NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
639117 | 5zvn | cing | 4-filtered-FRED | STAR | entry | full | 57 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5zvn # This FRED archive file contains, for PDB entry <5zvn>: # # - 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_5zvn _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5zvn _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2017.40 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 $glycosylated_analogue_of_Indolicidin A . 1 1 2 . 2 $BETA_D_GLUCOSE B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 . 1 . 1 1 stop_ save_ save_glycosylated_analogue_of_Indolicidin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "glycosylated analogue of Indolicidin" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code ILPWKWKWTPWRRX _Entity.Number_of_monomers 14 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 ILE . 1 1 2 LEU . 1 1 3 PRO . 1 1 4 TRP . 1 1 5 LYS . 1 1 6 TRP . 1 1 7 LYS . 1 1 8 TRP . 1 1 9 THR . 1 1 10 PRO . 1 1 11 TRP . 1 1 12 ARG . 1 1 13 ARG . 1 1 14 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 ILE 1 1 1 1 LEU 2 2 1 1 PRO 3 3 1 1 TRP 4 4 1 1 LYS 5 5 1 1 TRP 6 6 1 1 LYS 7 7 1 1 TRP 8 8 1 1 THR 9 9 1 1 PRO 10 10 1 1 TRP 11 11 1 1 ARG 12 12 1 1 ARG 13 13 1 1 NH2 14 14 1 1 stop_ save_ save_BETA_D_GLUCOSE _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "BETA D GLUCOSE" _Entity.Type non-polymer 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 . $. 1 2 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_. _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID . _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 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 ILE HA . 1 ILE HA 1 1 1 1 2 1 1 1 ILE MG . 1 ILE QG2 1 1 2 1 1 1 1 1 ILE HA . 1 ILE HA 1 1 2 1 2 1 1 2 LEU H . 2 LEU H 1 1 3 1 1 1 1 1 ILE HB . 1 ILE HB 1 1 3 1 2 1 1 1 ILE MD . 1 ILE QD1 1 1 4 1 1 1 1 1 ILE HB . 1 ILE HB 1 1 4 1 2 1 1 2 LEU H . 2 LEU H 1 1 5 1 1 1 1 1 ILE HB . 1 ILE HB 1 1 5 1 2 1 1 6 TRP H . 6 TRP H 1 1 6 1 1 1 1 1 ILE HB . 1 ILE HB 1 1 6 1 2 1 1 6 TRP QB . 6 TRP HB2 1 1 7 1 1 1 1 1 ILE QG . 1 ILE QG1 1 1 7 1 2 1 1 2 LEU H . 2 LEU H 1 1 8 1 1 1 1 1 ILE MG . 1 ILE QG2 1 1 8 1 2 1 1 2 LEU H . 2 LEU H 1 1 9 1 1 1 1 2 LEU H . 2 LEU H 1 1 9 1 2 1 1 2 LEU QB . 2 LEU HB2 1 1 10 1 1 1 1 2 LEU H . 2 LEU H 1 1 10 1 2 1 1 2 LEU QD . 2 LEU QQD 1 1 11 1 1 1 1 2 LEU H . 2 LEU H 1 1 11 1 2 1 1 6 TRP QB . 6 TRP HB2 1 1 12 1 1 1 1 2 LEU QD . 2 LEU QQD 1 1 12 1 2 1 1 6 TRP QB . 6 TRP HB2 1 1 13 1 1 1 1 4 TRP H . 4 TRP H 1 1 13 1 2 1 1 4 TRP QB . 4 TRP HB3 1 1 14 1 1 1 1 4 TRP H . 4 TRP H 1 1 14 1 2 1 1 5 LYS QB . 5 LYS QB 1 1 15 1 1 1 1 4 TRP H . 4 TRP H 1 1 15 1 2 1 1 5 LYS QG . 5 LYS QG 1 1 16 1 1 1 1 4 TRP QB . 4 TRP HB2 1 1 16 1 2 1 1 5 LYS H . 5 LYS H 1 1 17 1 1 1 1 5 LYS H . 5 LYS H 1 1 17 1 2 1 1 5 LYS QB . 5 LYS QB 1 1 18 1 1 1 1 5 LYS H . 5 LYS H 1 1 18 1 2 1 1 5 LYS QD . 5 LYS QD 1 1 19 1 1 1 1 5 LYS H . 5 LYS H 1 1 19 1 2 1 1 5 LYS QG . 5 LYS QG 1 1 20 1 1 1 1 5 LYS HA . 5 LYS HA 1 1 20 1 2 1 1 5 LYS QG . 5 LYS QG 1 1 21 1 1 1 1 5 LYS HA . 5 LYS HA 1 1 21 1 2 1 1 6 TRP H . 6 TRP H 1 1 22 1 1 1 1 5 LYS QG . 5 LYS QG 1 1 22 1 2 1 1 6 TRP H . 6 TRP H 1 1 23 1 1 1 1 6 TRP H . 6 TRP H 1 1 23 1 2 1 1 6 TRP QB . 6 TRP HB2 1 1 24 1 1 1 1 7 LYS H . 7 LYS H 1 1 24 1 2 1 1 7 LYS QB . 7 LYS QB 1 1 25 1 1 1 1 7 LYS H . 7 LYS H 1 1 25 1 2 1 1 7 LYS QD . 7 LYS QD 1 1 26 1 1 1 1 7 LYS H . 7 LYS H 1 1 26 1 2 1 1 7 LYS QE . 7 LYS QE 1 1 27 1 1 1 1 7 LYS H . 7 LYS H 1 1 27 1 2 1 1 7 LYS QG . 7 LYS QG 1 1 28 1 1 1 1 7 LYS HA . 7 LYS HA 1 1 28 1 2 1 1 7 LYS QG . 7 LYS QG 1 1 29 1 1 1 1 7 LYS QD . 7 LYS QD 1 1 29 1 2 1 1 8 TRP QB . 8 TRP HB2 1 1 30 1 1 1 1 7 LYS QG . 7 LYS QG 1 1 30 1 2 1 1 8 TRP H . 8 TRP H 1 1 31 1 1 1 1 8 TRP H . 8 TRP H 1 1 31 1 2 1 1 8 TRP QB . 8 TRP HB3 1 1 32 1 1 1 1 8 TRP QB . 8 TRP HB3 1 1 32 1 2 1 1 9 THR H . 9 THR H 1 1 33 1 1 1 1 8 TRP QB . 8 TRP HB3 1 1 33 1 2 1 1 9 THR MG . 9 THR QG2 1 1 34 1 1 1 1 9 THR H . 9 THR H 1 1 34 1 2 1 1 9 THR HB . 9 THR HB 1 1 35 1 1 1 1 9 THR H . 9 THR H 1 1 35 1 2 1 1 9 THR MG . 9 THR QG2 1 1 36 1 1 1 1 9 THR HA . 9 THR HA 1 1 36 1 2 1 1 9 THR MG . 9 THR QG2 1 1 37 1 1 1 1 9 THR HB . 9 THR HB 1 1 37 1 2 1 1 12 ARG HE . 12 ARG HE 1 1 38 1 1 1 1 9 THR HB . 9 THR HB 1 1 38 1 2 1 1 12 ARG QG . 12 ARG HG3 1 1 39 1 1 1 1 9 THR MG . 9 THR QG2 1 1 39 1 2 1 1 11 TRP H . 11 TRP H 1 1 40 1 1 1 1 10 PRO HA . 10 PRO HA 1 1 40 1 2 1 1 11 TRP H . 11 TRP H 1 1 41 1 1 1 1 10 PRO HA . 10 PRO HA 1 1 41 1 2 1 1 12 ARG QG . 12 ARG HG3 1 1 42 1 1 1 1 10 PRO QB . 10 PRO QB 1 1 42 1 2 1 1 11 TRP H . 11 TRP H 1 1 43 1 1 1 1 11 TRP H . 11 TRP H 1 1 43 1 2 1 1 11 TRP QB . 11 TRP QB 1 1 44 1 1 1 1 12 ARG H . 12 ARG H 1 1 44 1 2 1 1 12 ARG QB . 12 ARG QB 1 1 45 1 1 1 1 12 ARG H . 12 ARG H 1 1 45 1 2 1 1 12 ARG QG . 12 ARG HG2 1 1 46 1 1 1 1 12 ARG HA . 12 ARG HA 1 1 46 1 2 1 1 12 ARG HE . 12 ARG HE 1 1 47 1 1 1 1 12 ARG HA . 12 ARG HA 1 1 47 1 2 1 1 12 ARG QG . 12 ARG HG2 1 1 48 1 1 1 1 12 ARG HA . 12 ARG HA 1 1 48 1 2 1 1 13 ARG H . 13 ARG H 1 1 49 1 1 1 1 12 ARG QB . 12 ARG QB 1 1 49 1 2 1 1 12 ARG QD . 12 ARG QD 1 1 50 1 1 1 1 12 ARG HE . 12 ARG HE 1 1 50 1 2 1 1 12 ARG QG . 12 ARG HG3 1 1 51 1 1 1 1 12 ARG QG . 12 ARG HG3 1 1 51 1 2 1 1 13 ARG QD . 13 ARG QD 1 1 52 1 1 1 1 13 ARG H . 13 ARG H 1 1 52 1 2 1 1 13 ARG QB . 13 ARG QB 1 1 53 1 1 1 1 13 ARG H . 13 ARG H 1 1 53 1 2 1 1 13 ARG QD . 13 ARG QD 1 1 54 1 1 1 1 13 ARG H . 13 ARG H 1 1 54 1 2 1 1 13 ARG QG . 13 ARG HG2 1 1 55 1 1 1 1 13 ARG HA . 13 ARG HA 1 1 55 1 2 1 1 13 ARG HE . 13 ARG HE 1 1 56 1 1 1 1 13 ARG QB . 13 ARG QB 1 1 56 1 2 1 1 13 ARG QD . 13 ARG QD 1 1 57 1 1 1 1 13 ARG QB . 13 ARG QB 1 1 57 1 2 1 1 13 ARG HE . 13 ARG HE 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 . . . . . . . 3.22 1 1 2 1 . . . . . . . 2.97 1 1 3 1 . . . . . . . 3.62 1 1 4 1 . . . . . . . 3.5 1 1 5 1 . . . . . . . 3.28 1 1 6 1 . . . . . . . 4.03 1 1 7 1 . . . . . . . 4.63 1 1 8 1 . . . . . . . 3.63 1 1 9 1 . . . . . . . 3.21 1 1 10 1 . . . . . . . 4.26 1 1 11 1 . . . . . . . 4.58 1 1 12 1 . . . . . . . 4.34 1 1 13 1 . . . . . . . 3.09 1 1 14 1 . . . . . . . 5.0 1 1 15 1 . . . . . . . 3.59 1 1 16 1 . . . . . . . 3.95 1 1 17 1 . . . . . . . 3.44 1 1 18 1 . . . . . . . 3.4 1 1 19 1 . . . . . . . 3.46 1 1 20 1 . . . . . . . 3.46 1 1 21 1 . . . . . . . 2.67 1 1 22 1 . . . . . . . 3.85 1 1 23 1 . . . . . . . 3.08 1 1 24 1 . . . . . . . 3.56 1 1 25 1 . . . . . . . 3.41 1 1 26 1 . . . . . . . 4.17 1 1 27 1 . . . . . . . 3.6 1 1 28 1 . . . . . . . 3.86 1 1 29 1 . . . . . . . 3.6 1 1 30 1 . . . . . . . 4.36 1 1 31 1 . . . . . . . 3.27 1 1 32 1 . . . . . . . 4.21 1 1 33 1 . . . . . . . 4.9 1 1 34 1 . . . . . . . 3.71 1 1 35 1 . . . . . . . 3.73 1 1 36 1 . . . . . . . 3.26 1 1 37 1 . . . . . . . 4.48 1 1 38 1 . . . . . . . 4.48 1 1 39 1 . . . . . . . 3.55 1 1 40 1 . . . . . . . 3.21 1 1 41 1 . . . . . . . 3.75 1 1 42 1 . . . . . . . 3.94 1 1 43 1 . . . . . . . 3.26 1 1 44 1 . . . . . . . 3.3 1 1 45 1 . . . . . . . 3.25 1 1 46 1 . . . . . . . 3.64 1 1 47 1 . . . . . . . 2.96 1 1 48 1 . . . . . . . 2.71 1 1 49 1 . . . . . . . 3.46 1 1 50 1 . . . . . . . 3.86 1 1 51 1 . . . . . . . 4.21 1 1 52 1 . . . . . . . 3.28 1 1 53 1 . . . . . . . 3.93 1 1 54 1 . . . . . . . 3.11 1 1 55 1 . . . . . . . 3.14 1 1 56 1 . . . . . . . 3.35 1 1 57 1 . . . . . . . 3.96 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 ILE C C 6.237 1.118 -3.597 1.00 . A A . 1 ILE C 1 1 1 2 1 1 1 ILE CA C 7.177 2.270 -3.970 1.00 . A A . 1 ILE CA 1 1 1 3 1 1 1 ILE CB C 7.812 2.945 -2.716 1.00 . A A . 1 ILE CB 1 1 1 4 1 1 1 ILE CD1 C 7.767 5.538 -2.982 1.00 . A A . 1 ILE CD1 1 1 1 5 1 1 1 ILE CG1 C 8.595 4.242 -3.057 1.00 . A A . 1 ILE CG1 1 1 1 6 1 1 1 ILE CG2 C 8.735 1.984 -1.934 1.00 . A A . 1 ILE CG2 1 1 1 7 1 1 1 ILE H1 H 6.092 2.847 -5.609 1.00 . A A . 1 ILE H1 1 1 1 8 1 1 1 ILE HA H 7.961 1.909 -4.637 1.00 . A A . 1 ILE HA 1 1 1 9 1 1 1 ILE HB H 7.009 3.216 -2.024 1.00 . A A . 1 ILE HB 1 1 1 10 1 1 1 ILE HD11 H 8.413 6.407 -3.128 1.00 . A A . 1 ILE HD11 1 1 1 11 1 1 1 ILE HD12 H 6.979 5.606 -3.728 1.00 . A A . 1 ILE HD12 1 1 1 12 1 1 1 ILE HD13 H 7.307 5.657 -2.000 1.00 . A A . 1 ILE HD13 1 1 1 13 1 1 1 ILE HG12 H 9.407 4.371 -2.340 1.00 . A A . 1 ILE HG12 1 1 1 14 1 1 1 ILE HG13 H 9.094 4.160 -4.024 1.00 . A A . 1 ILE HG13 1 1 1 15 1 1 1 ILE HG21 H 9.568 1.637 -2.547 1.00 . A A . 1 ILE HG21 1 1 1 16 1 1 1 ILE HG22 H 9.158 2.477 -1.057 1.00 . A A . 1 ILE HG22 1 1 1 17 1 1 1 ILE HG23 H 8.201 1.110 -1.559 1.00 . A A . 1 ILE HG23 1 1 1 18 1 1 1 ILE N N 6.345 3.231 -4.712 1.00 . A A . 1 ILE N 1 1 1 19 1 1 1 ILE O O 5.060 1.399 -3.382 1.00 . A A . 1 ILE O 1 1 1 20 1 1 2 LEU C C 6.870 -2.227 -2.335 1.00 . A A . 2 LEU C 1 1 1 21 1 1 2 LEU CA C 5.929 -1.298 -3.124 1.00 . A A . 2 LEU CA 1 1 1 22 1 1 2 LEU CB C 5.271 -1.948 -4.370 1.00 . A A . 2 LEU CB 1 1 1 23 1 1 2 LEU CD1 C 4.406 -4.145 -3.296 1.00 . A A . 2 LEU CD1 1 1 1 24 1 1 2 LEU CD2 C 2.847 -2.151 -3.538 1.00 . A A . 2 LEU CD2 1 1 1 25 1 1 2 LEU CG C 4.067 -2.888 -4.114 1.00 . A A . 2 LEU CG 1 1 1 26 1 1 2 LEU H H 7.689 -0.325 -3.720 1.00 . A A . 2 LEU H 1 1 1 27 1 1 2 LEU HA H 5.122 -0.962 -2.476 1.00 . A A . 2 LEU HA 1 1 1 28 1 1 2 LEU HB2 H 4.922 -1.162 -5.040 1.00 . A A . 2 LEU HB2 1 1 1 29 1 1 2 LEU HB3 H 6.026 -2.490 -4.943 1.00 . A A . 2 LEU HB3 1 1 1 30 1 1 2 LEU HD11 H 3.592 -4.870 -3.345 1.00 . A A . 2 LEU HD11 1 1 1 31 1 1 2 LEU HD12 H 4.570 -3.921 -2.242 1.00 . A A . 2 LEU HD12 1 1 1 32 1 1 2 LEU HD13 H 5.297 -4.641 -3.681 1.00 . A A . 2 LEU HD13 1 1 1 33 1 1 2 LEU HD21 H 3.008 -1.825 -2.510 1.00 . A A . 2 LEU HD21 1 1 1 34 1 1 2 LEU HD22 H 1.971 -2.801 -3.533 1.00 . A A . 2 LEU HD22 1 1 1 35 1 1 2 LEU HD23 H 2.593 -1.274 -4.133 1.00 . A A . 2 LEU HD23 1 1 1 36 1 1 2 LEU HG H 3.765 -3.249 -5.100 1.00 . A A . 2 LEU HG 1 1 1 37 1 1 2 LEU N N 6.714 -0.131 -3.532 1.00 . A A . 2 LEU N 1 1 1 38 1 1 2 LEU O O 7.714 -2.869 -2.961 1.00 . A A . 2 LEU O 1 1 1 39 1 1 3 PRO C C 7.040 -4.597 -0.159 1.00 . A A . 3 PRO C 1 1 1 40 1 1 3 PRO CA C 7.652 -3.179 -0.188 1.00 . A A . 3 PRO CA 1 1 1 41 1 1 3 PRO CB C 7.665 -2.520 1.204 1.00 . A A . 3 PRO CB 1 1 1 42 1 1 3 PRO CD C 5.997 -1.407 -0.128 1.00 . A A . 3 PRO CD 1 1 1 43 1 1 3 PRO CG C 6.319 -1.813 1.312 1.00 . A A . 3 PRO CG 1 1 1 44 1 1 3 PRO HA H 8.670 -3.232 -0.580 1.00 . A A . 3 PRO HA 1 1 1 45 1 1 3 PRO HB2 H 7.833 -3.225 2.019 1.00 . A A . 3 PRO HB2 1 1 1 46 1 1 3 PRO HB3 H 8.468 -1.782 1.245 1.00 . A A . 3 PRO HB3 1 1 1 47 1 1 3 PRO HD2 H 4.929 -1.524 -0.322 1.00 . A A . 3 PRO HD2 1 1 1 48 1 1 3 PRO HD3 H 6.268 -0.365 -0.302 1.00 . A A . 3 PRO HD3 1 1 1 49 1 1 3 PRO HG2 H 5.562 -2.513 1.674 1.00 . A A . 3 PRO HG2 1 1 1 50 1 1 3 PRO HG3 H 6.334 -0.965 1.997 1.00 . A A . 3 PRO HG3 1 1 1 51 1 1 3 PRO N N 6.807 -2.280 -0.986 1.00 . A A . 3 PRO N 1 1 1 52 1 1 3 PRO O O 6.265 -4.914 0.740 1.00 . A A . 3 PRO O 1 1 1 53 1 1 4 TRP C C 6.916 -7.758 -0.159 1.00 . A A . 4 TRP C 1 1 1 54 1 1 4 TRP CA C 6.827 -6.791 -1.359 1.00 . A A . 4 TRP CA 1 1 1 55 1 1 4 TRP CB C 7.461 -7.422 -2.620 1.00 . A A . 4 TRP CB 1 1 1 56 1 1 4 TRP CD1 C 6.718 -6.745 -4.951 1.00 . A A . 4 TRP CD1 1 1 1 57 1 1 4 TRP CD2 C 5.366 -8.280 -4.017 1.00 . A A . 4 TRP CD2 1 1 1 58 1 1 4 TRP CE2 C 4.840 -7.998 -5.314 1.00 . A A . 4 TRP CE2 1 1 1 59 1 1 4 TRP CE3 C 4.673 -9.236 -3.237 1.00 . A A . 4 TRP CE3 1 1 1 60 1 1 4 TRP CG C 6.562 -7.466 -3.817 1.00 . A A . 4 TRP CG 1 1 1 61 1 1 4 TRP CH2 C 3.027 -9.583 -5.012 1.00 . A A . 4 TRP CH2 1 1 1 62 1 1 4 TRP CZ2 C 3.690 -8.635 -5.813 1.00 . A A . 4 TRP CZ2 1 1 1 63 1 1 4 TRP CZ3 C 3.518 -9.881 -3.726 1.00 . A A . 4 TRP CZ3 1 1 1 64 1 1 4 TRP H H 7.954 -5.068 -1.887 1.00 . A A . 4 TRP H 1 1 1 65 1 1 4 TRP HA H 5.757 -6.655 -1.537 1.00 . A A . 4 TRP HA 1 1 1 66 1 1 4 TRP HB2 H 8.388 -6.916 -2.890 1.00 . A A . 4 TRP HB2 1 1 1 67 1 1 4 TRP HB3 H 7.749 -8.459 -2.436 1.00 . A A . 4 TRP HB3 1 1 1 68 1 1 4 TRP HD1 H 7.523 -6.046 -5.126 1.00 . A A . 4 TRP HD1 1 1 1 69 1 1 4 TRP HE1 H 5.632 -6.656 -6.759 1.00 . A A . 4 TRP HE1 1 1 1 70 1 1 4 TRP HE3 H 5.035 -9.477 -2.249 1.00 . A A . 4 TRP HE3 1 1 1 71 1 1 4 TRP HH2 H 2.143 -10.080 -5.383 1.00 . A A . 4 TRP HH2 1 1 1 72 1 1 4 TRP HZ2 H 3.317 -8.403 -6.800 1.00 . A A . 4 TRP HZ2 1 1 1 73 1 1 4 TRP HZ3 H 3.007 -10.609 -3.112 1.00 . A A . 4 TRP HZ3 1 1 1 74 1 1 4 TRP N N 7.385 -5.444 -1.141 1.00 . A A . 4 TRP N 1 1 1 75 1 1 4 TRP NE1 N 5.699 -7.052 -5.831 1.00 . A A . 4 TRP NE1 1 1 1 76 1 1 4 TRP O O 6.046 -8.605 0.017 1.00 . A A . 4 TRP O 1 1 1 77 1 1 5 LYS C C 8.216 -9.699 2.213 1.00 . A A . 5 LYS C 1 1 1 78 1 1 5 LYS CA C 8.102 -8.170 2.032 1.00 . A A . 5 LYS CA 1 1 1 79 1 1 5 LYS CB C 7.035 -7.566 2.985 1.00 . A A . 5 LYS CB 1 1 1 80 1 1 5 LYS CD C 8.404 -6.300 4.757 1.00 . A A . 5 LYS CD 1 1 1 81 1 1 5 LYS CE C 8.688 -4.938 5.408 1.00 . A A . 5 LYS CE 1 1 1 82 1 1 5 LYS CG C 7.422 -6.196 3.577 1.00 . A A . 5 LYS CG 1 1 1 83 1 1 5 LYS H H 8.638 -6.945 0.385 1.00 . A A . 5 LYS H 1 1 1 84 1 1 5 LYS HA H 9.078 -7.812 2.356 1.00 . A A . 5 LYS HA 1 1 1 85 1 1 5 LYS HB2 H 6.080 -7.470 2.466 1.00 . A A . 5 LYS HB2 1 1 1 86 1 1 5 LYS HB3 H 6.822 -8.251 3.809 1.00 . A A . 5 LYS HB3 1 1 1 87 1 1 5 LYS HD2 H 7.988 -6.982 5.500 1.00 . A A . 5 LYS HD2 1 1 1 88 1 1 5 LYS HD3 H 9.337 -6.751 4.414 1.00 . A A . 5 LYS HD3 1 1 1 89 1 1 5 LYS HE2 H 9.122 -4.254 4.676 1.00 . A A . 5 LYS HE2 1 1 1 90 1 1 5 LYS HE3 H 7.755 -4.483 5.748 1.00 . A A . 5 LYS HE3 1 1 1 91 1 1 5 LYS HG2 H 7.828 -5.557 2.792 1.00 . A A . 5 LYS HG2 1 1 1 92 1 1 5 LYS HG3 H 6.506 -5.708 3.916 1.00 . A A . 5 LYS HG3 1 1 1 93 1 1 5 LYS HZ1 H 9.197 -5.672 7.255 1.00 . A A . 5 LYS HZ1 1 1 1 94 1 1 5 LYS HZ2 H 9.764 -4.156 6.970 1.00 . A A . 5 LYS HZ2 1 1 1 95 1 1 5 LYS HZ3 H 10.489 -5.450 6.257 1.00 . A A . 5 LYS HZ3 1 1 1 96 1 1 5 LYS N N 7.967 -7.641 0.666 1.00 . A A . 5 LYS N 1 1 1 97 1 1 5 LYS NZ N 9.604 -5.065 6.558 1.00 . A A . 5 LYS NZ 1 1 1 98 1 1 5 LYS O O 8.799 -10.125 3.212 1.00 . A A . 5 LYS O 1 1 1 99 1 1 6 TRP C C 8.867 -12.706 1.234 1.00 . A A . 6 TRP C 1 1 1 100 1 1 6 TRP CA C 7.522 -11.980 1.452 1.00 . A A . 6 TRP CA 1 1 1 101 1 1 6 TRP CB C 6.444 -12.487 0.461 1.00 . A A . 6 TRP CB 1 1 1 102 1 1 6 TRP CD1 C 6.301 -14.870 1.420 1.00 . A A . 6 TRP CD1 1 1 1 103 1 1 6 TRP CD2 C 4.371 -14.153 0.531 1.00 . A A . 6 TRP CD2 1 1 1 104 1 1 6 TRP CE2 C 4.127 -15.457 1.060 1.00 . A A . 6 TRP CE2 1 1 1 105 1 1 6 TRP CE3 C 3.275 -13.487 -0.066 1.00 . A A . 6 TRP CE3 1 1 1 106 1 1 6 TRP CG C 5.766 -13.798 0.782 1.00 . A A . 6 TRP CG 1 1 1 107 1 1 6 TRP CH2 C 1.791 -15.370 0.413 1.00 . A A . 6 TRP CH2 1 1 1 108 1 1 6 TRP CZ2 C 2.860 -16.065 1.007 1.00 . A A . 6 TRP CZ2 1 1 1 109 1 1 6 TRP CZ3 C 1.999 -14.085 -0.123 1.00 . A A . 6 TRP CZ3 1 1 1 110 1 1 6 TRP H H 7.134 -10.065 0.574 1.00 . A A . 6 TRP H 1 1 1 111 1 1 6 TRP HA H 7.176 -12.186 2.467 1.00 . A A . 6 TRP HA 1 1 1 112 1 1 6 TRP HB2 H 5.641 -11.750 0.438 1.00 . A A . 6 TRP HB2 1 1 1 113 1 1 6 TRP HB3 H 6.820 -12.526 -0.563 1.00 . A A . 6 TRP HB3 1 1 1 114 1 1 6 TRP HD1 H 7.320 -14.929 1.773 1.00 . A A . 6 TRP HD1 1 1 1 115 1 1 6 TRP HE1 H 5.458 -16.650 2.192 1.00 . A A . 6 TRP HE1 1 1 1 116 1 1 6 TRP HE3 H 3.411 -12.494 -0.466 1.00 . A A . 6 TRP HE3 1 1 1 117 1 1 6 TRP HH2 H 0.806 -15.813 0.380 1.00 . A A . 6 TRP HH2 1 1 1 118 1 1 6 TRP HZ2 H 2.701 -17.046 1.430 1.00 . A A . 6 TRP HZ2 1 1 1 119 1 1 6 TRP HZ3 H 1.174 -13.547 -0.569 1.00 . A A . 6 TRP HZ3 1 1 1 120 1 1 6 TRP N N 7.663 -10.522 1.312 1.00 . A A . 6 TRP N 1 1 1 121 1 1 6 TRP NE1 N 5.338 -15.848 1.588 1.00 . A A . 6 TRP NE1 1 1 1 122 1 1 6 TRP O O 9.057 -13.435 0.260 1.00 . A A . 6 TRP O 1 1 1 123 1 1 7 LYS C C 12.110 -12.547 1.241 1.00 . A A . 7 LYS C 1 1 1 124 1 1 7 LYS CA C 11.138 -13.104 2.291 1.00 . A A . 7 LYS CA 1 1 1 125 1 1 7 LYS CB C 11.106 -14.658 2.279 1.00 . A A . 7 LYS CB 1 1 1 126 1 1 7 LYS CD C 9.959 -16.808 3.104 1.00 . A A . 7 LYS CD 1 1 1 127 1 1 7 LYS CE C 11.173 -17.738 3.308 1.00 . A A . 7 LYS CE 1 1 1 128 1 1 7 LYS CG C 10.246 -15.317 3.380 1.00 . A A . 7 LYS CG 1 1 1 129 1 1 7 LYS H H 9.582 -11.763 2.825 1.00 . A A . 7 LYS H 1 1 1 130 1 1 7 LYS HA H 11.520 -12.785 3.262 1.00 . A A . 7 LYS HA 1 1 1 131 1 1 7 LYS HB2 H 10.764 -15.007 1.304 1.00 . A A . 7 LYS HB2 1 1 1 132 1 1 7 LYS HB3 H 12.132 -15.018 2.365 1.00 . A A . 7 LYS HB3 1 1 1 133 1 1 7 LYS HD2 H 9.149 -17.136 3.758 1.00 . A A . 7 LYS HD2 1 1 1 134 1 1 7 LYS HD3 H 9.573 -16.898 2.087 1.00 . A A . 7 LYS HD3 1 1 1 135 1 1 7 LYS HE2 H 12.065 -17.310 2.850 1.00 . A A . 7 LYS HE2 1 1 1 136 1 1 7 LYS HE3 H 11.387 -17.851 4.372 1.00 . A A . 7 LYS HE3 1 1 1 137 1 1 7 LYS HG2 H 10.712 -15.182 4.358 1.00 . A A . 7 LYS HG2 1 1 1 138 1 1 7 LYS HG3 H 9.286 -14.802 3.437 1.00 . A A . 7 LYS HG3 1 1 1 139 1 1 7 LYS HZ1 H 10.100 -19.500 3.007 1.00 . A A . 7 LYS HZ1 1 1 1 140 1 1 7 LYS HZ2 H 11.732 -19.682 2.882 1.00 . A A . 7 LYS HZ2 1 1 1 141 1 1 7 LYS HZ3 H 10.918 -18.932 1.678 1.00 . A A . 7 LYS HZ3 1 1 1 142 1 1 7 LYS N N 9.808 -12.502 2.162 1.00 . A A . 7 LYS N 1 1 1 143 1 1 7 LYS NZ N 10.957 -19.064 2.696 1.00 . A A . 7 LYS NZ 1 1 1 144 1 1 7 LYS O O 13.108 -11.920 1.579 1.00 . A A . 7 LYS O 1 1 1 145 1 1 8 TRP C C 11.724 -13.329 -2.371 1.00 . A A . 8 TRP C 1 1 1 146 1 1 8 TRP CA C 12.518 -12.596 -1.272 1.00 . A A . 8 TRP CA 1 1 1 147 1 1 8 TRP CB C 13.947 -13.201 -1.212 1.00 . A A . 8 TRP CB 1 1 1 148 1 1 8 TRP CD1 C 15.012 -12.767 -3.478 1.00 . A A . 8 TRP CD1 1 1 1 149 1 1 8 TRP CD2 C 16.079 -11.721 -1.800 1.00 . A A . 8 TRP CD2 1 1 1 150 1 1 8 TRP CE2 C 16.785 -11.406 -3.000 1.00 . A A . 8 TRP CE2 1 1 1 151 1 1 8 TRP CE3 C 16.577 -11.164 -0.598 1.00 . A A . 8 TRP CE3 1 1 1 152 1 1 8 TRP CG C 14.956 -12.593 -2.138 1.00 . A A . 8 TRP CG 1 1 1 153 1 1 8 TRP CH2 C 18.401 -10.057 -1.793 1.00 . A A . 8 TRP CH2 1 1 1 154 1 1 8 TRP CZ2 C 17.928 -10.588 -3.007 1.00 . A A . 8 TRP CZ2 1 1 1 155 1 1 8 TRP CZ3 C 17.725 -10.344 -0.591 1.00 . A A . 8 TRP CZ3 1 1 1 156 1 1 8 TRP H H 10.846 -13.194 -0.145 1.00 . A A . 8 TRP H 1 1 1 157 1 1 8 TRP HA H 12.558 -11.524 -1.473 1.00 . A A . 8 TRP HA 1 1 1 158 1 1 8 TRP HB2 H 14.380 -13.108 -0.219 1.00 . A A . 8 TRP HB2 1 1 1 159 1 1 8 TRP HB3 H 13.924 -14.275 -1.402 1.00 . A A . 8 TRP HB3 1 1 1 160 1 1 8 TRP HD1 H 14.311 -13.360 -4.048 1.00 . A A . 8 TRP HD1 1 1 1 161 1 1 8 TRP HE1 H 16.300 -12.033 -4.975 1.00 . A A . 8 TRP HE1 1 1 1 162 1 1 8 TRP HE3 H 16.067 -11.373 0.331 1.00 . A A . 8 TRP HE3 1 1 1 163 1 1 8 TRP HH2 H 19.280 -9.429 -1.784 1.00 . A A . 8 TRP HH2 1 1 1 164 1 1 8 TRP HZ2 H 18.441 -10.368 -3.931 1.00 . A A . 8 TRP HZ2 1 1 1 165 1 1 8 TRP HZ3 H 18.089 -9.934 0.340 1.00 . A A . 8 TRP HZ3 1 1 1 166 1 1 8 TRP N N 11.787 -12.821 -0.024 1.00 . A A . 8 TRP N 1 1 1 167 1 1 8 TRP NE1 N 16.083 -12.062 -3.988 1.00 . A A . 8 TRP NE1 1 1 1 168 1 1 8 TRP O O 11.613 -12.861 -3.499 1.00 . A A . 8 TRP O 1 1 1 169 1 1 9 THR C C 9.232 -15.947 -2.116 1.00 . A A . 9 THR C 1 1 1 170 1 1 9 THR CA C 10.481 -15.453 -2.869 1.00 . A A . 9 THR CA 1 1 1 171 1 1 9 THR CB C 11.462 -16.606 -3.199 1.00 . A A . 9 THR CB 1 1 1 172 1 1 9 THR CG2 C 12.417 -16.245 -4.349 1.00 . A A . 9 THR CG2 1 1 1 173 1 1 9 THR H H 11.328 -14.813 -1.078 1.00 . A A . 9 THR H 1 1 1 174 1 1 9 THR HA H 10.183 -14.955 -3.791 1.00 . A A . 9 THR HA 1 1 1 175 1 1 9 THR HB H 10.903 -17.507 -3.459 1.00 . A A . 9 THR HB 1 1 1 176 1 1 9 THR HG21 H 11.866 -15.993 -5.255 1.00 . A A . 9 THR HG21 1 1 1 177 1 1 9 THR HG22 H 13.088 -17.068 -4.592 1.00 . A A . 9 THR HG22 1 1 1 178 1 1 9 THR HG23 H 13.037 -15.386 -4.093 1.00 . A A . 9 THR HG23 1 1 1 179 1 1 9 THR N N 11.170 -14.494 -2.019 1.00 . A A . 9 THR N 1 1 1 180 1 1 9 THR O O 9.368 -16.280 -0.929 1.00 . A A . 9 THR O 1 1 1 181 1 1 9 THR OG1 O 12.265 -16.832 -2.023 1.00 . A A . 9 THR OG1 1 1 1 182 1 1 10 PRO C C 6.775 -17.872 -1.643 1.00 . A A . 10 PRO C 1 1 1 183 1 1 10 PRO CA C 6.793 -16.406 -2.095 1.00 . A A . 10 PRO CA 1 1 1 184 1 1 10 PRO CB C 5.692 -16.106 -3.123 1.00 . A A . 10 PRO CB 1 1 1 185 1 1 10 PRO CD C 7.836 -15.849 -4.202 1.00 . A A . 10 PRO CD 1 1 1 186 1 1 10 PRO CG C 6.380 -16.235 -4.474 1.00 . A A . 10 PRO CG 1 1 1 187 1 1 10 PRO HA H 6.659 -15.756 -1.228 1.00 . A A . 10 PRO HA 1 1 1 188 1 1 10 PRO HB2 H 4.821 -16.758 -3.032 1.00 . A A . 10 PRO HB2 1 1 1 189 1 1 10 PRO HB3 H 5.342 -15.082 -2.987 1.00 . A A . 10 PRO HB3 1 1 1 190 1 1 10 PRO HD2 H 8.523 -16.441 -4.809 1.00 . A A . 10 PRO HD2 1 1 1 191 1 1 10 PRO HD3 H 7.987 -14.795 -4.440 1.00 . A A . 10 PRO HD3 1 1 1 192 1 1 10 PRO HG2 H 6.336 -17.274 -4.804 1.00 . A A . 10 PRO HG2 1 1 1 193 1 1 10 PRO HG3 H 5.916 -15.623 -5.250 1.00 . A A . 10 PRO HG3 1 1 1 194 1 1 10 PRO N N 8.050 -16.057 -2.766 1.00 . A A . 10 PRO N 1 1 1 195 1 1 10 PRO O O 7.052 -18.787 -2.422 1.00 . A A . 10 PRO O 1 1 1 196 1 1 11 TRP C C 5.092 -20.087 0.055 1.00 . A A . 11 TRP C 1 1 1 197 1 1 11 TRP CA C 6.456 -19.406 0.273 1.00 . A A . 11 TRP CA 1 1 1 198 1 1 11 TRP CB C 6.778 -19.216 1.770 1.00 . A A . 11 TRP CB 1 1 1 199 1 1 11 TRP CD1 C 8.465 -21.064 2.125 1.00 . A A . 11 TRP CD1 1 1 1 200 1 1 11 TRP CD2 C 6.727 -21.221 3.537 1.00 . A A . 11 TRP CD2 1 1 1 201 1 1 11 TRP CE2 C 7.608 -22.304 3.838 1.00 . A A . 11 TRP CE2 1 1 1 202 1 1 11 TRP CE3 C 5.526 -21.146 4.282 1.00 . A A . 11 TRP CE3 1 1 1 203 1 1 11 TRP CG C 7.312 -20.439 2.452 1.00 . A A . 11 TRP CG 1 1 1 204 1 1 11 TRP CH2 C 6.115 -23.152 5.551 1.00 . A A . 11 TRP CH2 1 1 1 205 1 1 11 TRP CZ2 C 7.317 -23.258 4.829 1.00 . A A . 11 TRP CZ2 1 1 1 206 1 1 11 TRP CZ3 C 5.222 -22.098 5.276 1.00 . A A . 11 TRP CZ3 1 1 1 207 1 1 11 TRP H H 6.138 -17.294 0.173 1.00 . A A . 11 TRP H 1 1 1 208 1 1 11 TRP HA H 7.232 -20.024 -0.183 1.00 . A A . 11 TRP HA 1 1 1 209 1 1 11 TRP HB2 H 7.546 -18.450 1.877 1.00 . A A . 11 TRP HB2 1 1 1 210 1 1 11 TRP HB3 H 5.915 -18.845 2.325 1.00 . A A . 11 TRP HB3 1 1 1 211 1 1 11 TRP HD1 H 9.105 -20.763 1.309 1.00 . A A . 11 TRP HD1 1 1 1 212 1 1 11 TRP HE1 H 9.402 -22.824 2.841 1.00 . A A . 11 TRP HE1 1 1 1 213 1 1 11 TRP HE3 H 4.822 -20.354 4.072 1.00 . A A . 11 TRP HE3 1 1 1 214 1 1 11 TRP HH2 H 5.877 -23.881 6.312 1.00 . A A . 11 TRP HH2 1 1 1 215 1 1 11 TRP HZ2 H 8.001 -24.069 5.035 1.00 . A A . 11 TRP HZ2 1 1 1 216 1 1 11 TRP HZ3 H 4.296 -22.023 5.829 1.00 . A A . 11 TRP HZ3 1 1 1 217 1 1 11 TRP N N 6.441 -18.094 -0.369 1.00 . A A . 11 TRP N 1 1 1 218 1 1 11 TRP NE1 N 8.660 -22.145 2.959 1.00 . A A . 11 TRP NE1 1 1 1 219 1 1 11 TRP O O 4.286 -20.247 0.970 1.00 . A A . 11 TRP O 1 1 1 220 1 1 12 ARG C C 3.794 -22.679 -1.341 1.00 . A A . 12 ARG C 1 1 1 221 1 1 12 ARG CA C 3.650 -21.174 -1.655 1.00 . A A . 12 ARG CA 1 1 1 222 1 1 12 ARG CB C 3.479 -20.923 -3.176 1.00 . A A . 12 ARG CB 1 1 1 223 1 1 12 ARG CD C 4.565 -22.881 -4.482 1.00 . A A . 12 ARG CD 1 1 1 224 1 1 12 ARG CG C 4.611 -21.383 -4.130 1.00 . A A . 12 ARG CG 1 1 1 225 1 1 12 ARG CZ C 5.010 -24.346 -6.444 1.00 . A A . 12 ARG CZ 1 1 1 226 1 1 12 ARG H H 5.556 -20.231 -1.878 1.00 . A A . 12 ARG H 1 1 1 227 1 1 12 ARG HA H 2.775 -20.789 -1.125 1.00 . A A . 12 ARG HA 1 1 1 228 1 1 12 ARG HB2 H 2.528 -21.343 -3.510 1.00 . A A . 12 ARG HB2 1 1 1 229 1 1 12 ARG HB3 H 3.360 -19.846 -3.308 1.00 . A A . 12 ARG HB3 1 1 1 230 1 1 12 ARG HD2 H 5.063 -23.485 -3.724 1.00 . A A . 12 ARG HD2 1 1 1 231 1 1 12 ARG HD3 H 3.523 -23.194 -4.535 1.00 . A A . 12 ARG HD3 1 1 1 232 1 1 12 ARG HE H 5.762 -22.456 -6.156 1.00 . A A . 12 ARG HE 1 1 1 233 1 1 12 ARG HG2 H 4.523 -20.801 -5.049 1.00 . A A . 12 ARG HG2 1 1 1 234 1 1 12 ARG HG3 H 5.587 -21.127 -3.714 1.00 . A A . 12 ARG HG3 1 1 1 235 1 1 12 ARG HH11 H 3.856 -25.276 -4.992 1.00 . A A . 12 ARG HH11 1 1 1 236 1 1 12 ARG HH12 H 4.121 -26.214 -6.411 1.00 . A A . 12 ARG HH12 1 1 1 237 1 1 12 ARG HH21 H 6.130 -23.771 -8.068 1.00 . A A . 12 ARG HH21 1 1 1 238 1 1 12 ARG HH22 H 5.507 -25.365 -8.162 1.00 . A A . 12 ARG HH22 1 1 1 239 1 1 12 ARG N N 4.829 -20.442 -1.206 1.00 . A A . 12 ARG N 1 1 1 240 1 1 12 ARG NE N 5.165 -23.186 -5.788 1.00 . A A . 12 ARG NE 1 1 1 241 1 1 12 ARG NH1 N 4.286 -25.344 -5.926 1.00 . A A . 12 ARG NH1 1 1 1 242 1 1 12 ARG NH2 N 5.588 -24.506 -7.634 1.00 . A A . 12 ARG NH2 1 1 1 243 1 1 12 ARG O O 4.900 -23.168 -1.118 1.00 . A A . 12 ARG O 1 1 1 244 1 1 13 ARG C C 3.363 -25.662 -2.216 1.00 . A A . 13 ARG C 1 1 1 245 1 1 13 ARG CA C 2.637 -24.867 -1.112 1.00 . A A . 13 ARG CA 1 1 1 246 1 1 13 ARG CB C 1.167 -25.343 -1.042 1.00 . A A . 13 ARG CB 1 1 1 247 1 1 13 ARG CD C -1.062 -25.365 0.223 1.00 . A A . 13 ARG CD 1 1 1 248 1 1 13 ARG CG C 0.372 -24.802 0.164 1.00 . A A . 13 ARG CG 1 1 1 249 1 1 13 ARG CZ C -2.958 -25.411 1.868 1.00 . A A . 13 ARG CZ 1 1 1 250 1 1 13 ARG H H 1.817 -22.969 -1.624 1.00 . A A . 13 ARG H 1 1 1 251 1 1 13 ARG HA H 3.127 -25.057 -0.154 1.00 . A A . 13 ARG HA 1 1 1 252 1 1 13 ARG HB2 H 0.649 -25.088 -1.969 1.00 . A A . 13 ARG HB2 1 1 1 253 1 1 13 ARG HB3 H 1.155 -26.434 -0.993 1.00 . A A . 13 ARG HB3 1 1 1 254 1 1 13 ARG HD2 H -1.637 -25.035 -0.644 1.00 . A A . 13 ARG HD2 1 1 1 255 1 1 13 ARG HD3 H -1.029 -26.455 0.196 1.00 . A A . 13 ARG HD3 1 1 1 256 1 1 13 ARG HE H -1.278 -24.252 1.992 1.00 . A A . 13 ARG HE 1 1 1 257 1 1 13 ARG HG2 H 0.902 -25.056 1.085 1.00 . A A . 13 ARG HG2 1 1 1 258 1 1 13 ARG HG3 H 0.333 -23.712 0.121 1.00 . A A . 13 ARG HG3 1 1 1 259 1 1 13 ARG HH11 H -3.282 -26.677 0.281 1.00 . A A . 13 ARG HH11 1 1 1 260 1 1 13 ARG HH12 H -4.539 -26.676 1.445 1.00 . A A . 13 ARG HH12 1 1 1 261 1 1 13 ARG HH21 H -2.995 -24.280 3.591 1.00 . A A . 13 ARG HH21 1 1 1 262 1 1 13 ARG HH22 H -4.361 -25.281 3.367 1.00 . A A . 13 ARG HH22 1 1 1 263 1 1 13 ARG N N 2.680 -23.426 -1.377 1.00 . A A . 13 ARG N 1 1 1 264 1 1 13 ARG NE N -1.767 -24.955 1.450 1.00 . A A . 13 ARG NE 1 1 1 265 1 1 13 ARG NH1 N -3.639 -26.313 1.154 1.00 . A A . 13 ARG NH1 1 1 1 266 1 1 13 ARG NH2 N -3.471 -24.959 3.012 1.00 . A A . 13 ARG NH2 1 1 1 267 1 1 13 ARG O O 3.162 -25.433 -3.409 1.00 . A A . 13 ARG O 1 1 1 268 1 1 14 NH2 HN1 H 4.683 -27.169 -2.530 1.00 . A A . 14 NH2 HN1 1 1 1 269 1 1 14 NH2 HN2 H 4.397 -26.765 -0.859 1.00 . A A . 14 NH2 HN2 1 1 1 270 1 1 14 NH2 N N 4.200 -26.619 -1.838 1.00 . A A . 14 NH2 N 1 1 1 271 2 2 1 . C1 C 12.671 -18.146 -1.735 1.00 . B A . 101 BGC C1 1 1 1 272 2 2 1 . C2 C 11.588 -18.928 -0.964 1.00 . B A . 101 BGC C2 1 1 1 273 2 2 1 . C3 C 12.254 -20.227 -0.493 1.00 . B A . 101 BGC C3 1 1 1 274 2 2 1 . C4 C 12.737 -21.006 -1.719 1.00 . B A . 101 BGC C4 1 1 1 275 2 2 1 . C5 C 13.753 -20.142 -2.516 1.00 . B A . 101 BGC C5 1 1 1 276 2 2 1 . C6 C 14.220 -20.772 -3.842 1.00 . B A . 101 BGC C6 1 1 1 277 2 2 1 . H1 H 13.561 -17.995 -1.106 1.00 . B A . 101 BGC H1 1 1 1 278 2 2 1 . H2 H 10.752 -19.144 -1.632 1.00 . B A . 101 BGC H2 1 1 1 279 2 2 1 . H3 H 13.123 -19.987 0.122 1.00 . B A . 101 BGC H3 1 1 1 280 2 2 1 . H4 H 11.892 -21.240 -2.370 1.00 . B A . 101 BGC H4 1 1 1 281 2 2 1 . H5 H 14.629 -19.940 -1.897 1.00 . B A . 101 BGC H5 1 1 1 282 2 2 1 . H6 H 15.203 -22.356 -4.467 1.00 . B A . 101 BGC H6 1 1 1 283 2 2 1 . H6C1 H 14.991 -20.144 -4.292 1.00 . B A . 101 BGC H6C1 1 1 1 284 2 2 1 . H6C2 H 13.394 -20.811 -4.554 1.00 . B A . 101 BGC H6C2 1 1 1 285 2 2 1 . HB H 10.622 -17.396 -0.265 1.00 . B A . 101 BGC HB 1 1 1 286 2 2 1 . HC H 11.772 -21.938 0.186 1.00 . B A . 101 BGC HC 1 1 1 287 2 2 1 . HD H 13.849 -22.563 -2.019 1.00 . B A . 101 BGC HD 1 1 1 288 2 2 1 . O2 O 11.106 -18.153 0.136 1.00 . B A . 101 BGC O2 1 1 1 289 2 2 1 . O3 O 11.389 -21.044 0.289 1.00 . B A . 101 BGC O3 1 1 1 290 2 2 1 . O4 O 13.305 -22.230 -1.272 1.00 . B A . 101 BGC O4 1 1 1 291 2 2 1 . O5 O 13.117 -18.893 -2.845 1.00 . B A . 101 BGC O5 1 1 1 292 2 2 1 . O6 O 14.735 -22.090 -3.659 1.00 . B A . 101 BGC O6 1 1 2 293 1 1 1 ILE C C 3.564 -0.100 -0.559 1.00 . A A . 1 ILE C 1 1 2 294 1 1 1 ILE CA C 2.130 0.355 -0.866 1.00 . A A . 1 ILE CA 1 1 2 295 1 1 1 ILE CB C 2.022 1.122 -2.218 1.00 . A A . 1 ILE CB 1 1 2 296 1 1 1 ILE CD1 C -0.565 0.876 -2.437 1.00 . A A . 1 ILE CD1 1 1 2 297 1 1 1 ILE CG1 C 0.652 1.817 -2.429 1.00 . A A . 1 ILE CG1 1 1 2 298 1 1 1 ILE CG2 C 2.376 0.259 -3.449 1.00 . A A . 1 ILE CG2 1 1 2 299 1 1 1 ILE H1 H 2.493 1.868 0.389 1.00 . A A . 1 ILE H1 1 1 2 300 1 1 1 ILE HA H 1.474 -0.517 -0.880 1.00 . A A . 1 ILE HA 1 1 2 301 1 1 1 ILE HB H 2.763 1.925 -2.200 1.00 . A A . 1 ILE HB 1 1 2 302 1 1 1 ILE HD11 H -1.479 1.442 -2.627 1.00 . A A . 1 ILE HD11 1 1 2 303 1 1 1 ILE HD12 H -0.493 0.129 -3.229 1.00 . A A . 1 ILE HD12 1 1 2 304 1 1 1 ILE HD13 H -0.705 0.354 -1.491 1.00 . A A . 1 ILE HD13 1 1 2 305 1 1 1 ILE HG12 H 0.495 2.601 -1.688 1.00 . A A . 1 ILE HG12 1 1 2 306 1 1 1 ILE HG13 H 0.672 2.351 -3.381 1.00 . A A . 1 ILE HG13 1 1 2 307 1 1 1 ILE HG21 H 3.421 -0.051 -3.450 1.00 . A A . 1 ILE HG21 1 1 2 308 1 1 1 ILE HG22 H 1.760 -0.638 -3.513 1.00 . A A . 1 ILE HG22 1 1 2 309 1 1 1 ILE HG23 H 2.227 0.818 -4.374 1.00 . A A . 1 ILE HG23 1 1 2 310 1 1 1 ILE N N 1.723 1.223 0.254 1.00 . A A . 1 ILE N 1 1 2 311 1 1 1 ILE O O 4.253 0.626 0.152 1.00 . A A . 1 ILE O 1 1 2 312 1 1 2 LEU C C 5.747 -2.475 -2.209 1.00 . A A . 2 LEU C 1 1 2 313 1 1 2 LEU CA C 5.370 -1.773 -0.889 1.00 . A A . 2 LEU CA 1 1 2 314 1 1 2 LEU CB C 5.428 -2.664 0.382 1.00 . A A . 2 LEU CB 1 1 2 315 1 1 2 LEU CD1 C 7.637 -3.971 0.038 1.00 . A A . 2 LEU CD1 1 1 2 316 1 1 2 LEU CD2 C 7.654 -1.787 1.332 1.00 . A A . 2 LEU CD2 1 1 2 317 1 1 2 LEU CG C 6.829 -3.023 0.936 1.00 . A A . 2 LEU CG 1 1 2 318 1 1 2 LEU H H 3.412 -1.826 -1.648 1.00 . A A . 2 LEU H 1 1 2 319 1 1 2 LEU HA H 6.040 -0.931 -0.719 1.00 . A A . 2 LEU HA 1 1 2 320 1 1 2 LEU HB2 H 4.897 -2.154 1.186 1.00 . A A . 2 LEU HB2 1 1 2 321 1 1 2 LEU HB3 H 4.865 -3.584 0.213 1.00 . A A . 2 LEU HB3 1 1 2 322 1 1 2 LEU HD11 H 7.042 -4.830 -0.273 1.00 . A A . 2 LEU HD11 1 1 2 323 1 1 2 LEU HD12 H 8.514 -4.347 0.567 1.00 . A A . 2 LEU HD12 1 1 2 324 1 1 2 LEU HD13 H 7.997 -3.460 -0.853 1.00 . A A . 2 LEU HD13 1 1 2 325 1 1 2 LEU HD21 H 7.983 -1.213 0.466 1.00 . A A . 2 LEU HD21 1 1 2 326 1 1 2 LEU HD22 H 8.550 -2.076 1.884 1.00 . A A . 2 LEU HD22 1 1 2 327 1 1 2 LEU HD23 H 7.083 -1.118 1.978 1.00 . A A . 2 LEU HD23 1 1 2 328 1 1 2 LEU HG H 6.644 -3.571 1.862 1.00 . A A . 2 LEU HG 1 1 2 329 1 1 2 LEU N N 4.008 -1.261 -1.056 1.00 . A A . 2 LEU N 1 1 2 330 1 1 2 LEU O O 5.333 -3.618 -2.397 1.00 . A A . 2 LEU O 1 1 2 331 1 1 3 PRO C C 7.832 -3.399 -4.622 1.00 . A A . 3 PRO C 1 1 2 332 1 1 3 PRO CA C 6.695 -2.350 -4.509 1.00 . A A . 3 PRO CA 1 1 2 333 1 1 3 PRO CB C 6.985 -1.085 -5.341 1.00 . A A . 3 PRO CB 1 1 2 334 1 1 3 PRO CD C 6.979 -0.454 -3.030 1.00 . A A . 3 PRO CD 1 1 2 335 1 1 3 PRO CG C 7.663 -0.141 -4.361 1.00 . A A . 3 PRO CG 1 1 2 336 1 1 3 PRO HA H 5.790 -2.823 -4.894 1.00 . A A . 3 PRO HA 1 1 2 337 1 1 3 PRO HB2 H 7.584 -1.253 -6.238 1.00 . A A . 3 PRO HB2 1 1 2 338 1 1 3 PRO HB3 H 6.044 -0.648 -5.677 1.00 . A A . 3 PRO HB3 1 1 2 339 1 1 3 PRO HD2 H 7.682 -0.352 -2.202 1.00 . A A . 3 PRO HD2 1 1 2 340 1 1 3 PRO HD3 H 6.153 0.239 -2.862 1.00 . A A . 3 PRO HD3 1 1 2 341 1 1 3 PRO HG2 H 8.726 -0.385 -4.308 1.00 . A A . 3 PRO HG2 1 1 2 342 1 1 3 PRO HG3 H 7.581 0.908 -4.650 1.00 . A A . 3 PRO HG3 1 1 2 343 1 1 3 PRO N N 6.463 -1.823 -3.151 1.00 . A A . 3 PRO N 1 1 2 344 1 1 3 PRO O O 8.475 -3.481 -5.663 1.00 . A A . 3 PRO O 1 1 2 345 1 1 4 TRP C C 8.543 -6.643 -3.351 1.00 . A A . 4 TRP C 1 1 2 346 1 1 4 TRP CA C 9.123 -5.245 -3.575 1.00 . A A . 4 TRP CA 1 1 2 347 1 1 4 TRP CB C 10.278 -4.870 -2.621 1.00 . A A . 4 TRP CB 1 1 2 348 1 1 4 TRP CD1 C 12.323 -4.174 -3.932 1.00 . A A . 4 TRP CD1 1 1 2 349 1 1 4 TRP CD2 C 11.291 -2.421 -2.976 1.00 . A A . 4 TRP CD2 1 1 2 350 1 1 4 TRP CE2 C 12.414 -1.906 -3.694 1.00 . A A . 4 TRP CE2 1 1 2 351 1 1 4 TRP CE3 C 10.497 -1.484 -2.274 1.00 . A A . 4 TRP CE3 1 1 2 352 1 1 4 TRP CG C 11.255 -3.870 -3.160 1.00 . A A . 4 TRP CG 1 1 2 353 1 1 4 TRP CH2 C 11.910 0.368 -3.021 1.00 . A A . 4 TRP CH2 1 1 2 354 1 1 4 TRP CZ2 C 12.725 -0.536 -3.725 1.00 . A A . 4 TRP CZ2 1 1 2 355 1 1 4 TRP CZ3 C 10.801 -0.106 -2.293 1.00 . A A . 4 TRP CZ3 1 1 2 356 1 1 4 TRP H H 7.393 -4.227 -2.839 1.00 . A A . 4 TRP H 1 1 2 357 1 1 4 TRP HA H 9.581 -5.322 -4.564 1.00 . A A . 4 TRP HA 1 1 2 358 1 1 4 TRP HB2 H 9.912 -4.515 -1.660 1.00 . A A . 4 TRP HB2 1 1 2 359 1 1 4 TRP HB3 H 10.866 -5.763 -2.402 1.00 . A A . 4 TRP HB3 1 1 2 360 1 1 4 TRP HD1 H 12.586 -5.174 -4.249 1.00 . A A . 4 TRP HD1 1 1 2 361 1 1 4 TRP HE1 H 13.835 -3.009 -4.827 1.00 . A A . 4 TRP HE1 1 1 2 362 1 1 4 TRP HE3 H 9.647 -1.834 -1.712 1.00 . A A . 4 TRP HE3 1 1 2 363 1 1 4 TRP HH2 H 12.144 1.423 -3.036 1.00 . A A . 4 TRP HH2 1 1 2 364 1 1 4 TRP HZ2 H 13.582 -0.181 -4.279 1.00 . A A . 4 TRP HZ2 1 1 2 365 1 1 4 TRP HZ3 H 10.185 0.594 -1.748 1.00 . A A . 4 TRP HZ3 1 1 2 366 1 1 4 TRP N N 8.059 -4.235 -3.597 1.00 . A A . 4 TRP N 1 1 2 367 1 1 4 TRP NE1 N 13.003 -3.018 -4.252 1.00 . A A . 4 TRP NE1 1 1 2 368 1 1 4 TRP O O 8.186 -7.305 -4.324 1.00 . A A . 4 TRP O 1 1 2 369 1 1 5 LYS C C 9.655 -8.997 -1.236 1.00 . A A . 5 LYS C 1 1 2 370 1 1 5 LYS CA C 8.262 -8.447 -1.576 1.00 . A A . 5 LYS CA 1 1 2 371 1 1 5 LYS CB C 7.452 -9.408 -2.492 1.00 . A A . 5 LYS CB 1 1 2 372 1 1 5 LYS CD C 5.395 -9.733 -4.017 1.00 . A A . 5 LYS CD 1 1 2 373 1 1 5 LYS CE C 5.510 -9.024 -5.387 1.00 . A A . 5 LYS CE 1 1 2 374 1 1 5 LYS CG C 6.009 -8.968 -2.823 1.00 . A A . 5 LYS CG 1 1 2 375 1 1 5 LYS H H 8.789 -6.418 -1.404 1.00 . A A . 5 LYS H 1 1 2 376 1 1 5 LYS HA H 7.705 -8.349 -0.643 1.00 . A A . 5 LYS HA 1 1 2 377 1 1 5 LYS HB2 H 8.019 -9.594 -3.404 1.00 . A A . 5 LYS HB2 1 1 2 378 1 1 5 LYS HB3 H 7.408 -10.388 -2.013 1.00 . A A . 5 LYS HB3 1 1 2 379 1 1 5 LYS HD2 H 5.785 -10.751 -4.066 1.00 . A A . 5 LYS HD2 1 1 2 380 1 1 5 LYS HD3 H 4.329 -9.850 -3.813 1.00 . A A . 5 LYS HD3 1 1 2 381 1 1 5 LYS HE2 H 4.904 -9.560 -6.121 1.00 . A A . 5 LYS HE2 1 1 2 382 1 1 5 LYS HE3 H 5.101 -8.013 -5.325 1.00 . A A . 5 LYS HE3 1 1 2 383 1 1 5 LYS HG2 H 5.398 -9.141 -1.936 1.00 . A A . 5 LYS HG2 1 1 2 384 1 1 5 LYS HG3 H 5.947 -7.894 -3.001 1.00 . A A . 5 LYS HG3 1 1 2 385 1 1 5 LYS HZ1 H 6.915 -8.516 -6.809 1.00 . A A . 5 LYS HZ1 1 1 2 386 1 1 5 LYS HZ2 H 7.328 -9.858 -5.950 1.00 . A A . 5 LYS HZ2 1 1 2 387 1 1 5 LYS HZ3 H 7.451 -8.354 -5.273 1.00 . A A . 5 LYS HZ3 1 1 2 388 1 1 5 LYS N N 8.441 -7.076 -2.084 1.00 . A A . 5 LYS N 1 1 2 389 1 1 5 LYS NZ N 6.893 -8.951 -5.898 1.00 . A A . 5 LYS NZ 1 1 2 390 1 1 5 LYS O O 10.413 -9.300 -2.149 1.00 . A A . 5 LYS O 1 1 2 391 1 1 6 TRP C C 11.615 -10.945 0.586 1.00 . A A . 6 TRP C 1 1 2 392 1 1 6 TRP CA C 11.376 -9.428 0.484 1.00 . A A . 6 TRP CA 1 1 2 393 1 1 6 TRP CB C 11.626 -8.815 1.880 1.00 . A A . 6 TRP CB 1 1 2 394 1 1 6 TRP CD1 C 9.612 -8.697 3.426 1.00 . A A . 6 TRP CD1 1 1 2 395 1 1 6 TRP CD2 C 11.023 -10.353 3.984 1.00 . A A . 6 TRP CD2 1 1 2 396 1 1 6 TRP CE2 C 9.984 -10.346 4.962 1.00 . A A . 6 TRP CE2 1 1 2 397 1 1 6 TRP CE3 C 12.052 -11.311 4.150 1.00 . A A . 6 TRP CE3 1 1 2 398 1 1 6 TRP CG C 10.768 -9.274 3.028 1.00 . A A . 6 TRP CG 1 1 2 399 1 1 6 TRP CH2 C 11.044 -12.131 6.222 1.00 . A A . 6 TRP CH2 1 1 2 400 1 1 6 TRP CZ2 C 9.986 -11.214 6.069 1.00 . A A . 6 TRP CZ2 1 1 2 401 1 1 6 TRP CZ3 C 12.067 -12.188 5.255 1.00 . A A . 6 TRP CZ3 1 1 2 402 1 1 6 TRP H H 9.362 -8.827 0.776 1.00 . A A . 6 TRP H 1 1 2 403 1 1 6 TRP HA H 12.106 -9.017 -0.218 1.00 . A A . 6 TRP HA 1 1 2 404 1 1 6 TRP HB2 H 12.666 -8.984 2.165 1.00 . A A . 6 TRP HB2 1 1 2 405 1 1 6 TRP HB3 H 11.536 -7.731 1.807 1.00 . A A . 6 TRP HB3 1 1 2 406 1 1 6 TRP HD1 H 9.167 -7.831 2.956 1.00 . A A . 6 TRP HD1 1 1 2 407 1 1 6 TRP HE1 H 8.320 -9.022 5.057 1.00 . A A . 6 TRP HE1 1 1 2 408 1 1 6 TRP HE3 H 12.865 -11.337 3.438 1.00 . A A . 6 TRP HE3 1 1 2 409 1 1 6 TRP HH2 H 11.092 -12.756 7.102 1.00 . A A . 6 TRP HH2 1 1 2 410 1 1 6 TRP HZ2 H 9.209 -11.144 6.817 1.00 . A A . 6 TRP HZ2 1 1 2 411 1 1 6 TRP HZ3 H 12.901 -12.865 5.379 1.00 . A A . 6 TRP HZ3 1 1 2 412 1 1 6 TRP N N 10.012 -9.088 0.053 1.00 . A A . 6 TRP N 1 1 2 413 1 1 6 TRP NE1 N 9.129 -9.349 4.544 1.00 . A A . 6 TRP NE1 1 1 2 414 1 1 6 TRP O O 12.760 -11.384 0.663 1.00 . A A . 6 TRP O 1 1 2 415 1 1 7 LYS C C 10.818 -13.751 -0.746 1.00 . A A . 7 LYS C 1 1 2 416 1 1 7 LYS CA C 10.656 -13.213 0.680 1.00 . A A . 7 LYS CA 1 1 2 417 1 1 7 LYS CB C 9.386 -13.810 1.327 1.00 . A A . 7 LYS CB 1 1 2 418 1 1 7 LYS CD C 8.323 -14.543 3.537 1.00 . A A . 7 LYS CD 1 1 2 419 1 1 7 LYS CE C 8.433 -14.573 5.071 1.00 . A A . 7 LYS CE 1 1 2 420 1 1 7 LYS CG C 9.373 -13.646 2.857 1.00 . A A . 7 LYS CG 1 1 2 421 1 1 7 LYS H H 9.648 -11.350 0.453 1.00 . A A . 7 LYS H 1 1 2 422 1 1 7 LYS HA H 11.527 -13.515 1.264 1.00 . A A . 7 LYS HA 1 1 2 423 1 1 7 LYS HB2 H 8.483 -13.390 0.882 1.00 . A A . 7 LYS HB2 1 1 2 424 1 1 7 LYS HB3 H 9.355 -14.878 1.097 1.00 . A A . 7 LYS HB3 1 1 2 425 1 1 7 LYS HD2 H 7.329 -14.189 3.257 1.00 . A A . 7 LYS HD2 1 1 2 426 1 1 7 LYS HD3 H 8.393 -15.561 3.149 1.00 . A A . 7 LYS HD3 1 1 2 427 1 1 7 LYS HE2 H 8.350 -13.564 5.478 1.00 . A A . 7 LYS HE2 1 1 2 428 1 1 7 LYS HE3 H 7.601 -15.145 5.484 1.00 . A A . 7 LYS HE3 1 1 2 429 1 1 7 LYS HG2 H 10.367 -13.890 3.233 1.00 . A A . 7 LYS HG2 1 1 2 430 1 1 7 LYS HG3 H 9.203 -12.598 3.112 1.00 . A A . 7 LYS HG3 1 1 2 431 1 1 7 LYS HZ1 H 9.812 -16.105 5.105 1.00 . A A . 7 LYS HZ1 1 1 2 432 1 1 7 LYS HZ2 H 9.708 -15.284 6.523 1.00 . A A . 7 LYS HZ2 1 1 2 433 1 1 7 LYS HZ3 H 10.473 -14.602 5.238 1.00 . A A . 7 LYS HZ3 1 1 2 434 1 1 7 LYS N N 10.551 -11.760 0.617 1.00 . A A . 7 LYS N 1 1 2 435 1 1 7 LYS NZ N 9.699 -15.189 5.517 1.00 . A A . 7 LYS NZ 1 1 2 436 1 1 7 LYS O O 9.832 -14.013 -1.432 1.00 . A A . 7 LYS O 1 1 2 437 1 1 8 TRP C C 12.251 -15.913 -2.665 1.00 . A A . 8 TRP C 1 1 2 438 1 1 8 TRP CA C 12.491 -14.401 -2.479 1.00 . A A . 8 TRP CA 1 1 2 439 1 1 8 TRP CB C 13.992 -14.085 -2.670 1.00 . A A . 8 TRP CB 1 1 2 440 1 1 8 TRP CD1 C 14.988 -13.865 -4.993 1.00 . A A . 8 TRP CD1 1 1 2 441 1 1 8 TRP CD2 C 13.974 -11.984 -4.298 1.00 . A A . 8 TRP CD2 1 1 2 442 1 1 8 TRP CE2 C 14.500 -11.715 -5.598 1.00 . A A . 8 TRP CE2 1 1 2 443 1 1 8 TRP CE3 C 13.276 -10.932 -3.657 1.00 . A A . 8 TRP CE3 1 1 2 444 1 1 8 TRP CG C 14.311 -13.358 -3.939 1.00 . A A . 8 TRP CG 1 1 2 445 1 1 8 TRP CH2 C 13.658 -9.439 -5.556 1.00 . A A . 8 TRP CH2 1 1 2 446 1 1 8 TRP CZ2 C 14.352 -10.465 -6.224 1.00 . A A . 8 TRP CZ2 1 1 2 447 1 1 8 TRP CZ3 C 13.118 -9.675 -4.276 1.00 . A A . 8 TRP CZ3 1 1 2 448 1 1 8 TRP H H 12.807 -13.546 -0.563 1.00 . A A . 8 TRP H 1 1 2 449 1 1 8 TRP HA H 11.901 -13.876 -3.236 1.00 . A A . 8 TRP HA 1 1 2 450 1 1 8 TRP HB2 H 14.373 -13.457 -1.863 1.00 . A A . 8 TRP HB2 1 1 2 451 1 1 8 TRP HB3 H 14.599 -14.992 -2.634 1.00 . A A . 8 TRP HB3 1 1 2 452 1 1 8 TRP HD1 H 15.377 -14.873 -5.042 1.00 . A A . 8 TRP HD1 1 1 2 453 1 1 8 TRP HE1 H 15.582 -13.064 -6.845 1.00 . A A . 8 TRP HE1 1 1 2 454 1 1 8 TRP HE3 H 12.859 -11.095 -2.674 1.00 . A A . 8 TRP HE3 1 1 2 455 1 1 8 TRP HH2 H 13.544 -8.473 -6.024 1.00 . A A . 8 TRP HH2 1 1 2 456 1 1 8 TRP HZ2 H 14.769 -10.290 -7.205 1.00 . A A . 8 TRP HZ2 1 1 2 457 1 1 8 TRP HZ3 H 12.584 -8.889 -3.761 1.00 . A A . 8 TRP HZ3 1 1 2 458 1 1 8 TRP N N 12.078 -13.912 -1.160 1.00 . A A . 8 TRP N 1 1 2 459 1 1 8 TRP NE1 N 15.102 -12.899 -5.972 1.00 . A A . 8 TRP NE1 1 1 2 460 1 1 8 TRP O O 12.316 -16.407 -3.785 1.00 . A A . 8 TRP O 1 1 2 461 1 1 9 THR C C 10.123 -18.073 -0.912 1.00 . A A . 9 THR C 1 1 2 462 1 1 9 THR CA C 11.513 -18.030 -1.586 1.00 . A A . 9 THR CA 1 1 2 463 1 1 9 THR CB C 12.630 -18.921 -0.981 1.00 . A A . 9 THR CB 1 1 2 464 1 1 9 THR CG2 C 12.890 -18.766 0.535 1.00 . A A . 9 THR CG2 1 1 2 465 1 1 9 THR H H 11.887 -16.152 -0.703 1.00 . A A . 9 THR H 1 1 2 466 1 1 9 THR HA H 11.416 -18.381 -2.612 1.00 . A A . 9 THR HA 1 1 2 467 1 1 9 THR HB H 13.553 -18.666 -1.506 1.00 . A A . 9 THR HB 1 1 2 468 1 1 9 THR HG21 H 13.834 -19.231 0.820 1.00 . A A . 9 THR HG21 1 1 2 469 1 1 9 THR HG22 H 12.106 -19.226 1.134 1.00 . A A . 9 THR HG22 1 1 2 470 1 1 9 THR HG23 H 12.965 -17.717 0.816 1.00 . A A . 9 THR HG23 1 1 2 471 1 1 9 THR N N 11.933 -16.635 -1.582 1.00 . A A . 9 THR N 1 1 2 472 1 1 9 THR O O 10.024 -18.036 0.321 1.00 . A A . 9 THR O 1 1 2 473 1 1 9 THR OG1 O 12.304 -20.285 -1.304 1.00 . A A . 9 THR OG1 1 1 2 474 1 1 10 PRO C C 7.240 -19.516 -0.833 1.00 . A A . 10 PRO C 1 1 2 475 1 1 10 PRO CA C 7.657 -18.061 -1.128 1.00 . A A . 10 PRO CA 1 1 2 476 1 1 10 PRO CB C 6.791 -17.418 -2.227 1.00 . A A . 10 PRO CB 1 1 2 477 1 1 10 PRO CD C 8.980 -17.810 -3.136 1.00 . A A . 10 PRO CD 1 1 2 478 1 1 10 PRO CG C 7.502 -17.766 -3.527 1.00 . A A . 10 PRO CG 1 1 2 479 1 1 10 PRO HA H 7.579 -17.472 -0.213 1.00 . A A . 10 PRO HA 1 1 2 480 1 1 10 PRO HB2 H 5.750 -17.747 -2.218 1.00 . A A . 10 PRO HB2 1 1 2 481 1 1 10 PRO HB3 H 6.790 -16.335 -2.097 1.00 . A A . 10 PRO HB3 1 1 2 482 1 1 10 PRO HD2 H 9.494 -18.602 -3.683 1.00 . A A . 10 PRO HD2 1 1 2 483 1 1 10 PRO HD3 H 9.464 -16.861 -3.376 1.00 . A A . 10 PRO HD3 1 1 2 484 1 1 10 PRO HG2 H 7.182 -18.751 -3.872 1.00 . A A . 10 PRO HG2 1 1 2 485 1 1 10 PRO HG3 H 7.300 -17.054 -4.329 1.00 . A A . 10 PRO HG3 1 1 2 486 1 1 10 PRO N N 9.013 -18.028 -1.684 1.00 . A A . 10 PRO N 1 1 2 487 1 1 10 PRO O O 6.566 -20.151 -1.642 1.00 . A A . 10 PRO O 1 1 2 488 1 1 11 TRP C C 5.825 -21.570 1.215 1.00 . A A . 11 TRP C 1 1 2 489 1 1 11 TRP CA C 7.310 -21.416 0.792 1.00 . A A . 11 TRP CA 1 1 2 490 1 1 11 TRP CB C 8.281 -21.801 1.941 1.00 . A A . 11 TRP CB 1 1 2 491 1 1 11 TRP CD1 C 9.852 -23.671 1.315 1.00 . A A . 11 TRP CD1 1 1 2 492 1 1 11 TRP CD2 C 8.139 -24.424 2.554 1.00 . A A . 11 TRP CD2 1 1 2 493 1 1 11 TRP CE2 C 8.943 -25.558 2.216 1.00 . A A . 11 TRP CE2 1 1 2 494 1 1 11 TRP CE3 C 7.008 -24.674 3.370 1.00 . A A . 11 TRP CE3 1 1 2 495 1 1 11 TRP CG C 8.734 -23.235 1.937 1.00 . A A . 11 TRP CG 1 1 2 496 1 1 11 TRP CH2 C 7.486 -27.073 3.428 1.00 . A A . 11 TRP CH2 1 1 2 497 1 1 11 TRP CZ2 C 8.628 -26.862 2.635 1.00 . A A . 11 TRP CZ2 1 1 2 498 1 1 11 TRP CZ3 C 6.681 -25.978 3.798 1.00 . A A . 11 TRP CZ3 1 1 2 499 1 1 11 TRP H H 8.233 -19.499 0.916 1.00 . A A . 11 TRP H 1 1 2 500 1 1 11 TRP HA H 7.491 -22.089 -0.051 1.00 . A A . 11 TRP HA 1 1 2 501 1 1 11 TRP HB2 H 9.193 -21.210 1.850 1.00 . A A . 11 TRP HB2 1 1 2 502 1 1 11 TRP HB3 H 7.883 -21.555 2.927 1.00 . A A . 11 TRP HB3 1 1 2 503 1 1 11 TRP HD1 H 10.527 -23.028 0.769 1.00 . A A . 11 TRP HD1 1 1 2 504 1 1 11 TRP HE1 H 10.740 -25.566 1.076 1.00 . A A . 11 TRP HE1 1 1 2 505 1 1 11 TRP HE3 H 6.383 -23.853 3.679 1.00 . A A . 11 TRP HE3 1 1 2 506 1 1 11 TRP HH2 H 7.234 -28.070 3.758 1.00 . A A . 11 TRP HH2 1 1 2 507 1 1 11 TRP HZ2 H 9.256 -27.696 2.357 1.00 . A A . 11 TRP HZ2 1 1 2 508 1 1 11 TRP HZ3 H 5.811 -26.138 4.418 1.00 . A A . 11 TRP HZ3 1 1 2 509 1 1 11 TRP N N 7.608 -20.046 0.342 1.00 . A A . 11 TRP N 1 1 2 510 1 1 11 TRP NE1 N 9.974 -25.035 1.468 1.00 . A A . 11 TRP NE1 1 1 2 511 1 1 11 TRP O O 5.505 -22.044 2.300 1.00 . A A . 11 TRP O 1 1 2 512 1 1 12 ARG C C 2.887 -21.083 -0.962 1.00 . A A . 12 ARG C 1 1 2 513 1 1 12 ARG CA C 3.459 -21.348 0.436 1.00 . A A . 12 ARG CA 1 1 2 514 1 1 12 ARG CB C 2.794 -20.529 1.576 1.00 . A A . 12 ARG CB 1 1 2 515 1 1 12 ARG CD C 1.533 -18.547 0.489 1.00 . A A . 12 ARG CD 1 1 2 516 1 1 12 ARG CG C 2.701 -18.997 1.392 1.00 . A A . 12 ARG CG 1 1 2 517 1 1 12 ARG CZ C -0.315 -16.862 0.576 1.00 . A A . 12 ARG CZ 1 1 2 518 1 1 12 ARG H H 5.244 -20.757 -0.523 1.00 . A A . 12 ARG H 1 1 2 519 1 1 12 ARG HA H 3.319 -22.410 0.653 1.00 . A A . 12 ARG HA 1 1 2 520 1 1 12 ARG HB2 H 1.797 -20.929 1.765 1.00 . A A . 12 ARG HB2 1 1 2 521 1 1 12 ARG HB3 H 3.333 -20.723 2.503 1.00 . A A . 12 ARG HB3 1 1 2 522 1 1 12 ARG HD2 H 1.862 -18.417 -0.542 1.00 . A A . 12 ARG HD2 1 1 2 523 1 1 12 ARG HD3 H 0.764 -19.318 0.493 1.00 . A A . 12 ARG HD3 1 1 2 524 1 1 12 ARG HE H 1.455 -16.775 1.606 1.00 . A A . 12 ARG HE 1 1 2 525 1 1 12 ARG HG2 H 2.590 -18.552 2.381 1.00 . A A . 12 ARG HG2 1 1 2 526 1 1 12 ARG HG3 H 3.648 -18.622 0.999 1.00 . A A . 12 ARG HG3 1 1 2 527 1 1 12 ARG HH11 H -0.744 -18.406 -0.746 1.00 . A A . 12 ARG HH11 1 1 2 528 1 1 12 ARG HH12 H -2.007 -17.258 -0.551 1.00 . A A . 12 ARG HH12 1 1 2 529 1 1 12 ARG HH21 H -0.259 -15.184 1.770 1.00 . A A . 12 ARG HH21 1 1 2 530 1 1 12 ARG HH22 H -1.684 -15.348 0.837 1.00 . A A . 12 ARG HH22 1 1 2 531 1 1 12 ARG N N 4.895 -21.127 0.364 1.00 . A A . 12 ARG N 1 1 2 532 1 1 12 ARG NE N 0.895 -17.305 0.952 1.00 . A A . 12 ARG NE 1 1 2 533 1 1 12 ARG NH1 N -1.069 -17.537 -0.299 1.00 . A A . 12 ARG NH1 1 1 2 534 1 1 12 ARG NH2 N -0.776 -15.721 1.088 1.00 . A A . 12 ARG NH2 1 1 2 535 1 1 12 ARG O O 3.414 -20.247 -1.695 1.00 . A A . 12 ARG O 1 1 2 536 1 1 13 ARG C C 0.451 -20.107 -2.620 1.00 . A A . 13 ARG C 1 1 2 537 1 1 13 ARG CA C 1.087 -21.511 -2.594 1.00 . A A . 13 ARG CA 1 1 2 538 1 1 13 ARG CB C -0.002 -22.590 -2.789 1.00 . A A . 13 ARG CB 1 1 2 539 1 1 13 ARG CD C -0.489 -25.098 -3.184 1.00 . A A . 13 ARG CD 1 1 2 540 1 1 13 ARG CG C 0.576 -24.011 -2.950 1.00 . A A . 13 ARG CG 1 1 2 541 1 1 13 ARG CZ C -0.737 -25.533 -5.662 1.00 . A A . 13 ARG CZ 1 1 2 542 1 1 13 ARG H H 1.348 -22.352 -0.649 1.00 . A A . 13 ARG H 1 1 2 543 1 1 13 ARG HA H 1.819 -21.591 -3.401 1.00 . A A . 13 ARG HA 1 1 2 544 1 1 13 ARG HB2 H -0.707 -22.565 -1.956 1.00 . A A . 13 ARG HB2 1 1 2 545 1 1 13 ARG HB3 H -0.582 -22.342 -3.679 1.00 . A A . 13 ARG HB3 1 1 2 546 1 1 13 ARG HD2 H -0.049 -26.091 -3.080 1.00 . A A . 13 ARG HD2 1 1 2 547 1 1 13 ARG HD3 H -1.256 -25.035 -2.410 1.00 . A A . 13 ARG HD3 1 1 2 548 1 1 13 ARG HE H -1.987 -24.427 -4.482 1.00 . A A . 13 ARG HE 1 1 2 549 1 1 13 ARG HG2 H 1.298 -24.019 -3.769 1.00 . A A . 13 ARG HG2 1 1 2 550 1 1 13 ARG HG3 H 1.147 -24.276 -2.058 1.00 . A A . 13 ARG HG3 1 1 2 551 1 1 13 ARG HH11 H 0.921 -26.454 -4.888 1.00 . A A . 13 ARG HH11 1 1 2 552 1 1 13 ARG HH12 H 0.700 -26.718 -6.567 1.00 . A A . 13 ARG HH12 1 1 2 553 1 1 13 ARG HH21 H -2.309 -24.794 -6.778 1.00 . A A . 13 ARG HH21 1 1 2 554 1 1 13 ARG HH22 H -1.187 -25.727 -7.665 1.00 . A A . 13 ARG HH22 1 1 2 555 1 1 13 ARG N N 1.768 -21.724 -1.317 1.00 . A A . 13 ARG N 1 1 2 556 1 1 13 ARG NE N -1.131 -24.970 -4.509 1.00 . A A . 13 ARG NE 1 1 2 557 1 1 13 ARG NH1 N 0.372 -26.275 -5.718 1.00 . A A . 13 ARG NH1 1 1 2 558 1 1 13 ARG NH2 N -1.453 -25.333 -6.771 1.00 . A A . 13 ARG NH2 1 1 2 559 1 1 13 ARG O O -0.375 -19.761 -1.776 1.00 . A A . 13 ARG O 1 1 2 560 1 1 14 NH2 HN1 H 0.484 -18.334 -3.616 1.00 . A A . 14 NH2 HN1 1 1 2 561 1 1 14 NH2 HN2 H 1.625 -19.536 -4.167 1.00 . A A . 14 NH2 HN2 1 1 2 562 1 1 14 NH2 N N 0.866 -19.265 -3.558 1.00 . A A . 14 NH2 N 1 1 2 563 2 2 1 . C1 C 13.245 -21.274 -0.943 1.00 . B A . 101 BGC C1 1 1 2 564 2 2 1 . C2 C 12.963 -22.568 -1.735 1.00 . B A . 101 BGC C2 1 1 2 565 2 2 1 . C3 C 13.982 -23.648 -1.339 1.00 . B A . 101 BGC C3 1 1 2 566 2 2 1 . C4 C 15.413 -23.118 -1.484 1.00 . B A . 101 BGC C4 1 1 2 567 2 2 1 . C5 C 15.563 -21.808 -0.679 1.00 . B A . 101 BGC C5 1 1 2 568 2 2 1 . C6 C 16.937 -21.136 -0.829 1.00 . B A . 101 BGC C6 1 1 2 569 2 2 1 . H1 H 13.137 -21.421 0.141 1.00 . B A . 101 BGC H1 1 1 2 570 2 2 1 . H2 H 13.047 -22.338 -2.799 1.00 . B A . 101 BGC H2 1 1 2 571 2 2 1 . H3 H 13.817 -23.913 -0.292 1.00 . B A . 101 BGC H3 1 1 2 572 2 2 1 . H4 H 15.619 -22.908 -2.535 1.00 . B A . 101 BGC H4 1 1 2 573 2 2 1 . H5 H 15.379 -21.995 0.382 1.00 . B A . 101 BGC H5 1 1 2 574 2 2 1 . H6 H 17.909 -19.568 -0.162 1.00 . B A . 101 BGC H6 1 1 2 575 2 2 1 . H6C1 H 17.119 -20.879 -1.874 1.00 . B A . 101 BGC H6C1 1 1 2 576 2 2 1 . H6C2 H 17.723 -21.832 -0.529 1.00 . B A . 101 BGC H6C2 1 1 2 577 2 2 1 . HB H 11.589 -23.927 -1.867 1.00 . B A . 101 BGC HB 1 1 2 578 2 2 1 . HC H 13.939 -24.586 -3.067 1.00 . B A . 101 BGC HC 1 1 2 579 2 2 1 . HD H 15.985 -24.969 -1.390 1.00 . B A . 101 BGC HD 1 1 2 580 2 2 1 . O2 O 11.653 -23.046 -1.466 1.00 . B A . 101 BGC O2 1 1 2 581 2 2 1 . O3 O 13.804 -24.822 -2.137 1.00 . B A . 101 BGC O3 1 1 2 582 2 2 1 . O4 O 16.315 -24.124 -1.043 1.00 . B A . 101 BGC O4 1 1 2 583 2 2 1 . O5 O 14.580 -20.888 -1.178 1.00 . B A . 101 BGC O5 1 1 2 584 2 2 1 . O6 O 17.033 -19.957 -0.029 1.00 . B A . 101 BGC O6 1 1 3 585 1 1 1 ILE C C 7.859 3.401 -0.668 1.00 . A A . 1 ILE C 1 1 3 586 1 1 1 ILE CA C 8.273 4.016 0.671 1.00 . A A . 1 ILE CA 1 1 3 587 1 1 1 ILE CB C 7.259 3.700 1.808 1.00 . A A . 1 ILE CB 1 1 3 588 1 1 1 ILE CD1 C 4.777 3.755 2.540 1.00 . A A . 1 ILE CD1 1 1 3 589 1 1 1 ILE CG1 C 5.841 4.293 1.576 1.00 . A A . 1 ILE CG1 1 1 3 590 1 1 1 ILE CG2 C 7.824 4.128 3.179 1.00 . A A . 1 ILE CG2 1 1 3 591 1 1 1 ILE H1 H 8.474 5.966 1.336 1.00 . A A . 1 ILE H1 1 1 3 592 1 1 1 ILE HA H 9.258 3.627 0.938 1.00 . A A . 1 ILE HA 1 1 3 593 1 1 1 ILE HB H 7.151 2.614 1.843 1.00 . A A . 1 ILE HB 1 1 3 594 1 1 1 ILE HD11 H 3.789 4.141 2.277 1.00 . A A . 1 ILE HD11 1 1 3 595 1 1 1 ILE HD12 H 4.714 2.665 2.507 1.00 . A A . 1 ILE HD12 1 1 3 596 1 1 1 ILE HD13 H 4.966 4.050 3.572 1.00 . A A . 1 ILE HD13 1 1 3 597 1 1 1 ILE HG12 H 5.857 5.380 1.649 1.00 . A A . 1 ILE HG12 1 1 3 598 1 1 1 ILE HG13 H 5.491 4.067 0.568 1.00 . A A . 1 ILE HG13 1 1 3 599 1 1 1 ILE HG21 H 7.872 5.210 3.292 1.00 . A A . 1 ILE HG21 1 1 3 600 1 1 1 ILE HG22 H 7.207 3.750 3.996 1.00 . A A . 1 ILE HG22 1 1 3 601 1 1 1 ILE HG23 H 8.825 3.727 3.345 1.00 . A A . 1 ILE HG23 1 1 3 602 1 1 1 ILE N N 8.387 5.470 0.464 1.00 . A A . 1 ILE N 1 1 3 603 1 1 1 ILE O O 7.278 4.125 -1.474 1.00 . A A . 1 ILE O 1 1 3 604 1 1 2 LEU C C 7.593 -0.096 -1.692 1.00 . A A . 2 LEU C 1 1 3 605 1 1 2 LEU CA C 7.722 1.384 -2.102 1.00 . A A . 2 LEU CA 1 1 3 606 1 1 2 LEU CB C 8.704 1.678 -3.271 1.00 . A A . 2 LEU CB 1 1 3 607 1 1 2 LEU CD1 C 7.930 -0.077 -4.996 1.00 . A A . 2 LEU CD1 1 1 3 608 1 1 2 LEU CD2 C 6.973 2.271 -5.085 1.00 . A A . 2 LEU CD2 1 1 3 609 1 1 2 LEU CG C 8.186 1.406 -4.704 1.00 . A A . 2 LEU CG 1 1 3 610 1 1 2 LEU H H 8.640 1.559 -0.227 1.00 . A A . 2 LEU H 1 1 3 611 1 1 2 LEU HA H 6.742 1.755 -2.399 1.00 . A A . 2 LEU HA 1 1 3 612 1 1 2 LEU HB2 H 8.993 2.730 -3.242 1.00 . A A . 2 LEU HB2 1 1 3 613 1 1 2 LEU HB3 H 9.636 1.131 -3.119 1.00 . A A . 2 LEU HB3 1 1 3 614 1 1 2 LEU HD11 H 7.753 -0.238 -6.059 1.00 . A A . 2 LEU HD11 1 1 3 615 1 1 2 LEU HD12 H 7.057 -0.451 -4.463 1.00 . A A . 2 LEU HD12 1 1 3 616 1 1 2 LEU HD13 H 8.790 -0.685 -4.713 1.00 . A A . 2 LEU HD13 1 1 3 617 1 1 2 LEU HD21 H 7.153 3.326 -4.873 1.00 . A A . 2 LEU HD21 1 1 3 618 1 1 2 LEU HD22 H 6.070 1.972 -4.554 1.00 . A A . 2 LEU HD22 1 1 3 619 1 1 2 LEU HD23 H 6.758 2.188 -6.151 1.00 . A A . 2 LEU HD23 1 1 3 620 1 1 2 LEU HG H 8.997 1.707 -5.371 1.00 . A A . 2 LEU HG 1 1 3 621 1 1 2 LEU N N 8.144 2.118 -0.908 1.00 . A A . 2 LEU N 1 1 3 622 1 1 2 LEU O O 8.596 -0.809 -1.736 1.00 . A A . 2 LEU O 1 1 3 623 1 1 3 PRO C C 6.032 -2.939 -1.842 1.00 . A A . 3 PRO C 1 1 3 624 1 1 3 PRO CA C 6.253 -1.931 -0.694 1.00 . A A . 3 PRO CA 1 1 3 625 1 1 3 PRO CB C 5.032 -1.819 0.241 1.00 . A A . 3 PRO CB 1 1 3 626 1 1 3 PRO CD C 5.200 0.228 -1.005 1.00 . A A . 3 PRO CD 1 1 3 627 1 1 3 PRO CG C 4.176 -0.728 -0.388 1.00 . A A . 3 PRO CG 1 1 3 628 1 1 3 PRO HA H 7.122 -2.252 -0.117 1.00 . A A . 3 PRO HA 1 1 3 629 1 1 3 PRO HB2 H 4.486 -2.755 0.379 1.00 . A A . 3 PRO HB2 1 1 3 630 1 1 3 PRO HB3 H 5.361 -1.498 1.229 1.00 . A A . 3 PRO HB3 1 1 3 631 1 1 3 PRO HD2 H 4.822 0.638 -1.942 1.00 . A A . 3 PRO HD2 1 1 3 632 1 1 3 PRO HD3 H 5.403 1.056 -0.323 1.00 . A A . 3 PRO HD3 1 1 3 633 1 1 3 PRO HG2 H 3.554 -1.162 -1.174 1.00 . A A . 3 PRO HG2 1 1 3 634 1 1 3 PRO HG3 H 3.511 -0.243 0.327 1.00 . A A . 3 PRO HG3 1 1 3 635 1 1 3 PRO N N 6.421 -0.562 -1.205 1.00 . A A . 3 PRO N 1 1 3 636 1 1 3 PRO O O 4.941 -3.482 -1.998 1.00 . A A . 3 PRO O 1 1 3 637 1 1 4 TRP C C 8.226 -5.068 -3.720 1.00 . A A . 4 TRP C 1 1 3 638 1 1 4 TRP CA C 7.016 -4.137 -3.770 1.00 . A A . 4 TRP CA 1 1 3 639 1 1 4 TRP CB C 6.891 -3.382 -5.104 1.00 . A A . 4 TRP CB 1 1 3 640 1 1 4 TRP CD1 C 5.570 -4.843 -6.698 1.00 . A A . 4 TRP CD1 1 1 3 641 1 1 4 TRP CD2 C 7.719 -4.626 -7.310 1.00 . A A . 4 TRP CD2 1 1 3 642 1 1 4 TRP CE2 C 7.096 -5.473 -8.276 1.00 . A A . 4 TRP CE2 1 1 3 643 1 1 4 TRP CE3 C 9.093 -4.338 -7.497 1.00 . A A . 4 TRP CE3 1 1 3 644 1 1 4 TRP CG C 6.721 -4.247 -6.314 1.00 . A A . 4 TRP CG 1 1 3 645 1 1 4 TRP CH2 C 9.164 -5.701 -9.528 1.00 . A A . 4 TRP CH2 1 1 3 646 1 1 4 TRP CZ2 C 7.798 -6.006 -9.373 1.00 . A A . 4 TRP CZ2 1 1 3 647 1 1 4 TRP CZ3 C 9.809 -4.870 -8.590 1.00 . A A . 4 TRP CZ3 1 1 3 648 1 1 4 TRP H H 7.955 -2.744 -2.475 1.00 . A A . 4 TRP H 1 1 3 649 1 1 4 TRP HA H 6.124 -4.764 -3.679 1.00 . A A . 4 TRP HA 1 1 3 650 1 1 4 TRP HB2 H 6.037 -2.703 -5.058 1.00 . A A . 4 TRP HB2 1 1 3 651 1 1 4 TRP HB3 H 7.774 -2.766 -5.264 1.00 . A A . 4 TRP HB3 1 1 3 652 1 1 4 TRP HD1 H 4.628 -4.745 -6.172 1.00 . A A . 4 TRP HD1 1 1 3 653 1 1 4 TRP HE1 H 5.045 -6.049 -8.342 1.00 . A A . 