data_Remediated_restraints_file_for_PDB_entry_1qbf # This BMRB archive file contains, for PDB entry 1qbf: # # - 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, minor 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 as part of the wwPDB 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. ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID rr_1qbf _Entry.Title 'wwPDB remediated NMR restraints for PDB entry 1qbf' _Entry.Version_type original _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'Contains the remediated restraint lists and coordinates for PDB entry 1qbf' _Entry.PDB_coordinate_file_version 3.20 loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1qbf 'Master copy' rr_1qbf stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID rr_1qbf _Assembly.ID 1 _Assembly.Name 1qbf _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass 4241.7007 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'PEPTIDE YY' 1 $PEPTIDE_YY A . no . . . . . . rr_1qbf 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PEPTIDE_YY _Entity.Sf_category entity _Entity.Sf_framecode PEPTIDE_YY _Entity.Entry_ID rr_1qbf _Entity.ID 1 _Entity.Name PEPTIDE_YY _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code ; YPAKPEAPGEDASPEELSRY YASLRHYLNLVTRQRYX ; _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer yes _Entity.Nstd_chirality yes _Entity.Nstd_linkage yes _Entity.Number_of_monomers 37 _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Parent_entity_ID 1 _Entity.Formula_weight 4241.7007 loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . TYR . rr_1qbf 1 2 . PRO . rr_1qbf 1 3 . ALA . rr_1qbf 1 4 . LYS . rr_1qbf 1 5 . PRO . rr_1qbf 1 6 . GLU . rr_1qbf 1 7 . ALA . rr_1qbf 1 8 . PRO . rr_1qbf 1 9 . GLY . rr_1qbf 1 10 . GLU . rr_1qbf 1 11 . ASP . rr_1qbf 1 12 . ALA . rr_1qbf 1 13 . SER . rr_1qbf 1 14 . PRO . rr_1qbf 1 15 . GLU . rr_1qbf 1 16 . GLU . rr_1qbf 1 17 . LEU . rr_1qbf 1 18 . SER . rr_1qbf 1 19 . ARG . rr_1qbf 1 20 . TYR . rr_1qbf 1 21 . TYR . rr_1qbf 1 22 . ALA . rr_1qbf 1 23 . SER . rr_1qbf 1 24 . LEU . rr_1qbf 1 25 . ARG . rr_1qbf 1 26 . HIS . rr_1qbf 1 27 . TYR . rr_1qbf 1 28 . LEU . rr_1qbf 1 29 . ASN . rr_1qbf 1 30 . LEU . rr_1qbf 1 31 . VAL . rr_1qbf 1 32 . THR . rr_1qbf 1 33 . ARG . rr_1qbf 1 34 . GLN . rr_1qbf 1 35 . ARG . rr_1qbf 1 36 . TYR . rr_1qbf 1 37 . NH2 . rr_1qbf 1 stop_ loop_ _Entity_poly_seq.Hetero _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 . TYR 1 1 rr_1qbf 1 . PRO 2 2 rr_1qbf 1 . ALA 3 3 rr_1qbf 1 . LYS 4 4 rr_1qbf 1 . PRO 5 5 rr_1qbf 1 . GLU 6 6 rr_1qbf 1 . ALA 7 7 rr_1qbf 1 . PRO 8 8 rr_1qbf 1 . GLY 9 9 rr_1qbf 1 . GLU 10 10 rr_1qbf 1 . ASP 11 11 rr_1qbf 1 . ALA 12 12 rr_1qbf 1 . SER 13 13 rr_1qbf 1 . PRO 14 14 rr_1qbf 1 . GLU 15 15 rr_1qbf 1 . GLU 16 16 rr_1qbf 1 . LEU 17 17 rr_1qbf 1 . SER 18 18 rr_1qbf 1 . ARG 19 19 rr_1qbf 1 . TYR 20 20 rr_1qbf 1 . TYR 21 21 rr_1qbf 1 . ALA 22 22 rr_1qbf 1 . SER 23 23 rr_1qbf 1 . LEU 24 24 rr_1qbf 1 . ARG 25 25 rr_1qbf 1 . HIS 26 26 rr_1qbf 1 . TYR 27 27 rr_1qbf 1 . LEU 28 28 rr_1qbf 1 . ASN 29 29 rr_1qbf 1 . LEU 30 30 rr_1qbf 1 . VAL 31 31 rr_1qbf 1 . THR 32 32 rr_1qbf 1 . ARG 33 33 rr_1qbf 1 . GLN 34 34 rr_1qbf 1 . ARG 35 35 rr_1qbf 1 . TYR 36 36 rr_1qbf 1 . NH2 37 37 rr_1qbf 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID rr_1qbf _Chem_comp.ID NH2 _Chem_comp.Name 'AMINO GROUP' _Chem_comp.Type non-polymer _Chem_comp.PDB_code NH2 _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic no _Chem_comp.Aromatic no _Chem_comp.Formula 'H2 N' _Chem_comp.Formula_weight 16.0225 save_ ############################## # Structure determinations # ############################## ########################## # Conformer statistics # ########################## save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID rr_1qbf _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 1 save_ ##################################### # Conformer family coordinate set # ##################################### save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID rr_1qbf _Conformer_family_coord_set.ID 1 loop_ _Conformer_family_refinement.Refine_method _Conformer_family_refinement.Refine_details _Conformer_family_refinement.Software_ID _Conformer_family_refinement.Software_label _Conformer_family_refinement.Entry_ID _Conformer_family_refinement.Conformer_family_coord_set_ID 1 . . . rr_1qbf 1 stop_ loop_ _Conformer_family_software.Software_ID _Conformer_family_software.Software_label _Conformer_family_software.Method_ID _Conformer_family_software.Method_label _Conformer_family_software.Entry_ID _Conformer_family_software.Conformer_family_coord_set_ID . . . . rr_1qbf 1 stop_ loop_ _Atom_site.Assembly_ID _Atom_site.Model_ID _Atom_site.Model_site_ID _Atom_site.ID _Atom_site.Assembly_atom_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.Cartn_x_esd _Atom_site.Cartn_y_esd _Atom_site.Cartn_z_esd _Atom_site.Occupancy _Atom_site.Occupancy_esd _Atom_site.Uncertainty _Atom_site.Ordered_flag _Atom_site.Footnote_ID _Atom_site.PDBX_label_asym_ID _Atom_site.PDBX_label_seq_ID _Atom_site.PDBX_label_comp_ID _Atom_site.PDBX_label_atom_ID _Atom_site.PDBX_formal_charge _Atom_site.PDBX_label_entity_ID _Atom_site.PDB_record_ID _Atom_site.PDB_model_num _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.Auth_entity_assembly_ID _Atom_site.Auth_asym_ID _Atom_site.Auth_chain_ID _Atom_site.Auth_seq_ID _Atom_site.Auth_comp_ID _Atom_site.Auth_atom_ID _Atom_site.Auth_alt_ID _Atom_site.Auth_atom_name _Atom_site.Details _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID . 1 . 1 . 1 1 1 TYR C C -11.215 4.918 0.368 . . . 1.0 . . . . . . . . . . . . A . 1 TYR C . . . . . . . . . rr_1qbf 1 . 1 . 2 . 1 1 1 TYR CA C -12.042 5.091 1.655 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CA . . . . . . . . . rr_1qbf 1 . 1 . 3 . 1 1 1 TYR CB C -12.047 3.797 2.464 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CB . . . . . . . . . rr_1qbf 1 . 1 . 4 . 1 1 1 TYR CD1 C -9.752 3.748 3.500 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CD1 . . . . . . . . . rr_1qbf 1 . 1 . 5 . 1 1 1 TYR CD2 C -11.650 4.332 4.891 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CD2 . . . . . . . . . rr_1qbf 1 . 1 . 6 . 1 1 1 TYR CE1 C -8.899 3.905 4.598 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CE1 . . . . . . . . . rr_1qbf 1 . 1 . 7 . 1 1 1 TYR CE2 C -10.798 4.490 5.989 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CE2 . . . . . . . . . rr_1qbf 1 . 1 . 8 . 1 1 1 TYR CG C -11.127 3.960 3.647 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CG . . . . . . . . . rr_1qbf 1 . 1 . 9 . 1 1 1 TYR CZ C -9.421 4.276 5.843 . . . 1.0 . . . . . . . . . . . . A . 1 TYR CZ . . . . . . . . . rr_1qbf 1 . 1 . 10 . 1 1 1 TYR H1 H -13.445 6.309 0.714 . . . 1.0 . . . . . . . . . . . . A . 1 TYR H1 . . . . . . . . . rr_1qbf 1 . 1 . 11 . 1 1 1 TYR H2 H -13.990 5.618 2.167 . . . 1.0 . . . . . . . . . . . . A . 1 TYR H2 . . . . . . . . . rr_1qbf 1 . 1 . 12 . 1 1 1 TYR H3 H -13.875 4.668 0.762 . . . 1.0 . . . . . . . . . . . . A . 1 TYR H3 . . . . . . . . . rr_1qbf 1 . 1 . 13 . 1 1 1 TYR HA H -11.615 5.878 2.257 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HA . . . . . . . . . rr_1qbf 1 . 1 . 14 . 1 1 1 TYR HB2 H -13.051 3.595 2.811 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HB2 . . . . . . . . . rr_1qbf 1 . 1 . 15 . 1 1 1 TYR HB3 H -11.708 2.981 1.850 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HB3 . . . . . . . . . rr_1qbf 1 . 1 . 16 . 1 1 1 TYR HD1 H -9.348 3.464 2.540 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HD1 . . . . . . . . . rr_1qbf 1 . 1 . 17 . 1 1 1 TYR HD2 H -12.711 4.496 5.003 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HD2 . . . . . . . . . rr_1qbf 1 . 1 . 18 . 1 1 1 TYR HE1 H -7.837 3.739 4.485 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HE1 . . . . . . . . . rr_1qbf 1 . 1 . 19 . 1 1 1 TYR HE2 H -11.201 4.777 6.949 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HE2 . . . . . . . . . rr_1qbf 1 . 1 . 20 . 1 1 1 TYR HH H -8.295 5.351 6.947 . . . 1.0 . . . . . . . . . . . . A . 1 TYR HH . . . . . . . . . rr_1qbf 1 . 1 . 21 . 1 1 1 TYR N N -13.444 5.449 1.298 . . . 1.0 . . . . . . . . . . . . A . 1 TYR N . . . . . . . . . rr_1qbf 1 . 1 . 22 . 1 1 1 TYR O O -11.291 3.898 -0.282 . . . 1.0 . . . . . . . . . . . . A . 1 TYR O . . . . . . . . . rr_1qbf 1 . 1 . 23 . 1 1 1 TYR OH O -8.580 4.434 6.925 . . . 1.0 . . . . . . . . . . . . A . 1 TYR OH . . . . . . . . . rr_1qbf 1 . 1 . 24 . 1 1 2 PRO C C -8.258 5.365 -0.913 . . . 1.0 . . . . . . . . . . . . A . 2 PRO C . . . . . . . . . rr_1qbf 1 . 1 . 25 . 1 1 2 PRO CA C -9.628 5.991 -1.173 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CA . . . . . . . . . rr_1qbf 1 . 1 . 26 . 1 1 2 PRO CB C -9.457 7.487 -1.431 