4 TRP HE1 1 1 3 654 1 1 4 TRP HE3 H 9.601 -3.703 -6.788 1.00 . A A . 4 TRP HE3 1 1 3 655 1 1 4 TRP HH2 H 9.715 -6.092 -10.372 1.00 . A A . 4 TRP HH2 1 1 3 656 1 1 4 TRP HZ2 H 7.297 -6.630 -10.096 1.00 . A A . 4 TRP HZ2 1 1 3 657 1 1 4 TRP HZ3 H 10.855 -4.632 -8.712 1.00 . A A . 4 TRP HZ3 1 1 3 658 1 1 4 TRP N N 7.066 -3.204 -2.649 1.00 . A A . 4 TRP N 1 1 3 659 1 1 4 TRP NE1 N 5.789 -5.569 -7.849 1.00 . A A . 4 TRP NE1 1 1 3 660 1 1 4 TRP O O 9.365 -4.618 -3.640 1.00 . A A . 4 TRP O 1 1 3 661 1 1 5 LYS C C 9.960 -7.763 -2.918 1.00 . A A . 5 LYS C 1 1 3 662 1 1 5 LYS CA C 8.887 -7.489 -3.991 1.00 . A A . 5 LYS CA 1 1 3 663 1 1 5 LYS CB C 9.467 -7.475 -5.432 1.00 . A A . 5 LYS CB 1 1 3 664 1 1 5 LYS CD C 9.603 -10.034 -5.670 1.00 . A A . 5 LYS CD 1 1 3 665 1 1 5 LYS CE C 9.130 -11.290 -6.405 1.00 . A A . 5 LYS CE 1 1 3 666 1 1 5 LYS CG C 9.082 -8.713 -6.268 1.00 . A A . 5 LYS CG 1 1 3 667 1 1 5 LYS H H 6.986 -6.617 -3.748 1.00 . A A . 5 LYS H 1 1 3 668 1 1 5 LYS HA H 8.216 -8.342 -3.908 1.00 . A A . 5 LYS HA 1 1 3 669 1 1 5 LYS HB2 H 9.131 -6.588 -5.966 1.00 . A A . 5 LYS HB2 1 1 3 670 1 1 5 LYS HB3 H 10.555 -7.378 -5.407 1.00 . A A . 5 LYS HB3 1 1 3 671 1 1 5 LYS HD2 H 10.693 -10.001 -5.637 1.00 . A A . 5 LYS HD2 1 1 3 672 1 1 5 LYS HD3 H 9.269 -10.120 -4.638 1.00 . A A . 5 LYS HD3 1 1 3 673 1 1 5 LYS HE2 H 8.054 -11.239 -6.589 1.00 . A A . 5 LYS HE2 1 1 3 674 1 1 5 LYS HE3 H 9.621 -11.375 -7.377 1.00 . A A . 5 LYS HE3 1 1 3 675 1 1 5 LYS HG2 H 7.996 -8.743 -6.366 1.00 . A A . 5 LYS HG2 1 1 3 676 1 1 5 LYS HG3 H 9.471 -8.589 -7.280 1.00 . A A . 5 LYS HG3 1 1 3 677 1 1 5 LYS HZ1 H 8.949 -12.405 -4.692 1.00 . A A . 5 LYS HZ1 1 1 3 678 1 1 5 LYS HZ2 H 10.405 -12.564 -5.415 1.00 . A A . 5 LYS HZ2 1 1 3 679 1 1 5 LYS HZ3 H 9.092 -13.322 -6.054 1.00 . A A . 5 LYS HZ3 1 1 3 680 1 1 5 LYS N N 7.967 -6.379 -3.736 1.00 . A A . 5 LYS N 1 1 3 681 1 1 5 LYS NZ N 9.409 -12.485 -5.588 1.00 . A A . 5 LYS NZ 1 1 3 682 1 1 5 LYS O O 10.647 -8.780 -3.001 1.00 . A A . 5 LYS O 1 1 3 683 1 1 6 TRP C C 10.787 -8.202 0.182 1.00 . A A . 6 TRP C 1 1 3 684 1 1 6 TRP CA C 11.017 -6.996 -0.766 1.00 . A A . 6 TRP CA 1 1 3 685 1 1 6 TRP CB C 10.934 -5.662 0.014 1.00 . A A . 6 TRP CB 1 1 3 686 1 1 6 TRP CD1 C 13.155 -4.461 -0.077 1.00 . A A . 6 TRP CD1 1 1 3 687 1 1 6 TRP CD2 C 12.726 -5.277 1.971 1.00 . A A . 6 TRP CD2 1 1 3 688 1 1 6 TRP CE2 C 13.994 -4.623 2.039 1.00 . A A . 6 TRP CE2 1 1 3 689 1 1 6 TRP CE3 C 12.248 -5.866 3.167 1.00 . A A . 6 TRP CE3 1 1 3 690 1 1 6 TRP CG C 12.220 -5.162 0.603 1.00 . A A . 6 TRP CG 1 1 3 691 1 1 6 TRP CH2 C 14.240 -5.158 4.394 1.00 . A A . 6 TRP CH2 1 1 3 692 1 1 6 TRP CZ2 C 14.747 -4.559 3.226 1.00 . A A . 6 TRP CZ2 1 1 3 693 1 1 6 TRP CZ3 C 12.993 -5.811 4.362 1.00 . A A . 6 TRP CZ3 1 1 3 694 1 1 6 TRP H H 9.521 -6.074 -1.971 1.00 . A A . 6 TRP H 1 1 3 695 1 1 6 TRP HA H 12.015 -7.095 -1.196 1.00 . A A . 6 TRP HA 1 1 3 696 1 1 6 TRP HB2 H 10.599 -4.866 -0.653 1.00 . A A . 6 TRP HB2 1 1 3 697 1 1 6 TRP HB3 H 10.182 -5.708 0.803 1.00 . A A . 6 TRP HB3 1 1 3 698 1 1 6 TRP HD1 H 13.076 -4.198 -1.123 1.00 . A A . 6 TRP HD1 1 1 3 699 1 1 6 TRP HE1 H 15.023 -3.643 0.457 1.00 . A A . 6 TRP HE1 1 1 3 700 1 1 6 TRP HE3 H 11.296 -6.378 3.157 1.00 . A A . 6 TRP HE3 1 1 3 701 1 1 6 TRP HH2 H 14.810 -5.119 5.310 1.00 . A A . 6 TRP HH2 1 1 3 702 1 1 6 TRP HZ2 H 15.702 -4.057 3.245 1.00 . A A . 6 TRP HZ2 1 1 3 703 1 1 6 TRP HZ3 H 12.607 -6.275 5.259 1.00 . A A . 6 TRP HZ3 1 1 3 704 1 1 6 TRP N N 10.057 -6.926 -1.880 1.00 . A A . 6 TRP N 1 1 3 705 1 1 6 TRP NE1 N 14.204 -4.150 0.762 1.00 . A A . 6 TRP NE1 1 1 3 706 1 1 6 TRP O O 11.324 -8.248 1.285 1.00 . A A . 6 TRP O 1 1 3 707 1 1 7 LYS C C 9.461 -11.569 -0.507 1.00 . A A . 7 LYS C 1 1 3 708 1 1 7 LYS CA C 9.697 -10.421 0.482 1.00 . A A . 7 LYS CA 1 1 3 709 1 1 7 LYS CB C 8.540 -10.227 1.499 1.00 . A A . 7 LYS CB 1 1 3 710 1 1 7 LYS CD C 9.483 -11.466 3.573 1.00 . A A . 7 LYS CD 1 1 3 711 1 1 7 LYS CE C 8.341 -12.405 4.001 1.00 . A A . 7 LYS CE 1 1 3 712 1 1 7 LYS CG C 8.993 -10.135 2.972 1.00 . A A . 7 LYS CG 1 1 3 713 1 1 7 LYS H H 9.710 -9.161 -1.203 1.00 . A A . 7 LYS H 1 1 3 714 1 1 7 LYS HA H 10.607 -10.684 1.024 1.00 . A A . 7 LYS HA 1 1 3 715 1 1 7 LYS HB2 H 7.991 -9.318 1.247 1.00 . A A . 7 LYS HB2 1 1 3 716 1 1 7 LYS HB3 H 7.802 -11.024 1.396 1.00 . A A . 7 LYS HB3 1 1 3 717 1 1 7 LYS HD2 H 10.154 -11.962 2.872 1.00 . A A . 7 LYS HD2 1 1 3 718 1 1 7 LYS HD3 H 10.093 -11.236 4.449 1.00 . A A . 7 LYS HD3 1 1 3 719 1 1 7 LYS HE2 H 7.838 -11.998 4.881 1.00 . A A . 7 LYS HE2 1 1 3 720 1 1 7 LYS HE3 H 7.589 -12.485 3.216 1.00 . A A . 7 LYS HE3 1 1 3 721 1 1 7 LYS HG2 H 9.787 -9.393 3.047 1.00 . A A . 7 LYS HG2 1 1 3 722 1 1 7 LYS HG3 H 8.178 -9.737 3.579 1.00 . A A . 7 LYS HG3 1 1 3 723 1 1 7 LYS HZ1 H 9.646 -13.730 4.897 1.00 . A A . 7 LYS HZ1 1 1 3 724 1 1 7 LYS HZ2 H 9.072 -14.211 3.409 1.00 . A A . 7 LYS HZ2 1 1 3 725 1 1 7 LYS HZ3 H 8.111 -14.306 4.738 1.00 . A A . 7 LYS HZ3 1 1 3 726 1 1 7 LYS N N 9.988 -9.192 -0.231 1.00 . A A . 7 LYS N 1 1 3 727 1 1 7 LYS NZ N 8.836 -13.763 4.293 1.00 . A A . 7 LYS NZ 1 1 3 728 1 1 7 LYS O O 8.903 -11.380 -1.590 1.00 . A A . 7 LYS O 1 1 3 729 1 1 8 TRP C C 8.653 -14.809 0.426 1.00 . A A . 8 TRP C 1 1 3 730 1 1 8 TRP CA C 9.439 -14.054 -0.659 1.00 . A A . 8 TRP CA 1 1 3 731 1 1 8 TRP CB C 10.677 -14.868 -1.096 1.00 . A A . 8 TRP CB 1 1 3 732 1 1 8 TRP CD1 C 10.822 -15.976 -3.370 1.00 . A A . 8 TRP CD1 1 1 3 733 1 1 8 TRP CD2 C 11.539 -13.851 -3.422 1.00 . A A . 8 TRP CD2 1 1 3 734 1 1 8 TRP CE2 C 11.778 -14.407 -4.719 1.00 . A A . 8 TRP CE2 1 1 3 735 1 1 8 TRP CE3 C 11.908 -12.498 -3.230 1.00 . A A . 8 TRP CE3 1 1 3 736 1 1 8 TRP CG C 10.976 -14.897 -2.568 1.00 . A A . 8 TRP CG 1 1 3 737 1 1 8 TRP CH2 C 12.750 -12.333 -5.521 1.00 . A A . 8 TRP CH2 1 1 3 738 1 1 8 TRP CZ2 C 12.390 -13.673 -5.752 1.00 . A A . 8 TRP CZ2 1 1 3 739 1 1 8 TRP CZ3 C 12.499 -11.745 -4.266 1.00 . A A . 8 TRP CZ3 1 1 3 740 1 1 8 TRP H H 10.315 -12.829 0.801 1.00 . A A . 8 TRP H 1 1 3 741 1 1 8 TRP HA H 8.772 -13.908 -1.511 1.00 . A A . 8 TRP HA 1 1 3 742 1 1 8 TRP HB2 H 11.575 -14.527 -0.577 1.00 . A A . 8 TRP HB2 1 1 3 743 1 1 8 TRP HB3 H 10.567 -15.914 -0.793 1.00 . A A . 8 TRP HB3 1 1 3 744 1 1 8 TRP HD1 H 10.453 -16.937 -3.036 1.00 . A A . 8 TRP HD1 1 1 3 745 1 1 8 TRP HE1 H 11.374 -16.402 -5.351 1.00 . A A . 8 TRP HE1 1 1 3 746 1 1 8 TRP HE3 H 11.761 -12.035 -2.266 1.00 . A A . 8 TRP HE3 1 1 3 747 1 1 8 TRP HH2 H 13.243 -11.761 -6.297 1.00 . A A . 8 TRP HH2 1 1 3 748 1 1 8 TRP HZ2 H 12.598 -14.133 -6.709 1.00 . A A . 8 TRP HZ2 1 1 3 749 1 1 8 TRP HZ3 H 12.789 -10.719 -4.080 1.00 . A A . 8 TRP HZ3 1 1 3 750 1 1 8 TRP N N 9.849 -12.775 -0.089 1.00 . A A . 8 TRP N 1 1 3 751 1 1 8 TRP NE1 N 11.274 -15.685 -4.641 1.00 . A A . 8 TRP NE1 1 1 3 752 1 1 8 TRP O O 8.871 -14.607 1.631 1.00 . A A . 8 TRP O 1 1 3 753 1 1 9 THR C C 7.008 -17.987 0.306 1.00 . A A . 9 THR C 1 1 3 754 1 1 9 THR CA C 6.862 -16.522 0.779 1.00 . A A . 9 THR CA 1 1 3 755 1 1 9 THR CB C 5.431 -15.942 0.636 1.00 . A A . 9 THR CB 1 1 3 756 1 1 9 THR CG2 C 5.243 -14.639 1.440 1.00 . A A . 9 THR CG2 1 1 3 757 1 1 9 THR H H 7.565 -15.737 -1.008 1.00 . A A . 9 THR H 1 1 3 758 1 1 9 THR HA H 7.125 -16.496 1.836 1.00 . A A . 9 THR HA 1 1 3 759 1 1 9 THR HB H 4.706 -16.681 0.978 1.00 . A A . 9 THR HB 1 1 3 760 1 1 9 THR HG21 H 5.530 -14.779 2.482 1.00 . A A . 9 THR HG21 1 1 3 761 1 1 9 THR HG22 H 4.200 -14.322 1.450 1.00 . A A . 9 THR HG22 1 1 3 762 1 1 9 THR HG23 H 5.837 -13.821 1.031 1.00 . A A . 9 THR HG23 1 1 3 763 1 1 9 THR N N 7.756 -15.689 -0.015 1.00 . A A . 9 THR N 1 1 3 764 1 1 9 THR O O 6.182 -18.458 -0.475 1.00 . A A . 9 THR O 1 1 3 765 1 1 9 THR OG1 O 5.232 -15.672 -0.766 1.00 . A A . 9 THR OG1 1 1 3 766 1 1 10 PRO C C 7.312 -21.017 1.119 1.00 . A A . 10 PRO C 1 1 3 767 1 1 10 PRO CA C 8.270 -20.112 0.327 1.00 . A A . 10 PRO CA 1 1 3 768 1 1 10 PRO CB C 9.740 -20.405 0.662 1.00 . A A . 10 PRO CB 1 1 3 769 1 1 10 PRO CD C 9.172 -18.243 1.573 1.00 . A A . 10 PRO CD 1 1 3 770 1 1 10 PRO CG C 10.076 -19.456 1.806 1.00 . A A . 10 PRO CG 1 1 3 771 1 1 10 PRO HA H 8.099 -20.240 -0.744 1.00 . A A . 10 PRO HA 1 1 3 772 1 1 10 PRO HB2 H 9.925 -21.449 0.923 1.00 . A A . 10 PRO HB2 1 1 3 773 1 1 10 PRO HB3 H 10.365 -20.172 -0.200 1.00 . A A . 10 PRO HB3 1 1 3 774 1 1 10 PRO HD2 H 8.812 -17.849 2.524 1.00 . A A . 10 PRO HD2 1 1 3 775 1 1 10 PRO HD3 H 9.732 -17.461 1.060 1.00 . A A . 10 PRO HD3 1 1 3 776 1 1 10 PRO HG2 H 9.813 -19.930 2.753 1.00 . A A . 10 PRO HG2 1 1 3 777 1 1 10 PRO HG3 H 11.135 -19.202 1.851 1.00 . A A . 10 PRO HG3 1 1 3 778 1 1 10 PRO N N 8.075 -18.711 0.718 1.00 . A A . 10 PRO N 1 1 3 779 1 1 10 PRO O O 7.168 -20.856 2.332 1.00 . A A . 10 PRO O 1 1 3 780 1 1 11 TRP C C 5.641 -24.158 0.158 1.00 . A A . 11 TRP C 1 1 3 781 1 1 11 TRP CA C 5.722 -22.908 1.036 1.00 . A A . 11 TRP CA 1 1 3 782 1 1 11 TRP CB C 4.348 -22.251 1.285 1.00 . A A . 11 TRP CB 1 1 3 783 1 1 11 TRP CD1 C 3.726 -23.403 3.456 1.00 . A A . 11 TRP CD1 1 1 3 784 1 1 11 TRP CD2 C 2.010 -23.325 2.008 1.00 . A A . 11 TRP CD2 1 1 3 785 1 1 11 TRP CE2 C 1.514 -23.913 3.210 1.00 . A A . 11 TRP CE2 1 1 3 786 1 1 11 TRP CE3 C 1.088 -23.161 0.946 1.00 . A A . 11 TRP CE3 1 1 3 787 1 1 11 TRP CG C 3.416 -22.978 2.208 1.00 . A A . 11 TRP CG 1 1 3 788 1 1 11 TRP CH2 C -0.734 -24.057 2.311 1.00 . A A . 11 TRP CH2 1 1 3 789 1 1 11 TRP CZ2 C 0.165 -24.269 3.372 1.00 . A A . 11 TRP CZ2 1 1 3 790 1 1 11 TRP CZ3 C -0.268 -23.519 1.093 1.00 . A A . 11 TRP CZ3 1 1 3 791 1 1 11 TRP H H 6.816 -22.082 -0.550 1.00 . A A . 11 TRP H 1 1 3 792 1 1 11 TRP HA H 6.149 -23.215 1.994 1.00 . A A . 11 TRP HA 1 1 3 793 1 1 11 TRP HB2 H 4.481 -21.257 1.717 1.00 . A A . 11 TRP HB2 1 1 3 794 1 1 11 TRP HB3 H 3.841 -22.089 0.334 1.00 . A A . 11 TRP HB3 1 1 3 795 1 1 11 TRP HD1 H 4.689 -23.257 3.926 1.00 . A A . 11 TRP HD1 1 1 3 796 1 1 11 TRP HE1 H 2.598 -24.261 5.010 1.00 . A A . 11 TRP HE1 1 1 3 797 1 1 11 TRP HE3 H 1.421 -22.715 0.022 1.00 . A A . 11 TRP HE3 1 1 3 798 1 1 11 TRP HH2 H -1.782 -24.288 2.433 1.00 . A A . 11 TRP HH2 1 1 3 799 1 1 11 TRP HZ2 H -0.186 -24.674 4.309 1.00 . A A . 11 TRP HZ2 1 1 3 800 1 1 11 TRP HZ3 H -0.960 -23.345 0.281 1.00 . A A . 11 TRP HZ3 1 1 3 801 1 1 11 TRP N N 6.652 -21.961 0.441 1.00 . A A . 11 TRP N 1 1 3 802 1 1 11 TRP NE1 N 2.615 -23.980 4.037 1.00 . A A . 11 TRP NE1 1 1 3 803 1 1 11 TRP O O 5.888 -24.100 -1.048 1.00 . A A . 11 TRP O 1 1 3 804 1 1 12 ARG C C 3.714 -26.482 -0.711 1.00 . A A . 12 ARG C 1 1 3 805 1 1 12 ARG CA C 5.030 -26.558 0.085 1.00 . A A . 12 ARG CA 1 1 3 806 1 1 12 ARG CB C 5.014 -27.711 1.126 1.00 . A A . 12 ARG CB 1 1 3 807 1 1 12 ARG CD C 2.948 -28.397 2.561 1.00 . A A . 12 ARG CD 1 1 3 808 1 1 12 ARG CG C 4.199 -27.513 2.434 1.00 . A A . 12 ARG CG 1 1 3 809 1 1 12 ARG CZ C 0.486 -27.899 2.274 1.00 . A A . 12 ARG CZ 1 1 3 810 1 1 12 ARG H H 5.024 -25.221 1.739 1.00 . A A . 12 ARG H 1 1 3 811 1 1 12 ARG HA H 5.853 -26.740 -0.611 1.00 . A A . 12 ARG HA 1 1 3 812 1 1 12 ARG HB2 H 4.726 -28.641 0.635 1.00 . A A . 12 ARG HB2 1 1 3 813 1 1 12 ARG HB3 H 6.053 -27.876 1.419 1.00 . A A . 12 ARG HB3 1 1 3 814 1 1 12 ARG HD2 H 3.097 -29.387 2.127 1.00 . A A . 12 ARG HD2 1 1 3 815 1 1 12 ARG HD3 H 2.746 -28.547 3.622 1.00 . A A . 12 ARG HD3 1 1 3 816 1 1 12 ARG HE H 2.033 -27.105 1.189 1.00 . A A . 12 ARG HE 1 1 3 817 1 1 12 ARG HG2 H 4.855 -27.757 3.272 1.00 . A A . 12 ARG HG2 1 1 3 818 1 1 12 ARG HG3 H 3.929 -26.470 2.596 1.00 . A A . 12 ARG HG3 1 1 3 819 1 1 12 ARG HH11 H 0.784 -29.290 3.747 1.00 . A A . 12 ARG HH11 1 1 3 820 1 1 12 ARG HH12 H -0.864 -28.868 3.504 1.00 . A A . 12 ARG HH12 1 1 3 821 1 1 12 ARG HH21 H -0.125 -26.479 0.940 1.00 . A A . 12 ARG HH21 1 1 3 822 1 1 12 ARG HH22 H -1.415 -27.270 1.761 1.00 . A A . 12 ARG HH22 1 1 3 823 1 1 12 ARG N N 5.269 -25.290 0.763 1.00 . A A . 12 ARG N 1 1 3 824 1 1 12 ARG NE N 1.777 -27.740 1.964 1.00 . A A . 12 ARG NE 1 1 3 825 1 1 12 ARG NH1 N 0.103 -28.747 3.234 1.00 . A A . 12 ARG NH1 1 1 3 826 1 1 12 ARG NH2 N -0.420 -27.189 1.604 1.00 . A A . 12 ARG NH2 1 1 3 827 1 1 12 ARG O O 2.642 -26.323 -0.123 1.00 . A A . 12 ARG O 1 1 3 828 1 1 13 ARG C C 1.640 -27.545 -2.864 1.00 . A A . 13 ARG C 1 1 3 829 1 1 13 ARG CA C 2.695 -26.428 -2.993 1.00 . A A . 13 ARG CA 1 1 3 830 1 1 13 ARG CB C 3.280 -26.404 -4.432 1.00 . A A . 13 ARG CB 1 1 3 831 1 1 13 ARG CD C 2.922 -26.063 -6.957 1.00 . A A . 13 ARG CD 1 1 3 832 1 1 13 ARG CG C 2.271 -26.084 -5.560 1.00 . A A . 13 ARG CG 1 1 3 833 1 1 13 ARG CZ C 2.279 -25.303 -9.277 1.00 . A A . 13 ARG CZ 1 1 3 834 1 1 13 ARG H H 4.737 -26.632 -2.427 1.00 . A A . 13 ARG H 1 1 3 835 1 1 13 ARG HA H 2.208 -25.472 -2.781 1.00 . A A . 13 ARG HA 1 1 3 836 1 1 13 ARG HB2 H 4.077 -25.660 -4.470 1.00 . A A . 13 ARG HB2 1 1 3 837 1 1 13 ARG HB3 H 3.753 -27.365 -4.643 1.00 . A A . 13 ARG HB3 1 1 3 838 1 1 13 ARG HD2 H 3.789 -25.401 -6.945 1.00 . A A . 13 ARG HD2 1 1 3 839 1 1 13 ARG HD3 H 3.281 -27.059 -7.223 1.00 . A A . 13 ARG HD3 1 1 3 840 1 1 13 ARG HE H 1.020 -25.546 -7.684 1.00 . A A . 13 ARG HE 1 1 3 841 1 1 13 ARG HG2 H 1.464 -26.818 -5.562 1.00 . A A . 13 ARG HG2 1 1 3 842 1 1 13 ARG HG3 H 1.804 -25.119 -5.354 1.00 . A A . 13 ARG HG3 1 1 3 843 1 1 13 ARG HH11 H 4.250 -25.832 -9.150 1.00 . A A . 13 ARG HH11 1 1 3 844 1 1 13 ARG HH12 H 3.782 -25.264 -10.703 1.00 . A A . 13 ARG HH12 1 1 3 845 1 1 13 ARG HH21 H 0.374 -24.694 -9.780 1.00 . A A . 13 ARG HH21 1 1 3 846 1 1 13 ARG HH22 H 1.502 -24.622 -11.065 1.00 . A A . 13 ARG HH22 1 1 3 847 1 1 13 ARG N N 3.803 -26.597 -2.045 1.00 . A A . 13 ARG N 1 1 3 848 1 1 13 ARG NE N 1.984 -25.593 -7.998 1.00 . A A . 13 ARG NE 1 1 3 849 1 1 13 ARG NH1 N 3.520 -25.465 -9.745 1.00 . A A . 13 ARG NH1 1 1 3 850 1 1 13 ARG NH2 N 1.327 -24.844 -10.091 1.00 . A A . 13 ARG NH2 1 1 3 851 1 1 13 ARG O O 0.469 -27.325 -3.144 1.00 . A A . 13 ARG O 1 1 3 852 1 1 14 NH2 HN1 H 1.334 -29.472 -2.377 1.00 . A A . 14 NH2 HN1 1 1 3 853 1 1 14 NH2 HN2 H 2.993 -28.916 -2.219 1.00 . A A . 14 NH2 HN2 1 1 3 854 1 1 14 NH2 N N 2.029 -28.743 -2.443 1.00 . A A . 14 NH2 N 1 1 3 855 2 2 1 . C1 C 3.938 -15.292 -1.177 1.00 . B A . 101 BGC C1 1 1 3 856 2 2 1 . C2 C 3.885 -15.275 -2.712 1.00 . B A . 101 BGC C2 1 1 3 857 2 2 1 . C3 C 2.505 -14.790 -3.151 1.00 . B A . 101 BGC C3 1 1 3 858 2 2 1 . C4 C 1.408 -15.664 -2.538 1.00 . B A . 101 BGC C4 1 1 3 859 2 2 1 . C5 C 1.581 -15.714 -0.995 1.00 . B A . 101 BGC C5 1 1 3 860 2 2 1 . C6 C 0.642 -16.706 -0.292 1.00 . B A . 101 BGC C6 1 1 3 861 2 2 1 . H1 H 3.747 -14.297 -0.754 1.00 . B A . 101 BGC H1 1 1 3 862 2 2 1 . H2 H 4.059 -16.287 -3.081 1.00 . B A . 101 BGC H2 1 1 3 863 2 2 1 . H3 H 2.358 -13.764 -2.810 1.00 . B A . 101 BGC H3 1 1 3 864 2 2 1 . H4 H 1.495 -16.679 -2.936 1.00 . B A . 101 BGC H4 1 1 3 865 2 2 1 . H5 H 1.437 -14.721 -0.565 1.00 . B A . 101 BGC H5 1 1 3 866 2 2 1 . H6 H 2.015 -17.201 0.986 1.00 . B A . 101 BGC H6 1 1 3 867 2 2 1 . H6C1 H 0.629 -17.659 -0.821 1.00 . B A . 101 BGC H6C1 1 1 3 868 2 2 1 . H6C2 H -0.382 -16.331 -0.278 1.00 . B A . 101 BGC H6C2 1 1 3 869 2 2 1 . HB H 4.583 -14.306 -4.189 1.00 . B A . 101 BGC HB 1 1 3 870 2 2 1 . HC H 1.489 -14.563 -4.773 1.00 . B A . 101 BGC HC 1 1 3 871 2 2 1 . HD H -0.564 -15.724 -2.655 1.00 . B A . 101 BGC HD 1 1 3 872 2 2 1 . O2 O 4.870 -14.410 -3.266 1.00 . B A . 101 BGC O2 1 1 3 873 2 2 1 . O3 O 2.410 -14.804 -4.571 1.00 . B A . 101 BGC O3 1 1 3 874 2 2 1 . O4 O 0.148 -15.124 -2.927 1.00 . B A . 101 BGC O4 1 1 3 875 2 2 1 . O5 O 2.924 -16.152 -0.702 1.00 . B A . 101 BGC O5 1 1 3 876 2 2 1 . O6 O 1.084 -16.937 1.040 1.00 . B A . 101 BGC O6 1 1 4 877 1 1 1 ILE C C 10.334 3.455 -3.617 1.00 . A A . 1 ILE C 1 1 4 878 1 1 1 ILE CA C 10.920 4.859 -3.401 1.00 . A A . 1 ILE CA 1 1 4 879 1 1 1 ILE CB C 9.830 5.959 -3.220 1.00 . A A . 1 ILE CB 1 1 4 880 1 1 1 ILE CD1 C 10.701 8.093 -4.469 1.00 . A A . 1 ILE CD1 1 1 4 881 1 1 1 ILE CG1 C 10.419 7.393 -3.128 1.00 . A A . 1 ILE CG1 1 1 4 882 1 1 1 ILE CG2 C 8.934 5.710 -1.986 1.00 . A A . 1 ILE CG2 1 1 4 883 1 1 1 ILE H1 H 11.171 4.851 -5.376 1.00 . A A . 1 ILE H1 1 1 4 884 1 1 1 ILE HA H 11.573 4.848 -2.528 1.00 . A A . 1 ILE HA 1 1 4 885 1 1 1 ILE HB H 9.160 5.929 -4.082 1.00 . A A . 1 ILE HB 1 1 4 886 1 1 1 ILE HD11 H 10.899 9.153 -4.297 1.00 . A A . 1 ILE HD11 1 1 4 887 1 1 1 ILE HD12 H 11.570 7.708 -4.999 1.00 . A A . 1 ILE HD12 1 1 4 888 1 1 1 ILE HD13 H 9.839 8.042 -5.136 1.00 . A A . 1 ILE HD13 1 1 4 889 1 1 1 ILE HG12 H 9.702 8.033 -2.612 1.00 . A A . 1 ILE HG12 1 1 4 890 1 1 1 ILE HG13 H 11.306 7.410 -2.492 1.00 . A A . 1 ILE HG13 1 1 4 891 1 1 1 ILE HG21 H 8.181 6.493 -1.881 1.00 . A A . 1 ILE HG21 1 1 4 892 1 1 1 ILE HG22 H 8.378 4.776 -2.051 1.00 . A A . 1 ILE HG22 1 1 4 893 1 1 1 ILE HG23 H 9.513 5.698 -1.061 1.00 . A A . 1 ILE HG23 1 1 4 894 1 1 1 ILE N N 11.743 5.136 -4.590 1.00 . A A . 1 ILE N 1 1 4 895 1 1 1 ILE O O 10.179 3.083 -4.777 1.00 . A A . 1 ILE O 1 1 4 896 1 1 2 LEU C C 8.544 1.071 -1.466 1.00 . A A . 2 LEU C 1 1 4 897 1 1 2 LEU CA C 9.477 1.327 -2.669 1.00 . A A . 2 LEU CA 1 1 4 898 1 1 2 LEU CB C 10.616 0.287 -2.859 1.00 . A A . 2 LEU CB 1 1 4 899 1 1 2 LEU CD1 C 11.353 -1.748 -4.188 1.00 . A A . 2 LEU CD1 1 1 4 900 1 1 2 LEU CD2 C 9.625 -2.059 -2.399 1.00 . A A . 2 LEU CD2 1 1 4 901 1 1 2 LEU CG C 10.183 -1.082 -3.445 1.00 . A A . 2 LEU CG 1 1 4 902 1 1 2 LEU H H 10.165 3.030 -1.622 1.00 . A A . 2 LEU H 1 1 4 903 1 1 2 LEU HA H 8.882 1.277 -3.580 1.00 . A A . 2 LEU HA 1 1 4 904 1 1 2 LEU HB2 H 11.334 0.717 -3.558 1.00 . A A . 2 LEU HB2 1 1 4 905 1 1 2 LEU HB3 H 11.176 0.144 -1.934 1.00 . A A . 2 LEU HB3 1 1 4 906 1 1 2 LEU HD11 H 12.194 -1.948 -3.523 1.00 . A A . 2 LEU HD11 1 1 4 907 1 1 2 LEU HD12 H 11.716 -1.123 -5.005 1.00 . A A . 2 LEU HD12 1 1 4 908 1 1 2 LEU HD13 H 11.050 -2.699 -4.628 1.00 . A A . 2 LEU HD13 1 1 4 909 1 1 2 LEU HD21 H 8.737 -1.673 -1.900 1.00 . A A . 2 LEU HD21 1 1 4 910 1 1 2 LEU HD22 H 10.374 -2.307 -1.648 1.00 . A A . 2 LEU HD22 1 1 4 911 1 1 2 LEU HD23 H 9.321 -2.995 -2.872 1.00 . A A . 2 LEU HD23 1 1 4 912 1 1 2 LEU HG H 9.403 -0.909 -4.189 1.00 . A A . 2 LEU HG 1 1 4 913 1 1 2 LEU N N 10.046 2.677 -2.562 1.00 . A A . 2 LEU N 1 1 4 914 1 1 2 LEU O O 9.046 0.653 -0.412 1.00 . A A . 2 LEU O 1 1 4 915 1 1 3 PRO C C 5.932 -0.512 -0.541 1.00 . A A . 3 PRO C 1 1 4 916 1 1 3 PRO CA C 6.245 0.998 -0.528 1.00 . A A . 3 PRO CA 1 1 4 917 1 1 3 PRO CB C 5.003 1.830 -0.880 1.00 . A A . 3 PRO CB 1 1 4 918 1 1 3 PRO CD C 6.551 1.960 -2.723 1.00 . A A . 3 PRO CD 1 1 4 919 1 1 3 PRO CG C 5.056 1.973 -2.393 1.00 . A A . 3 PRO CG 1 1 4 920 1 1 3 PRO HA H 6.619 1.284 0.456 1.00 . A A . 3 PRO HA 1 1 4 921 1 1 3 PRO HB2 H 4.066 1.383 -0.541 1.00 . A A . 3 PRO HB2 1 1 4 922 1 1 3 PRO HB3 H 5.075 2.815 -0.416 1.00 . A A . 3 PRO HB3 1 1 4 923 1 1 3 PRO HD2 H 6.712 1.410 -3.650 1.00 . A A . 3 PRO HD2 1 1 4 924 1 1 3 PRO HD3 H 6.922 2.976 -2.861 1.00 . A A . 3 PRO HD3 1 1 4 925 1 1 3 PRO HG2 H 4.573 1.110 -2.855 1.00 . A A . 3 PRO HG2 1 1 4 926 1 1 3 PRO HG3 H 4.547 2.866 -2.756 1.00 . A A . 3 PRO HG3 1 1 4 927 1 1 3 PRO N N 7.221 1.331 -1.577 1.00 . A A . 3 PRO N 1 1 4 928 1 1 3 PRO O O 6.162 -1.176 -1.550 1.00 . A A . 3 PRO O 1 1 4 929 1 1 4 TRP C C 6.372 -3.344 0.955 1.00 . A A . 4 TRP C 1 1 4 930 1 1 4 TRP CA C 5.115 -2.458 0.827 1.00 . A A . 4 TRP CA 1 1 4 931 1 1 4 TRP CB C 4.079 -2.997 -0.186 1.00 . A A . 4 TRP CB 1 1 4 932 1 1 4 TRP CD1 C 2.490 -4.337 1.256 1.00 . A A . 4 TRP CD1 1 1 4 933 1 1 4 TRP CD2 C 3.454 -5.591 -0.341 1.00 . A A . 4 TRP CD2 1 1 4 934 1 1 4 TRP CE2 C 2.589 -6.452 0.399 1.00 . A A . 4 TRP CE2 1 1 4 935 1 1 4 TRP CE3 C 4.166 -6.170 -1.418 1.00 . A A . 4 TRP CE3 1 1 4 936 1 1 4 TRP CG C 3.367 -4.249 0.230 1.00 . A A . 4 TRP CG 1 1 4 937 1 1 4 TRP CH2 C 3.137 -8.350 -1.008 1.00 . A A . 4 TRP CH2 1 1 4 938 1 1 4 TRP CZ2 C 2.427 -7.812 0.080 1.00 . A A . 4 TRP CZ2 1 1 4 939 1 1 4 TRP CZ3 C 4.008 -7.531 -1.753 1.00 . A A . 4 TRP CZ3 1 1 4 940 1 1 4 TRP H H 5.265 -0.416 1.355 1.00 . A A . 4 TRP H 1 1 4 941 1 1 4 TRP HA H 4.637 -2.461 1.807 1.00 . A A . 4 TRP HA 1 1 4 942 1 1 4 TRP HB2 H 3.310 -2.245 -0.360 1.00 . A A . 4 TRP HB2 1 1 4 943 1 1 4 TRP HB3 H 4.542 -3.175 -1.157 1.00 . A A . 4 TRP HB3 1 1 4 944 1 1 4 TRP HD1 H 2.193 -3.509 1.883 1.00 . A A . 4 TRP HD1 1 1 4 945 1 1 4 TRP HE1 H 1.353 -5.927 2.049 1.00 . A A . 4 TRP HE1 1 1 4 946 1 1 4 TRP HE3 H 4.825 -5.552 -2.009 1.00 . A A . 4 TRP HE3 1 1 4 947 1 1 4 TRP HH2 H 3.017 -9.394 -1.264 1.00 . A A . 4 TRP HH2 1 1 4 948 1 1 4 TRP HZ2 H 1.763 -8.440 0.657 1.00 . A A . 4 TRP HZ2 1 1 4 949 1 1 4 TRP HZ3 H 4.549 -7.947 -2.590 1.00 . A A . 4 TRP HZ3 1 1 4 950 1 1 4 TRP N N 5.455 -1.046 0.592 1.00 . A A . 4 TRP N 1 1 4 951 1 1 4 TRP NE1 N 2.043 -5.637 1.368 1.00 . A A . 4 TRP NE1 1 1 4 952 1 1 4 TRP O O 7.460 -2.967 0.511 1.00 . A A . 4 TRP O 1 1 4 953 1 1 5 LYS C C 6.703 -6.816 2.194 1.00 . A A . 5 LYS C 1 1 4 954 1 1 5 LYS CA C 7.331 -5.476 1.802 1.00 . A A . 5 LYS CA 1 1 4 955 1 1 5 LYS CB C 8.412 -4.948 2.787 1.00 . A A . 5 LYS CB 1 1 4 956 1 1 5 LYS CD C 10.470 -3.350 2.726 1.00 . A A . 5 LYS CD 1 1 4 957 1 1 5 LYS CE C 9.832 -1.970 2.452 1.00 . A A . 5 LYS CE 1 1 4 958 1 1 5 LYS CG C 9.738 -4.556 2.097 1.00 . A A . 5 LYS CG 1 1 4 959 1 1 5 LYS H H 5.350 -4.820 1.924 1.00 . A A . 5 LYS H 1 1 4 960 1 1 5 LYS HA H 7.775 -5.648 0.820 1.00 . A A . 5 LYS HA 1 1 4 961 1 1 5 LYS HB2 H 8.009 -4.112 3.358 1.00 . A A . 5 LYS HB2 1 1 4 962 1 1 5 LYS HB3 H 8.633 -5.706 3.542 1.00 . A A . 5 LYS HB3 1 1 4 963 1 1 5 LYS HD2 H 10.552 -3.505 3.804 1.00 . A A . 5 LYS HD2 1 1 4 964 1 1 5 LYS HD3 H 11.499 -3.341 2.361 1.00 . A A . 5 LYS HD3 1 1 4 965 1 1 5 LYS HE2 H 8.847 -1.898 2.918 1.00 . A A . 5 LYS HE2 1 1 4 966 1 1 5 LYS HE3 H 10.448 -1.190 2.904 1.00 . A A . 5 LYS HE3 1 1 4 967 1 1 5 LYS HG2 H 10.400 -5.425 2.134 1.00 . A A . 5 LYS HG2 1 1 4 968 1 1 5 LYS HG3 H 9.590 -4.376 1.032 1.00 . A A . 5 LYS HG3 1 1 4 969 1 1 5 LYS HZ1 H 9.455 -0.727 0.807 1.00 . A A . 5 LYS HZ1 1 1 4 970 1 1 5 LYS HZ2 H 8.907 -2.257 0.665 1.00 . A A . 5 LYS HZ2 1 1 4 971 1 1 5 LYS HZ3 H 10.526 -1.946 0.501 1.00 . A A . 5 LYS HZ3 1 1 4 972 1 1 5 LYS N N 6.264 -4.496 1.618 1.00 . A A . 5 LYS N 1 1 4 973 1 1 5 LYS NZ N 9.696 -1.694 1.010 1.00 . A A . 5 LYS NZ 1 1 4 974 1 1 5 LYS O O 5.627 -6.834 2.790 1.00 . A A . 5 LYS O 1 1 4 975 1 1 6 TRP C C 8.076 -10.229 2.247 1.00 . A A . 6 TRP C 1 1 4 976 1 1 6 TRP CA C 6.876 -9.290 2.029 1.00 . A A . 6 TRP CA 1 1 4 977 1 1 6 TRP CB C 5.929 -9.663 0.863 1.00 . A A . 6 TRP CB 1 1 4 978 1 1 6 TRP CD1 C 3.878 -10.394 2.154 1.00 . A A . 6 TRP CD1 1 1 4 979 1 1 6 TRP CD2 C 4.456 -11.868 0.562 1.00 . A A . 6 TRP CD2 1 1 4 980 1 1 6 TRP CE2 C 3.290 -12.386 1.206 1.00 . A A . 6 TRP CE2 1 1 4 981 1 1 6 TRP CE3 C 4.990 -12.633 -0.501 1.00 . A A . 6 TRP CE3 1 1 4 982 1 1 6 TRP CG C 4.808 -10.601 1.195 1.00 . A A . 6 TRP CG 1 1 4 983 1 1 6 TRP CH2 C 3.260 -14.339 -0.235 1.00 . A A . 6 TRP CH2 1 1 4 984 1 1 6 TRP CZ2 C 2.693 -13.600 0.820 1.00 . A A . 6 TRP CZ2 1 1 4 985 1 1 6 TRP CZ3 C 4.408 -13.855 -0.891 1.00 . A A . 6 TRP CZ3 1 1 4 986 1 1 6 TRP H H 8.291 -7.857 1.458 1.00 . A A . 6 TRP H 1 1 4 987 1 1 6 TRP HA H 6.313 -9.312 2.963 1.00 . A A . 6 TRP HA 1 1 4 988 1 1 6 TRP HB2 H 5.446 -8.766 0.480 1.00 . A A . 6 TRP HB2 1 1 4 989 1 1 6 TRP HB3 H 6.495 -10.063 0.020 1.00 . A A . 6 TRP HB3 1 1 4 990 1 1 6 TRP HD1 H 3.844 -9.518 2.788 1.00 . A A . 6 TRP HD1 1 1 4 991 1 1 6 TRP HE1 H 2.192 -11.495 2.791 1.00 . A A . 6 TRP HE1 1 1 4 992 1 1 6 TRP HE3 H 5.867 -12.278 -1.023 1.00 . A A . 6 TRP HE3 1 1 4 993 1 1 6 TRP HH2 H 2.810 -15.271 -0.542 1.00 . A A . 6 TRP HH2 1 1 4 994 1 1 6 TRP HZ2 H 1.808 -13.959 1.323 1.00 . A A . 6 TRP HZ2 1 1 4 995 1 1 6 TRP HZ3 H 4.846 -14.416 -1.703 1.00 . A A . 6 TRP HZ3 1 1 4 996 1 1 6 TRP N N 7.363 -7.926 1.847 1.00 . A A . 6 TRP N 1 1 4 997 1 1 6 TRP NE1 N 2.987 -11.450 2.171 1.00 . A A . 6 TRP NE1 1 1 4 998 1 1 6 TRP O O 9.144 -9.769 2.658 1.00 . A A . 6 TRP O 1 1 4 999 1 1 7 LYS C C 8.820 -13.528 0.897 1.00 . A A . 7 LYS C 1 1 4 1000 1 1 7 LYS CA C 8.939 -12.569 2.093 1.00 . A A . 7 LYS CA 1 1 4 1001 1 1 7 LYS CB C 8.899 -13.263 3.479 1.00 . A A . 7 LYS CB 1 1 4 1002 1 1 7 LYS CD C 9.470 -13.107 5.981 1.00 . A A . 7 LYS CD 1 1 4 1003 1 1 7 LYS CE C 9.918 -12.179 7.125 1.00 . A A . 7 LYS CE 1 1 4 1004 1 1 7 LYS CG C 9.349 -12.360 4.644 1.00 . A A . 7 LYS CG 1 1 4 1005 1 1 7 LYS H H 7.052 -11.826 1.547 1.00 . A A . 7 LYS H 1 1 4 1006 1 1 7 LYS HA H 9.918 -12.103 1.969 1.00 . A A . 7 LYS HA 1 1 4 1007 1 1 7 LYS HB2 H 7.892 -13.645 3.664 1.00 . A A . 7 LYS HB2 1 1 4 1008 1 1 7 LYS HB3 H 9.545 -14.141 3.463 1.00 . A A . 7 LYS HB3 1 1 4 1009 1 1 7 LYS HD2 H 8.505 -13.560 6.221 1.00 . A A . 7 LYS HD2 1 1 4 1010 1 1 7 LYS HD3 H 10.180 -13.929 5.866 1.00 . A A . 7 LYS HD3 1 1 4 1011 1 1 7 LYS HE2 H 10.884 -11.728 6.883 1.00 . A A . 7 LYS HE2 1 1 4 1012 1 1 7 LYS HE3 H 9.209 -11.358 7.241 1.00 . A A . 7 LYS HE3 1 1 4 1013 1 1 7 LYS HG2 H 10.307 -11.902 4.390 1.00 . A A . 7 LYS HG2 1 1 4 1014 1 1 7 LYS HG3 H 8.641 -11.537 4.754 1.00 . A A . 7 LYS HG3 1 1 4 1015 1 1 7 LYS HZ1 H 9.140 -13.292 8.670 1.00 . A A . 7 LYS HZ1 1 1 4 1016 1 1 7 LYS HZ2 H 10.340 -12.267 9.132 1.00 . A A . 7 LYS HZ2 1 1 4 1017 1 1 7 LYS HZ3 H 10.713 -13.648 8.323 1.00 . A A . 7 LYS HZ3 1 1 4 1018 1 1 7 LYS N N 7.911 -11.531 1.997 1.00 . A A . 7 LYS N 1 1 4 1019 1 1 7 LYS NZ N 10.035 -12.903 8.407 1.00 . A A . 7 LYS NZ 1 1 4 1020 1 1 7 LYS O O 7.983 -13.319 0.024 1.00 . A A . 7 LYS O 1 1 4 1021 1 1 8 TRP C C 8.403 -16.421 -0.218 1.00 . A A . 8 TRP C 1 1 4 1022 1 1 8 TRP CA C 9.698 -15.590 -0.193 1.00 . A A . 8 TRP CA 1 1 4 1023 1 1 8 TRP CB C 10.899 -16.540 0.057 1.00 . A A . 8 TRP CB 1 1 4 1024 1 1 8 TRP CD1 C 12.319 -17.440 -1.840 1.00 . A A . 8 TRP CD1 1 1 4 1025 1 1 8 TRP CD2 C 13.028 -15.438 -1.112 1.00 . A A . 8 TRP CD2 1 1 4 1026 1 1 8 TRP CE2 C 13.923 -15.844 -2.151 1.00 . A A . 8 TRP CE2 1 1 4 1027 1 1 8 TRP CE3 C 13.300 -14.203 -0.479 1.00 . A A . 8 TRP CE3 1 1 4 1028 1 1 8 TRP CG C 12.018 -16.478 -0.938 1.00 . A A . 8 TRP CG 1 1 4 1029 1 1 8 TRP CH2 C 15.282 -13.856 -1.867 1.00 . A A . 8 TRP CH2 1 1 4 1030 1 1 8 TRP CZ2 C 15.036 -15.073 -2.527 1.00 . A A . 8 TRP CZ2 1 1 4 1031 1 1 8 TRP CZ3 C 14.415 -13.422 -0.846 1.00 . A A . 8 TRP CZ3 1 1 4 1032 1 1 8 TRP H H 10.276 -14.718 1.638 1.00 . A A . 8 TRP H 1 1 4 1033 1 1 8 TRP HA H 9.816 -15.082 -1.149 1.00 . A A . 8 TRP HA 1 1 4 1034 1 1 8 TRP HB2 H 11.331 -16.377 1.044 1.00 . A A . 8 TRP HB2 1 1 4 1035 1 1 8 TRP HB3 H 10.568 -17.582 0.079 1.00 . A A . 8 TRP HB3 1 1 4 1036 1 1 8 TRP HD1 H 11.775 -18.371 -1.939 1.00 . A A . 8 TRP HD1 1 1 4 1037 1 1 8 TRP HE1 H 13.893 -17.687 -3.220 1.00 . A A . 8 TRP HE1 1 1 4 1038 1 1 8 TRP HE3 H 12.648 -13.862 0.310 1.00 . A A . 8 TRP HE3 1 1 4 1039 1 1 8 TRP HH2 H 16.139 -13.257 -2.140 1.00 . A A . 8 TRP HH2 1 1 4 1040 1 1 8 TRP HZ2 H 15.702 -15.409 -3.310 1.00 . A A . 8 TRP HZ2 1 1 4 1041 1 1 8 TRP HZ3 H 14.611 -12.489 -0.340 1.00 . A A . 8 TRP HZ3 1 1 4 1042 1 1 8 TRP N N 9.665 -14.568 0.856 1.00 . A A . 8 TRP N 1 1 4 1043 1 1 8 TRP NE1 N 13.424 -17.057 -2.577 1.00 . A A . 8 TRP NE1 1 1 4 1044 1 1 8 TRP O O 7.903 -16.805 0.841 1.00 . A A . 8 TRP O 1 1 4 1045 1 1 9 THR C C 7.194 -19.147 -1.081 1.00 . A A . 9 THR C 1 1 4 1046 1 1 9 THR CA C 6.859 -17.744 -1.659 1.00 . A A . 9 THR CA 1 1 4 1047 1 1 9 THR CB C 6.445 -17.793 -3.161 1.00 . A A . 9 THR CB 1 1 4 1048 1 1 9 THR CG2 C 5.852 -16.479 -3.701 1.00 . A A . 9 THR CG2 1 1 4 1049 1 1 9 THR H H 8.327 -16.333 -2.238 1.00 . A A . 9 THR H 1 1 4 1050 1 1 9 THR HA H 6.004 -17.351 -1.114 1.00 . A A . 9 THR HA 1 1 4 1051 1 1 9 THR HB H 5.634 -18.520 -3.233 1.00 . A A . 9 THR HB 1 1 4 1052 1 1 9 THR HG21 H 5.629 -16.565 -4.765 1.00 . A A . 9 THR HG21 1 1 4 1053 1 1 9 THR HG22 H 6.517 -15.630 -3.565 1.00 . A A . 9 THR HG22 1 1 4 1054 1 1 9 THR HG23 H 4.918 -16.244 -3.191 1.00 . A A . 9 THR HG23 1 1 4 1055 1 1 9 THR N N 7.905 -16.744 -1.416 1.00 . A A . 9 THR N 1 1 4 1056 1 1 9 THR O O 8.359 -19.556 -1.136 1.00 . A A . 9 THR O 1 1 4 1057 1 1 9 THR OG1 O 7.463 -18.281 -4.070 1.00 . A A . 9 THR OG1 1 1 4 1058 1 1 10 PRO C C 6.611 -22.323 -0.868 1.00 . A A . 10 PRO C 1 1 4 1059 1 1 10 PRO CA C 6.469 -21.175 0.150 1.00 . A A . 10 PRO CA 1 1 4 1060 1 1 10 PRO CB C 5.243 -21.390 1.056 1.00 . A A . 10 PRO CB 1 1 4 1061 1 1 10 PRO CD C 4.815 -19.477 -0.339 1.00 . A A . 10 PRO CD 1 1 4 1062 1 1 10 PRO CG C 4.114 -20.641 0.363 1.00 . A A . 10 PRO CG 1 1 4 1063 1 1 10 PRO HA H 7.368 -21.117 0.767 1.00 . A A . 10 PRO HA 1 1 4 1064 1 1 10 PRO HB2 H 5.002 -22.442 1.222 1.00 . A A . 10 PRO HB2 1 1 4 1065 1 1 10 PRO HB3 H 5.431 -20.941 2.031 1.00 . A A . 10 PRO HB3 1 1 4 1066 1 1 10 PRO HD2 H 4.340 -19.247 -1.293 1.00 . A A . 10 PRO HD2 1 1 4 1067 1 1 10 PRO HD3 H 4.766 -18.590 0.295 1.00 . A A . 10 PRO HD3 1 1 4 1068 1 1 10 PRO HG2 H 3.646 -21.289 -0.381 1.00 . A A . 10 PRO HG2 1 1 4 1069 1 1 10 PRO HG3 H 3.334 -20.314 1.052 1.00 . A A . 10 PRO HG3 1 1 4 1070 1 1 10 PRO N N 6.215 -19.883 -0.503 1.00 . A A . 10 PRO N 1 1 4 1071 1 1 10 PRO O O 5.655 -22.679 -1.556 1.00 . A A . 10 PRO O 1 1 4 1072 1 1 11 TRP C C 7.447 -25.370 -1.390 1.00 . A A . 11 TRP C 1 1 4 1073 1 1 11 TRP CA C 8.130 -24.051 -1.814 1.00 . A A . 11 TRP CA 1 1 4 1074 1 1 11 TRP CB C 9.661 -24.245 -1.760 1.00 . A A . 11 TRP CB 1 1 4 1075 1 1 11 TRP CD1 C 10.614 -26.483 -2.494 1.00 . A A . 11 TRP CD1 1 1 4 1076 1 1 11 TRP CD2 C 10.582 -24.969 -4.153 1.00 . A A . 11 TRP CD2 1 1 4 1077 1 1 11 TRP CE2 C 11.151 -26.163 -4.692 1.00 . A A . 11 TRP CE2 1 1 4 1078 1 1 11 TRP CE3 C 10.473 -23.861 -5.025 1.00 . A A . 11 TRP CE3 1 1 4 1079 1 1 11 TRP CG C 10.251 -25.205 -2.751 1.00 . A A . 11 TRP CG 1 1 4 1080 1 1 11 TRP CH2 C 11.472 -25.129 -6.862 1.00 . A A . 11 TRP CH2 1 1 4 1081 1 1 11 TRP CZ2 C 11.592 -26.253 -6.024 1.00 . A A . 11 TRP CZ2 1 1 4 1082 1 1 11 TRP CZ3 C 10.912 -23.936 -6.363 1.00 . A A . 11 TRP CZ3 1 1 4 1083 1 1 11 TRP H H 8.553 -22.520 -0.399 1.00 . A A . 11 TRP H 1 1 4 1084 1 1 11 TRP HA H 7.824 -23.798 -2.831 1.00 . A A . 11 TRP HA 1 1 4 1085 1 1 11 TRP HB2 H 10.156 -23.288 -1.930 1.00 . A A . 11 TRP HB2 1 1 4 1086 1 1 11 TRP HB3 H 9.963 -24.560 -0.761 1.00 . A A . 11 TRP HB3 1 1 4 1087 1 1 11 TRP HD1 H 10.507 -26.967 -1.533 1.00 . A A . 11 TRP HD1 1 1 4 1088 1 1 11 TRP HE1 H 11.495 -27.998 -3.674 1.00 . A A . 11 TRP HE1 1 1 4 1089 1 1 11 TRP HE3 H 10.052 -22.936 -4.654 1.00 . A A . 11 TRP HE3 1 1 4 1090 1 1 11 TRP HH2 H 11.812 -25.180 -7.885 1.00 . A A . 11 TRP HH2 1 1 4 1091 1 1 11 TRP HZ2 H 12.025 -27.167 -6.401 1.00 . A A . 11 TRP HZ2 1 1 4 1092 1 1 11 TRP HZ3 H 10.823 -23.074 -7.006 1.00 . A A . 11 TRP HZ3 1 1 4 1093 1 1 11 TRP N N 7.797 -22.943 -0.915 1.00 . A A . 11 TRP N 1 1 4 1094 1 1 11 TRP NE1 N 11.136 -27.053 -3.638 1.00 . A A . 11 TRP NE1 1 1 4 1095 1 1 11 TRP O O 7.092 -26.196 -2.230 1.00 . A A . 11 TRP O 1 1 4 1096 1 1 12 ARG C C 5.131 -26.660 0.341 1.00 . A A . 12 ARG C 1 1 4 1097 1 1 12 ARG CA C 6.658 -26.807 0.450 1.00 . A A . 12 ARG CA 1 1 4 1098 1 1 12 ARG CB C 7.089 -27.014 1.927 1.00 . A A . 12 ARG CB 1 1 4 1099 1 1 12 ARG CD C 5.460 -28.989 2.526 1.00 . A A . 12 ARG CD 1 1 4 1100 1 1 12 ARG CG C 6.907 -28.452 2.471 1.00 . A A . 12 ARG CG 1 1 4 1101 1 1 12 ARG CZ C 4.490 -31.266 3.004 1.00 . A A . 12 ARG CZ 1 1 4 1102 1 1 12 ARG H H 7.457 -24.822 0.550 1.00 . A A . 12 ARG H 1 1 4 1103 1 1 12 ARG HA H 6.997 -27.664 -0.136 1.00 . A A . 12 ARG HA 1 1 4 1104 1 1 12 ARG HB2 H 8.151 -26.777 2.008 1.00 . A A . 12 ARG HB2 1 1 4 1105 1 1 12 ARG HB3 H 6.592 -26.302 2.589 1.00 . A A . 12 ARG HB3 1 1 4 1106 1 1 12 ARG HD2 H 4.800 -28.282 3.034 1.00 . A A . 12 ARG HD2 1 1 4 1107 1 1 12 ARG HD3 H 5.087 -29.117 1.513 1.00 . A A . 12 ARG HD3 1 1 4 1108 1 1 12 ARG HE H 6.074 -30.388 3.952 1.00 . A A . 12 ARG HE 1 1 4 1109 1 1 12 ARG HG2 H 7.516 -29.131 1.870 1.00 . A A . 12 ARG HG2 1 1 4 1110 1 1 12 ARG HG3 H 7.336 -28.483 3.474 1.00 . A A . 12 ARG HG3 1 1 4 1111 1 1 12 ARG HH11 H 3.399 -30.301 1.513 1.00 . A A . 12 ARG HH11 1 1 4 1112 1 1 12 ARG HH12 H 2.826 -31.858 1.926 1.00 . A A . 12 ARG HH12 1 1 4 1113 1 1 12 ARG HH21 H 5.306 -32.535 4.401 1.00 . A A . 12 ARG HH21 1 1 4 1114 1 1 12 ARG HH22 H 3.918 -33.153 3.615 1.00 . A A . 12 ARG HH22 1 1 4 1115 1 1 12 ARG N N 7.254 -25.584 -0.079 1.00 . A A . 12 ARG N 1 1 4 1116 1 1 12 ARG NE N 5.390 -30.292 3.211 1.00 . A A . 12 ARG NE 1 1 4 1117 1 1 12 ARG NH1 N 3.513 -31.140 2.099 1.00 . A A . 12 ARG NH1 1 1 4 1118 1 1 12 ARG NH2 N 4.573 -32.389 3.720 1.00 . A A . 12 ARG NH2 1 1 4 1119 1 1 12 ARG O O 4.476 -26.148 1.247 1.00 . A A . 12 ARG O 1 1 4 1120 1 1 13 ARG C C 2.413 -28.034 0.062 1.00 . A A . 13 ARG C 1 1 4 1121 1 1 13 ARG CA C 3.146 -27.244 -1.044 1.00 . A A . 13 ARG CA 1 1 4 1122 1 1 13 ARG CB C 2.960 -27.884 -2.439 1.00 . A A . 13 ARG CB 1 1 4 1123 1 1 13 ARG CD C 1.419 -28.433 -4.396 1.00 . A A . 13 ARG CD 1 1 4 1124 1 1 13 ARG CG C 1.508 -27.912 -2.952 1.00 . A A . 13 ARG CG 1 1 4 1125 1 1 13 ARG CZ C -0.290 -28.161 -6.235 1.00 . A A . 13 ARG CZ 1 1 4 1126 1 1 13 ARG H H 5.224 -27.432 -1.493 1.00 . A A . 13 ARG H 1 1 4 1127 1 1 13 ARG HA H 2.767 -26.220 -1.072 1.00 . A A . 13 ARG HA 1 1 4 1128 1 1 13 ARG HB2 H 3.566 -27.326 -3.154 1.00 . A A . 13 ARG HB2 1 1 4 1129 1 1 13 ARG HB3 H 3.359 -28.902 -2.432 1.00 . A A . 13 ARG HB3 1 1 4 1130 1 1 13 ARG HD2 H 2.124 -27.874 -5.011 1.00 . A A . 13 ARG HD2 1 1 4 1131 1 1 13 ARG HD3 H 1.719 -29.482 -4.445 1.00 . A A . 13 ARG HD3 1 1 4 1132 1 1 13 ARG HE H -0.667 -28.336 -4.239 1.00 . A A . 13 ARG HE 1 1 4 1133 1 1 13 ARG HG2 H 0.893 -28.533 -2.297 1.00 . A A . 13 ARG HG2 1 1 4 1134 1 1 13 ARG HG3 H 1.096 -26.901 -2.903 1.00 . A A . 13 ARG HG3 1 1 4 1135 1 1 13 ARG HH11 H 1.614 -28.291 -6.966 1.00 . A A . 13 ARG HH11 1 1 4 1136 1 1 13 ARG HH12 H 0.421 -28.085 -8.180 1.00 . A A . 13 ARG HH12 1 1 4 1137 1 1 13 ARG HH21 H -2.323 -28.015 -5.880 1.00 . A A . 13 ARG HH21 1 1 4 1138 1 1 13 ARG HH22 H -1.880 -27.929 -7.526 1.00 . A A . 13 ARG HH22 1 1 4 1139 1 1 13 ARG N N 4.575 -27.166 -0.763 1.00 . A A . 13 ARG N 1 1 4 1140 1 1 13 ARG NE N 0.056 -28.284 -4.944 1.00 . A A . 13 ARG NE 1 1 4 1141 1 1 13 ARG NH1 N 0.638 -28.176 -7.195 1.00 . A A . 13 ARG NH1 1 1 4 1142 1 1 13 ARG NH2 N -1.578 -28.027 -6.565 1.00 . A A . 13 ARG NH2 1 1 4 1143 1 1 13 ARG O O 2.712 -29.200 0.319 1.00 . A A . 13 ARG O 1 1 4 1144 1 1 14 NH2 HN1 H 1.004 -27.866 1.507 1.00 . A A . 14 NH2 HN1 1 1 4 1145 1 1 14 NH2 HN2 H 1.347 -26.406 0.613 1.00 . A A . 14 NH2 HN2 1 1 4 1146 1 1 14 NH2 N N 1.470 -27.399 0.746 1.00 . A A . 14 NH2 N 1 1 4 1147 2 2 1 . C1 C 8.766 -17.730 -4.091 1.00 . B A . 101 BGC C1 1 1 4 1148 2 2 1 . C2 C 9.548 -18.326 -5.282 1.00 . B A . 101 BGC C2 1 1 4 1149 2 2 1 . C3 C 10.967 -17.750 -5.304 1.00 . B A . 101 BGC C3 1 1 4 1150 2 2 1 . C4 C 10.935 -16.221 -5.295 1.00 . B A . 101 BGC C4 1 1 4 1151 2 2 1 . C5 C 10.069 -15.695 -4.131 1.00 . B A . 101 BGC C5 1 1 4 1152 2 2 1 . C6 C 9.844 -14.176 -4.184 1.00 . B A . 101 BGC C6 1 1 4 1153 2 2 1 . H1 H 9.247 -18.011 -3.143 1.00 . B A . 101 BGC H1 1 1 4 1154 2 2 1 . H2 H 9.023 -18.069 -6.204 1.00 . B A . 101 BGC H2 1 1 4 1155 2 2 1 . H3 H 11.498 -18.102 -4.419 1.00 . B A . 101 BGC H3 1 1 4 1156 2 2 1 . H4 H 10.497 -15.874 -6.233 1.00 . B A . 101 BGC H4 1 1 4 1157 2 2 1 . H5 H 10.530 -15.951 -3.181 1.00 . B A . 101 BGC H5 1 1 4 1158 2 2 1 . H6 H 8.038 -14.072 -3.455 1.00 . B A . 101 BGC H6 1 1 4 1159 2 2 1 . H6C1 H 9.465 -13.876 -5.162 1.00 . B A . 101 BGC H6C1 1 1 4 1160 2 2 1 . H6C2 H 10.788 -13.646 -4.038 1.00 . B A . 101 BGC H6C2 1 1 4 1161 2 2 1 . HB H 10.198 -20.024 -5.906 1.00 . B A . 101 BGC HB 1 1 4 1162 2 2 1 . HC H 12.435 -17.604 -6.559 1.00 . B A . 101 BGC HC 1 1 4 1163 2 2 1 . HD H 12.617 -15.917 -4.319 1.00 . B A . 101 BGC HD 1 1 4 1164 2 2 1 . O2 O 9.631 -19.741 -5.171 1.00 . B A . 101 BGC O2 1 1 4 1165 2 2 1 . O3 O 11.675 -18.201 -6.456 1.00 . B A . 101 BGC O3 1 1 4 1166 2 2 1 . O4 O 12.272 -15.727 -5.210 1.00 . B A . 101 BGC O4 1 1 4 1167 2 2 1 . O5 O 8.775 -16.317 -4.187 1.00 . B A . 101 BGC O5 1 1 4 1168 2 2 1 . O6 O 8.917 -13.766 -3.187 1.00 . B A . 101 BGC O6 1 1 5 1169 1 1 1 ILE C C 4.604 3.275 -3.805 1.00 . A A . 1 ILE C 1 1 5 1170 1 1 1 ILE CA C 3.601 3.562 -4.929 1.00 . A A . 1 ILE CA 1 1 5 1171 1 1 1 ILE CB C 4.151 3.256 -6.356 1.00 . A A . 1 ILE CB 1 1 5 1172 1 1 1 ILE CD1 C 4.529 1.362 -8.072 1.00 . A A . 1 ILE CD1 1 1 5 1173 1 1 1 ILE CG1 C 4.372 1.743 -6.593 1.00 . A A . 1 ILE CG1 1 1 5 1174 1 1 1 ILE CG2 C 5.418 4.068 -6.713 1.00 . A A . 1 ILE CG2 1 1 5 1175 1 1 1 ILE H1 H 2.741 5.126 -3.941 1.00 . A A . 1 ILE H1 1 1 5 1176 1 1 1 ILE HA H 2.698 2.974 -4.755 1.00 . A A . 1 ILE HA 1 1 5 1177 1 1 1 ILE HB H 3.372 3.561 -7.058 1.00 . A A . 1 ILE HB 1 1 5 1178 1 1 1 ILE HD11 H 5.431 1.789 -8.512 1.00 . A A . 1 ILE HD11 1 1 5 1179 1 1 1 ILE HD12 H 4.604 0.279 -8.185 1.00 . A A . 1 ILE HD12 1 1 5 1180 1 1 1 ILE HD13 H 3.677 1.691 -8.668 1.00 . A A . 1 ILE HD13 1 1 5 1181 1 1 1 ILE HG12 H 5.248 1.391 -6.045 1.00 . A A . 1 ILE HG12 1 1 5 1182 1 1 1 ILE HG13 H 3.523 1.182 -6.198 1.00 . A A . 1 ILE HG13 1 1 5 1183 1 1 1 ILE HG21 H 5.693 3.934 -7.760 1.00 . A A . 1 ILE HG21 1 1 5 1184 1 1 1 ILE HG22 H 5.285 5.140 -6.573 1.00 . A A . 1 ILE HG22 1 1 5 1185 1 1 1 ILE HG23 H 6.281 3.762 -6.118 1.00 . A A . 1 ILE HG23 1 1 5 1186 1 1 1 ILE N N 3.233 4.984 -4.811 1.00 . A A . 1 ILE N 1 1 5 1187 1 1 1 ILE O O 5.251 4.220 -3.359 1.00 . A A . 1 ILE O 1 1 5 1188 1 1 2 LEU C C 6.778 0.818 -3.139 1.00 . A A . 2 LEU C 1 1 5 1189 1 1 2 LEU CA C 5.697 1.589 -2.351 1.00 . A A . 2 LEU CA 1 1 5 1190 1 1 2 LEU CB C 4.936 0.662 -1.360 1.00 . A A . 2 LEU CB 1 1 5 1191 1 1 2 LEU CD1 C 6.523 -1.078 -0.305 1.00 . A A . 2 LEU CD1 1 1 5 1192 1 1 2 LEU CD2 C 6.470 1.291 0.625 1.00 . A A . 2 LEU CD2 1 1 5 1193 1 1 2 LEU CG C 5.675 0.184 -0.085 1.00 . A A . 2 LEU CG 1 1 5 1194 1 1 2 LEU H H 4.232 1.271 -3.809 1.00 . A A . 2 LEU H 1 1 5 1195 1 1 2 LEU HA H 6.104 2.439 -1.806 1.00 . A A . 2 LEU HA 1 1 5 1196 1 1 2 LEU HB2 H 4.059 1.212 -1.015 1.00 . A A . 2 LEU HB2 1 1 5 1197 1 1 2 LEU HB3 H 4.533 -0.208 -1.883 1.00 . A A . 2 LEU HB3 1 1 5 1198 1 1 2 LEU HD11 H 5.935 -1.887 -0.738 1.00 . A A . 2 LEU HD11 1 1 5 1199 1 1 2 LEU HD12 H 6.936 -1.440 0.638 1.00 . A A . 2 LEU HD12 1 1 5 1200 1 1 2 LEU HD13 H 7.363 -0.895 -0.969 1.00 . A A . 2 LEU HD13 1 1 5 1201 1 1 2 LEU HD21 H 6.811 0.957 1.605 1.00 . A A . 2 LEU HD21 1 1 5 1202 1 1 2 LEU HD22 H 5.863 2.183 0.781 1.00 . A A . 2 LEU HD22 1 1 5 1203 1 1 2 LEU HD23 H 7.359 1.578 0.062 1.00 . A A . 2 LEU HD23 1 1 5 1204 1 1 2 LEU HG H 4.891 -0.117 0.612 1.00 . A A . 2 LEU HG 1 1 5 1205 1 1 2 LEU N N 4.719 2.026 -3.347 1.00 . A A . 2 LEU N 1 1 5 1206 1 1 2 LEU O O 6.434 -0.209 -3.731 1.00 . A A . 2 LEU O 1 1 5 1207 1 1 3 PRO C C 9.755 -0.455 -2.965 1.00 . A A . 3 PRO C 1 1 5 1208 1 1 3 PRO CA C 9.128 0.594 -3.905 1.00 . A A . 3 PRO CA 1 1 5 1209 1 1 3 PRO CB C 10.147 1.693 -4.243 1.00 . A A . 3 PRO CB 1 1 5 1210 1 1 3 PRO CD C 8.475 2.638 -2.791 1.00 . A A . 3 PRO CD 1 1 5 1211 1 1 3 PRO CG C 9.962 2.729 -3.143 1.00 . A A . 3 PRO CG 1 1 5 1212 1 1 3 PRO HA H 8.779 0.105 -4.817 1.00 . A A . 3 PRO HA 1 1 5 1213 1 1 3 PRO HB2 H 11.176 1.334 -4.306 1.00 . A A . 3 PRO HB2 1 1 5 1214 1 1 3 PRO HB3 H 9.899 2.136 -5.208 1.00 . A A . 3 PRO HB3 1 1 5 1215 1 1 3 PRO HD2 H 8.334 2.781 -1.719 1.00 . A A . 3 PRO HD2 1 1 5 1216 1 1 3 PRO HD3 H 7.912 3.410 -3.317 1.00 . A A . 3 PRO HD3 1 1 5 1217 1 1 3 PRO HG2 H 10.562 2.450 -2.275 1.00 . A A . 3 PRO HG2 1 1 5 1218 1 1 3 PRO HG3 H 10.268 3.732 -3.445 1.00 . A A . 3 PRO HG3 1 1 5 1219 1 1 3 PRO N N 8.032 1.313 -3.238 1.00 . A A . 3 PRO N 1 1 5 1220 1 1 3 PRO O O 9.659 -0.332 -1.746 1.00 . A A . 3 PRO O 1 1 5 1221 1 1 4 TRP C C 10.045 -3.733 -2.581 1.00 . A A . 4 TRP C 1 1 5 1222 1 1 4 TRP CA C 11.061 -2.608 -2.878 1.00 . A A . 4 TRP CA 1 1 5 1223 1 1 4 TRP CB C 11.942 -2.188 -1.673 1.00 . A A . 4 TRP CB 1 1 5 1224 1 1 4 TRP CD1 C 13.067 -3.940 -0.223 1.00 . A A . 4 TRP CD1 1 1 5 1225 1 1 4 TRP CD2 C 14.316 -3.349 -1.995 1.00 . A A . 4 TRP CD2 1 1 5 1226 1 1 4 TRP CE2 C 15.058 -4.332 -1.272 1.00 . A A . 4 TRP CE2 1 1 5 1227 1 1 4 TRP CE3 C 14.924 -2.809 -3.153 1.00 . A A . 4 TRP CE3 1 1 5 1228 1 1 4 TRP CG C 13.049 -3.127 -1.303 1.00 . A A . 4 TRP CG 1 1 5 1229 1 1 4 TRP CH2 C 16.911 -4.198 -2.832 1.00 . A A . 4 TRP CH2 1 1 5 1230 1 1 4 TRP CZ2 C 16.336 -4.756 -1.676 1.00 . A A . 4 TRP CZ2 1 1 5 1231 1 1 4 TRP CZ3 C 16.206 -3.226 -3.568 1.00 . A A . 4 TRP CZ3 1 1 5 1232 1 1 4 TRP H H 10.416 -1.484 -4.551 1.00 . A A . 4 TRP H 1 1 5 1233 1 1 4 TRP HA H 11.735 -3.012 -3.634 1.00 . A A . 4 TRP HA 1 1 5 1234 1 1 4 TRP HB2 H 12.414 -1.226 -1.873 1.00 . A A . 4 TRP HB2 1 1 5 1235 1 1 4 TRP HB3 H 11.318 -2.032 -0.791 1.00 . A A . 4 TRP HB3 1 1 5 1236 1 1 4 TRP HD1 H 12.275 -4.002 0.510 1.00 . A A . 4 TRP HD1 1 1 5 1237 1 1 4 TRP HE1 H 14.483 -5.323 0.515 1.00 . A A . 4 TRP HE1 1 1 5 1238 1 1 4 TRP HE3 H 14.405 -2.051 -3.720 1.00 . A A . 4 TRP HE3 1 1 5 1239 1 1 4 TRP HH2 H 17.897 -4.508 -3.148 1.00 . A A . 4 TRP HH2 1 1 5 1240 1 1 4 TRP HZ2 H 16.879 -5.493 -1.104 1.00 . A A . 4 TRP HZ2 1 1 5 1241 1 1 4 TRP HZ3 H 16.655 -2.791 -4.450 1.00 . A A . 4 TRP HZ3 1 1 5 1242 1 1 4 TRP N N 10.416 -1.467 -3.546 1.00 . A A . 4 TRP N 1 1 5 1243 1 1 4 TRP NE1 N 14.241 -4.665 -0.213 1.00 . A A . 4 TRP NE1 1 1 5 1244 1 1 4 TRP O O 8.855 -3.600 -2.872 1.00 . A A . 4 TRP O 1 1 5 1245 1 1 5 LYS C C 10.606 -6.920 -0.743 1.00 . A A . 5 LYS C 1 1 5 1246 1 1 5 LYS CA C 9.701 -5.973 -1.537 1.00 . A A . 5 LYS CA 1 1 5 1247 1 1 5 LYS CB C 8.925 -6.699 -2.670 1.00 . A A . 5 LYS CB 1 1 5 1248 1 1 5 LYS CD C 9.003 -7.729 -5.041 1.00 . A A . 5 LYS CD 1 1 5 1249 1 1 5 LYS CE C 8.455 -6.573 -5.899 1.00 . A A . 5 LYS CE 1 1 5 1250 1 1 5 LYS CG C 9.802 -7.247 -3.819 1.00 . A A . 5 LYS CG 1 1 5 1251 1 1 5 LYS H H 11.503 -4.944 -1.851 1.00 . A A . 5 LYS H 1 1 5 1252 1 1 5 LYS HA H 8.976 -5.545 -0.842 1.00 . A A . 5 LYS HA 1 1 5 1253 1 1 5 LYS HB2 H 8.357 -7.524 -2.236 1.00 . A A . 5 LYS HB2 1 1 5 1254 1 1 5 LYS HB3 H 8.172 -6.019 -3.064 1.00 . A A . 5 LYS HB3 1 1 5 1255 1 1 5 LYS HD2 H 9.669 -8.344 -5.649 1.00 . A A . 5 LYS HD2 1 1 5 1256 1 1 5 LYS HD3 H 8.198 -8.388 -4.711 1.00 . A A . 5 LYS HD3 1 1 5 1257 1 1 5 LYS HE2 H 7.748 -5.972 -5.327 1.00 . A A . 5 LYS HE2 1 1 5 1258 1 1 5 LYS HE3 H 9.268 -5.905 -6.190 1.00 . A A . 5 LYS HE3 1 1 5 1259 1 1 5 LYS HG2 H 10.530 -6.498 -4.137 1.00 . A A . 5 LYS HG2 1 1 5 1260 1 1 5 LYS HG3 H 10.397 -8.078 -3.436 1.00 . A A . 5 LYS HG3 1 1 5 1261 1 1 5 LYS HZ1 H 7.020 -7.678 -6.874 1.00 . A A . 5 LYS HZ1 1 1 5 1262 1 1 5 LYS HZ2 H 8.446 -7.576 -7.691 1.00 . A A . 5 LYS HZ2 1 1 5 1263 1 1 5 LYS HZ3 H 7.429 -6.288 -7.652 1.00 . A A . 5 LYS HZ3 1 1 5 1264 1 1 5 LYS N N 10.509 -4.868 -2.045 1.00 . A A . 5 LYS N 1 1 5 1265 1 1 5 LYS NZ N 7.787 -7.068 -7.118 1.00 . A A . 5 LYS NZ 1 1 5 1266 1 1 5 LYS O O 11.722 -7.191 -1.178 1.00 . A A . 5 LYS O 1 1 5 1267 1 1 6 TRP C C 9.746 -9.345 1.909 1.00 . A A . 6 TRP C 1 1 5 1268 1 1 6 TRP CA C 10.783 -8.528 1.126 1.00 . A A . 6 TRP CA 1 1 5 1269 1 1 6 TRP CB C 11.944 -8.008 1.998 1.00 . A A . 6 TRP CB 1 1 5 1270 1 1 6 TRP CD1 C 13.932 -9.570 1.876 1.00 . A A . 6 TRP CD1 1 1 5 1271 1 1 6 TRP CD2 C 12.744 -9.850 3.763 1.00 . A A . 6 TRP CD2 1 1 5 1272 1 1 6 TRP CE2 C 13.809 -10.802 3.797 1.00 . A A . 6 TRP CE2 1 1 5 1273 1 1 6 TRP CE3 C 11.863 -9.837 4.871 1.00 . A A . 6 TRP CE3 1 1 5 1274 1 1 6 TRP CG C 12.845 -9.088 2.520 1.00 . A A . 6 TRP CG 1 1 5 1275 1 1 6 TRP CH2 C 13.088 -11.660 5.948 1.00 . A A . 6 TRP CH2 1 1 5 1276 1 1 6 TRP CZ2 C 13.985 -11.699 4.864 1.00 . A A . 6 TRP CZ2 1 1 5 1277 1 1 6 TRP CZ3 C 12.030 -10.729 5.950 1.00 . A A . 6 TRP CZ3 1 1 5 1278 1 1 6 TRP H H 9.216 -7.176 0.719 1.00 . A A . 6 TRP H 1 1 5 1279 1 1 6 TRP HA H 11.219 -9.199 0.381 1.00 . A A . 6 TRP HA 1 1 5 1280 1 1 6 TRP HB2 H 12.567 -7.333 1.411 1.00 . A A . 6 TRP HB2 1 1 5 1281 1 1 6 TRP HB3 H 11.571 -7.420 2.837 1.00 . A A . 6 TRP HB3 1 1 5 1282 1 1 6 TRP HD1 H 14.282 -9.214 0.917 1.00 . A A . 6 TRP HD1 1 1 5 1283 1 1 6 TRP HE1 H 15.344 -11.062 2.345 1.00 . A A . 6 TRP HE1 1 1 5 1284 1 1 6 TRP HE3 H 11.057 -9.120 4.895 1.00 . A A . 6 TRP HE3 1 1 5 1285 1 1 6 TRP HH2 H 13.220 -12.336 6.781 1.00 . A A . 6 TRP HH2 1 1 5 1286 1 1 6 TRP HZ2 H 14.804 -12.403 4.863 1.00 . A A . 6 TRP HZ2 1 1 5 1287 1 1 6 TRP HZ3 H 11.354 -10.692 6.793 1.00 . A A . 6 TRP HZ3 1 1 5 1288 1 1 6 TRP N N 10.125 -7.455 0.386 1.00 . A A . 6 TRP N 1 1 5 1289 1 1 6 TRP NE1 N 14.498 -10.581 2.624 1.00 . A A . 6 TRP NE1 1 1 5 1290 1 1 6 TRP O O 8.843 -8.773 2.534 1.00 . A A . 6 TRP O 1 1 5 1291 1 1 7 LYS C C 9.271 -12.963 1.506 1.00 . A A . 7 LYS C 1 1 5 1292 1 1 7 LYS CA C 9.218 -11.798 2.507 1.00 . A A . 7 LYS CA 1 1 5 1293 1 1 7 LYS CB C 7.751 -11.520 2.929 1.00 . A A . 7 LYS CB 1 1 5 1294 1 1 7 LYS CD C 5.430 -10.552 2.345 1.00 . A A . 7 LYS CD 1 1 5 1295 1 1 7 LYS CE C 5.413 -9.027 2.567 1.00 . A A . 7 LYS CE 1 1 5 1296 1 1 7 LYS CG C 6.762 -11.115 1.810 1.00 . A A . 7 LYS CG 1 1 5 1297 1 1 7 LYS H H 10.610 -11.000 1.215 1.00 . A A . 7 LYS H 1 1 5 1298 1 1 7 LYS HA H 9.808 -12.067 3.385 1.00 . A A . 7 LYS HA 1 1 5 1299 1 1 7 LYS HB2 H 7.358 -12.419 3.410 1.00 . A A . 7 LYS HB2 1 1 5 1300 1 1 7 LYS HB3 H 7.773 -10.782 3.727 1.00 . A A . 7 LYS HB3 1 1 5 1301 1 1 7 LYS HD2 H 4.657 -10.779 1.607 1.00 . A A . 7 LYS HD2 1 1 5 1302 1 1 7 LYS HD3 H 5.124 -11.087 3.245 1.00 . A A . 7 LYS HD3 1 1 5 1303 1 1 7 LYS HE2 H 5.629 -8.508 1.631 1.00 . A A . 7 LYS HE2 1 1 5 1304 1 1 7 LYS HE3 H 4.412 -8.717 2.871 1.00 . A A . 7 LYS HE3 1 1 5 1305 1 1 7 LYS HG2 H 7.211 -10.412 1.107 1.00 . A A . 7 LYS HG2 1 1 5 1306 1 1 7 LYS HG3 H 6.548 -12.006 1.215 1.00 . A A . 7 LYS HG3 1 1 5 1307 1 1 7 LYS HZ1 H 6.270 -7.598 3.780 1.00 . A A . 7 LYS HZ1 1 1 5 1308 1 1 7 LYS HZ2 H 7.329 -8.737 3.245 1.00 . A A . 7 LYS HZ2 1 1 5 1309 1 1 7 LYS HZ3 H 6.252 -9.102 4.450 1.00 . A A . 7 LYS HZ3 1 1 5 1310 1 1 7 LYS N N 9.894 -10.671 1.853 1.00 . A A . 7 LYS N 1 1 5 1311 1 1 7 LYS NZ N 6.376 -8.584 3.593 1.00 . A A . 7 LYS NZ 1 1 5 1312 1 1 7 LYS O O 9.343 -12.722 0.299 1.00 . A A . 7 LYS O 1 1 5 1313 1 1 8 TRP C C 8.061 -15.784 0.527 1.00 . A A . 8 TRP C 1 1 5 1314 1 1 8 TRP CA C 9.401 -15.401 1.171 1.00 . A A . 8 TRP CA 1 1 5 1315 1 1 8 TRP CB C 9.893 -16.576 2.048 1.00 . A A . 8 TRP CB 1 1 5 1316 1 1 8 TRP CD1 C 10.572 -18.636 0.715 1.00 . A A . 8 TRP CD1 1 1 5 1317 1 1 8 TRP CD2 C 12.321 -17.352 1.284 1.00 . A A . 8 TRP CD2 1 1 5 1318 1 1 8 TRP CE2 C 12.842 -18.454 0.539 1.00 . A A . 8 TRP CE2 1 1 5 1319 1 1 8 TRP CE3 C 13.253 -16.401 1.761 1.00 . A A . 8 TRP CE3 1 1 5 1320 1 1 8 TRP CG C 10.870 -17.492 1.370 1.00 . A A . 8 TRP CG 1 1 5 1321 1 1 8 TRP CH2 C 15.113 -17.632 0.762 1.00 . A A . 8 TRP CH2 1 1 5 1322 1 1 8 TRP CZ2 C 14.215 -18.601 0.278 1.00 . A A . 8 TRP CZ2 1 1 5 1323 1 1 8 TRP CZ3 C 14.632 -16.535 1.502 1.00 . A A . 8 TRP CZ3 1 1 5 1324 1 1 8 TRP H H 9.113 -14.353 2.985 1.00 . A A . 8 TRP H 1 1 5 1325 1 1 8 TRP HA H 10.121 -15.195 0.383 1.00 . A A . 8 TRP HA 1 1 5 1326 1 1 8 TRP HB2 H 10.398 -16.205 2.940 1.00 . A A . 8 TRP HB2 1 1 5 1327 1 1 8 TRP HB3 H 9.055 -17.171 2.416 1.00 . A A . 8 TRP HB3 1 1 5 1328 1 1 8 TRP HD1 H 9.574 -19.033 0.604 1.00 . A A . 8 TRP HD1 1 1 5 1329 1 1 8 TRP HE1 H 11.738 -20.096 -0.258 1.00 . A A . 8 TRP HE1 1 1 5 1330 1 1 8 TRP HE3 H 12.898 -15.556 2.333 1.00 . A A . 8 TRP HE3 1 1 5 1331 1 1 8 TRP HH2 H 16.173 -17.736 0.576 1.00 . A A . 8 TRP HH2 1 1 5 1332 1 1 8 TRP HZ2 H 14.581 -19.451 -0.279 1.00 . A A . 8 TRP HZ2 1 1 5 1333 1 1 8 TRP HZ3 H 15.325 -15.797 1.882 1.00 . A A . 8 TRP HZ3 1 1 5 1334 1 1 8 TRP N N 9.260 -14.206 2.001 1.00 . A A . 8 TRP N 1 1 5 1335 1 1 8 TRP NE1 N 11.730 -19.202 0.218 1.00 . A A . 8 TRP NE1 1 1 5 1336 1 1 8 TRP O O 6.990 -15.435 1.028 1.00 . A A . 8 TRP O 1 1 5 1337 1 1 9 THR C C 6.414 -18.327 -0.488 1.00 . A A . 9 THR C 1 1 5 1338 1 1 9 THR CA C 7.012 -17.134 -1.279 1.00 . A A . 9 THR CA 1 1 5 1339 1 1 9 THR CB C 7.551 -17.597 -2.657 1.00 . A A . 9 THR CB 1 1 5 1340 1 1 9 THR CG2 C 7.708 -16.408 -3.630 1.00 . A A . 9 THR CG2 1 1 5 1341 1 1 9 THR H H 9.051 -16.791 -0.923 1.00 . A A . 9 THR H 1 1 5 1342 1 1 9 THR HA H 6.240 -16.374 -1.406 1.00 . A A . 9 THR HA 1 1 5 1343 1 1 9 THR HB H 6.825 -18.273 -3.110 1.00 . A A . 9 THR HB 1 1 5 1344 1 1 9 THR HG21 H 8.533 -15.743 -3.381 1.00 . A A . 9 THR HG21 1 1 5 1345 1 1 9 THR HG22 H 6.806 -15.796 -3.610 1.00 . A A . 9 THR HG22 1 1 5 1346 1 1 9 THR HG23 H 7.793 -16.741 -4.662 1.00 . A A . 9 THR HG23 1 1 5 1347 1 1 9 THR N N 8.136 -16.532 -0.573 1.00 . A A . 9 THR N 1 1 5 1348 1 1 9 THR O O 7.109 -18.920 0.345 1.00 . A A . 9 THR O 1 1 5 1349 1 1 9 THR OG1 O 8.757 -18.378 -2.427 1.00 . A A . 9 THR OG1 1 1 5 1350 1 1 10 PRO C C 4.950 -21.217 -0.506 1.00 . A A . 10 PRO C 1 1 5 1351 1 1 10 PRO CA C 4.473 -19.828 -0.015 1.00 . A A . 10 PRO CA 1 1 5 1352 1 1 10 PRO CB C 2.974 -19.579 -0.258 1.00 . A A . 10 PRO CB 1 1 5 1353 1 1 10 PRO CD C 4.211 -18.077 -1.665 1.00 . A A . 10 PRO CD 1 1 5 1354 1 1 10 PRO CG C 2.922 -18.901 -1.617 1.00 . A A . 10 PRO CG 1 1 5 1355 1 1 10 PRO HA H 4.675 -19.766 1.056 1.00 . A A . 10 PRO HA 1 1 5 1356 1 1 10 PRO HB2 H 2.354 -20.476 -0.211 1.00 . A A . 10 PRO HB2 1 1 5 1357 1 1 10 PRO HB3 H 2.594 -18.895 0.501 1.00 . A A . 10 PRO HB3 1 1 5 1358 1 1 10 PRO HD2 H 4.601 -18.034 -2.682 1.00 . A A . 10 PRO HD2 1 1 5 1359 1 1 10 PRO HD3 H 4.008 -17.057 -1.333 1.00 . A A . 10 PRO HD3 1 1 5 1360 1 1 10 PRO HG2 H 2.939 -19.662 -2.401 1.00 . A A . 10 PRO HG2 1 1 5 1361 1 1 10 PRO HG3 H 2.024 -18.299 -1.761 1.00 . A A . 10 PRO HG3 1 1 5 1362 1 1 10 PRO N N 5.138 -18.718 -0.725 1.00 . A A . 10 PRO N 1 1 5 1363 1 1 10 PRO O O 4.169 -22.031 -0.994 1.00 . A A . 10 PRO O 1 1 5 1364 1 1 11 TRP C C 6.557 -23.981 -0.202 1.00 . A A . 11 TRP C 1 1 5 1365 1 1 11 TRP CA C 6.954 -22.662 -0.896 1.00 . A A . 11 TRP CA 1 1 5 1366 1 1 11 TRP CB C 8.470 -22.419 -0.715 1.00 . A A . 11 TRP CB 1 1 5 1367 1 1 11 TRP CD1 C 9.665 -22.188 -2.917 1.00 . A A . 11 TRP CD1 1 1 5 1368 1 1 11 TRP CD2 C 10.001 -24.208 -1.997 1.00 . A A . 11 TRP CD2 1 1 5 1369 1 1 11 TRP CE2 C 10.720 -24.186 -3.233 1.00 . A A . 11 TRP CE2 1 1 5 1370 1 1 11 TRP CE3 C 10.069 -25.401 -1.239 1.00 . A A . 11 TRP CE3 1 1 5 1371 1 1 11 TRP CG C 9.337 -22.917 -1.829 1.00 . A A . 11 TRP CG 1 1 5 1372 1 1 11 TRP CH2 C 11.511 -26.456 -2.910 1.00 . A A . 11 TRP CH2 1 1 5 1373 1 1 11 TRP CZ2 C 11.464 -25.287 -3.691 1.00 . A A . 11 TRP CZ2 1 1 5 1374 1 1 11 TRP CZ3 C 10.814 -26.512 -1.687 1.00 . A A . 11 TRP CZ3 1 1 5 1375 1 1 11 TRP H H 6.819 -20.743 0.027 1.00 . A A . 11 TRP H 1 1 5 1376 1 1 11 TRP HA H 6.714 -22.735 -1.959 1.00 . A A . 11 TRP HA 1 1 5 1377 1 1 11 TRP HB2 H 8.664 -21.347 -0.655 1.00 . A A . 11 TRP HB2 1 1 5 1378 1 1 11 TRP HB3 H 8.837 -22.826 0.227 1.00 . A A . 11 TRP HB3 1 1 5 1379 1 1 11 TRP HD1 H 9.314 -21.181 -3.092 1.00 . A A . 11 TRP HD1 1 1 5 1380 1 1 11 TRP HE1 H 10.804 -22.576 -4.636 1.00 . A A . 11 TRP HE1 1 1 5 1381 1 1 11 TRP HE3 H 9.532 -25.462 -0.306 1.00 . A A . 11 TRP HE3 1 1 5 1382 1 1 11 TRP HH2 H 12.080 -27.310 -3.250 1.00 . A A . 11 TRP HH2 1 1 5 1383 1 1 11 TRP HZ2 H 11.994 -25.241 -4.631 1.00 . A A . 11 TRP HZ2 1 1 5 1384 1 1 11 TRP HZ3 H 10.851 -27.412 -1.090 1.00 . A A . 11 TRP HZ3 1 1 5 1385 1 1 11 TRP N N 6.250 -21.496 -0.352 1.00 . A A . 11 TRP N 1 1 5 1386 1 1 11 TRP NE1 N 10.477 -22.930 -3.747 1.00 . A A . 11 TRP NE1 1 1 5 1387 1 1 11 TRP O O 6.750 -25.070 -0.741 1.00 . A A . 11 TRP O 1 1 5 1388 1 1 12 ARG C C 4.062 -25.395 1.200 1.00 . A A . 12 ARG C 1 1 5 1389 1 1 12 ARG CA C 5.457 -25.034 1.755 1.00 . A A . 12 ARG CA 1 1 5 1390 1 1 12 ARG CB C 5.401 -24.636 3.251 1.00 . A A . 12 ARG CB 1 1 5 1391 1 1 12 ARG CD C 5.024 -25.387 5.673 1.00 . A A . 12 ARG CD 1 1 5 1392 1 1 12 ARG CG C 5.038 -25.801 4.194 1.00 . A A . 12 ARG CG 1 1 5 1393 1 1 12 ARG CZ C 5.589 -27.245 7.293 1.00 . A A . 12 ARG CZ 1 1 5 1394 1 1 12 ARG H H 5.731 -22.966 1.300 1.00 . A A . 12 ARG H 1 1 5 1395 1 1 12 ARG HA H 6.126 -25.889 1.637 1.00 . A A . 12 ARG HA 1 1 5 1396 1 1 12 ARG HB2 H 6.377 -24.247 3.544 1.00 . A A . 12 ARG HB2 1 1 5 1397 1 1 12 ARG HB3 H 4.698 -23.814 3.395 1.00 . A A . 12 ARG HB3 1 1 5 1398 1 1 12 ARG HD2 H 5.965 -24.915 5.954 1.00 . A A . 12 ARG HD2 1 1 5 1399 1 1 12 ARG HD3 H 4.252 -24.632 5.831 1.00 . A A . 12 ARG HD3 1 1 5 1400 1 1 12 ARG HE H 3.737 -26.759 6.576 1.00 . A A . 12 ARG HE 1 1 5 1401 1 1 12 ARG HG2 H 4.060 -26.206 3.932 1.00 . A A . 12 ARG HG2 1 1 5 1402 1 1 12 ARG HG3 H 5.752 -26.614 4.049 1.00 . A A . 12 ARG HG3 1 1 5 1403 1 1 12 ARG HH11 H 7.252 -26.199 6.717 1.00 . A A . 12 ARG HH11 1 1 5 1404 1 1 12 ARG HH12 H 7.578 -27.457 7.837 1.00 . A A . 12 ARG HH12 1 1 5 1405 1 1 12 ARG HH21 H 4.156 -28.502 8.076 1.00 . A A . 12 ARG HH21 1 1 5 1406 1 1 12 ARG HH22 H 5.741 -28.801 8.646 1.00 . A A . 12 ARG HH22 1 1 5 1407 1 1 12 ARG N N 5.967 -23.899 0.998 1.00 . A A . 12 ARG N 1 1 5 1408 1 1 12 ARG NE N 4.726 -26.540 6.545 1.00 . A A . 12 ARG NE 1 1 5 1409 1 1 12 ARG NH1 N 6.894 -26.957 7.283 1.00 . A A . 12 ARG NH1 1 1 5 1410 1 1 12 ARG NH2 N 5.136 -28.248 8.050 1.00 . A A . 12 ARG NH2 1 1 5 1411 1 1 12 ARG O O 3.051 -25.047 1.806 1.00 . A A . 12 ARG O 1 1 5 1412 1 1 13 ARG C C 1.649 -27.059 -0.332 1.00 . A A . 13 ARG C 1 1 5 1413 1 1 13 ARG CA C 3.042 -26.619 -0.872 1.00 . A A . 13 ARG CA 1 1 5 1414 1 1 13 ARG CB C 3.773 -27.616 -1.820 1.00 . A A . 13 ARG CB 1 1 5 1415 1 1 13 ARG CD C 2.557 -29.742 -2.646 1.00 . A A . 13 ARG CD 1 1 5 1416 1 1 13 ARG CG C 2.983 -28.293 -2.964 1.00 . A A . 13 ARG CG 1 1 5 1417 1 1 13 ARG CZ C 0.281 -30.145 -3.641 1.00 . A A . 13 ARG CZ 1 1 5 1418 1 1 13 ARG H H 5.005 -26.124 -0.339 1.00 . A A . 13 ARG H 1 1 5 1419 1 1 13 ARG HA H 2.786 -25.760 -1.496 1.00 . A A . 13 ARG HA 1 1 5 1420 1 1 13 ARG HB2 H 4.592 -27.067 -2.288 1.00 . A A . 13 ARG HB2 1 1 5 1421 1 1 13 ARG HB3 H 4.264 -28.385 -1.223 1.00 . A A . 13 ARG HB3 1 1 5 1422 1 1 13 ARG HD2 H 3.443 -30.380 -2.633 1.00 . A A . 13 ARG HD2 1 1 5 1423 1 1 13 ARG HD3 H 2.122 -29.838 -1.652 1.00 . A A . 13 ARG HD3 1 1 5 1424 1 1 13 ARG HE H 2.074 -30.811 -4.376 1.00 . A A . 13 ARG HE 1 1 5 1425 1 1 13 ARG HG2 H 2.135 -27.676 -3.265 1.00 . A A . 13 ARG HG2 1 1 5 1426 1 1 13 ARG HG3 H 3.629 -28.326 -3.843 1.00 . A A . 13 ARG HG3 1 1 5 1427 1 1 13 ARG HH11 H 0.209 -28.813 -2.062 1.00 . A A . 13 ARG HH11 1 1 5 1428 1 1 13 ARG HH12 H -1.332 -29.252 -2.689 1.00 . A A . 13 ARG HH12 1 1 5 1429 1 1 13 ARG HH21 H -0.025 -31.387 -5.252 1.00 . A A . 13 ARG HH21 1 1 5 1430 1 1 13 ARG HH22 H -1.454 -30.710 -4.592 1.00 . A A . 13 ARG HH22 1 1 5 1431 1 1 13 ARG N N 4.066 -26.080 0.046 1.00 . A A . 13 ARG N 1 1 5 1432 1 1 13 ARG NE N 1.616 -30.279 -3.646 1.00 . A A . 13 ARG NE 1 1 5 1433 1 1 13 ARG NH1 N -0.333 -29.378 -2.738 1.00 . A A . 13 ARG NH1 1 1 5 1434 1 1 13 ARG NH2 N -0.446 -30.786 -4.557 1.00 . A A . 13 ARG NH2 1 1 5 1435 1 1 13 ARG O O 0.914 -27.795 -0.986 1.00 . A A . 13 ARG O 1 1 5 1436 1 1 14 NH2 HN1 H 0.303 -26.857 1.174 1.00 . A A . 14 NH2 HN1 1 1 5 1437 1 1 14 NH2 HN2 H 1.818 -25.956 1.337 1.00 . A A . 14 NH2 HN2 1 1 5 1438 1 1 14 NH2 N N 1.225 -26.635 0.843 1.00 . A A . 14 NH2 N 1 1 5 1439 2 2 1 . C1 C 10.047 -18.027 -2.907 1.00 . B A . 101 BGC C1 1 1 5 1440 2 2 1 . C2 C 10.236 -18.214 -4.432 1.00 . B A . 101 BGC C2 1 1 5 1441 2 2 1 . C3 C 11.722 -18.076 -4.756 1.00 . B A . 101 BGC C3 1 1 5 1442 2 2 1 . C4 C 12.218 -16.720 -4.248 1.00 . B A . 101 BGC C4 1 1 5 1443 2 2 1 . C5 C 11.943 -16.549 -2.730 1.00 . B A . 101 BGC C5 1 1 5 1444 2 2 1 . C6 C 12.304 -15.126 -2.257 1.00 . B A . 101 BGC C6 1 1 5 1445 2 2 1 . H1 H 10.682 -18.758 -2.389 1.00 . B A . 101 BGC H1 1 1 5 1446 2 2 1 . H2 H 9.711 -17.444 -4.986 1.00 . B A . 101 BGC H2 1 1 5 1447 2 2 1 . H3 H 12.282 -18.876 -4.267 1.00 . B A . 101 BGC H3 1 1 5 1448 2 2 1 . H4 H 11.673 -15.934 -4.777 1.00 . B A . 101 BGC H4 1 1 5 1449 2 2 1 . H5 H 12.522 -17.282 -2.165 1.00 . B A . 101 BGC H5 1 1 5 1450 2 2 1 . H6 H 12.811 -15.640 -0.428 1.00 . B A . 101 BGC H6 1 1 5 1451 2 2 1 . H6C1 H 11.645 -14.393 -2.724 1.00 . B A . 101 BGC H6C1 1 1 5 1452 2 2 1 . H6C2 H 13.318 -14.874 -2.567 1.00 . B A . 101 BGC H6C2 1 1 5 1453 2 2 1 . HB H 10.017 -19.565 -5.790 1.00 . B A . 101 BGC HB 1 1 5 1454 2 2 1 . HC H 12.823 -17.819 -6.333 1.00 . B A . 101 BGC HC 1 1 5 1455 2 2 1 . HD H 14.118 -17.241 -4.082 1.00 . B A . 101 BGC HD 1 1 5 1456 2 2 1 . O2 O 9.769 -19.486 -4.855 1.00 . B A . 101 BGC O2 1 1 5 1457 2 2 1 . O3 O 11.931 -18.166 -6.161 1.00 . B A . 101 BGC O3 1 1 5 1458 2 2 1 . O4 O 13.604 -16.577 -4.566 1.00 . B A . 101 BGC O4 1 1 5 1459 2 2 1 . O5 O 10.535 -16.768 -2.478 1.00 . B A . 101 BGC O5 1 1 5 1460 2 2 1 . O6 O 12.225 -14.988 -0.845 1.00 . B A . 101 BGC O6 1 1 6 1461 1 1 1 ILE C C 3.476 0.874 -1.778 1.00 . A A . 1 ILE C 1 1 6 1462 1 1 1 ILE CA C 3.585 2.382 -1.521 1.00 . A A . 1 ILE CA 1 1 6 1463 1 1 1 ILE CB C 4.643 2.742 -0.441 1.00 . A A . 1 ILE CB 1 1 6 1464 1 1 1 ILE CD1 C 5.531 2.224 1.930 1.00 . A A . 1 ILE CD1 1 1 6 1465 1 1 1 ILE CG1 C 4.345 2.141 0.959 1.00 . A A . 1 ILE CG1 1 1 6 1466 1 1 1 ILE CG2 C 4.853 4.268 -0.363 1.00 . A A . 1 ILE CG2 1 1 6 1467 1 1 1 ILE H1 H 1.963 2.331 -0.335 1.00 . A A . 1 ILE H1 1 1 6 1468 1 1 1 ILE HA H 3.856 2.855 -2.468 1.00 . A A . 1 ILE HA 1 1 6 1469 1 1 1 ILE HB H 5.591 2.318 -0.777 1.00 . A A . 1 ILE HB 1 1 6 1470 1 1 1 ILE HD11 H 6.422 1.744 1.520 1.00 . A A . 1 ILE HD11 1 1 6 1471 1 1 1 ILE HD12 H 5.790 3.254 2.177 1.00 . A A . 1 ILE HD12 1 1 6 1472 1 1 1 ILE HD13 H 5.297 1.723 2.870 1.00 . A A . 1 ILE HD13 1 1 6 1473 1 1 1 ILE HG12 H 3.484 2.629 1.416 1.00 . A A . 1 ILE HG12 1 1 6 1474 1 1 1 ILE HG13 H 4.081 1.085 0.876 1.00 . A A . 1 ILE HG13 1 1 6 1475 1 1 1 ILE HG21 H 3.999 4.786 0.077 1.00 . A A . 1 ILE HG21 1 1 6 1476 1 1 1 ILE HG22 H 5.723 4.517 0.245 1.00 . A A . 1 ILE HG22 1 1 6 1477 1 1 1 ILE HG23 H 5.037 4.701 -1.349 1.00 . A A . 1 ILE HG23 1 1 6 1478 1 1 1 ILE N N 2.249 2.875 -1.138 1.00 . A A . 1 ILE N 1 1 6 1479 1 1 1 ILE O O 2.439 0.305 -1.444 1.00 . A A . 1 ILE O 1 1 6 1480 1 1 2 LEU C C 5.950 -1.685 -2.240 1.00 . A A . 2 LEU C 1 1 6 1481 1 1 2 LEU CA C 4.547 -1.191 -2.643 1.00 . A A . 2 LEU CA 1 1 6 1482 1 1 2 LEU CB C 4.187 -1.390 -4.138 1.00 . A A . 2 LEU CB 1 1 6 1483 1 1 2 LEU CD1 C 3.062 -2.779 -5.928 1.00 . A A . 2 LEU CD1 1 1 6 1484 1 1 2 LEU CD2 C 4.862 -3.843 -4.534 1.00 . A A . 2 LEU CD2 1 1 6 1485 1 1 2 LEU CG C 3.726 -2.809 -4.541 1.00 . A A . 2 LEU CG 1 1 6 1486 1 1 2 LEU H H 5.351 0.742 -2.593 1.00 . A A . 2 LEU H 1 1 6 1487 1 1 2 LEU HA H 3.786 -1.710 -2.062 1.00 . A A . 2 LEU HA 1 1 6 1488 1 1 2 LEU HB2 H 3.368 -0.711 -4.377 1.00 . A A . 2 LEU HB2 1 1 6 1489 1 1 2 LEU HB3 H 5.014 -1.075 -4.778 1.00 . A A . 2 LEU HB3 1 1 6 1490 1 1 2 LEU HD11 H 3.763 -2.459 -6.699 1.00 . A A . 2 LEU HD11 1 1 6 1491 1 1 2 LEU HD12 H 2.210 -2.099 -5.949 1.00 . A A . 2 LEU HD12 1 1 6 1492 1 1 2 LEU HD13 H 2.690 -3.765 -6.210 1.00 . A A . 2 LEU HD13 1 1 6 1493 1 1 2 LEU HD21 H 5.222 -4.050 -3.528 1.00 . A A . 2 LEU HD21 1 1 6 1494 1 1 2 LEU HD22 H 5.710 -3.514 -5.135 1.00 . A A . 2 LEU HD22 1 1 6 1495 1 1 2 LEU HD23 H 4.518 -4.792 -4.945 1.00 . A A . 2 LEU HD23 1 1 6 1496 1 1 2 LEU HG H 2.964 -3.139 -3.832 1.00 . A A . 2 LEU HG 1 1 6 1497 1 1 2 LEU N N 4.508 0.239 -2.345 1.00 . A A . 2 LEU N 1 1 6 1498 1 1 2 LEU O O 6.906 -1.351 -2.940 1.00 . A A . 2 LEU O 1 1 6 1499 1 1 3 PRO C C 7.724 -4.253 -1.466 1.00 . A A . 3 PRO C 1 1 6 1500 1 1 3 PRO CA C 7.428 -2.944 -0.707 1.00 . A A . 3 PRO CA 1 1 6 1501 1 1 3 PRO CB C 7.279 -3.206 0.800 1.00 . A A . 3 PRO CB 1 1 6 1502 1 1 3 PRO CD C 5.100 -2.675 -0.090 1.00 . A A . 3 PRO CD 1 1 6 1503 1 1 3 PRO CG C 5.796 -3.493 1.002 1.00 . A A . 3 PRO CG 1 1 6 1504 1 1 3 PRO HA H 8.226 -2.219 -0.883 1.00 . A A . 3 PRO HA 1 1 6 1505 1 1 3 PRO HB2 H 7.910 -4.018 1.167 1.00 . A A . 3 PRO HB2 1 1 6 1506 1 1 3 PRO HB3 H 7.553 -2.307 1.355 1.00 . A A . 3 PRO HB3 1 1 6 1507 1 1 3 PRO HD2 H 4.258 -3.236 -0.499 1.00 . A A . 3 PRO HD2 1 1 6 1508 1 1 3 PRO HD3 H 4.724 -1.733 0.314 1.00 . A A . 3 PRO HD3 1 1 6 1509 1 1 3 PRO HG2 H 5.605 -4.555 0.842 1.00 . A A . 3 PRO HG2 1 1 6 1510 1 1 3 PRO HG3 H 5.448 -3.246 2.005 1.00 . A A . 3 PRO HG3 1 1 6 1511 1 1 3 PRO N N 6.122 -2.404 -1.108 1.00 . A A . 3 PRO N 1 1 6 1512 1 1 3 PRO O O 6.873 -5.141 -1.525 1.00 . A A . 3 PRO O 1 1 6 1513 1 1 4 TRP C C 10.885 -5.803 -2.673 1.00 . A A . 4 TRP C 1 1 6 1514 1 1 4 TRP CA C 9.364 -5.583 -2.763 1.00 . A A . 4 TRP CA 1 1 6 1515 1 1 4 TRP CB C 8.792 -5.598 -4.204 1.00 . A A . 4 TRP CB 1 1 6 1516 1 1 4 TRP CD1 C 6.748 -7.040 -4.614 1.00 . A A . 4 TRP CD1 1 1 6 1517 1 1 4 TRP CD2 C 8.620 -8.007 -5.376 1.00 . A A . 4 TRP CD2 1 1 6 1518 1 1 4 TRP CE2 C 7.525 -8.832 -5.788 1.00 . A A . 4 TRP CE2 1 1 6 1519 1 1 4 TRP CE3 C 9.914 -8.433 -5.755 1.00 . A A . 4 TRP CE3 1 1 6 1520 1 1 4 TRP CG C 8.086 -6.842 -4.674 1.00 . A A . 4 TRP CG 1 1 6 1521 1 1 4 TRP CH2 C 9.012 -10.393 -6.902 1.00 . A A . 4 TRP CH2 1 1 6 1522 1 1 4 TRP CZ2 C 7.707 -9.998 -6.553 1.00 . A A . 4 TRP CZ2 1 1 6 1523 1 1 4 TRP CZ3 C 10.112 -9.614 -6.498 1.00 . A A . 4 TRP CZ3 1 1 6 1524 1 1 4 TRP H H 9.542 -3.586 -2.055 1.00 . A A . 4 TRP H 1 1 6 1525 1 1 4 TRP HA H 8.947 -6.447 -2.238 1.00 . A A . 4 TRP HA 1 1 6 1526 1 1 4 TRP HB2 H 8.076 -4.783 -4.324 1.00 . A A . 4 TRP HB2 1 1 6 1527 1 1 4 TRP HB3 H 9.575 -5.371 -4.930 1.00 . A A . 4 TRP HB3 1 1 6 1528 1 1 4 TRP HD1 H 6.063 -6.324 -4.183 1.00 . A A . 4 TRP HD1 1 1 6 1529 1 1 4 TRP HE1 H 5.462 -8.312 -5.644 1.00 . A A . 4 TRP HE1 1 1 6 1530 1 1 4 TRP HE3 H 10.770 -7.830 -5.492 1.00 . A A . 4 TRP HE3 1 1 6 1531 1 1 4 TRP HH2 H 9.173 -11.278 -7.500 1.00 . A A . 4 TRP HH2 1 1 6 1532 1 1 4 TRP HZ2 H 6.865 -10.580 -6.898 1.00 . A A . 4 TRP HZ2 1 1 6 1533 1 1 4 TRP HZ3 H 11.114 -9.903 -6.786 1.00 . A A . 4 TRP HZ3 1 1 6 1534 1 1 4 TRP N N 8.927 -4.384 -2.037 1.00 . A A . 4 TRP N 1 1 6 1535 1 1 4 TRP NE1 N 6.405 -8.194 -5.293 1.00 . A A . 4 TRP NE1 1 1 6 1536 1 1 4 TRP O O 11.446 -6.548 -3.472 1.00 . A A . 4 TRP O 1 1 6 1537 1 1 5 LYS C C 13.306 -6.657 -0.744 1.00 . A A . 5 LYS C 1 1 6 1538 1 1 5 LYS CA C 13.029 -5.342 -1.506 1.00 . A A . 5 LYS CA 1 1 6 1539 1 1 5 LYS CB C 13.597 -4.168 -0.671 1.00 . A A . 5 LYS CB 1 1 6 1540 1 1 5 LYS CD C 14.536 -1.770 -0.752 1.00 . A A . 5 LYS CD 1 1 6 1541 1 1 5 LYS CE C 14.529 -1.553 0.777 1.00 . A A . 5 LYS CE 1 1 6 1542 1 1 5 LYS CG C 13.493 -2.772 -1.300 1.00 . A A . 5 LYS CG 1 1 6 1543 1 1 5 LYS H H 11.047 -4.735 -0.976 1.00 . A A . 5 LYS H 1 1 6 1544 1 1 5 LYS HA H 13.544 -5.382 -2.469 1.00 . A A . 5 LYS HA 1 1 6 1545 1 1 5 LYS HB2 H 13.130 -4.157 0.315 1.00 . A A . 5 LYS HB2 1 1 6 1546 1 1 5 LYS HB3 H 14.656 -4.386 -0.521 1.00 . A A . 5 LYS HB3 1 1 6 1547 1 1 5 LYS HD2 H 15.536 -2.051 -1.091 1.00 . A A . 5 LYS HD2 1 1 6 1548 1 1 5 LYS HD3 H 14.340 -0.808 -1.232 1.00 . A A . 5 LYS HD3 1 1 6 1549 1 1 5 LYS HE2 H 15.032 -0.613 1.008 1.00 . A A . 5 LYS HE2 1 1 6 1550 1 1 5 LYS HE3 H 13.505 -1.455 1.145 1.00 . A A . 5 LYS HE3 1 1 6 1551 1 1 5 LYS HG2 H 13.639 -2.853 -2.380 1.00 . A A . 5 LYS HG2 1 1 6 1552 1 1 5 LYS HG3 H 12.484 -2.381 -1.168 1.00 . A A . 5 LYS HG3 1 1 6 1553 1 1 5 LYS HZ1 H 14.784 -3.521 1.340 1.00 . A A . 5 LYS HZ1 1 1 6 1554 1 1 5 LYS HZ2 H 15.210 -2.444 2.504 1.00 . A A . 5 LYS HZ2 1 1 6 1555 1 1 5 LYS HZ3 H 16.194 -2.689 1.211 1.00 . A A . 5 LYS HZ3 1 1 6 1556 1 1 5 LYS N N 11.581 -5.180 -1.705 1.00 . A A . 5 LYS N 1 1 6 1557 1 1 5 LYS NZ N 15.230 -2.629 1.511 1.00 . A A . 5 LYS NZ 1 1 6 1558 1 1 5 LYS O O 13.757 -6.625 0.402 1.00 . A A . 5 LYS O 1 1 6 1559 1 1 6 TRP C C 11.378 -9.328 -0.366 1.00 . A A . 6 TRP C 1 1 6 1560 1 1 6 TRP CA C 12.819 -9.136 -0.868 1.00 . A A . 6 TRP CA 1 1 6 1561 1 1 6 TRP CB C 13.923 -9.574 0.123 1.00 . A A . 6 TRP CB 1 1 6 1562 1 1 6 TRP CD1 C 13.862 -12.052 -0.474 1.00 . A A . 6 TRP CD1 1 1 6 1563 1 1 6 TRP CD2 C 14.448 -11.681 1.662 1.00 . A A . 6 TRP CD2 1 1 6 1564 1 1 6 TRP CE2 C 14.469 -13.095 1.464 1.00 . A A . 6 TRP CE2 1 1 6 1565 1 1 6 TRP CE3 C 14.800 -11.209 2.948 1.00 . A A . 6 TRP CE3 1 1 6 1566 1 1 6 TRP CG C 14.062 -11.042 0.407 1.00 . A A . 6 TRP CG 1 1 6 1567 1 1 6 TRP CH2 C 15.192 -13.485 3.748 1.00 . A A . 6 TRP CH2 1 1 6 1568 1 1 6 TRP CZ2 C 14.832 -13.992 2.485 1.00 . A A . 6 TRP CZ2 1 1 6 1569 1 1 6 TRP CZ3 C 15.169 -12.097 3.980 1.00 . A A . 6 TRP CZ3 1 1 6 1570 1 1 6 TRP H H 12.551 -7.617 -2.299 1.00 . A A . 6 TRP H 1 1 6 1571 1 1 6 TRP HA H 12.918 -9.754 -1.760 1.00 . A A . 6 TRP HA 1 1 6 1572 1 1 6 TRP HB2 H 14.896 -9.227 -0.222 1.00 . A A . 6 TRP HB2 1 1 6 1573 1 1 6 TRP HB3 H 13.750 -9.084 1.082 1.00 . A A . 6 TRP HB3 1 1 6 1574 1 1 6 TRP HD1 H 13.585 -11.928 -1.511 1.00 . A A . 6 TRP HD1 1 1 6 1575 1 1 6 TRP HE1 H 14.029 -14.147 -0.334 1.00 . A A . 6 TRP HE1 1 1 6 1576 1 1 6 TRP HE3 H 14.799 -10.146 3.140 1.00 . A A . 6 TRP HE3 1 1 6 1577 1 1 6 TRP HH2 H 15.484 -14.161 4.539 1.00 . A A . 6 TRP HH2 1 1 6 1578 1 1 6 TRP HZ2 H 14.844 -15.057 2.306 1.00 . A A . 6 TRP HZ2 1 1 6 1579 1 1 6 TRP HZ3 H 15.444 -11.710 4.952 1.00 . A A . 6 TRP HZ3 1 1 6 1580 1 1 6 TRP N N 12.977 -7.779 -1.391 1.00 . A A . 6 TRP N 1 1 6 1581 1 1 6 TRP NE1 N 14.088 -13.260 0.150 1.00 . A A . 6 TRP NE1 1 1 6 1582 1 1 6 TRP O O 10.702 -8.361 -0.008 1.00 . A A . 6 TRP O 1 1 6 1583 1 1 7 LYS C C 9.478 -12.478 0.150 1.00 . A A . 7 LYS C 1 1 6 1584 1 1 7 LYS CA C 9.537 -10.955 0.000 1.00 . A A . 7 LYS CA 1 1 6 1585 1 1 7 LYS CB C 8.467 -10.371 -0.959 1.00 . A A . 7 LYS CB 1 1 6 1586 1 1 7 LYS CD C 8.096 -11.910 -3.044 1.00 . A A . 7 LYS CD 1 1 6 1587 1 1 7 LYS CE C 6.567 -12.012 -2.938 1.00 . A A . 7 LYS CE 1 1 6 1588 1 1 7 LYS CG C 8.692 -10.607 -2.473 1.00 . A A . 7 LYS CG 1 1 6 1589 1 1 7 LYS H H 11.490 -11.343 -0.637 1.00 . A A . 7 LYS H 1 1 6 1590 1 1 7 LYS HA H 9.367 -10.534 0.994 1.00 . A A . 7 LYS HA 1 1 6 1591 1 1 7 LYS HB2 H 7.480 -10.706 -0.645 1.00 . A A . 7 LYS HB2 1 1 6 1592 1 1 7 LYS HB3 H 8.441 -9.292 -0.799 1.00 . A A . 7 LYS HB3 1 1 6 1593 1 1 7 LYS HD2 H 8.391 -11.994 -4.091 1.00 . A A . 7 LYS HD2 1 1 6 1594 1 1 7 LYS HD3 H 8.545 -12.775 -2.554 1.00 . A A . 7 LYS HD3 1 1 6 1595 1 1 7 LYS HE2 H 6.225 -12.914 -3.447 1.00 . A A . 7 LYS HE2 1 1 6 1596 1 1 7 LYS HE3 H 6.252 -12.116 -1.899 1.00 . A A . 7 LYS HE3 1 1 6 1597 1 1 7 LYS HG2 H 8.290 -9.754 -3.018 1.00 . A A . 7 LYS HG2 1 1 6 1598 1 1 7 LYS HG3 H 9.756 -10.582 -2.709 1.00 . A A . 7 LYS HG3 1 1 6 1599 1 1 7 LYS HZ1 H 4.909 -10.958 -3.532 1.00 . A A . 7 LYS HZ1 1 1 6 1600 1 1 7 LYS HZ2 H 6.243 -10.689 -4.479 1.00 . A A . 7 LYS HZ2 1 1 6 1601 1 1 7 LYS HZ3 H 6.151 -10.008 -3.004 1.00 . A A . 7 LYS HZ3 1 1 6 1602 1 1 7 LYS N N 10.883 -10.568 -0.398 1.00 . A A . 7 LYS N 1 1 6 1603 1 1 7 LYS NZ N 5.910 -10.833 -3.536 1.00 . A A . 7 LYS NZ 1 1 6 1604 1 1 7 LYS O O 10.208 -13.197 -0.535 1.00 . A A . 7 LYS O 1 1 6 1605 1 1 8 TRP C C 7.339 -14.991 0.421 1.00 . A A . 8 TRP C 1 1 6 1606 1 1 8 TRP CA C 8.412 -14.376 1.346 1.00 . A A . 8 TRP CA 1 1 6 1607 1 1 8 TRP CB C 7.928 -14.463 2.815 1.00 . A A . 8 TRP CB 1 1 6 1608 1 1 8 TRP CD1 C 7.747 -16.712 3.977 1.00 . A A . 8 TRP CD1 1 1 6 1609 1 1 8 TRP CD2 C 9.809 -15.835 4.100 1.00 . A A . 8 TRP CD2 1 1 6 1610 1 1 8 TRP CE2 C 9.852 -17.090 4.781 1.00 . A A . 8 TRP CE2 1 1 6 1611 1 1 8 TRP CE3 C 11.007 -15.084 4.063 1.00 . A A . 8 TRP CE3 1 1 6 1612 1 1 8 TRP CG C 8.456 -15.630 3.591 1.00 . A A . 8 TRP CG 1 1 6 1613 1 1 8 TRP CH2 C 12.192 -16.799 5.342 1.00 . A A . 8 TRP CH2 1 1 6 1614 1 1 8 TRP CZ2 C 11.020 -17.575 5.390 1.00 . A A . 8 TRP CZ2 1 1 6 1615 1 1 8 TRP CZ3 C 12.183 -15.555 4.682 1.00 . A A . 8 TRP CZ3 1 1 6 1616 1 1 8 TRP H H 8.000 -12.314 1.517 1.00 . A A . 8 TRP H 1 1 6 1617 1 1 8 TRP HA H 9.358 -14.909 1.226 1.00 . A A . 8 TRP HA 1 1 6 1618 1 1 8 TRP HB2 H 8.250 -13.585 3.378 1.00 . A A . 8 TRP HB2 1 1 6 1619 1 1 8 TRP HB3 H 6.838 -14.459 2.876 1.00 . A A . 8 TRP HB3 1 1 6 1620 1 1 8 TRP HD1 H 6.699 -16.866 3.760 1.00 . A A . 8 TRP HD1 1 1 6 1621 1 1 8 TRP HE1 H 8.247 -18.476 5.009 1.00 . A A . 8 TRP HE1 1 1 6 1622 1 1 8 TRP HE3 H 11.019 -14.128 3.560 1.00 . A A . 8 TRP HE3 1 1 6 1623 1 1 8 TRP HH2 H 13.095 -17.154 5.817 1.00 . A A . 8 TRP HH2 1 1 6 1624 1 1 8 TRP HZ2 H 11.021 -18.527 5.901 1.00 . A A . 8 TRP HZ2 1 1 6 1625 1 1 8 TRP HZ3 H 13.079 -14.954 4.656 1.00 . A A . 8 TRP HZ3 1 1 6 1626 1 1 8 TRP N N 8.600 -12.960 1.033 1.00 . A A . 8 TRP N 1 1 6 1627 1 1 8 TRP NE1 N 8.571 -17.584 4.660 1.00 . A A . 8 TRP NE1 1 1 6 1628 1 1 8 TRP O O 6.667 -14.281 -0.338 1.00 . A A . 8 TRP O 1 1 6 1629 1 1 9 THR C C 5.527 -18.101 0.834 1.00 . A A . 9 THR C 1 1 6 1630 1 1 9 THR CA C 6.177 -17.134 -0.181 1.00 . A A . 9 THR CA 1 1 6 1631 1 1 9 THR CB C 6.803 -17.865 -1.399 1.00 . A A . 9 THR CB 1 1 6 1632 1 1 9 THR CG2 C 6.985 -16.999 -2.665 1.00 . A A . 9 THR CG2 1 1 6 1633 1 1 9 THR H H 7.802 -16.844 1.106 1.00 . A A . 9 THR H 1 1 6 1634 1 1 9 THR HA H 5.389 -16.474 -0.544 1.00 . A A . 9 THR HA 1 1 6 1635 1 1 9 THR HB H 6.119 -18.665 -1.686 1.00 . A A . 9 THR HB 1 1 6 1636 1 1 9 THR HG21 H 7.500 -17.554 -3.450 1.00 . A A . 9 THR HG21 1 1 6 1637 1 1 9 THR HG22 H 7.536 -16.080 -2.477 1.00 . A A . 9 THR HG22 1 1 6 1638 1 1 9 THR HG23 H 6.014 -16.702 -3.061 1.00 . A A . 9 THR HG23 1 1 6 1639 1 1 9 THR N N 7.174 -16.312 0.500 1.00 . A A . 9 THR N 1 1 6 1640 1 1 9 THR O O 6.171 -18.461 1.822 1.00 . A A . 9 THR O 1 1 6 1641 1 1 9 THR OG1 O 8.021 -18.527 -0.990 1.00 . A A . 9 THR OG1 1 1 6 1642 1 1 10 PRO C C 4.095 -20.917 1.346 1.00 . A A . 10 PRO C 1 1 6 1643 1 1 10 PRO CA C 3.598 -19.475 1.552 1.00 . A A . 10 PRO CA 1 1 6 1644 1 1 10 PRO CB C 2.106 -19.353 1.206 1.00 . A A . 10 PRO CB 1 1 6 1645 1 1 10 PRO CD C 3.363 -18.133 -0.450 1.00 . A A . 10 PRO CD 1 1 6 1646 1 1 10 PRO CG C 2.085 -18.955 -0.264 1.00 . A A . 10 PRO CG 1 1 6 1647 1 1 10 PRO HA H 3.768 -19.180 2.589 1.00 . A A . 10 PRO HA 1 1 6 1648 1 1 10 PRO HB2 H 1.533 -20.262 1.399 1.00 . A A . 10 PRO HB2 1 1 6 1649 1 1 10 PRO HB3 H 1.660 -18.558 1.805 1.00 . A A . 10 PRO HB3 1 1 6 1650 1 1 10 PRO HD2 H 3.800 -18.309 -1.433 1.00 . A A . 10 PRO HD2 1 1 6 1651 1 1 10 PRO HD3 H 3.138 -17.070 -0.356 1.00 . A A . 10 PRO HD3 1 1 6 1652 1 1 10 PRO HG2 H 2.134 -19.853 -0.882 1.00 . A A . 10 PRO HG2 1 1 6 1653 1 1 10 PRO HG3 H 1.183 -18.410 -0.545 1.00 . A A . 10 PRO HG3 1 1 6 1654 1 1 10 PRO N N 4.262 -18.537 0.637 1.00 . A A . 10 PRO N 1 1 6 1655 1 1 10 PRO O O 4.503 -21.295 0.248 1.00 . A A . 10 PRO O 1 1 6 1656 1 1 11 TRP C C 3.467 -24.110 1.639 1.00 . A A . 11 TRP C 1 1 6 1657 1 1 11 TRP CA C 4.409 -23.161 2.428 1.00 . A A . 11 TRP CA 1 1 6 1658 1 1 11 TRP CB C 4.496 -23.581 3.915 1.00 . A A . 11 TRP CB 1 1 6 1659 1 1 11 TRP CD1 C 5.025 -25.923 4.750 1.00 . A A . 11 TRP CD1 1 1 6 1660 1 1 11 TRP CD2 C 6.854 -24.820 4.051 1.00 . A A . 11 TRP CD2 1 1 6 1661 1 1 11 TRP CE2 C 7.290 -26.103 4.502 1.00 . A A . 11 TRP CE2 1 1 6 1662 1 1 11 TRP CE3 C 7.851 -23.939 3.566 1.00 . A A . 11 TRP CE3 1 1 6 1663 1 1 11 TRP CG C 5.405 -24.736 4.222 1.00 . A A . 11 TRP CG 1 1 6 1664 1 1 11 TRP CH2 C 9.603 -25.593 3.984 1.00 . A A . 11 TRP CH2 1 1 6 1665 1 1 11 TRP CZ2 C 8.640 -26.493 4.472 1.00 . A A . 11 TRP CZ2 1 1 6 1666 1 1 11 TRP CZ3 C 9.209 -24.318 3.532 1.00 . A A . 11 TRP CZ3 1 1 6 1667 1 1 11 TRP H H 3.610 -21.373 3.242 1.00 . A A . 11 TRP H 1 1 6 1668 1 1 11 TRP HA H 5.401 -23.222 1.977 1.00 . A A . 11 TRP HA 1 1 6 1669 1 1 11 TRP HB2 H 4.884 -22.752 4.508 1.00 . A A . 11 TRP HB2 1 1 6 1670 1 1 11 TRP HB3 H 3.502 -23.792 4.313 1.00 . A A . 11 TRP HB3 1 1 6 1671 1 1 11 TRP HD1 H 4.006 -26.176 5.006 1.00 . A A . 11 TRP HD1 1 1 6 1672 1 1 11 TRP HE1 H 6.089 -27.653 5.327 1.00 . A A . 11 TRP HE1 1 1 6 1673 1 1 11 TRP HE3 H 7.569 -22.956 3.220 1.00 . A A . 11 TRP HE3 1 1 6 1674 1 1 11 TRP HH2 H 10.646 -25.876 3.961 1.00 . A A . 11 TRP HH2 1 1 6 1675 1 1 11 TRP HZ2 H 8.940 -27.469 4.824 1.00 . A A . 11 TRP HZ2 1 1 6 1676 1 1 11 TRP HZ3 H 9.952 -23.626 3.160 1.00 . A A . 11 TRP HZ3 1 1 6 1677 1 1 11 TRP N N 3.976 -21.756 2.385 1.00 . A A . 11 TRP N 1 1 6 1678 1 1 11 TRP NE1 N 6.133 -26.730 4.915 1.00 . A A . 11 TRP NE1 1 1 6 1679 1 1 11 TRP O O 3.334 -25.293 1.947 1.00 . A A . 11 TRP O 1 1 6 1680 1 1 12 ARG C C 2.374 -23.576 -1.715 1.00 . A A . 12 ARG C 1 1 6 1681 1 1 12 ARG CA C 2.036 -24.298 -0.408 1.00 . A A . 12 ARG CA 1 1 6 1682 1 1 12 ARG CB C 0.518 -24.313 -0.093 1.00 . A A . 12 ARG CB 1 1 6 1683 1 1 12 ARG CD C 0.413 -26.436 1.406 1.00 . A A . 12 ARG CD 1 1 6 1684 1 1 12 ARG CG C 0.106 -24.934 1.259 1.00 . A A . 12 ARG CG 1 1 6 1685 1 1 12 ARG CZ C -0.399 -28.609 0.463 1.00 . A A . 12 ARG CZ 1 1 6 1686 1 1 12 ARG H H 3.054 -22.637 0.367 1.00 . A A . 12 ARG H 1 1 6 1687 1 1 12 ARG HA H 2.401 -25.322 -0.484 1.00 . A A . 12 ARG HA 1 1 6 1688 1 1 12 ARG HB2 H 0.150 -23.285 -0.116 1.00 . A A . 12 ARG HB2 1 1 6 1689 1 1 12 ARG HB3 H -0.007 -24.826 -0.899 1.00 . A A . 12 ARG HB3 1 1 6 1690 1 1 12 ARG HD2 H 1.430 -26.660 1.090 1.00 . A A . 12 ARG HD2 1 1 6 1691 1 1 12 ARG HD3 H 0.352 -26.711 2.461 1.00 . A A . 12 ARG HD3 1 1 6 1692 1 1 12 ARG HE H -1.364 -26.802 0.345 1.00 . A A . 12 ARG HE 1 1 6 1693 1 1 12 ARG HG2 H 0.594 -24.392 2.070 1.00 . A A . 12 ARG HG2 1 1 6 1694 1 1 12 ARG HG3 H -0.959 -24.764 1.418 1.00 . A A . 12 ARG HG3 1 1 6 1695 1 1 12 ARG HH11 H 1.397 -28.745 1.428 1.00 . A A . 12 ARG HH11 1 1 6 1696 1 1 12 ARG HH12 H 0.822 -30.248 0.827 1.00 . A A . 12 ARG HH12 1 1 6 1697 1 1 12 ARG HH21 H -2.178 -28.827 -0.553 1.00 . A A . 12 ARG HH21 1 1 6 1698 1 1 12 ARG HH22 H -1.295 -30.280 -0.358 1.00 . A A . 12 ARG HH22 1 1 6 1699 1 1 12 ARG N N 2.795 -23.591 0.608 1.00 . A A . 12 ARG N 1 1 6 1700 1 1 12 ARG NE N -0.534 -27.288 0.661 1.00 . A A . 12 ARG NE 1 1 6 1701 1 1 12 ARG NH1 N 0.675 -29.253 0.930 1.00 . A A . 12 ARG NH1 1 1 6 1702 1 1 12 ARG NH2 N -1.346 -29.281 -0.199 1.00 . A A . 12 ARG NH2 1 1 6 1703 1 1 12 ARG O O 2.054 -22.396 -1.857 1.00 . A A . 12 ARG O 1 1 6 1704 1 1 13 ARG C C 2.490 -23.459 -4.907 1.00 . A A . 13 ARG C 1 1 6 1705 1 1 13 ARG CA C 3.616 -23.692 -3.873 1.00 . A A . 13 ARG CA 1 1 6 1706 1 1 13 ARG CB C 4.701 -24.680 -4.386 1.00 . A A . 13 ARG CB 1 1 6 1707 1 1 13 ARG CD C 5.241 -23.899 -6.812 1.00 . A A . 13 ARG CD 1 1 6 1708 1 1 13 ARG CG C 5.743 -24.103 -5.372 1.00 . A A . 13 ARG CG 1 1 6 1709 1 1 13 ARG CZ C 6.202 -23.403 -9.070 1.00 . A A . 13 ARG CZ 1 1 6 1710 1 1 13 ARG H H 3.255 -25.226 -2.459 1.00 . A A . 13 ARG H 1 1 6 1711 1 1 13 ARG HA H 4.083 -22.734 -3.631 1.00 . A A . 13 ARG HA 1 1 6 1712 1 1 13 ARG HB2 H 5.267 -25.031 -3.522 1.00 . A A . 13 ARG HB2 1 1 6 1713 1 1 13 ARG HB3 H 4.242 -25.576 -4.808 1.00 . A A . 13 ARG HB3 1 1 6 1714 1 1 13 ARG HD2 H 4.696 -24.785 -7.144 1.00 . A A . 13 ARG HD2 1 1 6 1715 1 1 13 ARG HD3 H 4.555 -23.052 -6.854 1.00 . A A . 13 ARG HD3 1 1 6 1716 1 1 13 ARG HE H 7.257 -23.621 -7.327 1.00 . A A . 13 ARG HE 1 1 6 1717 1 1 13 ARG HG2 H 6.135 -23.165 -4.974 1.00 . A A . 13 ARG HG2 1 1 6 1718 1 1 13 ARG HG3 H 6.589 -24.791 -5.393 1.00 . A A . 13 ARG HG3 1 1 6 1719 1 1 13 ARG HH11 H 4.174 -23.660 -9.087 1.00 . A A . 13 ARG HH11 1 1 6 1720 1 1 13 ARG HH12 H 4.832 -23.245 -10.618 1.00 . A A . 13 ARG HH12 1 1 6 1721 1 1 13 ARG HH21 H 8.212 -23.121 -9.412 1.00 . A A . 13 ARG HH21 1 1 6 1722 1 1 13 ARG HH22 H 7.229 -22.961 -10.804 1.00 . A A . 13 ARG HH22 1 1 6 1723 1 1 13 ARG N N 3.046 -24.259 -2.649 1.00 . A A . 13 ARG N 1 1 6 1724 1 1 13 ARG NE N 6.340 -23.638 -7.756 1.00 . A A . 13 ARG NE 1 1 6 1725 1 1 13 ARG NH1 N 4.992 -23.428 -9.637 1.00 . A A . 13 ARG NH1 1 1 6 1726 1 1 13 ARG NH2 N 7.283 -23.145 -9.811 1.00 . A A . 13 ARG NH2 1 1 6 1727 1 1 13 ARG O O 2.422 -24.100 -5.952 1.00 . A A . 13 ARG O 1 1 6 1728 1 1 14 NH2 HN1 H 0.820 -22.356 -5.242 1.00 . A A . 14 NH2 HN1 1 1 6 1729 1 1 14 NH2 HN2 H 1.621 -22.121 -3.683 1.00 . A A . 14 NH2 HN2 1 1 6 1730 1 1 14 NH2 N N 1.581 -22.543 -4.611 1.00 . A A . 14 NH2 N 1 1 6 1731 2 2 1 . C1 C 9.275 -17.898 -1.173 1.00 . B A . 101 BGC C1 1 1 6 1732 2 2 1 . C2 C 10.178 -18.232 0.029 1.00 . B A . 101 BGC C2 1 1 6 1733 2 2 1 . C3 C 11.576 -17.644 -0.190 1.00 . B A . 101 BGC C3 1 1 6 1734 2 2 1 . C4 C 12.132 -18.124 -1.536 1.00 . B A . 101 BGC C4 1 1 6 1735 2 2 1 . C5 C 11.160 -17.717 -2.670 1.00 . B A . 101 BGC C5 1 1 6 1736 2 2 1 . C6 C 11.592 -18.249 -4.049 1.00 . B A . 101 BGC C6 1 1 6 1737 2 2 1 . H1 H 9.127 -16.814 -1.233 1.00 . B A . 101 BGC H1 1 1 6 1738 2 2 1 . H2 H 10.232 -19.317 0.139 1.00 . B A . 101 BGC H2 1 1 6 1739 2 2 1 . H3 H 11.498 -16.554 -0.205 1.00 . B A . 101 BGC H3 1 1 6 1740 2 2 1 . H4 H 12.208 -19.213 -1.522 1.00 . B A . 101 BGC H4 1 1 6 1741 2 2 1 . H5 H 11.060 -16.631 -2.709 1.00 . B A . 101 BGC H5 1 1 6 1742 2 2 1 . H6 H 10.720 -16.921 -5.196 1.00 . B A . 101 BGC H6 1 1 6 1743 2 2 1 . H6C1 H 11.670 -19.337 -4.020 1.00 . B A . 101 BGC H6C1 1 1 6 1744 2 2 1 . H6C2 H 12.582 -17.871 -4.308 1.00 . B A . 101 BGC H6C2 1 1 6 1745 2 2 1 . HB H 10.215 -17.900 1.941 1.00 . B A . 101 BGC HB 1 1 6 1746 2 2 1 . HC H 13.208 -17.422 0.867 1.00 . B A . 101 BGC HC 1 1 6 1747 2 2 1 . HD H 14.047 -18.109 -1.187 1.00 . B A . 101 BGC HD 1 1 6 1748 2 2 1 . O2 O 9.618 -17.666 1.209 1.00 . B A . 101 BGC O2 1 1 6 1749 2 2 1 . O3 O 12.446 -18.018 0.880 1.00 . B A . 101 BGC O3 1 1 6 1750 2 2 1 . O4 O 13.438 -17.588 -1.734 1.00 . B A . 101 BGC O4 1 1 6 1751 2 2 1 . O5 O 9.879 -18.298 -2.385 1.00 . B A . 101 BGC O5 1 1 6 1752 2 2 1 . O6 O 10.670 -17.879 -5.077 1.00 . B A . 101 BGC O6 1 1 7 1753 1 1 1 ILE C C 4.704 -1.165 -3.650 1.00 . A A . 1 ILE C 1 1 7 1754 1 1 1 ILE CA C 4.812 -0.346 -4.943 1.00 . A A . 1 ILE CA 1 1 7 1755 1 1 1 ILE CB C 6.092 -0.660 -5.770 1.00 . A A . 1 ILE CB 1 1 7 1756 1 1 1 ILE CD1 C 8.670 -0.861 -5.736 1.00 . A A . 1 ILE CD1 1 1 7 1757 1 1 1 ILE CG1 C 7.414 -0.332 -5.028 1.00 . A A . 1 ILE CG1 1 1 7 1758 1 1 1 ILE CG2 C 6.034 0.021 -7.153 1.00 . A A . 1 ILE CG2 1 1 7 1759 1 1 1 ILE H1 H 4.797 1.670 -5.405 1.00 . A A . 1 ILE H1 1 1 7 1760 1 1 1 ILE HA H 3.931 -0.576 -5.542 1.00 . A A . 1 ILE HA 1 1 7 1761 1 1 1 ILE HB H 6.093 -1.736 -5.958 1.00 . A A . 1 ILE HB 1 1 7 1762 1 1 1 ILE HD11 H 9.559 -0.677 -5.131 1.00 . A A . 1 ILE HD11 1 1 7 1763 1 1 1 ILE HD12 H 8.611 -1.937 -5.907 1.00 . A A . 1 ILE HD12 1 1 7 1764 1 1 1 ILE HD13 H 8.837 -0.375 -6.698 1.00 . A A . 1 ILE HD13 1 1 7 1765 1 1 1 ILE HG12 H 7.524 0.744 -4.885 1.00 . A A . 1 ILE HG12 1 1 7 1766 1 1 1 ILE HG13 H 7.406 -0.772 -4.029 1.00 . A A . 1 ILE HG13 1 1 7 1767 1 1 1 ILE HG21 H 6.155 1.104 -7.093 1.00 . A A . 1 ILE HG21 1 1 7 1768 1 1 1 ILE HG22 H 6.822 -0.349 -7.810 1.00 . A A . 1 ILE HG22 1 1 7 1769 1 1 1 ILE HG23 H 5.094 -0.183 -7.666 1.00 . A A . 1 ILE HG23 1 1 7 1770 1 1 1 ILE N N 4.752 1.084 -4.588 1.00 . A A . 1 ILE N 1 1 7 1771 1 1 1 ILE O O 4.739 -0.573 -2.574 1.00 . A A . 1 ILE O 1 1 7 1772 1 1 2 LEU C C 6.032 -3.614 -2.109 1.00 . A A . 2 LEU C 1 1 7 1773 1 1 2 LEU CA C 4.576 -3.395 -2.585 1.00 . A A . 2 LEU CA 1 1 7 1774 1 1 2 LEU CB C 4.002 -4.767 -3.021 1.00 . A A . 2 LEU CB 1 1 7 1775 1 1 2 LEU CD1 C 1.862 -4.033 -4.268 1.00 . A A . 2 LEU CD1 1 1 7 1776 1 1 2 LEU CD2 C 2.004 -6.309 -3.207 1.00 . A A . 2 LEU CD2 1 1 7 1777 1 1 2 LEU CG C 2.460 -4.845 -3.106 1.00 . A A . 2 LEU CG 1 1 7 1778 1 1 2 LEU H H 4.614 -2.938 -4.646 1.00 . A A . 2 LEU H 1 1 7 1779 1 1 2 LEU HA H 3.970 -2.966 -1.785 1.00 . A A . 2 LEU HA 1 1 7 1780 1 1 2 LEU HB2 H 4.451 -5.084 -3.964 1.00 . A A . 2 LEU HB2 1 1 7 1781 1 1 2 LEU HB3 H 4.320 -5.519 -2.294 1.00 . A A . 2 LEU HB3 1 1 7 1782 1 1 2 LEU HD11 H 0.786 -4.189 -4.337 1.00 . A A . 2 LEU HD11 1 1 7 1783 1 1 2 LEU HD12 H 2.294 -4.323 -5.226 1.00 . A A . 2 LEU HD12 1 1 7 1784 1 1 2 LEU HD13 H 2.007 -2.962 -4.135 1.00 . A A . 2 LEU HD13 1 1 7 1785 1 1 2 LEU HD21 H 2.369 -6.781 -4.121 1.00 . A A . 2 LEU HD21 1 1 7 1786 1 1 2 LEU HD22 H 0.916 -6.384 -3.214 1.00 . A A . 2 LEU HD22 1 1 7 1787 1 1 2 LEU HD23 H 2.359 -6.901 -2.363 1.00 . A A . 2 LEU HD23 1 1 7 1788 1 1 2 LEU HG H 2.045 -4.449 -2.177 1.00 . A A . 2 LEU HG 1 1 7 1789 1 1 2 LEU N N 4.577 -2.494 -3.741 1.00 . A A . 2 LEU N 1 1 7 1790 1 1 2 LEU O O 6.945 -3.529 -2.937 1.00 . A A . 2 LEU O 1 1 7 1791 1 1 3 PRO C C 8.073 -5.601 -0.792 1.00 . A A . 3 PRO C 1 1 7 1792 1 1 3 PRO CA C 7.616 -4.217 -0.304 1.00 . A A . 3 PRO CA 1 1 7 1793 1 1 3 PRO CB C 7.476 -4.154 1.225 1.00 . A A . 3 PRO CB 1 1 7 1794 1 1 3 PRO CD C 5.270 -3.997 0.253 1.00 . A A . 3 PRO CD 1 1 7 1795 1 1 3 PRO CG C 6.015 -4.484 1.499 1.00 . A A . 3 PRO CG 1 1 7 1796 1 1 3 PRO HA H 8.321 -3.453 -0.639 1.00 . A A . 3 PRO HA 1 1 7 1797 1 1 3 PRO HB2 H 8.159 -4.822 1.751 1.00 . A A . 3 PRO HB2 1 1 7 1798 1 1 3 PRO HB3 H 7.688 -3.141 1.566 1.00 . A A . 3 PRO HB3 1 1 7 1799 1 1 3 PRO HD2 H 4.448 -4.668 0.000 1.00 . A A . 3 PRO HD2 1 1 7 1800 1 1 3 PRO HD3 H 4.856 -3.002 0.432 1.00 . A A . 3 PRO HD3 1 1 7 1801 1 1 3 PRO HG2 H 5.898 -5.566 1.591 1.00 . A A . 3 PRO HG2 1 1 7 1802 1 1 3 PRO HG3 H 5.642 -4.032 2.419 1.00 . A A . 3 PRO HG3 1 1 7 1803 1 1 3 PRO N N 6.273 -3.917 -0.814 1.00 . A A . 3 PRO N 1 1 7 1804 1 1 3 PRO O O 7.376 -6.596 -0.601 1.00 . A A . 3 PRO O 1 1 7 1805 1 1 4 TRP C C 10.141 -7.996 -1.186 1.00 . A A . 4 TRP C 1 1 7 1806 1 1 4 TRP CA C 9.771 -6.835 -2.132 1.00 . A A . 4 TRP CA 1 1 7 1807 1 1 4 TRP CB C 11.024 -6.387 -2.919 1.00 . A A . 4 TRP CB 1 1 7 1808 1 1 4 TRP CD1 C 10.891 -7.434 -5.218 1.00 . A A . 4 TRP CD1 1 1 7 1809 1 1 4 TRP CD2 C 12.683 -8.146 -4.070 1.00 . A A . 4 TRP CD2 1 1 7 1810 1 1 4 TRP CE2 C 12.743 -8.761 -5.361 1.00 . A A . 4 TRP CE2 1 1 7 1811 1 1 4 TRP CE3 C 13.722 -8.466 -3.165 1.00 . A A . 4 TRP CE3 1 1 7 1812 1 1 4 TRP CG C 11.497 -7.293 -4.018 1.00 . A A . 4 TRP CG 1 1 7 1813 1 1 4 TRP CH2 C 14.789 -9.934 -4.806 1.00 . A A . 4 TRP CH2 1 1 7 1814 1 1 4 TRP CZ2 C 13.778 -9.632 -5.736 1.00 . A A . 4 TRP CZ2 1 1 7 1815 1 1 4 TRP CZ3 C 14.762 -9.350 -3.525 1.00 . A A . 4 TRP CZ3 1 1 7 1816 1 1 4 TRP H H 9.736 -4.786 -1.573 1.00 . A A . 4 TRP H 1 1 7 1817 1 1 4 TRP HA H 9.002 -7.180 -2.828 1.00 . A A . 4 TRP HA 1 1 7 1818 1 1 4 TRP HB2 H 10.822 -5.430 -3.399 1.00 . A A . 4 TRP HB2 1 1 7 1819 1 1 4 TRP HB3 H 11.862 -6.201 -2.244 1.00 . A A . 4 TRP HB3 1 1 7 1820 1 1 4 TRP HD1 H 9.998 -6.899 -5.516 1.00 . A A . 4 TRP HD1 1 1 7 1821 1 1 4 TRP HE1 H 11.401 -8.448 -6.988 1.00 . A A . 4 TRP HE1 1 1 7 1822 1 1 4 TRP HE3 H 13.728 -8.020 -2.180 1.00 . A A . 4 TRP HE3 1 1 7 1823 1 1 4 TRP HH2 H 15.599 -10.595 -5.083 1.00 . A A . 4 TRP HH2 1 1 7 1824 1 1 4 TRP HZ2 H 13.809 -10.064 -6.728 1.00 . A A . 4 TRP HZ2 1 1 7 1825 1 1 4 TRP HZ3 H 15.550 -9.569 -2.818 1.00 . A A . 4 TRP HZ3 1 1 7 1826 1 1 4 TRP N N 9.252 -5.660 -1.425 1.00 . A A . 4 TRP N 1 1 7 1827 1 1 4 TRP NE1 N 11.610 -8.312 -6.003 1.00 . A A . 4 TRP NE1 1 1 7 1828 1 1 4 TRP O O 10.118 -9.156 -1.609 1.00 . A A . 4 TRP O 1 1 7 1829 1 1 5 LYS C C 12.175 -9.285 0.970 1.00 . A A . 5 LYS C 1 1 7 1830 1 1 5 LYS CA C 10.879 -8.481 1.213 1.00 . A A . 5 LYS CA 1 1 7 1831 1 1 5 LYS CB C 9.730 -9.423 1.653 1.00 . A A . 5 LYS CB 1 1 7 1832 1 1 5 LYS CD C 7.536 -9.793 2.839 1.00 . A A . 5 LYS CD 1 1 7 1833 1 1 5 LYS CE C 6.255 -9.290 3.533 1.00 . A A . 5 LYS CE 1 1 7 1834 1 1 5 LYS CG C 8.500 -8.731 2.280 1.00 . A A . 5 LYS CG 1 1 7 1835 1 1 5 LYS H H 10.464 -6.657 0.238 1.00 . A A . 5 LYS H 1 1 7 1836 1 1 5 LYS HA H 11.097 -7.795 2.031 1.00 . A A . 5 LYS HA 1 1 7 1837 1 1 5 LYS HB2 H 9.415 -10.047 0.815 1.00 . A A . 5 LYS HB2 1 1 7 1838 1 1 5 LYS HB3 H 10.119 -10.123 2.395 1.00 . A A . 5 LYS HB3 1 1 7 1839 1 1 5 LYS HD2 H 7.285 -10.457 2.015 1.00 . A A . 5 LYS HD2 1 1 7 1840 1 1 5 LYS HD3 H 8.087 -10.386 3.564 1.00 . A A . 5 LYS HD3 1 1 7 1841 1 1 5 LYS HE2 H 6.524 -8.635 4.363 1.00 . A A . 5 LYS HE2 1 1 7 1842 1 1 5 LYS HE3 H 5.648 -8.701 2.845 1.00 . A A . 5 LYS HE3 1 1 7 1843 1 1 5 LYS HG2 H 8.813 -8.056 3.078 1.00 . A A . 5 LYS HG2 1 1 7 1844 1 1 5 LYS HG3 H 7.994 -8.121 1.530 1.00 . A A . 5 LYS HG3 1 1 7 1845 1 1 5 LYS HZ1 H 4.803 -10.111 4.777 1.00 . A A . 5 LYS HZ1 1 1 7 1846 1 1 5 LYS HZ2 H 6.048 -11.149 4.438 1.00 . A A . 5 LYS HZ2 1 1 7 1847 1 1 5 LYS HZ3 H 4.912 -10.860 3.325 1.00 . A A . 5 LYS HZ3 1 1 7 1848 1 1 5 LYS N N 10.489 -7.651 0.068 1.00 . A A . 5 LYS N 1 1 7 1849 1 1 5 LYS NZ N 5.447 -10.418 4.062 1.00 . A A . 5 LYS NZ 1 1 7 1850 1 1 5 LYS O O 12.594 -9.504 -0.166 1.00 . A A . 5 LYS O 1 1 7 1851 1 1 6 TRP C C 13.208 -12.282 1.621 1.00 . A A . 6 TRP C 1 1 7 1852 1 1 6 TRP CA C 13.797 -10.892 1.998 1.00 . A A . 6 TRP CA 1 1 7 1853 1 1 6 TRP CB C 14.501 -10.935 3.378 1.00 . A A . 6 TRP CB 1 1 7 1854 1 1 6 TRP CD1 C 13.513 -12.244 5.311 1.00 . A A . 6 TRP CD1 1 1 7 1855 1 1 6 TRP CD2 C 12.810 -10.110 5.284 1.00 . A A . 6 TRP CD2 1 1 7 1856 1 1 6 TRP CE2 C 12.170 -10.745 6.394 1.00 . A A . 6 TRP CE2 1 1 7 1857 1 1 6 TRP CE3 C 12.536 -8.733 5.093 1.00 . A A . 6 TRP CE3 1 1 7 1858 1 1 6 TRP CG C 13.644 -11.101 4.602 1.00 . A A . 6 TRP CG 1 1 7 1859 1 1 6 TRP CH2 C 11.009 -8.706 7.005 1.00 . A A . 6 TRP CH2 1 1 7 1860 1 1 6 TRP CZ2 C 11.276 -10.067 7.238 1.00 . A A . 6 TRP CZ2 1 1 7 1861 1 1 6 TRP CZ3 C 11.645 -8.039 5.938 1.00 . A A . 6 TRP CZ3 1 1 7 1862 1 1 6 TRP H H 12.374 -9.663 2.953 1.00 . A A . 6 TRP H 1 1 7 1863 1 1 6 TRP HA H 14.538 -10.635 1.239 1.00 . A A . 6 TRP HA 1 1 7 1864 1 1 6 TRP HB2 H 15.250 -11.730 3.378 1.00 . A A . 6 TRP HB2 1 1 7 1865 1 1 6 TRP HB3 H 15.074 -10.018 3.515 1.00 . A A . 6 TRP HB3 1 1 7 1866 1 1 6 TRP HD1 H 14.016 -13.171 5.070 1.00 . A A . 6 TRP HD1 1 1 7 1867 1 1 6 TRP HE1 H 12.420 -12.759 7.040 1.00 . A A . 6 TRP HE1 1 1 7 1868 1 1 6 TRP HE3 H 13.042 -8.194 4.306 1.00 . A A . 6 TRP HE3 1 1 7 1869 1 1 6 TRP HH2 H 10.343 -8.166 7.662 1.00 . A A . 6 TRP HH2 1 1 7 1870 1 1 6 TRP HZ2 H 10.812 -10.582 8.068 1.00 . A A . 6 TRP HZ2 1 1 7 1871 1 1 6 TRP HZ3 H 11.471 -6.982 5.789 1.00 . A A . 6 TRP HZ3 1 1 7 1872 1 1 6 TRP N N 12.743 -9.866 2.034 1.00 . A A . 6 TRP N 1 1 7 1873 1 1 6 TRP NE1 N 12.650 -12.035 6.367 1.00 . A A . 6 TRP NE1 1 1 7 1874 1 1 6 TRP O O 13.656 -13.320 2.091 1.00 . A A . 6 TRP O 1 1 7 1875 1 1 7 LYS C C 10.399 -14.052 1.240 1.00 . A A . 7 LYS C 1 1 7 1876 1 1 7 LYS CA C 11.408 -13.435 0.261 1.00 . A A . 7 LYS CA 1 1 7 1877 1 1 7 LYS CB C 12.290 -14.405 -0.551 1.00 . A A . 7 LYS CB 1 1 7 1878 1 1 7 LYS CD C 12.349 -13.034 -2.803 1.00 . A A . 7 LYS CD 1 1 7 1879 1 1 7 LYS CE C 12.027 -11.555 -2.502 1.00 . A A . 7 LYS CE 1 1 7 1880 1 1 7 LYS CG C 13.134 -13.743 -1.673 1.00 . A A . 7 LYS CG 1 1 7 1881 1 1 7 LYS H H 11.895 -11.373 0.461 1.00 . A A . 7 LYS H 1 1 7 1882 1 1 7 LYS HA H 10.709 -13.014 -0.456 1.00 . A A . 7 LYS HA 1 1 7 1883 1 1 7 LYS HB2 H 12.961 -14.935 0.128 1.00 . A A . 7 LYS HB2 1 1 7 1884 1 1 7 LYS HB3 H 11.662 -15.182 -0.990 1.00 . A A . 7 LYS HB3 1 1 7 1885 1 1 7 LYS HD2 H 12.965 -13.068 -3.704 1.00 . A A . 7 LYS HD2 1 1 7 1886 1 1 7 LYS HD3 H 11.445 -13.599 -3.036 1.00 . A A . 7 LYS HD3 1 1 7 1887 1 1 7 LYS HE2 H 11.393 -11.449 -1.629 1.00 . A A . 7 LYS HE2 1 1 7 1888 1 1 7 LYS HE3 H 12.942 -11.009 -2.278 1.00 . A A . 7 LYS HE3 1 1 7 1889 1 1 7 LYS HG2 H 13.871 -13.063 -1.241 1.00 . A A . 7 LYS HG2 1 1 7 1890 1 1 7 LYS HG3 H 13.730 -14.537 -2.126 1.00 . A A . 7 LYS HG3 1 1 7 1891 1 1 7 LYS HZ1 H 11.951 -10.607 -4.327 1.00 . A A . 7 LYS HZ1 1 1 7 1892 1 1 7 LYS HZ2 H 10.929 -10.021 -3.186 1.00 . A A . 7 LYS HZ2 1 1 7 1893 1 1 7 LYS HZ3 H 10.551 -11.426 -3.952 1.00 . A A . 7 LYS HZ3 1 1 7 1894 1 1 7 LYS N N 12.138 -12.288 0.812 1.00 . A A . 7 LYS N 1 1 7 1895 1 1 7 LYS NZ N 11.311 -10.874 -3.588 1.00 . A A . 7 LYS NZ 1 1 7 1896 1 1 7 LYS O O 9.671 -14.979 0.893 1.00 . A A . 7 LYS O 1 1 7 1897 1 1 8 TRP C C 7.818 -13.291 3.081 1.00 . A A . 8 TRP C 1 1 7 1898 1 1 8 TRP CA C 9.279 -13.620 3.491 1.00 . A A . 8 TRP CA 1 1 7 1899 1 1 8 TRP CB C 9.769 -12.733 4.654 1.00 . A A . 8 TRP CB 1 1 7 1900 1 1 8 TRP CD1 C 8.397 -12.375 6.760 1.00 . A A . 8 TRP CD1 1 1 7 1901 1 1 8 TRP CD2 C 9.800 -14.122 6.913 1.00 . A A . 8 TRP CD2 1 1 7 1902 1 1 8 TRP CE2 C 9.124 -14.023 8.166 1.00 . A A . 8 TRP CE2 1 1 7 1903 1 1 8 TRP CE3 C 10.768 -15.147 6.783 1.00 . A A . 8 TRP CE3 1 1 7 1904 1 1 8 TRP CG C 9.308 -13.067 6.037 1.00 . A A . 8 TRP CG 1 1 7 1905 1 1 8 TRP CH2 C 10.350 -15.910 9.069 1.00 . A A . 8 TRP CH2 1 1 7 1906 1 1 8 TRP CZ2 C 9.384 -14.901 9.232 1.00 . A A . 8 TRP CZ2 1 1 7 1907 1 1 8 TRP CZ3 C 11.041 -16.030 7.847 1.00 . A A . 8 TRP CZ3 1 1 7 1908 1 1 8 TRP H H 10.971 -12.736 2.591 1.00 . A A . 8 TRP H 1 1 7 1909 1 1 8 TRP HA H 9.329 -14.668 3.794 1.00 . A A . 8 TRP HA 1 1 7 1910 1 1 8 TRP HB2 H 10.852 -12.814 4.702 1.00 . A A . 8 TRP HB2 1 1 7 1911 1 1 8 TRP HB3 H 9.576 -11.680 4.458 1.00 . A A . 8 TRP HB3 1 1 7 1912 1 1 8 TRP HD1 H 7.869 -11.505 6.405 1.00 . A A . 8 TRP HD1 1 1 7 1913 1 1 8 TRP HE1 H 7.653 -12.606 8.733 1.00 . A A . 8 TRP HE1 1 1 7 1914 1 1 8 TRP HE3 H 11.310 -15.252 5.855 1.00 . A A . 8 TRP HE3 1 1 7 1915 1 1 8 TRP HH2 H 10.564 -16.590 9.881 1.00 . A A . 8 TRP HH2 1 1 7 1916 1 1 8 TRP HZ2 H 8.855 -14.804 10.169 1.00 . A A . 8 TRP HZ2 1 1 7 1917 1 1 8 TRP HZ3 H 11.787 -16.805 7.728 1.00 . A A . 8 TRP HZ3 1 1 7 1918 1 1 8 TRP N N 10.246 -13.413 2.406 1.00 . A A . 8 TRP N 1 1 7 1919 1 1 8 TRP NE1 N 8.274 -12.949 8.009 1.00 . A A . 8 TRP NE1 1 1 7 1920 1 1 8 TRP O O 7.028 -12.757 3.865 1.00 . A A . 8 TRP O 1 1 7 1921 1 1 9 THR C C 6.365 -14.517 -0.083 1.00 . A A . 9 THR C 1 1 7 1922 1 1 9 THR CA C 6.150 -13.780 1.261 1.00 . A A . 9 THR CA 1 1 7 1923 1 1 9 THR CB C 5.266 -12.485 1.237 1.00 . A A . 9 THR CB 1 1 7 1924 1 1 9 THR CG2 C 5.189 -11.590 -0.013 1.00 . A A . 9 THR CG2 1 1 7 1925 1 1 9 THR H H 8.224 -13.993 1.281 1.00 . A A . 9 THR H 1 1 7 1926 1 1 9 THR HA H 5.670 -14.465 1.962 1.00 . A A . 9 THR HA 1 1 7 1927 1 1 9 THR HB H 5.681 -11.826 1.980 1.00 . A A . 9 THR HB 1 1 7 1928 1 1 9 THR HG21 H 4.703 -12.091 -0.851 1.00 . A A . 9 THR HG21 1 1 7 1929 1 1 9 THR HG22 H 6.182 -11.288 -0.339 1.00 . A A . 9 THR HG22 1 1 7 1930 1 1 9 THR HG23 H 4.617 -10.684 0.189 1.00 . A A . 9 THR HG23 1 1 7 1931 1 1 9 THR N N 7.476 -13.554 1.816 1.00 . A A . 9 THR N 1 1 7 1932 1 1 9 THR O O 6.523 -13.863 -1.114 1.00 . A A . 9 THR O 1 1 7 1933 1 1 9 THR OG1 O 3.942 -12.740 1.731 1.00 . A A . 9 THR OG1 1 1 7 1934 1 1 10 PRO C C 5.087 -16.744 -1.931 1.00 . A A . 10 PRO C 1 1 7 1935 1 1 10 PRO CA C 6.517 -16.596 -1.378 1.00 . A A . 10 PRO CA 1 1 7 1936 1 1 10 PRO CB C 7.124 -17.952 -0.991 1.00 . A A . 10 PRO CB 1 1 7 1937 1 1 10 PRO CD C 6.590 -16.762 1.040 1.00 . A A . 10 PRO CD 1 1 7 1938 1 1 10 PRO CG C 6.686 -18.175 0.452 1.00 . A A . 10 PRO CG 1 1 7 1939 1 1 10 PRO HA H 7.154 -16.097 -2.109 1.00 . A A . 10 PRO HA 1 1 7 1940 1 1 10 PRO HB2 H 6.830 -18.763 -1.657 1.00 . A A . 10 PRO HB2 1 1 7 1941 1 1 10 PRO HB3 H 8.212 -17.879 -1.032 1.00 . A A . 10 PRO HB3 1 1 7 1942 1 1 10 PRO HD2 H 5.737 -16.691 1.719 1.00 . A A . 10 PRO HD2 1 1 7 1943 1 1 10 PRO HD3 H 7.496 -16.517 1.596 1.00 . A A . 10 PRO HD3 1 1 7 1944 1 1 10 PRO HG2 H 5.702 -18.647 0.466 1.00 . A A . 10 PRO HG2 1 1 7 1945 1 1 10 PRO HG3 H 7.370 -18.817 1.007 1.00 . A A . 10 PRO HG3 1 1 7 1946 1 1 10 PRO N N 6.463 -15.862 -0.111 1.00 . A A . 10 PRO N 1 1 7 1947 1 1 10 PRO O O 4.164 -17.060 -1.183 1.00 . A A . 10 PRO O 1 1 7 1948 1 1 11 TRP C C 3.482 -18.248 -4.373 1.00 . A A . 11 TRP C 1 1 7 1949 1 1 11 TRP CA C 3.614 -16.767 -3.939 1.00 . A A . 11 TRP CA 1 1 7 1950 1 1 11 TRP CB C 3.565 -15.815 -5.164 1.00 . A A . 11 TRP CB 1 1 7 1951 1 1 11 TRP CD1 C 1.034 -16.012 -5.468 1.00 . A A . 11 TRP CD1 1 1 7 1952 1 1 11 TRP CD2 C 1.873 -14.124 -6.343 1.00 . A A . 11 TRP CD2 1 1 7 1953 1 1 11 TRP CE2 C 0.460 -14.088 -6.557 1.00 . A A . 11 TRP CE2 1 1 7 1954 1 1 11 TRP CE3 C 2.617 -13.025 -6.834 1.00 . A A . 11 TRP CE3 1 1 7 1955 1 1 11 TRP CG C 2.210 -15.361 -5.640 1.00 . A A . 11 TRP CG 1 1 7 1956 1 1 11 TRP CH2 C 0.594 -11.954 -7.695 1.00 . A A . 11 TRP CH2 1 1 7 1957 1 1 11 TRP CZ2 C -0.178 -13.028 -7.220 1.00 . A A . 11 TRP CZ2 1 1 7 1958 1 1 11 TRP CZ3 C 1.990 -11.954 -7.504 1.00 . A A . 11 TRP CZ3 1 1 7 1959 1 1 11 TRP H H 5.684 -16.301 -3.815 1.00 . A A . 11 TRP H 1 1 7 1960 1 1 11 TRP HA H 2.791 -16.523 -3.265 1.00 . A A . 11 TRP HA 1 1 7 1961 1 1 11 TRP HB2 H 4.088 -14.893 -4.907 1.00 . A A . 11 TRP HB2 1 1 7 1962 1 1 11 TRP HB3 H 4.103 -16.233 -6.017 1.00 . A A . 11 TRP HB3 1 1 7 1963 1 1 11 TRP HD1 H 0.919 -16.971 -4.984 1.00 . A A . 11 TRP HD1 1 1 7 1964 1 1 11 TRP HE1 H -0.955 -15.587 -6.011 1.00 . A A . 11 TRP HE1 1 1 7 1965 1 1 11 TRP HE3 H 3.690 -13.013 -6.708 1.00 . A A . 11 TRP HE3 1 1 7 1966 1 1 11 TRP HH2 H 0.116 -11.135 -8.215 1.00 . A A . 11 TRP HH2 1 1 7 1967 1 1 11 TRP HZ2 H -1.248 -13.038 -7.370 1.00 . A A . 11 TRP HZ2 1 1 7 1968 1 1 11 TRP HZ3 H 2.580 -11.134 -7.882 1.00 . A A . 11 TRP HZ3 1 1 7 1969 1 1 11 TRP N N 4.897 -16.564 -3.245 1.00 . A A . 11 TRP N 1 1 7 1970 1 1 11 TRP NE1 N 0.004 -15.257 -5.990 1.00 . A A . 11 TRP NE1 1 1 7 1971 1 1 11 TRP O O 2.940 -18.566 -5.425 1.00 . A A . 11 TRP O 1 1 7 1972 1 1 12 ARG C C 4.344 -21.191 -2.316 1.00 . A A . 12 ARG C 1 1 7 1973 1 1 12 ARG CA C 3.941 -20.615 -3.682 1.00 . A A . 12 ARG CA 1 1 7 1974 1 1 12 ARG CB C 4.755 -21.150 -4.890 1.00 . A A . 12 ARG CB 1 1 7 1975 1 1 12 ARG CD C 7.091 -21.860 -4.025 1.00 . A A . 12 ARG CD 1 1 7 1976 1 1 12 ARG CG C 6.280 -20.888 -4.901 1.00 . A A . 12 ARG CG 1 1 7 1977 1 1 12 ARG CZ C 9.227 -23.155 -4.250 1.00 . A A . 12 ARG CZ 1 1 7 1978 1 1 12 ARG H H 4.366 -18.838 -2.673 1.00 . A A . 12 ARG H 1 1 7 1979 1 1 12 ARG HA H 2.889 -20.864 -3.839 1.00 . A A . 12 ARG HA 1 1 7 1980 1 1 12 ARG HB2 H 4.570 -22.218 -5.011 1.00 . A A . 12 ARG HB2 1 1 7 1981 1 1 12 ARG HB3 H 4.340 -20.708 -5.797 1.00 . A A . 12 ARG HB3 1 1 7 1982 1 1 12 ARG HD2 H 7.164 -21.495 -2.999 1.00 . A A . 12 ARG HD2 1 1 7 1983 1 1 12 ARG HD3 H 6.572 -22.818 -3.997 1.00 . A A . 12 ARG HD3 1 1 7 1984 1 1 12 ARG HE H 8.768 -21.401 -5.201 1.00 . A A . 12 ARG HE 1 1 7 1985 1 1 12 ARG HG2 H 6.619 -20.969 -5.935 1.00 . A A . 12 ARG HG2 1 1 7 1986 1 1 12 ARG HG3 H 6.479 -19.857 -4.607 1.00 . A A . 12 ARG HG3 1 1 7 1987 1 1 12 ARG HH11 H 7.967 -23.963 -2.813 1.00 . A A . 12 ARG HH11 1 1 7 1988 1 1 12 ARG HH12 H 9.392 -24.876 -3.110 1.00 . A A . 12 ARG HH12 1 1 7 1989 1 1 12 ARG HH21 H 10.711 -22.672 -5.598 1.00 . A A . 12 ARG HH21 1 1 7 1990 1 1 12 ARG HH22 H 11.032 -24.064 -4.664 1.00 . A A . 12 ARG HH22 1 1 7 1991 1 1 12 ARG N N 4.024 -19.168 -3.569 1.00 . A A . 12 ARG N 1 1 7 1992 1 1 12 ARG NE N 8.439 -22.113 -4.561 1.00 . A A . 12 ARG NE 1 1 7 1993 1 1 12 ARG NH1 N 8.847 -24.056 -3.339 1.00 . A A . 12 ARG NH1 1 1 7 1994 1 1 12 ARG NH2 N 10.406 -23.292 -4.860 1.00 . A A . 12 ARG NH2 1 1 7 1995 1 1 12 ARG O O 4.897 -20.476 -1.479 1.00 . A A . 12 ARG O 1 1 7 1996 1 1 13 ARG C C 6.058 -23.317 -0.832 1.00 . A A . 13 ARG C 1 1 7 1997 1 1 13 ARG CA C 4.522 -23.174 -0.857 1.00 . A A . 13 ARG CA 1 1 7 1998 1 1 13 ARG CB C 3.862 -24.570 -0.808 1.00 . A A . 13 ARG CB 1 1 7 1999 1 1 13 ARG CD C 1.817 -24.279 0.758 1.00 . A A . 13 ARG CD 1 1 7 2000 1 1 13 ARG CG C 2.321 -24.550 -0.673 1.00 . A A . 13 ARG CG 1 1 7 2001 1 1 13 ARG CZ C 1.845 -25.499 2.957 1.00 . A A . 13 ARG CZ 1 1 7 2002 1 1 13 ARG H H 3.704 -23.039 -2.824 1.00 . A A . 13 ARG H 1 1 7 2003 1 1 13 ARG HA H 4.200 -22.586 0.005 1.00 . A A . 13 ARG HA 1 1 7 2004 1 1 13 ARG HB2 H 4.124 -25.117 -1.717 1.00 . A A . 13 ARG HB2 1 1 7 2005 1 1 13 ARG HB3 H 4.289 -25.153 0.008 1.00 . A A . 13 ARG HB3 1 1 7 2006 1 1 13 ARG HD2 H 2.323 -23.417 1.189 1.00 . A A . 13 ARG HD2 1 1 7 2007 1 1 13 ARG HD3 H 0.752 -24.039 0.728 1.00 . A A . 13 ARG HD3 1 1 7 2008 1 1 13 ARG HE H 2.162 -26.315 1.112 1.00 . A A . 13 ARG HE 1 1 7 2009 1 1 13 ARG HG2 H 1.889 -23.813 -1.352 1.00 . A A . 13 ARG HG2 1 1 7 2010 1 1 13 ARG HG3 H 1.925 -25.509 -1.013 1.00 . A A . 13 ARG HG3 1 1 7 2011 1 1 13 ARG HH11 H 1.331 -23.525 3.190 1.00 . A A . 13 ARG HH11 1 1 7 2012 1 1 13 ARG HH12 H 1.406 -24.406 4.656 1.00 . A A . 13 ARG HH12 1 1 7 2013 1 1 13 ARG HH21 H 2.259 -27.513 3.116 1.00 . A A . 13 ARG HH21 1 1 7 2014 1 1 13 ARG HH22 H 1.915 -26.744 4.602 1.00 . A A . 13 ARG HH22 1 1 7 2015 1 1 13 ARG N N 4.118 -22.490 -2.087 1.00 . A A . 13 ARG N 1 1 7 2016 1 1 13 ARG NE N 1.988 -25.458 1.625 1.00 . A A . 13 ARG NE 1 1 7 2017 1 1 13 ARG NH1 N 1.522 -24.404 3.651 1.00 . A A . 13 ARG NH1 1 1 7 2018 1 1 13 ARG NH2 N 2.030 -26.654 3.599 1.00 . A A . 13 ARG NH2 1 1 7 2019 1 1 13 ARG O O 6.651 -23.966 -1.694 1.00 . A A . 13 ARG O 1 1 7 2020 1 1 14 NH2 HN1 H 7.727 -22.757 0.177 1.00 . A A . 14 NH2 HN1 1 1 7 2021 1 1 14 NH2 HN2 H 6.233 -22.050 0.742 1.00 . A A . 14 NH2 HN2 1 1 7 2022 1 1 14 NH2 N N 6.724 -22.676 0.120 1.00 . A A . 14 NH2 N 1 1 7 2023 2 2 1 . C1 C 3.133 -13.690 1.059 1.00 . B A . 101 BGC C1 1 1 7 2024 2 2 1 . C2 C 2.047 -14.177 2.026 1.00 . B A . 101 BGC C2 1 1 7 2025 2 2 1 . C3 C 1.207 -15.245 1.335 1.00 . B A . 101 BGC C3 1 1 7 2026 2 2 1 . C4 C 0.650 -14.703 0.020 1.00 . B A . 101 BGC C4 1 1 7 2027 2 2 1 . C5 C 1.805 -14.176 -0.872 1.00 . B A . 101 BGC C5 1 1 7 2028 2 2 1 . C6 C 1.335 -13.522 -2.186 1.00 . B A . 101 BGC C6 1 1 7 2029 2 2 1 . H1 H 3.757 -14.540 0.763 1.00 . B A . 101 BGC H1 1 1 7 2030 2 2 1 . H2 H 1.420 -13.332 2.315 1.00 . B A . 101 BGC H2 1 1 7 2031 2 2 1 . H3 H 1.831 -16.113 1.113 1.00 . B A . 101 BGC H3 1 1 7 2032 2 2 1 . H4 H -0.038 -13.881 0.222 1.00 . B A . 101 BGC H4 1 1 7 2033 2 2 1 . H5 H 2.470 -15.002 -1.127 1.00 . B A . 101 BGC H5 1 1 7 2034 2 2 1 . H6 H 0.458 -14.131 -3.864 1.00 . B A . 101 BGC H6 1 1 7 2035 2 2 1 . H6C1 H 2.204 -13.258 -2.794 1.00 . B A . 101 BGC H6C1 1 1 7 2036 2 2 1 . H6C2 H 0.800 -12.593 -1.982 1.00 . B A . 101 BGC H6C2 1 1 7 2037 2 2 1 . HB H 1.923 -15.160 3.669 1.00 . B A . 101 BGC HB 1 1 7 2038 2 2 1 . HC H -0.462 -16.155 1.589 1.00 . B A . 101 BGC HC 1 1 7 2039 2 2 1 . HD H -0.210 -15.441 -1.544 1.00 . B A . 101 BGC HD 1 1 7 2040 2 2 1 . O2 O 2.652 -14.734 3.187 1.00 . B A . 101 BGC O2 1 1 7 2041 2 2 1 . O3 O 0.141 -15.665 2.177 1.00 . B A . 101 BGC O3 1 1 7 2042 2 2 1 . O4 O -0.076 -15.746 -0.620 1.00 . B A . 101 BGC O4 1 1 7 2043 2 2 1 . O5 O 2.549 -13.195 -0.127 1.00 . B A . 101 BGC O5 1 1 7 2044 2 2 1 . O6 O 0.485 -14.399 -2.926 1.00 . B A . 101 BGC O6 1 1 8 2045 1 1 1 ILE C C 4.041 1.070 -0.389 1.00 . A A . 1 ILE C 1 1 8 2046 1 1 1 ILE CA C 4.090 2.602 -0.397 1.00 . A A . 1 ILE CA 1 1 8 2047 1 1 1 ILE CB C 5.518 3.159 -0.140 1.00 . A A . 1 ILE CB 1 1 8 2048 1 1 1 ILE CD1 C 7.586 3.054 1.408 1.00 . A A . 1 ILE CD1 1 1 8 2049 1 1 1 ILE CG1 C 6.074 2.830 1.271 1.00 . A A . 1 ILE CG1 1 1 8 2050 1 1 1 ILE CG2 C 5.571 4.673 -0.427 1.00 . A A . 1 ILE CG2 1 1 8 2051 1 1 1 ILE H1 H 3.391 2.602 1.475 1.00 . A A . 1 ILE H1 1 1 8 2052 1 1 1 ILE HA H 3.738 2.936 -1.376 1.00 . A A . 1 ILE HA 1 1 8 2053 1 1 1 ILE HB H 6.178 2.678 -0.867 1.00 . A A . 1 ILE HB 1 1 8 2054 1 1 1 ILE HD11 H 7.927 2.775 2.405 1.00 . A A . 1 ILE HD11 1 1 8 2055 1 1 1 ILE HD12 H 8.143 2.446 0.694 1.00 . A A . 1 ILE HD12 1 1 8 2056 1 1 1 ILE HD13 H 7.864 4.097 1.257 1.00 . A A . 1 ILE HD13 1 1 8 2057 1 1 1 ILE HG12 H 5.562 3.419 2.035 1.00 . A A . 1 ILE HG12 1 1 8 2058 1 1 1 ILE HG13 H 5.888 1.785 1.522 1.00 . A A . 1 ILE HG13 1 1 8 2059 1 1 1 ILE HG21 H 5.184 4.906 -1.421 1.00 . A A . 1 ILE HG21 1 1 8 2060 1 1 1 ILE HG22 H 5.004 5.257 0.298 1.00 . A A . 1 ILE HG22 1 1 8 2061 1 1 1 ILE HG23 H 6.595 5.047 -0.407 1.00 . A A . 1 ILE HG23 1 1 8 2062 1 1 1 ILE N N 3.143 3.086 0.622 1.00 . A A . 1 ILE N 1 1 8 2063 1 1 1 ILE O O 3.512 0.512 0.569 1.00 . A A . 1 ILE O 1 1 8 2064 1 1 2 LEU C C 6.110 -1.440 -1.004 1.00 . A A . 2 LEU C 1 1 8 2065 1 1 2 LEU CA C 4.698 -1.047 -1.497 1.00 . A A . 2 LEU CA 1 1 8 2066 1 1 2 LEU CB C 4.548 -1.486 -2.977 1.00 . A A . 2 LEU CB 1 1 8 2067 1 1 2 LEU CD1 C 2.219 -0.466 -3.425 1.00 . A A . 2 LEU CD1 1 1 8 2068 1 1 2 LEU CD2 C 3.053 -2.396 -4.811 1.00 . A A . 2 LEU CD2 1 1 8 2069 1 1 2 LEU CG C 3.089 -1.734 -3.426 1.00 . A A . 2 LEU CG 1 1 8 2070 1 1 2 LEU H H 5.067 0.920 -2.141 1.00 . A A . 2 LEU H 1 1 8 2071 1 1 2 LEU HA H 3.939 -1.532 -0.882 1.00 . A A . 2 LEU HA 1 1 8 2072 1 1 2 LEU HB2 H 5.036 -0.775 -3.646 1.00 . A A . 2 LEU HB2 1 1 8 2073 1 1 2 LEU HB3 H 5.087 -2.423 -3.130 1.00 . A A . 2 LEU HB3 1 1 8 2074 1 1 2 LEU HD11 H 2.652 0.317 -4.048 1.00 . A A . 2 LEU HD11 1 1 8 2075 1 1 2 LEU HD12 H 2.082 -0.072 -2.419 1.00 . A A . 2 LEU HD12 1 1 8 2076 1 1 2 LEU HD13 H 1.222 -0.680 -3.813 1.00 . A A . 2 LEU HD13 1 1 8 2077 1 1 2 LEU HD21 H 2.030 -2.630 -5.111 1.00 . A A . 2 LEU HD21 1 1 8 2078 1 1 2 LEU HD22 H 3.608 -3.335 -4.820 1.00 . A A . 2 LEU HD22 1 1 8 2079 1 1 2 LEU HD23 H 3.482 -1.750 -5.578 1.00 . A A . 2 LEU HD23 1 1 8 2080 1 1 2 LEU HG H 2.639 -2.444 -2.728 1.00 . A A . 2 LEU HG 1 1 8 2081 1 1 2 LEU N N 4.565 0.411 -1.426 1.00 . A A . 2 LEU N 1 1 8 2082 1 1 2 LEU O O 7.020 -0.604 -1.054 1.00 . A A . 2 LEU O 1 1 8 2083 1 1 3 PRO C C 8.587 -3.438 -1.260 1.00 . A A . 3 PRO C 1 1 8 2084 1 1 3 PRO CA C 7.635 -3.170 -0.076 1.00 . A A . 3 PRO CA 1 1 8 2085 1 1 3 PRO CB C 7.313 -4.442 0.731 1.00 . A A . 3 PRO CB 1 1 8 2086 1 1 3 PRO CD C 5.292 -3.722 -0.368 1.00 . A A . 3 PRO CD 1 1 8 2087 1 1 3 PRO CG C 6.018 -4.971 0.129 1.00 . A A . 3 PRO CG 1 1 8 2088 1 1 3 PRO HA H 8.097 -2.436 0.588 1.00 . A A . 3 PRO HA 1 1 8 2089 1 1 3 PRO HB2 H 8.110 -5.186 0.725 1.00 . A A . 3 PRO HB2 1 1 8 2090 1 1 3 PRO HB3 H 7.139 -4.172 1.774 1.00 . A A . 3 PRO HB3 1 1 8 2091 1 1 3 PRO HD2 H 4.751 -3.929 -1.294 1.00 . A A . 3 PRO HD2 1 1 8 2092 1 1 3 PRO HD3 H 4.568 -3.393 0.380 1.00 . A A . 3 PRO HD3 1 1 8 2093 1 1 3 PRO HG2 H 6.238 -5.617 -0.721 1.00 . A A . 3 PRO HG2 1 1 8 2094 1 1 3 PRO HG3 H 5.426 -5.556 0.834 1.00 . A A . 3 PRO HG3 1 1 8 2095 1 1 3 PRO N N 6.323 -2.691 -0.535 1.00 . A A . 3 PRO N 1 1 8 2096 1 1 3 PRO O O 8.693 -4.559 -1.749 1.00 . A A . 3 PRO O 1 1 8 2097 1 1 4 TRP C C 11.393 -3.387 -2.907 1.00 . A A . 4 TRP C 1 1 8 2098 1 1 4 TRP CA C 10.244 -2.347 -2.840 1.00 . A A . 4 TRP CA 1 1 8 2099 1 1 4 TRP CB C 10.797 -0.904 -2.950 1.00 . A A . 4 TRP CB 1 1 8 2100 1 1 4 TRP CD1 C 9.756 -0.112 -5.114 1.00 . A A . 4 TRP CD1 1 1 8 2101 1 1 4 TRP CD2 C 9.385 1.318 -3.419 1.00 . A A . 4 TRP CD2 1 1 8 2102 1 1 4 TRP CE2 C 8.792 1.890 -4.587 1.00 . A A . 4 TRP CE2 1 1 8 2103 1 1 4 TRP CE3 C 9.286 2.065 -2.222 1.00 . A A . 4 TRP CE3 1 1 8 2104 1 1 4 TRP CG C 10.000 0.045 -3.792 1.00 . A A . 4 TRP CG 1 1 8 2105 1 1 4 TRP CH2 C 8.080 3.861 -3.366 1.00 . A A . 4 TRP CH2 1 1 8 2106 1 1 4 TRP CZ2 C 8.146 3.138 -4.571 1.00 . A A . 4 TRP CZ2 1 1 8 2107 1 1 4 TRP CZ3 C 8.651 3.324 -2.196 1.00 . A A . 4 TRP CZ3 1 1 8 2108 1 1 4 TRP H H 9.056 -1.506 -1.305 1.00 . A A . 4 TRP H 1 1 8 2109 1 1 4 TRP HA H 9.651 -2.557 -3.732 1.00 . A A . 4 TRP HA 1 1 8 2110 1 1 4 TRP HB2 H 10.938 -0.470 -1.960 1.00 . A A . 4 TRP HB2 1 1 8 2111 1 1 4 TRP HB3 H 11.793 -0.894 -3.396 1.00 . A A . 4 TRP HB3 1 1 8 2112 1 1 4 TRP HD1 H 10.100 -0.950 -5.704 1.00 . A A . 4 TRP HD1 1 1 8 2113 1 1 4 TRP HE1 H 8.771 1.072 -6.554 1.00 . A A . 4 TRP HE1 1 1 8 2114 1 1 4 TRP HE3 H 9.726 1.675 -1.317 1.00 . A A . 4 TRP HE3 1 1 8 2115 1 1 4 TRP HH2 H 7.611 4.834 -3.348 1.00 . A A . 4 TRP HH2 1 1 8 2116 1 1 4 TRP HZ2 H 7.727 3.549 -5.477 1.00 . A A . 4 TRP HZ2 1 1 8 2117 1 1 4 TRP HZ3 H 8.616 3.889 -1.276 1.00 . A A . 4 TRP HZ3 1 1 8 2118 1 1 4 TRP N N 9.310 -2.402 -1.704 1.00 . A A . 4 TRP N 1 1 8 2119 1 1 4 TRP NE1 N 9.036 0.967 -5.581 1.00 . A A . 4 TRP NE1 1 1 8 2120 1 1 4 TRP O O 12.229 -3.307 -3.806 1.00 . A A . 4 TRP O 1 1 8 2121 1 1 5 LYS C C 11.845 -6.667 -1.195 1.00 . A A . 5 LYS C 1 1 8 2122 1 1 5 LYS CA C 12.402 -5.480 -2.009 1.00 . A A . 5 LYS CA 1 1 8 2123 1 1 5 LYS CB C 13.872 -5.030 -1.743 1.00 . A A . 5 LYS CB 1 1 8 2124 1 1 5 LYS CD C 15.892 -4.233 -3.194 1.00 . A A . 5 LYS CD 1 1 8 2125 1 1 5 LYS CE C 15.305 -2.997 -3.912 1.00 . A A . 5 LYS CE 1 1 8 2126 1 1 5 LYS CG C 14.837 -5.325 -2.920 1.00 . A A . 5 LYS CG 1 1 8 2127 1 1 5 LYS H H 10.684 -4.415 -1.351 1.00 . A A . 5 LYS H 1 1 8 2128 1 1 5 LYS HA H 12.342 -5.860 -3.030 1.00 . A A . 5 LYS HA 1 1 8 2129 1 1 5 LYS HB2 H 13.886 -3.961 -1.523 1.00 . A A . 5 LYS HB2 1 1 8 2130 1 1 5 LYS HB3 H 14.267 -5.487 -0.836 1.00 . A A . 5 LYS HB3 1 1 8 2131 1 1 5 LYS HD2 H 16.385 -3.949 -2.264 1.00 . A A . 5 LYS HD2 1 1 8 2132 1 1 5 LYS HD3 H 16.664 -4.677 -3.827 1.00 . A A . 5 LYS HD3 1 1 8 2133 1 1 5 LYS HE2 H 14.716 -3.308 -4.777 1.00 . A A . 5 LYS HE2 1 1 8 2134 1 1 5 LYS HE3 H 14.627 -2.462 -3.246 1.00 . A A . 5 LYS HE3 1 1 8 2135 1 1 5 LYS HG2 H 15.337 -6.275 -2.723 1.00 . A A . 5 LYS HG2 1 1 8 2136 1 1 5 LYS HG3 H 14.285 -5.489 -3.847 1.00 . A A . 5 LYS HG3 1 1 8 2137 1 1 5 LYS HZ1 H 16.947 -2.514 -5.057 1.00 . A A . 5 LYS HZ1 1 1 8 2138 1 1 5 LYS HZ2 H 16.905 -1.726 -3.608 1.00 . A A . 5 LYS HZ2 1 1 8 2139 1 1 5 LYS HZ3 H 15.902 -1.270 -4.828 1.00 . A A . 5 LYS HZ3 1 1 8 2140 1 1 5 LYS N N 11.479 -4.344 -1.975 1.00 . A A . 5 LYS N 1 1 8 2141 1 1 5 LYS NZ N 16.347 -2.061 -4.380 1.00 . A A . 5 LYS NZ 1 1 8 2142 1 1 5 LYS O O 12.548 -7.272 -0.373 1.00 . A A . 5 LYS O 1 1 8 2143 1 1 6 TRP C C 10.350 -9.449 -1.221 1.00 . A A . 6 TRP C 1 1 8 2144 1 1 6 TRP CA C 9.753 -8.065 -0.892 1.00 . A A . 6 TRP CA 1 1 8 2145 1 1 6 TRP CB C 8.321 -7.942 -1.447 1.00 . A A . 6 TRP CB 1 1 8 2146 1 1 6 TRP CD1 C 6.848 -8.661 0.483 1.00 . A A . 6 TRP CD1 1 1 8 2147 1 1 6 TRP CD2 C 6.517 -9.903 -1.360 1.00 . A A . 6 TRP CD2 1 1 8 2148 1 1 6 TRP CE2 C 5.640 -10.410 -0.355 1.00 . A A . 6 TRP CE2 1 1 8 2149 1 1 6 TRP CE3 C 6.475 -10.536 -2.626 1.00 . A A . 6 TRP CE3 1 1 8 2150 1 1 6 TRP CG C 7.276 -8.793 -0.794 1.00 . A A . 6 TRP CG 1 1 8 2151 1 1 6 TRP CH2 C 4.742 -12.085 -1.862 1.00 . A A . 6 TRP CH2 1 1 8 2152 1 1 6 TRP CZ2 C 4.768 -11.487 -0.590 1.00 . A A . 6 TRP CZ2 1 1 8 2153 1 1 6 TRP CZ3 C 5.595 -11.610 -2.878 1.00 . A A . 6 TRP CZ3 1 1 8 2154 1 1 6 TRP H H 10.072 -6.370 -2.096 1.00 . A A . 6 TRP H 1 1 8 2155 1 1 6 TRP HA H 9.728 -7.952 0.193 1.00 . A A . 6 TRP HA 1 1 8 2156 1 1 6 TRP HB2 H 7.976 -6.918 -1.341 1.00 . A A . 6 TRP HB2 1 1 8 2157 1 1 6 TRP HB3 H 8.312 -8.146 -2.519 1.00 . A A . 6 TRP HB3 1 1 8 2158 1 1 6 TRP HD1 H 7.210 -7.918 1.178 1.00 . A A . 6 TRP HD1 1 1 8 2159 1 1 6 TRP HE1 H 5.430 -9.719 1.641 1.00 . A A . 6 TRP HE1 1 1 8 2160 1 1 6 TRP HE3 H 7.121 -10.187 -3.417 1.00 . A A . 6 TRP HE3 1 1 8 2161 1 1 6 TRP HH2 H 4.074 -12.911 -2.060 1.00 . A A . 6 TRP HH2 1 1 8 2162 1 1 6 TRP HZ2 H 4.116 -11.847 0.193 1.00 . A A . 6 TRP HZ2 1 1 8 2163 1 1 6 TRP HZ3 H 5.574 -12.071 -3.855 1.00 . A A . 6 TRP HZ3 1 1 8 2164 1 1 6 TRP N N 10.553 -6.954 -1.422 1.00 . A A . 6 TRP N 1 1 8 2165 1 1 6 TRP NE1 N 5.890 -9.617 0.746 1.00 . A A . 6 TRP NE1 1 1 8 2166 1 1 6 TRP O O 11.187 -9.575 -2.115 1.00 . A A . 6 TRP O 1 1 8 2167 1 1 7 LYS C C 9.275 -12.774 -0.210 1.00 . A A . 7 LYS C 1 1 8 2168 1 1 7 LYS CA C 10.455 -11.848 -0.512 1.00 . A A . 7 LYS CA 1 1 8 2169 1 1 7 LYS CB C 11.629 -12.054 0.475 1.00 . A A . 7 LYS CB 1 1 8 2170 1 1 7 LYS CD C 13.911 -11.184 1.292 1.00 . A A . 7 LYS CD 1 1 8 2171 1 1 7 LYS CE C 14.905 -10.021 1.140 1.00 . A A . 7 LYS CE 1 1 8 2172 1 1 7 LYS CG C 12.876 -11.206 0.162 1.00 . A A . 7 LYS CG 1 1 8 2173 1 1 7 LYS H H 9.152 -10.362 0.146 1.00 . A A . 7 LYS H 1 1 8 2174 1 1 7 LYS HA H 10.792 -12.066 -1.527 1.00 . A A . 7 LYS HA 1 1 8 2175 1 1 7 LYS HB2 H 11.273 -11.834 1.483 1.00 . A A . 7 LYS HB2 1 1 8 2176 1 1 7 LYS HB3 H 11.913 -13.108 0.489 1.00 . A A . 7 LYS HB3 1 1 8 2177 1 1 7 LYS HD2 H 13.415 -11.117 2.263 1.00 . A A . 7 LYS HD2 1 1 8 2178 1 1 7 LYS HD3 H 14.449 -12.135 1.300 1.00 . A A . 7 LYS HD3 1 1 8 2179 1 1 7 LYS HE2 H 15.690 -10.116 1.892 1.00 . A A . 7 LYS HE2 1 1 8 2180 1 1 7 LYS HE3 H 15.398 -10.064 0.165 1.00 . A A . 7 LYS HE3 1 1 8 2181 1 1 7 LYS HG2 H 13.331 -11.547 -0.770 1.00 . A A . 7 LYS HG2 1 1 8 2182 1 1 7 LYS HG3 H 12.568 -10.183 -0.019 1.00 . A A . 7 LYS HG3 1 1 8 2183 1 1 7 LYS HZ1 H 14.930 -7.968 1.300 1.00 . A A . 7 LYS HZ1 1 1 8 2184 1 1 7 LYS HZ2 H 13.741 -8.685 2.182 1.00 . A A . 7 LYS HZ2 1 1 8 2185 1 1 7 LYS HZ3 H 13.580 -8.515 0.557 1.00 . A A . 7 LYS HZ3 1 1 8 2186 1 1 7 LYS N N 9.966 -10.472 -0.451 1.00 . A A . 7 LYS N 1 1 8 2187 1 1 7 LYS NZ N 14.245 -8.709 1.308 1.00 . A A . 7 LYS NZ 1 1 8 2188 1 1 7 LYS O O 8.364 -12.380 0.518 1.00 . A A . 7 LYS O 1 1 8 2189 1 1 8 TRP C C 8.898 -16.370 -0.472 1.00 . A A . 8 TRP C 1 1 8 2190 1 1 8 TRP CA C 8.244 -14.994 -0.593 1.00 . A A . 8 TRP CA 1 1 8 2191 1 1 8 TRP CB C 7.266 -14.873 -1.775 1.00 . A A . 8 TRP CB 1 1 8 2192 1 1 8 TRP CD1 C 5.118 -15.462 -0.566 1.00 . A A . 8 TRP CD1 1 1 8 2193 1 1 8 TRP CD2 C 5.233 -16.378 -2.614 1.00 . A A . 8 TRP CD2 1 1 8 2194 1 1 8 TRP CE2 C 3.967 -16.746 -2.066 1.00 . A A . 8 TRP CE2 1 1 8 2195 1 1 8 TRP CE3 C 5.524 -16.839 -3.920 1.00 . A A . 8 TRP CE3 1 1 8 2196 1 1 8 TRP CG C 5.938 -15.549 -1.639 1.00 . A A . 8 TRP CG 1 1 8 2197 1 1 8 TRP CH2 C 3.356 -17.956 -4.079 1.00 . A A . 8 TRP CH2 1 1 8 2198 1 1 8 TRP CZ2 C 3.034 -17.518 -2.781 1.00 . A A . 8 TRP CZ2 1 1 8 2199 1 1 8 TRP CZ3 C 4.600 -17.617 -4.645 1.00 . A A . 8 TRP CZ3 1 1 8 2200 1 1 8 TRP H H 10.110 -14.322 -1.250 1.00 . A A . 8 TRP H 1 1 8 2201 1 1 8 TRP HA H 7.711 -14.800 0.340 1.00 . A A . 8 TRP HA 1 1 8 2202 1 1 8 TRP HB2 H 7.053 -13.821 -1.965 1.00 . A A . 8 TRP HB2 1 1 8 2203 1 1 8 TRP HB3 H 7.747 -15.240 -2.682 1.00 . A A . 8 TRP HB3 1 1 8 2204 1 1 8 TRP HD1 H 5.336 -14.885 0.322 1.00 . A A . 8 TRP HD1 1 1 8 2205 1 1 8 TRP HE1 H 3.189 -16.179 -0.161 1.00 . A A . 8 TRP HE1 1 1 8 2206 1 1 8 TRP HE3 H 6.469 -16.579 -4.375 1.00 . A A . 8 TRP HE3 1 1 8 2207 1 1 8 TRP HH2 H 2.651 -18.543 -4.649 1.00 . A A . 8 TRP HH2 1 1 8 2208 1 1 8 TRP HZ2 H 2.078 -17.764 -2.350 1.00 . A A . 8 TRP HZ2 1 1 8 2209 1 1 8 TRP HZ3 H 4.846 -17.947 -5.645 1.00 . A A . 8 TRP HZ3 1 1 8 2210 1 1 8 TRP N N 9.298 -14.000 -0.737 1.00 . A A . 8 TRP N 1 1 8 2211 1 1 8 TRP NE1 N 3.961 -16.172 -0.811 1.00 . A A . 8 TRP NE1 1 1 8 2212 1 1 8 TRP O O 9.955 -16.592 -1.059 1.00 . A A . 8 TRP O 1 1 8 2213 1 1 9 THR C C 7.565 -19.618 0.584 1.00 . A A . 9 THR C 1 1 8 2214 1 1 9 THR CA C 8.765 -18.644 0.504 1.00 . A A . 9 THR CA 1 1 8 2215 1 1 9 THR CB C 9.798 -18.659 1.663 1.00 . A A . 9 THR CB 1 1 8 2216 1 1 9 THR CG2 C 9.222 -18.333 3.067 1.00 . A A . 9 THR CG2 1 1 8 2217 1 1 9 THR H H 7.401 -17.045 0.714 1.00 . A A . 9 THR H 1 1 8 2218 1 1 9 THR HA H 9.342 -18.947 -0.372 1.00 . A A . 9 THR HA 1 1 8 2219 1 1 9 THR HB H 10.560 -17.905 1.456 1.00 . A A . 9 THR HB 1 1 8 2220 1 1 9 THR HG21 H 10.014 -18.140 3.789 1.00 . A A . 9 THR HG21 1 1 8 2221 1 1 9 THR HG22 H 8.592 -19.123 3.469 1.00 . A A . 9 THR HG22 1 1 8 2222 1 1 9 THR HG23 H 8.623 -17.424 3.033 1.00 . A A . 9 THR HG23 1 1 8 2223 1 1 9 THR N N 8.276 -17.286 0.276 1.00 . A A . 9 THR N 1 1 8 2224 1 1 9 THR O O 7.083 -19.926 1.678 1.00 . A A . 9 THR O 1 1 8 2225 1 1 9 THR OG1 O 10.464 -19.935 1.589 1.00 . A A . 9 THR OG1 1 1 8 2226 1 1 10 PRO C C 6.160 -22.387 -0.284 1.00 . A A . 10 PRO C 1 1 8 2227 1 1 10 PRO CA C 5.794 -20.914 -0.560 1.00 . A A . 10 PRO CA 1 1 8 2228 1 1 10 PRO CB C 5.196 -20.710 -1.963 1.00 . A A . 10 PRO CB 1 1 8 2229 1 1 10 PRO CD C 7.366 -19.677 -1.922 1.00 . A A . 10 PRO CD 1 1 8 2230 1 1 10 PRO CG C 6.399 -20.416 -2.848 1.00 . A A . 10 PRO CG 1 1 8 2231 1 1 10 PRO HA H 5.072 -20.585 0.189 1.00 . A A . 10 PRO HA 1 1 8 2232 1 1 10 PRO HB2 H 4.608 -21.557 -2.320 1.00 . A A . 10 PRO HB2 1 1 8 2233 1 1 10 PRO HB3 H 4.539 -19.841 -1.949 1.00 . A A . 10 PRO HB3 1 1 8 2234 1 1 10 PRO HD2 H 8.399 -19.946 -2.152 1.00 . A A . 10 PRO HD2 1 1 8 2235 1 1 10 PRO HD3 H 7.259 -18.599 -2.048 1.00 . A A . 10 PRO HD3 1 1 8 2236 1 1 10 PRO HG2 H 6.849 -21.354 -3.178 1.00 . A A . 10 PRO HG2 1 1 8 2237 1 1 10 PRO HG3 H 6.145 -19.843 -3.739 1.00 . A A . 10 PRO HG3 1 1 8 2238 1 1 10 PRO N N 6.985 -20.056 -0.558 1.00 . A A . 10 PRO N 1 1 8 2239 1 1 10 PRO O O 6.305 -23.185 -1.210 1.00 . A A . 10 PRO O 1 1 8 2240 1 1 11 TRP C C 5.222 -24.987 1.288 1.00 . A A . 11 TRP C 1 1 8 2241 1 1 11 TRP CA C 6.512 -24.149 1.449 1.00 . A A . 11 TRP CA 1 1 8 2242 1 1 11 TRP CB C 7.005 -24.123 2.921 1.00 . A A . 11 TRP CB 1 1 8 2243 1 1 11 TRP CD1 C 9.269 -25.151 3.345 1.00 . A A . 11 TRP CD1 1 1 8 2244 1 1 11 TRP CD2 C 7.623 -26.614 3.766 1.00 . A A . 11 TRP CD2 1 1 8 2245 1 1 11 TRP CE2 C 8.860 -27.294 3.995 1.00 . A A . 11 TRP CE2 1 1 8 2246 1 1 11 TRP CE3 C 6.442 -27.355 4.013 1.00 . A A . 11 TRP CE3 1 1 8 2247 1 1 11 TRP CG C 7.921 -25.248 3.321 1.00 . A A . 11 TRP CG 1 1 8 2248 1 1 11 TRP CH2 C 7.726 -29.344 4.626 1.00 . A A . 11 TRP CH2 1 1 8 2249 1 1 11 TRP CZ2 C 8.921 -28.636 4.410 1.00 . A A . 11 TRP CZ2 1 1 8 2250 1 1 11 TRP CZ3 C 6.488 -28.700 4.433 1.00 . A A . 11 TRP CZ3 1 1 8 2251 1 1 11 TRP H H 6.225 -22.048 1.701 1.00 . A A . 11 TRP H 1 1 8 2252 1 1 11 TRP HA H 7.298 -24.579 0.825 1.00 . A A . 11 TRP HA 1 1 8 2253 1 1 11 TRP HB2 H 7.580 -23.209 3.076 1.00 . A A . 11 TRP HB2 1 1 8 2254 1 1 11 TRP HB3 H 6.184 -24.062 3.637 1.00 . A A . 11 TRP HB3 1 1 8 2255 1 1 11 TRP HD1 H 9.812 -24.257 3.090 1.00 . A A . 11 TRP HD1 1 1 8 2256 1 1 11 TRP HE1 H 10.825 -26.490 3.810 1.00 . A A . 11 TRP HE1 1 1 8 2257 1 1 11 TRP HE3 H 5.481 -26.883 3.890 1.00 . A A . 11 TRP HE3 1 1 8 2258 1 1 11 TRP HH2 H 7.759 -30.374 4.950 1.00 . A A . 11 TRP HH2 1 1 8 2259 1 1 11 TRP HZ2 H 9.874 -29.119 4.569 1.00 . A A . 11 TRP HZ2 1 1 8 2260 1 1 11 TRP HZ3 H 5.570 -29.240 4.614 1.00 . A A . 11 TRP HZ3 1 1 8 2261 1 1 11 TRP N N 6.260 -22.773 0.996 1.00 . A A . 11 TRP N 1 1 8 2262 1 1 11 TRP NE1 N 9.826 -26.351 3.729 1.00 . A A . 11 TRP NE1 1 1 8 2263 1 1 11 TRP O O 4.557 -25.345 2.257 1.00 . A A . 11 TRP O 1 1 8 2264 1 1 12 ARG C C 3.637 -25.994 -1.936 1.00 . A A . 12 ARG C 1 1 8 2265 1 1 12 ARG CA C 3.671 -26.019 -0.403 1.00 . A A . 12 ARG CA 1 1 8 2266 1 1 12 ARG CB C 2.329 -25.516 0.189 1.00 . A A . 12 ARG CB 1 1 8 2267 1 1 12 ARG CD C 0.802 -23.570 0.782 1.00 . A A . 12 ARG CD 1 1 8 2268 1 1 12 ARG CG C 2.025 -24.019 -0.027 1.00 . A A . 12 ARG CG 1 1 8 2269 1 1 12 ARG CZ C -0.039 -21.286 1.451 1.00 . A A . 12 ARG CZ 1 1 8 2270 1 1 12 ARG H H 5.350 -24.768 -0.702 1.00 . A A . 12 ARG H 1 1 8 2271 1 1 12 ARG HA H 3.846 -27.045 -0.074 1.00 . A A . 12 ARG HA 1 1 8 2272 1 1 12 ARG HB2 H 1.514 -26.108 -0.229 1.00 . A A . 12 ARG HB2 1 1 8 2273 1 1 12 ARG HB3 H 2.310 -25.739 1.255 1.00 . A A . 12 ARG HB3 1 1 8 2274 1 1 12 ARG HD2 H -0.070 -24.169 0.512 1.00 . A A . 12 ARG HD2 1 1 8 2275 1 1 12 ARG HD3 H 1.003 -23.757 1.837 1.00 . A A . 12 ARG HD3 1 1 8 2276 1 1 12 ARG HE H 0.693 -21.834 -0.378 1.00 . A A . 12 ARG HE 1 1 8 2277 1 1 12 ARG HG2 H 2.883 -23.419 0.274 1.00 . A A . 12 ARG HG2 1 1 8 2278 1 1 12 ARG HG3 H 1.872 -23.825 -1.089 1.00 . A A . 12 ARG HG3 1 1 8 2279 1 1 12 ARG HH11 H -0.110 -22.628 2.982 1.00 . A A . 12 ARG HH11 1 1 8 2280 1 1 12 ARG HH12 H -0.751 -21.087 3.392 1.00 . A A . 12 ARG HH12 1 1 8 2281 1 1 12 ARG HH21 H -0.094 -19.695 0.145 1.00 . A A . 12 ARG HH21 1 1 8 2282 1 1 12 ARG HH22 H -0.718 -19.356 1.705 1.00 . A A . 12 ARG HH22 1 1 8 2283 1 1 12 ARG N N 4.810 -25.222 0.037 1.00 . A A . 12 ARG N 1 1 8 2284 1 1 12 ARG NE N 0.499 -22.141 0.567 1.00 . A A . 12 ARG NE 1 1 8 2285 1 1 12 ARG NH1 N -0.334 -21.685 2.690 1.00 . A A . 12 ARG NH1 1 1 8 2286 1 1 12 ARG NH2 N -0.292 -20.029 1.079 1.00 . A A . 12 ARG NH2 1 1 8 2287 1 1 12 ARG O O 3.866 -24.949 -2.546 1.00 . A A . 12 ARG O 1 1 8 2288 1 1 13 ARG C C 1.942 -26.689 -4.577 1.00 . A A . 13 ARG C 1 1 8 2289 1 1 13 ARG CA C 3.244 -27.307 -4.014 1.00 . A A . 13 ARG CA 1 1 8 2290 1 1 13 ARG CB C 3.307 -28.826 -4.299 1.00 . A A . 13 ARG CB 1 1 8 2291 1 1 13 ARG CD C 3.251 -30.676 -6.053 1.00 . A A . 13 ARG CD 1 1 8 2292 1 1 13 ARG CG C 3.496 -29.186 -5.786 1.00 . A A . 13 ARG CG 1 1 8 2293 1 1 13 ARG CZ C 2.384 -30.950 -8.405 1.00 . A A . 13 ARG CZ 1 1 8 2294 1 1 13 ARG H H 3.064 -27.922 -1.992 1.00 . A A . 13 ARG H 1 1 8 2295 1 1 13 ARG HA H 4.105 -26.814 -4.475 1.00 . A A . 13 ARG HA 1 1 8 2296 1 1 13 ARG HB2 H 4.130 -29.268 -3.736 1.00 . A A . 13 ARG HB2 1 1 8 2297 1 1 13 ARG HB3 H 2.401 -29.301 -3.918 1.00 . A A . 13 ARG HB3 1 1 8 2298 1 1 13 ARG HD2 H 3.986 -31.268 -5.506 1.00 . A A . 13 ARG HD2 1 1 8 2299 1 1 13 ARG HD3 H 2.273 -30.984 -5.679 1.00 . A A . 13 ARG HD3 1 1 8 2300 1 1 13 ARG HE H 4.300 -31.276 -7.752 1.00 . A A . 13 ARG HE 1 1 8 2301 1 1 13 ARG HG2 H 2.824 -28.605 -6.416 1.00 . A A . 13 ARG HG2 1 1 8 2302 1 1 13 ARG HG3 H 4.504 -28.905 -6.096 1.00 . A A . 13 ARG HG3 1 1 8 2303 1 1 13 ARG HH11 H 0.981 -30.135 -7.159 1.00 . A A . 13 ARG HH11 1 1 8 2304 1 1 13 ARG HH12 H 0.392 -30.482 -8.733 1.00 . A A . 13 ARG HH12 1 1 8 2305 1 1 13 ARG HH21 H 3.537 -31.697 -9.945 1.00 . A A . 13 ARG HH21 1 1 8 2306 1 1 13 ARG HH22 H 1.925 -31.322 -10.381 1.00 . A A . 13 ARG HH22 1 1 8 2307 1 1 13 ARG N N 3.298 -27.125 -2.563 1.00 . A A . 13 ARG N 1 1 8 2308 1 1 13 ARG NE N 3.363 -30.991 -7.489 1.00 . A A . 13 ARG NE 1 1 8 2309 1 1 13 ARG NH1 N 1.166 -30.507 -8.082 1.00 . A A . 13 ARG NH1 1 1 8 2310 1 1 13 ARG NH2 N 2.632 -31.346 -9.657 1.00 . A A . 13 ARG NH2 1 1 8 2311 1 1 13 ARG O O 1.058 -27.380 -5.079 1.00 . A A . 13 ARG O 1 1 8 2312 1 1 14 NH2 HN1 H 0.991 -24.924 -4.853 1.00 . A A . 14 NH2 HN1 1 1 8 2313 1 1 14 NH2 HN2 H 2.550 -24.854 -4.012 1.00 . A A . 14 NH2 HN2 1 1 8 2314 1 1 14 NH2 N N 1.807 -25.374 -4.475 1.00 . A A . 14 NH2 N 1 1 8 2315 2 2 1 . C1 C 11.033 -20.510 2.741 1.00 . B A . 101 BGC C1 1 1 8 2316 2 2 1 . C2 C 11.800 -21.777 2.322 1.00 . B A . 101 BGC C2 1 1 8 2317 2 2 1 . C3 C 12.346 -22.464 3.581 1.00 . B A . 101 BGC C3 1 1 8 2318 2 2 1 . C4 C 13.177 -21.475 4.410 1.00 . B A . 101 BGC C4 1 1 8 2319 2 2 1 . C5 C 12.364 -20.190 4.697 1.00 . B A . 101 BGC C5 1 1 8 2320 2 2 1 . C6 C 13.184 -19.090 5.396 1.00 . B A . 101 BGC C6 1 1 8 2321 2 2 1 . H1 H 10.199 -20.750 3.414 1.00 . B A . 101 BGC H1 1 1 8 2322 2 2 1 . H2 H 12.616 -21.478 1.663 1.00 . B A . 101 BGC H2 1 1 8 2323 2 2 1 . H3 H 11.501 -22.803 4.186 1.00 . B A . 101 BGC H3 1 1 8 2324 2 2 1 . H4 H 14.070 -21.200 3.850 1.00 . B A . 101 BGC H4 1 1 8 2325 2 2 1 . H5 H 11.496 -20.431 5.315 1.00 . B A . 101 BGC H5 1 1 8 2326 2 2 1 . H6 H 11.730 -18.163 6.331 1.00 . B A . 101 BGC H6 1 1 8 2327 2 2 1 . H6C1 H 14.031 -18.804 4.773 1.00 . B A . 101 BGC H6C1 1 1 8 2328 2 2 1 . H6C2 H 13.596 -19.466 6.334 1.00 . B A . 101 BGC H6C2 1 1 8 2329 2 2 1 . HB H 11.441 -23.481 1.463 1.00 . B A . 101 BGC HB 1 1 8 2330 2 2 1 . HC H 13.880 -23.305 2.684 1.00 . B A . 101 BGC HC 1 1 8 2331 2 2 1 . HD H 13.852 -23.022 5.371 1.00 . B A . 101 BGC HD 1 1 8 2332 2 2 1 . O2 O 10.942 -22.664 1.616 1.00 . B A . 101 BGC O2 1 1 8 2333 2 2 1 . O3 O 13.137 -23.604 3.228 1.00 . B A . 101 BGC O3 1 1 8 2334 2 2 1 . O4 O 13.579 -22.120 5.611 1.00 . B A . 101 BGC O4 1 1 8 2335 2 2 1 . O5 O 11.917 -19.662 3.437 1.00 . B A . 101 BGC O5 1 1 8 2336 2 2 1 . O6 O 12.395 -17.932 5.668 1.00 . B A . 101 BGC O6 1 1 9 2337 1 1 1 ILE C C 3.468 3.119 -2.784 1.00 . A A . 1 ILE C 1 1 9 2338 1 1 1 ILE CA C 3.488 4.039 -4.008 1.00 . A A . 1 ILE CA 1 1 9 2339 1 1 1 ILE CB C 4.530 5.187 -3.877 1.00 . A A . 1 ILE CB 1 1 9 2340 1 1 1 ILE CD1 C 5.363 7.173 -2.439 1.00 . A A . 1 ILE CD1 1 1 9 2341 1 1 1 ILE CG1 C 4.217 6.197 -2.738 1.00 . A A . 1 ILE CG1 1 1 9 2342 1 1 1 ILE CG2 C 4.720 5.907 -5.227 1.00 . A A . 1 ILE CG2 1 1 9 2343 1 1 1 ILE H1 H 1.496 3.823 -4.376 1.00 . A A . 1 ILE H1 1 1 9 2344 1 1 1 ILE HA H 3.725 3.430 -4.884 1.00 . A A . 1 ILE HA 1 1 9 2345 1 1 1 ILE HB H 5.488 4.719 -3.638 1.00 . A A . 1 ILE HB 1 1 9 2346 1 1 1 ILE HD11 H 5.121 7.798 -1.577 1.00 . A A . 1 ILE HD11 1 1 9 2347 1 1 1 ILE HD12 H 6.290 6.648 -2.206 1.00 . A A . 1 ILE HD12 1 1 9 2348 1 1 1 ILE HD13 H 5.559 7.848 -3.272 1.00 . A A . 1 ILE HD13 1 1 9 2349 1 1 1 ILE HG12 H 3.321 6.774 -2.964 1.00 . A A . 1 ILE HG12 1 1 9 2350 1 1 1 ILE HG13 H 4.006 5.664 -1.809 1.00 . A A . 1 ILE HG13 1 1 9 2351 1 1 1 ILE HG21 H 3.850 6.498 -5.512 1.00 . A A . 1 ILE HG21 1 1 9 2352 1 1 1 ILE HG22 H 5.573 6.588 -5.196 1.00 . A A . 1 ILE HG22 1 1 9 2353 1 1 1 ILE HG23 H 4.927 5.203 -6.035 1.00 . A A . 1 ILE HG23 1 1 9 2354 1 1 1 ILE N N 2.129 4.581 -4.178 1.00 . A A . 1 ILE N 1 1 9 2355 1 1 1 ILE O O 2.622 3.328 -1.919 1.00 . A A . 1 ILE O 1 1 9 2356 1 1 2 LEU C C 6.061 0.905 -1.511 1.00 . A A . 2 LEU C 1 1 9 2357 1 1 2 LEU CA C 4.555 1.206 -1.600 1.00 . A A . 2 LEU CA 1 1 9 2358 1 1 2 LEU CB C 3.725 -0.093 -1.765 1.00 . A A . 2 LEU CB 1 1 9 2359 1 1 2 LEU CD1 C 1.402 0.130 -2.818 1.00 . A A . 2 LEU CD1 1 1 9 2360 1 1 2 LEU CD2 C 1.683 -1.138 -0.663 1.00 . A A . 2 LEU CD2 1 1 9 2361 1 1 2 LEU CG C 2.204 0.035 -1.510 1.00 . A A . 2 LEU CG 1 1 9 2362 1 1 2 LEU H H 5.076 2.026 -3.429 1.00 . A A . 2 LEU H 1 1 9 2363 1 1 2 LEU HA H 4.259 1.711 -0.681 1.00 . A A . 2 LEU HA 1 1 9 2364 1 1 2 LEU HB2 H 3.911 -0.536 -2.745 1.00 . A A . 2 LEU HB2 1 1 9 2365 1 1 2 LEU HB3 H 4.126 -0.832 -1.068 1.00 . A A . 2 LEU HB3 1 1 9 2366 1 1 2 LEU HD11 H 0.340 0.279 -2.613 1.00 . A A . 2 LEU HD11 1 1 9 2367 1 1 2 LEU HD12 H 1.494 -0.786 -3.404 1.00 . A A . 2 LEU HD12 1 1 9 2368 1 1 2 LEU HD13 H 1.734 0.955 -3.443 1.00 . A A . 2 LEU HD13 1 1 9 2369 1 1 2 LEU HD21 H 0.615 -1.037 -0.464 1.00 . A A . 2 LEU HD21 1 1 9 2370 1 1 2 LEU HD22 H 2.187 -1.189 0.302 1.00 . A A . 2 LEU HD22 1 1 9 2371 1 1 2 LEU HD23 H 1.834 -2.094 -1.169 1.00 . A A . 2 LEU HD23 1 1 9 2372 1 1 2 LEU HG H 2.019 0.940 -0.929 1.00 . A A . 2 LEU HG 1 1 9 2373 1 1 2 LEU N N 4.354 2.123 -2.721 1.00 . A A . 2 LEU N 1 1 9 2374 1 1 2 LEU O O 6.728 0.993 -2.547 1.00 . A A . 2 LEU O 1 1 9 2375 1 1 3 PRO C C 8.023 -1.434 -0.749 1.00 . A A . 3 PRO C 1 1 9 2376 1 1 3 PRO CA C 7.975 0.014 -0.223 1.00 . A A . 3 PRO CA 1 1 9 2377 1 1 3 PRO CB C 8.288 0.082 1.281 1.00 . A A . 3 PRO CB 1 1 9 2378 1 1 3 PRO CD C 5.940 0.564 0.974 1.00 . A A . 3 PRO CD 1 1 9 2379 1 1 3 PRO CG C 6.933 -0.041 1.970 1.00 . A A . 3 PRO CG 1 1 9 2380 1 1 3 PRO HA H 8.674 0.640 -0.781 1.00 . A A . 3 PRO HA 1 1 9 2381 1 1 3 PRO HB2 H 8.998 -0.681 1.604 1.00 . A A . 3 PRO HB2 1 1 9 2382 1 1 3 PRO HB3 H 8.729 1.053 1.512 1.00 . A A . 3 PRO HB3 1 1 9 2383 1 1 3 PRO HD2 H 5.000 0.011 0.975 1.00 . A A . 3 PRO HD2 1 1 9 2384 1 1 3 PRO HD3 H 5.727 1.603 1.239 1.00 . A A . 3 PRO HD3 1 1 9 2385 1 1 3 PRO HG2 H 6.696 -1.097 2.116 1.00 . A A . 3 PRO HG2 1 1 9 2386 1 1 3 PRO HG3 H 6.907 0.449 2.945 1.00 . A A . 3 PRO HG3 1 1 9 2387 1 1 3 PRO N N 6.604 0.528 -0.333 1.00 . A A . 3 PRO N 1 1 9 2388 1 1 3 PRO O O 7.232 -2.273 -0.313 1.00 . A A . 3 PRO O 1 1 9 2389 1 1 4 TRP C C 9.777 -3.980 -1.323 1.00 . A A . 4 TRP C 1 1 9 2390 1 1 4 TRP CA C 9.099 -3.022 -2.319 1.00 . A A . 4 TRP CA 1 1 9 2391 1 1 4 TRP CB C 9.982 -2.862 -3.576 1.00 . A A . 4 TRP CB 1 1 9 2392 1 1 4 TRP CD1 C 10.128 -5.070 -4.822 1.00 . A A . 4 TRP CD1 1 1 9 2393 1 1 4 TRP CD2 C 8.788 -3.580 -5.840 1.00 . A A . 4 TRP CD2 1 1 9 2394 1 1 4 TRP CE2 C 8.779 -4.760 -6.643 1.00 . A A . 4 TRP CE2 1 1 9 2395 1 1 4 TRP CE3 C 8.018 -2.485 -6.299 1.00 . A A . 4 TRP CE3 1 1 9 2396 1 1 4 TRP CG C 9.653 -3.810 -4.686 1.00 . A A . 4 TRP CG 1 1 9 2397 1 1 4 TRP CH2 C 7.295 -3.739 -8.270 1.00 . A A . 4 TRP CH2 1 1 9 2398 1 1 4 TRP CZ2 C 8.046 -4.849 -7.841 1.00 . A A . 4 TRP CZ2 1 1 9 2399 1 1 4 TRP CZ3 C 7.280 -2.560 -7.499 1.00 . A A . 4 TRP CZ3 1 1 9 2400 1 1 4 TRP H H 9.597 -1.000 -1.946 1.00 . A A . 4 TRP H 1 1 9 2401 1 1 4 TRP HA H 8.112 -3.397 -2.604 1.00 . A A . 4 TRP HA 1 1 9 2402 1 1 4 TRP HB2 H 9.875 -1.859 -3.990 1.00 . A A . 4 TRP HB2 1 1 9 2403 1 1 4 TRP HB3 H 11.043 -2.957 -3.330 1.00 . A A . 4 TRP HB3 1 1 9 2404 1 1 4 TRP HD1 H 10.815 -5.541 -4.133 1.00 . A A . 4 TRP HD1 1 1 9 2405 1 1 4 TRP HE1 H 9.839 -6.567 -6.280 1.00 . A A . 4 TRP HE1 1 1 9 2406 1 1 4 TRP HE3 H 8.006 -1.571 -5.725 1.00 . A A . 4 TRP HE3 1 1 9 2407 1 1 4 TRP HH2 H 6.734 -3.791 -9.192 1.00 . A A . 4 TRP HH2 1 1 9 2408 1 1 4 TRP HZ2 H 8.065 -5.750 -8.434 1.00 . A A . 4 TRP HZ2 1 1 9 2409 1 1 4 TRP HZ3 H 6.707 -1.708 -7.836 1.00 . A A . 4 TRP HZ3 1 1 9 2410 1 1 4 TRP N N 8.938 -1.716 -1.684 1.00 . A A . 4 TRP N 1 1 9 2411 1 1 4 TRP NE1 N 9.600 -5.639 -5.964 1.00 . A A . 4 TRP NE1 1 1 9 2412 1 1 4 TRP O O 10.740 -3.597 -0.655 1.00 . A A . 4 TRP O 1 1 9 2413 1 1 5 LYS C C 9.171 -7.541 -0.546 1.00 . A A . 5 LYS C 1 1 9 2414 1 1 5 LYS CA C 9.658 -6.148 -0.148 1.00 . A A . 5 LYS CA 1 1 9 2415 1 1 5 LYS CB C 9.164 -5.689 1.248 1.00 . A A . 5 LYS CB 1 1 9 2416 1 1 5 LYS CD C 7.204 -4.432 2.375 1.00 . A A . 5 LYS CD 1 1 9 2417 1 1 5 LYS CE C 7.523 -4.774 3.836 1.00 . A A . 5 LYS CE 1 1 9 2418 1 1 5 LYS CG C 7.631 -5.513 1.369 1.00 . A A . 5 LYS CG 1 1 9 2419 1 1 5 LYS H H 8.480 -5.492 -1.757 1.00 . A A . 5 LYS H 1 1 9 2420 1 1 5 LYS HA H 10.751 -6.173 -0.138 1.00 . A A . 5 LYS HA 1 1 9 2421 1 1 5 LYS HB2 H 9.512 -6.396 2.001 1.00 . A A . 5 LYS HB2 1 1 9 2422 1 1 5 LYS HB3 H 9.661 -4.747 1.483 1.00 . A A . 5 LYS HB3 1 1 9 2423 1 1 5 LYS HD2 H 7.676 -3.488 2.093 1.00 . A A . 5 LYS HD2 1 1 9 2424 1 1 5 LYS HD3 H 6.130 -4.272 2.259 1.00 . A A . 5 LYS HD3 1 1 9 2425 1 1 5 LYS HE2 H 7.045 -5.715 4.116 1.00 . A A . 5 LYS HE2 1 1 9 2426 1 1 5 LYS HE3 H 8.598 -4.911 3.966 1.00 . A A . 5 LYS HE3 1 1 9 2427 1 1 5 LYS HG2 H 7.215 -5.219 0.403 1.00 . A A . 5 LYS HG2 1 1 9 2428 1 1 5 LYS HG3 H 7.161 -6.471 1.598 1.00 . A A . 5 LYS HG3 1 1 9 2429 1 1 5 LYS HZ1 H 7.521 -2.838 4.506 1.00 . A A . 5 LYS HZ1 1 1 9 2430 1 1 5 LYS HZ2 H 7.289 -3.941 5.704 1.00 . A A . 5 LYS HZ2 1 1 9 2431 1 1 5 LYS HZ3 H 6.065 -3.589 4.662 1.00 . A A . 5 LYS HZ3 1 1 9 2432 1 1 5 LYS N N 9.248 -5.194 -1.168 1.00 . A A . 5 LYS N 1 1 9 2433 1 1 5 LYS NZ N 7.065 -3.707 4.746 1.00 . A A . 5 LYS NZ 1 1 9 2434 1 1 5 LYS O O 8.074 -7.680 -1.082 1.00 . A A . 5 LYS O 1 1 9 2435 1 1 6 TRP C C 10.476 -10.823 0.497 1.00 . A A . 6 TRP C 1 1 9 2436 1 1 6 TRP CA C 9.664 -9.974 -0.489 1.00 . A A . 6 TRP CA 1 1 9 2437 1 1 6 TRP CB C 9.876 -10.353 -1.975 1.00 . A A . 6 TRP CB 1 1 9 2438 1 1 6 TRP CD1 C 7.579 -11.242 -2.560 1.00 . A A . 6 TRP CD1 1 1 9 2439 1 1 6 TRP CD2 C 9.218 -12.588 -3.296 1.00 . A A . 6 TRP CD2 1 1 9 2440 1 1 6 TRP CE2 C 7.985 -13.128 -3.777 1.00 . A A . 6 TRP CE2 1 1 9 2441 1 1 6 TRP CE3 C 10.402 -13.274 -3.659 1.00 . A A . 6 TRP CE3 1 1 9 2442 1 1 6 TRP CG C 8.926 -11.360 -2.555 1.00 . A A . 6 TRP CG 1 1 9 2443 1 1 6 TRP CH2 C 9.134 -14.896 -4.979 1.00 . A A . 6 TRP CH2 1 1 9 2444 1 1 6 TRP CZ2 C 7.935 -14.258 -4.613 1.00 . A A . 6 TRP CZ2 1 1 9 2445 1 1 6 TRP CZ3 C 10.363 -14.414 -4.489 1.00 . A A . 6 TRP CZ3 1 1 9 2446 1 1 6 TRP H H 10.846 -8.395 0.221 1.00 . A A . 6 TRP H 1 1 9 2447 1 1 6 TRP HA H 8.613 -10.112 -0.226 1.00 . A A . 6 TRP HA 1 1 9 2448 1 1 6 TRP HB2 H 9.771 -9.470 -2.606 1.00 . A A . 6 TRP HB2 1 1 9 2449 1 1 6 TRP HB3 H 10.899 -10.695 -2.139 1.00 . A A . 6 TRP HB3 1 1 9 2450 1 1 6 TRP HD1 H 7.044 -10.404 -2.132 1.00 . A A . 6 TRP HD1 1 1 9 2451 1 1 6 TRP HE1 H 6.035 -12.310 -3.491 1.00 . A A . 6 TRP HE1 1 1 9 2452 1 1 6 TRP HE3 H 11.357 -12.896 -3.326 1.00 . A A . 6 TRP HE3 1 1 9 2453 1 1 6 TRP HH2 H 9.119 -15.736 -5.659 1.00 . A A . 6 TRP HH2 1 1 9 2454 1 1 6 TRP HZ2 H 6.989 -14.608 -5.001 1.00 . A A . 6 TRP HZ2 1 1 9 2455 1 1 6 TRP HZ3 H 11.288 -14.893 -4.778 1.00 . A A . 6 TRP HZ3 1 1 9 2456 1 1 6 TRP N N 9.975 -8.568 -0.263 1.00 . A A . 6 TRP N 1 1 9 2457 1 1 6 TRP NE1 N 7.020 -12.294 -3.258 1.00 . A A . 6 TRP NE1 1 1 9 2458 1 1 6 TRP O O 11.252 -10.291 1.293 1.00 . A A . 6 TRP O 1 1 9 2459 1 1 7 LYS C C 11.317 -14.316 0.219 1.00 . A A . 7 LYS C 1 1 9 2460 1 1 7 LYS CA C 11.089 -13.135 1.160 1.00 . A A . 7 LYS CA 1 1 9 2461 1 1 7 LYS CB C 10.372 -13.568 2.463 1.00 . A A . 7 LYS CB 1 1 9 2462 1 1 7 LYS CD C 11.949 -12.817 4.368 1.00 . A A . 7 LYS CD 1 1 9 2463 1 1 7 LYS CE C 12.029 -12.059 5.707 1.00 . A A . 7 LYS CE 1 1 9 2464 1 1 7 LYS CG C 10.578 -12.649 3.685 1.00 . A A . 7 LYS CG 1 1 9 2465 1 1 7 LYS H H 9.714 -12.524 -0.289 1.00 . A A . 7 LYS H 1 1 9 2466 1 1 7 LYS HA H 12.072 -12.723 1.398 1.00 . A A . 7 LYS HA 1 1 9 2467 1 1 7 LYS HB2 H 9.303 -13.656 2.260 1.00 . A A . 7 LYS HB2 1 1 9 2468 1 1 7 LYS HB3 H 10.683 -14.579 2.740 1.00 . A A . 7 LYS HB3 1 1 9 2469 1 1 7 LYS HD2 H 12.129 -13.879 4.536 1.00 . A A . 7 LYS HD2 1 1 9 2470 1 1 7 LYS HD3 H 12.738 -12.475 3.696 1.00 . A A . 7 LYS HD3 1 1 9 2471 1 1 7 LYS HE2 H 12.021 -10.983 5.531 1.00 . A A . 7 LYS HE2 1 1 9 2472 1 1 7 LYS HE3 H 11.155 -12.278 6.322 1.00 . A A . 7 LYS HE3 1 1 9 2473 1 1 7 LYS HG2 H 10.407 -11.607 3.413 1.00 . A A . 7 LYS HG2 1 1 9 2474 1 1 7 LYS HG3 H 9.802 -12.894 4.411 1.00 . A A . 7 LYS HG3 1 1 9 2475 1 1 7 LYS HZ1 H 14.068 -12.185 5.952 1.00 . A A . 7 LYS HZ1 1 1 9 2476 1 1 7 LYS HZ2 H 13.230 -13.405 6.688 1.00 . A A . 7 LYS HZ2 1 1 9 2477 1 1 7 LYS HZ3 H 13.243 -11.906 7.349 1.00 . A A . 7 LYS HZ3 1 1 9 2478 1 1 7 LYS N N 10.309 -12.144 0.436 1.00 . A A . 7 LYS N 1 1 9 2479 1 1 7 LYS NZ N 13.236 -12.416 6.476 1.00 . A A . 7 LYS NZ 1 1 9 2480 1 1 7 LYS O O 10.412 -14.680 -0.537 1.00 . A A . 7 LYS O 1 1 9 2481 1 1 8 TRP C C 11.904 -17.214 0.868 1.00 . A A . 8 TRP C 1 1 9 2482 1 1 8 TRP CA C 12.660 -16.340 -0.139 1.00 . A A . 8 TRP CA 1 1 9 2483 1 1 8 TRP CB C 14.155 -16.711 -0.159 1.00 . A A . 8 TRP CB 1 1 9 2484 1 1 8 TRP CD1 C 14.712 -18.272 -2.075 1.00 . A A . 8 TRP CD1 1 1 9 2485 1 1 8 TRP CD2 C 14.518 -19.362 -0.120 1.00 . A A . 8 TRP CD2 1 1 9 2486 1 1 8 TRP CE2 C 14.801 -20.344 -1.117 1.00 . A A . 8 TRP CE2 1 1 9 2487 1 1 8 TRP CE3 C 14.371 -19.829 1.210 1.00 . A A . 8 TRP CE3 1 1 9 2488 1 1 8 TRP CG C 14.454 -18.052 -0.766 1.00 . A A . 8 TRP CG 1 1 9 2489 1 1 8 TRP CH2 C 14.763 -22.139 0.515 1.00 . A A . 8 TRP CH2 1 1 9 2490 1 1 8 TRP CZ2 C 14.921 -21.713 -0.816 1.00 . A A . 8 TRP CZ2 1 1 9 2491 1 1 8 TRP CZ3 C 14.491 -21.197 1.525 1.00 . A A . 8 TRP CZ3 1 1 9 2492 1 1 8 TRP H H 13.157 -14.640 1.001 1.00 . A A . 8 TRP H 1 1 9 2493 1 1 8 TRP HA H 12.248 -16.446 -1.145 1.00 . A A . 8 TRP HA 1 1 9 2494 1 1 8 TRP HB2 H 14.699 -15.966 -0.739 1.00 . A A . 8 TRP HB2 1 1 9 2495 1 1 8 TRP HB3 H 14.590 -16.683 0.840 1.00 . A A . 8 TRP HB3 1 1 9 2496 1 1 8 TRP HD1 H 14.749 -17.498 -2.831 1.00 . A A . 8 TRP HD1 1 1 9 2497 1 1 8 TRP HE1 H 15.158 -20.009 -3.187 1.00 . A A . 8 TRP HE1 1 1 9 2498 1 1 8 TRP HE3 H 14.174 -19.121 2.001 1.00 . A A . 8 TRP HE3 1 1 9 2499 1 1 8 TRP HH2 H 14.862 -23.187 0.762 1.00 . A A . 8 TRP HH2 1 1 9 2500 1 1 8 TRP HZ2 H 15.140 -22.431 -1.592 1.00 . A A . 8 TRP HZ2 1 1 9 2501 1 1 8 TRP HZ3 H 14.383 -21.526 2.550 1.00 . A A . 8 TRP HZ3 1 1 9 2502 1 1 8 TRP N N 12.476 -14.975 0.340 1.00 . A A . 8 TRP N 1 1 9 2503 1 1 8 TRP NE1 N 14.909 -19.622 -2.285 1.00 . A A . 8 TRP NE1 1 1 9 2504 1 1 8 TRP O O 12.296 -17.312 2.030 1.00 . A A . 8 TRP O 1 1 9 2505 1 1 9 THR C C 9.065 -19.375 0.215 1.00 . A A . 9 THR C 1 1 9 2506 1 1 9 THR CA C 9.818 -18.499 1.234 1.00 . A A . 9 THR CA 1 1 9 2507 1 1 9 THR CB C 8.987 -17.540 2.138 1.00 . A A . 9 THR CB 1 1 9 2508 1 1 9 THR CG2 C 7.978 -16.626 1.410 1.00 . A A . 9 THR CG2 1 1 9 2509 1 1 9 THR H H 10.461 -17.513 -0.502 1.00 . A A . 9 THR H 1 1 9 2510 1 1 9 THR HA H 10.395 -19.126 1.915 1.00 . A A . 9 THR HA 1 1 9 2511 1 1 9 THR HB H 9.705 -16.892 2.644 1.00 . A A . 9 THR HB 1 1 9 2512 1 1 9 THR HG21 H 7.657 -15.794 2.035 1.00 . A A . 9 THR HG21 1 1 9 2513 1 1 9 THR HG22 H 7.089 -17.179 1.110 1.00 . A A . 9 THR HG22 1 1 9 2514 1 1 9 THR HG23 H 8.422 -16.190 0.517 1.00 . A A . 9 THR HG23 1 1 9 2515 1 1 9 THR N N 10.752 -17.722 0.441 1.00 . A A . 9 THR N 1 1 9 2516 1 1 9 THR O O 8.226 -18.849 -0.517 1.00 . A A . 9 THR O 1 1 9 2517 1 1 9 THR OG1 O 8.305 -18.317 3.140 1.00 . A A . 9 THR OG1 1 1 9 2518 1 1 10 PRO C C 7.404 -22.084 -0.588 1.00 . A A . 10 PRO C 1 1 9 2519 1 1 10 PRO CA C 8.790 -21.527 -0.979 1.00 . A A . 10 PRO CA 1 1 9 2520 1 1 10 PRO CB C 9.805 -22.667 -1.165 1.00 . A A . 10 PRO CB 1 1 9 2521 1 1 10 PRO CD C 10.481 -21.382 0.753 1.00 . A A . 10 PRO CD 1 1 9 2522 1 1 10 PRO CG C 10.481 -22.804 0.190 1.00 . A A . 10 PRO CG 1 1 9 2523 1 1 10 PRO HA H 8.679 -20.986 -1.920 1.00 . A A . 10 PRO HA 1 1 9 2524 1 1 10 PRO HB2 H 9.361 -23.604 -1.508 1.00 . A A . 10 PRO HB2 1 1 9 2525 1 1 10 PRO HB3 H 10.544 -22.374 -1.912 1.00 . A A . 10 PRO HB3 1 1 9 2526 1 1 10 PRO HD2 H 10.336 -21.394 1.834 1.00 . A A . 10 PRO HD2 1 1 9 2527 1 1 10 PRO HD3 H 11.435 -20.895 0.542 1.00 . A A . 10 PRO HD3 1 1 9 2528 1 1 10 PRO HG2 H 9.888 -23.459 0.830 1.00 . A A . 10 PRO HG2 1 1 9 2529 1 1 10 PRO HG3 H 11.484 -23.230 0.121 1.00 . A A . 10 PRO HG3 1 1 9 2530 1 1 10 PRO N N 9.401 -20.673 0.054 1.00 . A A . 10 PRO N 1 1 9 2531 1 1 10 PRO O O 6.796 -22.796 -1.381 1.00 . A A . 10 PRO O 1 1 9 2532 1 1 11 TRP C C 4.410 -21.867 0.654 1.00 . A A . 11 TRP C 1 1 9 2533 1 1 11 TRP CA C 5.742 -22.336 1.290 1.00 . A A . 11 TRP CA 1 1 9 2534 1 1 11 TRP CB C 5.857 -21.922 2.779 1.00 . A A . 11 TRP CB 1 1 9 2535 1 1 11 TRP CD1 C 6.251 -23.838 4.377 1.00 . A A . 11 TRP CD1 1 1 9 2536 1 1 11 TRP CD2 C 4.106 -23.172 4.371 1.00 . A A . 11 TRP CD2 1 1 9 2537 1 1 11 TRP CE2 C 4.210 -24.240 5.313 1.00 . A A . 11 TRP CE2 1 1 9 2538 1 1 11 TRP CE3 C 2.828 -22.585 4.209 1.00 . A A . 11 TRP CE3 1 1 9 2539 1 1 11 TRP CG C 5.426 -22.942 3.788 1.00 . A A . 11 TRP CG 1 1 9 2540 1 1 11 TRP CH2 C 1.851 -24.103 5.859 1.00 . A A . 11 TRP CH2 1 1 9 2541 1 1 11 TRP CZ2 C 3.107 -24.706 6.049 1.00 . A A . 11 TRP CZ2 1 1 9 2542 1 1 11 TRP CZ3 C 1.714 -23.043 4.942 1.00 . A A . 11 TRP CZ3 1 1 9 2543 1 1 11 TRP H H 7.452 -21.127 1.171 1.00 . A A . 11 TRP H 1 1 9 2544 1 1 11 TRP HA H 5.804 -23.423 1.211 1.00 . A A . 11 TRP HA 1 1 9 2545 1 1 11 TRP HB2 H 6.898 -21.709 3.025 1.00 . A A . 11 TRP HB2 1 1 9 2546 1 1 11 TRP HB3 H 5.338 -20.988 2.988 1.00 . A A . 11 TRP HB3 1 1 9 2547 1 1 11 TRP HD1 H 7.310 -23.924 4.169 1.00 . A A . 11 TRP HD1 1 1 9 2548 1 1 11 TRP HE1 H 5.959 -25.332 5.836 1.00 . A A . 11 TRP HE1 1 1 9 2549 1 1 11 TRP HE3 H 2.703 -21.769 3.513 1.00 . A A . 11 TRP HE3 1 1 9 2550 1 1 11 TRP HH2 H 0.996 -24.451 6.418 1.00 . A A . 11 TRP HH2 1 1 9 2551 1 1 11 TRP HZ2 H 3.220 -25.516 6.755 1.00 . A A . 11 TRP HZ2 1 1 9 2552 1 1 11 TRP HZ3 H 0.749 -22.576 4.801 1.00 . A A . 11 TRP HZ3 1 1 9 2553 1 1 11 TRP N N 6.909 -21.765 0.614 1.00 . A A . 11 TRP N 1 1 9 2554 1 1 11 TRP NE1 N 5.539 -24.602 5.275 1.00 . A A . 11 TRP NE1 1 1 9 2555 1 1 11 TRP O O 3.634 -21.122 1.248 1.00 . A A . 11 TRP O 1 1 9 2556 1 1 12 ARG C C 2.868 -23.050 -2.503 1.00 . A A . 12 ARG C 1 1 9 2557 1 1 12 ARG CA C 2.923 -22.052 -1.343 1.00 . A A . 12 ARG CA 1 1 9 2558 1 1 12 ARG CB C 2.728 -20.580 -1.785 1.00 . A A . 12 ARG CB 1 1 9 2559 1 1 12 ARG CD C 4.901 -19.195 -1.813 1.00 . A A . 12 ARG CD 1 1 9 2560 1 1 12 ARG CG C 3.864 -19.975 -2.638 1.00 . A A . 12 ARG CG 1 1 9 2561 1 1 12 ARG CZ C 6.643 -17.551 -2.614 1.00 . A A . 12 ARG CZ 1 1 9 2562 1 1 12 ARG H H 4.883 -22.799 -1.073 1.00 . A A . 12 ARG H 1 1 9 2563 1 1 12 ARG HA H 2.105 -22.310 -0.667 1.00 . A A . 12 ARG HA 1 1 9 2564 1 1 12 ARG HB2 H 1.806 -20.526 -2.365 1.00 . A A . 12 ARG HB2 1 1 9 2565 1 1 12 ARG HB3 H 2.541 -19.950 -0.914 1.00 . A A . 12 ARG HB3 1 1 9 2566 1 1 12 ARG HD2 H 4.403 -18.362 -1.316 1.00 . A A . 12 ARG HD2 1 1 9 2567 1 1 12 ARG HD3 H 5.321 -19.817 -1.022 1.00 . A A . 12 ARG HD3 1 1 9 2568 1 1 12 ARG HE H 6.405 -19.488 -3.215 1.00 . A A . 12 ARG HE 1 1 9 2569 1 1 12 ARG HG2 H 4.348 -20.745 -3.239 1.00 . A A . 12 ARG HG2 1 1 9 2570 1 1 12 ARG HG3 H 3.419 -19.280 -3.353 1.00 . A A . 12 ARG HG3 1 1 9 2571 1 1 12 ARG HH11 H 5.484 -16.773 -1.139 1.00 . A A . 12 ARG HH11 1 1 9 2572 1 1 12 ARG HH12 H 6.679 -15.681 -1.730 1.00 . A A . 12 ARG HH12 1 1 9 2573 1 1 12 ARG HH21 H 8.032 -18.036 -4.046 1.00 . A A . 12 ARG HH21 1 1 9 2574 1 1 12 ARG HH22 H 8.180 -16.443 -3.425 1.00 . A A . 12 ARG HH22 1 1 9 2575 1 1 12 ARG N N 4.163 -22.253 -0.601 1.00 . A A . 12 ARG N 1 1 9 2576 1 1 12 ARG NE N 6.018 -18.737 -2.658 1.00 . A A . 12 ARG NE 1 1 9 2577 1 1 12 ARG NH1 N 6.232 -16.586 -1.789 1.00 . A A . 12 ARG NH1 1 1 9 2578 1 1 12 ARG NH2 N 7.681 -17.326 -3.420 1.00 . A A . 12 ARG NH2 1 1 9 2579 1 1 12 ARG O O 3.908 -23.428 -3.042 1.00 . A A . 12 ARG O 1 1 9 2580 1 1 13 ARG C C 1.582 -23.652 -5.386 1.00 . A A . 13 ARG C 1 1 9 2581 1 1 13 ARG CA C 1.420 -24.380 -4.032 1.00 . A A . 13 ARG CA 1 1 9 2582 1 1 13 ARG CB C -0.010 -24.954 -3.873 1.00 . A A . 13 ARG CB 1 1 9 2583 1 1 13 ARG CD C -1.795 -26.534 -4.803 1.00 . A A . 13 ARG CD 1 1 9 2584 1 1 13 ARG CG C -0.309 -26.155 -4.794 1.00 . A A . 13 ARG CG 1 1 9 2585 1 1 13 ARG CZ C -2.436 -27.704 -6.943 1.00 . A A . 13 ARG CZ 1 1 9 2586 1 1 13 ARG H H 0.851 -23.039 -2.487 1.00 . A A . 13 ARG H 1 1 9 2587 1 1 13 ARG HA H 2.146 -25.197 -3.975 1.00 . A A . 13 ARG HA 1 1 9 2588 1 1 13 ARG HB2 H -0.162 -25.273 -2.841 1.00 . A A . 13 ARG HB2 1 1 9 2589 1 1 13 ARG HB3 H -0.743 -24.165 -4.050 1.00 . A A . 13 ARG HB3 1 1 9 2590 1 1 13 ARG HD2 H -2.115 -26.781 -3.791 1.00 . A A . 13 ARG HD2 1 1 9 2591 1 1 13 ARG HD3 H -2.411 -25.692 -5.119 1.00 . A A . 13 ARG HD3 1 1 9 2592 1 1 13 ARG HE H -1.873 -28.583 -5.182 1.00 . A A . 13 ARG HE 1 1 9 2593 1 1 13 ARG HG2 H -0.002 -25.942 -5.819 1.00 . A A . 13 ARG HG2 1 1 9 2594 1 1 13 ARG HG3 H 0.296 -27.006 -4.477 1.00 . A A . 13 ARG HG3 1 1 9 2595 1 1 13 ARG HH11 H -2.418 -25.670 -7.164 1.00 . A A . 13 ARG HH11 1 1 9 2596 1 1 13 ARG HH12 H -2.952 -26.515 -8.558 1.00 . A A . 13 ARG HH12 1 1 9 2597 1 1 13 ARG HH21 H -2.510 -29.757 -7.097 1.00 . A A . 13 ARG HH21 1 1 9 2598 1 1 13 ARG HH22 H -2.948 -28.923 -8.525 1.00 . A A . 13 ARG HH22 1 1 9 2599 1 1 13 ARG N N 1.661 -23.439 -2.935 1.00 . A A . 13 ARG N 1 1 9 2600 1 1 13 ARG NE N -2.033 -27.707 -5.665 1.00 . A A . 13 ARG NE 1 1 9 2601 1 1 13 ARG NH1 N -2.624 -26.559 -7.604 1.00 . A A . 13 ARG NH1 1 1 9 2602 1 1 13 ARG NH2 N -2.644 -28.868 -7.563 1.00 . A A . 13 ARG NH2 1 1 9 2603 1 1 13 ARG O O 0.646 -23.521 -6.168 1.00 . A A . 13 ARG O 1 1 9 2604 1 1 14 NH2 HN1 H 2.934 -22.691 -6.544 1.00 . A A . 14 NH2 HN1 1 1 9 2605 1 1 14 NH2 HN2 H 3.516 -23.263 -4.970 1.00 . A A . 14 NH2 HN2 1 1 9 2606 1 1 14 NH2 N N 2.777 -23.148 -5.661 1.00 . A A . 14 NH2 N 1 1 9 2607 2 2 1 . C1 C 7.914 -17.594 4.292 1.00 . B A . 101 BGC C1 1 1 9 2608 2 2 1 . C2 C 7.159 -18.492 5.293 1.00 . B A . 101 BGC C2 1 1 9 2609 2 2 1 . C3 C 6.703 -17.615 6.476 1.00 . B A . 101 BGC C3 1 1 9 2610 2 2 1 . C4 C 7.904 -16.870 7.078 1.00 . B A . 101 BGC C4 1 1 9 2611 2 2 1 . C5 C 8.660 -16.081 5.987 1.00 . B A . 101 BGC C5 1 1 9 2612 2 2 1 . C6 C 9.979 -15.462 6.480 1.00 . B A . 101 BGC C6 1 1 9 2613 2 2 1 . H1 H 7.260 -16.782 3.947 1.00 . B A . 101 BGC H1 1 1 9 2614 2 2 1 . H2 H 7.834 -19.280 5.632 1.00 . B A . 101 BGC H2 1 1 9 2615 2 2 1 . H3 H 5.980 -16.879 6.113 1.00 . B A . 101 BGC H3 1 1 9 2616 2 2 1 . H4 H 8.581 -17.605 7.516 1.00 . B A . 101 BGC H4 1 1 9 2617 2 2 1 . H5 H 8.027 -15.299 5.562 1.00 . B A . 101 BGC H5 1 1 9 2618 2 2 1 . H6 H 9.070 -14.475 7.880 1.00 . B A . 101 BGC H6 1 1 9 2619 2 2 1 . H6C1 H 10.609 -15.231 5.623 1.00 . B A . 101 BGC H6C1 1 1 9 2620 2 2 1 . H6C2 H 10.529 -16.180 7.090 1.00 . B A . 101 BGC H6C2 1 1 9 2621 2 2 1 . HB H 5.756 -19.849 5.179 1.00 . B A . 101 BGC HB 1 1 9 2622 2 2 1 . HC H 5.212 -18.697 7.143 1.00 . B A . 101 BGC HC 1 1 9 2623 2 2 1 . HD H 6.885 -16.554 8.684 1.00 . B A . 101 BGC HD 1 1 9 2624 2 2 1 . O2 O 6.031 -19.080 4.656 1.00 . B A . 101 BGC O2 1 1 9 2625 2 2 1 . O3 O 6.070 -18.400 7.483 1.00 . B A . 101 BGC O3 1 1 9 2626 2 2 1 . O4 O 7.455 -16.005 8.114 1.00 . B A . 101 BGC O4 1 1 9 2627 2 2 1 . O5 O 9.010 -16.998 4.948 1.00 . B A . 101 BGC O5 1 1 9 2628 2 2 1 . O6 O 9.768 -14.267 7.225 1.00 . B A . 101 BGC O6 1 1 10 2629 1 1 1 ILE C C 7.967 5.329 -2.008 1.00 . A A . 1 ILE C 1 1 10 2630 1 1 1 ILE CA C 7.784 6.234 -3.233 1.00 . A A . 1 ILE CA 1 1 10 2631 1 1 1 ILE CB C 8.601 5.739 -4.461 1.00 . A A . 1 ILE CB 1 1 10 2632 1 1 1 ILE CD1 C 10.887 4.869 -5.303 1.00 . A A . 1 ILE CD1 1 1 10 2633 1 1 1 ILE CG1 C 10.134 5.658 -4.221 1.00 . A A . 1 ILE CG1 1 1 10 2634 1 1 1 ILE CG2 C 8.278 6.580 -5.714 1.00 . A A . 1 ILE CG2 1 1 10 2635 1 1 1 ILE H1 H 7.562 7.933 -2.127 1.00 . A A . 1 ILE H1 1 1 10 2636 1 1 1 ILE HA H 6.722 6.253 -3.485 1.00 . A A . 1 ILE HA 1 1 10 2637 1 1 1 ILE HB H 8.258 4.724 -4.674 1.00 . A A . 1 ILE HB 1 1 10 2638 1 1 1 ILE HD11 H 10.492 3.859 -5.414 1.00 . A A . 1 ILE HD11 1 1 10 2639 1 1 1 ILE HD12 H 10.838 5.358 -6.276 1.00 . A A . 1 ILE HD12 1 1 10 2640 1 1 1 ILE HD13 H 11.944 4.779 -5.050 1.00 . A A . 1 ILE HD13 1 1 10 2641 1 1 1 ILE HG12 H 10.568 6.657 -4.149 1.00 . A A . 1 ILE HG12 1 1 10 2642 1 1 1 ILE HG13 H 10.355 5.169 -3.272 1.00 . A A . 1 ILE HG13 1 1 10 2643 1 1 1 ILE HG21 H 7.203 6.668 -5.877 1.00 . A A . 1 ILE HG21 1 1 10 2644 1 1 1 ILE HG22 H 8.693 7.587 -5.660 1.00 . A A . 1 ILE HG22 1 1 10 2645 1 1 1 ILE HG23 H 8.685 6.118 -6.615 1.00 . A A . 1 ILE HG23 1 1 10 2646 1 1 1 ILE N N 8.187 7.598 -2.847 1.00 . A A . 1 ILE N 1 1 10 2647 1 1 1 ILE O O 8.704 5.728 -1.110 1.00 . A A . 1 ILE O 1 1 10 2648 1 1 2 LEU C C 7.489 1.752 -1.522 1.00 . A A . 2 LEU C 1 1 10 2649 1 1 2 LEU CA C 7.509 3.162 -0.898 1.00 . A A . 2 LEU CA 1 1 10 2650 1 1 2 LEU CB C 6.442 3.408 0.203 1.00 . A A . 2 LEU CB 1 1 10 2651 1 1 2 LEU CD1 C 6.748 1.271 1.643 1.00 . A A . 2 LEU CD1 1 1 10 2652 1 1 2 LEU CD2 C 7.968 3.409 2.276 1.00 . A A . 2 LEU CD2 1 1 10 2653 1 1 2 LEU CG C 6.724 2.808 1.604 1.00 . A A . 2 LEU CG 1 1 10 2654 1 1 2 LEU H H 6.738 3.855 -2.727 1.00 . A A . 2 LEU H 1 1 10 2655 1 1 2 LEU HA H 8.480 3.311 -0.431 1.00 . A A . 2 LEU HA 1 1 10 2656 1 1 2 LEU HB2 H 6.318 4.484 0.343 1.00 . A A . 2 LEU HB2 1 1 10 2657 1 1 2 LEU HB3 H 5.466 3.058 -0.142 1.00 . A A . 2 LEU HB3 1 1 10 2658 1 1 2 LEU HD11 H 5.869 0.851 1.157 1.00 . A A . 2 LEU HD11 1 1 10 2659 1 1 2 LEU HD12 H 6.744 0.910 2.673 1.00 . A A . 2 LEU HD12 1 1 10 2660 1 1 2 LEU HD13 H 7.634 0.857 1.162 1.00 . A A . 2 LEU HD13 1 1 10 2661 1 1 2 LEU HD21 H 8.893 3.090 1.795 1.00 . A A . 2 LEU HD21 1 1 10 2662 1 1 2 LEU HD22 H 8.028 3.106 3.321 1.00 . A A . 2 LEU HD22 1 1 10 2663 1 1 2 LEU HD23 H 7.941 4.500 2.259 1.00 . A A . 2 LEU HD23 1 1 10 2664 1 1 2 LEU HG H 5.874 3.105 2.221 1.00 . A A . 2 LEU HG 1 1 10 2665 1 1 2 LEU N N 7.347 4.144 -1.972 1.00 . A A . 2 LEU N 1 1 10 2666 1 1 2 LEU O O 6.403 1.216 -1.735 1.00 . A A . 2 LEU O 1 1 10 2667 1 1 3 PRO C C 8.674 -1.196 -1.125 1.00 . A A . 3 PRO C 1 1 10 2668 1 1 3 PRO CA C 8.692 -0.244 -2.341 1.00 . A A . 3 PRO CA 1 1 10 2669 1 1 3 PRO CB C 10.022 -0.329 -3.114 1.00 . A A . 3 PRO CB 1 1 10 2670 1 1 3 PRO CD C 9.958 1.794 -1.966 1.00 . A A . 3 PRO CD 1 1 10 2671 1 1 3 PRO CG C 10.923 0.719 -2.468 1.00 . A A . 3 PRO CG 1 1 10 2672 1 1 3 PRO HA H 7.861 -0.478 -3.010 1.00 . A A . 3 PRO HA 1 1 10 2673 1 1 3 PRO HB2 H 10.462 -1.327 -3.107 1.00 . A A . 3 PRO HB2 1 1 10 2674 1 1 3 PRO HB3 H 9.845 -0.064 -4.157 1.00 . A A . 3 PRO HB3 1 1 10 2675 1 1 3 PRO HD2 H 10.290 2.180 -1.001 1.00 . A A . 3 PRO HD2 1 1 10 2676 1 1 3 PRO HD3 H 9.909 2.625 -2.672 1.00 . A A . 3 PRO HD3 1 1 10 2677 1 1 3 PRO HG2 H 11.450 0.282 -1.619 1.00 . A A . 3 PRO HG2 1 1 10 2678 1 1 3 PRO HG3 H 11.673 1.114 -3.156 1.00 . A A . 3 PRO HG3 1 1 10 2679 1 1 3 PRO N N 8.643 1.149 -1.881 1.00 . A A . 3 PRO N 1 1 10 2680 1 1 3 PRO O O 9.676 -1.300 -0.417 1.00 . A A . 3 PRO O 1 1 10 2681 1 1 4 TRP C C 8.309 -3.922 0.436 1.00 . A A . 4 TRP C 1 1 10 2682 1 1 4 TRP CA C 7.294 -2.776 0.256 1.00 . A A . 4 TRP CA 1 1 10 2683 1 1 4 TRP CB C 5.863 -3.359 0.164 1.00 . A A . 4 TRP CB 1 1 10 2684 1 1 4 TRP CD1 C 4.384 -2.993 2.178 1.00 . A A . 4 TRP CD1 1 1 10 2685 1 1 4 TRP CD2 C 4.078 -1.419 0.605 1.00 . A A . 4 TRP CD2 1 1 10 2686 1 1 4 TRP CE2 C 3.212 -1.095 1.694 1.00 . A A . 4 TRP CE2 1 1 10 2687 1 1 4 TRP CE3 C 4.040 -0.556 -0.516 1.00 . A A . 4 TRP CE3 1 1 10 2688 1 1 4 TRP CG C 4.821 -2.628 0.953 1.00 . A A . 4 TRP CG 1 1 10 2689 1 1 4 TRP CH2 C 2.373 0.876 0.555 1.00 . A A . 4 TRP CH2 1 1 10 2690 1 1 4 TRP CZ2 C 2.371 0.032 1.681 1.00 . A A . 4 TRP CZ2 1 1 10 2691 1 1 4 TRP CZ3 C 3.205 0.580 -0.541 1.00 . A A . 4 TRP CZ3 1 1 10 2692 1 1 4 TRP H H 6.750 -1.664 -1.468 1.00 . A A . 4 TRP H 1 1 10 2693 1 1 4 TRP HA H 7.366 -2.167 1.161 1.00 . A A . 4 TRP HA 1 1 10 2694 1 1 4 TRP HB2 H 5.529 -3.443 -0.870 1.00 . A A . 4 TRP HB2 1 1 10 2695 1 1 4 TRP HB3 H 5.849 -4.383 0.544 1.00 . A A . 4 TRP HB3 1 1 10 2696 1 1 4 TRP HD1 H 4.736 -3.861 2.720 1.00 . A A . 4 TRP HD1 1 1 10 2697 1 1 4 TRP HE1 H 2.968 -2.171 3.512 1.00 . A A . 4 TRP HE1 1 1 10 2698 1 1 4 TRP HE3 H 4.669 -0.761 -1.368 1.00 . A A . 4 TRP HE3 1 1 10 2699 1 1 4 TRP HH2 H 1.730 1.745 0.533 1.00 . A A . 4 TRP HH2 1 1 10 2700 1 1 4 TRP HZ2 H 1.728 0.247 2.521 1.00 . A A . 4 TRP HZ2 1 1 10 2701 1 1 4 TRP HZ3 H 3.205 1.224 -1.407 1.00 . A A . 4 TRP HZ3 1 1 10 2702 1 1 4 TRP N N 7.548 -1.890 -0.892 1.00 . A A . 4 TRP N 1 1 10 2703 1 1 4 TRP NE1 N 3.435 -2.093 2.617 1.00 . A A . 4 TRP NE1 1 1 10 2704 1 1 4 TRP O O 8.705 -4.233 1.557 1.00 . A A . 4 TRP O 1 1 10 2705 1 1 5 LYS C C 9.208 -6.919 -0.035 1.00 . A A . 5 LYS C 1 1 10 2706 1 1 5 LYS CA C 9.706 -5.639 -0.737 1.00 . A A . 5 LYS CA 1 1 10 2707 1 1 5 LYS CB C 11.112 -5.180 -0.268 1.00 . A A . 5 LYS CB 1 1 10 2708 1 1 5 LYS CD C 13.103 -3.619 -0.673 1.00 . A A . 5 LYS CD 1 1 10 2709 1 1 5 LYS CE C 13.696 -2.514 -1.564 1.00 . A A . 5 LYS CE 1 1 10 2710 1 1 5 LYS CG C 11.742 -4.114 -1.184 1.00 . A A . 5 LYS CG 1 1 10 2711 1 1 5 LYS H H 8.315 -4.239 -1.538 1.00 . A A . 5 LYS H 1 1 10 2712 1 1 5 LYS HA H 9.794 -5.912 -1.790 1.00 . A A . 5 LYS HA 1 1 10 2713 1 1 5 LYS HB2 H 11.066 -4.812 0.758 1.00 . A A . 5 LYS HB2 1 1 10 2714 1 1 5 LYS HB3 H 11.776 -6.044 -0.242 1.00 . A A . 5 LYS HB3 1 1 10 2715 1 1 5 LYS HD2 H 12.980 -3.244 0.346 1.00 . A A . 5 LYS HD2 1 1 10 2716 1 1 5 LYS HD3 H 13.789 -4.466 -0.614 1.00 . A A . 5 LYS HD3 1 1 10 2717 1 1 5 LYS HE2 H 13.799 -2.875 -2.589 1.00 . A A . 5 LYS HE2 1 1 10 2718 1 1 5 LYS HE3 H 13.019 -1.659 -1.596 1.00 . A A . 5 LYS HE3 1 1 10 2719 1 1 5 LYS HG2 H 11.847 -4.522 -2.190 1.00 . A A . 5 LYS HG2 1 1 10 2720 1 1 5 LYS HG3 H 11.062 -3.267 -1.270 1.00 . A A . 5 LYS HG3 1 1 10 2721 1 1 5 LYS HZ1 H 15.376 -1.339 -1.681 1.00 . A A . 5 LYS HZ1 1 1 10 2722 1 1 5 LYS HZ2 H 15.668 -2.840 -1.081 1.00 . A A . 5 LYS HZ2 1 1 10 2723 1 1 5 LYS HZ3 H 14.936 -1.704 -0.138 1.00 . A A . 5 LYS HZ3 1 1 10 2724 1 1 5 LYS N N 8.716 -4.559 -0.673 1.00 . A A . 5 LYS N 1 1 10 2725 1 1 5 LYS NZ N 15.016 -2.068 -1.077 1.00 . A A . 5 LYS NZ 1 1 10 2726 1 1 5 LYS O O 9.822 -7.408 0.919 1.00 . A A . 5 LYS O 1 1 10 2727 1 1 6 TRP C C 8.628 -9.837 -0.810 1.00 . A A . 6 TRP C 1 1 10 2728 1 1 6 TRP CA C 7.620 -8.826 -0.235 1.00 . A A . 6 TRP CA 1 1 10 2729 1 1 6 TRP CB C 6.223 -9.023 -0.851 1.00 . A A . 6 TRP CB 1 1 10 2730 1 1 6 TRP CD1 C 4.639 -7.081 -1.246 1.00 . A A . 6 TRP CD1 1 1 10 2731 1 1 6 TRP CD2 C 4.629 -7.779 0.890 1.00 . A A . 6 TRP CD2 1 1 10 2732 1 1 6 TRP CE2 C 3.720 -6.682 0.808 1.00 . A A . 6 TRP CE2 1 1 10 2733 1 1 6 TRP CE3 C 4.775 -8.395 2.157 1.00 . A A . 6 TRP CE3 1 1 10 2734 1 1 6 TRP CG C 5.203 -8.004 -0.434 1.00 . A A . 6 TRP CG 1 1 10 2735 1 1 6 TRP CH2 C 3.165 -6.853 3.163 1.00 . A A . 6 TRP CH2 1 1 10 2736 1 1 6 TRP CZ2 C 2.995 -6.217 1.919 1.00 . A A . 6 TRP CZ2 1 1 10 2737 1 1 6 TRP CZ3 C 4.052 -7.941 3.279 1.00 . A A . 6 TRP CZ3 1 1 10 2738 1 1 6 TRP H H 7.639 -7.001 -1.293 1.00 . A A . 6 TRP H 1 1 10 2739 1 1 6 TRP HA H 7.556 -8.948 0.848 1.00 . A A . 6 TRP HA 1 1 10 2740 1 1 6 TRP HB2 H 6.293 -9.020 -1.940 1.00 . A A . 6 TRP HB2 1 1 10 2741 1 1 6 TRP HB3 H 5.836 -10.007 -0.582 1.00 . A A . 6 TRP HB3 1 1 10 2742 1 1 6 TRP HD1 H 4.842 -6.989 -2.304 1.00 . A A . 6 TRP HD1 1 1 10 2743 1 1 6 TRP HE1 H 3.184 -5.583 -0.928 1.00 . A A . 6 TRP HE1 1 1 10 2744 1 1 6 TRP HE3 H 5.437 -9.240 2.262 1.00 . A A . 6 TRP HE3 1 1 10 2745 1 1 6 TRP HH2 H 2.607 -6.512 4.022 1.00 . A A . 6 TRP HH2 1 1 10 2746 1 1 6 TRP HZ2 H 2.312 -5.386 1.822 1.00 . A A . 6 TRP HZ2 1 1 10 2747 1 1 6 TRP HZ3 H 4.167 -8.435 4.234 1.00 . A A . 6 TRP HZ3 1 1 10 2748 1 1 6 TRP N N 8.091 -7.469 -0.525 1.00 . A A . 6 TRP N 1 1 10 2749 1 1 6 TRP NE1 N 3.771 -6.296 -0.515 1.00 . A A . 6 TRP NE1 1 1 10 2750 1 1 6 TRP O O 9.272 -9.550 -1.817 1.00 . A A . 6 TRP O 1 1 10 2751 1 1 7 LYS C C 9.638 -13.273 -0.699 1.00 . A A . 7 LYS C 1 1 10 2752 1 1 7 LYS CA C 9.997 -11.836 -0.301 1.00 . A A . 7 LYS CA 1 1 10 2753 1 1 7 LYS CB C 10.849 -11.794 0.988 1.00 . A A . 7 LYS CB 1 1 10 2754 1 1 7 LYS CD C 12.087 -10.203 2.604 1.00 . A A . 7 LYS CD 1 1 10 2755 1 1 7 LYS CE C 10.962 -9.725 3.546 1.00 . A A . 7 LYS CE 1 1 10 2756 1 1 7 LYS CG C 11.624 -10.470 1.161 1.00 . A A . 7 LYS CG 1 1 10 2757 1 1 7 LYS H H 8.180 -11.176 0.636 1.00 . A A . 7 LYS H 1 1 10 2758 1 1 7 LYS HA H 10.623 -11.477 -1.121 1.00 . A A . 7 LYS HA 1 1 10 2759 1 1 7 LYS HB2 H 10.206 -11.994 1.845 1.00 . A A . 7 LYS HB2 1 1 10 2760 1 1 7 LYS HB3 H 11.575 -12.612 0.978 1.00 . A A . 7 LYS HB3 1 1 10 2761 1 1 7 LYS HD2 H 12.528 -11.120 3.001 1.00 . A A . 7 LYS HD2 1 1 10 2762 1 1 7 LYS HD3 H 12.899 -9.474 2.598 1.00 . A A . 7 LYS HD3 1 1 10 2763 1 1 7 LYS HE2 H 10.083 -10.365 3.460 1.00 . A A . 7 LYS HE2 1 1 10 2764 1 1 7 LYS HE3 H 11.300 -9.806 4.580 1.00 . A A . 7 LYS HE3 1 1 10 2765 1 1 7 LYS HG2 H 12.496 -10.507 0.506 1.00 . A A . 7 LYS HG2 1 1 10 2766 1 1 7 LYS HG3 H 11.036 -9.630 0.800 1.00 . A A . 7 LYS HG3 1 1 10 2767 1 1 7 LYS HZ1 H 9.798 -8.058 3.891 1.00 . A A . 7 LYS HZ1 1 1 10 2768 1 1 7 LYS HZ2 H 10.283 -8.166 2.330 1.00 . A A . 7 LYS HZ2 1 1 10 2769 1 1 7 LYS HZ3 H 11.347 -7.701 3.482 1.00 . A A . 7 LYS HZ3 1 1 10 2770 1 1 7 LYS N N 8.831 -10.962 -0.117 1.00 . A A . 7 LYS N 1 1 10 2771 1 1 7 LYS NZ N 10.573 -8.321 3.301 1.00 . A A . 7 LYS NZ 1 1 10 2772 1 1 7 LYS O O 10.534 -14.020 -1.068 1.00 . A A . 7 LYS O 1 1 10 2773 1 1 8 TRP C C 8.407 -16.171 -0.586 1.00 . A A . 8 TRP C 1 1 10 2774 1 1 8 TRP CA C 7.766 -14.884 -1.147 1.00 . A A . 8 TRP CA 1 1 10 2775 1 1 8 TRP CB C 7.709 -14.861 -2.689 1.00 . A A . 8 TRP CB 1 1 10 2776 1 1 8 TRP CD1 C 7.028 -16.878 -4.073 1.00 . A A . 8 TRP CD1 1 1 10 2777 1 1 8 TRP CD2 C 5.274 -15.883 -3.082 1.00 . A A . 8 TRP CD2 1 1 10 2778 1 1 8 TRP CE2 C 4.764 -17.007 -3.797 1.00 . A A . 8 TRP CE2 1 1 10 2779 1 1 8 TRP CE3 C 4.334 -15.096 -2.373 1.00 . A A . 8 TRP CE3 1 1 10 2780 1 1 8 TRP CG C 6.724 -15.832 -3.273 1.00 . A A . 8 TRP CG 1 1 10 2781 1 1 8 TRP CH2 C 2.493 -16.540 -3.078 1.00 . A A . 8 TRP CH2 1 1 10 2782 1 1 8 TRP CZ2 C 3.396 -17.339 -3.802 1.00 . A A . 8 TRP CZ2 1 1 10 2783 1 1 8 TRP CZ3 C 2.961 -15.420 -2.366 1.00 . A A . 8 TRP CZ3 1 1 10 2784 1 1 8 TRP H H 7.705 -12.932 -0.333 1.00 . A A . 8 TRP H 1 1 10 2785 1 1 8 TRP HA H 6.735 -14.891 -0.803 1.00 . A A . 8 TRP HA 1 1 10 2786 1 1 8 TRP HB2 H 7.413 -13.872 -3.038 1.00 . A A . 8 TRP HB2 1 1 10 2787 1 1 8 TRP HB3 H 8.699 -15.046 -3.113 1.00 . A A . 8 TRP HB3 1 1 10 2788 1 1 8 TRP HD1 H 8.031 -17.125 -4.390 1.00 . A A . 8 TRP HD1 1 1 10 2789 1 1 8 TRP HE1 H 5.875 -18.372 -4.998 1.00 . A A . 8 TRP HE1 1 1 10 2790 1 1 8 TRP HE3 H 4.672 -14.226 -1.831 1.00 . A A . 8 TRP HE3 1 1 10 2791 1 1 8 TRP HH2 H 1.440 -16.783 -3.074 1.00 . A A . 8 TRP HH2 1 1 10 2792 1 1 8 TRP HZ2 H 3.041 -18.194 -4.356 1.00 . A A . 8 TRP HZ2 1 1 10 2793 1 1 8 TRP HZ3 H 2.263 -14.802 -1.819 1.00 . A A . 8 TRP HZ3 1 1 10 2794 1 1 8 TRP N N 8.353 -13.646 -0.625 1.00 . A A . 8 TRP N 1 1 10 2795 1 1 8 TRP NE1 N 5.874 -17.567 -4.391 1.00 . A A . 8 TRP NE1 1 1 10 2796 1 1 8 TRP O O 9.056 -16.928 -1.305 1.00 . A A . 8 TRP O 1 1 10 2797 1 1 9 THR C C 7.668 -18.890 0.485 1.00 . A A . 9 THR C 1 1 10 2798 1 1 9 THR CA C 8.344 -17.767 1.314 1.00 . A A . 9 THR CA 1 1 10 2799 1 1 9 THR CB C 7.931 -17.781 2.817 1.00 . A A . 9 THR CB 1 1 10 2800 1 1 9 THR CG2 C 8.813 -16.899 3.721 1.00 . A A . 9 THR CG2 1 1 10 2801 1 1 9 THR H H 7.712 -15.757 1.275 1.00 . A A . 9 THR H 1 1 10 2802 1 1 9 THR HA H 9.420 -17.931 1.288 1.00 . A A . 9 THR HA 1 1 10 2803 1 1 9 THR HB H 8.091 -18.801 3.173 1.00 . A A . 9 THR HB 1 1 10 2804 1 1 9 THR HG21 H 8.842 -15.858 3.405 1.00 . A A . 9 THR HG21 1 1 10 2805 1 1 9 THR HG22 H 9.843 -17.257 3.714 1.00 . A A . 9 THR HG22 1 1 10 2806 1 1 9 THR HG23 H 8.464 -16.931 4.752 1.00 . A A . 9 THR HG23 1 1 10 2807 1 1 9 THR N N 8.191 -16.440 0.709 1.00 . A A . 9 THR N 1 1 10 2808 1 1 9 THR O O 6.531 -18.684 0.049 1.00 . A A . 9 THR O 1 1 10 2809 1 1 9 THR OG1 O 6.525 -17.503 3.073 1.00 . A A . 9 THR OG1 1 1 10 2810 1 1 10 PRO C C 6.692 -21.837 -0.312 1.00 . A A . 10 PRO C 1 1 10 2811 1 1 10 PRO CA C 7.894 -21.004 -0.777 1.00 . A A . 10 PRO CA 1 1 10 2812 1 1 10 PRO CB C 9.121 -21.889 -1.047 1.00 . A A . 10 PRO CB 1 1 10 2813 1 1 10 PRO CD C 9.635 -20.427 0.794 1.00 . A A . 10 PRO CD 1 1 10 2814 1 1 10 PRO CG C 9.931 -21.822 0.238 1.00 . A A . 10 PRO CG 1 1 10 2815 1 1 10 PRO HA H 7.622 -20.472 -1.692 1.00 . A A . 10 PRO HA 1 1 10 2816 1 1 10 PRO HB2 H 8.871 -22.912 -1.332 1.00 . A A . 10 PRO HB2 1 1 10 2817 1 1 10 PRO HB3 H 9.703 -21.458 -1.865 1.00 . A A . 10 PRO HB3 1 1 10 2818 1 1 10 PRO HD2 H 9.618 -20.427 1.885 1.00 . A A . 10 PRO HD2 1 1 10 2819 1 1 10 PRO HD3 H 10.411 -19.736 0.457 1.00 . A A . 10 PRO HD3 1 1 10 2820 1 1 10 PRO HG2 H 9.563 -22.578 0.936 1.00 . A A . 10 PRO HG2 1 1 10 2821 1 1 10 PRO HG3 H 10.995 -22.002 0.083 1.00 . A A . 10 PRO HG3 1 1 10 2822 1 1 10 PRO N N 8.347 -20.029 0.220 1.00 . A A . 10 PRO N 1 1 10 2823 1 1 10 PRO O O 6.536 -22.148 0.870 1.00 . A A . 10 PRO O 1 1 10 2824 1 1 11 TRP C C 5.102 -24.526 -0.968 1.00 . A A . 11 TRP C 1 1 10 2825 1 1 11 TRP CA C 4.675 -23.053 -1.072 1.00 . A A . 11 TRP CA 1 1 10 2826 1 1 11 TRP CB C 3.745 -22.873 -2.287 1.00 . A A . 11 TRP CB 1 1 10 2827 1 1 11 TRP CD1 C 1.366 -23.253 -1.504 1.00 . A A . 11 TRP CD1 1 1 10 2828 1 1 11 TRP CD2 C 2.060 -24.833 -2.941 1.00 . A A . 11 TRP CD2 1 1 10 2829 1 1 11 TRP CE2 C 0.711 -25.150 -2.596 1.00 . A A . 11 TRP CE2 1 1 10 2830 1 1 11 TRP CE3 C 2.706 -25.692 -3.861 1.00 . A A . 11 TRP CE3 1 1 10 2831 1 1 11 TRP CG C 2.446 -23.616 -2.231 1.00 . A A . 11 TRP CG 1 1 10 2832 1 1 11 TRP CH2 C 0.704 -27.082 -4.065 1.00 . A A . 11 TRP CH2 1 1 10 2833 1 1 11 TRP CZ2 C 0.037 -26.256 -3.142 1.00 . A A . 11 TRP CZ2 1 1 10 2834 1 1 11 TRP CZ3 C 2.037 -26.799 -4.424 1.00 . A A . 11 TRP CZ3 1 1 10 2835 1 1 11 TRP H H 6.086 -21.976 -2.225 1.00 . A A . 11 TRP H 1 1 10 2836 1 1 11 TRP HA H 4.160 -22.733 -0.164 1.00 . A A . 11 TRP HA 1 1 10 2837 1 1 11 TRP HB2 H 3.502 -21.815 -2.394 1.00 . A A . 11 TRP HB2 1 1 10 2838 1 1 11 TRP HB3 H 4.256 -23.153 -3.209 1.00 . A A . 11 TRP HB3 1 1 10 2839 1 1 11 TRP HD1 H 1.322 -22.370 -0.880 1.00 . A A . 11 TRP HD1 1 1 10 2840 1 1 11 TRP HE1 H -0.580 -24.032 -1.320 1.00 . A A . 11 TRP HE1 1 1 10 2841 1 1 11 TRP HE3 H 3.725 -25.478 -4.149 1.00 . A A . 11 TRP HE3 1 1 10 2842 1 1 11 TRP HH2 H 0.189 -27.919 -4.510 1.00 . A A . 11 TRP HH2 1 1 10 2843 1 1 11 TRP HZ2 H -0.990 -26.457 -2.875 1.00 . A A . 11 TRP HZ2 1 1 10 2844 1 1 11 TRP HZ3 H 2.543 -27.420 -5.146 1.00 . A A . 11 TRP HZ3 1 1 10 2845 1 1 11 TRP N N 5.854 -22.228 -1.279 1.00 . A A . 11 TRP N 1 1 10 2846 1 1 11 TRP NE1 N 0.346 -24.160 -1.708 1.00 . A A . 11 TRP NE1 1 1 10 2847 1 1 11 TRP O O 5.813 -25.046 -1.830 1.00 . A A . 11 TRP O 1 1 10 2848 1 1 12 ARG C C 4.202 -27.480 -0.751 1.00 . A A . 12 ARG C 1 1 10 2849 1 1 12 ARG CA C 4.853 -26.621 0.355 1.00 . A A . 12 ARG CA 1 1 10 2850 1 1 12 ARG CB C 4.315 -26.959 1.769 1.00 . A A . 12 ARG CB 1 1 10 2851 1 1 12 ARG CD C 1.916 -27.861 2.152 1.00 . A A . 12 ARG CD 1 1 10 2852 1 1 12 ARG CG C 2.827 -26.625 2.048 1.00 . A A . 12 ARG CG 1 1 10 2853 1 1 12 ARG CZ C 1.459 -29.672 3.835 1.00 . A A . 12 ARG CZ 1 1 10 2854 1 1 12 ARG H H 4.088 -24.671 0.745 1.00 . A A . 12 ARG H 1 1 10 2855 1 1 12 ARG HA H 5.931 -26.798 0.348 1.00 . A A . 12 ARG HA 1 1 10 2856 1 1 12 ARG HB2 H 4.514 -28.011 1.984 1.00 . A A . 12 ARG HB2 1 1 10 2857 1 1 12 ARG HB3 H 4.928 -26.412 2.488 1.00 . A A . 12 ARG HB3 1 1 10 2858 1 1 12 ARG HD2 H 0.874 -27.540 2.101 1.00 . A A . 12 ARG HD2 1 1 10 2859 1 1 12 ARG HD3 H 2.080 -28.540 1.314 1.00 . A A . 12 ARG HD3 1 1 10 2860 1 1 12 ARG HE H 2.815 -28.139 4.019 1.00 . A A . 12 ARG HE 1 1 10 2861 1 1 12 ARG HG2 H 2.757 -26.049 2.972 1.00 . A A . 12 ARG HG2 1 1 10 2862 1 1 12 ARG HG3 H 2.425 -25.960 1.280 1.00 . A A . 12 ARG HG3 1 1 10 2863 1 1 12 ARG HH11 H 0.262 -29.788 2.187 1.00 . A A . 12 ARG HH11 1 1 10 2864 1 1 12 ARG HH12 H -0.015 -31.038 3.336 1.00 . A A . 12 ARG HH12 1 1 10 2865 1 1 12 ARG HH21 H 2.446 -29.839 5.637 1.00 . A A . 12 ARG HH21 1 1 10 2866 1 1 12 ARG HH22 H 1.275 -31.054 5.357 1.00 . A A . 12 ARG HH22 1 1 10 2867 1 1 12 ARG N N 4.646 -25.200 0.093 1.00 . A A . 12 ARG N 1 1 10 2868 1 1 12 ARG NE N 2.118 -28.575 3.427 1.00 . A A . 12 ARG NE 1 1 10 2869 1 1 12 ARG NH1 N 0.514 -30.218 3.067 1.00 . A A . 12 ARG NH1 1 1 10 2870 1 1 12 ARG NH2 N 1.750 -30.229 5.013 1.00 . A A . 12 ARG NH2 1 1 10 2871 1 1 12 ARG O O 2.978 -27.483 -0.886 1.00 . A A . 12 ARG O 1 1 10 2872 1 1 13 ARG C C 3.716 -30.044 -2.611 1.00 . A A . 13 ARG C 1 1 10 2873 1 1 13 ARG CA C 4.748 -28.900 -2.779 1.00 . A A . 13 ARG CA 1 1 10 2874 1 1 13 ARG CB C 6.098 -29.413 -3.353 1.00 . A A . 13 ARG CB 1 1 10 2875 1 1 13 ARG CD C 6.651 -31.369 -4.954 1.00 . A A . 13 ARG CD 1 1 10 2876 1 1 13 ARG CG C 6.034 -29.967 -4.798 1.00 . A A . 13 ARG CG 1 1 10 2877 1 1 13 ARG CZ C 5.735 -33.707 -4.622 1.00 . A A . 13 ARG CZ 1 1 10 2878 1 1 13 ARG H H 6.016 -28.020 -1.347 1.00 . A A . 13 ARG H 1 1 10 2879 1 1 13 ARG HA H 4.336 -28.176 -3.481 1.00 . A A . 13 ARG HA 1 1 10 2880 1 1 13 ARG HB2 H 6.821 -28.595 -3.345 1.00 . A A . 13 ARG HB2 1 1 10 2881 1 1 13 ARG HB3 H 6.514 -30.163 -2.680 1.00 . A A . 13 ARG HB3 1 1 10 2882 1 1 13 ARG HD2 H 6.778 -31.579 -6.018 1.00 . A A . 13 ARG HD2 1 1 10 2883 1 1 13 ARG HD3 H 7.642 -31.419 -4.498 1.00 . A A . 13 ARG HD3 1 1 10 2884 1 1 13 ARG HE H 5.102 -31.995 -3.688 1.00 . A A . 13 ARG HE 1 1 10 2885 1 1 13 ARG HG2 H 5.008 -29.975 -5.169 1.00 . A A . 13 ARG HG2 1 1 10 2886 1 1 13 ARG HG3 H 6.560 -29.278 -5.460 1.00 . A A . 13 ARG HG3 1 1 10 2887 1 1 13 ARG HH11 H 7.295 -33.705 -5.940 1.00 . A A . 13 ARG HH11 1 1 10 2888 1 1 13 ARG HH12 H 6.595 -35.253 -5.695 1.00 . A A . 13 ARG HH12 1 1 10 2889 1 1 13 ARG HH21 H 4.163 -34.027 -3.358 1.00 . A A . 13 ARG HH21 1 1 10 2890 1 1 13 ARG HH22 H 4.734 -35.452 -4.138 1.00 . A A . 13 ARG HH22 1 1 10 2891 1 1 13 ARG N N 5.038 -28.174 -1.538 1.00 . A A . 13 ARG N 1 1 10 2892 1 1 13 ARG NE N 5.764 -32.392 -4.375 1.00 . A A . 13 ARG NE 1 1 10 2893 1 1 13 ARG NH1 N 6.596 -34.267 -5.473 1.00 . A A . 13 ARG NH1 1 1 10 2894 1 1 13 ARG NH2 N 4.822 -34.454 -3.998 1.00 . A A . 13 ARG NH2 1 1 10 2895 1 1 13 ARG O O 4.041 -31.230 -2.683 1.00 . A A . 13 ARG O 1 1 10 2896 1 1 14 NH2 HN1 H 1.729 -30.397 -2.340 1.00 . A A . 14 NH2 HN1 1 1 10 2897 1 1 14 NH2 HN2 H 2.261 -28.717 -2.217 1.00 . A A . 14 NH2 HN2 1 1 10 2898 1 1 14 NH2 N N 2.453 -29.703 -2.408 1.00 . A A . 14 NH2 N 1 1 10 2899 2 2 1 . C1 C 5.897 -16.358 2.532 1.00 . B A . 101 BGC C1 1 1 10 2900 2 2 1 . C2 C 4.511 -16.206 3.183 1.00 . B A . 101 BGC C2 1 1 10 2901 2 2 1 . C3 C 3.810 -14.971 2.603 1.00 . B A . 101 BGC C3 1 1 10 2902 2 2 1 . C4 C 4.697 -13.745 2.823 1.00 . B A . 101 BGC C4 1 1 10 2903 2 2 1 . C5 C 6.072 -13.983 2.170 1.00 . B A . 101 BGC C5 1 1 10 2904 2 2 1 . C6 C 7.075 -12.848 2.433 1.00 . B A . 101 BGC C6 1 1 10 2905 2 2 1 . H1 H 5.794 -16.527 1.450 1.00 . B A . 101 BGC H1 1 1 10 2906 2 2 1 . H2 H 4.642 -16.102 4.262 1.00 . B A . 101 BGC H2 1 1 10 2907 2 2 1 . H3 H 3.643 -15.123 1.533 1.00 . B A . 101 BGC H3 1 1 10 2908 2 2 1 . H4 H 4.828 -13.596 3.896 1.00 . B A . 101 BGC H4 1 1 10 2909 2 2 1 . H5 H 5.950 -14.124 1.097 1.00 . B A . 101 BGC H5 1 1 10 2910 2 2 1 . H6 H 5.781 -11.577 1.769 1.00 . B A . 101 BGC H6 1 1 10 2911 2 2 1 . H6C1 H 8.083 -13.176 2.178 1.00 . B A . 101 BGC H6C1 1 1 10 2912 2 2 1 . H6C2 H 7.084 -12.598 3.495 1.00 . B A . 101 BGC H6C2 1 1 10 2913 2 2 1 . HB H 4.306 -18.130 3.149 1.00 . B A . 101 BGC HB 1 1 10 2914 2 2 1 . HC H 2.097 -15.636 3.186 1.00 . B A . 101 BGC HC 1 1 10 2915 2 2 1 . HD H 3.131 -12.656 2.581 1.00 . B A . 101 BGC HD 1 1 10 2916 2 2 1 . O2 O 3.745 -17.370 2.919 1.00 . B A . 101 BGC O2 1 1 10 2917 2 2 1 . O3 O 2.551 -14.776 3.232 1.00 . B A . 101 BGC O3 1 1 10 2918 2 2 1 . O4 O 4.060 -12.590 2.286 1.00 . B A . 101 BGC O4 1 1 10 2919 2 2 1 . O5 O 6.638 -15.171 2.728 1.00 . B A . 101 BGC O5 1 1 10 2920 2 2 1 . O6 O 6.754 -11.687 1.671 1.00 . B A . 101 BGC O6 1 1 11 2921 1 1 1 ILE C C 8.344 5.240 -3.353 1.00 . A A . 1 ILE C 1 1 11 2922 1 1 1 ILE CA C 8.098 6.620 -2.730 1.00 . A A . 1 ILE CA 1 1 11 2923 1 1 1 ILE CB C 6.604 6.822 -2.326 1.00 . A A . 1 ILE CB 1 1 11 2924 1 1 1 ILE CD1 C 5.750 9.142 -3.140 1.00 . A A . 1 ILE CD1 1 1 11 2925 1 1 1 ILE CG1 C 6.263 8.292 -1.963 1.00 . A A . 1 ILE CG1 1 1 11 2926 1 1 1 ILE CG2 C 6.189 5.900 -1.158 1.00 . A A . 1 ILE CG2 1 1 11 2927 1 1 1 ILE H1 H 9.501 7.583 -3.876 1.00 . A A . 1 ILE H1 1 1 11 2928 1 1 1 ILE HA H 8.742 6.758 -1.859 1.00 . A A . 1 ILE HA 1 1 11 2929 1 1 1 ILE HB H 5.973 6.536 -3.172 1.00 . A A . 1 ILE HB 1 1 11 2930 1 1 1 ILE HD11 H 5.448 10.132 -2.789 1.00 . A A . 1 ILE HD11 1 1 11 2931 1 1 1 ILE HD12 H 6.482 9.299 -3.929 1.00 . A A . 1 ILE HD12 1 1 11 2932 1 1 1 ILE HD13 H 4.864 8.694 -3.594 1.00 . A A . 1 ILE HD13 1 1 11 2933 1 1 1 ILE HG12 H 5.463 8.305 -1.220 1.00 . A A . 1 ILE HG12 1 1 11 2934 1 1 1 ILE HG13 H 7.103 8.785 -1.470 1.00 . A A . 1 ILE HG13 1 1 11 2935 1 1 1 ILE HG21 H 6.765 6.107 -0.255 1.00 . A A . 1 ILE HG21 1 1 11 2936 1 1 1 ILE HG22 H 5.134 6.039 -0.910 1.00 . A A . 1 ILE HG22 1 1 11 2937 1 1 1 ILE HG23 H 6.305 4.844 -1.399 1.00 . A A . 1 ILE HG23 1 1 11 2938 1 1 1 ILE N N 8.498 7.596 -3.757 1.00 . A A . 1 ILE N 1 1 11 2939 1 1 1 ILE O O 8.183 5.133 -4.566 1.00 . A A . 1 ILE O 1 1 11 2940 1 1 2 LEU C C 8.499 1.885 -1.952 1.00 . A A . 2 LEU C 1 1 11 2941 1 1 2 LEU CA C 8.957 2.855 -3.062 1.00 . A A . 2 LEU CA 1 1 11 2942 1 1 2 LEU CB C 10.437 2.695 -3.499 1.00 . A A . 2 LEU CB 1 1 11 2943 1 1 2 LEU CD1 C 12.182 1.621 -4.977 1.00 . A A . 2 LEU CD1 1 1 11 2944 1 1 2 LEU CD2 C 10.314 0.182 -4.086 1.00 . A A . 2 LEU CD2 1 1 11 2945 1 1 2 LEU CG C 10.705 1.595 -4.553 1.00 . A A . 2 LEU CG 1 1 11 2946 1 1 2 LEU H H 8.857 4.344 -1.582 1.00 . A A . 2 LEU H 1 1 11 2947 1 1 2 LEU HA H 8.354 2.688 -3.953 1.00 . A A . 2 LEU HA 1 1 11 2948 1 1 2 LEU HB2 H 10.778 3.636 -3.932 1.00 . A A . 2 LEU HB2 1 1 11 2949 1 1 2 LEU HB3 H 11.075 2.535 -2.629 1.00 . A A . 2 LEU HB3 1 1 11 2950 1 1 2 LEU HD11 H 12.469 2.597 -5.369 1.00 . A A . 2 LEU HD11 1 1 11 2951 1 1 2 LEU HD12 H 12.382 0.888 -5.760 1.00 . A A . 2 LEU HD12 1 1 11 2952 1 1 2 LEU HD13 H 12.841 1.392 -4.139 1.00 . A A . 2 LEU HD13 1 1 11 2953 1 1 2 LEU HD21 H 10.662 -0.576 -4.790 1.00 . A A . 2 LEU HD21 1 1 11 2954 1 1 2 LEU HD22 H 9.236 0.061 -4.003 1.00 . A A . 2 LEU HD22 1 1 11 2955 1 1 2 LEU HD23 H 10.755 -0.049 -3.117 1.00 . A A . 2 LEU HD23 1 1 11 2956 1 1 2 LEU HG H 10.114 1.822 -5.442 1.00 . A A . 2 LEU HG 1 1 11 2957 1 1 2 LEU N N 8.730 4.219 -2.578 1.00 . A A . 2 LEU N 1 1 11 2958 1 1 2 LEU O O 9.271 1.647 -1.025 1.00 . A A . 2 LEU O 1 1 11 2959 1 1 3 PRO C C 7.205 -0.991 -1.214 1.00 . A A . 3 PRO C 1 1 11 2960 1 1 3 PRO CA C 6.749 0.459 -0.936 1.00 . A A . 3 PRO CA 1 1 11 2961 1 1 3 PRO CB C 5.219 0.621 -1.023 1.00 . A A . 3 PRO CB 1 1 11 2962 1 1 3 PRO CD C 6.189 1.730 -2.923 1.00 . A A . 3 PRO CD 1 1 11 2963 1 1 3 PRO CG C 4.948 0.945 -2.488 1.00 . A A . 3 PRO CG 1 1 11 2964 1 1 3 PRO HA H 7.088 0.755 0.059 1.00 . A A . 3 PRO HA 1 1 11 2965 1 1 3 PRO HB2 H 4.664 -0.241 -0.657 1.00 . A A . 3 PRO HB2 1 1 11 2966 1 1 3 PRO HB3 H 4.918 1.468 -0.405 1.00 . A A . 3 PRO HB3 1 1 11 2967 1 1 3 PRO HD2 H 6.461 1.475 -3.949 1.00 . A A . 3 PRO HD2 1 1 11 2968 1 1 3 PRO HD3 H 5.999 2.803 -2.875 1.00 . A A . 3 PRO HD3 1 1 11 2969 1 1 3 PRO HG2 H 4.873 0.028 -3.072 1.00 . A A . 3 PRO HG2 1 1 11 2970 1 1 3 PRO HG3 H 4.024 1.508 -2.635 1.00 . A A . 3 PRO HG3 1 1 11 2971 1 1 3 PRO N N 7.248 1.373 -1.972 1.00 . A A . 3 PRO N 1 1 11 2972 1 1 3 PRO O O 6.464 -1.770 -1.827 1.00 . A A . 3 PRO O 1 1 11 2973 1 1 4 TRP C C 8.233 -3.782 -0.122 1.00 . A A . 4 TRP C 1 1 11 2974 1 1 4 TRP CA C 9.030 -2.674 -0.838 1.00 . A A . 4 TRP CA 1 1 11 2975 1 1 4 TRP CB C 10.461 -2.616 -0.251 1.00 . A A . 4 TRP CB 1 1 11 2976 1 1 4 TRP CD1 C 12.331 -1.162 -1.156 1.00 . A A . 4 TRP CD1 1 1 11 2977 1 1 4 TRP CD2 C 11.985 -3.007 -2.396 1.00 . A A . 4 TRP CD2 1 1 11 2978 1 1 4 TRP CE2 C 13.049 -2.284 -3.016 1.00 . A A . 4 TRP CE2 1 1 11 2979 1 1 4 TRP CE3 C 11.606 -4.230 -2.999 1.00 . A A . 4 TRP CE3 1 1 11 2980 1 1 4 TRP CG C 11.542 -2.258 -1.221 1.00 . A A . 4 TRP CG 1 1 11 2981 1 1 4 TRP CH2 C 13.280 -3.955 -4.758 1.00 . A A . 4 TRP CH2 1 1 11 2982 1 1 4 TRP CZ2 C 13.691 -2.741 -4.179 1.00 . A A . 4 TRP CZ2 1 1 11 2983 1 1 4 TRP CZ3 C 12.242 -4.700 -4.166 1.00 . A A . 4 TRP CZ3 1 1 11 2984 1 1 4 TRP H H 8.955 -0.628 -0.293 1.00 . A A . 4 TRP H 1 1 11 2985 1 1 4 TRP HA H 9.084 -2.948 -1.893 1.00 . A A . 4 TRP HA 1 1 11 2986 1 1 4 TRP HB2 H 10.497 -1.942 0.605 1.00 . A A . 4 TRP HB2 1 1 11 2987 1 1 4 TRP HB3 H 10.756 -3.589 0.146 1.00 . A A . 4 TRP HB3 1 1 11 2988 1 1 4 TRP HD1 H 12.268 -0.404 -0.387 1.00 . A A . 4 TRP HD1 1 1 11 2989 1 1 4 TRP HE1 H 13.933 -0.470 -2.340 1.00 . A A . 4 TRP HE1 1 1 11 2990 1 1 4 TRP HE3 H 10.823 -4.825 -2.553 1.00 . A A . 4 TRP HE3 1 1 11 2991 1 1 4 TRP HH2 H 13.769 -4.319 -5.650 1.00 . A A . 4 TRP HH2 1 1 11 2992 1 1 4 TRP HZ2 H 14.496 -2.172 -4.623 1.00 . A A . 4 TRP HZ2 1 1 11 2993 1 1 4 TRP HZ3 H 11.935 -5.638 -4.604 1.00 . A A . 4 TRP HZ3 1 1 11 2994 1 1 4 TRP N N 8.411 -1.346 -0.754 1.00 . A A . 4 TRP N 1 1 11 2995 1 1 4 TRP NE1 N 13.218 -1.175 -2.214 1.00 . A A . 4 TRP NE1 1 1 11 2996 1 1 4 TRP O O 7.403 -3.507 0.745 1.00 . A A . 4 TRP O 1 1 11 2997 1 1 5 LYS C C 9.248 -7.280 -0.078 1.00 . A A . 5 LYS C 1 1 11 2998 1 1 5 LYS CA C 8.114 -6.278 0.159 1.00 . A A . 5 LYS CA 1 1 11 2999 1 1 5 LYS CB C 6.765 -6.850 -0.347 1.00 . A A . 5 LYS CB 1 1 11 3000 1 1 5 LYS CD C 5.129 -5.053 -1.142 1.00 . A A . 5 LYS CD 1 1 11 3001 1 1 5 LYS CE C 4.190 -3.940 -0.666 1.00 . A A . 5 LYS CE 1 1 11 3002 1 1 5 LYS CG C 5.518 -6.016 -0.011 1.00 . A A . 5 LYS CG 1 1 11 3003 1 1 5 LYS H H 9.223 -5.179 -1.198 1.00 . A A . 5 LYS H 1 1 11 3004 1 1 5 LYS HA H 8.051 -6.094 1.233 1.00 . A A . 5 LYS HA 1 1 11 3005 1 1 5 LYS HB2 H 6.814 -7.056 -1.417 1.00 . A A . 5 LYS HB2 1 1 11 3006 1 1 5 LYS HB3 H 6.630 -7.830 0.117 1.00 . A A . 5 LYS HB3 1 1 11 3007 1 1 5 LYS HD2 H 6.026 -4.606 -1.564 1.00 . A A . 5 LYS HD2 1 1 11 3008 1 1 5 LYS HD3 H 4.673 -5.620 -1.956 1.00 . A A . 5 LYS HD3 1 1 11 3009 1 1 5 LYS HE2 H 3.215 -4.353 -0.399 1.00 . A A . 5 LYS HE2 1 1 11 3010 1 1 5 LYS HE3 H 4.594 -3.464 0.229 1.00 . A A . 5 LYS HE3 1 1 11 3011 1 1 5 LYS HG2 H 4.676 -6.684 0.180 1.00 . A A . 5 LYS HG2 1 1 11 3012 1 1 5 LYS HG3 H 5.684 -5.483 0.926 1.00 . A A . 5 LYS HG3 1 1 11 3013 1 1 5 LYS HZ1 H 3.392 -2.199 -1.411 1.00 . A A . 5 LYS HZ1 1 1 11 3014 1 1 5 LYS HZ2 H 3.738 -3.326 -2.574 1.00 . A A . 5 LYS HZ2 1 1 11 3015 1 1 5 LYS HZ3 H 4.964 -2.481 -1.841 1.00 . A A . 5 LYS HZ3 1 1 11 3016 1 1 5 LYS N N 8.501 -5.036 -0.502 1.00 . A A . 5 LYS N 1 1 11 3017 1 1 5 LYS NZ N 4.041 -2.911 -1.706 1.00 . A A . 5 LYS NZ 1 1 11 3018 1 1 5 LYS O O 9.914 -7.217 -1.114 1.00 . A A . 5 LYS O 1 1 11 3019 1 1 6 TRP C C 9.330 -10.481 -0.091 1.00 . A A . 6 TRP C 1 1 11 3020 1 1 6 TRP CA C 10.215 -9.442 0.615 1.00 . A A . 6 TRP CA 1 1 11 3021 1 1 6 TRP CB C 10.654 -10.018 1.976 1.00 . A A . 6 TRP CB 1 1 11 3022 1 1 6 TRP CD1 C 11.580 -8.509 3.796 1.00 . A A . 6 TRP CD1 1 1 11 3023 1 1 6 TRP CD2 C 13.127 -9.080 2.268 1.00 . A A . 6 TRP CD2 1 1 11 3024 1 1 6 TRP CE2 C 13.775 -8.233 3.218 1.00 . A A . 6 TRP CE2 1 1 11 3025 1 1 6 TRP CE3 C 13.919 -9.575 1.205 1.00 . A A . 6 TRP CE3 1 1 11 3026 1 1 6 TRP CG C 11.728 -9.232 2.663 1.00 . A A . 6 TRP CG 1 1 11 3027 1 1 6 TRP CH2 C 15.891 -8.399 2.045 1.00 . A A . 6 TRP CH2 1 1 11 3028 1 1 6 TRP CZ2 C 15.134 -7.891 3.115 1.00 . A A . 6 TRP CZ2 1 1 11 3029 1 1 6 TRP CZ3 C 15.285 -9.241 1.093 1.00 . A A . 6 TRP CZ3 1 1 11 3030 1 1 6 TRP H H 8.795 -8.254 1.629 1.00 . A A . 6 TRP H 1 1 11 3031 1 1 6 TRP HA H 11.089 -9.220 0.000 1.00 . A A . 6 TRP HA 1 1 11 3032 1 1 6 TRP HB2 H 9.797 -10.117 2.644 1.00 . A A . 6 TRP HB2 1 1 11 3033 1 1 6 TRP HB3 H 11.047 -11.027 1.851 1.00 . A A . 6 TRP HB3 1 1 11 3034 1 1 6 TRP HD1 H 10.657 -8.420 4.352 1.00 . A A . 6 TRP HD1 1 1 11 3035 1 1 6 TRP HE1 H 12.912 -7.343 4.947 1.00 . A A . 6 TRP HE1 1 1 11 3036 1 1 6 TRP HE3 H 13.472 -10.223 0.470 1.00 . A A . 6 TRP HE3 1 1 11 3037 1 1 6 TRP HH2 H 16.938 -8.146 1.957 1.00 . A A . 6 TRP HH2 1 1 11 3038 1 1 6 TRP HZ2 H 15.595 -7.247 3.850 1.00 . A A . 6 TRP HZ2 1 1 11 3039 1 1 6 TRP HZ3 H 15.873 -9.632 0.276 1.00 . A A . 6 TRP HZ3 1 1 11 3040 1 1 6 TRP N N 9.416 -8.239 0.836 1.00 . A A . 6 TRP N 1 1 11 3041 1 1 6 TRP NE1 N 12.783 -7.918 4.124 1.00 . A A . 6 TRP NE1 1 1 11 3042 1 1 6 TRP O O 8.109 -10.475 0.068 1.00 . A A . 6 TRP O 1 1 11 3043 1 1 7 LYS C C 8.874 -13.618 -0.678 1.00 . A A . 7 LYS C 1 1 11 3044 1 1 7 LYS CA C 9.260 -12.450 -1.611 1.00 . A A . 7 LYS CA 1 1 11 3045 1 1 7 LYS CB C 10.195 -12.947 -2.739 1.00 . A A . 7 LYS CB 1 1 11 3046 1 1 7 LYS CD C 11.202 -12.419 -5.059 1.00 . A A . 7 LYS CD 1 1 11 3047 1 1 7 LYS CE C 12.623 -12.965 -4.833 1.00 . A A . 7 LYS CE 1 1 11 3048 1 1 7 LYS CG C 10.533 -11.866 -3.786 1.00 . A A . 7 LYS CG 1 1 11 3049 1 1 7 LYS H H 10.948 -11.375 -0.883 1.00 . A A . 7 LYS H 1 1 11 3050 1 1 7 LYS HA H 8.340 -12.057 -2.052 1.00 . A A . 7 LYS HA 1 1 11 3051 1 1 7 LYS HB2 H 11.109 -13.360 -2.307 1.00 . A A . 7 LYS HB2 1 1 11 3052 1 1 7 LYS HB3 H 9.702 -13.779 -3.248 1.00 . A A . 7 LYS HB3 1 1 11 3053 1 1 7 LYS HD2 H 10.560 -13.190 -5.490 1.00 . A A . 7 LYS HD2 1 1 11 3054 1 1 7 LYS HD3 H 11.237 -11.613 -5.794 1.00 . A A . 7 LYS HD3 1 1 11 3055 1 1 7 LYS HE2 H 13.256 -12.191 -4.395 1.00 . A A . 7 LYS HE2 1 1 11 3056 1 1 7 LYS HE3 H 12.602 -13.795 -4.124 1.00 . A A . 7 LYS HE3 1 1 11 3057 1 1 7 LYS HG2 H 9.605 -11.370 -4.080 1.00 . A A . 7 LYS HG2 1 1 11 3058 1 1 7 LYS HG3 H 11.154 -11.087 -3.341 1.00 . A A . 7 LYS HG3 1 1 11 3059 1 1 7 LYS HZ1 H 14.161 -13.789 -5.912 1.00 . A A . 7 LYS HZ1 1 1 11 3060 1 1 7 LYS HZ2 H 13.285 -12.689 -6.765 1.00 . A A . 7 LYS HZ2 1 1 11 3061 1 1 7 LYS HZ3 H 12.671 -14.189 -6.478 1.00 . A A . 7 LYS HZ3 1 1 11 3062 1 1 7 LYS N N 9.941 -11.394 -0.856 1.00 . A A . 7 LYS N 1 1 11 3063 1 1 7 LYS NZ N 13.228 -13.442 -6.092 1.00 . A A . 7 LYS NZ 1 1 11 3064 1 1 7 LYS O O 9.298 -14.759 -0.870 1.00 . A A . 7 LYS O 1 1 11 3065 1 1 8 TRP C C 6.410 -15.063 0.793 1.00 . A A . 8 TRP C 1 1 11 3066 1 1 8 TRP CA C 7.580 -14.242 1.372 1.00 . A A . 8 TRP CA 1 1 11 3067 1 1 8 TRP CB C 7.139 -13.388 2.584 1.00 . A A . 8 TRP CB 1 1 11 3068 1 1 8 TRP CD1 C 7.060 -15.398 4.168 1.00 . A A . 8 TRP CD1 1 1 11 3069 1 1 8 TRP CD2 C 6.618 -13.447 5.188 1.00 . A A . 8 TRP CD2 1 1 11 3070 1 1 8 TRP CE2 C 6.557 -14.463 6.190 1.00 . A A . 8 TRP CE2 1 1 11 3071 1 1 8 TRP CE3 C 6.371 -12.119 5.607 1.00 . A A . 8 TRP CE3 1 1 11 3072 1 1 8 TRP CG C 6.944 -14.073 3.909 1.00 . A A . 8 TRP CG 1 1 11 3073 1 1 8 TRP CH2 C 6.028 -12.844 7.918 1.00 . A A . 8 TRP CH2 1 1 11 3074 1 1 8 TRP CZ2 C 6.268 -14.175 7.535 1.00 . A A . 8 TRP CZ2 1 1 11 3075 1 1 8 TRP CZ3 C 6.080 -11.817 6.953 1.00 . A A . 8 TRP CZ3 1 1 11 3076 1 1 8 TRP H H 7.751 -12.359 0.404 1.00 . A A . 8 TRP H 1 1 11 3077 1 1 8 TRP HA H 8.392 -14.909 1.666 1.00 . A A . 8 TRP HA 1 1 11 3078 1 1 8 TRP HB2 H 7.897 -12.626 2.771 1.00 . A A . 8 TRP HB2 1 1 11 3079 1 1 8 TRP HB3 H 6.225 -12.838 2.357 1.00 . A A . 8 TRP HB3 1 1 11 3080 1 1 8 TRP HD1 H 7.300 -16.156 3.435 1.00 . A A . 8 TRP HD1 1 1 11 3081 1 1 8 TRP HE1 H 6.885 -16.542 5.934 1.00 . A A . 8 TRP HE1 1 1 11 3082 1 1 8 TRP HE3 H 6.405 -11.321 4.882 1.00 . A A . 8 TRP HE3 1 1 11 3083 1 1 8 TRP HH2 H 5.805 -12.609 8.947 1.00 . A A . 8 TRP HH2 1 1 11 3084 1 1 8 TRP HZ2 H 6.230 -14.965 8.271 1.00 . A A . 8 TRP HZ2 1 1 11 3085 1 1 8 TRP HZ3 H 5.895 -10.795 7.251 1.00 . A A . 8 TRP HZ3 1 1 11 3086 1 1 8 TRP N N 8.064 -13.325 0.342 1.00 . A A . 8 TRP N 1 1 11 3087 1 1 8 TRP NE1 N 6.834 -15.628 5.508 1.00 . A A . 8 TRP NE1 1 1 11 3088 1 1 8 TRP O O 5.253 -14.891 1.159 1.00 . A A . 8 TRP O 1 1 11 3089 1 1 9 THR C C 6.436 -18.170 -1.057 1.00 . A A . 9 THR C 1 1 11 3090 1 1 9 THR CA C 5.793 -16.779 -0.900 1.00 . A A . 9 THR CA 1 1 11 3091 1 1 9 THR CB C 5.311 -16.010 -2.162 1.00 . A A . 9 THR CB 1 1 11 3092 1 1 9 THR CG2 C 6.382 -15.599 -3.203 1.00 . A A . 9 THR CG2 1 1 11 3093 1 1 9 THR H H 7.702 -15.970 -0.448 1.00 . A A . 9 THR H 1 1 11 3094 1 1 9 THR HA H 4.889 -16.907 -0.305 1.00 . A A . 9 THR HA 1 1 11 3095 1 1 9 THR HB H 4.899 -15.071 -1.788 1.00 . A A . 9 THR HB 1 1 11 3096 1 1 9 THR HG21 H 5.943 -14.984 -3.989 1.00 . A A . 9 THR HG21 1 1 11 3097 1 1 9 THR HG22 H 6.874 -16.448 -3.676 1.00 . A A . 9 THR HG22 1 1 11 3098 1 1 9 THR HG23 H 7.162 -15.002 -2.734 1.00 . A A . 9 THR HG23 1 1 11 3099 1 1 9 THR N N 6.729 -15.943 -0.159 1.00 . A A . 9 THR N 1 1 11 3100 1 1 9 THR O O 7.102 -18.426 -2.063 1.00 . A A . 9 THR O 1 1 11 3101 1 1 9 THR OG1 O 4.179 -16.692 -2.745 1.00 . A A . 9 THR OG1 1 1 11 3102 1 1 10 PRO C C 6.303 -21.385 -0.925 1.00 . A A . 10 PRO C 1 1 11 3103 1 1 10 PRO CA C 7.026 -20.352 -0.048 1.00 . A A . 10 PRO CA 1 1 11 3104 1 1 10 PRO CB C 7.023 -20.793 1.424 1.00 . A A . 10 PRO CB 1 1 11 3105 1 1 10 PRO CD C 5.606 -18.858 1.219 1.00 . A A . 10 PRO CD 1 1 11 3106 1 1 10 PRO CG C 5.777 -20.152 2.018 1.00 . A A . 10 PRO CG 1 1 11 3107 1 1 10 PRO HA H 8.055 -20.228 -0.395 1.00 . A A . 10 PRO HA 1 1 11 3108 1 1 10 PRO HB2 H 7.042 -21.877 1.557 1.00 . A A . 10 PRO HB2 1 1 11 3109 1 1 10 PRO HB3 H 7.908 -20.395 1.922 1.00 . A A . 10 PRO HB3 1 1 11 3110 1 1 10 PRO HD2 H 4.548 -18.643 1.059 1.00 . A A . 10 PRO HD2 1 1 11 3111 1 1 10 PRO HD3 H 6.045 -18.018 1.762 1.00 . A A . 10 PRO HD3 1 1 11 3112 1 1 10 PRO HG2 H 4.916 -20.804 1.854 1.00 . A A . 10 PRO HG2 1 1 11 3113 1 1 10 PRO HG3 H 5.857 -19.980 3.091 1.00 . A A . 10 PRO HG3 1 1 11 3114 1 1 10 PRO N N 6.329 -19.061 -0.042 1.00 . A A . 10 PRO N 1 1 11 3115 1 1 10 PRO O O 5.070 -21.450 -0.944 1.00 . A A . 10 PRO O 1 1 11 3116 1 1 11 TRP C C 6.572 -24.571 -1.253 1.00 . A A . 11 TRP C 1 1 11 3117 1 1 11 TRP CA C 6.584 -23.433 -2.287 1.00 . A A . 11 TRP CA 1 1 11 3118 1 1 11 TRP CB C 7.566 -23.790 -3.419 1.00 . A A . 11 TRP CB 1 1 11 3119 1 1 11 TRP CD1 C 6.991 -25.844 -4.799 1.00 . A A . 11 TRP CD1 1 1 11 3120 1 1 11 TRP CD2 C 6.139 -23.945 -5.649 1.00 . A A . 11 TRP CD2 1 1 11 3121 1 1 11 TRP CE2 C 5.743 -25.001 -6.522 1.00 . A A . 11 TRP CE2 1 1 11 3122 1 1 11 TRP CE3 C 5.726 -22.636 -5.992 1.00 . A A . 11 TRP CE3 1 1 11 3123 1 1 11 TRP CG C 6.931 -24.515 -4.564 1.00 . A A . 11 TRP CG 1 1 11 3124 1 1 11 TRP CH2 C 4.586 -23.458 -7.994 1.00 . A A . 11 TRP CH2 1 1 11 3125 1 1 11 TRP CZ2 C 4.976 -24.772 -7.679 1.00 . A A . 11 TRP CZ2 1 1 11 3126 1 1 11 TRP CZ3 C 4.962 -22.393 -7.152 1.00 . A A . 11 TRP CZ3 1 1 11 3127 1 1 11 TRP H H 8.073 -22.198 -1.449 1.00 . A A . 11 TRP H 1 1 11 3128 1 1 11 TRP HA H 5.587 -23.249 -2.693 1.00 . A A . 11 TRP HA 1 1 11 3129 1 1 11 TRP HB2 H 7.998 -22.883 -3.843 1.00 . A A . 11 TRP HB2 1 1 11 3130 1 1 11 TRP HB3 H 8.412 -24.372 -3.049 1.00 . A A . 11 TRP HB3 1 1 11 3131 1 1 11 TRP HD1 H 7.522 -26.552 -4.180 1.00 . A A . 11 TRP HD1 1 1 11 3132 1 1 11 TRP HE1 H 6.235 -27.059 -6.356 1.00 . A A . 11 TRP HE1 1 1 11 3133 1 1 11 TRP HE3 H 6.014 -21.808 -5.362 1.00 . A A . 11 TRP HE3 1 1 11 3134 1 1 11 TRP HH2 H 4.006 -23.263 -8.884 1.00 . A A . 11 TRP HH2 1 1 11 3135 1 1 11 TRP HZ2 H 4.695 -25.589 -8.326 1.00 . A A . 11 TRP HZ2 1 1 11 3136 1 1 11 TRP HZ3 H 4.671 -21.385 -7.408 1.00 . A A . 11 TRP HZ3 1 1 11 3137 1 1 11 TRP N N 7.075 -22.246 -1.595 1.00 . A A . 11 TRP N 1 1 11 3138 1 1 11 TRP NE1 N 6.284 -26.134 -5.951 1.00 . A A . 11 TRP NE1 1 1 11 3139 1 1 11 TRP O O 7.499 -24.687 -0.453 1.00 . A A . 11 TRP O 1 1 11 3140 1 1 12 ARG C C 4.457 -27.552 -0.819 1.00 . A A . 12 ARG C 1 1 11 3141 1 1 12 ARG CA C 5.301 -26.426 -0.217 1.00 . A A . 12 ARG CA 1 1 11 3142 1 1 12 ARG CB C 4.766 -25.896 1.150 1.00 . A A . 12 ARG CB 1 1 11 3143 1 1 12 ARG CD C 2.966 -24.154 0.415 1.00 . A A . 12 ARG CD 1 1 11 3144 1 1 12 ARG CG C 4.254 -24.436 1.217 1.00 . A A . 12 ARG CG 1 1 11 3145 1 1 12 ARG CZ C 1.888 -21.886 -0.009 1.00 . A A . 12 ARG CZ 1 1 11 3146 1 1 12 ARG H H 4.806 -25.312 -1.943 1.00 . A A . 12 ARG H 1 1 11 3147 1 1 12 ARG HA H 6.281 -26.870 -0.024 1.00 . A A . 12 ARG HA 1 1 11 3148 1 1 12 ARG HB2 H 3.993 -26.561 1.538 1.00 . A A . 12 ARG HB2 1 1 11 3149 1 1 12 ARG HB3 H 5.583 -25.975 1.867 1.00 . A A . 12 ARG HB3 1 1 11 3150 1 1 12 ARG HD2 H 2.923 -24.765 -0.486 1.00 . A A . 12 ARG HD2 1 1 11 3151 1 1 12 ARG HD3 H 2.095 -24.426 1.012 1.00 . A A . 12 ARG HD3 1 1 11 3152 1 1 12 ARG HE H 3.806 -22.380 -0.380 1.00 . A A . 12 ARG HE 1 1 11 3153 1 1 12 ARG HG2 H 4.053 -24.204 2.264 1.00 . A A . 12 ARG HG2 1 1 11 3154 1 1 12 ARG HG3 H 5.051 -23.750 0.935 1.00 . A A . 12 ARG HG3 1 1 11 3155 1 1 12 ARG HH11 H 0.523 -23.188 0.775 1.00 . A A . 12 ARG HH11 1 1 11 3156 1 1 12 ARG HH12 H -0.103 -21.616 0.453 1.00 . A A . 12 ARG HH12 1 1 11 3157 1 1 12 ARG HH21 H 2.971 -20.396 -0.928 1.00 . A A . 12 ARG HH21 1 1 11 3158 1 1 12 ARG HH22 H 1.387 -19.925 -0.489 1.00 . A A . 12 ARG HH22 1 1 11 3159 1 1 12 ARG N N 5.504 -25.374 -1.210 1.00 . A A . 12 ARG N 1 1 11 3160 1 1 12 ARG NE N 2.914 -22.744 -0.010 1.00 . A A . 12 ARG NE 1 1 11 3161 1 1 12 ARG NH1 N 0.684 -22.249 0.440 1.00 . A A . 12 ARG NH1 1 1 11 3162 1 1 12 ARG NH2 N 2.089 -20.651 -0.473 1.00 . A A . 12 ARG NH2 1 1 11 3163 1 1 12 ARG O O 3.463 -27.269 -1.482 1.00 . A A . 12 ARG O 1 1 11 3164 1 1 13 ARG C C 3.007 -30.473 -0.211 1.00 . A A . 13 ARG C 1 1 11 3165 1 1 13 ARG CA C 4.175 -30.012 -1.113 1.00 . A A . 13 ARG CA 1 1 11 3166 1 1 13 ARG CB C 5.235 -31.154 -1.182 1.00 . A A . 13 ARG CB 1 1 11 3167 1 1 13 ARG CD C 4.136 -32.980 -2.708 1.00 . A A . 13 ARG CD 1 1 11 3168 1 1 13 ARG CG C 5.260 -31.946 -2.508 1.00 . A A . 13 ARG CG 1 1 11 3169 1 1 13 ARG CZ C 3.661 -34.803 -1.014 1.00 . A A . 13 ARG CZ 1 1 11 3170 1 1 13 ARG H H 5.651 -28.961 0.001 1.00 . A A . 13 ARG H 1 1 11 3171 1 1 13 ARG HA H 3.784 -29.792 -2.110 1.00 . A A . 13 ARG HA 1 1 11 3172 1 1 13 ARG HB2 H 6.232 -30.725 -1.073 1.00 . A A . 13 ARG HB2 1 1 11 3173 1 1 13 ARG HB3 H 5.147 -31.847 -0.341 1.00 . A A . 13 ARG HB3 1 1 11 3174 1 1 13 ARG HD2 H 3.148 -32.575 -2.510 1.00 . A A . 13 ARG HD2 1 1 11 3175 1 1 13 ARG HD3 H 4.110 -33.244 -3.768 1.00 . A A . 13 ARG HD3 1 1 11 3176 1 1 13 ARG HE H 5.182 -34.755 -2.376 1.00 . A A . 13 ARG HE 1 1 11 3177 1 1 13 ARG HG2 H 5.259 -31.246 -3.346 1.00 . A A . 13 ARG HG2 1 1 11 3178 1 1 13 ARG HG3 H 6.220 -32.461 -2.579 1.00 . A A . 13 ARG HG3 1 1 11 3179 1 1 13 ARG HH11 H 2.475 -33.153 -0.640 1.00 . A A . 13 ARG HH11 1 1 11 3180 1 1 13 ARG HH12 H 2.004 -34.568 0.212 1.00 . A A . 13 ARG HH12 1 1 11 3181 1 1 13 ARG HH21 H 4.729 -36.565 -0.978 1.00 . A A . 13 ARG HH21 1 1 11 3182 1 1 13 ARG HH22 H 3.437 -36.492 0.142 1.00 . A A . 13 ARG HH22 1 1 11 3183 1 1 13 ARG N N 4.825 -28.815 -0.560 1.00 . A A . 13 ARG N 1 1 11 3184 1 1 13 ARG NE N 4.399 -34.243 -1.987 1.00 . A A . 13 ARG NE 1 1 11 3185 1 1 13 ARG NH1 N 2.634 -34.158 -0.462 1.00 . A A . 13 ARG NH1 1 1 11 3186 1 1 13 ARG NH2 N 3.965 -36.029 -0.586 1.00 . A A . 13 ARG NH2 1 1 11 3187 1 1 13 ARG O O 2.379 -31.492 -0.473 1.00 . A A . 13 ARG O 1 1 11 3188 1 1 14 NH2 HN1 H 1.938 -30.066 1.458 1.00 . A A . 14 NH2 HN1 1 1 11 3189 1 1 14 NH2 HN2 H 3.207 -28.919 1.057 1.00 . A A . 14 NH2 HN2 1 1 11 3190 1 1 14 NH2 N N 2.710 -29.773 0.877 1.00 . A A . 14 NH2 N 1 1 11 3191 2 2 1 . C1 C 4.357 -17.527 -3.871 1.00 . B A . 101 BGC C1 1 1 11 3192 2 2 1 . C2 C 3.153 -18.486 -3.965 1.00 . B A . 101 BGC C2 1 1 11 3193 2 2 1 . C3 C 3.257 -19.331 -5.234 1.00 . B A . 101 BGC C3 1 1 11 3194 2 2 1 . C4 C 3.354 -18.412 -6.449 1.00 . B A . 101 BGC C4 1 1 11 3195 2 2 1 . C5 C 4.624 -17.544 -6.277 1.00 . B A . 101 BGC C5 1 1 11 3196 2 2 1 . C6 C 4.861 -16.532 -7.404 1.00 . B A . 101 BGC C6 1 1 11 3197 2 2 1 . H1 H 5.294 -18.083 -3.743 1.00 . B A . 101 BGC H1 1 1 11 3198 2 2 1 . H2 H 2.236 -17.892 -3.991 1.00 . B A . 101 BGC H2 1 1 11 3199 2 2 1 . H3 H 4.157 -19.949 -5.186 1.00 . B A . 101 BGC H3 1 1 11 3200 2 2 1 . H4 H 2.474 -17.764 -6.486 1.00 . B A . 101 BGC H4 1 1 11 3201 2 2 1 . H5 H 5.507 -18.180 -6.186 1.00 . B A . 101 BGC H5 1 1 11 3202 2 2 1 . H6 H 3.688 -15.191 -6.614 1.00 . B A . 101 BGC H6 1 1 11 3203 2 2 1 . H6C1 H 4.975 -17.037 -8.364 1.00 . B A . 101 BGC H6C1 1 1 11 3204 2 2 1 . H6C2 H 5.788 -15.985 -7.226 1.00 . B A . 101 BGC H6C2 1 1 11 3205 2 2 1 . HB H 2.481 -20.067 -3.193 1.00 . B A . 101 BGC HB 1 1 11 3206 2 2 1 . HC H 2.140 -20.520 -6.256 1.00 . B A . 101 BGC HC 1 1 11 3207 2 2 1 . HD H 3.198 -18.607 -8.387 1.00 . B A . 101 BGC HD 1 1 11 3208 2 2 1 . O2 O 3.093 -19.384 -2.861 1.00 . B A . 101 BGC O2 1 1 11 3209 2 2 1 . O3 O 2.133 -20.195 -5.338 1.00 . B A . 101 BGC O3 1 1 11 3210 2 2 1 . O4 O 3.382 -19.197 -7.637 1.00 . B A . 101 BGC O4 1 1 11 3211 2 2 1 . O5 O 4.471 -16.779 -5.068 1.00 . B A . 101 BGC O5 1 1 11 3212 2 2 1 . O6 O 3.788 -15.604 -7.486 1.00 . B A . 101 BGC O6 1 1 12 3213 1 1 1 ILE C C 5.486 -0.363 -7.071 1.00 . A A . 1 ILE C 1 1 12 3214 1 1 1 ILE CA C 5.914 1.108 -7.145 1.00 . A A . 1 ILE CA 1 1 12 3215 1 1 1 ILE CB C 6.149 1.738 -5.743 1.00 . A A . 1 ILE CB 1 1 12 3216 1 1 1 ILE CD1 C 5.173 2.120 -3.382 1.00 . A A . 1 ILE CD1 1 1 12 3217 1 1 1 ILE CG1 C 4.882 1.774 -4.849 1.00 . A A . 1 ILE CG1 1 1 12 3218 1 1 1 ILE CG2 C 6.787 3.137 -5.874 1.00 . A A . 1 ILE CG2 1 1 12 3219 1 1 1 ILE H1 H 4.811 1.476 -8.822 1.00 . A A . 1 ILE H1 1 1 12 3220 1 1 1 ILE HA H 6.842 1.151 -7.718 1.00 . A A . 1 ILE HA 1 1 12 3221 1 1 1 ILE HB H 6.883 1.110 -5.232 1.00 . A A . 1 ILE HB 1 1 12 3222 1 1 1 ILE HD11 H 4.264 2.057 -2.782 1.00 . A A . 1 ILE HD11 1 1 12 3223 1 1 1 ILE HD12 H 5.899 1.433 -2.944 1.00 . A A . 1 ILE HD12 1 1 12 3224 1 1 1 ILE HD13 H 5.559 3.134 -3.266 1.00 . A A . 1 ILE HD13 1 1 12 3225 1 1 1 ILE HG12 H 4.152 2.484 -5.238 1.00 . A A . 1 ILE HG12 1 1 12 3226 1 1 1 ILE HG13 H 4.389 0.801 -4.848 1.00 . A A . 1 ILE HG13 1 1 12 3227 1 1 1 ILE HG21 H 7.132 3.508 -4.908 1.00 . A A . 1 ILE HG21 1 1 12 3228 1 1 1 ILE HG22 H 7.663 3.122 -6.523 1.00 . A A . 1 ILE HG22 1 1 12 3229 1 1 1 ILE HG23 H 6.090 3.878 -6.267 1.00 . A A . 1 ILE HG23 1 1 12 3230 1 1 1 ILE N N 4.878 1.851 -7.887 1.00 . A A . 1 ILE N 1 1 12 3231 1 1 1 ILE O O 4.323 -0.647 -7.352 1.00 . A A . 1 ILE O 1 1 12 3232 1 1 2 LEU C C 5.793 -2.795 -4.889 1.00 . A A . 2 LEU C 1 1 12 3233 1 1 2 LEU CA C 6.073 -2.676 -6.404 1.00 . A A . 2 LEU CA 1 1 12 3234 1 1 2 LEU CB C 7.313 -3.552 -6.720 1.00 . A A . 2 LEU CB 1 1 12 3235 1 1 2 LEU CD1 C 7.811 -2.776 -9.132 1.00 . A A . 2 LEU CD1 1 1 12 3236 1 1 2 LEU CD2 C 8.541 -5.053 -8.346 1.00 . A A . 2 LEU CD2 1 1 12 3237 1 1 2 LEU CG C 7.474 -3.956 -8.204 1.00 . A A . 2 LEU CG 1 1 12 3238 1 1 2 LEU H H 7.301 -0.974 -6.388 1.00 . A A . 2 LEU H 1 1 12 3239 1 1 2 LEU HA H 5.214 -3.009 -6.987 1.00 . A A . 2 LEU HA 1 1 12 3240 1 1 2 LEU HB2 H 8.226 -3.075 -6.357 1.00 . A A . 2 LEU HB2 1 1 12 3241 1 1 2 LEU HB3 H 7.241 -4.479 -6.145 1.00 . A A . 2 LEU HB3 1 1 12 3242 1 1 2 LEU HD11 H 6.993 -2.060 -9.190 1.00 . A A . 2 LEU HD11 1 1 12 3243 1 1 2 LEU HD12 H 7.993 -3.123 -10.149 1.00 . A A . 2 LEU HD12 1 1 12 3244 1 1 2 LEU HD13 H 8.707 -2.249 -8.802 1.00 . A A . 2 LEU HD13 1 1 12 3245 1 1 2 LEU HD21 H 9.523 -4.699 -8.029 1.00 . A A . 2 LEU HD21 1 1 12 3246 1 1 2 LEU HD22 H 8.633 -5.385 -9.382 1.00 . A A . 2 LEU HD22 1 1 12 3247 1 1 2 LEU HD23 H 8.298 -5.931 -7.748 1.00 . A A . 2 LEU HD23 1 1 12 3248 1 1 2 LEU HG H 6.530 -4.385 -8.545 1.00 . A A . 2 LEU HG 1 1 12 3249 1 1 2 LEU N N 6.390 -1.275 -6.699 1.00 . A A . 2 LEU N 1 1 12 3250 1 1 2 LEU O O 6.363 -2.016 -4.122 1.00 . A A . 2 LEU O 1 1 12 3251 1 1 3 PRO C C 5.893 -4.753 -2.366 1.00 . A A . 3 PRO C 1 1 12 3252 1 1 3 PRO CA C 4.715 -3.999 -3.013 1.00 . A A . 3 PRO CA 1 1 12 3253 1 1 3 PRO CB C 3.427 -4.834 -2.979 1.00 . A A . 3 PRO CB 1 1 12 3254 1 1 3 PRO CD C 4.139 -4.643 -5.274 1.00 . A A . 3 PRO CD 1 1 12 3255 1 1 3 PRO CG C 3.412 -5.580 -4.306 1.00 . A A . 3 PRO CG 1 1 12 3256 1 1 3 PRO HA H 4.556 -3.053 -2.490 1.00 . A A . 3 PRO HA 1 1 12 3257 1 1 3 PRO HB2 H 3.361 -5.498 -2.115 1.00 . A A . 3 PRO HB2 1 1 12 3258 1 1 3 PRO HB3 H 2.567 -4.163 -2.928 1.00 . A A . 3 PRO HB3 1 1 12 3259 1 1 3 PRO HD2 H 4.744 -5.201 -5.991 1.00 . A A . 3 PRO HD2 1 1 12 3260 1 1 3 PRO HD3 H 3.413 -4.047 -5.832 1.00 . A A . 3 PRO HD3 1 1 12 3261 1 1 3 PRO HG2 H 3.973 -6.506 -4.205 1.00 . A A . 3 PRO HG2 1 1 12 3262 1 1 3 PRO HG3 H 2.403 -5.832 -4.637 1.00 . A A . 3 PRO HG3 1 1 12 3263 1 1 3 PRO N N 4.953 -3.753 -4.440 1.00 . A A . 3 PRO N 1 1 12 3264 1 1 3 PRO O O 6.527 -5.602 -3.002 1.00 . A A . 3 PRO O 1 1 12 3265 1 1 4 TRP C C 6.991 -6.400 0.208 1.00 . A A . 4 TRP C 1 1 12 3266 1 1 4 TRP CA C 7.214 -4.929 -0.211 1.00 . A A . 4 TRP CA 1 1 12 3267 1 1 4 TRP CB C 7.283 -3.993 1.023 1.00 . A A . 4 TRP CB 1 1 12 3268 1 1 4 TRP CD1 C 5.461 -4.172 2.783 1.00 . A A . 4 TRP CD1 1 1 12 3269 1 1 4 TRP CD2 C 5.000 -2.614 1.231 1.00 . A A . 4 TRP CD2 1 1 12 3270 1 1 4 TRP CE2 C 3.888 -2.649 2.127 1.00 . A A . 4 TRP CE2 1 1 12 3271 1 1 4 TRP CE3 C 4.938 -1.677 0.169 1.00 . A A . 4 TRP CE3 1 1 12 3272 1 1 4 TRP CG C 5.976 -3.614 1.664 1.00 . A A . 4 TRP CG 1 1 12 3273 1 1 4 TRP CH2 C 2.732 -0.910 0.892 1.00 . A A . 4 TRP CH2 1 1 12 3274 1 1 4 TRP CZ2 C 2.767 -1.816 1.968 1.00 . A A . 4 TRP CZ2 1 1 12 3275 1 1 4 TRP CZ3 C 3.817 -0.840 -0.002 1.00 . A A . 4 TRP CZ3 1 1 12 3276 1 1 4 TRP H H 5.509 -3.802 -0.639 1.00 . A A . 4 TRP H 1 1 12 3277 1 1 4 TRP HA H 8.167 -4.875 -0.741 1.00 . A A . 4 TRP HA 1 1 12 3278 1 1 4 TRP HB2 H 7.932 -4.427 1.786 1.00 . A A . 4 TRP HB2 1 1 12 3279 1 1 4 TRP HB3 H 7.773 -3.062 0.738 1.00 . A A . 4 TRP HB3 1 1 12 3280 1 1 4 TRP HD1 H 5.945 -4.955 3.352 1.00 . A A . 4 TRP HD1 1 1 12 3281 1 1 4 TRP HE1 H 3.679 -3.871 3.863 1.00 . A A . 4 TRP HE1 1 1 12 3282 1 1 4 TRP HE3 H 5.768 -1.594 -0.515 1.00 . A A . 4 TRP HE3 1 1 12 3283 1 1 4 TRP HH2 H 1.877 -0.261 0.767 1.00 . A A . 4 TRP HH2 1 1 12 3284 1 1 4 TRP HZ2 H 1.944 -1.866 2.667 1.00 . A A . 4 TRP HZ2 1 1 12 3285 1 1 4 TRP HZ3 H 3.793 -0.129 -0.815 1.00 . A A . 4 TRP HZ3 1 1 12 3286 1 1 4 TRP N N 6.142 -4.452 -1.087 1.00 . A A . 4 TRP N 1 1 12 3287 1 1 4 TRP NE1 N 4.229 -3.612 3.053 1.00 . A A . 4 TRP NE1 1 1 12 3288 1 1 4 TRP O O 6.698 -6.722 1.355 1.00 . A A . 4 TRP O 1 1 12 3289 1 1 5 LYS C C 7.826 -9.477 -1.582 1.00 . A A . 5 LYS C 1 1 12 3290 1 1 5 LYS CA C 6.919 -8.744 -0.596 1.00 . A A . 5 LYS CA 1 1 12 3291 1 1 5 LYS CB C 5.418 -9.134 -0.682 1.00 . A A . 5 LYS CB 1 1 12 3292 1 1 5 LYS CD C 3.903 -9.320 -2.822 1.00 . A A . 5 LYS CD 1 1 12 3293 1 1 5 LYS CE C 4.846 -9.954 -3.862 1.00 . A A . 5 LYS CE 1 1 12 3294 1 1 5 LYS CG C 4.573 -8.418 -1.769 1.00 . A A . 5 LYS CG 1 1 12 3295 1 1 5 LYS H H 7.336 -6.960 -1.681 1.00 . A A . 5 LYS H 1 1 12 3296 1 1 5 LYS HA H 7.264 -9.017 0.404 1.00 . A A . 5 LYS HA 1 1 12 3297 1 1 5 LYS HB2 H 5.321 -10.216 -0.766 1.00 . A A . 5 LYS HB2 1 1 12 3298 1 1 5 LYS HB3 H 4.971 -8.895 0.285 1.00 . A A . 5 LYS HB3 1 1 12 3299 1 1 5 LYS HD2 H 3.334 -10.102 -2.317 1.00 . A A . 5 LYS HD2 1 1 12 3300 1 1 5 LYS HD3 H 3.156 -8.723 -3.348 1.00 . A A . 5 LYS HD3 1 1 12 3301 1 1 5 LYS HE2 H 5.475 -10.716 -3.400 1.00 . A A . 5 LYS HE2 1 1 12 3302 1 1 5 LYS HE3 H 4.243 -10.460 -4.618 1.00 . A A . 5 LYS HE3 1 1 12 3303 1 1 5 LYS HG2 H 3.775 -7.883 -1.250 1.00 . A A . 5 LYS HG2 1 1 12 3304 1 1 5 LYS HG3 H 5.132 -7.631 -2.267 1.00 . A A . 5 LYS HG3 1 1 12 3305 1 1 5 LYS HZ1 H 6.121 -9.331 -5.365 1.00 . A A . 5 LYS HZ1 1 1 12 3306 1 1 5 LYS HZ2 H 6.501 -8.783 -3.874 1.00 . A A . 5 LYS HZ2 1 1 12 3307 1 1 5 LYS HZ3 H 5.242 -8.094 -4.702 1.00 . A A . 5 LYS HZ3 1 1 12 3308 1 1 5 LYS N N 7.113 -7.311 -0.757 1.00 . A A . 5 LYS N 1 1 12 3309 1 1 5 LYS NZ N 5.722 -8.960 -4.516 1.00 . A A . 5 LYS NZ 1 1 12 3310 1 1 5 LYS O O 7.733 -9.225 -2.787 1.00 . A A . 5 LYS O 1 1 12 3311 1 1 6 TRP C C 9.738 -12.571 -1.126 1.00 . A A . 6 TRP C 1 1 12 3312 1 1 6 TRP CA C 9.577 -11.229 -1.860 1.00 . A A . 6 TRP CA 1 1 12 3313 1 1 6 TRP CB C 10.850 -10.450 -2.283 1.00 . A A . 6 TRP CB 1 1 12 3314 1 1 6 TRP CD1 C 10.695 -10.280 -4.797 1.00 . A A . 6 TRP CD1 1 1 12 3315 1 1 6 TRP CD2 C 12.504 -11.439 -4.141 1.00 . A A . 6 TRP CD2 1 1 12 3316 1 1 6 TRP CE2 C 12.516 -11.416 -5.570 1.00 . A A . 6 TRP CE2 1 1 12 3317 1 1 6 TRP CE3 C 13.579 -12.105 -3.506 1.00 . A A . 6 TRP CE3 1 1 12 3318 1 1 6 TRP CG C 11.321 -10.717 -3.680 1.00 . A A . 6 TRP CG 1 1 12 3319 1 1 6 TRP CH2 C 14.576 -12.690 -5.661 1.00 . A A . 6 TRP CH2 1 1 12 3320 1 1 6 TRP CZ2 C 13.531 -12.026 -6.326 1.00 . A A . 6 TRP CZ2 1 1 12 3321 1 1 6 TRP CZ3 C 14.598 -12.730 -4.254 1.00 . A A . 6 TRP CZ3 1 1 12 3322 1 1 6 TRP H H 8.681 -10.534 -0.086 1.00 . A A . 6 TRP H 1 1 12 3323 1 1 6 TRP HA H 9.043 -11.490 -2.777 1.00 . A A . 6 TRP HA 1 1 12 3324 1 1 6 TRP HB2 H 10.650 -9.379 -2.254 1.00 . A A . 6 TRP HB2 1 1 12 3325 1 1 6 TRP HB3 H 11.678 -10.580 -1.588 1.00 . A A . 6 TRP HB3 1 1 12 3326 1 1 6 TRP HD1 H 9.791 -9.689 -4.793 1.00 . A A . 6 TRP HD1 1 1 12 3327 1 1 6 TRP HE1 H 11.137 -10.462 -6.861 1.00 . A A . 6 TRP HE1 1 1 12 3328 1 1 6 TRP HE3 H 13.622 -12.144 -2.430 1.00 . A A . 6 TRP HE3 1 1 12 3329 1 1 6 TRP HH2 H 15.361 -13.166 -6.230 1.00 . A A . 6 TRP HH2 1 1 12 3330 1 1 6 TRP HZ2 H 13.512 -11.988 -7.406 1.00 . A A . 6 TRP HZ2 1 1 12 3331 1 1 6 TRP HZ3 H 15.401 -13.243 -3.744 1.00 . A A . 6 TRP HZ3 1 1 12 3332 1 1 6 TRP N N 8.674 -10.381 -1.084 1.00 . A A . 6 TRP N 1 1 12 3333 1 1 6 TRP NE1 N 11.389 -10.700 -5.911 1.00 . A A . 6 TRP NE1 1 1 12 3334 1 1 6 TRP O O 8.727 -13.252 -0.940 1.00 . A A . 6 TRP O 1 1 12 3335 1 1 7 LYS C C 12.676 -14.612 -0.793 1.00 . A A . 7 LYS C 1 1 12 3336 1 1 7 LYS CA C 11.505 -14.065 0.037 1.00 . A A . 7 LYS CA 1 1 12 3337 1 1 7 LYS CB C 10.516 -15.241 0.244 1.00 . A A . 7 LYS CB 1 1 12 3338 1 1 7 LYS CD C 8.418 -16.186 1.347 1.00 . A A . 7 LYS CD 1 1 12 3339 1 1 7 LYS CE C 7.378 -15.953 0.234 1.00 . A A . 7 LYS CE 1 1 12 3340 1 1 7 LYS CG C 9.496 -15.086 1.390 1.00 . A A . 7 LYS CG 1 1 12 3341 1 1 7 LYS H H 11.690 -12.278 -1.018 1.00 . A A . 7 LYS H 1 1 12 3342 1 1 7 LYS HA H 11.884 -13.720 0.999 1.00 . A A . 7 LYS HA 1 1 12 3343 1 1 7 LYS HB2 H 10.038 -15.465 -0.708 1.00 . A A . 7 LYS HB2 1 1 12 3344 1 1 7 LYS HB3 H 11.089 -16.138 0.479 1.00 . A A . 7 LYS HB3 1 1 12 3345 1 1 7 LYS HD2 H 8.907 -17.155 1.226 1.00 . A A . 7 LYS HD2 1 1 12 3346 1 1 7 LYS HD3 H 7.912 -16.220 2.314 1.00 . A A . 7 LYS HD3 1 1 12 3347 1 1 7 LYS HE2 H 6.778 -15.071 0.464 1.00 . A A . 7 LYS HE2 1 1 12 3348 1 1 7 LYS HE3 H 7.857 -15.753 -0.724 1.00 . A A . 7 LYS HE3 1 1 12 3349 1 1 7 LYS HG2 H 10.031 -15.139 2.339 1.00 . A A . 7 LYS HG2 1 1 12 3350 1 1 7 LYS HG3 H 9.025 -14.103 1.383 1.00 . A A . 7 LYS HG3 1 1 12 3351 1 1 7 LYS HZ1 H 6.079 -17.432 0.919 1.00 . A A . 7 LYS HZ1 1 1 12 3352 1 1 7 LYS HZ2 H 6.971 -17.911 -0.359 1.00 . A A . 7 LYS HZ2 1 1 12 3353 1 1 7 LYS HZ3 H 5.746 -16.889 -0.590 1.00 . A A . 7 LYS HZ3 1 1 12 3354 1 1 7 LYS N N 10.965 -12.901 -0.691 1.00 . A A . 7 LYS N 1 1 12 3355 1 1 7 LYS NZ N 6.486 -17.111 0.054 1.00 . A A . 7 LYS NZ 1 1 12 3356 1 1 7 LYS O O 12.553 -14.697 -2.010 1.00 . A A . 7 LYS O 1 1 12 3357 1 1 8 TRP C C 14.624 -16.984 -1.487 1.00 . A A . 8 TRP C 1 1 12 3358 1 1 8 TRP CA C 14.941 -15.651 -0.792 1.00 . A A . 8 TRP CA 1 1 12 3359 1 1 8 TRP CB C 16.048 -15.893 0.249 1.00 . A A . 8 TRP CB 1 1 12 3360 1 1 8 TRP CD1 C 17.968 -14.261 0.184 1.00 . A A . 8 TRP CD1 1 1 12 3361 1 1 8 TRP CD2 C 16.419 -13.691 1.711 1.00 . A A . 8 TRP CD2 1 1 12 3362 1 1 8 TRP CE2 C 17.440 -12.693 1.756 1.00 . A A . 8 TRP CE2 1 1 12 3363 1 1 8 TRP CE3 C 15.336 -13.541 2.611 1.00 . A A . 8 TRP CE3 1 1 12 3364 1 1 8 TRP CG C 16.785 -14.669 0.690 1.00 . A A . 8 TRP CG 1 1 12 3365 1 1 8 TRP CH2 C 16.292 -11.476 3.511 1.00 . A A . 8 TRP CH2 1 1 12 3366 1 1 8 TRP CZ2 C 17.387 -11.601 2.638 1.00 . A A . 8 TRP CZ2 1 1 12 3367 1 1 8 TRP CZ3 C 15.269 -12.444 3.497 1.00 . A A . 8 TRP CZ3 1 1 12 3368 1 1 8 TRP H H 13.834 -14.907 0.852 1.00 . A A . 8 TRP H 1 1 12 3369 1 1 8 TRP HA H 15.314 -14.968 -1.559 1.00 . A A . 8 TRP HA 1 1 12 3370 1 1 8 TRP HB2 H 15.661 -16.411 1.125 1.00 . A A . 8 TRP HB2 1 1 12 3371 1 1 8 TRP HB3 H 16.798 -16.564 -0.177 1.00 . A A . 8 TRP HB3 1 1 12 3372 1 1 8 TRP HD1 H 18.511 -14.779 -0.595 1.00 . A A . 8 TRP HD1 1 1 12 3373 1 1 8 TRP HE1 H 19.212 -12.616 0.578 1.00 . A A . 8 TRP HE1 1 1 12 3374 1 1 8 TRP HE3 H 14.555 -14.283 2.635 1.00 . A A . 8 TRP HE3 1 1 12 3375 1 1 8 TRP HH2 H 16.242 -10.642 4.196 1.00 . A A . 8 TRP HH2 1 1 12 3376 1 1 8 TRP HZ2 H 18.179 -10.867 2.649 1.00 . A A . 8 TRP HZ2 1 1 12 3377 1 1 8 TRP HZ3 H 14.436 -12.350 4.181 1.00 . A A . 8 TRP HZ3 1 1 12 3378 1 1 8 TRP N N 13.769 -15.043 -0.143 1.00 . A A . 8 TRP N 1 1 12 3379 1 1 8 TRP NE1 N 18.351 -13.092 0.803 1.00 . A A . 8 TRP NE1 1 1 12 3380 1 1 8 TRP O O 15.148 -17.255 -2.561 1.00 . A A . 8 TRP O 1 1 12 3381 1 1 9 THR C C 11.585 -18.763 -1.296 1.00 . A A . 9 THR C 1 1 12 3382 1 1 9 THR CA C 13.097 -18.924 -1.533 1.00 . A A . 9 THR CA 1 1 12 3383 1 1 9 THR CB C 13.720 -20.258 -1.065 1.00 . A A . 9 THR CB 1 1 12 3384 1 1 9 THR CG2 C 13.462 -20.636 0.410 1.00 . A A . 9 THR CG2 1 1 12 3385 1 1 9 THR H H 13.339 -17.498 -0.012 1.00 . A A . 9 THR H 1 1 12 3386 1 1 9 THR HA H 13.304 -18.870 -2.602 1.00 . A A . 9 THR HA 1 1 12 3387 1 1 9 THR HB H 14.799 -20.205 -1.231 1.00 . A A . 9 THR HB 1 1 12 3388 1 1 9 THR HG21 H 13.747 -19.822 1.074 1.00 . A A . 9 THR HG21 1 1 12 3389 1 1 9 THR HG22 H 14.062 -21.498 0.705 1.00 . A A . 9 THR HG22 1 1 12 3390 1 1 9 THR HG23 H 12.417 -20.878 0.599 1.00 . A A . 9 THR HG23 1 1 12 3391 1 1 9 THR N N 13.730 -17.780 -0.895 1.00 . A A . 9 THR N 1 1 12 3392 1 1 9 THR O O 11.170 -18.620 -0.139 1.00 . A A . 9 THR O 1 1 12 3393 1 1 9 THR OG1 O 13.173 -21.252 -1.942 1.00 . A A . 9 THR OG1 1 1 12 3394 1 1 10 PRO C C 8.429 -19.559 -1.734 1.00 . A A . 10 PRO C 1 1 12 3395 1 1 10 PRO CA C 9.317 -18.377 -2.168 1.00 . A A . 10 PRO CA 1 1 12 3396 1 1 10 PRO CB C 8.876 -17.835 -3.534 1.00 . A A . 10 PRO CB 1 1 12 3397 1 1 10 PRO CD C 11.088 -18.751 -3.765 1.00 . A A . 10 PRO CD 1 1 12 3398 1 1 10 PRO CG C 9.774 -18.560 -4.527 1.00 . A A . 10 PRO CG 1 1 12 3399 1 1 10 PRO HA H 9.210 -17.590 -1.422 1.00 . A A . 10 PRO HA 1 1 12 3400 1 1 10 PRO HB2 H 7.815 -17.974 -3.750 1.00 . A A . 10 PRO HB2 1 1 12 3401 1 1 10 PRO HB3 H 9.081 -16.765 -3.578 1.00 . A A . 10 PRO HB3 1 1 12 3402 1 1 10 PRO HD2 H 11.575 -19.690 -4.032 1.00 . A A . 10 PRO HD2 1 1 12 3403 1 1 10 PRO HD3 H 11.771 -17.930 -3.998 1.00 . A A . 10 PRO HD3 1 1 12 3404 1 1 10 PRO HG2 H 9.344 -19.532 -4.777 1.00 . A A . 10 PRO HG2 1 1 12 3405 1 1 10 PRO HG3 H 9.906 -18.005 -5.458 1.00 . A A . 10 PRO HG3 1 1 12 3406 1 1 10 PRO N N 10.735 -18.696 -2.343 1.00 . A A . 10 PRO N 1 1 12 3407 1 1 10 PRO O O 7.303 -19.272 -1.327 1.00 . A A . 10 PRO O 1 1 12 3408 1 1 11 TRP C C 6.828 -22.359 -1.381 1.00 . A A . 11 TRP C 1 1 12 3409 1 1 11 TRP CA C 8.327 -22.156 -1.706 1.00 . A A . 11 TRP CA 1 1 12 3410 1 1 11 TRP CB C 9.257 -23.075 -0.883 1.00 . A A . 11 TRP CB 1 1 12 3411 1 1 11 TRP CD1 C 8.468 -25.203 0.256 1.00 . A A . 11 TRP CD1 1 1 12 3412 1 1 11 TRP CD2 C 9.141 -25.572 -1.855 1.00 . A A . 11 TRP CD2 1 1 12 3413 1 1 11 TRP CE2 C 8.801 -26.843 -1.298 1.00 . A A . 11 TRP CE2 1 1 12 3414 1 1 11 TRP CE3 C 9.587 -25.569 -3.198 1.00 . A A . 11 TRP CE3 1 1 12 3415 1 1 11 TRP CG C 8.945 -24.547 -0.829 1.00 . A A . 11 TRP CG 1 1 12 3416 1 1 11 TRP CH2 C 9.414 -28.003 -3.340 1.00 . A A . 11 TRP CH2 1 1 12 3417 1 1 11 TRP CZ2 C 8.934 -28.044 -2.018 1.00 . A A . 11 TRP CZ2 1 1 12 3418 1 1 11 TRP CZ3 C 9.734 -26.765 -3.930 1.00 . A A . 11 TRP CZ3 1 1 12 3419 1 1 11 TRP H H 9.893 -20.844 -2.072 1.00 . A A . 11 TRP H 1 1 12 3420 1 1 11 TRP HA H 8.414 -22.507 -2.736 1.00 . A A . 11 TRP HA 1 1 12 3421 1 1 11 TRP HB2 H 10.276 -23.000 -1.269 1.00 . A A . 11 TRP HB2 1 1 12 3422 1 1 11 TRP HB3 H 9.303 -22.707 0.143 1.00 . A A . 11 TRP HB3 1 1 12 3423 1 1 11 TRP HD1 H 8.235 -24.733 1.200 1.00 . A A . 11 TRP HD1 1 1 12 3424 1 1 11 TRP HE1 H 8.067 -27.247 0.648 1.00 . A A . 11 TRP HE1 1 1 12 3425 1 1 11 TRP HE3 H 9.826 -24.630 -3.669 1.00 . A A . 11 TRP HE3 1 1 12 3426 1 1 11 TRP HH2 H 9.532 -28.919 -3.901 1.00 . A A . 11 TRP HH2 1 1 12 3427 1 1 11 TRP HZ2 H 8.678 -28.991 -1.564 1.00 . A A . 11 TRP HZ2 1 1 12 3428 1 1 11 TRP HZ3 H 10.095 -26.734 -4.949 1.00 . A A . 11 TRP HZ3 1 1 12 3429 1 1 11 TRP N N 8.930 -20.806 -1.762 1.00 . A A . 11 TRP N 1 1 12 3430 1 1 11 TRP NE1 N 8.373 -26.553 -0.020 1.00 . A A . 11 TRP NE1 1 1 12 3431 1 1 11 TRP O O 6.187 -23.195 -2.009 1.00 . A A . 11 TRP O 1 1 12 3432 1 1 12 ARG C C 4.172 -20.355 0.178 1.00 . A A . 12 ARG C 1 1 12 3433 1 1 12 ARG CA C 4.819 -21.728 -0.078 1.00 . A A . 12 ARG CA 1 1 12 3434 1 1 12 ARG CB C 4.584 -22.825 0.993 1.00 . A A . 12 ARG CB 1 1 12 3435 1 1 12 ARG CD C 4.490 -21.556 3.232 1.00 . A A . 12 ARG CD 1 1 12 3436 1 1 12 ARG CG C 5.221 -22.610 2.384 1.00 . A A . 12 ARG CG 1 1 12 3437 1 1 12 ARG CZ C 4.319 -20.813 5.607 1.00 . A A . 12 ARG CZ 1 1 12 3438 1 1 12 ARG H H 6.756 -20.823 -0.102 1.00 . A A . 12 ARG H 1 1 12 3439 1 1 12 ARG HA H 4.294 -22.078 -0.970 1.00 . A A . 12 ARG HA 1 1 12 3440 1 1 12 ARG HB2 H 3.513 -22.996 1.111 1.00 . A A . 12 ARG HB2 1 1 12 3441 1 1 12 ARG HB3 H 4.968 -23.765 0.590 1.00 . A A . 12 ARG HB3 1 1 12 3442 1 1 12 ARG HD2 H 4.739 -20.556 2.881 1.00 . A A . 12 ARG HD2 1 1 12 3443 1 1 12 ARG HD3 H 3.411 -21.686 3.134 1.00 . A A . 12 ARG HD3 1 1 12 3444 1 1 12 ARG HE H 5.438 -22.390 4.915 1.00 . A A . 12 ARG HE 1 1 12 3445 1 1 12 ARG HG2 H 5.204 -23.566 2.910 1.00 . A A . 12 ARG HG2 1 1 12 3446 1 1 12 ARG HG3 H 6.274 -22.349 2.272 1.00 . A A . 12 ARG HG3 1 1 12 3447 1 1 12 ARG HH11 H 3.133 -19.715 4.314 1.00 . A A . 12 ARG HH11 1 1 12 3448 1 1 12 ARG HH12 H 3.033 -19.238 5.968 1.00 . A A . 12 ARG HH12 1 1 12 3449 1 1 12 ARG HH21 H 5.322 -21.703 7.179 1.00 . A A . 12 ARG HH21 1 1 12 3450 1 1 12 ARG HH22 H 4.342 -20.377 7.623 1.00 . A A . 12 ARG HH22 1 1 12 3451 1 1 12 ARG N N 6.235 -21.621 -0.434 1.00 . A A . 12 ARG N 1 1 12 3452 1 1 12 ARG NE N 4.818 -21.628 4.664 1.00 . A A . 12 ARG NE 1 1 12 3453 1 1 12 ARG NH1 N 3.459 -19.842 5.279 1.00 . A A . 12 ARG NH1 1 1 12 3454 1 1 12 ARG NH2 N 4.690 -20.970 6.880 1.00 . A A . 12 ARG NH2 1 1 12 3455 1 1 12 ARG O O 4.859 -19.365 0.446 1.00 . A A . 12 ARG O 1 1 12 3456 1 1 13 ARG C C 2.042 -18.578 1.731 1.00 . A A . 13 ARG C 1 1 12 3457 1 1 13 ARG CA C 2.016 -19.099 0.273 1.00 . A A . 13 ARG CA 1 1 12 3458 1 1 13 ARG CB C 0.557 -19.406 -0.156 1.00 . A A . 13 ARG CB 1 1 12 3459 1 1 13 ARG CD C -1.087 -19.907 -2.085 1.00 . A A . 13 ARG CD 1 1 12 3460 1 1 13 ARG CG C 0.389 -19.796 -1.645 1.00 . A A . 13 ARG CG 1 1 12 3461 1 1 13 ARG CZ C -2.283 -20.184 -4.295 1.00 . A A . 13 ARG CZ 1 1 12 3462 1 1 13 ARG H H 2.348 -21.170 -0.058 1.00 . A A . 13 ARG H 1 1 12 3463 1 1 13 ARG HA H 2.426 -18.319 -0.373 1.00 . A A . 13 ARG HA 1 1 12 3464 1 1 13 ARG HB2 H 0.146 -20.196 0.476 1.00 . A A . 13 ARG HB2 1 1 12 3465 1 1 13 ARG HB3 H -0.061 -18.527 0.034 1.00 . A A . 13 ARG HB3 1 1 12 3466 1 1 13 ARG HD2 H -1.626 -20.617 -1.457 1.00 . A A . 13 ARG HD2 1 1 12 3467 1 1 13 ARG HD3 H -1.570 -18.937 -1.959 1.00 . A A . 13 ARG HD3 1 1 12 3468 1 1 13 ARG HE H -0.442 -20.900 -3.825 1.00 . A A . 13 ARG HE 1 1 12 3469 1 1 13 ARG HG2 H 0.883 -19.050 -2.271 1.00 . A A . 13 ARG HG2 1 1 12 3470 1 1 13 ARG HG3 H 0.900 -20.741 -1.839 1.00 . A A . 13 ARG HG3 1 1 12 3471 1 1 13 ARG HH11 H -3.470 -19.203 -2.932 1.00 . A A . 13 ARG HH11 1 1 12 3472 1 1 13 ARG HH12 H -4.210 -19.451 -4.456 1.00 . A A . 13 ARG HH12 1 1 12 3473 1 1 13 ARG HH21 H -1.440 -21.147 -5.921 1.00 . A A . 13 ARG HH21 1 1 12 3474 1 1 13 ARG HH22 H -3.036 -20.598 -6.169 1.00 . A A . 13 ARG HH22 1 1 12 3475 1 1 13 ARG N N 2.834 -20.300 0.102 1.00 . A A . 13 ARG N 1 1 12 3476 1 1 13 ARG NE N -1.215 -20.337 -3.492 1.00 . A A . 13 ARG NE 1 1 12 3477 1 1 13 ARG NH1 N -3.389 -19.565 -3.871 1.00 . A A . 13 ARG NH1 1 1 12 3478 1 1 13 ARG NH2 N -2.245 -20.665 -5.539 1.00 . A A . 13 ARG NH2 1 1 12 3479 1 1 13 ARG O O 2.456 -19.262 2.668 1.00 . A A . 13 ARG O 1 1 12 3480 1 1 14 NH2 HN1 H 1.580 -16.986 2.889 1.00 . A A . 14 NH2 HN1 1 1 12 3481 1 1 14 NH2 HN2 H 1.229 -16.781 1.195 1.00 . A A . 14 NH2 HN2 1 1 12 3482 1 1 14 NH2 N N 1.610 -17.339 1.943 1.00 . A A . 14 NH2 N 1 1 12 3483 2 2 1 . C1 C 13.613 -22.581 -1.789 1.00 . B A . 101 BGC C1 1 1 12 3484 2 2 1 . C2 C 13.307 -23.342 -3.085 1.00 . B A . 101 BGC C2 1 1 12 3485 2 2 1 . C3 C 13.733 -24.804 -2.924 1.00 . B A . 101 BGC C3 1 1 12 3486 2 2 1 . C4 C 15.213 -24.882 -2.514 1.00 . B A . 101 BGC C4 1 1 12 3487 2 2 1 . C5 C 15.415 -24.050 -1.223 1.00 . B A . 101 BGC C5 1 1 12 3488 2 2 1 . C6 C 16.870 -23.959 -0.729 1.00 . B A . 101 BGC C6 1 1 12 3489 2 2 1 . H1 H 13.072 -22.987 -0.924 1.00 . B A . 101 BGC H1 1 1 12 3490 2 2 1 . H2 H 13.867 -22.878 -3.901 1.00 . B A . 101 BGC H2 1 1 12 3491 2 2 1 . H3 H 13.120 -25.269 -2.147 1.00 . B A . 101 BGC H3 1 1 12 3492 2 2 1 . H4 H 15.831 -24.459 -3.310 1.00 . B A . 101 BGC H4 1 1 12 3493 2 2 1 . H5 H 14.801 -24.462 -0.416 1.00 . B A . 101 BGC H5 1 1 12 3494 2 2 1 . H6 H 17.872 -23.127 0.751 1.00 . B A . 101 BGC H6 1 1 12 3495 2 2 1 . H6C1 H 17.496 -23.466 -1.475 1.00 . B A . 101 BGC H6C1 1 1 12 3496 2 2 1 . H6C2 H 17.282 -24.958 -0.568 1.00 . B A . 101 BGC H6C2 1 1 12 3497 2 2 1 . HB H 11.817 -23.893 -4.134 1.00 . B A . 101 BGC HB 1 1 12 3498 2 2 1 . HC H 13.899 -26.395 -4.004 1.00 . B A . 101 BGC HC 1 1 12 3499 2 2 1 . HD H 16.539 -26.319 -2.286 1.00 . B A . 101 BGC HD 1 1 12 3500 2 2 1 . O2 O 11.921 -23.277 -3.389 1.00 . B A . 101 BGC O2 1 1 12 3501 2 2 1 . O3 O 13.523 -25.509 -4.143 1.00 . B A . 101 BGC O3 1 1 12 3502 2 2 1 . O4 O 15.575 -26.253 -2.344 1.00 . B A . 101 BGC O4 1 1 12 3503 2 2 1 . O5 O 14.989 -22.707 -1.512 1.00 . B A . 101 BGC O5 1 1 12 3504 2 2 1 . O6 O 16.943 -23.237 0.499 1.00 . B A . 101 BGC O6 1 1 13 3505 1 1 1 ILE C C 6.742 4.003 -3.893 1.00 . A A . 1 ILE C 1 1 13 3506 1 1 1 ILE CA C 7.793 5.086 -4.171 1.00 . A A . 1 ILE CA 1 1 13 3507 1 1 1 ILE CB C 9.198 4.694 -3.629 1.00 . A A . 1 ILE CB 1 1 13 3508 1 1 1 ILE CD1 C 10.526 3.802 -1.597 1.00 . A A . 1 ILE CD1 1 1 13 3509 1 1 1 ILE CG1 C 9.255 4.510 -2.088 1.00 . A A . 1 ILE CG1 1 1 13 3510 1 1 1 ILE CG2 C 10.272 5.688 -4.113 1.00 . A A . 1 ILE CG2 1 1 13 3511 1 1 1 ILE H1 H 8.020 7.066 -3.606 1.00 . A A . 1 ILE H1 1 1 13 3512 1 1 1 ILE HA H 7.845 5.233 -5.252 1.00 . A A . 1 ILE HA 1 1 13 3513 1 1 1 ILE HB H 9.449 3.729 -4.075 1.00 . A A . 1 ILE HB 1 1 13 3514 1 1 1 ILE HD11 H 10.653 2.827 -2.069 1.00 . A A . 1 ILE HD11 1 1 13 3515 1 1 1 ILE HD12 H 11.425 4.387 -1.791 1.00 . A A . 1 ILE HD12 1 1 13 3516 1 1 1 ILE HD13 H 10.484 3.637 -0.519 1.00 . A A . 1 ILE HD13 1 1 13 3517 1 1 1 ILE HG12 H 9.172 5.472 -1.580 1.00 . A A . 1 ILE HG12 1 1 13 3518 1 1 1 ILE HG13 H 8.412 3.913 -1.737 1.00 . A A . 1 ILE HG13 1 1 13 3519 1 1 1 ILE HG21 H 10.179 6.667 -3.641 1.00 . A A . 1 ILE HG21 1 1 13 3520 1 1 1 ILE HG22 H 11.277 5.324 -3.892 1.00 . A A . 1 ILE HG22 1 1 13 3521 1 1 1 ILE HG23 H 10.233 5.831 -5.194 1.00 . A A . 1 ILE HG23 1 1 13 3522 1 1 1 ILE N N 7.323 6.341 -3.557 1.00 . A A . 1 ILE N 1 1 13 3523 1 1 1 ILE O O 5.927 4.205 -2.996 1.00 . A A . 1 ILE O 1 1 13 3524 1 1 2 LEU C C 6.863 0.487 -4.630 1.00 . A A . 2 LEU C 1 1 13 3525 1 1 2 LEU CA C 5.951 1.694 -4.349 1.00 . A A . 2 LEU CA 1 1 13 3526 1 1 2 LEU CB C 4.652 1.757 -5.192 1.00 . A A . 2 LEU CB 1 1 13 3527 1 1 2 LEU CD1 C 2.183 1.240 -5.392 1.00 . A A . 2 LEU CD1 1 1 13 3528 1 1 2 LEU CD2 C 3.780 -0.667 -5.031 1.00 . A A . 2 LEU CD2 1 1 13 3529 1 1 2 LEU CG C 3.508 0.818 -4.738 1.00 . A A . 2 LEU CG 1 1 13 3530 1 1 2 LEU H H 7.456 2.751 -5.346 1.00 . A A . 2 LEU H 1 1 13 3531 1 1 2 LEU HA H 5.646 1.693 -3.303 1.00 . A A . 2 LEU HA 1 1 13 3532 1 1 2 LEU HB2 H 4.272 2.779 -5.138 1.00 . A A . 2 LEU HB2 1 1 13 3533 1 1 2 LEU HB3 H 4.873 1.591 -6.249 1.00 . A A . 2 LEU HB3 1 1 13 3534 1 1 2 LEU HD11 H 1.928 2.272 -5.149 1.00 . A A . 2 LEU HD11 1 1 13 3535 1 1 2 LEU HD12 H 1.353 0.619 -5.051 1.00 . A A . 2 LEU HD12 1 1 13 3536 1 1 2 LEU HD13 H 2.230 1.159 -6.479 1.00 . A A . 2 LEU HD13 1 1 13 3537 1 1 2 LEU HD21 H 2.900 -1.272 -4.815 1.00 . A A . 2 LEU HD21 1 1 13 3538 1 1 2 LEU HD22 H 4.596 -1.054 -4.424 1.00 . A A . 2 LEU HD22 1 1 13 3539 1 1 2 LEU HD23 H 4.037 -0.821 -6.080 1.00 . A A . 2 LEU HD23 1 1 13 3540 1 1 2 LEU HG H 3.377 0.934 -3.661 1.00 . A A . 2 LEU HG 1 1 13 3541 1 1 2 LEU N N 6.771 2.876 -4.611 1.00 . A A . 2 LEU N 1 1 13 3542 1 1 2 LEU O O 7.056 0.170 -5.801 1.00 . A A . 2 LEU O 1 1 13 3543 1 1 3 PRO C C 7.795 -2.593 -3.991 1.00 . A A . 3 PRO C 1 1 13 3544 1 1 3 PRO CA C 8.465 -1.215 -3.823 1.00 . A A . 3 PRO CA 1 1 13 3545 1 1 3 PRO CB C 9.317 -1.182 -2.541 1.00 . A A . 3 PRO CB 1 1 13 3546 1 1 3 PRO CD C 7.418 0.235 -2.191 1.00 . A A . 3 PRO CD 1 1 13 3547 1 1 3 PRO CG C 8.349 -0.732 -1.457 1.00 . A A . 3 PRO CG 1 1 13 3548 1 1 3 PRO HA H 9.091 -1.017 -4.697 1.00 . A A . 3 PRO HA 1 1 13 3549 1 1 3 PRO HB2 H 9.804 -2.127 -2.299 1.00 . A A . 3 PRO HB2 1 1 13 3550 1 1 3 PRO HB3 H 10.110 -0.441 -2.653 1.00 . A A . 3 PRO HB3 1 1 13 3551 1 1 3 PRO HD2 H 6.402 0.161 -1.801 1.00 . A A . 3 PRO HD2 1 1 13 3552 1 1 3 PRO HD3 H 7.765 1.263 -2.061 1.00 . A A . 3 PRO HD3 1 1 13 3553 1 1 3 PRO HG2 H 7.786 -1.593 -1.092 1.00 . A A . 3 PRO HG2 1 1 13 3554 1 1 3 PRO HG3 H 8.851 -0.278 -0.602 1.00 . A A . 3 PRO HG3 1 1 13 3555 1 1 3 PRO N N 7.493 -0.135 -3.610 1.00 . A A . 3 PRO N 1 1 13 3556 1 1 3 PRO O O 6.590 -2.771 -3.767 1.00 . A A . 3 PRO O 1 1 13 3557 1 1 4 TRP C C 8.651 -5.337 -2.641 1.00 . A A . 4 TRP C 1 1 13 3558 1 1 4 TRP CA C 8.336 -5.013 -4.112 1.00 . A A . 4 TRP CA 1 1 13 3559 1 1 4 TRP CB C 9.226 -5.858 -5.043 1.00 . A A . 4 TRP CB 1 1 13 3560 1 1 4 TRP CD1 C 8.070 -6.571 -7.183 1.00 . A A . 4 TRP CD1 1 1 13 3561 1 1 4 TRP CD2 C 9.303 -4.712 -7.456 1.00 . A A . 4 TRP CD2 1 1 13 3562 1 1 4 TRP CE2 C 8.683 -4.988 -8.713 1.00 . A A . 4 TRP CE2 1 1 13 3563 1 1 4 TRP CE3 C 10.156 -3.583 -7.398 1.00 . A A . 4 TRP CE3 1 1 13 3564 1 1 4 TRP CG C 8.879 -5.731 -6.497 1.00 . A A . 4 TRP CG 1 1 13 3565 1 1 4 TRP CH2 C 9.734 -3.064 -9.751 1.00 . A A . 4 TRP CH2 1 1 13 3566 1 1 4 TRP CZ2 C 8.887 -4.182 -9.846 1.00 . A A . 4 TRP CZ2 1 1 13 3567 1 1 4 TRP CZ3 C 10.370 -2.768 -8.529 1.00 . A A . 4 TRP CZ3 1 1 13 3568 1 1 4 TRP H H 9.592 -3.364 -4.430 1.00 . A A . 4 TRP H 1 1 13 3569 1 1 4 TRP HA H 7.287 -5.227 -4.321 1.00 . A A . 4 TRP HA 1 1 13 3570 1 1 4 TRP HB2 H 10.282 -5.616 -4.911 1.00 . A A . 4 TRP HB2 1 1 13 3571 1 1 4 TRP HB3 H 9.130 -6.913 -4.779 1.00 . A A . 4 TRP HB3 1 1 13 3572 1 1 4 TRP HD1 H 7.599 -7.449 -6.764 1.00 . A A . 4 TRP HD1 1 1 13 3573 1 1 4 TRP HE1 H 7.424 -6.631 -9.193 1.00 . A A . 4 TRP HE1 1 1 13 3574 1 1 4 TRP HE3 H 10.666 -3.351 -6.477 1.00 . A A . 4 TRP HE3 1 1 13 3575 1 1 4 TRP HH2 H 9.907 -2.442 -10.617 1.00 . A A . 4 TRP HH2 1 1 13 3576 1 1 4 TRP HZ2 H 8.408 -4.420 -10.785 1.00 . A A . 4 TRP HZ2 1 1 13 3577 1 1 4 TRP HZ3 H 11.034 -1.918 -8.463 1.00 . A A . 4 TRP HZ3 1 1 13 3578 1 1 4 TRP N N 8.617 -3.595 -4.315 1.00 . A A . 4 TRP N 1 1 13 3579 1 1 4 TRP NE1 N 7.945 -6.130 -8.485 1.00 . A A . 4 TRP NE1 1 1 13 3580 1 1 4 TRP O O 9.479 -4.679 -2.015 1.00 . A A . 4 TRP O 1 1 13 3581 1 1 5 LYS C C 8.297 -8.113 -0.541 1.00 . A A . 5 LYS C 1 1 13 3582 1 1 5 LYS CA C 7.934 -6.634 -0.652 1.00 . A A . 5 LYS CA 1 1 13 3583 1 1 5 LYS CB C 6.572 -6.266 0.006 1.00 . A A . 5 LYS CB 1 1 13 3584 1 1 5 LYS CD C 5.027 -5.040 -1.654 1.00 . A A . 5 LYS CD 1 1 13 3585 1 1 5 LYS CE C 4.306 -5.247 -2.997 1.00 . A A . 5 LYS CE 1 1 13 3586 1 1 5 LYS CG C 5.319 -6.356 -0.900 1.00 . A A . 5 LYS CG 1 1 13 3587 1 1 5 LYS H H 7.395 -6.926 -2.656 1.00 . A A . 5 LYS H 1 1 13 3588 1 1 5 LYS HA H 8.708 -6.072 -0.124 1.00 . A A . 5 LYS HA 1 1 13 3589 1 1 5 LYS HB2 H 6.423 -6.918 0.869 1.00 . A A . 5 LYS HB2 1 1 13 3590 1 1 5 LYS HB3 H 6.637 -5.263 0.430 1.00 . A A . 5 LYS HB3 1 1 13 3591 1 1 5 LYS HD2 H 4.449 -4.381 -1.005 1.00 . A A . 5 LYS HD2 1 1 13 3592 1 1 5 LYS HD3 H 5.964 -4.514 -1.835 1.00 . A A . 5 LYS HD3 1 1 13 3593 1 1 5 LYS HE2 H 4.863 -5.955 -3.612 1.00 . A A . 5 LYS HE2 1 1 13 3594 1 1 5 LYS HE3 H 3.314 -5.674 -2.839 1.00 . A A . 5 LYS HE3 1 1 13 3595 1 1 5 LYS HG2 H 5.425 -7.199 -1.584 1.00 . A A . 5 LYS HG2 1 1 13 3596 1 1 5 LYS HG3 H 4.451 -6.600 -0.285 1.00 . A A . 5 LYS HG3 1 1 13 3597 1 1 5 LYS HZ1 H 5.113 -3.539 -3.818 1.00 . A A . 5 LYS HZ1 1 1 13 3598 1 1 5 LYS HZ2 H 3.574 -3.342 -3.262 1.00 . A A . 5 LYS HZ2 1 1 13 3599 1 1 5 LYS HZ3 H 3.839 -4.149 -4.675 1.00 . A A . 5 LYS HZ3 1 1 13 3600 1 1 5 LYS N N 7.934 -6.305 -2.072 1.00 . A A . 5 LYS N 1 1 13 3601 1 1 5 LYS NZ N 4.189 -3.980 -3.743 1.00 . A A . 5 LYS NZ 1 1 13 3602 1 1 5 LYS O O 7.503 -8.970 -0.923 1.00 . A A . 5 LYS O 1 1 13 3603 1 1 6 TRP C C 11.092 -9.618 1.240 1.00 . A A . 6 TRP C 1 1 13 3604 1 1 6 TRP CA C 10.119 -9.705 0.059 1.00 . A A . 6 TRP CA 1 1 13 3605 1 1 6 TRP CB C 10.797 -10.071 -1.277 1.00 . A A . 6 TRP CB 1 1 13 3606 1 1 6 TRP CD1 C 12.302 -12.096 -1.532 1.00 . A A . 6 TRP CD1 1 1 13 3607 1 1 6 TRP CD2 C 10.124 -12.589 -1.792 1.00 . A A . 6 TRP CD2 1 1 13 3608 1 1 6 TRP CE2 C 10.850 -13.799 -2.005 1.00 . A A . 6 TRP CE2 1 1 13 3609 1 1 6 TRP CE3 C 8.715 -12.654 -1.912 1.00 . A A . 6 TRP CE3 1 1 13 3610 1 1 6 TRP CG C 11.078 -11.522 -1.504 1.00 . A A . 6 TRP CG 1 1 13 3611 1 1 6 TRP CH2 C 8.812 -15.042 -2.435 1.00 . A A . 6 TRP CH2 1 1 13 3612 1 1 6 TRP CZ2 C 10.214 -15.012 -2.324 1.00 . A A . 6 TRP CZ2 1 1 13 3613 1 1 6 TRP CZ3 C 8.065 -13.865 -2.229 1.00 . A A . 6 TRP CZ3 1 1 13 3614 1 1 6 TRP H H 10.122 -7.633 0.218 1.00 . A A . 6 TRP H 1 1 13 3615 1 1 6 TRP HA H 9.337 -10.433 0.284 1.00 . A A . 6 TRP HA 1 1 13 3616 1 1 6 TRP HB2 H 10.168 -9.761 -2.113 1.00 . A A . 6 TRP HB2 1 1 13 3617 1 1 6 TRP HB3 H 11.728 -9.512 -1.389 1.00 . A A . 6 TRP HB3 1 1 13 3618 1 1 6 TRP HD1 H 13.232 -11.567 -1.375 1.00 . A A . 6 TRP HD1 1 1 13 3619 1 1 6 TRP HE1 H 12.954 -14.069 -1.928 1.00 . A A . 6 TRP HE1 1 1 13 3620 1 1 6 TRP HE3 H 8.133 -11.756 -1.771 1.00 . A A . 6 TRP HE3 1 1 13 3621 1 1 6 TRP HH2 H 8.315 -15.968 -2.686 1.00 . A A . 6 TRP HH2 1 1 13 3622 1 1 6 TRP HZ2 H 10.794 -15.909 -2.488 1.00 . A A . 6 TRP HZ2 1 1 13 3623 1 1 6 TRP HZ3 H 6.990 -13.888 -2.327 1.00 . A A . 6 TRP HZ3 1 1 13 3624 1 1 6 TRP N N 9.511 -8.390 -0.062 1.00 . A A . 6 TRP N 1 1 13 3625 1 1 6 TRP NE1 N 12.169 -13.438 -1.827 1.00 . A A . 6 TRP NE1 1 1 13 3626 1 1 6 TRP O O 11.812 -8.627 1.351 1.00 . A A . 6 TRP O 1 1 13 3627 1 1 7 LYS C C 12.276 -12.126 3.756 1.00 . A A . 7 LYS C 1 1 13 3628 1 1 7 LYS CA C 12.033 -10.688 3.268 1.00 . A A . 7 LYS CA 1 1 13 3629 1 1 7 LYS CB C 11.691 -9.689 4.401 1.00 . A A . 7 LYS CB 1 1 13 3630 1 1 7 LYS CD C 10.196 -9.332 6.474 1.00 . A A . 7 LYS CD 1 1 13 3631 1 1 7 LYS CE C 10.450 -7.820 6.600 1.00 . A A . 7 LYS CE 1 1 13 3632 1 1 7 LYS CG C 10.293 -9.870 5.034 1.00 . A A . 7 LYS CG 1 1 13 3633 1 1 7 LYS H H 10.471 -11.385 1.998 1.00 . A A . 7 LYS H 1 1 13 3634 1 1 7 LYS HA H 13.010 -10.390 2.881 1.00 . A A . 7 LYS HA 1 1 13 3635 1 1 7 LYS HB2 H 12.455 -9.791 5.174 1.00 . A A . 7 LYS HB2 1 1 13 3636 1 1 7 LYS HB3 H 11.798 -8.669 4.031 1.00 . A A . 7 LYS HB3 1 1 13 3637 1 1 7 LYS HD2 H 9.205 -9.574 6.861 1.00 . A A . 7 LYS HD2 1 1 13 3638 1 1 7 LYS HD3 H 10.904 -9.886 7.094 1.00 . A A . 7 LYS HD3 1 1 13 3639 1 1 7 LYS HE2 H 11.434 -7.565 6.201 1.00 . A A . 7 LYS HE2 1 1 13 3640 1 1 7 LYS HE3 H 9.718 -7.266 6.011 1.00 . A A . 7 LYS HE3 1 1 13 3641 1 1 7 LYS HG2 H 9.538 -9.412 4.394 1.00 . A A . 7 LYS HG2 1 1 13 3642 1 1 7 LYS HG3 H 10.048 -10.934 5.065 1.00 . A A . 7 LYS HG3 1 1 13 3643 1 1 7 LYS HZ1 H 9.472 -7.551 8.394 1.00 . A A . 7 LYS HZ1 1 1 13 3644 1 1 7 LYS HZ2 H 10.579 -6.382 8.059 1.00 . A A . 7 LYS HZ2 1 1 13 3645 1 1 7 LYS HZ3 H 11.080 -7.866 8.555 1.00 . A A . 7 LYS HZ3 1 1 13 3646 1 1 7 LYS N N 11.093 -10.604 2.144 1.00 . A A . 7 LYS N 1 1 13 3647 1 1 7 LYS NZ N 10.388 -7.373 8.006 1.00 . A A . 7 LYS NZ 1 1 13 3648 1 1 7 LYS O O 12.809 -12.323 4.844 1.00 . A A . 7 LYS O 1 1 13 3649 1 1 8 TRP C C 11.680 -15.259 1.919 1.00 . A A . 8 TRP C 1 1 13 3650 1 1 8 TRP CA C 12.018 -14.555 3.235 1.00 . A A . 8 TRP CA 1 1 13 3651 1 1 8 TRP CB C 11.156 -15.041 4.423 1.00 . A A . 8 TRP CB 1 1 13 3652 1 1 8 TRP CD1 C 12.785 -16.042 6.063 1.00 . A A . 8 TRP CD1 1 1 13 3653 1 1 8 TRP CD2 C 11.438 -17.598 5.158 1.00 . A A . 8 TRP CD2 1 1 13 3654 1 1 8 TRP CE2 C 12.332 -18.280 6.040 1.00 . A A . 8 TRP CE2 1 1 13 3655 1 1 8 TRP CE3 C 10.481 -18.389 4.480 1.00 . A A . 8 TRP CE3 1 1 13 3656 1 1 8 TRP CG C 11.763 -16.174 5.187 1.00 . A A . 8 TRP CG 1 1 13 3657 1 1 8 TRP CH2 C 11.327 -20.428 5.535 1.00 . A A . 8 TRP CH2 1 1 13 3658 1 1 8 TRP CZ2 C 12.287 -19.672 6.230 1.00 . A A . 8 TRP CZ2 1 1 13 3659 1 1 8 TRP CZ3 C 10.425 -19.786 4.664 1.00 . A A . 8 TRP CZ3 1 1 13 3660 1 1 8 TRP H H 11.514 -12.945 2.047 1.00 . A A . 8 TRP H 1 1 13 3661 1 1 8 TRP HA H 13.076 -14.719 3.451 1.00 . A A . 8 TRP HA 1 1 13 3662 1 1 8 TRP HB2 H 11.010 -14.238 5.145 1.00 . A A . 8 TRP HB2 1 1 13 3663 1 1 8 TRP HB3 H 10.153 -15.319 4.097 1.00 . A A . 8 TRP HB3 1 1 13 3664 1 1 8 TRP HD1 H 13.259 -15.100 6.304 1.00 . A A . 8 TRP HD1 1 1 13 3665 1 1 8 TRP HE1 H 13.868 -17.416 7.236 1.00 . A A . 8 TRP HE1 1 1 13 3666 1 1 8 TRP HE3 H 9.780 -17.912 3.815 1.00 . A A . 8 TRP HE3 1 1 13 3667 1 1 8 TRP HH2 H 11.283 -21.498 5.673 1.00 . A A . 8 TRP HH2 1 1 13 3668 1 1 8 TRP HZ2 H 12.978 -20.158 6.903 1.00 . A A . 8 TRP HZ2 1 1 13 3669 1 1 8 TRP HZ3 H 9.686 -20.374 4.141 1.00 . A A . 8 TRP HZ3 1 1 13 3670 1 1 8 TRP N N 11.846 -13.129 2.987 1.00 . A A . 8 TRP N 1 1 13 3671 1 1 8 TRP NE1 N 13.125 -17.281 6.561 1.00 . A A . 8 TRP NE1 1 1 13 3672 1 1 8 TRP O O 11.157 -14.611 1.014 1.00 . A A . 8 TRP O 1 1 13 3673 1 1 9 THR C C 10.882 -18.565 0.800 1.00 . A A . 9 THR C 1 1 13 3674 1 1 9 THR CA C 11.789 -17.333 0.571 1.00 . A A . 9 THR CA 1 1 13 3675 1 1 9 THR CB C 13.219 -17.523 -0.011 1.00 . A A . 9 THR CB 1 1 13 3676 1 1 9 THR CG2 C 14.214 -18.372 0.818 1.00 . A A . 9 THR CG2 1 1 13 3677 1 1 9 THR H H 12.295 -17.064 2.611 1.00 . A A . 9 THR H 1 1 13 3678 1 1 9 THR HA H 11.266 -16.739 -0.180 1.00 . A A . 9 THR HA 1 1 13 3679 1 1 9 THR HB H 13.654 -16.522 -0.032 1.00 . A A . 9 THR HB 1 1 13 3680 1 1 9 THR HG21 H 14.303 -17.983 1.832 1.00 . A A . 9 THR HG21 1 1 13 3681 1 1 9 THR HG22 H 15.212 -18.334 0.384 1.00 . A A . 9 THR HG22 1 1 13 3682 1 1 9 THR HG23 H 13.926 -19.417 0.906 1.00 . A A . 9 THR HG23 1 1 13 3683 1 1 9 THR N N 11.918 -16.569 1.815 1.00 . A A . 9 THR N 1 1 13 3684 1 1 9 THR O O 11.373 -19.692 0.885 1.00 . A A . 9 THR O 1 1 13 3685 1 1 9 THR OG1 O 13.147 -17.900 -1.403 1.00 . A A . 9 THR OG1 1 1 13 3686 1 1 10 PRO C C 8.246 -20.201 -0.068 1.00 . A A . 10 PRO C 1 1 13 3687 1 1 10 PRO CA C 8.622 -19.483 1.240 1.00 . A A . 10 PRO CA 1 1 13 3688 1 1 10 PRO CB C 7.395 -18.803 1.873 1.00 . A A . 10 PRO CB 1 1 13 3689 1 1 10 PRO CD C 8.848 -17.088 1.028 1.00 . A A . 10 PRO CD 1 1 13 3690 1 1 10 PRO CG C 7.371 -17.407 1.261 1.00 . A A . 10 PRO CG 1 1 13 3691 1 1 10 PRO HA H 9.049 -20.202 1.940 1.00 . A A . 10 PRO HA 1 1 13 3692 1 1 10 PRO HB2 H 6.466 -19.350 1.708 1.00 . A A . 10 PRO HB2 1 1 13 3693 1 1 10 PRO HB3 H 7.541 -18.728 2.951 1.00 . A A . 10 PRO HB3 1 1 13 3694 1 1 10 PRO HD2 H 8.989 -16.507 0.115 1.00 . A A . 10 PRO HD2 1 1 13 3695 1 1 10 PRO HD3 H 9.213 -16.499 1.867 1.00 . A A . 10 PRO HD3 1 1 13 3696 1 1 10 PRO HG2 H 6.846 -17.426 0.304 1.00 . A A . 10 PRO HG2 1 1 13 3697 1 1 10 PRO HG3 H 6.877 -16.670 1.894 1.00 . A A . 10 PRO HG3 1 1 13 3698 1 1 10 PRO N N 9.550 -18.378 0.978 1.00 . A A . 10 PRO N 1 1 13 3699 1 1 10 PRO O O 7.454 -19.686 -0.859 1.00 . A A . 10 PRO O 1 1 13 3700 1 1 11 TRP C C 7.001 -22.803 -1.231 1.00 . A A . 11 TRP C 1 1 13 3701 1 1 11 TRP CA C 8.440 -22.274 -1.406 1.00 . A A . 11 TRP CA 1 1 13 3702 1 1 11 TRP CB C 9.459 -23.435 -1.470 1.00 . A A . 11 TRP CB 1 1 13 3703 1 1 11 TRP CD1 C 8.702 -24.143 -3.812 1.00 . A A . 11 TRP CD1 1 1 13 3704 1 1 11 TRP CD2 C 10.371 -25.408 -3.004 1.00 . A A . 11 TRP CD2 1 1 13 3705 1 1 11 TRP CE2 C 10.074 -25.898 -4.312 1.00 . A A . 11 TRP CE2 1 1 13 3706 1 1 11 TRP CE3 C 11.410 -26.059 -2.298 1.00 . A A . 11 TRP CE3 1 1 13 3707 1 1 11 TRP CG C 9.483 -24.283 -2.714 1.00 . A A . 11 TRP CG 1 1 13 3708 1 1 11 TRP CH2 C 11.804 -27.591 -4.163 1.00 . A A . 11 TRP CH2 1 1 13 3709 1 1 11 TRP CZ2 C 10.774 -26.970 -4.892 1.00 . A A . 11 TRP CZ2 1 1 13 3710 1 1 11 TRP CZ3 C 12.120 -27.137 -2.868 1.00 . A A . 11 TRP CZ3 1 1 13 3711 1 1 11 TRP H H 9.437 -21.763 0.400 1.00 . A A . 11 TRP H 1 1 13 3712 1 1 11 TRP HA H 8.519 -21.682 -2.321 1.00 . A A . 11 TRP HA 1 1 13 3713 1 1 11 TRP HB2 H 10.465 -23.024 -1.379 1.00 . A A . 11 TRP HB2 1 1 13 3714 1 1 11 TRP HB3 H 9.334 -24.102 -0.617 1.00 . A A . 11 TRP HB3 1 1 13 3715 1 1 11 TRP HD1 H 7.937 -23.390 -3.943 1.00 . A A . 11 TRP HD1 1 1 13 3716 1 1 11 TRP HE1 H 8.623 -25.133 -5.667 1.00 . A A . 11 TRP HE1 1 1 13 3717 1 1 11 TRP HE3 H 11.670 -25.716 -1.308 1.00 . A A . 11 TRP HE3 1 1 13 3718 1 1 11 TRP HH2 H 12.357 -28.412 -4.598 1.00 . A A . 11 TRP HH2 1 1 13 3719 1 1 11 TRP HZ2 H 10.533 -27.311 -5.887 1.00 . A A . 11 TRP HZ2 1 1 13 3720 1 1 11 TRP HZ3 H 12.915 -27.612 -2.311 1.00 . A A . 11 TRP HZ3 1 1 13 3721 1 1 11 TRP N N 8.768 -21.416 -0.269 1.00 . A A . 11 TRP N 1 1 13 3722 1 1 11 TRP NE1 N 9.045 -25.094 -4.750 1.00 . A A . 11 TRP NE1 1 1 13 3723 1 1 11 TRP O O 6.752 -23.777 -0.521 1.00 . A A . 11 TRP O 1 1 13 3724 1 1 12 ARG C C 4.426 -23.199 -3.286 1.00 . A A . 12 ARG C 1 1 13 3725 1 1 12 ARG CA C 4.643 -22.493 -1.940 1.00 . A A . 12 ARG CA 1 1 13 3726 1 1 12 ARG CB C 3.775 -21.215 -1.924 1.00 . A A . 12 ARG CB 1 1 13 3727 1 1 12 ARG CD C 2.899 -19.230 -0.559 1.00 . A A . 12 ARG CD 1 1 13 3728 1 1 12 ARG CG C 3.803 -20.475 -0.574 1.00 . A A . 12 ARG CG 1 1 13 3729 1 1 12 ARG CZ C 1.517 -18.161 1.269 1.00 . A A . 12 ARG CZ 1 1 13 3730 1 1 12 ARG H H 6.347 -21.320 -2.406 1.00 . A A . 12 ARG H 1 1 13 3731 1 1 12 ARG HA H 4.361 -23.155 -1.119 1.00 . A A . 12 ARG HA 1 1 13 3732 1 1 12 ARG HB2 H 4.094 -20.539 -2.721 1.00 . A A . 12 ARG HB2 1 1 13 3733 1 1 12 ARG HB3 H 2.743 -21.483 -2.158 1.00 . A A . 12 ARG HB3 1 1 13 3734 1 1 12 ARG HD2 H 3.352 -18.416 -1.128 1.00 . A A . 12 ARG HD2 1 1 13 3735 1 1 12 ARG HD3 H 1.955 -19.476 -1.047 1.00 . A A . 12 ARG HD3 1 1 13 3736 1 1 12 ARG HE H 3.408 -18.921 1.442 1.00 . A A . 12 ARG HE 1 1 13 3737 1 1 12 ARG HG2 H 3.504 -21.167 0.214 1.00 . A A . 12 ARG HG2 1 1 13 3738 1 1 12 ARG HG3 H 4.827 -20.176 -0.346 1.00 . A A . 12 ARG HG3 1 1 13 3739 1 1 12 ARG HH11 H 0.605 -18.005 -0.557 1.00 . A A . 12 ARG HH11 1 1 13 3740 1 1 12 ARG HH12 H -0.328 -17.381 0.740 1.00 . A A . 12 ARG HH12 1 1 13 3741 1 1 12 ARG HH21 H 2.126 -18.124 3.235 1.00 . A A . 12 ARG HH21 1 1 13 3742 1 1 12 ARG HH22 H 0.604 -17.394 2.951 1.00 . A A . 12 ARG HH22 1 1 13 3743 1 1 12 ARG N N 6.045 -22.111 -1.853 1.00 . A A . 12 ARG N 1 1 13 3744 1 1 12 ARG NE N 2.619 -18.785 0.821 1.00 . A A . 12 ARG NE 1 1 13 3745 1 1 12 ARG NH1 N 0.526 -17.832 0.436 1.00 . A A . 12 ARG NH1 1 1 13 3746 1 1 12 ARG NH2 N 1.411 -17.870 2.566 1.00 . A A . 12 ARG NH2 1 1 13 3747 1 1 12 ARG O O 5.016 -22.809 -4.292 1.00 . A A . 12 ARG O 1 1 13 3748 1 1 13 ARG C C 1.736 -24.096 -4.887 1.00 . A A . 13 ARG C 1 1 13 3749 1 1 13 ARG CA C 3.045 -24.821 -4.532 1.00 . A A . 13 ARG CA 1 1 13 3750 1 1 13 ARG CB C 2.790 -26.332 -4.278 1.00 . A A . 13 ARG CB 1 1 13 3751 1 1 13 ARG CD C 1.572 -28.214 -3.012 1.00 . A A . 13 ARG CD 1 1 13 3752 1 1 13 ARG CG C 1.668 -26.703 -3.278 1.00 . A A . 13 ARG CG 1 1 13 3753 1 1 13 ARG CZ C 2.062 -29.214 -0.735 1.00 . A A . 13 ARG CZ 1 1 13 3754 1 1 13 ARG H H 3.010 -24.369 -2.472 1.00 . A A . 13 ARG H 1 1 13 3755 1 1 13 ARG HA H 3.768 -24.711 -5.344 1.00 . A A . 13 ARG HA 1 1 13 3756 1 1 13 ARG HB2 H 2.564 -26.800 -5.237 1.00 . A A . 13 ARG HB2 1 1 13 3757 1 1 13 ARG HB3 H 3.728 -26.783 -3.951 1.00 . A A . 13 ARG HB3 1 1 13 3758 1 1 13 ARG HD2 H 0.534 -28.467 -2.800 1.00 . A A . 13 ARG HD2 1 1 13 3759 1 1 13 ARG HD3 H 1.837 -28.787 -3.902 1.00 . A A . 13 ARG HD3 1 1 13 3760 1 1 13 ARG HE H 3.419 -28.490 -2.080 1.00 . A A . 13 ARG HE 1 1 13 3761 1 1 13 ARG HG2 H 1.810 -26.167 -2.339 1.00 . A A . 13 ARG HG2 1 1 13 3762 1 1 13 ARG HG3 H 0.704 -26.370 -3.665 1.00 . A A . 13 ARG HG3 1 1 13 3763 1 1 13 ARG HH11 H 0.053 -29.262 -1.140 1.00 . A A . 13 ARG HH11 1 1 13 3764 1 1 13 ARG HH12 H 0.473 -29.934 0.380 1.00 . A A . 13 ARG HH12 1 1 13 3765 1 1 13 ARG HH21 H 3.978 -29.362 0.009 1.00 . A A . 13 ARG HH21 1 1 13 3766 1 1 13 ARG HH22 H 2.765 -29.985 1.043 1.00 . A A . 13 ARG HH22 1 1 13 3767 1 1 13 ARG N N 3.545 -24.205 -3.308 1.00 . A A . 13 ARG N 1 1 13 3768 1 1 13 ARG NE N 2.433 -28.626 -1.885 1.00 . A A . 13 ARG NE 1 1 13 3769 1 1 13 ARG NH1 N 0.779 -29.478 -0.470 1.00 . A A . 13 ARG NH1 1 1 13 3770 1 1 13 ARG NH2 N 2.992 -29.534 0.166 1.00 . A A . 13 ARG NH2 1 1 13 3771 1 1 13 ARG O O 0.952 -23.757 -4.002 1.00 . A A . 13 ARG O 1 1 13 3772 1 1 14 NH2 HN1 H 0.624 -23.368 -6.397 1.00 . A A . 14 NH2 HN1 1 1 13 3773 1 1 14 NH2 HN2 H 2.149 -24.082 -6.881 1.00 . A A . 14 NH2 HN2 1 1 13 3774 1 1 14 NH2 N N 1.476 -23.855 -6.164 1.00 . A A . 14 NH2 N 1 1 13 3775 2 2 1 . C1 C 13.379 -19.240 -1.785 1.00 . B A . 101 BGC C1 1 1 13 3776 2 2 1 . C2 C 12.798 -19.458 -3.195 1.00 . B A . 101 BGC C2 1 1 13 3777 2 2 1 . C3 C 13.105 -20.882 -3.668 1.00 . B A . 101 BGC C3 1 1 13 3778 2 2 1 . C4 C 14.604 -21.168 -3.567 1.00 . B A . 101 BGC C4 1 1 13 3779 2 2 1 . C5 C 15.084 -20.915 -2.119 1.00 . B A . 101 BGC C5 1 1 13 3780 2 2 1 . C6 C 16.611 -21.058 -1.948 1.00 . B A . 101 BGC C6 1 1 13 3781 2 2 1 . H1 H 12.886 -19.893 -1.055 1.00 . B A . 101 BGC H1 1 1 13 3782 2 2 1 . H2 H 13.252 -18.735 -3.876 1.00 . B A . 101 BGC H2 1 1 13 3783 2 2 1 . H3 H 12.569 -21.595 -3.038 1.00 . B A . 101 BGC H3 1 1 13 3784 2 2 1 . H4 H 15.148 -20.497 -4.236 1.00 . B A . 101 BGC H4 1 1 13 3785 2 2 1 . H5 H 14.574 -21.587 -1.425 1.00 . B A . 101 BGC H5 1 1 13 3786 2 2 1 . H6 H 16.867 -22.949 -1.461 1.00 . B A . 101 BGC H6 1 1 13 3787 2 2 1 . H6C1 H 16.903 -20.781 -0.934 1.00 . B A . 101 BGC H6C1 1 1 13 3788 2 2 1 . H6C2 H 17.122 -20.364 -2.616 1.00 . B A . 101 BGC H6C2 1 1 13 3789 2 2 1 . HB H 11.098 -19.495 -4.081 1.00 . B A . 101 BGC HB 1 1 13 3790 2 2 1 . HC H 13.072 -21.914 -5.287 1.00 . B A . 101 BGC HC 1 1 13 3791 2 2 1 . HD H 15.786 -22.696 -3.782 1.00 . B A . 101 BGC HD 1 1 13 3792 2 2 1 . O2 O 11.388 -19.266 -3.183 1.00 . B A . 101 BGC O2 1 1 13 3793 2 2 1 . O3 O 12.684 -21.063 -5.015 1.00 . B A . 101 BGC O3 1 1 13 3794 2 2 1 . O4 O 14.847 -22.511 -3.977 1.00 . B A . 101 BGC O4 1 1 13 3795 2 2 1 . O5 O 14.757 -19.562 -1.780 1.00 . B A . 101 BGC O5 1 1 13 3796 2 2 1 . O6 O 17.074 -22.382 -2.221 1.00 . B A . 101 BGC O6 1 1 14 3797 1 1 1 ILE C C 5.407 0.229 -4.280 1.00 . A A . 1 ILE C 1 1 14 3798 1 1 1 ILE CA C 4.450 1.415 -4.456 1.00 . A A . 1 ILE CA 1 1 14 3799 1 1 1 ILE CB C 3.345 1.467 -3.363 1.00 . A A . 1 ILE CB 1 1 14 3800 1 1 1 ILE CD1 C 1.593 0.090 -2.065 1.00 . A A . 1 ILE CD1 1 1 14 3801 1 1 1 ILE CG1 C 2.394 0.243 -3.366 1.00 . A A . 1 ILE CG1 1 1 14 3802 1 1 1 ILE CG2 C 2.553 2.789 -3.442 1.00 . A A . 1 ILE CG2 1 1 14 3803 1 1 1 ILE H1 H 4.608 1.359 -6.481 1.00 . A A . 1 ILE H1 1 1 14 3804 1 1 1 ILE HA H 5.050 2.326 -4.408 1.00 . A A . 1 ILE HA 1 1 14 3805 1 1 1 ILE HB H 3.856 1.475 -2.398 1.00 . A A . 1 ILE HB 1 1 14 3806 1 1 1 ILE HD11 H 2.248 0.009 -1.197 1.00 . A A . 1 ILE HD11 1 1 14 3807 1 1 1 ILE HD12 H 0.915 0.928 -1.897 1.00 . A A . 1 ILE HD12 1 1 14 3808 1 1 1 ILE HD13 H 0.982 -0.814 -2.092 1.00 . A A . 1 ILE HD13 1 1 14 3809 1 1 1 ILE HG12 H 1.698 0.294 -4.205 1.00 . A A . 1 ILE HG12 1 1 14 3810 1 1 1 ILE HG13 H 2.954 -0.684 -3.497 1.00 . A A . 1 ILE HG13 1 1 14 3811 1 1 1 ILE HG21 H 1.898 2.909 -2.579 1.00 . A A . 1 ILE HG21 1 1 14 3812 1 1 1 ILE HG22 H 3.217 3.656 -3.444 1.00 . A A . 1 ILE HG22 1 1 14 3813 1 1 1 ILE HG23 H 1.923 2.846 -4.329 1.00 . A A . 1 ILE HG23 1 1 14 3814 1 1 1 ILE N N 3.859 1.329 -5.803 1.00 . A A . 1 ILE N 1 1 14 3815 1 1 1 ILE O O 5.408 -0.648 -5.142 1.00 . A A . 1 ILE O 1 1 14 3816 1 1 2 LEU C C 7.008 -1.072 -1.331 1.00 . A A . 2 LEU C 1 1 14 3817 1 1 2 LEU CA C 7.108 -0.896 -2.863 1.00 . A A . 2 LEU CA 1 1 14 3818 1 1 2 LEU CB C 8.515 -0.549 -3.425 1.00 . A A . 2 LEU CB 1 1 14 3819 1 1 2 LEU CD1 C 9.741 -2.629 -2.546 1.00 . A A . 2 LEU CD1 1 1 14 3820 1 1 2 LEU CD2 C 8.944 -2.571 -4.951 1.00 . A A . 2 LEU CD2 1 1 14 3821 1 1 2 LEU CG C 9.443 -1.740 -3.756 1.00 . A A . 2 LEU CG 1 1 14 3822 1 1 2 LEU H H 6.147 0.931 -2.508 1.00 . A A . 2 LEU H 1 1 14 3823 1 1 2 LEU HA H 6.774 -1.812 -3.348 1.00 . A A . 2 LEU HA 1 1 14 3824 1 1 2 LEU HB2 H 8.408 0.027 -4.344 1.00 . A A . 2 LEU HB2 1 1 14 3825 1 1 2 LEU HB3 H 9.034 0.123 -2.739 1.00 . A A . 2 LEU HB3 1 1 14 3826 1 1 2 LEU HD11 H 10.078 -2.043 -1.691 1.00 . A A . 2 LEU HD11 1 1 14 3827 1 1 2 LEU HD12 H 10.520 -3.358 -2.771 1.00 . A A . 2 LEU HD12 1 1 14 3828 1 1 2 LEU HD13 H 8.858 -3.190 -2.241 1.00 . A A . 2 LEU HD13 1 1 14 3829 1 1 2 LEU HD21 H 8.757 -1.945 -5.823 1.00 . A A . 2 LEU HD21 1 1 14 3830 1 1 2 LEU HD22 H 8.023 -3.109 -4.725 1.00 . A A . 2 LEU HD22 1 1 14 3831 1 1 2 LEU HD23 H 9.686 -3.316 -5.242 1.00 . A A . 2 LEU HD23 1 1 14 3832 1 1 2 LEU HG H 10.394 -1.305 -4.063 1.00 . A A . 2 LEU HG 1 1 14 3833 1 1 2 LEU N N 6.191 0.194 -3.198 1.00 . A A . 2 LEU N 1 1 14 3834 1 1 2 LEU O O 7.707 -0.357 -0.613 1.00 . A A . 2 LEU O 1 1 14 3835 1 1 3 PRO C C 6.796 -2.841 1.393 1.00 . A A . 3 PRO C 1 1 14 3836 1 1 3 PRO CA C 5.769 -1.979 0.629 1.00 . A A . 3 PRO CA 1 1 14 3837 1 1 3 PRO CB C 4.348 -2.573 0.667 1.00 . A A . 3 PRO CB 1 1 14 3838 1 1 3 PRO CD C 5.167 -2.761 -1.581 1.00 . A A . 3 PRO CD 1 1 14 3839 1 1 3 PRO CG C 4.287 -3.477 -0.556 1.00 . A A . 3 PRO CG 1 1 14 3840 1 1 3 PRO HA H 5.754 -0.986 1.081 1.00 . A A . 3 PRO HA 1 1 14 3841 1 1 3 PRO HB2 H 4.113 -3.103 1.593 1.00 . A A . 3 PRO HB2 1 1 14 3842 1 1 3 PRO HB3 H 3.615 -1.772 0.567 1.00 . A A . 3 PRO HB3 1 1 14 3843 1 1 3 PRO HD2 H 5.713 -3.487 -2.188 1.00 . A A . 3 PRO HD2 1 1 14 3844 1 1 3 PRO HD3 H 4.553 -2.150 -2.243 1.00 . A A . 3 PRO HD3 1 1 14 3845 1 1 3 PRO HG2 H 4.719 -4.449 -0.308 1.00 . A A . 3 PRO HG2 1 1 14 3846 1 1 3 PRO HG3 H 3.270 -3.651 -0.908 1.00 . A A . 3 PRO HG3 1 1 14 3847 1 1 3 PRO N N 6.077 -1.905 -0.810 1.00 . A A . 3 PRO N 1 1 14 3848 1 1 3 PRO O O 6.494 -3.952 1.818 1.00 . A A . 3 PRO O 1 1 14 3849 1 1 4 TRP C C 9.937 -3.843 1.143 1.00 . A A . 4 TRP C 1 1 14 3850 1 1 4 TRP CA C 9.196 -2.947 2.151 1.00 . A A . 4 TRP CA 1 1 14 3851 1 1 4 TRP CB C 8.910 -3.618 3.516 1.00 . A A . 4 TRP CB 1 1 14 3852 1 1 4 TRP CD1 C 10.713 -5.047 4.587 1.00 . A A . 4 TRP CD1 1 1 14 3853 1 1 4 TRP CD2 C 10.905 -2.872 5.117 1.00 . A A . 4 TRP CD2 1 1 14 3854 1 1 4 TRP CE2 C 11.980 -3.553 5.763 1.00 . A A . 4 TRP CE2 1 1 14 3855 1 1 4 TRP CE3 C 10.815 -1.475 5.321 1.00 . A A . 4 TRP CE3 1 1 14 3856 1 1 4 TRP CG C 10.117 -3.852 4.372 1.00 . A A . 4 TRP CG 1 1 14 3857 1 1 4 TRP CH2 C 12.793 -1.499 6.759 1.00 . A A . 4 TRP CH2 1 1 14 3858 1 1 4 TRP CZ2 C 12.914 -2.887 6.574 1.00 . A A . 4 TRP CZ2 1 1 14 3859 1 1 4 TRP CZ3 C 11.746 -0.794 6.133 1.00 . A A . 4 TRP CZ3 1 1 14 3860 1 1 4 TRP H H 8.178 -1.443 1.056 1.00 . A A . 4 TRP H 1 1 14 3861 1 1 4 TRP HA H 9.864 -2.108 2.346 1.00 . A A . 4 TRP HA 1 1 14 3862 1 1 4 TRP HB2 H 8.216 -3.010 4.097 1.00 . A A . 4 TRP HB2 1 1 14 3863 1 1 4 TRP HB3 H 8.413 -4.577 3.363 1.00 . A A . 4 TRP HB3 1 1 14 3864 1 1 4 TRP HD1 H 10.368 -5.985 4.171 1.00 . A A . 4 TRP HD1 1 1 14 3865 1 1 4 TRP HE1 H 12.382 -5.647 5.716 1.00 . A A . 4 TRP HE1 1 1 14 3866 1 1 4 TRP HE3 H 10.006 -0.925 4.864 1.00 . A A . 4 TRP HE3 1 1 14 3867 1 1 4 TRP HH2 H 13.495 -0.974 7.393 1.00 . A A . 4 TRP HH2 1 1 14 3868 1 1 4 TRP HZ2 H 13.707 -3.434 7.062 1.00 . A A . 4 TRP HZ2 1 1 14 3869 1 1 4 TRP HZ3 H 11.646 0.270 6.286 1.00 . A A . 4 TRP HZ3 1 1 14 3870 1 1 4 TRP N N 8.019 -2.317 1.540 1.00 . A A . 4 TRP N 1 1 14 3871 1 1 4 TRP NE1 N 11.822 -4.870 5.391 1.00 . A A . 4 TRP NE1 1 1 14 3872 1 1 4 TRP O O 9.421 -4.154 0.069 1.00 . A A . 4 TRP O 1 1 14 3873 1 1 5 LYS C C 11.443 -6.621 0.974 1.00 . A A . 5 LYS C 1 1 14 3874 1 1 5 LYS CA C 11.940 -5.200 0.669 1.00 . A A . 5 LYS CA 1 1 14 3875 1 1 5 LYS CB C 13.436 -5.072 1.027 1.00 . A A . 5 LYS CB 1 1 14 3876 1 1 5 LYS CD C 15.607 -3.776 0.622 1.00 . A A . 5 LYS CD 1 1 14 3877 1 1 5 LYS CE C 16.246 -2.522 0.005 1.00 . A A . 5 LYS CE 1 1 14 3878 1 1 5 LYS CG C 14.078 -3.790 0.468 1.00 . A A . 5 LYS CG 1 1 14 3879 1 1 5 LYS H H 11.466 -4.106 2.425 1.00 . A A . 5 LYS H 1 1 14 3880 1 1 5 LYS HA H 11.807 -5.002 -0.397 1.00 . A A . 5 LYS HA 1 1 14 3881 1 1 5 LYS HB2 H 13.578 -5.133 2.109 1.00 . A A . 5 LYS HB2 1 1 14 3882 1 1 5 LYS HB3 H 13.964 -5.934 0.611 1.00 . A A . 5 LYS HB3 1 1 14 3883 1 1 5 LYS HD2 H 15.857 -3.846 1.682 1.00 . A A . 5 LYS HD2 1 1 14 3884 1 1 5 LYS HD3 H 16.013 -4.672 0.148 1.00 . A A . 5 LYS HD3 1 1 14 3885 1 1 5 LYS HE2 H 15.971 -2.440 -1.048 1.00 . A A . 5 LYS HE2 1 1 14 3886 1 1 5 LYS HE3 H 15.868 -1.626 0.500 1.00 . A A . 5 LYS HE3 1 1 14 3887 1 1 5 LYS HG2 H 13.822 -3.698 -0.589 1.00 . A A . 5 LYS HG2 1 1 14 3888 1 1 5 LYS HG3 H 13.640 -2.920 0.964 1.00 . A A . 5 LYS HG3 1 1 14 3889 1 1 5 LYS HZ1 H 18.105 -1.702 -0.286 1.00 . A A . 5 LYS HZ1 1 1 14 3890 1 1 5 LYS HZ2 H 18.084 -3.345 -0.396 1.00 . A A . 5 LYS HZ2 1 1 14 3891 1 1 5 LYS HZ3 H 17.996 -2.616 1.080 1.00 . A A . 5 LYS HZ3 1 1 14 3892 1 1 5 LYS N N 11.164 -4.261 1.472 1.00 . A A . 5 LYS N 1 1 14 3893 1 1 5 LYS NZ N 17.718 -2.549 0.110 1.00 . A A . 5 LYS NZ 1 1 14 3894 1 1 5 LYS O O 11.899 -7.262 1.921 1.00 . A A . 5 LYS O 1 1 14 3895 1 1 6 TRP C C 10.895 -9.438 -0.447 1.00 . A A . 6 TRP C 1 1 14 3896 1 1 6 TRP CA C 9.931 -8.433 0.213 1.00 . A A . 6 TRP CA 1 1 14 3897 1 1 6 TRP CB C 8.566 -8.451 -0.514 1.00 . A A . 6 TRP CB 1 1 14 3898 1 1 6 TRP CD1 C 7.005 -10.368 0.097 1.00 . A A . 6 TRP CD1 1 1 14 3899 1 1 6 TRP CD2 C 6.756 -8.564 1.415 1.00 . A A . 6 TRP CD2 1 1 14 3900 1 1 6 TRP CE2 C 5.840 -9.550 1.889 1.00 . A A . 6 TRP CE2 1 1 14 3901 1 1 6 TRP CE3 C 6.772 -7.320 2.089 1.00 . A A . 6 TRP CE3 1 1 14 3902 1 1 6 TRP CG C 7.487 -9.117 0.280 1.00 . A A . 6 TRP CG 1 1 14 3903 1 1 6 TRP CH2 C 5.027 -8.064 3.629 1.00 . A A . 6 TRP CH2 1 1 14 3904 1 1 6 TRP CZ2 C 4.986 -9.314 2.981 1.00 . A A . 6 TRP CZ2 1 1 14 3905 1 1 6 TRP CZ3 C 5.918 -7.070 3.181 1.00 . A A . 6 TRP CZ3 1 1 14 3906 1 1 6 TRP H H 10.119 -6.449 -0.528 1.00 . A A . 6 TRP H 1 1 14 3907 1 1 6 TRP HA H 9.801 -8.713 1.261 1.00 . A A . 6 TRP HA 1 1 14 3908 1 1 6 TRP HB2 H 8.213 -7.438 -0.713 1.00 . A A . 6 TRP HB2 1 1 14 3909 1 1 6 TRP HB3 H 8.632 -8.927 -1.494 1.00 . A A . 6 TRP HB3 1 1 14 3910 1 1 6 TRP HD1 H 7.337 -11.048 -0.676 1.00 . A A . 6 TRP HD1 1 1 14 3911 1 1 6 TRP HE1 H 5.510 -11.489 1.080 1.00 . A A . 6 TRP HE1 1 1 14 3912 1 1 6 TRP HE3 H 7.439 -6.539 1.753 1.00 . A A . 6 TRP HE3 1 1 14 3913 1 1 6 TRP HH2 H 4.371 -7.862 4.464 1.00 . A A . 6 TRP HH2 1 1 14 3914 1 1 6 TRP HZ2 H 4.299 -10.076 3.318 1.00 . A A . 6 TRP HZ2 1 1 14 3915 1 1 6 TRP HZ3 H 5.942 -6.103 3.665 1.00 . A A . 6 TRP HZ3 1 1 14 3916 1 1 6 TRP N N 10.481 -7.083 0.169 1.00 . A A . 6 TRP N 1 1 14 3917 1 1 6 TRP NE1 N 6.040 -10.628 1.050 1.00 . A A . 6 TRP NE1 1 1 14 3918 1 1 6 TRP O O 11.935 -9.068 -0.997 1.00 . A A . 6 TRP O 1 1 14 3919 1 1 7 LYS C C 10.495 -12.975 -1.374 1.00 . A A . 7 LYS C 1 1 14 3920 1 1 7 LYS CA C 11.368 -11.844 -0.818 1.00 . A A . 7 LYS CA 1 1 14 3921 1 1 7 LYS CB C 12.297 -12.293 0.334 1.00 . A A . 7 LYS CB 1 1 14 3922 1 1 7 LYS CD C 12.093 -13.763 2.465 1.00 . A A . 7 LYS CD 1 1 14 3923 1 1 7 LYS CE C 11.688 -15.096 1.813 1.00 . A A . 7 LYS CE 1 1 14 3924 1 1 7 LYS CG C 11.559 -12.562 1.669 1.00 . A A . 7 LYS CG 1 1 14 3925 1 1 7 LYS H H 9.629 -10.959 -0.023 1.00 . A A . 7 LYS H 1 1 14 3926 1 1 7 LYS HA H 11.992 -11.513 -1.652 1.00 . A A . 7 LYS HA 1 1 14 3927 1 1 7 LYS HB2 H 12.853 -13.173 0.009 1.00 . A A . 7 LYS HB2 1 1 14 3928 1 1 7 LYS HB3 H 13.057 -11.528 0.499 1.00 . A A . 7 LYS HB3 1 1 14 3929 1 1 7 LYS HD2 H 13.177 -13.687 2.570 1.00 . A A . 7 LYS HD2 1 1 14 3930 1 1 7 LYS HD3 H 11.679 -13.709 3.473 1.00 . A A . 7 LYS HD3 1 1 14 3931 1 1 7 LYS HE2 H 10.609 -15.118 1.642 1.00 . A A . 7 LYS HE2 1 1 14 3932 1 1 7 LYS HE3 H 12.171 -15.196 0.842 1.00 . A A . 7 LYS HE3 1 1 14 3933 1 1 7 LYS HG2 H 11.622 -11.661 2.281 1.00 . A A . 7 LYS HG2 1 1 14 3934 1 1 7 LYS HG3 H 10.491 -12.710 1.499 1.00 . A A . 7 LYS HG3 1 1 14 3935 1 1 7 LYS HZ1 H 11.576 -16.218 3.522 1.00 . A A . 7 LYS HZ1 1 1 14 3936 1 1 7 LYS HZ2 H 13.052 -16.287 2.777 1.00 . A A . 7 LYS HZ2 1 1 14 3937 1 1 7 LYS HZ3 H 11.762 -17.096 2.138 1.00 . A A . 7 LYS HZ3 1 1 14 3938 1 1 7 LYS N N 10.546 -10.725 -0.382 1.00 . A A . 7 LYS N 1 1 14 3939 1 1 7 LYS NZ N 12.053 -16.262 2.632 1.00 . A A . 7 LYS NZ 1 1 14 3940 1 1 7 LYS O O 9.313 -13.065 -1.042 1.00 . A A . 7 LYS O 1 1 14 3941 1 1 8 TRP C C 9.878 -15.983 -1.666 1.00 . A A . 8 TRP C 1 1 14 3942 1 1 8 TRP CA C 10.502 -15.074 -2.739 1.00 . A A . 8 TRP CA 1 1 14 3943 1 1 8 TRP CB C 11.549 -15.847 -3.569 1.00 . A A . 8 TRP CB 1 1 14 3944 1 1 8 TRP CD1 C 11.263 -15.980 -6.077 1.00 . A A . 8 TRP CD1 1 1 14 3945 1 1 8 TRP CD2 C 12.468 -14.185 -5.457 1.00 . A A . 8 TRP CD2 1 1 14 3946 1 1 8 TRP CE2 C 12.357 -14.145 -6.881 1.00 . A A . 8 TRP CE2 1 1 14 3947 1 1 8 TRP CE3 C 13.208 -13.143 -4.846 1.00 . A A . 8 TRP CE3 1 1 14 3948 1 1 8 TRP CG C 11.748 -15.363 -4.974 1.00 . A A . 8 TRP CG 1 1 14 3949 1 1 8 TRP CH2 C 13.653 -12.097 -7.012 1.00 . A A . 8 TRP CH2 1 1 14 3950 1 1 8 TRP CZ2 C 12.935 -13.122 -7.654 1.00 . A A . 8 TRP CZ2 1 1 14 3951 1 1 8 TRP CZ3 C 13.790 -12.109 -5.610 1.00 . A A . 8 TRP CZ3 1 1 14 3952 1 1 8 TRP H H 12.069 -13.703 -2.400 1.00 . A A . 8 TRP H 1 1 14 3953 1 1 8 TRP HA H 9.705 -14.746 -3.411 1.00 . A A . 8 TRP HA 1 1 14 3954 1 1 8 TRP HB2 H 12.514 -15.869 -3.063 1.00 . A A . 8 TRP HB2 1 1 14 3955 1 1 8 TRP HB3 H 11.246 -16.893 -3.649 1.00 . A A . 8 TRP HB3 1 1 14 3956 1 1 8 TRP HD1 H 10.683 -16.892 -6.067 1.00 . A A . 8 TRP HD1 1 1 14 3957 1 1 8 TRP HE1 H 11.374 -15.546 -8.141 1.00 . A A . 8 TRP HE1 1 1 14 3958 1 1 8 TRP HE3 H 13.341 -13.134 -3.777 1.00 . A A . 8 TRP HE3 1 1 14 3959 1 1 8 TRP HH2 H 14.101 -11.307 -7.596 1.00 . A A . 8 TRP HH2 1 1 14 3960 1 1 8 TRP HZ2 H 12.831 -13.121 -8.729 1.00 . A A . 8 TRP HZ2 1 1 14 3961 1 1 8 TRP HZ3 H 14.346 -11.323 -5.122 1.00 . A A . 8 TRP HZ3 1 1 14 3962 1 1 8 TRP N N 11.104 -13.869 -2.165 1.00 . A A . 8 TRP N 1 1 14 3963 1 1 8 TRP NE1 N 11.619 -15.263 -7.200 1.00 . A A . 8 TRP NE1 1 1 14 3964 1 1 8 TRP O O 10.528 -16.334 -0.678 1.00 . A A . 8 TRP O 1 1 14 3965 1 1 9 THR C C 6.921 -18.056 -1.680 1.00 . A A . 9 THR C 1 1 14 3966 1 1 9 THR CA C 7.726 -16.986 -0.907 1.00 . A A . 9 THR CA 1 1 14 3967 1 1 9 THR CB C 7.001 -15.835 -0.139 1.00 . A A . 9 THR CB 1 1 14 3968 1 1 9 THR CG2 C 6.110 -14.883 -0.968 1.00 . A A . 9 THR CG2 1 1 14 3969 1 1 9 THR H H 8.158 -16.012 -2.709 1.00 . A A . 9 THR H 1 1 14 3970 1 1 9 THR HA H 8.315 -17.516 -0.159 1.00 . A A . 9 THR HA 1 1 14 3971 1 1 9 THR HB H 7.803 -15.198 0.236 1.00 . A A . 9 THR HB 1 1 14 3972 1 1 9 THR HG21 H 5.241 -15.376 -1.403 1.00 . A A . 9 THR HG21 1 1 14 3973 1 1 9 THR HG22 H 6.668 -14.438 -1.791 1.00 . A A . 9 THR HG22 1 1 14 3974 1 1 9 THR HG23 H 5.758 -14.055 -0.354 1.00 . A A . 9 THR HG23 1 1 14 3975 1 1 9 THR N N 8.613 -16.349 -1.873 1.00 . A A . 9 THR N 1 1 14 3976 1 1 9 THR O O 5.771 -17.816 -2.041 1.00 . A A . 9 THR O 1 1 14 3977 1 1 9 THR OG1 O 6.357 -16.318 1.061 1.00 . A A . 9 THR OG1 1 1 14 3978 1 1 10 PRO C C 5.985 -21.141 -2.137 1.00 . A A . 10 PRO C 1 1 14 3979 1 1 10 PRO CA C 6.916 -20.202 -2.923 1.00 . A A . 10 PRO CA 1 1 14 3980 1 1 10 PRO CB C 8.100 -20.994 -3.501 1.00 . A A . 10 PRO CB 1 1 14 3981 1 1 10 PRO CD C 8.937 -19.567 -1.758 1.00 . A A . 10 PRO CD 1 1 14 3982 1 1 10 PRO CG C 9.166 -20.930 -2.415 1.00 . A A . 10 PRO CG 1 1 14 3983 1 1 10 PRO HA H 6.359 -19.720 -3.730 1.00 . A A . 10 PRO HA 1 1 14 3984 1 1 10 PRO HB2 H 7.845 -22.018 -3.778 1.00 . A A . 10 PRO HB2 1 1 14 3985 1 1 10 PRO HB3 H 8.463 -20.497 -4.402 1.00 . A A . 10 PRO HB3 1 1 14 3986 1 1 10 PRO HD2 H 9.123 -19.616 -0.685 1.00 . A A . 10 PRO HD2 1 1 14 3987 1 1 10 PRO HD3 H 9.617 -18.837 -2.196 1.00 . A A . 10 PRO HD3 1 1 14 3988 1 1 10 PRO HG2 H 8.995 -21.724 -1.687 1.00 . A A . 10 PRO HG2 1 1 14 3989 1 1 10 PRO HG3 H 10.178 -21.049 -2.805 1.00 . A A . 10 PRO HG3 1 1 14 3990 1 1 10 PRO N N 7.545 -19.200 -2.054 1.00 . A A . 10 PRO N 1 1 14 3991 1 1 10 PRO O O 6.310 -21.574 -1.029 1.00 . A A . 10 PRO O 1 1 14 3992 1 1 11 TRP C C 4.568 -23.927 -2.501 1.00 . A A . 11 TRP C 1 1 14 3993 1 1 11 TRP CA C 3.949 -22.543 -2.241 1.00 . A A . 11 TRP CA 1 1 14 3994 1 1 11 TRP CB C 2.574 -22.396 -2.935 1.00 . A A . 11 TRP CB 1 1 14 3995 1 1 11 TRP CD1 C 1.160 -20.541 -1.934 1.00 . A A . 11 TRP CD1 1 1 14 3996 1 1 11 TRP CD2 C 0.659 -22.568 -1.100 1.00 . A A . 11 TRP CD2 1 1 14 3997 1 1 11 TRP CE2 C -0.197 -21.629 -0.448 1.00 . A A . 11 TRP CE2 1 1 14 3998 1 1 11 TRP CE3 C 0.518 -23.928 -0.735 1.00 . A A . 11 TRP CE3 1 1 14 3999 1 1 11 TRP CG C 1.510 -21.843 -2.038 1.00 . A A . 11 TRP CG 1 1 14 4000 1 1 11 TRP CH2 C -1.260 -23.381 0.850 1.00 . A A . 11 TRP CH2 1 1 14 4001 1 1 11 TRP CZ2 C -1.145 -22.020 0.513 1.00 . A A . 11 TRP CZ2 1 1 14 4002 1 1 11 TRP CZ3 C -0.429 -24.333 0.227 1.00 . A A . 11 TRP CZ3 1 1 14 4003 1 1 11 TRP H H 4.663 -21.148 -3.666 1.00 . A A . 11 TRP H 1 1 14 4004 1 1 11 TRP HA H 3.819 -22.413 -1.162 1.00 . A A . 11 TRP HA 1 1 14 4005 1 1 11 TRP HB2 H 2.643 -21.769 -3.824 1.00 . A A . 11 TRP HB2 1 1 14 4006 1 1 11 TRP HB3 H 2.193 -23.354 -3.295 1.00 . A A . 11 TRP HB3 1 1 14 4007 1 1 11 TRP HD1 H 1.607 -19.738 -2.502 1.00 . A A . 11 TRP HD1 1 1 14 4008 1 1 11 TRP HE1 H -0.273 -19.523 -0.765 1.00 . A A . 11 TRP HE1 1 1 14 4009 1 1 11 TRP HE3 H 1.142 -24.669 -1.210 1.00 . A A . 11 TRP HE3 1 1 14 4010 1 1 11 TRP HH2 H -1.989 -23.696 1.582 1.00 . A A . 11 TRP HH2 1 1 14 4011 1 1 11 TRP HZ2 H -1.783 -21.288 0.985 1.00 . A A . 11 TRP HZ2 1 1 14 4012 1 1 11 TRP HZ3 H -0.525 -25.377 0.485 1.00 . A A . 11 TRP HZ3 1 1 14 4013 1 1 11 TRP N N 4.861 -21.524 -2.751 1.00 . A A . 11 TRP N 1 1 14 4014 1 1 11 TRP NE1 N 0.159 -20.411 -0.990 1.00 . A A . 11 TRP NE1 1 1 14 4015 1 1 11 TRP O O 4.469 -24.491 -3.592 1.00 . A A . 11 TRP O 1 1 14 4016 1 1 12 ARG C C 5.015 -26.912 -1.432 1.00 . A A . 12 ARG C 1 1 14 4017 1 1 12 ARG CA C 6.004 -25.724 -1.514 1.00 . A A . 12 ARG CA 1 1 14 4018 1 1 12 ARG CB C 7.001 -25.678 -0.322 1.00 . A A . 12 ARG CB 1 1 14 4019 1 1 12 ARG CD C 7.758 -28.018 0.585 1.00 . A A . 12 ARG CD 1 1 14 4020 1 1 12 ARG CG C 8.095 -26.774 -0.269 1.00 . A A . 12 ARG CG 1 1 14 4021 1 1 12 ARG CZ C 9.724 -29.519 1.179 1.00 . A A . 12 ARG CZ 1 1 14 4022 1 1 12 ARG H H 5.340 -23.888 -0.664 1.00 . A A . 12 ARG H 1 1 14 4023 1 1 12 ARG HA H 6.564 -25.788 -2.450 1.00 . A A . 12 ARG HA 1 1 14 4024 1 1 12 ARG HB2 H 7.527 -24.723 -0.389 1.00 . A A . 12 ARG HB2 1 1 14 4025 1 1 12 ARG HB3 H 6.464 -25.628 0.627 1.00 . A A . 12 ARG HB3 1 1 14 4026 1 1 12 ARG HD2 H 6.973 -27.774 1.301 1.00 . A A . 12 ARG HD2 1 1 14 4027 1 1 12 ARG HD3 H 7.351 -28.821 -0.030 1.00 . A A . 12 ARG HD3 1 1 14 4028 1 1 12 ARG HE H 9.039 -27.906 2.222 1.00 . A A . 12 ARG HE 1 1 14 4029 1 1 12 ARG HG2 H 8.357 -27.076 -1.283 1.00 . A A . 12 ARG HG2 1 1 14 4030 1 1 12 ARG HG3 H 9.000 -26.309 0.127 1.00 . A A . 12 ARG HG3 1 1 14 4031 1 1 12 ARG HH11 H 8.848 -30.097 -0.567 1.00 . A A . 12 ARG HH11 1 1 14 4032 1 1 12 ARG HH12 H 10.160 -31.101 -0.082 1.00 . A A . 12 ARG HH12 1 1 14 4033 1 1 12 ARG HH21 H 10.851 -29.214 2.875 1.00 . A A . 12 ARG HH21 1 1 14 4034 1 1 12 ARG HH22 H 11.329 -30.570 1.953 1.00 . A A . 12 ARG HH22 1 1 14 4035 1 1 12 ARG N N 5.260 -24.465 -1.490 1.00 . A A . 12 ARG N 1 1 14 4036 1 1 12 ARG NE N 8.916 -28.468 1.387 1.00 . A A . 12 ARG NE 1 1 14 4037 1 1 12 ARG NH1 N 9.572 -30.300 0.106 1.00 . A A . 12 ARG NH1 1 1 14 4038 1 1 12 ARG NH2 N 10.697 -29.785 2.055 1.00 . A A . 12 ARG NH2 1 1 14 4039 1 1 12 ARG O O 4.939 -27.576 -0.402 1.00 . A A . 12 ARG O 1 1 14 4040 1 1 13 ARG C C 2.780 -29.288 -2.131 1.00 . A A . 13 ARG C 1 1 14 4041 1 1 13 ARG CA C 3.094 -27.958 -2.861 1.00 . A A . 13 ARG CA 1 1 14 4042 1 1 13 ARG CB C 2.921 -28.011 -4.401 1.00 . A A . 13 ARG CB 1 1 14 4043 1 1 13 ARG CD C 3.558 -30.385 -5.254 1.00 . A A . 13 ARG CD 1 1 14 4044 1 1 13 ARG CG C 3.923 -28.885 -5.197 1.00 . A A . 13 ARG CG 1 1 14 4045 1 1 13 ARG CZ C 3.684 -32.183 -7.011 1.00 . A A . 13 ARG CZ 1 1 14 4046 1 1 13 ARG H H 4.402 -26.362 -3.196 1.00 . A A . 13 ARG H 1 1 14 4047 1 1 13 ARG HA H 2.264 -27.334 -2.523 1.00 . A A . 13 ARG HA 1 1 14 4048 1 1 13 ARG HB2 H 1.904 -28.324 -4.642 1.00 . A A . 13 ARG HB2 1 1 14 4049 1 1 13 ARG HB3 H 2.980 -26.990 -4.783 1.00 . A A . 13 ARG HB3 1 1 14 4050 1 1 13 ARG HD2 H 3.867 -30.898 -4.342 1.00 . A A . 13 ARG HD2 1 1 14 4051 1 1 13 ARG HD3 H 2.473 -30.476 -5.323 1.00 . A A . 13 ARG HD3 1 1 14 4052 1 1 13 ARG HE H 5.025 -30.662 -6.731 1.00 . A A . 13 ARG HE 1 1 14 4053 1 1 13 ARG HG2 H 3.966 -28.495 -6.215 1.00 . A A . 13 ARG HG2 1 1 14 4054 1 1 13 ARG HG3 H 4.925 -28.754 -4.787 1.00 . A A . 13 ARG HG3 1 1 14 4055 1 1 13 ARG HH11 H 2.049 -32.385 -5.796 1.00 . A A . 13 ARG HH11 1 1 14 4056 1 1 13 ARG HH12 H 2.159 -33.591 -7.011 1.00 . A A . 13 ARG HH12 1 1 14 4057 1 1 13 ARG HH21 H 5.191 -32.302 -8.414 1.00 . A A . 13 ARG HH21 1 1 14 4058 1 1 13 ARG HH22 H 4.018 -33.542 -8.524 1.00 . A A . 13 ARG HH22 1 1 14 4059 1 1 13 ARG N N 4.256 -27.111 -2.521 1.00 . A A . 13 ARG N 1 1 14 4060 1 1 13 ARG NE N 4.157 -31.075 -6.415 1.00 . A A . 13 ARG NE 1 1 14 4061 1 1 13 ARG NH1 N 2.563 -32.768 -6.580 1.00 . A A . 13 ARG NH1 1 1 14 4062 1 1 13 ARG NH2 N 4.344 -32.711 -8.044 1.00 . A A . 13 ARG NH2 1 1 14 4063 1 1 13 ARG O O 2.088 -30.140 -2.678 1.00 . A A . 13 ARG O 1 1 14 4064 1 1 14 NH2 HN1 H 2.982 -30.346 -0.423 1.00 . A A . 14 NH2 HN1 1 1 14 4065 1 1 14 NH2 HN2 H 3.845 -28.796 -0.491 1.00 . A A . 14 NH2 HN2 1 1 14 4066 1 1 14 NH2 N N 3.261 -29.518 -0.924 1.00 . A A . 14 NH2 N 1 1 14 4067 2 2 1 . C1 C 4.986 -16.671 1.026 1.00 . B A . 101 BGC C1 1 1 14 4068 2 2 1 . C2 C 4.637 -17.476 2.290 1.00 . B A . 101 BGC C2 1 1 14 4069 2 2 1 . C3 C 3.151 -17.869 2.256 1.00 . B A . 101 BGC C3 1 1 14 4070 2 2 1 . C4 C 2.281 -16.616 2.080 1.00 . B A . 101 BGC C4 1 1 14 4071 2 2 1 . C5 C 2.735 -15.862 0.810 1.00 . B A . 101 BGC C5 1 1 14 4072 2 2 1 . C6 C 2.024 -14.524 0.592 1.00 . B A . 101 BGC C6 1 1 14 4073 2 2 1 . H1 H 4.817 -17.264 0.120 1.00 . B A . 101 BGC H1 1 1 14 4074 2 2 1 . H2 H 4.836 -16.852 3.164 1.00 . B A . 101 BGC H2 1 1 14 4075 2 2 1 . H3 H 2.985 -18.539 1.407 1.00 . B A . 101 BGC H3 1 1 14 4076 2 2 1 . H4 H 2.423 -15.955 2.938 1.00 . B A . 101 BGC H4 1 1 14 4077 2 2 1 . H5 H 2.601 -16.484 -0.078 1.00 . B A . 101 BGC H5 1 1 14 4078 2 2 1 . H6 H 3.648 -13.901 -0.240 1.00 . B A . 101 BGC H6 1 1 14 4079 2 2 1 . H6C1 H 2.031 -13.935 1.508 1.00 . B A . 101 BGC H6C1 1 1 14 4080 2 2 1 . H6C2 H 0.979 -14.673 0.310 1.00 . B A . 101 BGC H6C2 1 1 14 4081 2 2 1 . HB H 5.067 -19.156 3.111 1.00 . B A . 101 BGC HB 1 1 14 4082 2 2 1 . HC H 1.911 -18.932 3.321 1.00 . B A . 101 BGC HC 1 1 14 4083 2 2 1 . HD H 0.569 -17.084 2.918 1.00 . B A . 101 BGC HD 1 1 14 4084 2 2 1 . O2 O 5.437 -18.650 2.370 1.00 . B A . 101 BGC O2 1 1 14 4085 2 2 1 . O3 O 2.798 -18.562 3.452 1.00 . B A . 101 BGC O3 1 1 14 4086 2 2 1 . O4 O 0.902 -16.981 2.014 1.00 . B A . 101 BGC O4 1 1 14 4087 2 2 1 . O5 O 4.131 -15.550 0.960 1.00 . B A . 101 BGC O5 1 1 14 4088 2 2 1 . O6 O 2.701 -13.795 -0.422 1.00 . B A . 101 BGC O6 1 1 15 4089 1 1 1 ILE C C 2.522 0.566 -2.340 1.00 . A A . 1 ILE C 1 1 15 4090 1 1 1 ILE CA C 1.122 0.777 -2.934 1.00 . A A . 1 ILE CA 1 1 15 4091 1 1 1 ILE CB C 0.616 -0.439 -3.762 1.00 . A A . 1 ILE CB 1 1 15 4092 1 1 1 ILE CD1 C 1.219 -2.152 -5.595 1.00 . A A . 1 ILE CD1 1 1 15 4093 1 1 1 ILE CG1 C 1.488 -0.762 -5.002 1.00 . A A . 1 ILE CG1 1 1 15 4094 1 1 1 ILE CG2 C -0.868 -0.265 -4.147 1.00 . A A . 1 ILE CG2 1 1 15 4095 1 1 1 ILE H1 H 0.238 2.238 -4.113 1.00 . A A . 1 ILE H1 1 1 15 4096 1 1 1 ILE HA H 0.446 0.952 -2.095 1.00 . A A . 1 ILE HA 1 1 15 4097 1 1 1 ILE HB H 0.661 -1.311 -3.105 1.00 . A A . 1 ILE HB 1 1 15 4098 1 1 1 ILE HD11 H 1.376 -2.937 -4.855 1.00 . A A . 1 ILE HD11 1 1 15 4099 1 1 1 ILE HD12 H 0.205 -2.248 -5.982 1.00 . A A . 1 ILE HD12 1 1 15 4100 1 1 1 ILE HD13 H 1.898 -2.354 -6.426 1.00 . A A . 1 ILE HD13 1 1 15 4101 1 1 1 ILE HG12 H 1.349 -0.013 -5.782 1.00 . A A . 1 ILE HG12 1 1 15 4102 1 1 1 ILE HG13 H 2.549 -0.737 -4.745 1.00 . A A . 1 ILE HG13 1 1 15 4103 1 1 1 ILE HG21 H -1.484 -0.026 -3.278 1.00 . A A . 1 ILE HG21 1 1 15 4104 1 1 1 ILE HG22 H -1.017 0.518 -4.890 1.00 . A A . 1 ILE HG22 1 1 15 4105 1 1 1 ILE HG23 H -1.278 -1.185 -4.568 1.00 . A A . 1 ILE HG23 1 1 15 4106 1 1 1 ILE N N 1.150 2.001 -3.755 1.00 . A A . 1 ILE N 1 1 15 4107 1 1 1 ILE O O 3.414 1.352 -2.653 1.00 . A A . 1 ILE O 1 1 15 4108 1 1 2 LEU C C 4.698 -1.805 -2.056 1.00 . A A . 2 LEU C 1 1 15 4109 1 1 2 LEU CA C 4.037 -0.870 -1.015 1.00 . A A . 2 LEU CA 1 1 15 4110 1 1 2 LEU CB C 3.861 -1.687 0.292 1.00 . A A . 2 LEU CB 1 1 15 4111 1 1 2 LEU CD1 C 2.190 -0.284 1.659 1.00 . A A . 2 LEU CD1 1 1 15 4112 1 1 2 LEU CD2 C 3.928 -1.680 2.827 1.00 . A A . 2 LEU CD2 1 1 15 4113 1 1 2 LEU CG C 3.616 -0.851 1.569 1.00 . A A . 2 LEU CG 1 1 15 4114 1 1 2 LEU H H 1.972 -1.120 -1.352 1.00 . A A . 2 LEU H 1 1 15 4115 1 1 2 LEU HA H 4.658 0.009 -0.835 1.00 . A A . 2 LEU HA 1 1 15 4116 1 1 2 LEU HB2 H 3.081 -2.441 0.174 1.00 . A A . 2 LEU HB2 1 1 15 4117 1 1 2 LEU HB3 H 4.775 -2.259 0.459 1.00 . A A . 2 LEU HB3 1 1 15 4118 1 1 2 LEU HD11 H 1.439 -1.072 1.606 1.00 . A A . 2 LEU HD11 1 1 15 4119 1 1 2 LEU HD12 H 1.987 0.437 0.869 1.00 . A A . 2 LEU HD12 1 1 15 4120 1 1 2 LEU HD13 H 2.041 0.243 2.603 1.00 . A A . 2 LEU HD13 1 1 15 4121 1 1 2 LEU HD21 H 3.779 -1.086 3.732 1.00 . A A . 2 LEU HD21 1 1 15 4122 1 1 2 LEU HD22 H 4.963 -2.020 2.839 1.00 . A A . 2 LEU HD22 1 1 15 4123 1 1 2 LEU HD23 H 3.280 -2.555 2.902 1.00 . A A . 2 LEU HD23 1 1 15 4124 1 1 2 LEU HG H 4.310 -0.008 1.568 1.00 . A A . 2 LEU HG 1 1 15 4125 1 1 2 LEU N N 2.721 -0.462 -1.510 1.00 . A A . 2 LEU N 1 1 15 4126 1 1 2 LEU O O 3.970 -2.473 -2.794 1.00 . A A . 2 LEU O 1 1 15 4127 1 1 3 PRO C C 6.759 -4.267 -2.444 1.00 . A A . 3 PRO C 1 1 15 4128 1 1 3 PRO CA C 6.772 -2.820 -2.983 1.00 . A A . 3 PRO CA 1 1 15 4129 1 1 3 PRO CB C 8.199 -2.243 -3.020 1.00 . A A . 3 PRO CB 1 1 15 4130 1 1 3 PRO CD C 6.981 -1.069 -1.323 1.00 . A A . 3 PRO CD 1 1 15 4131 1 1 3 PRO CG C 8.380 -1.580 -1.665 1.00 . A A . 3 PRO CG 1 1 15 4132 1 1 3 PRO HA H 6.340 -2.815 -3.985 1.00 . A A . 3 PRO HA 1 1 15 4133 1 1 3 PRO HB2 H 8.981 -2.973 -3.226 1.00 . A A . 3 PRO HB2 1 1 15 4134 1 1 3 PRO HB3 H 8.261 -1.487 -3.804 1.00 . A A . 3 PRO HB3 1 1 15 4135 1 1 3 PRO HD2 H 6.795 -1.120 -0.250 1.00 . A A . 3 PRO HD2 1 1 15 4136 1 1 3 PRO HD3 H 6.881 -0.027 -1.633 1.00 . A A . 3 PRO HD3 1 1 15 4137 1 1 3 PRO HG2 H 8.699 -2.324 -0.934 1.00 . A A . 3 PRO HG2 1 1 15 4138 1 1 3 PRO HG3 H 9.130 -0.789 -1.678 1.00 . A A . 3 PRO HG3 1 1 15 4139 1 1 3 PRO N N 6.047 -1.893 -2.100 1.00 . A A . 3 PRO N 1 1 15 4140 1 1 3 PRO O O 6.151 -4.557 -1.406 1.00 . A A . 3 PRO O 1 1 15 4141 1 1 4 TRP C C 8.120 -6.933 -1.433 1.00 . A A . 4 TRP C 1 1 15 4142 1 1 4 TRP CA C 7.648 -6.599 -2.866 1.00 . A A . 4 TRP CA 1 1 15 4143 1 1 4 TRP CB C 8.578 -7.227 -3.931 1.00 . A A . 4 TRP CB 1 1 15 4144 1 1 4 TRP CD1 C 10.693 -5.814 -3.779 1.00 . A A . 4 TRP CD1 1 1 15 4145 1 1 4 TRP CD2 C 11.112 -8.017 -3.647 1.00 . A A . 4 TRP CD2 1 1 15 4146 1 1 4 TRP CE2 C 12.370 -7.347 -3.558 1.00 . A A . 4 TRP CE2 1 1 15 4147 1 1 4 TRP CE3 C 11.139 -9.433 -3.600 1.00 . A A . 4 TRP CE3 1 1 15 4148 1 1 4 TRP CG C 10.060 -7.012 -3.789 1.00 . A A . 4 TRP CG 1 1 15 4149 1 1 4 TRP CH2 C 13.577 -9.446 -3.402 1.00 . A A . 4 TRP CH2 1 1 15 4150 1 1 4 TRP CZ2 C 13.586 -8.040 -3.434 1.00 . A A . 4 TRP CZ2 1 1 15 4151 1 1 4 TRP CZ3 C 12.355 -10.140 -3.485 1.00 . A A . 4 TRP CZ3 1 1 15 4152 1 1 4 TRP H H 7.946 -4.822 -3.960 1.00 . A A . 4 TRP H 1 1 15 4153 1 1 4 TRP HA H 6.659 -7.046 -2.983 1.00 . A A . 4 TRP HA 1 1 15 4154 1 1 4 TRP HB2 H 8.420 -8.306 -3.937 1.00 . A A . 4 TRP HB2 1 1 15 4155 1 1 4 TRP HB3 H 8.286 -6.901 -4.930 1.00 . A A . 4 TRP HB3 1 1 15 4156 1 1 4 TRP HD1 H 10.205 -4.859 -3.880 1.00 . A A . 4 TRP HD1 1 1 15 4157 1 1 4 TRP HE1 H 12.728 -5.258 -3.640 1.00 . A A . 4 TRP HE1 1 1 15 4158 1 1 4 TRP HE3 H 10.213 -9.987 -3.665 1.00 . A A . 4 TRP HE3 1 1 15 4159 1 1 4 TRP HH2 H 14.509 -9.988 -3.320 1.00 . A A . 4 TRP HH2 1 1 15 4160 1 1 4 TRP HZ2 H 14.522 -7.503 -3.378 1.00 . A A . 4 TRP HZ2 1 1 15 4161 1 1 4 TRP HZ3 H 12.348 -11.220 -3.469 1.00 . A A . 4 TRP HZ3 1 1 15 4162 1 1 4 TRP N N 7.462 -5.168 -3.146 1.00 . A A . 4 TRP N 1 1 15 4163 1 1 4 TRP NE1 N 12.051 -6.010 -3.630 1.00 . A A . 4 TRP NE1 1 1 15 4164 1 1 4 TRP O O 8.486 -6.053 -0.648 1.00 . A A . 4 TRP O 1 1 15 4165 1 1 5 LYS C C 9.656 -9.801 -0.255 1.00 . A A . 5 LYS C 1 1 15 4166 1 1 5 LYS CA C 8.598 -8.779 0.164 1.00 . A A . 5 LYS CA 1 1 15 4167 1 1 5 LYS CB C 7.449 -9.465 0.951 1.00 . A A . 5 LYS CB 1 1 15 4168 1 1 5 LYS CD C 6.198 -7.280 1.630 1.00 . A A . 5 LYS CD 1 1 15 4169 1 1 5 LYS CE C 7.058 -6.073 2.058 1.00 . A A . 5 LYS CE 1 1 15 4170 1 1 5 LYS CG C 6.805 -8.626 2.076 1.00 . A A . 5 LYS CG 1 1 15 4171 1 1 5 LYS H H 7.888 -8.907 -1.790 1.00 . A A . 5 LYS H 1 1 15 4172 1 1 5 LYS HA H 9.087 -8.026 0.783 1.00 . A A . 5 LYS HA 1 1 15 4173 1 1 5 LYS HB2 H 6.678 -9.816 0.262 1.00 . A A . 5 LYS HB2 1 1 15 4174 1 1 5 LYS HB3 H 7.827 -10.374 1.421 1.00 . A A . 5 LYS HB3 1 1 15 4175 1 1 5 LYS HD2 H 6.035 -7.291 0.553 1.00 . A A . 5 LYS HD2 1 1 15 4176 1 1 5 LYS HD3 H 5.204 -7.176 2.067 1.00 . A A . 5 LYS HD3 1 1 15 4177 1 1 5 LYS HE2 H 6.895 -5.851 3.114 1.00 . A A . 5 LYS HE2 1 1 15 4178 1 1 5 LYS HE3 H 8.119 -6.297 1.951 1.00 . A A . 5 LYS HE3 1 1 15 4179 1 1 5 LYS HG2 H 6.010 -9.231 2.517 1.00 . A A . 5 LYS HG2 1 1 15 4180 1 1 5 LYS HG3 H 7.526 -8.474 2.881 1.00 . A A . 5 LYS HG3 1 1 15 4181 1 1 5 LYS HZ1 H 5.796 -4.639 1.254 1.00 . A A . 5 LYS HZ1 1 1 15 4182 1 1 5 LYS HZ2 H 7.033 -5.073 0.275 1.00 . A A . 5 LYS HZ2 1 1 15 4183 1 1 5 LYS HZ3 H 7.336 -4.098 1.551 1.00 . A A . 5 LYS HZ3 1 1 15 4184 1 1 5 LYS N N 8.077 -8.217 -1.074 1.00 . A A . 5 LYS N 1 1 15 4185 1 1 5 LYS NZ N 6.775 -4.879 1.246 1.00 . A A . 5 LYS NZ 1 1 15 4186 1 1 5 LYS O O 9.345 -10.697 -1.042 1.00 . A A . 5 LYS O 1 1 15 4187 1 1 6 TRP C C 11.798 -11.669 1.281 1.00 . A A . 6 TRP C 1 1 15 4188 1 1 6 TRP CA C 11.931 -10.668 0.123 1.00 . A A . 6 TRP CA 1 1 15 4189 1 1 6 TRP CB C 13.289 -9.947 0.254 1.00 . A A . 6 TRP CB 1 1 15 4190 1 1 6 TRP CD1 C 14.730 -11.755 -0.810 1.00 . A A . 6 TRP CD1 1 1 15 4191 1 1 6 TRP CD2 C 15.731 -10.768 0.941 1.00 . A A . 6 TRP CD2 1 1 15 4192 1 1 6 TRP CE2 C 16.637 -11.753 0.445 1.00 . A A . 6 TRP CE2 1 1 15 4193 1 1 6 TRP CE3 C 16.162 -10.008 2.056 1.00 . A A . 6 TRP CE3 1 1 15 4194 1 1 6 TRP CG C 14.524 -10.792 0.119 1.00 . A A . 6 TRP CG 1 1 15 4195 1 1 6 TRP CH2 C 18.305 -11.183 2.114 1.00 . A A . 6 TRP CH2 1 1 15 4196 1 1 6 TRP CZ2 C 17.905 -11.966 1.013 1.00 . A A . 6 TRP CZ2 1 1 15 4197 1 1 6 TRP CZ3 C 17.432 -10.208 2.634 1.00 . A A . 6 TRP CZ3 1 1 15 4198 1 1 6 TRP H H 11.054 -8.934 0.927 1.00 . A A . 6 TRP H 1 1 15 4199 1 1 6 TRP HA H 11.858 -11.175 -0.840 1.00 . A A . 6 TRP HA 1 1 15 4200 1 1 6 TRP HB2 H 13.360 -9.157 -0.495 1.00 . A A . 6 TRP HB2 1 1 15 4201 1 1 6 TRP HB3 H 13.343 -9.444 1.220 1.00 . A A . 6 TRP HB3 1 1 15 4202 1 1 6 TRP HD1 H 14.030 -12.018 -1.591 1.00 . A A . 6 TRP HD1 1 1 15 4203 1 1 6 TRP HE1 H 16.352 -13.049 -1.214 1.00 . A A . 6 TRP HE1 1 1 15 4204 1 1 6 TRP HE3 H 15.512 -9.248 2.463 1.00 . A A . 6 TRP HE3 1 1 15 4205 1 1 6 TRP HH2 H 19.282 -11.326 2.553 1.00 . A A . 6 TRP HH2 1 1 15 4206 1 1 6 TRP HZ2 H 18.571 -12.714 0.607 1.00 . A A . 6 TRP HZ2 1 1 15 4207 1 1 6 TRP HZ3 H 17.744 -9.606 3.476 1.00 . A A . 6 TRP HZ3 1 1 15 4208 1 1 6 TRP N N 10.874 -9.678 0.273 1.00 . A A . 6 TRP N 1 1 15 4209 1 1 6 TRP NE1 N 15.967 -12.330 -0.613 1.00 . A A . 6 TRP NE1 1 1 15 4210 1 1 6 TRP O O 11.449 -11.295 2.406 1.00 . A A . 6 TRP O 1 1 15 4211 1 1 7 LYS C C 13.047 -15.108 1.276 1.00 . A A . 7 LYS C 1 1 15 4212 1 1 7 LYS CA C 12.260 -14.004 1.984 1.00 . A A . 7 LYS CA 1 1 15 4213 1 1 7 LYS CB C 10.889 -14.485 2.533 1.00 . A A . 7 LYS CB 1 1 15 4214 1 1 7 LYS CD C 9.672 -15.941 4.296 1.00 . A A . 7 LYS CD 1 1 15 4215 1 1 7 LYS CE C 8.542 -14.977 4.686 1.00 . A A . 7 LYS CE 1 1 15 4216 1 1 7 LYS CG C 10.993 -15.283 3.848 1.00 . A A . 7 LYS CG 1 1 15 4217 1 1 7 LYS H H 12.376 -13.189 0.073 1.00 . A A . 7 LYS H 1 1 15 4218 1 1 7 LYS HA H 12.867 -13.605 2.800 1.00 . A A . 7 LYS HA 1 1 15 4219 1 1 7 LYS HB2 H 10.242 -13.624 2.696 1.00 . A A . 7 LYS HB2 1 1 15 4220 1 1 7 LYS HB3 H 10.394 -15.087 1.769 1.00 . A A . 7 LYS HB3 1 1 15 4221 1 1 7 LYS HD2 H 9.306 -16.579 3.491 1.00 . A A . 7 LYS HD2 1 1 15 4222 1 1 7 LYS HD3 H 9.871 -16.621 5.126 1.00 . A A . 7 LYS HD3 1 1 15 4223 1 1 7 LYS HE2 H 8.307 -14.297 3.867 1.00 . A A . 7 LYS HE2 1 1 15 4224 1 1 7 LYS HE3 H 7.634 -15.550 4.885 1.00 . A A . 7 LYS HE3 1 1 15 4225 1 1 7 LYS HG2 H 11.725 -16.080 3.713 1.00 . A A . 7 LYS HG2 1 1 15 4226 1 1 7 LYS HG3 H 11.398 -14.647 4.635 1.00 . A A . 7 LYS HG3 1 1 15 4227 1 1 7 LYS HZ1 H 9.059 -14.837 6.662 1.00 . A A . 7 LYS HZ1 1 1 15 4228 1 1 7 LYS HZ2 H 8.089 -13.614 6.141 1.00 . A A . 7 LYS HZ2 1 1 15 4229 1 1 7 LYS HZ3 H 9.685 -13.631 5.729 1.00 . A A . 7 LYS HZ3 1 1 15 4230 1 1 7 LYS N N 12.091 -12.940 1.012 1.00 . A A . 7 LYS N 1 1 15 4231 1 1 7 LYS NZ N 8.871 -14.204 5.896 1.00 . A A . 7 LYS NZ 1 1 15 4232 1 1 7 LYS O O 12.781 -15.382 0.108 1.00 . A A . 7 LYS O 1 1 15 4233 1 1 8 TRP C C 13.948 -18.220 1.301 1.00 . A A . 8 TRP C 1 1 15 4234 1 1 8 TRP CA C 14.767 -16.915 1.499 1.00 . A A . 8 TRP CA 1 1 15 4235 1 1 8 TRP CB C 15.903 -17.158 2.528 1.00 . A A . 8 TRP CB 1 1 15 4236 1 1 8 TRP CD1 C 17.675 -18.520 1.321 1.00 . A A . 8 TRP CD1 1 1 15 4237 1 1 8 TRP CD2 C 18.431 -16.509 1.978 1.00 . A A . 8 TRP CD2 1 1 15 4238 1 1 8 TRP CE2 C 19.518 -17.171 1.327 1.00 . A A . 8 TRP CE2 1 1 15 4239 1 1 8 TRP CE3 C 18.687 -15.214 2.491 1.00 . A A . 8 TRP CE3 1 1 15 4240 1 1 8 TRP CG C 17.268 -17.395 1.953 1.00 . A A . 8 TRP CG 1 1 15 4241 1 1 8 TRP CH2 C 21.007 -15.296 1.719 1.00 . A A . 8 TRP CH2 1 1 15 4242 1 1 8 TRP CZ2 C 20.787 -16.581 1.192 1.00 . A A . 8 TRP CZ2 1 1 15 4243 1 1 8 TRP CZ3 C 19.960 -14.617 2.371 1.00 . A A . 8 TRP CZ3 1 1 15 4244 1 1 8 TRP H H 14.138 -15.488 2.932 1.00 . A A . 8 TRP H 1 1 15 4245 1 1 8 TRP HA H 15.196 -16.631 0.535 1.00 . A A . 8 TRP HA 1 1 15 4246 1 1 8 TRP HB2 H 16.007 -16.305 3.199 1.00 . A A . 8 TRP HB2 1 1 15 4247 1 1 8 TRP HB3 H 15.667 -18.001 3.182 1.00 . A A . 8 TRP HB3 1 1 15 4248 1 1 8 TRP HD1 H 17.050 -19.387 1.149 1.00 . A A . 8 TRP HD1 1 1 15 4249 1 1 8 TRP HE1 H 19.498 -19.113 0.455 1.00 . A A . 8 TRP HE1 1 1 15 4250 1 1 8 TRP HE3 H 17.898 -14.675 2.991 1.00 . A A . 8 TRP HE3 1 1 15 4251 1 1 8 TRP HH2 H 21.981 -14.836 1.630 1.00 . A A . 8 TRP HH2 1 1 15 4252 1 1 8 TRP HZ2 H 21.588 -17.108 0.694 1.00 . A A . 8 TRP HZ2 1 1 15 4253 1 1 8 TRP HZ3 H 20.135 -13.633 2.781 1.00 . A A . 8 TRP HZ3 1 1 15 4254 1 1 8 TRP N N 13.947 -15.795 1.991 1.00 . A A . 8 TRP N 1 1 15 4255 1 1 8 TRP NE1 N 18.994 -18.385 0.943 1.00 . A A . 8 TRP NE1 1 1 15 4256 1 1 8 TRP O O 14.504 -19.284 1.065 1.00 . A A . 8 TRP O 1 1 15 4257 1 1 9 THR C C 10.382 -18.517 0.717 1.00 . A A . 9 THR C 1 1 15 4258 1 1 9 THR CA C 11.642 -19.207 1.290 1.00 . A A . 9 THR CA 1 1 15 4259 1 1 9 THR CB C 11.579 -19.989 2.638 1.00 . A A . 9 THR CB 1 1 15 4260 1 1 9 THR CG2 C 11.230 -19.186 3.909 1.00 . A A . 9 THR CG2 1 1 15 4261 1 1 9 THR H H 12.252 -17.206 1.505 1.00 . A A . 9 THR H 1 1 15 4262 1 1 9 THR HA H 11.998 -19.925 0.550 1.00 . A A . 9 THR HA 1 1 15 4263 1 1 9 THR HB H 12.598 -20.341 2.806 1.00 . A A . 9 THR HB 1 1 15 4264 1 1 9 THR HG21 H 11.928 -18.365 4.056 1.00 . A A . 9 THR HG21 1 1 15 4265 1 1 9 THR HG22 H 11.308 -19.820 4.792 1.00 . A A . 9 THR HG22 1 1 15 4266 1 1 9 THR HG23 H 10.226 -18.771 3.877 1.00 . A A . 9 THR HG23 1 1 15 4267 1 1 9 THR N N 12.621 -18.139 1.425 1.00 . A A . 9 THR N 1 1 15 4268 1 1 9 THR O O 9.504 -18.109 1.485 1.00 . A A . 9 THR O 1 1 15 4269 1 1 9 THR OG1 O 10.805 -21.205 2.519 1.00 . A A . 9 THR OG1 1 1 15 4270 1 1 10 PRO C C 7.982 -18.245 -1.458 1.00 . A A . 10 PRO C 1 1 15 4271 1 1 10 PRO CA C 9.265 -17.425 -1.219 1.00 . A A . 10 PRO CA 1 1 15 4272 1 1 10 PRO CB C 9.897 -16.922 -2.528 1.00 . A A . 10 PRO CB 1 1 15 4273 1 1 10 PRO CD C 11.353 -18.584 -1.597 1.00 . A A . 10 PRO CD 1 1 15 4274 1 1 10 PRO CG C 10.861 -18.029 -2.933 1.00 . A A . 10 PRO CG 1 1 15 4275 1 1 10 PRO HA H 9.019 -16.567 -0.591 1.00 . A A . 10 PRO HA 1 1 15 4276 1 1 10 PRO HB2 H 9.173 -16.689 -3.310 1.00 . A A . 10 PRO HB2 1 1 15 4277 1 1 10 PRO HB3 H 10.461 -16.011 -2.331 1.00 . A A . 10 PRO HB3 1 1 15 4278 1 1 10 PRO HD2 H 11.517 -19.661 -1.662 1.00 . A A . 10 PRO HD2 1 1 15 4279 1 1 10 PRO HD3 H 12.299 -18.110 -1.326 1.00 . A A . 10 PRO HD3 1 1 15 4280 1 1 10 PRO HG2 H 10.323 -18.805 -3.479 1.00 . A A . 10 PRO HG2 1 1 15 4281 1 1 10 PRO HG3 H 11.673 -17.677 -3.568 1.00 . A A . 10 PRO HG3 1 1 15 4282 1 1 10 PRO N N 10.325 -18.240 -0.606 1.00 . A A . 10 PRO N 1 1 15 4283 1 1 10 PRO O O 7.696 -18.682 -2.575 1.00 . A A . 10 PRO O 1 1 15 4284 1 1 11 TRP C C 4.885 -18.279 -1.230 1.00 . A A . 11 TRP C 1 1 15 4285 1 1 11 TRP CA C 5.900 -19.136 -0.455 1.00 . A A . 11 TRP CA 1 1 15 4286 1 1 11 TRP CB C 5.384 -19.394 0.971 1.00 . A A . 11 TRP CB 1 1 15 4287 1 1 11 TRP CD1 C 4.061 -21.560 0.943 1.00 . A A . 11 TRP CD1 1 1 15 4288 1 1 11 TRP CD2 C 2.750 -19.758 1.225 1.00 . A A . 11 TRP CD2 1 1 15 4289 1 1 11 TRP CE2 C 1.893 -20.900 1.227 1.00 . A A . 11 TRP CE2 1 1 15 4290 1 1 11 TRP CE3 C 2.133 -18.495 1.389 1.00 . A A . 11 TRP CE3 1 1 15 4291 1 1 11 TRP CG C 4.128 -20.214 1.047 1.00 . A A . 11 TRP CG 1 1 15 4292 1 1 11 TRP CH2 C -0.077 -19.527 1.575 1.00 . A A . 11 TRP CH2 1 1 15 4293 1 1 11 TRP CZ2 C 0.501 -20.798 1.395 1.00 . A A . 11 TRP CZ2 1 1 15 4294 1 1 11 TRP CZ3 C 0.739 -18.378 1.572 1.00 . A A . 11 TRP CZ3 1 1 15 4295 1 1 11 TRP H H 7.494 -18.077 0.490 1.00 . A A . 11 TRP H 1 1 15 4296 1 1 11 TRP HA H 6.044 -20.096 -0.956 1.00 . A A . 11 TRP HA 1 1 15 4297 1 1 11 TRP HB2 H 6.152 -19.915 1.540 1.00 . A A . 11 TRP HB2 1 1 15 4298 1 1 11 TRP HB3 H 5.212 -18.455 1.498 1.00 . A A . 11 TRP HB3 1 1 15 4299 1 1 11 TRP HD1 H 4.911 -22.212 0.794 1.00 . A A . 11 TRP HD1 1 1 15 4300 1 1 11 TRP HE1 H 2.467 -22.938 0.998 1.00 . A A . 11 TRP HE1 1 1 15 4301 1 1 11 TRP HE3 H 2.751 -17.609 1.390 1.00 . A A . 11 TRP HE3 1 1 15 4302 1 1 11 TRP HH2 H -1.141 -19.440 1.729 1.00 . A A . 11 TRP HH2 1 1 15 4303 1 1 11 TRP HZ2 H -0.114 -21.684 1.403 1.00 . A A . 11 TRP HZ2 1 1 15 4304 1 1 11 TRP HZ3 H 0.297 -17.406 1.723 1.00 . A A . 11 TRP HZ3 1 1 15 4305 1 1 11 TRP N N 7.187 -18.448 -0.397 1.00 . A A . 11 TRP N 1 1 15 4306 1 1 11 TRP NE1 N 2.747 -21.966 1.043 1.00 . A A . 11 TRP NE1 1 1 15 4307 1 1 11 TRP O O 4.622 -17.129 -0.872 1.00 . A A . 11 TRP O 1 1 15 4308 1 1 12 ARG C C 1.956 -18.796 -2.669 1.00 . A A . 12 ARG C 1 1 15 4309 1 1 12 ARG CA C 3.310 -18.249 -3.137 1.00 . A A . 12 ARG CA 1 1 15 4310 1 1 12 ARG CB C 3.535 -18.712 -4.594 1.00 . A A . 12 ARG CB 1 1 15 4311 1 1 12 ARG CD C 5.182 -18.775 -6.575 1.00 . A A . 12 ARG CD 1 1 15 4312 1 1 12 ARG CG C 4.815 -18.131 -5.228 1.00 . A A . 12 ARG CG 1 1 15 4313 1 1 12 ARG CZ C 4.099 -18.200 -8.797 1.00 . A A . 12 ARG CZ 1 1 15 4314 1 1 12 ARG H H 4.531 -19.829 -2.455 1.00 . A A . 12 ARG H 1 1 15 4315 1 1 12 ARG HA H 3.327 -17.158 -3.077 1.00 . A A . 12 ARG HA 1 1 15 4316 1 1 12 ARG HB2 H 3.572 -19.803 -4.629 1.00 . A A . 12 ARG HB2 1 1 15 4317 1 1 12 ARG HB3 H 2.673 -18.420 -5.194 1.00 . A A . 12 ARG HB3 1 1 15 4318 1 1 12 ARG HD2 H 6.088 -18.310 -6.959 1.00 . A A . 12 ARG HD2 1 1 15 4319 1 1 12 ARG HD3 H 5.427 -19.827 -6.422 1.00 . A A . 12 ARG HD3 1 1 15 4320 1 1 12 ARG HE H 3.234 -19.149 -7.208 1.00 . A A . 12 ARG HE 1 1 15 4321 1 1 12 ARG HG2 H 4.715 -17.050 -5.340 1.00 . A A . 12 ARG HG2 1 1 15 4322 1 1 12 ARG HG3 H 5.657 -18.277 -4.550 1.00 . A A . 12 ARG HG3 1 1 15 4323 1 1 12 ARG HH11 H 6.046 -17.576 -8.729 1.00 . A A . 12 ARG HH11 1 1 15 4324 1 1 12 ARG HH12 H 5.274 -17.278 -10.234 1.00 . A A . 12 ARG HH12 1 1 15 4325 1 1 12 ARG HH21 H 2.151 -18.714 -9.225 1.00 . A A . 12 ARG HH21 1 1 15 4326 1 1 12 ARG HH22 H 2.975 -17.936 -10.508 1.00 . A A . 12 ARG HH22 1 1 15 4327 1 1 12 ARG N N 4.334 -18.850 -2.301 1.00 . A A . 12 ARG N 1 1 15 4328 1 1 12 ARG NE N 4.072 -18.691 -7.548 1.00 . A A . 12 ARG NE 1 1 15 4329 1 1 12 ARG NH1 N 5.206 -17.636 -9.288 1.00 . A A . 12 ARG NH1 1 1 15 4330 1 1 12 ARG NH2 N 3.003 -18.278 -9.555 1.00 . A A . 12 ARG NH2 1 1 15 4331 1 1 12 ARG O O 1.772 -20.011 -2.616 1.00 . A A . 12 ARG O 1 1 15 4332 1 1 13 ARG C C -1.083 -18.737 -3.326 1.00 . A A . 13 ARG C 1 1 15 4333 1 1 13 ARG CA C -0.369 -18.257 -2.047 1.00 . A A . 13 ARG CA 1 1 15 4334 1 1 13 ARG CB C -1.080 -17.020 -1.433 1.00 . A A . 13 ARG CB 1 1 15 4335 1 1 13 ARG CD C -1.943 -14.606 -1.672 1.00 . A A . 13 ARG CD 1 1 15 4336 1 1 13 ARG CG C -1.344 -15.829 -2.383 1.00 . A A . 13 ARG CG 1 1 15 4337 1 1 13 ARG CZ C -3.058 -12.459 -2.376 1.00 . A A . 13 ARG CZ 1 1 15 4338 1 1 13 ARG H H 1.241 -16.927 -2.454 1.00 . A A . 13 ARG H 1 1 15 4339 1 1 13 ARG HA H -0.350 -19.064 -1.310 1.00 . A A . 13 ARG HA 1 1 15 4340 1 1 13 ARG HB2 H -2.034 -17.353 -1.021 1.00 . A A . 13 ARG HB2 1 1 15 4341 1 1 13 ARG HB3 H -0.498 -16.679 -0.578 1.00 . A A . 13 ARG HB3 1 1 15 4342 1 1 13 ARG HD2 H -2.789 -14.918 -1.058 1.00 . A A . 13 ARG HD2 1 1 15 4343 1 1 13 ARG HD3 H -1.206 -14.157 -1.005 1.00 . A A . 13 ARG HD3 1 1 15 4344 1 1 13 ARG HE H -2.266 -13.881 -3.609 1.00 . A A . 13 ARG HE 1 1 15 4345 1 1 13 ARG HG2 H -0.413 -15.541 -2.875 1.00 . A A . 13 ARG HG2 1 1 15 4346 1 1 13 ARG HG3 H -2.027 -16.138 -3.175 1.00 . A A . 13 ARG HG3 1 1 15 4347 1 1 13 ARG HH11 H -2.961 -12.655 -0.342 1.00 . A A . 13 ARG HH11 1 1 15 4348 1 1 13 ARG HH12 H -3.775 -11.240 -0.866 1.00 . A A . 13 ARG HH12 1 1 15 4349 1 1 13 ARG HH21 H -3.384 -11.966 -4.352 1.00 . A A . 13 ARG HH21 1 1 15 4350 1 1 13 ARG HH22 H -3.997 -10.832 -3.229 1.00 . A A . 13 ARG HH22 1 1 15 4351 1 1 13 ARG N N 1.007 -17.902 -2.374 1.00 . A A . 13 ARG N 1 1 15 4352 1 1 13 ARG NE N -2.420 -13.607 -2.645 1.00 . A A . 13 ARG NE 1 1 15 4353 1 1 13 ARG NH1 N -3.266 -12.077 -1.113 1.00 . A A . 13 ARG NH1 1 1 15 4354 1 1 13 ARG NH2 N -3.489 -11.695 -3.383 1.00 . A A . 13 ARG NH2 1 1 15 4355 1 1 13 ARG O O -0.937 -18.137 -4.390 1.00 . A A . 13 ARG O 1 1 15 4356 1 1 14 NH2 HN1 H -2.325 -20.132 -4.076 1.00 . A A . 14 NH2 HN1 1 1 15 4357 1 1 14 NH2 HN2 H -1.912 -20.332 -2.385 1.00 . A A . 14 NH2 HN2 1 1 15 4358 1 1 14 NH2 N N -1.870 -19.801 -3.241 1.00 . A A . 14 NH2 N 1 1 15 4359 2 2 1 . C1 C 9.420 -21.207 2.807 1.00 . B A . 101 BGC C1 1 1 15 4360 2 2 1 . C2 C 8.817 -22.533 2.291 1.00 . B A . 101 BGC C2 1 1 15 4361 2 2 1 . C3 C 7.352 -22.704 2.744 1.00 . B A . 101 BGC C3 1 1 15 4362 2 2 1 . C4 C 7.172 -22.384 4.234 1.00 . B A . 101 BGC C4 1 1 15 4363 2 2 1 . C5 C 7.761 -20.988 4.514 1.00 . B A . 101 BGC C5 1 1 15 4364 2 2 1 . C6 C 7.677 -20.515 5.971 1.00 . B A . 101 BGC C6 1 1 15 4365 2 2 1 . H1 H 8.971 -20.348 2.300 1.00 . B A . 101 BGC H1 1 1 15 4366 2 2 1 . H2 H 9.428 -23.352 2.674 1.00 . B A . 101 BGC H2 1 1 15 4367 2 2 1 . H3 H 6.744 -21.997 2.180 1.00 . B A . 101 BGC H3 1 1 15 4368 2 2 1 . H4 H 7.705 -23.122 4.836 1.00 . B A . 101 BGC H4 1 1 15 4369 2 2 1 . H5 H 7.281 -20.236 3.884 1.00 . B A . 101 BGC H5 1 1 15 4370 2 2 1 . H6 H 9.400 -19.651 5.902 1.00 . B A . 101 BGC H6 1 1 15 4371 2 2 1 . H6C1 H 8.017 -21.303 6.645 1.00 . B A . 101 BGC H6C1 1 1 15 4372 2 2 1 . H6C2 H 6.647 -20.281 6.244 1.00 . B A . 101 BGC H6C2 1 1 15 4373 2 2 1 . HB H 8.491 -23.375 0.567 1.00 . B A . 101 BGC HB 1 1 15 4374 2 2 1 . HC H 7.418 -24.668 2.942 1.00 . B A . 101 BGC HC 1 1 15 4375 2 2 1 . HD H 5.436 -23.252 4.152 1.00 . B A . 101 BGC HD 1 1 15 4376 2 2 1 . O2 O 8.862 -22.531 0.868 1.00 . B A . 101 BGC O2 1 1 15 4377 2 2 1 . O3 O 6.876 -24.022 2.462 1.00 . B A . 101 BGC O3 1 1 15 4378 2 2 1 . O4 O 5.792 -22.444 4.560 1.00 . B A . 101 BGC O4 1 1 15 4379 2 2 1 . O5 O 9.153 -21.059 4.185 1.00 . B A . 101 BGC O5 1 1 15 4380 2 2 1 . O6 O 8.506 -19.362 6.150 1.00 . B A . 101 BGC O6 1 1 16 4381 1 1 1 ILE C C 5.485 -2.619 2.439 1.00 . A A . 1 ILE C 1 1 16 4382 1 1 1 ILE CA C 4.081 -2.002 2.447 1.00 . A A . 1 ILE CA 1 1 16 4383 1 1 1 ILE CB C 3.889 -0.909 1.357 1.00 . A A . 1 ILE CB 1 1 16 4384 1 1 1 ILE CD1 C 4.877 1.220 0.283 1.00 . A A . 1 ILE CD1 1 1 16 4385 1 1 1 ILE CG1 C 4.819 0.321 1.526 1.00 . A A . 1 ILE CG1 1 1 16 4386 1 1 1 ILE CG2 C 2.410 -0.485 1.259 1.00 . A A . 1 ILE CG2 1 1 16 4387 1 1 1 ILE H1 H 3.932 -2.202 4.460 1.00 . A A . 1 ILE H1 1 1 16 4388 1 1 1 ILE HA H 3.369 -2.812 2.277 1.00 . A A . 1 ILE HA 1 1 16 4389 1 1 1 ILE HB H 4.144 -1.371 0.399 1.00 . A A . 1 ILE HB 1 1 16 4390 1 1 1 ILE HD11 H 5.593 2.030 0.426 1.00 . A A . 1 ILE HD11 1 1 16 4391 1 1 1 ILE HD12 H 5.196 0.659 -0.597 1.00 . A A . 1 ILE HD12 1 1 16 4392 1 1 1 ILE HD13 H 3.914 1.680 0.060 1.00 . A A . 1 ILE HD13 1 1 16 4393 1 1 1 ILE HG12 H 4.518 0.923 2.384 1.00 . A A . 1 ILE HG12 1 1 16 4394 1 1 1 ILE HG13 H 5.844 0.002 1.725 1.00 . A A . 1 ILE HG13 1 1 16 4395 1 1 1 ILE HG21 H 2.235 0.138 0.380 1.00 . A A . 1 ILE HG21 1 1 16 4396 1 1 1 ILE HG22 H 1.750 -1.348 1.155 1.00 . A A . 1 ILE HG22 1 1 16 4397 1 1 1 ILE HG23 H 2.081 0.089 2.126 1.00 . A A . 1 ILE HG23 1 1 16 4398 1 1 1 ILE N N 3.838 -1.451 3.792 1.00 . A A . 1 ILE N 1 1 16 4399 1 1 1 ILE O O 6.223 -2.406 3.399 1.00 . A A . 1 ILE O 1 1 16 4400 1 1 2 LEU C C 7.870 -2.734 0.192 1.00 . A A . 2 LEU C 1 1 16 4401 1 1 2 LEU CA C 7.217 -3.791 1.112 1.00 . A A . 2 LEU CA 1 1 16 4402 1 1 2 LEU CB C 7.168 -5.141 0.348 1.00 . A A . 2 LEU CB 1 1 16 4403 1 1 2 LEU CD1 C 5.770 -6.512 2.021 1.00 . A A . 2 LEU CD1 1 1 16 4404 1 1 2 LEU CD2 C 7.358 -7.667 0.446 1.00 . A A . 2 LEU CD2 1 1 16 4405 1 1 2 LEU CG C 7.099 -6.389 1.258 1.00 . A A . 2 LEU CG 1 1 16 4406 1 1 2 LEU H H 5.226 -3.415 0.592 1.00 . A A . 2 LEU H 1 1 16 4407 1 1 2 LEU HA H 7.790 -3.891 2.034 1.00 . A A . 2 LEU HA 1 1 16 4408 1 1 2 LEU HB2 H 6.349 -5.150 -0.374 1.00 . A A . 2 LEU HB2 1 1 16 4409 1 1 2 LEU HB3 H 8.067 -5.239 -0.265 1.00 . A A . 2 LEU HB3 1 1 16 4410 1 1 2 LEU HD11 H 4.918 -6.513 1.341 1.00 . A A . 2 LEU HD11 1 1 16 4411 1 1 2 LEU HD12 H 5.637 -5.700 2.734 1.00 . A A . 2 LEU HD12 1 1 16 4412 1 1 2 LEU HD13 H 5.733 -7.441 2.593 1.00 . A A . 2 LEU HD13 1 1 16 4413 1 1 2 LEU HD21 H 6.569 -7.828 -0.288 1.00 . A A . 2 LEU HD21 1 1 16 4414 1 1 2 LEU HD22 H 7.391 -8.548 1.087 1.00 . A A . 2 LEU HD22 1 1 16 4415 1 1 2 LEU HD23 H 8.305 -7.619 -0.092 1.00 . A A . 2 LEU HD23 1 1 16 4416 1 1 2 LEU HG H 7.902 -6.314 1.994 1.00 . A A . 2 LEU HG 1 1 16 4417 1 1 2 LEU N N 5.844 -3.359 1.388 1.00 . A A . 2 LEU N 1 1 16 4418 1 1 2 LEU O O 7.139 -1.985 -0.461 1.00 . A A . 2 LEU O 1 1 16 4419 1 1 3 PRO C C 9.885 -2.370 -2.256 1.00 . A A . 3 PRO C 1 1 16 4420 1 1 3 PRO CA C 9.926 -1.792 -0.828 1.00 . A A . 3 PRO CA 1 1 16 4421 1 1 3 PRO CB C 11.364 -1.740 -0.282 1.00 . A A . 3 PRO CB 1 1 16 4422 1 1 3 PRO CD C 10.163 -3.432 0.939 1.00 . A A . 3 PRO CD 1 1 16 4423 1 1 3 PRO CG C 11.556 -3.080 0.414 1.00 . A A . 3 PRO CG 1 1 16 4424 1 1 3 PRO HA H 9.485 -0.793 -0.837 1.00 . A A . 3 PRO HA 1 1 16 4425 1 1 3 PRO HB2 H 12.122 -1.556 -1.044 1.00 . A A . 3 PRO HB2 1 1 16 4426 1 1 3 PRO HB3 H 11.443 -0.935 0.450 1.00 . A A . 3 PRO HB3 1 1 16 4427 1 1 3 PRO HD2 H 9.988 -4.506 0.880 1.00 . A A . 3 PRO HD2 1 1 16 4428 1 1 3 PRO HD3 H 10.064 -3.126 1.982 1.00 . A A . 3 PRO HD3 1 1 16 4429 1 1 3 PRO HG2 H 11.870 -3.828 -0.316 1.00 . A A . 3 PRO HG2 1 1 16 4430 1 1 3 PRO HG3 H 12.311 -3.049 1.200 1.00 . A A . 3 PRO HG3 1 1 16 4431 1 1 3 PRO N N 9.218 -2.665 0.119 1.00 . A A . 3 PRO N 1 1 16 4432 1 1 3 PRO O O 9.462 -3.506 -2.466 1.00 . A A . 3 PRO O 1 1 16 4433 1 1 4 TRP C C 11.337 -3.084 -5.075 1.00 . A A . 4 TRP C 1 1 16 4434 1 1 4 TRP CA C 10.386 -1.927 -4.674 1.00 . A A . 4 TRP CA 1 1 16 4435 1 1 4 TRP CB C 10.778 -0.656 -5.468 1.00 . A A . 4 TRP CB 1 1 16 4436 1 1 4 TRP CD1 C 8.717 0.688 -4.751 1.00 . A A . 4 TRP CD1 1 1 16 4437 1 1 4 TRP CD2 C 9.913 1.678 -6.373 1.00 . A A . 4 TRP CD2 1 1 16 4438 1 1 4 TRP CE2 C 8.804 2.533 -6.098 1.00 . A A . 4 TRP CE2 1 1 16 4439 1 1 4 TRP CE3 C 10.807 2.094 -7.389 1.00 . A A . 4 TRP CE3 1 1 16 4440 1 1 4 TRP CG C 9.834 0.512 -5.498 1.00 . A A . 4 TRP CG 1 1 16 4441 1 1 4 TRP CH2 C 9.499 4.117 -7.800 1.00 . A A . 4 TRP CH2 1 1 16 4442 1 1 4 TRP CZ2 C 8.592 3.737 -6.794 1.00 . A A . 4 TRP CZ2 1 1 16 4443 1 1 4 TRP CZ3 C 10.604 3.297 -8.096 1.00 . A A . 4 TRP CZ3 1 1 16 4444 1 1 4 TRP H H 10.722 -0.691 -2.990 1.00 . A A . 4 TRP H 1 1 16 4445 1 1 4 TRP HA H 9.381 -2.233 -4.969 1.00 . A A . 4 TRP HA 1 1 16 4446 1 1 4 TRP HB2 H 11.752 -0.293 -5.139 1.00 . A A . 4 TRP HB2 1 1 16 4447 1 1 4 TRP HB3 H 10.907 -0.914 -6.520 1.00 . A A . 4 TRP HB3 1 1 16 4448 1 1 4 TRP HD1 H 8.349 -0.008 -4.011 1.00 . A A . 4 TRP HD1 1 1 16 4449 1 1 4 TRP HE1 H 7.259 2.214 -4.677 1.00 . A A . 4 TRP HE1 1 1 16 4450 1 1 4 TRP HE3 H 11.655 1.472 -7.633 1.00 . A A . 4 TRP HE3 1 1 16 4451 1 1 4 TRP HH2 H 9.344 5.036 -8.348 1.00 . A A . 4 TRP HH2 1 1 16 4452 1 1 4 TRP HZ2 H 7.741 4.362 -6.568 1.00 . A A . 4 TRP HZ2 1 1 16 4453 1 1 4 TRP HZ3 H 11.297 3.589 -8.873 1.00 . A A . 4 TRP HZ3 1 1 16 4454 1 1 4 TRP N N 10.383 -1.608 -3.237 1.00 . A A . 4 TRP N 1 1 16 4455 1 1 4 TRP NE1 N 8.119 1.885 -5.093 1.00 . A A . 4 TRP NE1 1 1 16 4456 1 1 4 TRP O O 11.633 -3.258 -6.255 1.00 . A A . 4 TRP O 1 1 16 4457 1 1 5 LYS C C 12.123 -6.148 -3.359 1.00 . A A . 5 LYS C 1 1 16 4458 1 1 5 LYS CA C 12.611 -5.087 -4.345 1.00 . A A . 5 LYS CA 1 1 16 4459 1 1 5 LYS CB C 14.133 -4.825 -4.270 1.00 . A A . 5 LYS CB 1 1 16 4460 1 1 5 LYS CD C 16.162 -3.810 -5.531 1.00 . A A . 5 LYS CD 1 1 16 4461 1 1 5 LYS CE C 16.649 -4.967 -6.421 1.00 . A A . 5 LYS CE 1 1 16 4462 1 1 5 LYS CG C 14.640 -3.820 -5.325 1.00 . A A . 5 LYS CG 1 1 16 4463 1 1 5 LYS H H 11.416 -3.785 -3.200 1.00 . A A . 5 LYS H 1 1 16 4464 1 1 5 LYS HA H 12.390 -5.460 -5.348 1.00 . A A . 5 LYS HA 1 1 16 4465 1 1 5 LYS HB2 H 14.399 -4.476 -3.270 1.00 . A A . 5 LYS HB2 1 1 16 4466 1 1 5 LYS HB3 H 14.641 -5.781 -4.396 1.00 . A A . 5 LYS HB3 1 1 16 4467 1 1 5 LYS HD2 H 16.420 -2.861 -6.006 1.00 . A A . 5 LYS HD2 1 1 16 4468 1 1 5 LYS HD3 H 16.666 -3.813 -4.563 1.00 . A A . 5 LYS HD3 1 1 16 4469 1 1 5 LYS HE2 H 16.488 -5.925 -5.924 1.00 . A A . 5 LYS HE2 1 1 16 4470 1 1 5 LYS HE3 H 16.075 -4.993 -7.349 1.00 . A A . 5 LYS HE3 1 1 16 4471 1 1 5 LYS HG2 H 14.149 -4.003 -6.282 1.00 . A A . 5 LYS HG2 1 1 16 4472 1 1 5 LYS HG3 H 14.319 -2.820 -5.024 1.00 . A A . 5 LYS HG3 1 1 16 4473 1 1 5 LYS HZ1 H 18.361 -5.598 -7.356 1.00 . A A . 5 LYS HZ1 1 1 16 4474 1 1 5 LYS HZ2 H 18.641 -4.832 -5.924 1.00 . A A . 5 LYS HZ2 1 1 16 4475 1 1 5 LYS HZ3 H 18.224 -3.964 -7.260 1.00 . A A . 5 LYS HZ3 1 1 16 4476 1 1 5 LYS N N 11.832 -3.879 -4.120 1.00 . A A . 5 LYS N 1 1 16 4477 1 1 5 LYS NZ N 18.077 -4.830 -6.762 1.00 . A A . 5 LYS NZ 1 1 16 4478 1 1 5 LYS O O 12.119 -5.920 -2.149 1.00 . A A . 5 LYS O 1 1 16 4479 1 1 6 TRP C C 12.474 -9.224 -2.580 1.00 . A A . 6 TRP C 1 1 16 4480 1 1 6 TRP CA C 11.252 -8.456 -3.121 1.00 . A A . 6 TRP CA 1 1 16 4481 1 1 6 TRP CB C 10.469 -9.365 -4.090 1.00 . A A . 6 TRP CB 1 1 16 4482 1 1 6 TRP CD1 C 9.636 -11.587 -3.198 1.00 . A A . 6 TRP CD1 1 1 16 4483 1 1 6 TRP CD2 C 8.085 -9.968 -3.081 1.00 . A A . 6 TRP CD2 1 1 16 4484 1 1 6 TRP CE2 C 7.473 -11.163 -2.593 1.00 . A A . 6 TRP CE2 1 1 16 4485 1 1 6 TRP CE3 C 7.276 -8.809 -3.139 1.00 . A A . 6 TRP CE3 1 1 16 4486 1 1 6 TRP CG C 9.461 -10.274 -3.461 1.00 . A A . 6 TRP CG 1 1 16 4487 1 1 6 TRP CH2 C 5.347 -10.039 -2.275 1.00 . A A . 6 TRP CH2 1 1 16 4488 1 1 6 TRP CZ2 C 6.125 -11.209 -2.197 1.00 . A A . 6 TRP CZ2 1 1 16 4489 1 1 6 TRP CZ3 C 5.922 -8.843 -2.748 1.00 . A A . 6 TRP CZ3 1 1 16 4490 1 1 6 TRP H H 11.795 -7.424 -4.882 1.00 . A A . 6 TRP H 1 1 16 4491 1 1 6 TRP HA H 10.606 -8.115 -2.309 1.00 . A A . 6 TRP HA 1 1 16 4492 1 1 6 TRP HB2 H 9.908 -8.759 -4.803 1.00 . A A . 6 TRP HB2 1 1 16 4493 1 1 6 TRP HB3 H 11.152 -9.963 -4.696 1.00 . A A . 6 TRP HB3 1 1 16 4494 1 1 6 TRP HD1 H 10.539 -12.138 -3.421 1.00 . A A . 6 TRP HD1 1 1 16 4495 1 1 6 TRP HE1 H 8.363 -13.094 -2.471 1.00 . A A . 6 TRP HE1 1 1 16 4496 1 1 6 TRP HE3 H 7.696 -7.888 -3.516 1.00 . A A . 6 TRP HE3 1 1 16 4497 1 1 6 TRP HH2 H 4.306 -10.062 -1.986 1.00 . A A . 6 TRP HH2 1 1 16 4498 1 1 6 TRP HZ2 H 5.681 -12.132 -1.855 1.00 . A A . 6 TRP HZ2 1 1 16 4499 1 1 6 TRP HZ3 H 5.320 -7.948 -2.823 1.00 . A A . 6 TRP HZ3 1 1 16 4500 1 1 6 TRP N N 11.717 -7.305 -3.885 1.00 . A A . 6 TRP N 1 1 16 4501 1 1 6 TRP NE1 N 8.478 -12.106 -2.657 1.00 . A A . 6 TRP NE1 1 1 16 4502 1 1 6 TRP O O 13.527 -9.245 -3.218 1.00 . A A . 6 TRP O 1 1 16 4503 1 1 7 LYS C C 12.774 -11.816 0.032 1.00 . A A . 7 LYS C 1 1 16 4504 1 1 7 LYS CA C 13.382 -10.653 -0.764 1.00 . A A . 7 LYS CA 1 1 16 4505 1 1 7 LYS CB C 14.384 -9.768 0.018 1.00 . A A . 7 LYS CB 1 1 16 4506 1 1 7 LYS CD C 14.738 -8.807 2.414 1.00 . A A . 7 LYS CD 1 1 16 4507 1 1 7 LYS CE C 15.249 -10.103 3.088 1.00 . A A . 7 LYS CE 1 1 16 4508 1 1 7 LYS CG C 13.782 -8.995 1.216 1.00 . A A . 7 LYS CG 1 1 16 4509 1 1 7 LYS H H 11.429 -9.837 -0.970 1.00 . A A . 7 LYS H 1 1 16 4510 1 1 7 LYS HA H 13.957 -11.146 -1.553 1.00 . A A . 7 LYS HA 1 1 16 4511 1 1 7 LYS HB2 H 15.195 -10.417 0.346 1.00 . A A . 7 LYS HB2 1 1 16 4512 1 1 7 LYS HB3 H 14.859 -9.061 -0.665 1.00 . A A . 7 LYS HB3 1 1 16 4513 1 1 7 LYS HD2 H 15.600 -8.218 2.090 1.00 . A A . 7 LYS HD2 1 1 16 4514 1 1 7 LYS HD3 H 14.238 -8.190 3.162 1.00 . A A . 7 LYS HD3 1 1 16 4515 1 1 7 LYS HE2 H 15.946 -10.631 2.437 1.00 . A A . 7 LYS HE2 1 1 16 4516 1 1 7 LYS HE3 H 15.819 -9.842 3.982 1.00 . A A . 7 LYS HE3 1 1 16 4517 1 1 7 LYS HG2 H 13.465 -8.013 0.857 1.00 . A A . 7 LYS HG2 1 1 16 4518 1 1 7 LYS HG3 H 12.861 -9.460 1.565 1.00 . A A . 7 LYS HG3 1 1 16 4519 1 1 7 LYS HZ1 H 13.478 -10.569 4.052 1.00 . A A . 7 LYS HZ1 1 1 16 4520 1 1 7 LYS HZ2 H 14.541 -11.825 3.965 1.00 . A A . 7 LYS HZ2 1 1 16 4521 1 1 7 LYS HZ3 H 13.707 -11.382 2.625 1.00 . A A . 7 LYS HZ3 1 1 16 4522 1 1 7 LYS N N 12.337 -9.860 -1.411 1.00 . A A . 7 LYS N 1 1 16 4523 1 1 7 LYS NZ N 14.164 -11.028 3.472 1.00 . A A . 7 LYS NZ 1 1 16 4524 1 1 7 LYS O O 13.093 -12.005 1.210 1.00 . A A . 7 LYS O 1 1 16 4525 1 1 8 TRP C C 10.848 -14.683 -1.169 1.00 . A A . 8 TRP C 1 1 16 4526 1 1 8 TRP CA C 11.121 -13.677 -0.036 1.00 . A A . 8 TRP CA 1 1 16 4527 1 1 8 TRP CB C 9.879 -13.169 0.731 1.00 . A A . 8 TRP CB 1 1 16 4528 1 1 8 TRP CD1 C 9.508 -15.253 2.107 1.00 . A A . 8 TRP CD1 1 1 16 4529 1 1 8 TRP CD2 C 7.601 -14.459 1.225 1.00 . A A . 8 TRP CD2 1 1 16 4530 1 1 8 TRP CE2 C 7.280 -15.692 1.869 1.00 . A A . 8 TRP CE2 1 1 16 4531 1 1 8 TRP CE3 C 6.536 -13.758 0.615 1.00 . A A . 8 TRP CE3 1 1 16 4532 1 1 8 TRP CG C 9.036 -14.231 1.360 1.00 . A A . 8 TRP CG 1 1 16 4533 1 1 8 TRP CH2 C 4.936 -15.482 1.285 1.00 . A A . 8 TRP CH2 1 1 16 4534 1 1 8 TRP CZ2 C 5.974 -16.209 1.896 1.00 . A A . 8 TRP CZ2 1 1 16 4535 1 1 8 TRP CZ3 C 5.217 -14.255 0.650 1.00 . A A . 8 TRP CZ3 1 1 16 4536 1 1 8 TRP H H 11.694 -12.402 -1.581 1.00 . A A . 8 TRP H 1 1 16 4537 1 1 8 TRP HA H 11.779 -14.194 0.666 1.00 . A A . 8 TRP HA 1 1 16 4538 1 1 8 TRP HB2 H 10.176 -12.480 1.522 1.00 . A A . 8 TRP HB2 1 1 16 4539 1 1 8 TRP HB3 H 9.245 -12.597 0.053 1.00 . A A . 8 TRP HB3 1 1 16 4540 1 1 8 TRP HD1 H 10.544 -15.394 2.380 1.00 . A A . 8 TRP HD1 1 1 16 4541 1 1 8 TRP HE1 H 8.657 -17.055 2.772 1.00 . A A . 8 TRP HE1 1 1 16 4542 1 1 8 TRP HE3 H 6.738 -12.817 0.127 1.00 . A A . 8 TRP HE3 1 1 16 4543 1 1 8 TRP HH2 H 3.925 -15.861 1.309 1.00 . A A . 8 TRP HH2 1 1 16 4544 1 1 8 TRP HZ2 H 5.766 -17.148 2.389 1.00 . A A . 8 TRP HZ2 1 1 16 4545 1 1 8 TRP HZ3 H 4.417 -13.695 0.187 1.00 . A A . 8 TRP HZ3 1 1 16 4546 1 1 8 TRP N N 11.850 -12.545 -0.590 1.00 . A A . 8 TRP N 1 1 16 4547 1 1 8 TRP NE1 N 8.487 -16.138 2.361 1.00 . A A . 8 TRP NE1 1 1 16 4548 1 1 8 TRP O O 11.116 -14.378 -2.330 1.00 . A A . 8 TRP O 1 1 16 4549 1 1 9 THR C C 8.592 -17.452 -1.457 1.00 . A A . 9 THR C 1 1 16 4550 1 1 9 THR CA C 10.018 -16.955 -1.767 1.00 . A A . 9 THR CA 1 1 16 4551 1 1 9 THR CB C 11.117 -18.061 -1.792 1.00 . A A . 9 THR CB 1 1 16 4552 1 1 9 THR CG2 C 12.499 -17.603 -2.298 1.00 . A A . 9 THR CG2 1 1 16 4553 1 1 9 THR H H 10.013 -16.023 0.109 1.00 . A A . 9 THR H 1 1 16 4554 1 1 9 THR HA H 10.020 -16.565 -2.783 1.00 . A A . 9 THR HA 1 1 16 4555 1 1 9 THR HB H 10.768 -18.812 -2.503 1.00 . A A . 9 THR HB 1 1 16 4556 1 1 9 THR HG21 H 12.938 -16.824 -1.676 1.00 . A A . 9 THR HG21 1 1 16 4557 1 1 9 THR HG22 H 12.423 -17.201 -3.309 1.00 . A A . 9 THR HG22 1 1 16 4558 1 1 9 THR HG23 H 13.196 -18.441 -2.333 1.00 . A A . 9 THR HG23 1 1 16 4559 1 1 9 THR N N 10.329 -15.870 -0.842 1.00 . A A . 9 THR N 1 1 16 4560 1 1 9 THR O O 8.433 -18.261 -0.539 1.00 . A A . 9 THR O 1 1 16 4561 1 1 9 THR OG1 O 11.221 -18.750 -0.522 1.00 . A A . 9 THR OG1 1 1 16 4562 1 1 10 PRO C C 5.942 -18.736 -2.617 1.00 . A A . 10 PRO C 1 1 16 4563 1 1 10 PRO CA C 6.164 -17.383 -1.921 1.00 . A A . 10 PRO CA 1 1 16 4564 1 1 10 PRO CB C 5.296 -16.279 -2.548 1.00 . A A . 10 PRO CB 1 1 16 4565 1 1 10 PRO CD C 7.600 -15.858 -3.134 1.00 . A A . 10 PRO CD 1 1 16 4566 1 1 10 PRO CG C 6.167 -15.652 -3.628 1.00 . A A . 10 PRO CG 1 1 16 4567 1 1 10 PRO HA H 5.947 -17.469 -0.854 1.00 . A A . 10 PRO HA 1 1 16 4568 1 1 10 PRO HB2 H 4.348 -16.647 -2.943 1.00 . A A . 10 PRO HB2 1 1 16 4569 1 1 10 PRO HB3 H 5.061 -15.530 -1.794 1.00 . A A . 10 PRO HB3 1 1 16 4570 1 1 10 PRO HD2 H 8.247 -16.108 -3.976 1.00 . A A . 10 PRO HD2 1 1 16 4571 1 1 10 PRO HD3 H 7.979 -14.954 -2.660 1.00 . A A . 10 PRO HD3 1 1 16 4572 1 1 10 PRO HG2 H 6.027 -16.192 -4.566 1.00 . A A . 10 PRO HG2 1 1 16 4573 1 1 10 PRO HG3 H 5.929 -14.604 -3.816 1.00 . A A . 10 PRO HG3 1 1 16 4574 1 1 10 PRO N N 7.543 -16.937 -2.140 1.00 . A A . 10 PRO N 1 1 16 4575 1 1 10 PRO O O 6.210 -18.874 -3.810 1.00 . A A . 10 PRO O 1 1 16 4576 1 1 11 TRP C C 4.003 -21.698 -1.596 1.00 . A A . 11 TRP C 1 1 16 4577 1 1 11 TRP CA C 5.162 -21.074 -2.384 1.00 . A A . 11 TRP CA 1 1 16 4578 1 1 11 TRP CB C 6.440 -21.939 -2.442 1.00 . A A . 11 TRP CB 1 1 16 4579 1 1 11 TRP CD1 C 6.346 -24.389 -3.108 1.00 . A A . 11 TRP CD1 1 1 16 4580 1 1 11 TRP CD2 C 6.328 -23.003 -4.875 1.00 . A A . 11 TRP CD2 1 1 16 4581 1 1 11 TRP CE2 C 6.262 -24.332 -5.392 1.00 . A A . 11 TRP CE2 1 1 16 4582 1 1 11 TRP CE3 C 6.342 -21.947 -5.817 1.00 . A A . 11 TRP CE3 1 1 16 4583 1 1 11 TRP CG C 6.379 -23.073 -3.418 1.00 . A A . 11 TRP CG 1 1 16 4584 1 1 11 TRP CH2 C 6.241 -23.526 -7.680 1.00 . A A . 11 TRP CH2 1 1 16 4585 1 1 11 TRP CZ2 C 6.221 -24.600 -6.771 1.00 . A A . 11 TRP CZ2 1 1 16 4586 1 1 11 TRP CZ3 C 6.298 -22.202 -7.203 1.00 . A A . 11 TRP CZ3 1 1 16 4587 1 1 11 TRP H H 5.203 -19.570 -0.914 1.00 . A A . 11 TRP H 1 1 16 4588 1 1 11 TRP HA H 4.791 -20.952 -3.404 1.00 . A A . 11 TRP HA 1 1 16 4589 1 1 11 TRP HB2 H 7.294 -21.330 -2.741 1.00 . A A . 11 TRP HB2 1 1 16 4590 1 1 11 TRP HB3 H 6.682 -22.321 -1.449 1.00 . A A . 11 TRP HB3 1 1 16 4591 1 1 11 TRP HD1 H 6.378 -24.782 -2.101 1.00 . A A . 11 TRP HD1 1 1 16 4592 1 1 11 TRP HE1 H 6.280 -26.143 -4.275 1.00 . A A . 11 TRP HE1 1 1 16 4593 1 1 11 TRP HE3 H 6.405 -20.926 -5.467 1.00 . A A . 11 TRP HE3 1 1 16 4594 1 1 11 TRP HH2 H 6.222 -23.716 -8.744 1.00 . A A . 11 TRP HH2 1 1 16 4595 1 1 11 TRP HZ2 H 6.185 -25.617 -7.134 1.00 . A A . 11 TRP HZ2 1 1 16 4596 1 1 11 TRP HZ3 H 6.324 -21.378 -7.902 1.00 . A A . 11 TRP HZ3 1 1 16 4597 1 1 11 TRP N N 5.451 -19.737 -1.880 1.00 . A A . 11 TRP N 1 1 16 4598 1 1 11 TRP NE1 N 6.260 -25.132 -4.269 1.00 . A A . 11 TRP NE1 1 1 16 4599 1 1 11 TRP O O 3.554 -21.145 -0.591 1.00 . A A . 11 TRP O 1 1 16 4600 1 1 12 ARG C C 3.059 -24.832 -0.750 1.00 . A A . 12 ARG C 1 1 16 4601 1 1 12 ARG CA C 2.430 -23.604 -1.424 1.00 . A A . 12 ARG CA 1 1 16 4602 1 1 12 ARG CB C 1.441 -24.071 -2.516 1.00 . A A . 12 ARG CB 1 1 16 4603 1 1 12 ARG CD C -0.313 -23.361 -4.258 1.00 . A A . 12 ARG CD 1 1 16 4604 1 1 12 ARG CG C 0.649 -22.907 -3.146 1.00 . A A . 12 ARG CG 1 1 16 4605 1 1 12 ARG CZ C -2.438 -22.482 -5.288 1.00 . A A . 12 ARG CZ 1 1 16 4606 1 1 12 ARG H H 4.017 -23.308 -2.798 1.00 . A A . 12 ARG H 1 1 16 4607 1 1 12 ARG HA H 1.900 -23.007 -0.679 1.00 . A A . 12 ARG HA 1 1 16 4608 1 1 12 ARG HB2 H 1.979 -24.616 -3.294 1.00 . A A . 12 ARG HB2 1 1 16 4609 1 1 12 ARG HB3 H 0.737 -24.783 -2.084 1.00 . A A . 12 ARG HB3 1 1 16 4610 1 1 12 ARG HD2 H 0.242 -23.619 -5.162 1.00 . A A . 12 ARG HD2 1 1 16 4611 1 1 12 ARG HD3 H -0.839 -24.259 -3.932 1.00 . A A . 12 ARG HD3 1 1 16 4612 1 1 12 ARG HE H -1.071 -21.406 -4.210 1.00 . A A . 12 ARG HE 1 1 16 4613 1 1 12 ARG HG2 H 0.099 -22.389 -2.359 1.00 . A A . 12 ARG HG2 1 1 16 4614 1 1 12 ARG HG3 H 1.346 -22.176 -3.559 1.00 . A A . 12 ARG HG3 1 1 16 4615 1 1 12 ARG HH11 H -2.062 -24.423 -5.816 1.00 . A A . 12 ARG HH11 1 1 16 4616 1 1 12 ARG HH12 H -3.549 -23.814 -6.417 1.00 . A A . 12 ARG HH12 1 1 16 4617 1 1 12 ARG HH21 H -3.135 -20.567 -4.975 1.00 . A A . 12 ARG HH21 1 1 16 4618 1 1 12 ARG HH22 H -4.135 -21.529 -5.974 1.00 . A A . 12 ARG HH22 1 1 16 4619 1 1 12 ARG N N 3.497 -22.843 -2.063 1.00 . A A . 12 ARG N 1 1 16 4620 1 1 12 ARG NE N -1.319 -22.324 -4.561 1.00 . A A . 12 ARG NE 1 1 16 4621 1 1 12 ARG NH1 N -2.713 -23.653 -5.869 1.00 . A A . 12 ARG NH1 1 1 16 4622 1 1 12 ARG NH2 N -3.286 -21.460 -5.427 1.00 . A A . 12 ARG NH2 1 1 16 4623 1 1 12 ARG O O 3.825 -25.554 -1.385 1.00 . A A . 12 ARG O 1 1 16 4624 1 1 13 ARG C C 2.640 -27.575 0.900 1.00 . A A . 13 ARG C 1 1 16 4625 1 1 13 ARG CA C 3.193 -26.200 1.352 1.00 . A A . 13 ARG CA 1 1 16 4626 1 1 13 ARG CB C 2.848 -25.907 2.837 1.00 . A A . 13 ARG CB 1 1 16 4627 1 1 13 ARG CD C 0.860 -26.512 4.375 1.00 . A A . 13 ARG CD 1 1 16 4628 1 1 13 ARG CG C 1.350 -25.683 3.173 1.00 . A A . 13 ARG CG 1 1 16 4629 1 1 13 ARG CZ C 0.119 -28.918 4.668 1.00 . A A . 13 ARG CZ 1 1 16 4630 1 1 13 ARG H H 2.095 -24.429 0.963 1.00 . A A . 13 ARG H 1 1 16 4631 1 1 13 ARG HA H 4.281 -26.249 1.261 1.00 . A A . 13 ARG HA 1 1 16 4632 1 1 13 ARG HB2 H 3.244 -26.724 3.444 1.00 . A A . 13 ARG HB2 1 1 16 4633 1 1 13 ARG HB3 H 3.415 -25.035 3.166 1.00 . A A . 13 ARG HB3 1 1 16 4634 1 1 13 ARG HD2 H 1.532 -26.402 5.229 1.00 . A A . 13 ARG HD2 1 1 16 4635 1 1 13 ARG HD3 H -0.119 -26.146 4.687 1.00 . A A . 13 ARG HD3 1 1 16 4636 1 1 13 ARG HE H 1.218 -28.150 3.118 1.00 . A A . 13 ARG HE 1 1 16 4637 1 1 13 ARG HG2 H 1.188 -24.624 3.380 1.00 . A A . 13 ARG HG2 1 1 16 4638 1 1 13 ARG HG3 H 0.719 -25.902 2.310 1.00 . A A . 13 ARG HG3 1 1 16 4639 1 1 13 ARG HH11 H -0.495 -27.756 6.233 1.00 . A A . 13 ARG HH11 1 1 16 4640 1 1 13 ARG HH12 H -0.979 -29.401 6.354 1.00 . A A . 13 ARG HH12 1 1 16 4641 1 1 13 ARG HH21 H 0.608 -30.329 3.274 1.00 . A A . 13 ARG HH21 1 1 16 4642 1 1 13 ARG HH22 H -0.308 -30.941 4.595 1.00 . A A . 13 ARG HH22 1 1 16 4643 1 1 13 ARG N N 2.709 -25.092 0.518 1.00 . A A . 13 ARG N 1 1 16 4644 1 1 13 ARG NE N 0.734 -27.932 4.005 1.00 . A A . 13 ARG NE 1 1 16 4645 1 1 13 ARG NH1 N -0.498 -28.682 5.829 1.00 . A A . 13 ARG NH1 1 1 16 4646 1 1 13 ARG NH2 N 0.129 -30.145 4.148 1.00 . A A . 13 ARG NH2 1 1 16 4647 1 1 13 ARG O O 1.992 -28.297 1.659 1.00 . A A . 13 ARG O 1 1 16 4648 1 1 14 NH2 HN1 H 2.577 -28.844 -0.692 1.00 . A A . 14 NH2 HN1 1 1 16 4649 1 1 14 NH2 HN2 H 3.396 -27.295 -0.940 1.00 . A A . 14 NH2 HN2 1 1 16 4650 1 1 14 NH2 N N 2.870 -27.943 -0.351 1.00 . A A . 14 NH2 N 1 1 16 4651 2 2 1 . C1 C 12.038 -18.235 0.507 1.00 . B A . 101 BGC C1 1 1 16 4652 2 2 1 . C2 C 11.543 -18.787 1.842 1.00 . B A . 101 BGC C2 1 1 16 4653 2 2 1 . C3 C 12.321 -18.118 2.981 1.00 . B A . 101 BGC C3 1 1 16 4654 2 2 1 . C4 C 13.848 -18.209 2.750 1.00 . B A . 101 BGC C4 1 1 16 4655 2 2 1 . C5 C 14.261 -17.876 1.286 1.00 . B A . 101 BGC C5 1 1 16 4656 2 2 1 . C6 C 15.699 -18.313 0.947 1.00 . B A . 101 BGC C6 1 1 16 4657 2 2 1 . H1 H 11.970 -17.144 0.480 1.00 . B A . 101 BGC H1 1 1 16 4658 2 2 1 . H2 H 11.706 -19.866 1.851 1.00 . B A . 101 BGC H2 1 1 16 4659 2 2 1 . H3 H 12.041 -17.066 3.024 1.00 . B A . 101 BGC H3 1 1 16 4660 2 2 1 . H4 H 14.168 -19.229 2.972 1.00 . B A . 101 BGC H4 1 1 16 4661 2 2 1 . H5 H 14.165 -16.803 1.109 1.00 . B A . 101 BGC H5 1 1 16 4662 2 2 1 . H6 H 17.550 -18.006 1.528 1.00 . B A . 101 BGC H6 1 1 16 4663 2 2 1 . H6C1 H 15.919 -18.081 -0.096 1.00 . B A . 101 BGC H6C1 1 1 16 4664 2 2 1 . H6C2 H 15.792 -19.395 1.051 1.00 . B A . 101 BGC H6C2 1 1 16 4665 2 2 1 . HB H 9.733 -18.842 1.134 1.00 . B A . 101 BGC HB 1 1 16 4666 2 2 1 . HC H 10.966 -18.763 4.206 1.00 . B A . 101 BGC HC 1 1 16 4667 2 2 1 . HD H 15.477 -17.389 3.400 1.00 . B A . 101 BGC HD 1 1 16 4668 2 2 1 . O2 O 10.146 -18.526 1.963 1.00 . B A . 101 BGC O2 1 1 16 4669 2 2 1 . O3 O 11.935 -18.736 4.205 1.00 . B A . 101 BGC O3 1 1 16 4670 2 2 1 . O4 O 14.531 -17.314 3.625 1.00 . B A . 101 BGC O4 1 1 16 4671 2 2 1 . O5 O 13.398 -18.561 0.369 1.00 . B A . 101 BGC O5 1 1 16 4672 2 2 1 . O6 O 16.672 -17.679 1.780 1.00 . B A . 101 BGC O6 1 1 17 4673 1 1 1 ILE C C 7.326 1.240 -4.186 1.00 . A A . 1 ILE C 1 1 17 4674 1 1 1 ILE CA C 7.612 1.209 -5.694 1.00 . A A . 1 ILE CA 1 1 17 4675 1 1 1 ILE CB C 9.130 1.342 -6.026 1.00 . A A . 1 ILE CB 1 1 17 4676 1 1 1 ILE CD1 C 9.047 0.157 -8.344 1.00 . A A . 1 ILE CD1 1 1 17 4677 1 1 1 ILE CG1 C 9.421 1.417 -7.545 1.00 . A A . 1 ILE CG1 1 1 17 4678 1 1 1 ILE CG2 C 10.014 0.260 -5.369 1.00 . A A . 1 ILE CG2 1 1 17 4679 1 1 1 ILE H1 H 5.864 2.153 -6.178 1.00 . A A . 1 ILE H1 1 1 17 4680 1 1 1 ILE HA H 7.224 0.275 -6.103 1.00 . A A . 1 ILE HA 1 1 17 4681 1 1 1 ILE HB H 9.471 2.292 -5.607 1.00 . A A . 1 ILE HB 1 1 17 4682 1 1 1 ILE HD11 H 7.982 -0.064 -8.314 1.00 . A A . 1 ILE HD11 1 1 17 4683 1 1 1 ILE HD12 H 9.317 0.282 -9.395 1.00 . A A . 1 ILE HD12 1 1 17 4684 1 1 1 ILE HD13 H 9.587 -0.723 -7.990 1.00 . A A . 1 ILE HD13 1 1 17 4685 1 1 1 ILE HG12 H 8.936 2.284 -7.995 1.00 . A A . 1 ILE HG12 1 1 17 4686 1 1 1 ILE HG13 H 10.488 1.602 -7.689 1.00 . A A . 1 ILE HG13 1 1 17 4687 1 1 1 ILE HG21 H 10.033 0.360 -4.284 1.00 . A A . 1 ILE HG21 1 1 17 4688 1 1 1 ILE HG22 H 9.677 -0.749 -5.610 1.00 . A A . 1 ILE HG22 1 1 17 4689 1 1 1 ILE HG23 H 11.050 0.348 -5.701 1.00 . A A . 1 ILE HG23 1 1 17 4690 1 1 1 ILE N N 6.852 2.323 -6.289 1.00 . A A . 1 ILE N 1 1 17 4691 1 1 1 ILE O O 7.091 2.328 -3.668 1.00 . A A . 1 ILE O 1 1 17 4692 1 1 2 LEU C C 8.394 0.138 -1.288 1.00 . A A . 2 LEU C 1 1 17 4693 1 1 2 LEU CA C 7.057 -0.012 -2.061 1.00 . A A . 2 LEU CA 1 1 17 4694 1 1 2 LEU CB C 6.473 -1.411 -1.751 1.00 . A A . 2 LEU CB 1 1 17 4695 1 1 2 LEU CD1 C 4.718 -1.728 -3.627 1.00 . A A . 2 LEU CD1 1 1 17 4696 1 1 2 LEU CD2 C 4.415 -2.842 -1.393 1.00 . A A . 2 LEU CD2 1 1 17 4697 1 1 2 LEU CG C 4.981 -1.610 -2.116 1.00 . A A . 2 LEU CG 1 1 17 4698 1 1 2 LEU H H 7.556 -0.773 -3.966 1.00 . A A . 2 LEU H 1 1 17 4699 1 1 2 LEU HA H 6.344 0.757 -1.764 1.00 . A A . 2 LEU HA 1 1 17 4700 1 1 2 LEU HB2 H 7.085 -2.202 -2.187 1.00 . A A . 2 LEU HB2 1 1 17 4701 1 1 2 LEU HB3 H 6.543 -1.562 -0.673 1.00 . A A . 2 LEU HB3 1 1 17 4702 1 1 2 LEU HD11 H 5.309 -2.525 -4.080 1.00 . A A . 2 LEU HD11 1 1 17 4703 1 1 2 LEU HD12 H 4.926 -0.799 -4.153 1.00 . A A . 2 LEU HD12 1 1 17 4704 1 1 2 LEU HD13 H 3.668 -1.957 -3.817 1.00 . A A . 2 LEU HD13 1 1 17 4705 1 1 2 LEU HD21 H 4.915 -3.759 -1.706 1.00 . A A . 2 LEU HD21 1 1 17 4706 1 1 2 LEU HD22 H 3.348 -2.963 -1.592 1.00 . A A . 2 LEU HD22 1 1 17 4707 1 1 2 LEU HD23 H 4.527 -2.756 -0.311 1.00 . A A . 2 LEU HD23 1 1 17 4708 1 1 2 LEU HG H 4.423 -0.748 -1.746 1.00 . A A . 2 LEU HG 1 1 17 4709 1 1 2 LEU N N 7.313 0.089 -3.503 1.00 . A A . 2 LEU N 1 1 17 4710 1 1 2 LEU O O 9.427 -0.322 -1.799 1.00 . A A . 2 LEU O 1 1 17 4711 1 1 3 PRO C C 10.247 -0.249 1.254 1.00 . A A . 3 PRO C 1 1 17 4712 1 1 3 PRO CA C 9.605 1.036 0.705 1.00 . A A . 3 PRO CA 1 1 17 4713 1 1 3 PRO CB C 9.160 2.012 1.806 1.00 . A A . 3 PRO CB 1 1 17 4714 1 1 3 PRO CD C 7.198 1.241 0.623 1.00 . A A . 3 PRO CD 1 1 17 4715 1 1 3 PRO CG C 7.670 1.756 1.985 1.00 . A A . 3 PRO CG 1 1 17 4716 1 1 3 PRO HA H 10.340 1.533 0.070 1.00 . A A . 3 PRO HA 1 1 17 4717 1 1 3 PRO HB2 H 9.719 1.909 2.738 1.00 . A A . 3 PRO HB2 1 1 17 4718 1 1 3 PRO HB3 H 9.311 3.036 1.460 1.00 . A A . 3 PRO HB3 1 1 17 4719 1 1 3 PRO HD2 H 6.440 0.463 0.739 1.00 . A A . 3 PRO HD2 1 1 17 4720 1 1 3 PRO HD3 H 6.756 2.065 0.058 1.00 . A A . 3 PRO HD3 1 1 17 4721 1 1 3 PRO HG2 H 7.514 0.992 2.747 1.00 . A A . 3 PRO HG2 1 1 17 4722 1 1 3 PRO HG3 H 7.129 2.646 2.309 1.00 . A A . 3 PRO HG3 1 1 17 4723 1 1 3 PRO N N 8.392 0.753 -0.078 1.00 . A A . 3 PRO N 1 1 17 4724 1 1 3 PRO O O 11.304 -0.649 0.764 1.00 . A A . 3 PRO O 1 1 17 4725 1 1 4 TRP C C 8.942 -3.215 1.641 1.00 . A A . 4 TRP C 1 1 17 4726 1 1 4 TRP CA C 9.842 -2.333 2.531 1.00 . A A . 4 TRP CA 1 1 17 4727 1 1 4 TRP CB C 9.494 -2.588 4.011 1.00 . A A . 4 TRP CB 1 1 17 4728 1 1 4 TRP CD1 C 11.261 -4.286 4.639 1.00 . A A . 4 TRP CD1 1 1 17 4729 1 1 4 TRP CD2 C 9.180 -5.096 4.889 1.00 . A A . 4 TRP CD2 1 1 17 4730 1 1 4 TRP CE2 C 10.082 -6.155 5.213 1.00 . A A . 4 TRP CE2 1 1 17 4731 1 1 4 TRP CE3 C 7.797 -5.381 4.991 1.00 . A A . 4 TRP CE3 1 1 17 4732 1 1 4 TRP CG C 9.964 -3.922 4.513 1.00 . A A . 4 TRP CG 1 1 17 4733 1 1 4 TRP CH2 C 8.260 -7.673 5.710 1.00 . A A . 4 TRP CH2 1 1 17 4734 1 1 4 TRP CZ2 C 9.641 -7.427 5.612 1.00 . A A . 4 TRP CZ2 1 1 17 4735 1 1 4 TRP CZ3 C 7.342 -6.652 5.402 1.00 . A A . 4 TRP CZ3 1 1 17 4736 1 1 4 TRP H H 8.683 -0.570 2.481 1.00 . A A . 4 TRP H 1 1 17 4737 1 1 4 TRP HA H 10.891 -2.574 2.356 1.00 . A A . 4 TRP HA 1 1 17 4738 1 1 4 TRP HB2 H 9.968 -1.829 4.635 1.00 . A A . 4 TRP HB2 1 1 17 4739 1 1 4 TRP HB3 H 8.421 -2.500 4.189 1.00 . A A . 4 TRP HB3 1 1 17 4740 1 1 4 TRP HD1 H 12.104 -3.641 4.431 1.00 . A A . 4 TRP HD1 1 1 17 4741 1 1 4 TRP HE1 H 12.203 -6.088 5.213 1.00 . A A . 4 TRP HE1 1 1 17 4742 1 1 4 TRP HE3 H 7.078 -4.607 4.770 1.00 . A A . 4 TRP HE3 1 1 17 4743 1 1 4 TRP HH2 H 7.913 -8.644 6.034 1.00 . A A . 4 TRP HH2 1 1 17 4744 1 1 4 TRP HZ2 H 10.349 -8.207 5.849 1.00 . A A . 4 TRP HZ2 1 1 17 4745 1 1 4 TRP HZ3 H 6.281 -6.840 5.494 1.00 . A A . 4 TRP HZ3 1 1 17 4746 1 1 4 TRP N N 9.573 -0.938 2.182 1.00 . A A . 4 TRP N 1 1 17 4747 1 1 4 TRP NE1 N 11.332 -5.602 5.039 1.00 . A A . 4 TRP NE1 1 1 17 4748 1 1 4 TRP O O 7.988 -2.728 1.034 1.00 . A A . 4 TRP O 1 1 17 4749 1 1 5 LYS C C 8.789 -6.852 1.325 1.00 . A A . 5 LYS C 1 1 17 4750 1 1 5 LYS CA C 8.560 -5.475 0.697 1.00 . A A . 5 LYS CA 1 1 17 4751 1 1 5 LYS CB C 8.903 -5.376 -0.817 1.00 . A A . 5 LYS CB 1 1 17 4752 1 1 5 LYS CD C 11.066 -4.357 -1.878 1.00 . A A . 5 LYS CD 1 1 17 4753 1 1 5 LYS CE C 11.175 -3.163 -0.921 1.00 . A A . 5 LYS CE 1 1 17 4754 1 1 5 LYS CG C 10.394 -5.572 -1.202 1.00 . A A . 5 LYS CG 1 1 17 4755 1 1 5 LYS H H 10.013 -4.892 2.080 1.00 . A A . 5 LYS H 1 1 17 4756 1 1 5 LYS HA H 7.494 -5.259 0.804 1.00 . A A . 5 LYS HA 1 1 17 4757 1 1 5 LYS HB2 H 8.319 -6.137 -1.337 1.00 . A A . 5 LYS HB2 1 1 17 4758 1 1 5 LYS HB3 H 8.527 -4.430 -1.208 1.00 . A A . 5 LYS HB3 1 1 17 4759 1 1 5 LYS HD2 H 12.063 -4.658 -2.202 1.00 . A A . 5 LYS HD2 1 1 17 4760 1 1 5 LYS HD3 H 10.516 -4.083 -2.778 1.00 . A A . 5 LYS HD3 1 1 17 4761 1 1 5 LYS HE2 H 10.179 -2.792 -0.693 1.00 . A A . 5 LYS HE2 1 1 17 4762 1 1 5 LYS HE3 H 11.638 -3.468 0.019 1.00 . A A . 5 LYS HE3 1 1 17 4763 1 1 5 LYS HG2 H 10.985 -5.869 -0.333 1.00 . A A . 5 LYS HG2 1 1 17 4764 1 1 5 LYS HG3 H 10.464 -6.423 -1.881 1.00 . A A . 5 LYS HG3 1 1 17 4765 1 1 5 LYS HZ1 H 12.878 -2.254 -1.691 1.00 . A A . 5 LYS HZ1 1 1 17 4766 1 1 5 LYS HZ2 H 11.925 -1.331 -0.697 1.00 . A A . 5 LYS HZ2 1 1 17 4767 1 1 5 LYS HZ3 H 11.431 -1.594 -2.228 1.00 . A A . 5 LYS HZ3 1 1 17 4768 1 1 5 LYS N N 9.291 -4.495 1.483 1.00 . A A . 5 LYS N 1 1 17 4769 1 1 5 LYS NZ N 11.925 -2.017 -1.457 1.00 . A A . 5 LYS NZ 1 1 17 4770 1 1 5 LYS O O 9.931 -7.176 1.635 1.00 . A A . 5 LYS O 1 1 17 4771 1 1 6 TRP C C 8.115 -9.940 0.879 1.00 . A A . 6 TRP C 1 1 17 4772 1 1 6 TRP CA C 7.781 -8.995 2.049 1.00 . A A . 6 TRP CA 1 1 17 4773 1 1 6 TRP CB C 6.397 -9.345 2.670 1.00 . A A . 6 TRP CB 1 1 17 4774 1 1 6 TRP CD1 C 5.626 -9.864 5.011 1.00 . A A . 6 TRP CD1 1 1 17 4775 1 1 6 TRP CD2 C 7.060 -11.425 4.264 1.00 . A A . 6 TRP CD2 1 1 17 4776 1 1 6 TRP CE2 C 6.694 -11.790 5.597 1.00 . A A . 6 TRP CE2 1 1 17 4777 1 1 6 TRP CE3 C 7.958 -12.296 3.599 1.00 . A A . 6 TRP CE3 1 1 17 4778 1 1 6 TRP CG C 6.369 -10.175 3.923 1.00 . A A . 6 TRP CG 1 1 17 4779 1 1 6 TRP CH2 C 8.087 -13.771 5.545 1.00 . A A . 6 TRP CH2 1 1 17 4780 1 1 6 TRP CZ2 C 7.195 -12.937 6.238 1.00 . A A . 6 TRP CZ2 1 1 17 4781 1 1 6 TRP CZ3 C 8.465 -13.451 4.228 1.00 . A A . 6 TRP CZ3 1 1 17 4782 1 1 6 TRP H H 6.815 -7.266 1.273 1.00 . A A . 6 TRP H 1 1 17 4783 1 1 6 TRP HA H 8.559 -9.055 2.816 1.00 . A A . 6 TRP HA 1 1 17 4784 1 1 6 TRP HB2 H 5.884 -8.417 2.929 1.00 . A A . 6 TRP HB2 1 1 17 4785 1 1 6 TRP HB3 H 5.725 -9.840 1.970 1.00 . A A . 6 TRP HB3 1 1 17 4786 1 1 6 TRP HD1 H 4.989 -8.995 5.088 1.00 . A A . 6 TRP HD1 1 1 17 4787 1 1 6 TRP HE1 H 5.372 -10.751 6.902 1.00 . A A . 6 TRP HE1 1 1 17 4788 1 1 6 TRP HE3 H 8.274 -12.084 2.590 1.00 . A A . 6 TRP HE3 1 1 17 4789 1 1 6 TRP HH2 H 8.485 -14.655 6.026 1.00 . A A . 6 TRP HH2 1 1 17 4790 1 1 6 TRP HZ2 H 6.905 -13.172 7.251 1.00 . A A . 6 TRP HZ2 1 1 17 4791 1 1 6 TRP HZ3 H 9.154 -14.091 3.696 1.00 . A A . 6 TRP HZ3 1 1 17 4792 1 1 6 TRP N N 7.720 -7.635 1.506 1.00 . A A . 6 TRP N 1 1 17 4793 1 1 6 TRP NE1 N 5.817 -10.809 5.994 1.00 . A A . 6 TRP NE1 1 1 17 4794 1 1 6 TRP O O 9.211 -10.485 0.811 1.00 . A A . 6 TRP O 1 1 17 4795 1 1 7 LYS C C 7.242 -12.483 -0.695 1.00 . A A . 7 LYS C 1 1 17 4796 1 1 7 LYS CA C 7.178 -11.025 -1.198 1.00 . A A . 7 LYS CA 1 1 17 4797 1 1 7 LYS CB C 8.290 -10.690 -2.235 1.00 . A A . 7 LYS CB 1 1 17 4798 1 1 7 LYS CD C 7.356 -12.507 -3.875 1.00 . A A . 7 LYS CD 1 1 17 4799 1 1 7 LYS CE C 7.301 -13.068 -5.303 1.00 . A A . 7 LYS CE 1 1 17 4800 1 1 7 LYS CG C 7.999 -11.114 -3.705 1.00 . A A . 7 LYS CG 1 1 17 4801 1 1 7 LYS H H 6.314 -9.601 0.099 1.00 . A A . 7 LYS H 1 1 17 4802 1 1 7 LYS HA H 6.216 -10.882 -1.688 1.00 . A A . 7 LYS HA 1 1 17 4803 1 1 7 LYS HB2 H 8.470 -9.614 -2.232 1.00 . A A . 7 LYS HB2 1 1 17 4804 1 1 7 LYS HB3 H 9.240 -11.120 -1.913 1.00 . A A . 7 LYS HB3 1 1 17 4805 1 1 7 LYS HD2 H 7.866 -13.230 -3.243 1.00 . A A . 7 LYS HD2 1 1 17 4806 1 1 7 LYS HD3 H 6.331 -12.461 -3.502 1.00 . A A . 7 LYS HD3 1 1 17 4807 1 1 7 LYS HE2 H 6.457 -13.760 -5.376 1.00 . A A . 7 LYS HE2 1 1 17 4808 1 1 7 LYS HE3 H 7.128 -12.285 -6.043 1.00 . A A . 7 LYS HE3 1 1 17 4809 1 1 7 LYS HG2 H 7.340 -10.372 -4.160 1.00 . A A . 7 LYS HG2 1 1 17 4810 1 1 7 LYS HG3 H 8.934 -11.062 -4.262 1.00 . A A . 7 LYS HG3 1 1 17 4811 1 1 7 LYS HZ1 H 8.348 -14.428 -6.443 1.00 . A A . 7 LYS HZ1 1 1 17 4812 1 1 7 LYS HZ2 H 8.692 -14.523 -4.893 1.00 . A A . 7 LYS HZ2 1 1 17 4813 1 1 7 LYS HZ3 H 9.323 -13.260 -5.758 1.00 . A A . 7 LYS HZ3 1 1 17 4814 1 1 7 LYS N N 7.169 -10.104 -0.060 1.00 . A A . 7 LYS N 1 1 17 4815 1 1 7 LYS NZ N 8.512 -13.840 -5.624 1.00 . A A . 7 LYS NZ 1 1 17 4816 1 1 7 LYS O O 8.298 -13.115 -0.715 1.00 . A A . 7 LYS O 1 1 17 4817 1 1 8 TRP C C 6.245 -15.289 -1.315 1.00 . A A . 8 TRP C 1 1 17 4818 1 1 8 TRP CA C 5.960 -14.479 -0.040 1.00 . A A . 8 TRP CA 1 1 17 4819 1 1 8 TRP CB C 4.559 -14.795 0.520 1.00 . A A . 8 TRP CB 1 1 17 4820 1 1 8 TRP CD1 C 4.863 -14.000 2.896 1.00 . A A . 8 TRP CD1 1 1 17 4821 1 1 8 TRP CD2 C 4.250 -16.159 2.786 1.00 . A A . 8 TRP CD2 1 1 17 4822 1 1 8 TRP CE2 C 4.438 -15.849 4.168 1.00 . A A . 8 TRP CE2 1 1 17 4823 1 1 8 TRP CE3 C 3.857 -17.482 2.473 1.00 . A A . 8 TRP CE3 1 1 17 4824 1 1 8 TRP CG C 4.539 -14.961 2.004 1.00 . A A . 8 TRP CG 1 1 17 4825 1 1 8 TRP CH2 C 3.855 -18.105 4.838 1.00 . A A . 8 TRP CH2 1 1 17 4826 1 1 8 TRP CZ2 C 4.249 -16.800 5.183 1.00 . A A . 8 TRP CZ2 1 1 17 4827 1 1 8 TRP CZ3 C 3.657 -18.445 3.485 1.00 . A A . 8 TRP CZ3 1 1 17 4828 1 1 8 TRP H H 5.246 -12.502 -0.325 1.00 . A A . 8 TRP H 1 1 17 4829 1 1 8 TRP HA H 6.711 -14.751 0.706 1.00 . A A . 8 TRP HA 1 1 17 4830 1 1 8 TRP HB2 H 3.832 -14.034 0.236 1.00 . A A . 8 TRP HB2 1 1 17 4831 1 1 8 TRP HB3 H 4.176 -15.725 0.097 1.00 . A A . 8 TRP HB3 1 1 17 4832 1 1 8 TRP HD1 H 5.154 -12.991 2.640 1.00 . A A . 8 TRP HD1 1 1 17 4833 1 1 8 TRP HE1 H 5.059 -13.977 4.988 1.00 . A A . 8 TRP HE1 1 1 17 4834 1 1 8 TRP HE3 H 3.694 -17.757 1.442 1.00 . A A . 8 TRP HE3 1 1 17 4835 1 1 8 TRP HH2 H 3.697 -18.841 5.613 1.00 . A A . 8 TRP HH2 1 1 17 4836 1 1 8 TRP HZ2 H 4.398 -16.532 6.220 1.00 . A A . 8 TRP HZ2 1 1 17 4837 1 1 8 TRP HZ3 H 3.343 -19.445 3.223 1.00 . A A . 8 TRP HZ3 1 1 17 4838 1 1 8 TRP N N 6.092 -13.047 -0.307 1.00 . A A . 8 TRP N 1 1 17 4839 1 1 8 TRP NE1 N 4.813 -14.522 4.170 1.00 . A A . 8 TRP NE1 1 1 17 4840 1 1 8 TRP O O 5.729 -14.970 -2.387 1.00 . A A . 8 TRP O 1 1 17 4841 1 1 9 THR C C 7.831 -18.541 -1.914 1.00 . A A . 9 THR C 1 1 17 4842 1 1 9 THR CA C 7.632 -17.064 -2.343 1.00 . A A . 9 THR CA 1 1 17 4843 1 1 9 THR CB C 8.832 -16.246 -2.951 1.00 . A A . 9 THR CB 1 1 17 4844 1 1 9 THR CG2 C 10.255 -16.454 -2.402 1.00 . A A . 9 THR CG2 1 1 17 4845 1 1 9 THR H H 7.534 -16.478 -0.309 1.00 . A A . 9 THR H 1 1 17 4846 1 1 9 THR HA H 6.842 -17.088 -3.095 1.00 . A A . 9 THR HA 1 1 17 4847 1 1 9 THR HB H 8.649 -15.207 -2.689 1.00 . A A . 9 THR HB 1 1 17 4848 1 1 9 THR HG21 H 10.927 -15.670 -2.754 1.00 . A A . 9 THR HG21 1 1 17 4849 1 1 9 THR HG22 H 10.700 -17.403 -2.692 1.00 . A A . 9 THR HG22 1 1 17 4850 1 1 9 THR HG23 H 10.259 -16.410 -1.311 1.00 . A A . 9 THR HG23 1 1 17 4851 1 1 9 THR N N 7.111 -16.302 -1.210 1.00 . A A . 9 THR N 1 1 17 4852 1 1 9 THR O O 8.966 -19.006 -1.854 1.00 . A A . 9 THR O 1 1 17 4853 1 1 9 THR OG1 O 8.858 -16.219 -4.395 1.00 . A A . 9 THR OG1 1 1 17 4854 1 1 10 PRO C C 7.176 -21.714 -1.999 1.00 . A A . 10 PRO C 1 1 17 4855 1 1 10 PRO CA C 6.911 -20.625 -0.941 1.00 . A A . 10 PRO CA 1 1 17 4856 1 1 10 PRO CB C 5.567 -20.873 -0.233 1.00 . A A . 10 PRO CB 1 1 17 4857 1 1 10 PRO CD C 5.355 -18.872 -1.551 1.00 . A A . 10 PRO CD 1 1 17 4858 1 1 10 PRO CG C 4.553 -20.070 -1.036 1.00 . A A . 10 PRO CG 1 1 17 4859 1 1 10 PRO HA H 7.716 -20.630 -0.203 1.00 . A A . 10 PRO HA 1 1 17 4860 1 1 10 PRO HB2 H 5.299 -21.929 -0.160 1.00 . A A . 10 PRO HB2 1 1 17 4861 1 1 10 PRO HB3 H 5.616 -20.480 0.784 1.00 . A A . 10 PRO HB3 1 1 17 4862 1 1 10 PRO HD2 H 5.026 -18.575 -2.547 1.00 . A A . 10 PRO HD2 1 1 17 4863 1 1 10 PRO HD3 H 5.199 -18.034 -0.873 1.00 . A A . 10 PRO HD3 1 1 17 4864 1 1 10 PRO HG2 H 4.196 -20.665 -1.879 1.00 . A A . 10 PRO HG2 1 1 17 4865 1 1 10 PRO HG3 H 3.680 -19.778 -0.449 1.00 . A A . 10 PRO HG3 1 1 17 4866 1 1 10 PRO N N 6.765 -19.286 -1.531 1.00 . A A . 10 PRO N 1 1 17 4867 1 1 10 PRO O O 6.356 -21.930 -2.891 1.00 . A A . 10 PRO O 1 1 17 4868 1 1 11 TRP C C 7.695 -24.794 -2.324 1.00 . A A . 11 TRP C 1 1 17 4869 1 1 11 TRP CA C 8.633 -23.621 -2.670 1.00 . A A . 11 TRP CA 1 1 17 4870 1 1 11 TRP CB C 10.090 -24.032 -2.339 1.00 . A A . 11 TRP CB 1 1 17 4871 1 1 11 TRP CD1 C 10.472 -26.352 -3.324 1.00 . A A . 11 TRP CD1 1 1 17 4872 1 1 11 TRP CD2 C 11.826 -24.798 -4.213 1.00 . A A . 11 TRP CD2 1 1 17 4873 1 1 11 TRP CE2 C 12.129 -26.034 -4.862 1.00 . A A . 11 TRP CE2 1 1 17 4874 1 1 11 TRP CE3 C 12.592 -23.672 -4.594 1.00 . A A . 11 TRP CE3 1 1 17 4875 1 1 11 TRP CG C 10.748 -25.028 -3.255 1.00 . A A . 11 TRP CG 1 1 17 4876 1 1 11 TRP CH2 C 13.847 -24.994 -6.225 1.00 . A A . 11 TRP CH2 1 1 17 4877 1 1 11 TRP CZ2 C 13.118 -26.140 -5.856 1.00 . A A . 11 TRP CZ2 1 1 17 4878 1 1 11 TRP CZ3 C 13.586 -23.763 -5.591 1.00 . A A . 11 TRP CZ3 1 1 17 4879 1 1 11 TRP H H 8.991 -22.108 -1.217 1.00 . A A . 11 TRP H 1 1 17 4880 1 1 11 TRP HA H 8.546 -23.365 -3.727 1.00 . A A . 11 TRP HA 1 1 17 4881 1 1 11 TRP HB2 H 10.729 -23.150 -2.343 1.00 . A A . 11 TRP HB2 1 1 17 4882 1 1 11 TRP HB3 H 10.162 -24.426 -1.324 1.00 . A A . 11 TRP HB3 1 1 17 4883 1 1 11 TRP HD1 H 9.725 -26.854 -2.726 1.00 . A A . 11 TRP HD1 1 1 17 4884 1 1 11 TRP HE1 H 11.249 -27.928 -4.500 1.00 . A A . 11 TRP HE1 1 1 17 4885 1 1 11 TRP HE3 H 12.418 -22.725 -4.104 1.00 . A A . 11 TRP HE3 1 1 17 4886 1 1 11 TRP HH2 H 14.613 -25.061 -6.985 1.00 . A A . 11 TRP HH2 1 1 17 4887 1 1 11 TRP HZ2 H 13.322 -27.088 -6.328 1.00 . A A . 11 TRP HZ2 1 1 17 4888 1 1 11 TRP HZ3 H 14.156 -22.888 -5.866 1.00 . A A . 11 TRP HZ3 1 1 17 4889 1 1 11 TRP N N 8.284 -22.454 -1.849 1.00 . A A . 11 TRP N 1 1 17 4890 1 1 11 TRP NE1 N 11.275 -26.944 -4.276 1.00 . A A . 11 TRP NE1 1 1 17 4891 1 1 11 TRP O O 7.159 -25.480 -3.192 1.00 . A A . 11 TRP O 1 1 17 4892 1 1 12 ARG C C 5.173 -25.649 -0.471 1.00 . A A . 12 ARG C 1 1 17 4893 1 1 12 ARG CA C 6.660 -26.082 -0.451 1.00 . A A . 12 ARG CA 1 1 17 4894 1 1 12 ARG CB C 7.204 -26.308 0.987 1.00 . A A . 12 ARG CB 1 1 17 4895 1 1 12 ARG CD C 5.590 -27.861 2.342 1.00 . A A . 12 ARG CD 1 1 17 4896 1 1 12 ARG CG C 6.942 -27.692 1.625 1.00 . A A . 12 ARG CG 1 1 17 4897 1 1 12 ARG CZ C 5.665 -30.009 3.692 1.00 . A A . 12 ARG CZ 1 1 17 4898 1 1 12 ARG H H 7.863 -24.327 -0.393 1.00 . A A . 12 ARG H 1 1 17 4899 1 1 12 ARG HA H 6.786 -26.984 -1.049 1.00 . A A . 12 ARG HA 1 1 17 4900 1 1 12 ARG HB2 H 8.292 -26.216 0.942 1.00 . A A . 12 ARG HB2 1 1 17 4901 1 1 12 ARG HB3 H 6.892 -25.511 1.663 1.00 . A A . 12 ARG HB3 1 1 17 4902 1 1 12 ARG HD2 H 5.226 -26.888 2.675 1.00 . A A . 12 ARG HD2 1 1 17 4903 1 1 12 ARG HD3 H 4.823 -28.260 1.676 1.00 . A A . 12 ARG HD3 1 1 17 4904 1 1 12 ARG HE H 5.890 -28.100 4.387 1.00 . A A . 12 ARG HE 1 1 17 4905 1 1 12 ARG HG2 H 7.065 -28.470 0.868 1.00 . A A . 12 ARG HG2 1 1 17 4906 1 1 12 ARG HG3 H 7.745 -27.871 2.343 1.00 . A A . 12 ARG HG3 1 1 17 4907 1 1 12 ARG HH11 H 5.346 -30.380 1.708 1.00 . A A . 12 ARG HH11 1 1 17 4908 1 1 12 ARG HH12 H 5.430 -31.795 2.678 1.00 . A A . 12 ARG HH12 1 1 17 4909 1 1 12 ARG HH21 H 5.970 -30.018 5.731 1.00 . A A . 12 ARG HH21 1 1 17 4910 1 1 12 ARG HH22 H 5.775 -31.571 5.041 1.00 . A A . 12 ARG HH22 1 1 17 4911 1 1 12 ARG N N 7.453 -24.997 -1.023 1.00 . A A . 12 ARG N 1 1 17 4912 1 1 12 ARG NE N 5.729 -28.674 3.567 1.00 . A A . 12 ARG NE 1 1 17 4913 1 1 12 ARG NH1 N 5.465 -30.787 2.624 1.00 . A A . 12 ARG NH1 1 1 17 4914 1 1 12 ARG NH2 N 5.813 -30.569 4.895 1.00 . A A . 12 ARG NH2 1 1 17 4915 1 1 12 ARG O O 4.541 -25.573 0.579 1.00 . A A . 12 ARG O 1 1 17 4916 1 1 13 ARG C C 2.098 -24.813 -1.438 1.00 . A A . 13 ARG C 1 1 17 4917 1 1 13 ARG CA C 3.450 -24.688 -2.182 1.00 . A A . 13 ARG CA 1 1 17 4918 1 1 13 ARG CB C 3.364 -24.873 -3.719 1.00 . A A . 13 ARG CB 1 1 17 4919 1 1 13 ARG CD C 1.593 -26.720 -4.155 1.00 . A A . 13 ARG CD 1 1 17 4920 1 1 13 ARG CG C 3.076 -26.300 -4.251 1.00 . A A . 13 ARG CG 1 1 17 4921 1 1 13 ARG CZ C 0.009 -28.366 -5.172 1.00 . A A . 13 ARG CZ 1 1 17 4922 1 1 13 ARG H H 5.399 -25.413 -2.398 1.00 . A A . 13 ARG H 1 1 17 4923 1 1 13 ARG HA H 3.669 -23.626 -2.053 1.00 . A A . 13 ARG HA 1 1 17 4924 1 1 13 ARG HB2 H 2.619 -24.187 -4.126 1.00 . A A . 13 ARG HB2 1 1 17 4925 1 1 13 ARG HB3 H 4.305 -24.530 -4.152 1.00 . A A . 13 ARG HB3 1 1 17 4926 1 1 13 ARG HD2 H 1.348 -27.002 -3.131 1.00 . A A . 13 ARG HD2 1 1 17 4927 1 1 13 ARG HD3 H 0.956 -25.875 -4.427 1.00 . A A . 13 ARG HD3 1 1 17 4928 1 1 13 ARG HE H 2.014 -28.181 -5.604 1.00 . A A . 13 ARG HE 1 1 17 4929 1 1 13 ARG HG2 H 3.384 -26.329 -5.298 1.00 . A A . 13 ARG HG2 1 1 17 4930 1 1 13 ARG HG3 H 3.710 -27.020 -3.734 1.00 . A A . 13 ARG HG3 1 1 17 4931 1 1 13 ARG HH11 H -0.870 -27.079 -3.844 1.00 . A A . 13 ARG HH11 1 1 17 4932 1 1 13 ARG HH12 H -1.957 -28.217 -4.531 1.00 . A A . 13 ARG HH12 1 1 17 4933 1 1 13 ARG HH21 H 0.537 -29.773 -6.580 1.00 . A A . 13 ARG HH21 1 1 17 4934 1 1 13 ARG HH22 H -1.118 -29.794 -6.140 1.00 . A A . 13 ARG HH22 1 1 17 4935 1 1 13 ARG N N 4.684 -25.325 -1.679 1.00 . A A . 13 ARG N 1 1 17 4936 1 1 13 ARG NE N 1.241 -27.845 -5.043 1.00 . A A . 13 ARG NE 1 1 17 4937 1 1 13 ARG NH1 N -1.010 -27.870 -4.462 1.00 . A A . 13 ARG NH1 1 1 17 4938 1 1 13 ARG NH2 N -0.203 -29.383 -6.010 1.00 . A A . 13 ARG NH2 1 1 17 4939 1 1 13 ARG O O 1.041 -24.703 -2.050 1.00 . A A . 13 ARG O 1 1 17 4940 1 1 14 NH2 HN1 H 1.193 -25.048 0.348 1.00 . A A . 14 NH2 HN1 1 1 17 4941 1 1 14 NH2 HN2 H 2.966 -25.173 0.343 1.00 . A A . 14 NH2 HN2 1 1 17 4942 1 1 14 NH2 N N 2.073 -25.052 -0.141 1.00 . A A . 14 NH2 N 1 1 17 4943 2 2 1 . C1 C 8.787 -17.432 -5.122 1.00 . B A . 101 BGC C1 1 1 17 4944 2 2 1 . C2 C 9.057 -17.107 -6.604 1.00 . B A . 101 BGC C2 1 1 17 4945 2 2 1 . C3 C 8.909 -18.376 -7.431 1.00 . B A . 101 BGC C3 1 1 17 4946 2 2 1 . C4 C 9.905 -19.414 -6.912 1.00 . B A . 101 BGC C4 1 1 17 4947 2 2 1 . C5 C 9.662 -19.664 -5.401 1.00 . B A . 101 BGC C5 1 1 17 4948 2 2 1 . C6 C 10.736 -20.553 -4.764 1.00 . B A . 101 BGC C6 1 1 17 4949 2 2 1 . H1 H 7.784 -17.854 -4.967 1.00 . B A . 101 BGC H1 1 1 17 4950 2 2 1 . H2 H 10.082 -16.736 -6.692 1.00 . B A . 101 BGC H2 1 1 17 4951 2 2 1 . H3 H 7.890 -18.763 -7.344 1.00 . B A . 101 BGC H3 1 1 17 4952 2 2 1 . H4 H 10.918 -19.026 -7.041 1.00 . B A . 101 BGC H4 1 1 17 4953 2 2 1 . H5 H 8.679 -20.111 -5.244 1.00 . B A . 101 BGC H5 1 1 17 4954 2 2 1 . H6 H 10.237 -19.919 -2.971 1.00 . B A . 101 BGC H6 1 1 17 4955 2 2 1 . H6C1 H 11.721 -20.095 -4.856 1.00 . B A . 101 BGC H6C1 1 1 17 4956 2 2 1 . H6C2 H 10.780 -21.513 -5.278 1.00 . B A . 101 BGC H6C2 1 1 17 4957 2 2 1 . HB H 8.162 -16.301 -8.075 1.00 . B A . 101 BGC HB 1 1 17 4958 2 2 1 . HC H 9.341 -18.923 -9.241 1.00 . B A . 101 BGC HC 1 1 17 4959 2 2 1 . HD H 8.953 -21.049 -7.490 1.00 . B A . 101 BGC HD 1 1 17 4960 2 2 1 . O2 O 8.174 -16.109 -7.114 1.00 . B A . 101 BGC O2 1 1 17 4961 2 2 1 . O3 O 9.160 -18.074 -8.797 1.00 . B A . 101 BGC O3 1 1 17 4962 2 2 1 . O4 O 9.791 -20.604 -7.688 1.00 . B A . 101 BGC O4 1 1 17 4963 2 2 1 . O5 O 9.718 -18.401 -4.707 1.00 . B A . 101 BGC O5 1 1 17 4964 2 2 1 . O6 O 10.450 -20.776 -3.388 1.00 . B A . 101 BGC O6 1 1 18 4965 1 1 1 ILE C C 3.322 -2.359 1.185 1.00 . A A . 1 ILE C 1 1 18 4966 1 1 1 ILE CA C 2.751 -2.700 2.568 1.00 . A A . 1 ILE CA 1 1 18 4967 1 1 1 ILE CB C 2.822 -4.227 2.876 1.00 . A A . 1 ILE CB 1 1 18 4968 1 1 1 ILE CD1 C 0.557 -5.087 3.824 1.00 . A A . 1 ILE CD1 1 1 18 4969 1 1 1 ILE CG1 C 1.996 -4.632 4.127 1.00 . A A . 1 ILE CG1 1 1 18 4970 1 1 1 ILE CG2 C 4.274 -4.728 3.039 1.00 . A A . 1 ILE CG2 1 1 18 4971 1 1 1 ILE H1 H 0.999 -2.534 1.647 1.00 . A A . 1 ILE H1 1 1 18 4972 1 1 1 ILE HA H 3.289 -2.142 3.337 1.00 . A A . 1 ILE HA 1 1 18 4973 1 1 1 ILE HB H 2.416 -4.774 2.022 1.00 . A A . 1 ILE HB 1 1 18 4974 1 1 1 ILE HD11 H 0.553 -5.940 3.142 1.00 . A A . 1 ILE HD11 1 1 18 4975 1 1 1 ILE HD12 H 0.065 -5.419 4.740 1.00 . A A . 1 ILE HD12 1 1 18 4976 1 1 1 ILE HD13 H -0.070 -4.313 3.388 1.00 . A A . 1 ILE HD13 1 1 18 4977 1 1 1 ILE HG12 H 2.478 -5.477 4.623 1.00 . A A . 1 ILE HG12 1 1 18 4978 1 1 1 ILE HG13 H 2.002 -3.839 4.876 1.00 . A A . 1 ILE HG13 1 1 18 4979 1 1 1 ILE HG21 H 4.866 -4.600 2.133 1.00 . A A . 1 ILE HG21 1 1 18 4980 1 1 1 ILE HG22 H 4.790 -4.219 3.854 1.00 . A A . 1 ILE HG22 1 1 18 4981 1 1 1 ILE HG23 H 4.298 -5.797 3.260 1.00 . A A . 1 ILE HG23 1 1 18 4982 1 1 1 ILE N N 1.353 -2.234 2.549 1.00 . A A . 1 ILE N 1 1 18 4983 1 1 1 ILE O O 2.532 -2.293 0.246 1.00 . A A . 1 ILE O 1 1 18 4984 1 1 2 LEU C C 6.661 -2.681 -0.117 1.00 . A A . 2 LEU C 1 1 18 4985 1 1 2 LEU CA C 5.322 -1.927 -0.223 1.00 . A A . 2 LEU CA 1 1 18 4986 1 1 2 LEU CB C 5.463 -0.407 -0.486 1.00 . A A . 2 LEU CB 1 1 18 4987 1 1 2 LEU CD1 C 5.435 1.516 -2.129 1.00 . A A . 2 LEU CD1 1 1 18 4988 1 1 2 LEU CD2 C 7.058 -0.364 -2.517 1.00 . A A . 2 LEU CD2 1 1 18 4989 1 1 2 LEU CG C 5.672 0.006 -1.962 1.00 . A A . 2 LEU CG 1 1 18 4990 1 1 2 LEU H H 5.264 -2.224 1.840 1.00 . A A . 2 LEU H 1 1 18 4991 1 1 2 LEU HA H 4.711 -2.344 -1.022 1.00 . A A . 2 LEU HA 1 1 18 4992 1 1 2 LEU HB2 H 4.551 0.081 -0.141 1.00 . A A . 2 LEU HB2 1 1 18 4993 1 1 2 LEU HB3 H 6.262 0.010 0.130 1.00 . A A . 2 LEU HB3 1 1 18 4994 1 1 2 LEU HD11 H 4.437 1.805 -1.796 1.00 . A A . 2 LEU HD11 1 1 18 4995 1 1 2 LEU HD12 H 5.524 1.817 -3.174 1.00 . A A . 2 LEU HD12 1 1 18 4996 1 1 2 LEU HD13 H 6.158 2.097 -1.557 1.00 . A A . 2 LEU HD13 1 1 18 4997 1 1 2 LEU HD21 H 7.184 -1.436 -2.644 1.00 . A A . 2 LEU HD21 1 1 18 4998 1 1 2 LEU HD22 H 7.855 -0.011 -1.865 1.00 . A A . 2 LEU HD22 1 1 18 4999 1 1 2 LEU HD23 H 7.220 0.080 -3.500 1.00 . A A . 2 LEU HD23 1 1 18 5000 1 1 2 LEU HG H 4.920 -0.498 -2.571 1.00 . A A . 2 LEU HG 1 1 18 5001 1 1 2 LEU N N 4.635 -2.143 1.050 1.00 . A A . 2 LEU N 1 1 18 5002 1 1 2 LEU O O 7.391 -2.429 0.845 1.00 . A A . 2 LEU O 1 1 18 5003 1 1 3 PRO C C 9.395 -3.474 -1.591 1.00 . A A . 3 PRO C 1 1 18 5004 1 1 3 PRO CA C 8.273 -4.341 -0.984 1.00 . A A . 3 PRO CA 1 1 18 5005 1 1 3 PRO CB C 8.010 -5.618 -1.805 1.00 . A A . 3 PRO CB 1 1 18 5006 1 1 3 PRO CD C 6.129 -4.147 -2.090 1.00 . A A . 3 PRO CD 1 1 18 5007 1 1 3 PRO CG C 6.953 -5.210 -2.821 1.00 . A A . 3 PRO CG 1 1 18 5008 1 1 3 PRO HA H 8.549 -4.619 0.034 1.00 . A A . 3 PRO HA 1 1 18 5009 1 1 3 PRO HB2 H 8.906 -6.032 -2.273 1.00 . A A . 3 PRO HB2 1 1 18 5010 1 1 3 PRO HB3 H 7.607 -6.391 -1.151 1.00 . A A . 3 PRO HB3 1 1 18 5011 1 1 3 PRO HD2 H 5.808 -3.367 -2.782 1.00 . A A . 3 PRO HD2 1 1 18 5012 1 1 3 PRO HD3 H 5.239 -4.599 -1.650 1.00 . A A . 3 PRO HD3 1 1 18 5013 1 1 3 PRO HG2 H 7.437 -4.766 -3.694 1.00 . A A . 3 PRO HG2 1 1 18 5014 1 1 3 PRO HG3 H 6.350 -6.048 -3.173 1.00 . A A . 3 PRO HG3 1 1 18 5015 1 1 3 PRO N N 6.992 -3.627 -1.023 1.00 . A A . 3 PRO N 1 1 18 5016 1 1 3 PRO O O 9.729 -3.605 -2.766 1.00 . A A . 3 PRO O 1 1 18 5017 1 1 4 TRP C C 12.479 -2.585 -1.277 1.00 . A A . 4 TRP C 1 1 18 5018 1 1 4 TRP CA C 11.167 -1.761 -1.169 1.00 . A A . 4 TRP CA 1 1 18 5019 1 1 4 TRP CB C 11.324 -0.612 -0.145 1.00 . A A . 4 TRP CB 1 1 18 5020 1 1 4 TRP CD1 C 10.226 1.408 -1.195 1.00 . A A . 4 TRP CD1 1 1 18 5021 1 1 4 TRP CD2 C 9.260 0.837 0.752 1.00 . A A . 4 TRP CD2 1 1 18 5022 1 1 4 TRP CE2 C 8.590 2.008 0.280 1.00 . A A . 4 TRP CE2 1 1 18 5023 1 1 4 TRP CE3 C 8.818 0.302 1.985 1.00 . A A . 4 TRP CE3 1 1 18 5024 1 1 4 TRP CG C 10.305 0.485 -0.209 1.00 . A A . 4 TRP CG 1 1 18 5025 1 1 4 TRP CH2 C 7.140 2.066 2.224 1.00 . A A . 4 TRP CH2 1 1 18 5026 1 1 4 TRP CZ2 C 7.547 2.620 0.997 1.00 . A A . 4 TRP CZ2 1 1 18 5027 1 1 4 TRP CZ3 C 7.773 0.908 2.715 1.00 . A A . 4 TRP CZ3 1 1 18 5028 1 1 4 TRP H H 9.620 -2.460 0.133 1.00 . A A . 4 TRP H 1 1 18 5029 1 1 4 TRP HA H 10.982 -1.327 -2.154 1.00 . A A . 4 TRP HA 1 1 18 5030 1 1 4 TRP HB2 H 11.366 -1.000 0.872 1.00 . A A . 4 TRP HB2 1 1 18 5031 1 1 4 TRP HB3 H 12.277 -0.105 -0.308 1.00 . A A . 4 TRP HB3 1 1 18 5032 1 1 4 TRP HD1 H 10.878 1.441 -2.057 1.00 . A A . 4 TRP HD1 1 1 18 5033 1 1 4 TRP HE1 H 8.992 3.084 -1.515 1.00 . A A . 4 TRP HE1 1 1 18 5034 1 1 4 TRP HE3 H 9.296 -0.580 2.381 1.00 . A A . 4 TRP HE3 1 1 18 5035 1 1 4 TRP HH2 H 6.351 2.539 2.791 1.00 . A A . 4 TRP HH2 1 1 18 5036 1 1 4 TRP HZ2 H 7.071 3.512 0.617 1.00 . A A . 4 TRP HZ2 1 1 18 5037 1 1 4 TRP HZ3 H 7.468 0.489 3.663 1.00 . A A . 4 TRP HZ3 1 1 18 5038 1 1 4 TRP N N 10.016 -2.597 -0.788 1.00 . A A . 4 TRP N 1 1 18 5039 1 1 4 TRP NE1 N 9.209 2.297 -0.916 1.00 . A A . 4 TRP NE1 1 1 18 5040 1 1 4 TRP O O 13.497 -2.253 -0.658 1.00 . A A . 4 TRP O 1 1 18 5041 1 1 5 LYS C C 12.636 -6.007 -2.638 1.00 . A A . 5 LYS C 1 1 18 5042 1 1 5 LYS CA C 13.408 -4.691 -2.444 1.00 . A A . 5 LYS CA 1 1 18 5043 1 1 5 LYS CB C 14.589 -4.895 -1.456 1.00 . A A . 5 LYS CB 1 1 18 5044 1 1 5 LYS CD C 15.425 -5.182 0.986 1.00 . A A . 5 LYS CD 1 1 18 5045 1 1 5 LYS CE C 16.181 -3.835 1.028 1.00 . A A . 5 LYS CE 1 1 18 5046 1 1 5 LYS CG C 14.233 -5.257 0.007 1.00 . A A . 5 LYS CG 1 1 18 5047 1 1 5 LYS H H 11.493 -3.871 -2.413 1.00 . A A . 5 LYS H 1 1 18 5048 1 1 5 LYS HA H 13.800 -4.373 -3.412 1.00 . A A . 5 LYS HA 1 1 18 5049 1 1 5 LYS HB2 H 15.244 -5.673 -1.852 1.00 . A A . 5 LYS HB2 1 1 18 5050 1 1 5 LYS HB3 H 15.189 -3.988 -1.496 1.00 . A A . 5 LYS HB3 1 1 18 5051 1 1 5 LYS HD2 H 15.069 -5.432 1.987 1.00 . A A . 5 LYS HD2 1 1 18 5052 1 1 5 LYS HD3 H 16.137 -5.969 0.730 1.00 . A A . 5 LYS HD3 1 1 18 5053 1 1 5 LYS HE2 H 16.934 -3.868 1.818 1.00 . A A . 5 LYS HE2 1 1 18 5054 1 1 5 LYS HE3 H 16.730 -3.671 0.100 1.00 . A A . 5 LYS HE3 1 1 18 5055 1 1 5 LYS HG2 H 13.423 -4.633 0.379 1.00 . A A . 5 LYS HG2 1 1 18 5056 1 1 5 LYS HG3 H 13.828 -6.271 0.029 1.00 . A A . 5 LYS HG3 1 1 18 5057 1 1 5 LYS HZ1 H 14.778 -2.800 2.131 1.00 . A A . 5 LYS HZ1 1 1 18 5058 1 1 5 LYS HZ2 H 14.621 -2.587 0.500 1.00 . A A . 5 LYS HZ2 1 1 18 5059 1 1 5 LYS HZ3 H 15.826 -1.828 1.312 1.00 . A A . 5 LYS HZ3 1 1 18 5060 1 1 5 LYS N N 12.423 -3.688 -2.030 1.00 . A A . 5 LYS N 1 1 18 5061 1 1 5 LYS NZ N 15.292 -2.684 1.272 1.00 . A A . 5 LYS NZ 1 1 18 5062 1 1 5 LYS O O 11.702 -6.300 -1.888 1.00 . A A . 5 LYS O 1 1 18 5063 1 1 6 TRP C C 12.490 -9.158 -3.122 1.00 . A A . 6 TRP C 1 1 18 5064 1 1 6 TRP CA C 12.318 -7.987 -4.100 1.00 . A A . 6 TRP CA 1 1 18 5065 1 1 6 TRP CB C 12.876 -8.422 -5.470 1.00 . A A . 6 TRP CB 1 1 18 5066 1 1 6 TRP CD1 C 13.736 -6.797 -7.215 1.00 . A A . 6 TRP CD1 1 1 18 5067 1 1 6 TRP CD2 C 11.492 -6.936 -7.194 1.00 . A A . 6 TRP CD2 1 1 18 5068 1 1 6 TRP CE2 C 11.841 -5.996 -8.210 1.00 . A A . 6 TRP CE2 1 1 18 5069 1 1 6 TRP CE3 C 10.112 -7.194 -7.006 1.00 . A A . 6 TRP CE3 1 1 18 5070 1 1 6 TRP CG C 12.722 -7.425 -6.577 1.00 . A A . 6 TRP CG 1 1 18 5071 1 1 6 TRP CH2 C 9.513 -5.624 -8.784 1.00 . A A . 6 TRP CH2 1 1 18 5072 1 1 6 TRP CZ2 C 10.875 -5.345 -8.998 1.00 . A A . 6 TRP CZ2 1 1 18 5073 1 1 6 TRP CZ3 C 9.134 -6.547 -7.790 1.00 . A A . 6 TRP CZ3 1 1 18 5074 1 1 6 TRP H H 13.787 -6.478 -4.231 1.00 . A A . 6 TRP H 1 1 18 5075 1 1 6 TRP HA H 11.256 -7.751 -4.196 1.00 . A A . 6 TRP HA 1 1 18 5076 1 1 6 TRP HB2 H 13.934 -8.679 -5.378 1.00 . A A . 6 TRP HB2 1 1 18 5077 1 1 6 TRP HB3 H 12.379 -9.334 -5.802 1.00 . A A . 6 TRP HB3 1 1 18 5078 1 1 6 TRP HD1 H 14.785 -6.951 -7.003 1.00 . A A . 6 TRP HD1 1 1 18 5079 1 1 6 TRP HE1 H 13.793 -5.399 -8.798 1.00 . A A . 6 TRP HE1 1 1 18 5080 1 1 6 TRP HE3 H 9.800 -7.903 -6.256 1.00 . A A . 6 TRP HE3 1 1 18 5081 1 1 6 TRP HH2 H 8.760 -5.134 -9.385 1.00 . A A . 6 TRP HH2 1 1 18 5082 1 1 6 TRP HZ2 H 11.170 -4.642 -9.763 1.00 . A A . 6 TRP HZ2 1 1 18 5083 1 1 6 TRP HZ3 H 8.086 -6.762 -7.633 1.00 . A A . 6 TRP HZ3 1 1 18 5084 1 1 6 TRP N N 13.015 -6.781 -3.660 1.00 . A A . 6 TRP N 1 1 18 5085 1 1 6 TRP NE1 N 13.218 -5.951 -8.174 1.00 . A A . 6 TRP NE1 1 1 18 5086 1 1 6 TRP O O 13.529 -9.313 -2.478 1.00 . A A . 6 TRP O 1 1 18 5087 1 1 7 LYS C C 10.906 -12.358 -3.243 1.00 . A A . 7 LYS C 1 1 18 5088 1 1 7 LYS CA C 11.431 -11.261 -2.315 1.00 . A A . 7 LYS CA 1 1 18 5089 1 1 7 LYS CB C 10.633 -11.075 -1.000 1.00 . A A . 7 LYS CB 1 1 18 5090 1 1 7 LYS CD C 11.923 -11.625 1.186 1.00 . A A . 7 LYS CD 1 1 18 5091 1 1 7 LYS CE C 12.897 -12.667 0.607 1.00 . A A . 7 LYS CE 1 1 18 5092 1 1 7 LYS CG C 11.471 -10.543 0.183 1.00 . A A . 7 LYS CG 1 1 18 5093 1 1 7 LYS H H 10.666 -9.830 -3.647 1.00 . A A . 7 LYS H 1 1 18 5094 1 1 7 LYS HA H 12.446 -11.568 -2.058 1.00 . A A . 7 LYS HA 1 1 18 5095 1 1 7 LYS HB2 H 9.801 -10.395 -1.190 1.00 . A A . 7 LYS HB2 1 1 18 5096 1 1 7 LYS HB3 H 10.155 -12.009 -0.702 1.00 . A A . 7 LYS HB3 1 1 18 5097 1 1 7 LYS HD2 H 12.390 -11.124 2.036 1.00 . A A . 7 LYS HD2 1 1 18 5098 1 1 7 LYS HD3 H 11.038 -12.125 1.584 1.00 . A A . 7 LYS HD3 1 1 18 5099 1 1 7 LYS HE2 H 12.427 -13.205 -0.216 1.00 . A A . 7 LYS HE2 1 1 18 5100 1 1 7 LYS HE3 H 13.781 -12.177 0.196 1.00 . A A . 7 LYS HE3 1 1 18 5101 1 1 7 LYS HG2 H 12.324 -9.963 -0.173 1.00 . A A . 7 LYS HG2 1 1 18 5102 1 1 7 LYS HG3 H 10.854 -9.827 0.729 1.00 . A A . 7 LYS HG3 1 1 18 5103 1 1 7 LYS HZ1 H 13.919 -13.215 2.311 1.00 . A A . 7 LYS HZ1 1 1 18 5104 1 1 7 LYS HZ2 H 13.797 -14.424 1.195 1.00 . A A . 7 LYS HZ2 1 1 18 5105 1 1 7 LYS HZ3 H 12.502 -14.020 2.131 1.00 . A A . 7 LYS HZ3 1 1 18 5106 1 1 7 LYS N N 11.474 -10.022 -3.072 1.00 . A A . 7 LYS N 1 1 18 5107 1 1 7 LYS NZ N 13.317 -13.648 1.627 1.00 . A A . 7 LYS NZ 1 1 18 5108 1 1 7 LYS O O 9.761 -12.786 -3.122 1.00 . A A . 7 LYS O 1 1 18 5109 1 1 8 TRP C C 11.668 -15.221 -4.202 1.00 . A A . 8 TRP C 1 1 18 5110 1 1 8 TRP CA C 11.482 -13.951 -5.052 1.00 . A A . 8 TRP CA 1 1 18 5111 1 1 8 TRP CB C 12.482 -13.910 -6.227 1.00 . A A . 8 TRP CB 1 1 18 5112 1 1 8 TRP CD1 C 11.372 -14.849 -8.303 1.00 . A A . 8 TRP CD1 1 1 18 5113 1 1 8 TRP CD2 C 13.005 -16.184 -7.527 1.00 . A A . 8 TRP CD2 1 1 18 5114 1 1 8 TRP CE2 C 12.489 -16.801 -8.707 1.00 . A A . 8 TRP CE2 1 1 18 5115 1 1 8 TRP CE3 C 14.062 -16.853 -6.867 1.00 . A A . 8 TRP CE3 1 1 18 5116 1 1 8 TRP CG C 12.277 -14.936 -7.301 1.00 . A A . 8 TRP CG 1 1 18 5117 1 1 8 TRP CH2 C 14.061 -18.640 -8.536 1.00 . A A . 8 TRP CH2 1 1 18 5118 1 1 8 TRP CZ2 C 13.003 -18.007 -9.214 1.00 . A A . 8 TRP CZ2 1 1 18 5119 1 1 8 TRP CZ3 C 14.586 -18.066 -7.362 1.00 . A A . 8 TRP CZ3 1 1 18 5120 1 1 8 TRP H H 12.676 -12.415 -4.226 1.00 . A A . 8 TRP H 1 1 18 5121 1 1 8 TRP HA H 10.463 -13.902 -5.442 1.00 . A A . 8 TRP HA 1 1 18 5122 1 1 8 TRP HB2 H 12.416 -12.937 -6.713 1.00 . A A . 8 TRP HB2 1 1 18 5123 1 1 8 TRP HB3 H 13.512 -13.992 -5.873 1.00 . A A . 8 TRP HB3 1 1 18 5124 1 1 8 TRP HD1 H 10.686 -14.024 -8.437 1.00 . A A . 8 TRP HD1 1 1 18 5125 1 1 8 TRP HE1 H 10.936 -16.075 -9.965 1.00 . A A . 8 TRP HE1 1 1 18 5126 1 1 8 TRP HE3 H 14.480 -16.422 -5.969 1.00 . A A . 8 TRP HE3 1 1 18 5127 1 1 8 TRP HH2 H 14.472 -19.564 -8.918 1.00 . A A . 8 TRP HH2 1 1 18 5128 1 1 8 TRP HZ2 H 12.600 -18.441 -10.116 1.00 . A A . 8 TRP HZ2 1 1 18 5129 1 1 8 TRP HZ3 H 15.399 -18.551 -6.842 1.00 . A A . 8 TRP HZ3 1 1 18 5130 1 1 8 TRP N N 11.748 -12.808 -4.180 1.00 . A A . 8 TRP N 1 1 18 5131 1 1 8 TRP NE1 N 11.486 -15.953 -9.124 1.00 . A A . 8 TRP NE1 1 1 18 5132 1 1 8 TRP O O 12.781 -15.711 -4.024 1.00 . A A . 8 TRP O 1 1 18 5133 1 1 9 THR C C 9.128 -17.424 -2.666 1.00 . A A . 9 THR C 1 1 18 5134 1 1 9 THR CA C 10.544 -16.805 -2.651 1.00 . A A . 9 THR CA 1 1 18 5135 1 1 9 THR CB C 11.142 -16.368 -1.282 1.00 . A A . 9 THR CB 1 1 18 5136 1 1 9 THR CG2 C 10.354 -15.273 -0.511 1.00 . A A . 9 THR CG2 1 1 18 5137 1 1 9 THR H H 9.730 -15.131 -3.670 1.00 . A A . 9 THR H 1 1 18 5138 1 1 9 THR HA H 11.215 -17.573 -3.041 1.00 . A A . 9 THR HA 1 1 18 5139 1 1 9 THR HB H 12.117 -15.925 -1.487 1.00 . A A . 9 THR HB 1 1 18 5140 1 1 9 THR HG21 H 9.364 -15.586 -0.184 1.00 . A A . 9 THR HG21 1 1 18 5141 1 1 9 THR HG22 H 10.196 -14.406 -1.148 1.00 . A A . 9 THR HG22 1 1 18 5142 1 1 9 THR HG23 H 10.894 -14.920 0.363 1.00 . A A . 9 THR HG23 1 1 18 5143 1 1 9 THR N N 10.582 -15.669 -3.568 1.00 . A A . 9 THR N 1 1 18 5144 1 1 9 THR O O 8.379 -17.262 -1.699 1.00 . A A . 9 THR O 1 1 18 5145 1 1 9 THR OG1 O 11.442 -17.555 -0.515 1.00 . A A . 9 THR OG1 1 1 18 5146 1 1 10 PRO C C 6.977 -19.764 -3.148 1.00 . A A . 10 PRO C 1 1 18 5147 1 1 10 PRO CA C 7.300 -18.492 -3.956 1.00 . A A . 10 PRO CA 1 1 18 5148 1 1 10 PRO CB C 7.162 -18.713 -5.473 1.00 . A A . 10 PRO CB 1 1 18 5149 1 1 10 PRO CD C 9.489 -18.337 -4.984 1.00 . A A . 10 PRO CD 1 1 18 5150 1 1 10 PRO CG C 8.561 -19.089 -5.940 1.00 . A A . 10 PRO CG 1 1 18 5151 1 1 10 PRO HA H 6.615 -17.697 -3.652 1.00 . A A . 10 PRO HA 1 1 18 5152 1 1 10 PRO HB2 H 6.416 -19.463 -5.741 1.00 . A A . 10 PRO HB2 1 1 18 5153 1 1 10 PRO HB3 H 6.861 -17.778 -5.948 1.00 . A A . 10 PRO HB3 1 1 18 5154 1 1 10 PRO HD2 H 10.381 -18.924 -4.762 1.00 . A A . 10 PRO HD2 1 1 18 5155 1 1 10 PRO HD3 H 9.806 -17.403 -5.449 1.00 . A A . 10 PRO HD3 1 1 18 5156 1 1 10 PRO HG2 H 8.708 -20.164 -5.825 1.00 . A A . 10 PRO HG2 1 1 18 5157 1 1 10 PRO HG3 H 8.742 -18.841 -6.987 1.00 . A A . 10 PRO HG3 1 1 18 5158 1 1 10 PRO N N 8.694 -18.060 -3.780 1.00 . A A . 10 PRO N 1 1 18 5159 1 1 10 PRO O O 7.194 -20.889 -3.603 1.00 . A A . 10 PRO O 1 1 18 5160 1 1 11 TRP C C 4.542 -21.144 -1.787 1.00 . A A . 11 TRP C 1 1 18 5161 1 1 11 TRP CA C 5.868 -20.691 -1.151 1.00 . A A . 11 TRP CA 1 1 18 5162 1 1 11 TRP CB C 5.643 -20.235 0.307 1.00 . A A . 11 TRP CB 1 1 18 5163 1 1 11 TRP CD1 C 6.140 -22.100 1.957 1.00 . A A . 11 TRP CD1 1 1 18 5164 1 1 11 TRP CD2 C 3.935 -21.768 1.694 1.00 . A A . 11 TRP CD2 1 1 18 5165 1 1 11 TRP CE2 C 4.085 -22.821 2.648 1.00 . A A . 11 TRP CE2 1 1 18 5166 1 1 11 TRP CE3 C 2.611 -21.367 1.396 1.00 . A A . 11 TRP CE3 1 1 18 5167 1 1 11 TRP CG C 5.265 -21.329 1.270 1.00 . A A . 11 TRP CG 1 1 18 5168 1 1 11 TRP CH2 C 1.686 -23.018 2.943 1.00 . A A . 11 TRP CH2 1 1 18 5169 1 1 11 TRP CZ2 C 2.987 -23.440 3.270 1.00 . A A . 11 TRP CZ2 1 1 18 5170 1 1 11 TRP CZ3 C 1.500 -21.982 2.009 1.00 . A A . 11 TRP CZ3 1 1 18 5171 1 1 11 TRP H H 6.283 -18.648 -1.613 1.00 . A A . 11 TRP H 1 1 18 5172 1 1 11 TRP HA H 6.584 -21.515 -1.148 1.00 . A A . 11 TRP HA 1 1 18 5173 1 1 11 TRP HB2 H 6.564 -19.784 0.677 1.00 . A A . 11 TRP HB2 1 1 18 5174 1 1 11 TRP HB3 H 4.889 -19.448 0.364 1.00 . A A . 11 TRP HB3 1 1 18 5175 1 1 11 TRP HD1 H 7.216 -21.988 1.900 1.00 . A A . 11 TRP HD1 1 1 18 5176 1 1 11 TRP HE1 H 5.890 -23.504 3.512 1.00 . A A . 11 TRP HE1 1 1 18 5177 1 1 11 TRP HE3 H 2.446 -20.557 0.700 1.00 . A A . 11 TRP HE3 1 1 18 5178 1 1 11 TRP HH2 H 0.832 -23.474 3.425 1.00 . A A . 11 TRP HH2 1 1 18 5179 1 1 11 TRP HZ2 H 3.131 -24.223 4.001 1.00 . A A . 11 TRP HZ2 1 1 18 5180 1 1 11 TRP HZ3 H 0.502 -21.638 1.777 1.00 . A A . 11 TRP HZ3 1 1 18 5181 1 1 11 TRP N N 6.401 -19.593 -1.951 1.00 . A A . 11 TRP N 1 1 18 5182 1 1 11 TRP NE1 N 5.450 -22.999 2.750 1.00 . A A . 11 TRP NE1 1 1 18 5183 1 1 11 TRP O O 3.497 -20.527 -1.596 1.00 . A A . 11 TRP O 1 1 18 5184 1 1 12 ARG C C 2.382 -23.287 -2.157 1.00 . A A . 12 ARG C 1 1 18 5185 1 1 12 ARG CA C 3.475 -22.924 -3.185 1.00 . A A . 12 ARG CA 1 1 18 5186 1 1 12 ARG CB C 3.977 -24.140 -4.012 1.00 . A A . 12 ARG CB 1 1 18 5187 1 1 12 ARG CD C 4.718 -26.061 -2.388 1.00 . A A . 12 ARG CD 1 1 18 5188 1 1 12 ARG CG C 5.129 -24.993 -3.420 1.00 . A A . 12 ARG CG 1 1 18 5189 1 1 12 ARG CZ C 5.861 -25.527 -0.200 1.00 . A A . 12 ARG CZ 1 1 18 5190 1 1 12 ARG H H 5.541 -22.511 -2.829 1.00 . A A . 12 ARG H 1 1 18 5191 1 1 12 ARG HA H 3.027 -22.217 -3.887 1.00 . A A . 12 ARG HA 1 1 18 5192 1 1 12 ARG HB2 H 3.140 -24.784 -4.285 1.00 . A A . 12 ARG HB2 1 1 18 5193 1 1 12 ARG HB3 H 4.340 -23.741 -4.961 1.00 . A A . 12 ARG HB3 1 1 18 5194 1 1 12 ARG HD2 H 3.755 -25.867 -1.927 1.00 . A A . 12 ARG HD2 1 1 18 5195 1 1 12 ARG HD3 H 4.592 -27.018 -2.896 1.00 . A A . 12 ARG HD3 1 1 18 5196 1 1 12 ARG HE H 6.421 -26.944 -1.566 1.00 . A A . 12 ARG HE 1 1 18 5197 1 1 12 ARG HG2 H 5.592 -25.521 -4.256 1.00 . A A . 12 ARG HG2 1 1 18 5198 1 1 12 ARG HG3 H 5.929 -24.361 -3.034 1.00 . A A . 12 ARG HG3 1 1 18 5199 1 1 12 ARG HH11 H 4.180 -24.327 -0.444 1.00 . A A . 12 ARG HH11 1 1 18 5200 1 1 12 ARG HH12 H 5.099 -23.975 0.961 1.00 . A A . 12 ARG HH12 1 1 18 5201 1 1 12 ARG HH21 H 7.529 -26.550 0.451 1.00 . A A . 12 ARG HH21 1 1 18 5202 1 1 12 ARG HH22 H 6.986 -25.298 1.495 1.00 . A A . 12 ARG HH22 1 1 18 5203 1 1 12 ARG N N 4.606 -22.222 -2.576 1.00 . A A . 12 ARG N 1 1 18 5204 1 1 12 ARG NE N 5.745 -26.222 -1.343 1.00 . A A . 12 ARG NE 1 1 18 5205 1 1 12 ARG NH1 N 5.010 -24.551 0.121 1.00 . A A . 12 ARG NH1 1 1 18 5206 1 1 12 ARG NH2 N 6.862 -25.811 0.633 1.00 . A A . 12 ARG NH2 1 1 18 5207 1 1 12 ARG O O 2.692 -23.876 -1.118 1.00 . A A . 12 ARG O 1 1 18 5208 1 1 13 ARG C C -0.528 -24.476 -1.359 1.00 . A A . 13 ARG C 1 1 18 5209 1 1 13 ARG CA C -0.040 -23.019 -1.548 1.00 . A A . 13 ARG CA 1 1 18 5210 1 1 13 ARG CB C -1.158 -22.093 -2.099 1.00 . A A . 13 ARG CB 1 1 18 5211 1 1 13 ARG CD C -3.283 -22.737 -3.401 1.00 . A A . 13 ARG CD 1 1 18 5212 1 1 13 ARG CG C -1.767 -22.466 -3.475 1.00 . A A . 13 ARG CG 1 1 18 5213 1 1 13 ARG CZ C -3.871 -24.869 -4.596 1.00 . A A . 13 ARG CZ 1 1 18 5214 1 1 13 ARG H H 0.989 -22.408 -3.294 1.00 . A A . 13 ARG H 1 1 18 5215 1 1 13 ARG HA H 0.256 -22.640 -0.568 1.00 . A A . 13 ARG HA 1 1 18 5216 1 1 13 ARG HB2 H -1.948 -22.036 -1.349 1.00 . A A . 13 ARG HB2 1 1 18 5217 1 1 13 ARG HB3 H -0.771 -21.074 -2.152 1.00 . A A . 13 ARG HB3 1 1 18 5218 1 1 13 ARG HD2 H -3.555 -23.253 -2.480 1.00 . A A . 13 ARG HD2 1 1 18 5219 1 1 13 ARG HD3 H -3.823 -21.789 -3.373 1.00 . A A . 13 ARG HD3 1 1 18 5220 1 1 13 ARG HE H -4.098 -22.961 -5.314 1.00 . A A . 13 ARG HE 1 1 18 5221 1 1 13 ARG HG2 H -1.591 -21.644 -4.171 1.00 . A A . 13 ARG HG2 1 1 18 5222 1 1 13 ARG HG3 H -1.252 -23.324 -3.909 1.00 . A A . 13 ARG HG3 1 1 18 5223 1 1 13 ARG HH11 H -2.849 -25.241 -2.837 1.00 . A A . 13 ARG HH11 1 1 18 5224 1 1 13 ARG HH12 H -3.544 -26.637 -3.564 1.00 . A A . 13 ARG HH12 1 1 18 5225 1 1 13 ARG HH21 H -4.811 -24.899 -6.427 1.00 . A A . 13 ARG HH21 1 1 18 5226 1 1 13 ARG HH22 H -4.553 -26.445 -5.734 1.00 . A A . 13 ARG HH22 1 1 18 5227 1 1 13 ARG N N 1.122 -22.928 -2.440 1.00 . A A . 13 ARG N 1 1 18 5228 1 1 13 ARG NE N -3.763 -23.532 -4.546 1.00 . A A . 13 ARG NE 1 1 18 5229 1 1 13 ARG NH1 N -3.410 -25.638 -3.607 1.00 . A A . 13 ARG NH1 1 1 18 5230 1 1 13 ARG NH2 N -4.442 -25.442 -5.657 1.00 . A A . 13 ARG NH2 1 1 18 5231 1 1 13 ARG O O -1.643 -24.847 -1.717 1.00 . A A . 13 ARG O 1 1 18 5232 1 1 14 NH2 HN1 H 0.035 -26.281 -0.618 1.00 . A A . 14 NH2 HN1 1 1 18 5233 1 1 14 NH2 HN2 H 1.241 -24.986 -0.560 1.00 . A A . 14 NH2 HN2 1 1 18 5234 1 1 14 NH2 N N 0.319 -25.334 -0.811 1.00 . A A . 14 NH2 N 1 1 18 5235 2 2 1 . C1 C 10.903 -17.732 0.773 1.00 . B A . 101 BGC C1 1 1 18 5236 2 2 1 . C2 C 11.151 -19.191 1.213 1.00 . B A . 101 BGC C2 1 1 18 5237 2 2 1 . C3 C 10.664 -19.401 2.655 1.00 . B A . 101 BGC C3 1 1 18 5238 2 2 1 . C4 C 11.260 -18.337 3.585 1.00 . B A . 101 BGC C4 1 1 18 5239 2 2 1 . C5 C 10.930 -16.933 3.034 1.00 . B A . 101 BGC C5 1 1 18 5240 2 2 1 . C6 C 11.547 -15.780 3.843 1.00 . B A . 101 BGC C6 1 1 18 5241 2 2 1 . H1 H 9.825 -17.525 0.715 1.00 . B A . 101 BGC H1 1 1 18 5242 2 2 1 . H2 H 12.221 -19.391 1.140 1.00 . B A . 101 BGC H2 1 1 18 5243 2 2 1 . H3 H 9.575 -19.300 2.671 1.00 . B A . 101 BGC H3 1 1 18 5244 2 2 1 . H4 H 12.345 -18.454 3.625 1.00 . B A . 101 BGC H4 1 1 18 5245 2 2 1 . H5 H 9.848 -16.791 2.981 1.00 . B A . 101 BGC H5 1 1 18 5246 2 2 1 . H6 H 10.355 -14.336 3.321 1.00 . B A . 101 BGC H6 1 1 18 5247 2 2 1 . H6C1 H 12.621 -15.933 3.951 1.00 . B A . 101 BGC H6C1 1 1 18 5248 2 2 1 . H6C2 H 11.130 -15.765 4.852 1.00 . B A . 101 BGC H6C2 1 1 18 5249 2 2 1 . HB H 10.594 -20.977 0.694 1.00 . B A . 101 BGC HB 1 1 18 5250 2 2 1 . HC H 11.965 -20.810 3.119 1.00 . B A . 101 BGC HC 1 1 18 5251 2 2 1 . HD H 10.794 -19.461 5.107 1.00 . B A . 101 BGC HD 1 1 18 5252 2 2 1 . O2 O 10.451 -20.082 0.353 1.00 . B A . 101 BGC O2 1 1 18 5253 2 2 1 . O3 O 11.000 -20.714 3.113 1.00 . B A . 101 BGC O3 1 1 18 5254 2 2 1 . O4 O 10.745 -18.513 4.896 1.00 . B A . 101 BGC O4 1 1 18 5255 2 2 1 . O5 O 11.480 -16.846 1.713 1.00 . B A . 101 BGC O5 1 1 18 5256 2 2 1 . O6 O 11.307 -14.516 3.207 1.00 . B A . 101 BGC O6 1 1 19 5257 1 1 1 ILE C C 4.994 3.331 -3.745 1.00 . A A . 1 ILE C 1 1 19 5258 1 1 1 ILE CA C 3.998 3.578 -4.885 1.00 . A A . 1 ILE CA 1 1 19 5259 1 1 1 ILE CB C 4.654 3.410 -6.289 1.00 . A A . 1 ILE CB 1 1 19 5260 1 1 1 ILE CD1 C 2.407 3.286 -7.603 1.00 . A A . 1 ILE CD1 1 1 19 5261 1 1 1 ILE CG1 C 3.786 3.950 -7.454 1.00 . A A . 1 ILE CG1 1 1 19 5262 1 1 1 ILE CG2 C 5.106 1.964 -6.585 1.00 . A A . 1 ILE CG2 1 1 19 5263 1 1 1 ILE H1 H 4.334 5.516 -4.552 1.00 . A A . 1 ILE H1 1 1 19 5264 1 1 1 ILE HA H 3.154 2.894 -4.783 1.00 . A A . 1 ILE HA 1 1 19 5265 1 1 1 ILE HB H 5.567 4.012 -6.299 1.00 . A A . 1 ILE HB 1 1 19 5266 1 1 1 ILE HD11 H 1.877 3.703 -8.462 1.00 . A A . 1 ILE HD11 1 1 19 5267 1 1 1 ILE HD12 H 2.493 2.213 -7.782 1.00 . A A . 1 ILE HD12 1 1 19 5268 1 1 1 ILE HD13 H 1.769 3.433 -6.732 1.00 . A A . 1 ILE HD13 1 1 19 5269 1 1 1 ILE HG12 H 3.660 5.029 -7.378 1.00 . A A . 1 ILE HG12 1 1 19 5270 1 1 1 ILE HG13 H 4.331 3.811 -8.391 1.00 . A A . 1 ILE HG13 1 1 19 5271 1 1 1 ILE HG21 H 4.284 1.252 -6.503 1.00 . A A . 1 ILE HG21 1 1 19 5272 1 1 1 ILE HG22 H 5.509 1.877 -7.596 1.00 . A A . 1 ILE HG22 1 1 19 5273 1 1 1 ILE HG23 H 5.900 1.634 -5.914 1.00 . A A . 1 ILE HG23 1 1 19 5274 1 1 1 ILE N N 3.505 4.954 -4.704 1.00 . A A . 1 ILE N 1 1 19 5275 1 1 1 ILE O O 5.580 4.306 -3.282 1.00 . A A . 1 ILE O 1 1 19 5276 1 1 2 LEU C C 6.754 0.365 -2.686 1.00 . A A . 2 LEU C 1 1 19 5277 1 1 2 LEU CA C 6.146 1.713 -2.259 1.00 . A A . 2 LEU CA 1 1 19 5278 1 1 2 LEU CB C 5.435 1.695 -0.880 1.00 . A A . 2 LEU CB 1 1 19 5279 1 1 2 LEU CD1 C 6.959 0.172 0.570 1.00 . A A . 2 LEU CD1 1 1 19 5280 1 1 2 LEU CD2 C 7.363 2.681 0.516 1.00 . A A . 2 LEU CD2 1 1 19 5281 1 1 2 LEU CG C 6.321 1.559 0.384 1.00 . A A . 2 LEU CG 1 1 19 5282 1 1 2 LEU H H 4.693 1.304 -3.712 1.00 . A A . 2 LEU H 1 1 19 5283 1 1 2 LEU HA H 6.923 2.472 -2.213 1.00 . A A . 2 LEU HA 1 1 19 5284 1 1 2 LEU HB2 H 4.874 2.625 -0.774 1.00 . A A . 2 LEU HB2 1 1 19 5285 1 1 2 LEU HB3 H 4.682 0.906 -0.867 1.00 . A A . 2 LEU HB3 1 1 19 5286 1 1 2 LEU HD11 H 7.330 0.049 1.588 1.00 . A A . 2 LEU HD11 1 1 19 5287 1 1 2 LEU HD12 H 7.808 0.018 -0.094 1.00 . A A . 2 LEU HD12 1 1 19 5288 1 1 2 LEU HD13 H 6.238 -0.626 0.389 1.00 . A A . 2 LEU HD13 1 1 19 5289 1 1 2 LEU HD21 H 8.154 2.596 -0.228 1.00 . A A . 2 LEU HD21 1 1 19 5290 1 1 2 LEU HD22 H 7.840 2.652 1.497 1.00 . A A . 2 LEU HD22 1 1 19 5291 1 1 2 LEU HD23 H 6.904 3.664 0.410 1.00 . A A . 2 LEU HD23 1 1 19 5292 1 1 2 LEU HG H 5.637 1.681 1.227 1.00 . A A . 2 LEU HG 1 1 19 5293 1 1 2 LEU N N 5.182 2.086 -3.294 1.00 . A A . 2 LEU N 1 1 19 5294 1 1 2 LEU O O 6.016 -0.623 -2.685 1.00 . A A . 2 LEU O 1 1 19 5295 1 1 3 PRO C C 9.118 -1.717 -2.142 1.00 . A A . 3 PRO C 1 1 19 5296 1 1 3 PRO CA C 8.686 -0.988 -3.430 1.00 . A A . 3 PRO CA 1 1 19 5297 1 1 3 PRO CB C 9.889 -0.579 -4.297 1.00 . A A . 3 PRO CB 1 1 19 5298 1 1 3 PRO CD C 8.942 1.418 -3.335 1.00 . A A . 3 PRO CD 1 1 19 5299 1 1 3 PRO CG C 10.266 0.814 -3.807 1.00 . A A . 3 PRO CG 1 1 19 5300 1 1 3 PRO HA H 8.024 -1.635 -4.008 1.00 . A A . 3 PRO HA 1 1 19 5301 1 1 3 PRO HB2 H 10.722 -1.282 -4.247 1.00 . A A . 3 PRO HB2 1 1 19 5302 1 1 3 PRO HB3 H 9.580 -0.525 -5.342 1.00 . A A . 3 PRO HB3 1 1 19 5303 1 1 3 PRO HD2 H 9.100 2.018 -2.438 1.00 . A A . 3 PRO HD2 1 1 19 5304 1 1 3 PRO HD3 H 8.518 2.061 -4.108 1.00 . A A . 3 PRO HD3 1 1 19 5305 1 1 3 PRO HG2 H 10.956 0.734 -2.966 1.00 . A A . 3 PRO HG2 1 1 19 5306 1 1 3 PRO HG3 H 10.756 1.415 -4.575 1.00 . A A . 3 PRO HG3 1 1 19 5307 1 1 3 PRO N N 8.041 0.285 -3.089 1.00 . A A . 3 PRO N 1 1 19 5308 1 1 3 PRO O O 10.211 -1.490 -1.620 1.00 . A A . 3 PRO O 1 1 19 5309 1 1 4 TRP C C 9.399 -4.596 -0.933 1.00 . A A . 4 TRP C 1 1 19 5310 1 1 4 TRP CA C 8.534 -3.418 -0.446 1.00 . A A . 4 TRP CA 1 1 19 5311 1 1 4 TRP CB C 7.209 -3.913 0.182 1.00 . A A . 4 TRP CB 1 1 19 5312 1 1 4 TRP CD1 C 6.450 -3.089 2.457 1.00 . A A . 4 TRP CD1 1 1 19 5313 1 1 4 TRP CD2 C 7.979 -4.726 2.613 1.00 . A A . 4 TRP CD2 1 1 19 5314 1 1 4 TRP CE2 C 7.659 -4.329 3.947 1.00 . A A . 4 TRP CE2 1 1 19 5315 1 1 4 TRP CE3 C 8.930 -5.763 2.471 1.00 . A A . 4 TRP CE3 1 1 19 5316 1 1 4 TRP CG C 7.199 -3.910 1.684 1.00 . A A . 4 TRP CG 1 1 19 5317 1 1 4 TRP CH2 C 9.208 -5.939 4.894 1.00 . A A . 4 TRP CH2 1 1 19 5318 1 1 4 TRP CZ2 C 8.257 -4.918 5.075 1.00 . A A . 4 TRP CZ2 1 1 19 5319 1 1 4 TRP CZ3 C 9.542 -6.360 3.592 1.00 . A A . 4 TRP CZ3 1 1 19 5320 1 1 4 TRP H H 7.362 -2.720 -2.080 1.00 . A A . 4 TRP H 1 1 19 5321 1 1 4 TRP HA H 9.076 -2.820 0.290 1.00 . A A . 4 TRP HA 1 1 19 5322 1 1 4 TRP HB2 H 6.387 -3.270 -0.136 1.00 . A A . 4 TRP HB2 1 1 19 5323 1 1 4 TRP HB3 H 6.942 -4.914 -0.157 1.00 . A A . 4 TRP HB3 1 1 19 5324 1 1 4 TRP HD1 H 5.758 -2.351 2.078 1.00 . A A . 4 TRP HD1 1 1 19 5325 1 1 4 TRP HE1 H 6.266 -2.841 4.547 1.00 . A A . 4 TRP HE1 1 1 19 5326 1 1 4 TRP HE3 H 9.195 -6.119 1.488 1.00 . A A . 4 TRP HE3 1 1 19 5327 1 1 4 TRP HH2 H 9.676 -6.401 5.751 1.00 . A A . 4 TRP HH2 1 1 19 5328 1 1 4 TRP HZ2 H 7.993 -4.594 6.071 1.00 . A A . 4 TRP HZ2 1 1 19 5329 1 1 4 TRP HZ3 H 10.265 -7.148 3.440 1.00 . A A . 4 TRP HZ3 1 1 19 5330 1 1 4 TRP N N 8.248 -2.588 -1.615 1.00 . A A . 4 TRP N 1 1 19 5331 1 1 4 TRP NE1 N 6.719 -3.334 3.788 1.00 . A A . 4 TRP NE1 1 1 19 5332 1 1 4 TRP O O 8.942 -5.443 -1.703 1.00 . A A . 4 TRP O 1 1 19 5333 1 1 5 LYS C C 11.786 -6.693 -0.045 1.00 . A A . 5 LYS C 1 1 19 5334 1 1 5 LYS CA C 11.706 -5.507 -1.015 1.00 . A A . 5 LYS CA 1 1 19 5335 1 1 5 LYS CB C 13.069 -4.774 -0.969 1.00 . A A . 5 LYS CB 1 1 19 5336 1 1 5 LYS CD C 14.525 -2.862 -1.954 1.00 . A A . 5 LYS CD 1 1 19 5337 1 1 5 LYS CE C 14.701 -1.813 -0.839 1.00 . A A . 5 LYS CE 1 1 19 5338 1 1 5 LYS CG C 13.168 -3.592 -1.954 1.00 . A A . 5 LYS CG 1 1 19 5339 1 1 5 LYS H H 10.933 -3.912 0.156 1.00 . A A . 5 LYS H 1 1 19 5340 1 1 5 LYS HA H 11.496 -5.849 -2.030 1.00 . A A . 5 LYS HA 1 1 19 5341 1 1 5 LYS HB2 H 13.260 -4.440 0.049 1.00 . A A . 5 LYS HB2 1 1 19 5342 1 1 5 LYS HB3 H 13.859 -5.491 -1.205 1.00 . A A . 5 LYS HB3 1 1 19 5343 1 1 5 LYS HD2 H 15.351 -3.576 -1.971 1.00 . A A . 5 LYS HD2 1 1 19 5344 1 1 5 LYS HD3 H 14.596 -2.329 -2.905 1.00 . A A . 5 LYS HD3 1 1 19 5345 1 1 5 LYS HE2 H 15.543 -1.165 -1.085 1.00 . A A . 5 LYS HE2 1 1 19 5346 1 1 5 LYS HE3 H 13.822 -1.166 -0.781 1.00 . A A . 5 LYS HE3 1 1 19 5347 1 1 5 LYS HG2 H 12.988 -3.979 -2.960 1.00 . A A . 5 LYS HG2 1 1 19 5348 1 1 5 LYS HG3 H 12.366 -2.874 -1.780 1.00 . A A . 5 LYS HG3 1 1 19 5349 1 1 5 LYS HZ1 H 14.178 -2.993 0.757 1.00 . A A . 5 LYS HZ1 1 1 19 5350 1 1 5 LYS HZ2 H 15.099 -1.697 1.170 1.00 . A A . 5 LYS HZ2 1 1 19 5351 1 1 5 LYS HZ3 H 15.792 -2.997 0.438 1.00 . A A . 5 LYS HZ3 1 1 19 5352 1 1 5 LYS N N 10.677 -4.587 -0.545 1.00 . A A . 5 LYS N 1 1 19 5353 1 1 5 LYS NZ N 14.963 -2.422 0.480 1.00 . A A . 5 LYS NZ 1 1 19 5354 1 1 5 LYS O O 12.075 -6.479 1.131 1.00 . A A . 5 LYS O 1 1 19 5355 1 1 6 TRP C C 10.114 -9.526 0.627 1.00 . A A . 6 TRP C 1 1 19 5356 1 1 6 TRP CA C 11.521 -9.208 0.102 1.00 . A A . 6 TRP CA 1 1 19 5357 1 1 6 TRP CB C 12.674 -9.466 1.105 1.00 . A A . 6 TRP CB 1 1 19 5358 1 1 6 TRP CD1 C 13.164 -11.950 1.385 1.00 . A A . 6 TRP CD1 1 1 19 5359 1 1 6 TRP CD2 C 12.005 -11.083 3.105 1.00 . A A . 6 TRP CD2 1 1 19 5360 1 1 6 TRP CE2 C 12.211 -12.463 3.398 1.00 . A A . 6 TRP CE2 1 1 19 5361 1 1 6 TRP CE3 C 11.284 -10.326 4.059 1.00 . A A . 6 TRP CE3 1 1 19 5362 1 1 6 TRP CG C 12.630 -10.785 1.820 1.00 . A A . 6 TRP CG 1 1 19 5363 1 1 6 TRP CH2 C 11.043 -12.274 5.514 1.00 . A A . 6 TRP CH2 1 1 19 5364 1 1 6 TRP CZ2 C 11.747 -13.058 4.581 1.00 . A A . 6 TRP CZ2 1 1 19 5365 1 1 6 TRP CZ3 C 10.808 -10.912 5.250 1.00 . A A . 6 TRP CZ3 1 1 19 5366 1 1 6 TRP H H 11.250 -7.911 -1.527 1.00 . A A . 6 TRP H 1 1 19 5367 1 1 6 TRP HA H 11.692 -9.916 -0.711 1.00 . A A . 6 TRP HA 1 1 19 5368 1 1 6 TRP HB2 H 13.630 -9.390 0.589 1.00 . A A . 6 TRP HB2 1 1 19 5369 1 1 6 TRP HB3 H 12.691 -8.712 1.890 1.00 . A A . 6 TRP HB3 1 1 19 5370 1 1 6 TRP HD1 H 13.701 -12.073 0.455 1.00 . A A . 6 TRP HD1 1 1 19 5371 1 1 6 TRP HE1 H 13.178 -13.925 2.205 1.00 . A A . 6 TRP HE1 1 1 19 5372 1 1 6 TRP HE3 H 11.102 -9.279 3.871 1.00 . A A . 6 TRP HE3 1 1 19 5373 1 1 6 TRP HH2 H 10.691 -12.715 6.436 1.00 . A A . 6 TRP HH2 1 1 19 5374 1 1 6 TRP HZ2 H 11.942 -14.103 4.772 1.00 . A A . 6 TRP HZ2 1 1 19 5375 1 1 6 TRP HZ3 H 10.269 -10.310 5.966 1.00 . A A . 6 TRP HZ3 1 1 19 5376 1 1 6 TRP N N 11.558 -7.905 -0.568 1.00 . A A . 6 TRP N 1 1 19 5377 1 1 6 TRP NE1 N 12.903 -12.942 2.309 1.00 . A A . 6 TRP NE1 1 1 19 5378 1 1 6 TRP O O 9.447 -8.670 1.198 1.00 . A A . 6 TRP O 1 1 19 5379 1 1 7 LYS C C 8.788 -12.885 1.093 1.00 . A A . 7 LYS C 1 1 19 5380 1 1 7 LYS CA C 8.480 -11.389 0.983 1.00 . A A . 7 LYS CA 1 1 19 5381 1 1 7 LYS CB C 7.226 -11.124 0.114 1.00 . A A . 7 LYS CB 1 1 19 5382 1 1 7 LYS CD C 5.325 -9.501 -0.519 1.00 . A A . 7 LYS CD 1 1 19 5383 1 1 7 LYS CE C 5.379 -9.624 -2.051 1.00 . A A . 7 LYS CE 1 1 19 5384 1 1 7 LYS CG C 6.696 -9.677 0.151 1.00 . A A . 7 LYS CG 1 1 19 5385 1 1 7 LYS H H 10.315 -11.450 0.036 1.00 . A A . 7 LYS H 1 1 19 5386 1 1 7 LYS HA H 8.323 -11.006 1.994 1.00 . A A . 7 LYS HA 1 1 19 5387 1 1 7 LYS HB2 H 7.437 -11.429 -0.911 1.00 . A A . 7 LYS HB2 1 1 19 5388 1 1 7 LYS HB3 H 6.431 -11.787 0.461 1.00 . A A . 7 LYS HB3 1 1 19 5389 1 1 7 LYS HD2 H 4.623 -10.222 -0.095 1.00 . A A . 7 LYS HD2 1 1 19 5390 1 1 7 LYS HD3 H 4.944 -8.514 -0.248 1.00 . A A . 7 LYS HD3 1 1 19 5391 1 1 7 LYS HE2 H 6.057 -8.873 -2.462 1.00 . A A . 7 LYS HE2 1 1 19 5392 1 1 7 LYS HE3 H 5.773 -10.598 -2.344 1.00 . A A . 7 LYS HE3 1 1 19 5393 1 1 7 LYS HG2 H 6.622 -9.360 1.193 1.00 . A A . 7 LYS HG2 1 1 19 5394 1 1 7 LYS HG3 H 7.413 -8.998 -0.313 1.00 . A A . 7 LYS HG3 1 1 19 5395 1 1 7 LYS HZ1 H 3.425 -10.183 -2.322 1.00 . A A . 7 LYS HZ1 1 1 19 5396 1 1 7 LYS HZ2 H 4.114 -9.520 -3.661 1.00 . A A . 7 LYS HZ2 1 1 19 5397 1 1 7 LYS HZ3 H 3.664 -8.555 -2.405 1.00 . A A . 7 LYS HZ3 1 1 19 5398 1 1 7 LYS N N 9.672 -10.768 0.425 1.00 . A A . 7 LYS N 1 1 19 5399 1 1 7 LYS NZ N 4.045 -9.457 -2.655 1.00 . A A . 7 LYS NZ 1 1 19 5400 1 1 7 LYS O O 9.601 -13.394 0.317 1.00 . A A . 7 LYS O 1 1 19 5401 1 1 8 TRP C C 7.240 -15.622 0.992 1.00 . A A . 8 TRP C 1 1 19 5402 1 1 8 TRP CA C 8.172 -15.053 2.072 1.00 . A A . 8 TRP CA 1 1 19 5403 1 1 8 TRP CB C 7.725 -15.530 3.470 1.00 . A A . 8 TRP CB 1 1 19 5404 1 1 8 TRP CD1 C 8.240 -18.014 3.469 1.00 . A A . 8 TRP CD1 1 1 19 5405 1 1 8 TRP CD2 C 9.500 -16.873 4.933 1.00 . A A . 8 TRP CD2 1 1 19 5406 1 1 8 TRP CE2 C 9.927 -18.233 4.993 1.00 . A A . 8 TRP CE2 1 1 19 5407 1 1 8 TRP CE3 C 10.148 -15.960 5.797 1.00 . A A . 8 TRP CE3 1 1 19 5408 1 1 8 TRP CG C 8.439 -16.762 3.937 1.00 . A A . 8 TRP CG 1 1 19 5409 1 1 8 TRP CH2 C 11.590 -17.723 6.685 1.00 . A A . 8 TRP CH2 1 1 19 5410 1 1 8 TRP CZ2 C 10.958 -18.662 5.849 1.00 . A A . 8 TRP CZ2 1 1 19 5411 1 1 8 TRP CZ3 C 11.183 -16.375 6.661 1.00 . A A . 8 TRP CZ3 1 1 19 5412 1 1 8 TRP H H 7.406 -13.141 2.558 1.00 . A A . 8 TRP H 1 1 19 5413 1 1 8 TRP HA H 9.193 -15.373 1.889 1.00 . A A . 8 TRP HA 1 1 19 5414 1 1 8 TRP HB2 H 7.919 -14.759 4.214 1.00 . A A . 8 TRP HB2 1 1 19 5415 1 1 8 TRP HB3 H 6.649 -15.711 3.509 1.00 . A A . 8 TRP HB3 1 1 19 5416 1 1 8 TRP HD1 H 7.512 -18.277 2.714 1.00 . A A . 8 TRP HD1 1 1 19 5417 1 1 8 TRP HE1 H 9.132 -19.871 3.880 1.00 . A A . 8 TRP HE1 1 1 19 5418 1 1 8 TRP HE3 H 9.839 -14.927 5.795 1.00 . A A . 8 TRP HE3 1 1 19 5419 1 1 8 TRP HH2 H 12.381 -18.037 7.352 1.00 . A A . 8 TRP HH2 1 1 19 5420 1 1 8 TRP HZ2 H 11.257 -19.699 5.872 1.00 . A A . 8 TRP HZ2 1 1 19 5421 1 1 8 TRP HZ3 H 11.661 -15.655 7.311 1.00 . A A . 8 TRP HZ3 1 1 19 5422 1 1 8 TRP N N 8.109 -13.596 2.000 1.00 . A A . 8 TRP N 1 1 19 5423 1 1 8 TRP NE1 N 9.122 -18.880 4.080 1.00 . A A . 8 TRP NE1 1 1 19 5424 1 1 8 TRP O O 6.097 -15.176 0.869 1.00 . A A . 8 TRP O 1 1 19 5425 1 1 9 THR C C 6.249 -18.429 -0.449 1.00 . A A . 9 THR C 1 1 19 5426 1 1 9 THR CA C 7.010 -17.165 -0.918 1.00 . A A . 9 THR CA 1 1 19 5427 1 1 9 THR CB C 8.017 -17.502 -2.044 1.00 . A A . 9 THR CB 1 1 19 5428 1 1 9 THR CG2 C 8.527 -16.236 -2.754 1.00 . A A . 9 THR CG2 1 1 19 5429 1 1 9 THR H H 8.688 -16.895 0.315 1.00 . A A . 9 THR H 1 1 19 5430 1 1 9 THR HA H 6.293 -16.440 -1.302 1.00 . A A . 9 THR HA 1 1 19 5431 1 1 9 THR HB H 7.474 -18.071 -2.800 1.00 . A A . 9 THR HB 1 1 19 5432 1 1 9 THR HG21 H 7.685 -15.621 -3.068 1.00 . A A . 9 THR HG21 1 1 19 5433 1 1 9 THR HG22 H 9.069 -16.486 -3.665 1.00 . A A . 9 THR HG22 1 1 19 5434 1 1 9 THR HG23 H 9.144 -15.616 -2.103 1.00 . A A . 9 THR HG23 1 1 19 5435 1 1 9 THR N N 7.741 -16.558 0.184 1.00 . A A . 9 THR N 1 1 19 5436 1 1 9 THR O O 6.687 -19.084 0.500 1.00 . A A . 9 THR O 1 1 19 5437 1 1 9 THR OG1 O 9.061 -18.388 -1.557 1.00 . A A . 9 THR OG1 1 1 19 5438 1 1 10 PRO C C 4.926 -21.255 -1.077 1.00 . A A . 10 PRO C 1 1 19 5439 1 1 10 PRO CA C 4.287 -19.924 -0.649 1.00 . A A . 10 PRO CA 1 1 19 5440 1 1 10 PRO CB C 2.924 -19.712 -1.327 1.00 . A A . 10 PRO CB 1 1 19 5441 1 1 10 PRO CD C 4.464 -18.067 -2.187 1.00 . A A . 10 PRO CD 1 1 19 5442 1 1 10 PRO CG C 3.238 -18.899 -2.574 1.00 . A A . 10 PRO CG 1 1 19 5443 1 1 10 PRO HA H 4.164 -19.916 0.436 1.00 . A A . 10 PRO HA 1 1 19 5444 1 1 10 PRO HB2 H 2.401 -20.642 -1.558 1.00 . A A . 10 PRO HB2 1 1 19 5445 1 1 10 PRO HB3 H 2.277 -19.132 -0.666 1.00 . A A . 10 PRO HB3 1 1 19 5446 1 1 10 PRO HD2 H 5.139 -17.951 -3.036 1.00 . A A . 10 PRO HD2 1 1 19 5447 1 1 10 PRO HD3 H 4.149 -17.078 -1.854 1.00 . A A . 10 PRO HD3 1 1 19 5448 1 1 10 PRO HG2 H 3.501 -19.579 -3.387 1.00 . A A . 10 PRO HG2 1 1 19 5449 1 1 10 PRO HG3 H 2.397 -18.291 -2.911 1.00 . A A . 10 PRO HG3 1 1 19 5450 1 1 10 PRO N N 5.097 -18.774 -1.069 1.00 . A A . 10 PRO N 1 1 19 5451 1 1 10 PRO O O 5.496 -21.371 -2.163 1.00 . A A . 10 PRO O 1 1 19 5452 1 1 11 TRP C C 4.426 -24.371 -1.450 1.00 . A A . 11 TRP C 1 1 19 5453 1 1 11 TRP CA C 5.326 -23.613 -0.456 1.00 . A A . 11 TRP CA 1 1 19 5454 1 1 11 TRP CB C 5.359 -24.367 0.890 1.00 . A A . 11 TRP CB 1 1 19 5455 1 1 11 TRP CD1 C 5.200 -26.849 1.379 1.00 . A A . 11 TRP CD1 1 1 19 5456 1 1 11 TRP CD2 C 7.082 -26.320 0.269 1.00 . A A . 11 TRP CD2 1 1 19 5457 1 1 11 TRP CE2 C 7.107 -27.733 0.483 1.00 . A A . 11 TRP CE2 1 1 19 5458 1 1 11 TRP CE3 C 8.192 -25.757 -0.407 1.00 . A A . 11 TRP CE3 1 1 19 5459 1 1 11 TRP CG C 5.852 -25.786 0.855 1.00 . A A . 11 TRP CG 1 1 19 5460 1 1 11 TRP CH2 C 9.252 -27.949 -0.629 1.00 . A A . 11 TRP CH2 1 1 19 5461 1 1 11 TRP CZ2 C 8.171 -28.542 0.048 1.00 . A A . 11 TRP CZ2 1 1 19 5462 1 1 11 TRP CZ3 C 9.262 -26.559 -0.854 1.00 . A A . 11 TRP CZ3 1 1 19 5463 1 1 11 TRP H H 4.280 -22.116 0.625 1.00 . A A . 11 TRP H 1 1 19 5464 1 1 11 TRP HA H 6.332 -23.526 -0.866 1.00 . A A . 11 TRP HA 1 1 19 5465 1 1 11 TRP HB2 H 6.009 -23.827 1.581 1.00 . A A . 11 TRP HB2 1 1 19 5466 1 1 11 TRP HB3 H 4.367 -24.361 1.343 1.00 . A A . 11 TRP HB3 1 1 19 5467 1 1 11 TRP HD1 H 4.262 -26.785 1.914 1.00 . A A . 11 TRP HD1 1 1 19 5468 1 1 11 TRP HE1 H 5.724 -28.871 1.630 1.00 . A A . 11 TRP HE1 1 1 19 5469 1 1 11 TRP HE3 H 8.243 -24.689 -0.562 1.00 . A A . 11 TRP HE3 1 1 19 5470 1 1 11 TRP HH2 H 10.086 -28.555 -0.956 1.00 . A A . 11 TRP HH2 1 1 19 5471 1 1 11 TRP HZ2 H 8.174 -29.605 0.241 1.00 . A A . 11 TRP HZ2 1 1 19 5472 1 1 11 TRP HZ3 H 10.105 -26.101 -1.352 1.00 . A A . 11 TRP HZ3 1 1 19 5473 1 1 11 TRP N N 4.804 -22.273 -0.219 1.00 . A A . 11 TRP N 1 1 19 5474 1 1 11 TRP NE1 N 5.941 -27.995 1.168 1.00 . A A . 11 TRP NE1 1 1 19 5475 1 1 11 TRP O O 3.207 -24.203 -1.464 1.00 . A A . 11 TRP O 1 1 19 5476 1 1 12 ARG C C 3.420 -27.126 -2.822 1.00 . A A . 12 ARG C 1 1 19 5477 1 1 12 ARG CA C 4.413 -26.043 -3.323 1.00 . A A . 12 ARG CA 1 1 19 5478 1 1 12 ARG CB C 5.571 -26.687 -4.136 1.00 . A A . 12 ARG CB 1 1 19 5479 1 1 12 ARG CD C 4.509 -27.986 -6.149 1.00 . A A . 12 ARG CD 1 1 19 5480 1 1 12 ARG CG C 5.361 -26.798 -5.664 1.00 . A A . 12 ARG CG 1 1 19 5481 1 1 12 ARG CZ C 4.226 -28.127 -8.662 1.00 . A A . 12 ARG CZ 1 1 19 5482 1 1 12 ARG H H 6.027 -25.368 -2.109 1.00 . A A . 12 ARG H 1 1 19 5483 1 1 12 ARG HA H 3.861 -25.337 -3.947 1.00 . A A . 12 ARG HA 1 1 19 5484 1 1 12 ARG HB2 H 6.461 -26.066 -4.015 1.00 . A A . 12 ARG HB2 1 1 19 5485 1 1 12 ARG HB3 H 5.852 -27.655 -3.717 1.00 . A A . 12 ARG HB3 1 1 19 5486 1 1 12 ARG HD2 H 4.685 -28.850 -5.506 1.00 . A A . 12 ARG HD2 1 1 19 5487 1 1 12 ARG HD3 H 3.444 -27.767 -6.077 1.00 . A A . 12 ARG HD3 1 1 19 5488 1 1 12 ARG HE H 5.740 -28.925 -7.547 1.00 . A A . 12 ARG HE 1 1 19 5489 1 1 12 ARG HG2 H 4.937 -25.865 -6.039 1.00 . A A . 12 ARG HG2 1 1 19 5490 1 1 12 ARG HG3 H 6.349 -26.866 -6.122 1.00 . A A . 12 ARG HG3 1 1 19 5491 1 1 12 ARG HH11 H 2.710 -27.075 -7.785 1.00 . A A . 12 ARG HH11 1 1 19 5492 1 1 12 ARG HH12 H 2.580 -27.186 -9.494 1.00 . A A . 12 ARG HH12 1 1 19 5493 1 1 12 ARG HH21 H 5.580 -29.099 -9.873 1.00 . A A . 12 ARG HH21 1 1 19 5494 1 1 12 ARG HH22 H 4.257 -28.405 -10.706 1.00 . A A . 12 ARG HH22 1 1 19 5495 1 1 12 ARG N N 5.028 -25.277 -2.231 1.00 . A A . 12 ARG N 1 1 19 5496 1 1 12 ARG NE N 4.884 -28.385 -7.521 1.00 . A A . 12 ARG NE 1 1 19 5497 1 1 12 ARG NH1 N 3.091 -27.423 -8.654 1.00 . A A . 12 ARG NH1 1 1 19 5498 1 1 12 ARG NH2 N 4.715 -28.576 -9.820 1.00 . A A . 12 ARG NH2 1 1 19 5499 1 1 12 ARG O O 2.892 -27.891 -3.627 1.00 . A A . 12 ARG O 1 1 19 5500 1 1 13 ARG C C 2.532 -29.403 -0.525 1.00 . A A . 13 ARG C 1 1 19 5501 1 1 13 ARG CA C 2.115 -27.949 -0.826 1.00 . A A . 13 ARG CA 1 1 19 5502 1 1 13 ARG CB C 0.694 -27.670 -1.408 1.00 . A A . 13 ARG CB 1 1 19 5503 1 1 13 ARG CD C -1.061 -29.528 -1.625 1.00 . A A . 13 ARG CD 1 1 19 5504 1 1 13 ARG CG C 0.054 -28.733 -2.331 1.00 . A A . 13 ARG CG 1 1 19 5505 1 1 13 ARG CZ C -0.971 -31.977 -2.179 1.00 . A A . 13 ARG CZ 1 1 19 5506 1 1 13 ARG H H 3.623 -26.474 -0.964 1.00 . A A . 13 ARG H 1 1 19 5507 1 1 13 ARG HA H 2.102 -27.485 0.161 1.00 . A A . 13 ARG HA 1 1 19 5508 1 1 13 ARG HB2 H 0.018 -27.483 -0.573 1.00 . A A . 13 ARG HB2 1 1 19 5509 1 1 13 ARG HB3 H 0.709 -26.715 -1.936 1.00 . A A . 13 ARG HB3 1 1 19 5510 1 1 13 ARG HD2 H -0.777 -29.804 -0.610 1.00 . A A . 13 ARG HD2 1 1 19 5511 1 1 13 ARG HD3 H -1.941 -28.892 -1.514 1.00 . A A . 13 ARG HD3 1 1 19 5512 1 1 13 ARG HE H -2.210 -30.576 -3.022 1.00 . A A . 13 ARG HE 1 1 19 5513 1 1 13 ARG HG2 H -0.384 -28.218 -3.189 1.00 . A A . 13 ARG HG2 1 1 19 5514 1 1 13 ARG HG3 H 0.811 -29.393 -2.755 1.00 . A A . 13 ARG HG3 1 1 19 5515 1 1 13 ARG HH11 H 0.579 -31.412 -0.933 1.00 . A A . 13 ARG HH11 1 1 19 5516 1 1 13 ARG HH12 H 0.413 -33.114 -1.130 1.00 . A A . 13 ARG HH12 1 1 19 5517 1 1 13 ARG HH21 H -2.334 -32.890 -3.426 1.00 . A A . 13 ARG HH21 1 1 19 5518 1 1 13 ARG HH22 H -1.209 -33.956 -2.698 1.00 . A A . 13 ARG HH22 1 1 19 5519 1 1 13 ARG N N 3.170 -27.196 -1.508 1.00 . A A . 13 ARG N 1 1 19 5520 1 1 13 ARG NE N -1.452 -30.740 -2.370 1.00 . A A . 13 ARG NE 1 1 19 5521 1 1 13 ARG NH1 N 0.060 -32.196 -1.360 1.00 . A A . 13 ARG NH1 1 1 19 5522 1 1 13 ARG NH2 N -1.531 -33.006 -2.822 1.00 . A A . 13 ARG NH2 1 1 19 5523 1 1 13 ARG O O 1.702 -30.292 -0.359 1.00 . A A . 13 ARG O 1 1 19 5524 1 1 14 NH2 HN1 H 4.141 -30.609 -0.277 1.00 . A A . 14 NH2 HN1 1 1 19 5525 1 1 14 NH2 HN2 H 4.491 -28.909 -0.564 1.00 . A A . 14 NH2 HN2 1 1 19 5526 1 1 14 NH2 N N 3.830 -29.670 -0.463 1.00 . A A . 14 NH2 N 1 1 19 5527 2 2 1 . C1 C 10.384 -17.991 -1.213 1.00 . B A . 101 BGC C1 1 1 19 5528 2 2 1 . C2 C 11.291 -17.587 -2.406 1.00 . B A . 101 BGC C2 1 1 19 5529 2 2 1 . C3 C 12.729 -17.469 -1.911 1.00 . B A . 101 BGC C3 1 1 19 5530 2 2 1 . C4 C 12.786 -16.494 -0.732 1.00 . B A . 101 BGC C4 1 1 19 5531 2 2 1 . C5 C 11.835 -16.969 0.400 1.00 . B A . 101 BGC C5 1 1 19 5532 2 2 1 . C6 C 11.783 -16.007 1.606 1.00 . B A . 101 BGC C6 1 1 19 5533 2 2 1 . H1 H 10.778 -18.929 -0.799 1.00 . B A . 101 BGC H1 1 1 19 5534 2 2 1 . H2 H 11.020 -16.614 -2.802 1.00 . B A . 101 BGC H2 1 1 19 5535 2 2 1 . H3 H 13.085 -18.448 -1.582 1.00 . B A . 101 BGC H3 1 1 19 5536 2 2 1 . H4 H 12.461 -15.504 -1.061 1.00 . B A . 101 BGC H4 1 1 19 5537 2 2 1 . H5 H 12.145 -17.953 0.756 1.00 . B A . 101 BGC H5 1 1 19 5538 2 2 1 . H6 H 13.260 -16.566 2.772 1.00 . B A . 101 BGC H6 1 1 19 5539 2 2 1 . H6C1 H 11.104 -16.401 2.363 1.00 . B A . 101 BGC H6C1 1 1 19 5540 2 2 1 . H6C2 H 11.386 -15.045 1.283 1.00 . B A . 101 BGC H6C2 1 1 19 5541 2 2 1 . HB H 11.943 -18.313 -4.062 1.00 . B A . 101 BGC HB 1 1 19 5542 2 2 1 . HC H 14.427 -16.807 -2.530 1.00 . B A . 101 BGC HC 1 1 19 5543 2 2 1 . HD H 14.122 -15.914 0.560 1.00 . B A . 101 BGC HD 1 1 19 5544 2 2 1 . O2 O 11.229 -18.550 -3.448 1.00 . B A . 101 BGC O2 1 1 19 5545 2 2 1 . O3 O 13.575 -17.008 -2.957 1.00 . B A . 101 BGC O3 1 1 19 5546 2 2 1 . O4 O 14.138 -16.394 -0.291 1.00 . B A . 101 BGC O4 1 1 19 5547 2 2 1 . O5 O 10.498 -17.068 -0.145 1.00 . B A . 101 BGC O5 1 1 19 5548 2 2 1 . O6 O 13.062 -15.794 2.211 1.00 . B A . 101 BGC O6 1 1 20 5549 1 1 1 ILE C C 3.096 -0.288 1.431 1.00 . A A . 1 ILE C 1 1 20 5550 1 1 1 ILE CA C 2.985 1.234 1.267 1.00 . A A . 1 ILE CA 1 1 20 5551 1 1 1 ILE CB C 4.361 1.965 1.186 1.00 . A A . 1 ILE CB 1 1 20 5552 1 1 1 ILE CD1 C 4.555 1.868 -1.401 1.00 . A A . 1 ILE CD1 1 1 20 5553 1 1 1 ILE CG1 C 5.220 1.588 -0.045 1.00 . A A . 1 ILE CG1 1 1 20 5554 1 1 1 ILE CG2 C 5.210 1.822 2.469 1.00 . A A . 1 ILE CG2 1 1 20 5555 1 1 1 ILE H1 H 1.279 1.324 2.372 1.00 . A A . 1 ILE H1 1 1 20 5556 1 1 1 ILE HA H 2.403 1.444 0.368 1.00 . A A . 1 ILE HA 1 1 20 5557 1 1 1 ILE HB H 4.148 3.031 1.080 1.00 . A A . 1 ILE HB 1 1 20 5558 1 1 1 ILE HD11 H 4.251 2.912 -1.489 1.00 . A A . 1 ILE HD11 1 1 20 5559 1 1 1 ILE HD12 H 5.256 1.671 -2.214 1.00 . A A . 1 ILE HD12 1 1 20 5560 1 1 1 ILE HD13 H 3.682 1.242 -1.581 1.00 . A A . 1 ILE HD13 1 1 20 5561 1 1 1 ILE HG12 H 6.148 2.163 -0.013 1.00 . A A . 1 ILE HG12 1 1 20 5562 1 1 1 ILE HG13 H 5.539 0.545 0.001 1.00 . A A . 1 ILE HG13 1 1 20 5563 1 1 1 ILE HG21 H 6.134 2.398 2.389 1.00 . A A . 1 ILE HG21 1 1 20 5564 1 1 1 ILE HG22 H 4.698 2.188 3.359 1.00 . A A . 1 ILE HG22 1 1 20 5565 1 1 1 ILE HG23 H 5.502 0.786 2.653 1.00 . A A . 1 ILE HG23 1 1 20 5566 1 1 1 ILE N N 2.203 1.727 2.414 1.00 . A A . 1 ILE N 1 1 20 5567 1 1 1 ILE O O 2.938 -0.761 2.554 1.00 . A A . 1 ILE O 1 1 20 5568 1 1 2 LEU C C 4.790 -2.685 -0.567 1.00 . A A . 2 LEU C 1 1 20 5569 1 1 2 LEU CA C 3.568 -2.476 0.347 1.00 . A A . 2 LEU CA 1 1 20 5570 1 1 2 LEU CB C 2.263 -3.166 -0.129 1.00 . A A . 2 LEU CB 1 1 20 5571 1 1 2 LEU CD1 C 3.050 -5.491 -0.935 1.00 . A A . 2 LEU CD1 1 1 20 5572 1 1 2 LEU CD2 C 2.344 -5.171 1.486 1.00 . A A . 2 LEU CD2 1 1 20 5573 1 1 2 LEU CG C 2.158 -4.701 0.035 1.00 . A A . 2 LEU CG 1 1 20 5574 1 1 2 LEU H H 3.516 -0.596 -0.547 1.00 . A A . 2 LEU H 1 1 20 5575 1 1 2 LEU HA H 3.778 -2.814 1.359 1.00 . A A . 2 LEU HA 1 1 20 5576 1 1 2 LEU HB2 H 1.427 -2.733 0.422 1.00 . A A . 2 LEU HB2 1 1 20 5577 1 1 2 LEU HB3 H 2.074 -2.910 -1.173 1.00 . A A . 2 LEU HB3 1 1 20 5578 1 1 2 LEU HD11 H 4.101 -5.433 -0.658 1.00 . A A . 2 LEU HD11 1 1 20 5579 1 1 2 LEU HD12 H 2.952 -5.127 -1.958 1.00 . A A . 2 LEU HD12 1 1 20 5580 1 1 2 LEU HD13 H 2.779 -6.547 -0.940 1.00 . A A . 2 LEU HD13 1 1 20 5581 1 1 2 LEU HD21 H 2.087 -6.226 1.586 1.00 . A A . 2 LEU HD21 1 1 20 5582 1 1 2 LEU HD22 H 1.701 -4.615 2.169 1.00 . A A . 2 LEU HD22 1 1 20 5583 1 1 2 LEU HD23 H 3.374 -5.058 1.824 1.00 . A A . 2 LEU HD23 1 1 20 5584 1 1 2 LEU HG H 1.132 -4.952 -0.240 1.00 . A A . 2 LEU HG 1 1 20 5585 1 1 2 LEU N N 3.349 -1.033 0.353 1.00 . A A . 2 LEU N 1 1 20 5586 1 1 2 LEU O O 4.668 -2.375 -1.752 1.00 . A A . 2 LEU O 1 1 20 5587 1 1 3 PRO C C 7.199 -4.670 -1.531 1.00 . A A . 3 PRO C 1 1 20 5588 1 1 3 PRO CA C 7.176 -3.281 -0.867 1.00 . A A . 3 PRO CA 1 1 20 5589 1 1 3 PRO CB C 8.331 -3.168 0.142 1.00 . A A . 3 PRO CB 1 1 20 5590 1 1 3 PRO CD C 6.268 -3.280 1.376 1.00 . A A . 3 PRO CD 1 1 20 5591 1 1 3 PRO CG C 7.744 -3.682 1.450 1.00 . A A . 3 PRO CG 1 1 20 5592 1 1 3 PRO HA H 7.261 -2.507 -1.633 1.00 . A A . 3 PRO HA 1 1 20 5593 1 1 3 PRO HB2 H 9.227 -3.715 -0.157 1.00 . A A . 3 PRO HB2 1 1 20 5594 1 1 3 PRO HB3 H 8.614 -2.120 0.253 1.00 . A A . 3 PRO HB3 1 1 20 5595 1 1 3 PRO HD2 H 5.639 -4.053 1.820 1.00 . A A . 3 PRO HD2 1 1 20 5596 1 1 3 PRO HD3 H 6.102 -2.345 1.913 1.00 . A A . 3 PRO HD3 1 1 20 5597 1 1 3 PRO HG2 H 7.828 -4.771 1.482 1.00 . A A . 3 PRO HG2 1 1 20 5598 1 1 3 PRO HG3 H 8.250 -3.285 2.329 1.00 . A A . 3 PRO HG3 1 1 20 5599 1 1 3 PRO N N 5.970 -3.090 -0.049 1.00 . A A . 3 PRO N 1 1 20 5600 1 1 3 PRO O O 6.639 -5.634 -1.005 1.00 . A A . 3 PRO O 1 1 20 5601 1 1 4 TRP C C 9.229 -6.839 -2.420 1.00 . A A . 4 TRP C 1 1 20 5602 1 1 4 TRP CA C 8.229 -6.066 -3.291 1.00 . A A . 4 TRP CA 1 1 20 5603 1 1 4 TRP CB C 8.844 -5.823 -4.681 1.00 . A A . 4 TRP CB 1 1 20 5604 1 1 4 TRP CD1 C 7.931 -4.094 -6.297 1.00 . A A . 4 TRP CD1 1 1 20 5605 1 1 4 TRP CD2 C 6.745 -6.004 -6.309 1.00 . A A . 4 TRP CD2 1 1 20 5606 1 1 4 TRP CE2 C 6.131 -5.128 -7.255 1.00 . A A . 4 TRP CE2 1 1 20 5607 1 1 4 TRP CE3 C 6.165 -7.285 -6.153 1.00 . A A . 4 TRP CE3 1 1 20 5608 1 1 4 TRP CG C 7.888 -5.314 -5.715 1.00 . A A . 4 TRP CG 1 1 20 5609 1 1 4 TRP CH2 C 4.449 -6.783 -7.820 1.00 . A A . 4 TRP CH2 1 1 20 5610 1 1 4 TRP CZ2 C 5.001 -5.501 -8.003 1.00 . A A . 4 TRP CZ2 1 1 20 5611 1 1 4 TRP CZ3 C 5.031 -7.673 -6.896 1.00 . A A . 4 TRP CZ3 1 1 20 5612 1 1 4 TRP H H 8.386 -3.973 -3.014 1.00 . A A . 4 TRP H 1 1 20 5613 1 1 4 TRP HA H 7.308 -6.642 -3.396 1.00 . A A . 4 TRP HA 1 1 20 5614 1 1 4 TRP HB2 H 9.693 -5.140 -4.607 1.00 . A A . 4 TRP HB2 1 1 20 5615 1 1 4 TRP HB3 H 9.249 -6.757 -5.074 1.00 . A A . 4 TRP HB3 1 1 20 5616 1 1 4 TRP HD1 H 8.673 -3.337 -6.085 1.00 . A A . 4 TRP HD1 1 1 20 5617 1 1 4 TRP HE1 H 6.749 -3.159 -7.774 1.00 . A A . 4 TRP HE1 1 1 20 5618 1 1 4 TRP HE3 H 6.603 -7.983 -5.456 1.00 . A A . 4 TRP HE3 1 1 20 5619 1 1 4 TRP HH2 H 3.582 -7.082 -8.392 1.00 . A A . 4 TRP HH2 1 1 20 5620 1 1 4 TRP HZ2 H 4.563 -4.818 -8.714 1.00 . A A . 4 TRP HZ2 1 1 20 5621 1 1 4 TRP HZ3 H 4.608 -8.657 -6.763 1.00 . A A . 4 TRP HZ3 1 1 20 5622 1 1 4 TRP N N 7.924 -4.789 -2.650 1.00 . A A . 4 TRP N 1 1 20 5623 1 1 4 TRP NE1 N 6.895 -3.981 -7.202 1.00 . A A . 4 TRP NE1 1 1 20 5624 1 1 4 TRP O O 10.269 -6.309 -2.026 1.00 . A A . 4 TRP O 1 1 20 5625 1 1 5 LYS C C 10.880 -9.538 -1.909 1.00 . A A . 5 LYS C 1 1 20 5626 1 1 5 LYS CA C 9.655 -8.944 -1.186 1.00 . A A . 5 LYS CA 1 1 20 5627 1 1 5 LYS CB C 8.728 -10.070 -0.679 1.00 . A A . 5 LYS CB 1 1 20 5628 1 1 5 LYS CD C 6.636 -10.720 0.668 1.00 . A A . 5 LYS CD 1 1 20 5629 1 1 5 LYS CE C 7.247 -11.427 1.891 1.00 . A A . 5 LYS CE 1 1 20 5630 1 1 5 LYS CG C 7.510 -9.574 0.129 1.00 . A A . 5 LYS CG 1 1 20 5631 1 1 5 LYS H H 8.043 -8.462 -2.479 1.00 . A A . 5 LYS H 1 1 20 5632 1 1 5 LYS HA H 10.003 -8.355 -0.335 1.00 . A A . 5 LYS HA 1 1 20 5633 1 1 5 LYS HB2 H 8.387 -10.681 -1.518 1.00 . A A . 5 LYS HB2 1 1 20 5634 1 1 5 LYS HB3 H 9.327 -10.727 -0.049 1.00 . A A . 5 LYS HB3 1 1 20 5635 1 1 5 LYS HD2 H 5.662 -10.309 0.941 1.00 . A A . 5 LYS HD2 1 1 20 5636 1 1 5 LYS HD3 H 6.446 -11.430 -0.139 1.00 . A A . 5 LYS HD3 1 1 20 5637 1 1 5 LYS HE2 H 8.262 -11.756 1.678 1.00 . A A . 5 LYS HE2 1 1 20 5638 1 1 5 LYS HE3 H 7.311 -10.742 2.737 1.00 . A A . 5 LYS HE3 1 1 20 5639 1 1 5 LYS HG2 H 7.835 -8.930 0.948 1.00 . A A . 5 LYS HG2 1 1 20 5640 1 1 5 LYS HG3 H 6.893 -8.941 -0.513 1.00 . A A . 5 LYS HG3 1 1 20 5641 1 1 5 LYS HZ1 H 6.943 -13.109 3.019 1.00 . A A . 5 LYS HZ1 1 1 20 5642 1 1 5 LYS HZ2 H 6.424 -13.252 1.489 1.00 . A A . 5 LYS HZ2 1 1 20 5643 1 1 5 LYS HZ3 H 5.532 -12.369 2.568 1.00 . A A . 5 LYS HZ3 1 1 20 5644 1 1 5 LYS N N 8.901 -8.095 -2.100 1.00 . A A . 5 LYS N 1 1 20 5645 1 1 5 LYS NZ N 6.466 -12.615 2.276 1.00 . A A . 5 LYS NZ 1 1 20 5646 1 1 5 LYS O O 10.892 -10.709 -2.293 1.00 . A A . 5 LYS O 1 1 20 5647 1 1 6 TRP C C 13.898 -10.124 -1.773 1.00 . A A . 6 TRP C 1 1 20 5648 1 1 6 TRP CA C 13.215 -9.062 -2.657 1.00 . A A . 6 TRP CA 1 1 20 5649 1 1 6 TRP CB C 14.074 -7.777 -2.755 1.00 . A A . 6 TRP CB 1 1 20 5650 1 1 6 TRP CD1 C 15.903 -8.756 -4.234 1.00 . A A . 6 TRP CD1 1 1 20 5651 1 1 6 TRP CD2 C 16.695 -7.247 -2.773 1.00 . A A . 6 TRP CD2 1 1 20 5652 1 1 6 TRP CE2 C 17.813 -7.724 -3.525 1.00 . A A . 6 TRP CE2 1 1 20 5653 1 1 6 TRP CE3 C 16.961 -6.270 -1.783 1.00 . A A . 6 TRP CE3 1 1 20 5654 1 1 6 TRP CG C 15.489 -7.926 -3.249 1.00 . A A . 6 TRP CG 1 1 20 5655 1 1 6 TRP CH2 C 19.349 -6.280 -2.322 1.00 . A A . 6 TRP CH2 1 1 20 5656 1 1 6 TRP CZ2 C 19.121 -7.255 -3.312 1.00 . A A . 6 TRP CZ2 1 1 20 5657 1 1 6 TRP CZ3 C 18.269 -5.790 -1.561 1.00 . A A . 6 TRP CZ3 1 1 20 5658 1 1 6 TRP H H 11.759 -7.742 -1.828 1.00 . A A . 6 TRP H 1 1 20 5659 1 1 6 TRP HA H 13.056 -9.462 -3.660 1.00 . A A . 6 TRP HA 1 1 20 5660 1 1 6 TRP HB2 H 13.581 -7.050 -3.401 1.00 . A A . 6 TRP HB2 1 1 20 5661 1 1 6 TRP HB3 H 14.126 -7.311 -1.769 1.00 . A A . 6 TRP HB3 1 1 20 5662 1 1 6 TRP HD1 H 15.250 -9.395 -4.811 1.00 . A A . 6 TRP HD1 1 1 20 5663 1 1 6 TRP HE1 H 17.762 -9.116 -5.144 1.00 . A A . 6 TRP HE1 1 1 20 5664 1 1 6 TRP HE3 H 16.138 -5.862 -1.213 1.00 . A A . 6 TRP HE3 1 1 20 5665 1 1 6 TRP HH2 H 20.343 -5.880 -2.174 1.00 . A A . 6 TRP HH2 1 1 20 5666 1 1 6 TRP HZ2 H 19.939 -7.614 -3.921 1.00 . A A . 6 TRP HZ2 1 1 20 5667 1 1 6 TRP HZ3 H 18.438 -5.011 -0.826 1.00 . A A . 6 TRP HZ3 1 1 20 5668 1 1 6 TRP N N 11.914 -8.709 -2.094 1.00 . A A . 6 TRP N 1 1 20 5669 1 1 6 TRP NE1 N 17.270 -8.648 -4.391 1.00 . A A . 6 TRP NE1 1 1 20 5670 1 1 6 TRP O O 14.380 -9.801 -0.688 1.00 . A A . 6 TRP O 1 1 20 5671 1 1 7 LYS C C 13.389 -13.294 -0.799 1.00 . A A . 7 LYS C 1 1 20 5672 1 1 7 LYS CA C 14.460 -12.587 -1.643 1.00 . A A . 7 LYS CA 1 1 20 5673 1 1 7 LYS CB C 15.844 -12.417 -0.963 1.00 . A A . 7 LYS CB 1 1 20 5674 1 1 7 LYS CD C 18.071 -11.105 -1.195 1.00 . A A . 7 LYS CD 1 1 20 5675 1 1 7 LYS CE C 17.567 -9.824 -0.501 1.00 . A A . 7 LYS CE 1 1 20 5676 1 1 7 LYS CG C 16.941 -11.870 -1.904 1.00 . A A . 7 LYS CG 1 1 20 5677 1 1 7 LYS H H 13.404 -11.504 -3.117 1.00 . A A . 7 LYS H 1 1 20 5678 1 1 7 LYS HA H 14.633 -13.273 -2.474 1.00 . A A . 7 LYS HA 1 1 20 5679 1 1 7 LYS HB2 H 15.723 -11.801 -0.074 1.00 . A A . 7 LYS HB2 1 1 20 5680 1 1 7 LYS HB3 H 16.168 -13.385 -0.576 1.00 . A A . 7 LYS HB3 1 1 20 5681 1 1 7 LYS HD2 H 18.575 -11.758 -0.480 1.00 . A A . 7 LYS HD2 1 1 20 5682 1 1 7 LYS HD3 H 18.812 -10.847 -1.953 1.00 . A A . 7 LYS HD3 1 1 20 5683 1 1 7 LYS HE2 H 16.832 -9.329 -1.129 1.00 . A A . 7 LYS HE2 1 1 20 5684 1 1 7 LYS HE3 H 17.062 -10.065 0.436 1.00 . A A . 7 LYS HE3 1 1 20 5685 1 1 7 LYS HG2 H 17.359 -12.703 -2.473 1.00 . A A . 7 LYS HG2 1 1 20 5686 1 1 7 LYS HG3 H 16.508 -11.207 -2.654 1.00 . A A . 7 LYS HG3 1 1 20 5687 1 1 7 LYS HZ1 H 19.380 -9.291 0.318 1.00 . A A . 7 LYS HZ1 1 1 20 5688 1 1 7 LYS HZ2 H 18.271 -8.069 0.263 1.00 . A A . 7 LYS HZ2 1 1 20 5689 1 1 7 LYS HZ3 H 19.023 -8.529 -1.113 1.00 . A A . 7 LYS HZ3 1 1 20 5690 1 1 7 LYS N N 13.924 -11.370 -2.264 1.00 . A A . 7 LYS N 1 1 20 5691 1 1 7 LYS NZ N 18.651 -8.863 -0.233 1.00 . A A . 7 LYS NZ 1 1 20 5692 1 1 7 LYS O O 13.599 -13.574 0.382 1.00 . A A . 7 LYS O 1 1 20 5693 1 1 8 TRP C C 10.604 -15.310 -1.916 1.00 . A A . 8 TRP C 1 1 20 5694 1 1 8 TRP CA C 11.168 -14.385 -0.835 1.00 . A A . 8 TRP CA 1 1 20 5695 1 1 8 TRP CB C 10.117 -13.502 -0.139 1.00 . A A . 8 TRP CB 1 1 20 5696 1 1 8 TRP CD1 C 9.316 -14.664 1.964 1.00 . A A . 8 TRP CD1 1 1 20 5697 1 1 8 TRP CD2 C 7.784 -14.722 0.325 1.00 . A A . 8 TRP CD2 1 1 20 5698 1 1 8 TRP CE2 C 7.252 -15.475 1.418 1.00 . A A . 8 TRP CE2 1 1 20 5699 1 1 8 TRP CE3 C 6.972 -14.608 -0.827 1.00 . A A . 8 TRP CE3 1 1 20 5700 1 1 8 TRP CG C 9.120 -14.257 0.689 1.00 . A A . 8 TRP CG 1 1 20 5701 1 1 8 TRP CH2 C 5.214 -15.966 0.199 1.00 . A A . 8 TRP CH2 1 1 20 5702 1 1 8 TRP CZ2 C 5.995 -16.102 1.360 1.00 . A A . 8 TRP CZ2 1 1 20 5703 1 1 8 TRP CZ3 C 5.701 -15.215 -0.890 1.00 . A A . 8 TRP CZ3 1 1 20 5704 1 1 8 TRP H H 12.084 -13.271 -2.359 1.00 . A A . 8 TRP H 1 1 20 5705 1 1 8 TRP HA H 11.591 -15.025 -0.063 1.00 . A A . 8 TRP HA 1 1 20 5706 1 1 8 TRP HB2 H 10.627 -12.795 0.517 1.00 . A A . 8 TRP HB2 1 1 20 5707 1 1 8 TRP HB3 H 9.583 -12.908 -0.880 1.00 . A A . 8 TRP HB3 1 1 20 5708 1 1 8 TRP HD1 H 10.234 -14.502 2.515 1.00 . A A . 8 TRP HD1 1 1 20 5709 1 1 8 TRP HE1 H 8.242 -15.939 3.243 1.00 . A A . 8 TRP HE1 1 1 20 5710 1 1 8 TRP HE3 H 7.351 -14.076 -1.690 1.00 . A A . 8 TRP HE3 1 1 20 5711 1 1 8 TRP HH2 H 4.247 -16.446 0.138 1.00 . A A . 8 TRP HH2 1 1 20 5712 1 1 8 TRP HZ2 H 5.631 -16.683 2.197 1.00 . A A . 8 TRP HZ2 1 1 20 5713 1 1 8 TRP HZ3 H 5.112 -15.128 -1.792 1.00 . A A . 8 TRP HZ3 1 1 20 5714 1 1 8 TRP N N 12.231 -13.575 -1.408 1.00 . A A . 8 TRP N 1 1 20 5715 1 1 8 TRP NE1 N 8.210 -15.365 2.403 1.00 . A A . 8 TRP NE1 1 1 20 5716 1 1 8 TRP O O 9.770 -14.893 -2.716 1.00 . A A . 8 TRP O 1 1 20 5717 1 1 9 THR C C 8.949 -17.917 -2.177 1.00 . A A . 9 THR C 1 1 20 5718 1 1 9 THR CA C 10.431 -17.710 -2.582 1.00 . A A . 9 THR CA 1 1 20 5719 1 1 9 THR CB C 11.279 -19.001 -2.384 1.00 . A A . 9 THR CB 1 1 20 5720 1 1 9 THR CG2 C 12.655 -18.969 -3.075 1.00 . A A . 9 THR CG2 1 1 20 5721 1 1 9 THR H H 11.827 -16.795 -1.307 1.00 . A A . 9 THR H 1 1 20 5722 1 1 9 THR HA H 10.453 -17.462 -3.643 1.00 . A A . 9 THR HA 1 1 20 5723 1 1 9 THR HB H 10.740 -19.811 -2.876 1.00 . A A . 9 THR HB 1 1 20 5724 1 1 9 THR HG21 H 12.537 -18.920 -4.158 1.00 . A A . 9 THR HG21 1 1 20 5725 1 1 9 THR HG22 H 13.223 -19.873 -2.850 1.00 . A A . 9 THR HG22 1 1 20 5726 1 1 9 THR HG23 H 13.254 -18.110 -2.787 1.00 . A A . 9 THR HG23 1 1 20 5727 1 1 9 THR N N 11.065 -16.563 -1.928 1.00 . A A . 9 THR N 1 1 20 5728 1 1 9 THR O O 8.597 -17.615 -1.032 1.00 . A A . 9 THR O 1 1 20 5729 1 1 9 THR OG1 O 11.416 -19.437 -1.005 1.00 . A A . 9 THR OG1 1 1 20 5730 1 1 10 PRO C C 6.422 -19.860 -1.910 1.00 . A A . 10 PRO C 1 1 20 5731 1 1 10 PRO CA C 6.650 -18.617 -2.789 1.00 . A A . 10 PRO CA 1 1 20 5732 1 1 10 PRO CB C 5.988 -18.776 -4.166 1.00 . A A . 10 PRO CB 1 1 20 5733 1 1 10 PRO CD C 8.376 -18.758 -4.477 1.00 . A A . 10 PRO CD 1 1 20 5734 1 1 10 PRO CG C 7.084 -19.333 -5.061 1.00 . A A . 10 PRO CG 1 1 20 5735 1 1 10 PRO HA H 6.246 -17.736 -2.288 1.00 . A A . 10 PRO HA 1 1 20 5736 1 1 10 PRO HB2 H 5.100 -19.412 -4.152 1.00 . A A . 10 PRO HB2 1 1 20 5737 1 1 10 PRO HB3 H 5.678 -17.797 -4.536 1.00 . A A . 10 PRO HB3 1 1 20 5738 1 1 10 PRO HD2 H 9.193 -19.476 -4.559 1.00 . A A . 10 PRO HD2 1 1 20 5739 1 1 10 PRO HD3 H 8.657 -17.855 -5.022 1.00 . A A . 10 PRO HD3 1 1 20 5740 1 1 10 PRO HG2 H 7.101 -20.422 -4.980 1.00 . A A . 10 PRO HG2 1 1 20 5741 1 1 10 PRO HG3 H 6.947 -19.083 -6.115 1.00 . A A . 10 PRO HG3 1 1 20 5742 1 1 10 PRO N N 8.073 -18.411 -3.084 1.00 . A A . 10 PRO N 1 1 20 5743 1 1 10 PRO O O 6.988 -20.924 -2.155 1.00 . A A . 10 PRO O 1 1 20 5744 1 1 11 TRP C C 4.035 -21.603 -0.469 1.00 . A A . 11 TRP C 1 1 20 5745 1 1 11 TRP CA C 5.225 -20.771 0.056 1.00 . A A . 11 TRP CA 1 1 20 5746 1 1 11 TRP CB C 4.838 -20.102 1.391 1.00 . A A . 11 TRP CB 1 1 20 5747 1 1 11 TRP CD1 C 5.725 -21.830 3.017 1.00 . A A . 11 TRP CD1 1 1 20 5748 1 1 11 TRP CD2 C 3.600 -21.250 3.461 1.00 . A A . 11 TRP CD2 1 1 20 5749 1 1 11 TRP CE2 C 3.974 -22.232 4.428 1.00 . A A . 11 TRP CE2 1 1 20 5750 1 1 11 TRP CE3 C 2.288 -20.727 3.554 1.00 . A A . 11 TRP CE3 1 1 20 5751 1 1 11 TRP CG C 4.737 -21.019 2.573 1.00 . A A . 11 TRP CG 1 1 20 5752 1 1 11 TRP CH2 C 1.802 -22.124 5.502 1.00 . A A . 11 TRP CH2 1 1 20 5753 1 1 11 TRP CZ2 C 3.098 -22.667 5.437 1.00 . A A . 11 TRP CZ2 1 1 20 5754 1 1 11 TRP CZ3 C 1.399 -21.156 4.560 1.00 . A A . 11 TRP CZ3 1 1 20 5755 1 1 11 TRP H H 5.107 -18.826 -0.793 1.00 . A A . 11 TRP H 1 1 20 5756 1 1 11 TRP HA H 6.090 -21.420 0.200 1.00 . A A . 11 TRP HA 1 1 20 5757 1 1 11 TRP HB2 H 5.589 -19.355 1.652 1.00 . A A . 11 TRP HB2 1 1 20 5758 1 1 11 TRP HB3 H 3.897 -19.559 1.288 1.00 . A A . 11 TRP HB3 1 1 20 5759 1 1 11 TRP HD1 H 6.714 -21.886 2.579 1.00 . A A . 11 TRP HD1 1 1 20 5760 1 1 11 TRP HE1 H 5.869 -23.178 4.633 1.00 . A A . 11 TRP HE1 1 1 20 5761 1 1 11 TRP HE3 H 1.962 -19.986 2.841 1.00 . A A . 11 TRP HE3 1 1 20 5762 1 1 11 TRP HH2 H 1.120 -22.444 6.276 1.00 . A A . 11 TRP HH2 1 1 20 5763 1 1 11 TRP HZ2 H 3.414 -23.404 6.160 1.00 . A A . 11 TRP HZ2 1 1 20 5764 1 1 11 TRP HZ3 H 0.404 -20.738 4.614 1.00 . A A . 11 TRP HZ3 1 1 20 5765 1 1 11 TRP N N 5.569 -19.714 -0.891 1.00 . A A . 11 TRP N 1 1 20 5766 1 1 11 TRP NE1 N 5.276 -22.552 4.103 1.00 . A A . 11 TRP NE1 1 1 20 5767 1 1 11 TRP O O 3.331 -21.214 -1.403 1.00 . A A . 11 TRP O 1 1 20 5768 1 1 12 ARG C C 1.393 -23.173 0.346 1.00 . A A . 12 ARG C 1 1 20 5769 1 1 12 ARG CA C 2.737 -23.705 -0.188 1.00 . A A . 12 ARG CA 1 1 20 5770 1 1 12 ARG CB C 3.045 -25.055 0.511 1.00 . A A . 12 ARG CB 1 1 20 5771 1 1 12 ARG CD C 4.165 -26.630 -1.210 1.00 . A A . 12 ARG CD 1 1 20 5772 1 1 12 ARG CG C 4.340 -25.753 0.043 1.00 . A A . 12 ARG CG 1 1 20 5773 1 1 12 ARG CZ C 3.737 -29.086 -1.601 1.00 . A A . 12 ARG CZ 1 1 20 5774 1 1 12 ARG H H 4.311 -22.928 1.010 1.00 . A A . 12 ARG H 1 1 20 5775 1 1 12 ARG HA H 2.690 -23.837 -1.271 1.00 . A A . 12 ARG HA 1 1 20 5776 1 1 12 ARG HB2 H 3.127 -24.877 1.586 1.00 . A A . 12 ARG HB2 1 1 20 5777 1 1 12 ARG HB3 H 2.199 -25.734 0.399 1.00 . A A . 12 ARG HB3 1 1 20 5778 1 1 12 ARG HD2 H 3.531 -26.146 -1.954 1.00 . A A . 12 ARG HD2 1 1 20 5779 1 1 12 ARG HD3 H 5.147 -26.761 -1.668 1.00 . A A . 12 ARG HD3 1 1 20 5780 1 1 12 ARG HE H 3.169 -27.993 0.033 1.00 . A A . 12 ARG HE 1 1 20 5781 1 1 12 ARG HG2 H 5.129 -25.019 -0.134 1.00 . A A . 12 ARG HG2 1 1 20 5782 1 1 12 ARG HG3 H 4.719 -26.370 0.859 1.00 . A A . 12 ARG HG3 1 1 20 5783 1 1 12 ARG HH11 H 4.776 -28.223 -3.140 1.00 . A A . 12 ARG HH11 1 1 20 5784 1 1 12 ARG HH12 H 4.452 -29.893 -3.370 1.00 . A A . 12 ARG HH12 1 1 20 5785 1 1 12 ARG HH21 H 2.781 -30.294 -0.231 1.00 . A A . 12 ARG HH21 1 1 20 5786 1 1 12 ARG HH22 H 3.280 -31.097 -1.657 1.00 . A A . 12 ARG HH22 1 1 20 5787 1 1 12 ARG N N 3.797 -22.763 0.156 1.00 . A A . 12 ARG N 1 1 20 5788 1 1 12 ARG NE N 3.637 -27.967 -0.865 1.00 . A A . 12 ARG NE 1 1 20 5789 1 1 12 ARG NH1 N 4.350 -29.070 -2.788 1.00 . A A . 12 ARG NH1 1 1 20 5790 1 1 12 ARG NH2 N 3.219 -30.228 -1.140 1.00 . A A . 12 ARG NH2 1 1 20 5791 1 1 12 ARG O O 1.236 -23.015 1.554 1.00 . A A . 12 ARG O 1 1 20 5792 1 1 13 ARG C C -1.816 -23.404 0.530 1.00 . A A . 13 ARG C 1 1 20 5793 1 1 13 ARG CA C -0.922 -22.403 -0.251 1.00 . A A . 13 ARG CA 1 1 20 5794 1 1 13 ARG CB C -1.593 -21.944 -1.576 1.00 . A A . 13 ARG CB 1 1 20 5795 1 1 13 ARG CD C -3.184 -23.075 -3.268 1.00 . A A . 13 ARG CD 1 1 20 5796 1 1 13 ARG CG C -1.761 -23.019 -2.681 1.00 . A A . 13 ARG CG 1 1 20 5797 1 1 13 ARG CZ C -5.398 -23.995 -2.443 1.00 . A A . 13 ARG CZ 1 1 20 5798 1 1 13 ARG H H 0.680 -22.995 -1.515 1.00 . A A . 13 ARG H 1 1 20 5799 1 1 13 ARG HA H -0.807 -21.522 0.386 1.00 . A A . 13 ARG HA 1 1 20 5800 1 1 13 ARG HB2 H -2.564 -21.511 -1.329 1.00 . A A . 13 ARG HB2 1 1 20 5801 1 1 13 ARG HB3 H -1.027 -21.107 -1.985 1.00 . A A . 13 ARG HB3 1 1 20 5802 1 1 13 ARG HD2 H -3.518 -22.085 -3.585 1.00 . A A . 13 ARG HD2 1 1 20 5803 1 1 13 ARG HD3 H -3.187 -23.715 -4.151 1.00 . A A . 13 ARG HD3 1 1 20 5804 1 1 13 ARG HE H -3.698 -23.706 -1.339 1.00 . A A . 13 ARG HE 1 1 20 5805 1 1 13 ARG HG2 H -1.052 -22.814 -3.484 1.00 . A A . 13 ARG HG2 1 1 20 5806 1 1 13 ARG HG3 H -1.490 -24.007 -2.306 1.00 . A A . 13 ARG HG3 1 1 20 5807 1 1 13 ARG HH11 H -5.498 -23.507 -4.424 1.00 . A A . 13 ARG HH11 1 1 20 5808 1 1 13 ARG HH12 H -6.964 -24.142 -3.789 1.00 . A A . 13 ARG HH12 1 1 20 5809 1 1 13 ARG HH21 H -5.614 -24.545 -0.487 1.00 . A A . 13 ARG HH21 1 1 20 5810 1 1 13 ARG HH22 H -7.034 -24.759 -1.433 1.00 . A A . 13 ARG HH22 1 1 20 5811 1 1 13 ARG N N 0.421 -22.924 -0.543 1.00 . A A . 13 ARG N 1 1 20 5812 1 1 13 ARG NE N -4.121 -23.633 -2.280 1.00 . A A . 13 ARG NE 1 1 20 5813 1 1 13 ARG NH1 N -5.998 -23.884 -3.632 1.00 . A A . 13 ARG NH1 1 1 20 5814 1 1 13 ARG NH2 N -6.065 -24.473 -1.392 1.00 . A A . 13 ARG NH2 1 1 20 5815 1 1 13 ARG O O -2.901 -23.783 0.090 1.00 . A A . 13 ARG O 1 1 20 5816 1 1 14 NH2 HN1 H -1.924 -24.477 2.261 1.00 . A A . 14 NH2 HN1 1 1 20 5817 1 1 14 NH2 HN2 H -0.447 -23.543 2.001 1.00 . A A . 14 NH2 HN2 1 1 20 5818 1 1 14 NH2 N N -1.368 -23.862 1.690 1.00 . A A . 14 NH2 N 1 1 20 5819 2 2 1 . C1 C 11.945 -18.600 0.008 1.00 . B A . 101 BGC C1 1 1 20 5820 2 2 1 . C2 C 12.148 -19.440 1.287 1.00 . B A . 101 BGC C2 1 1 20 5821 2 2 1 . C3 C 12.809 -18.588 2.375 1.00 . B A . 101 BGC C3 1 1 20 5822 2 2 1 . C4 C 14.110 -17.980 1.854 1.00 . B A . 101 BGC C4 1 1 20 5823 2 2 1 . C5 C 13.793 -17.133 0.601 1.00 . B A . 101 BGC C5 1 1 20 5824 2 2 1 . C6 C 15.039 -16.546 -0.085 1.00 . B A . 101 BGC C6 1 1 20 5825 2 2 1 . H1 H 11.205 -17.812 0.200 1.00 . B A . 101 BGC H1 1 1 20 5826 2 2 1 . H2 H 12.778 -20.299 1.047 1.00 . B A . 101 BGC H2 1 1 20 5827 2 2 1 . H3 H 12.132 -17.779 2.659 1.00 . B A . 101 BGC H3 1 1 20 5828 2 2 1 . H4 H 14.796 -18.785 1.582 1.00 . B A . 101 BGC H4 1 1 20 5829 2 2 1 . H5 H 13.110 -16.326 0.860 1.00 . B A . 101 BGC H5 1 1 20 5830 2 2 1 . H6 H 14.440 -16.918 -1.895 1.00 . B A . 101 BGC H6 1 1 20 5831 2 2 1 . H6C1 H 15.833 -17.291 -0.128 1.00 . B A . 101 BGC H6C1 1 1 20 5832 2 2 1 . H6C2 H 15.424 -15.699 0.485 1.00 . B A . 101 BGC H6C2 1 1 20 5833 2 2 1 . HB H 11.105 -20.349 2.619 1.00 . B A . 101 BGC HB 1 1 20 5834 2 2 1 . HC H 13.618 -18.814 4.111 1.00 . B A . 101 BGC HC 1 1 20 5835 2 2 1 . HD H 15.635 -17.036 2.674 1.00 . B A . 101 BGC HD 1 1 20 5836 2 2 1 . O2 O 10.898 -19.902 1.782 1.00 . B A . 101 BGC O2 1 1 20 5837 2 2 1 . O3 O 13.074 -19.373 3.532 1.00 . B A . 101 BGC O3 1 1 20 5838 2 2 1 . O4 O 14.707 -17.205 2.895 1.00 . B A . 101 BGC O4 1 1 20 5839 2 2 1 . O5 O 13.163 -17.985 -0.372 1.00 . B A . 101 BGC O5 1 1 20 5840 2 2 1 . O6 O 14.743 -16.130 -1.417 1.00 . B A . 101 BGC O6 1 1 stop_ save_
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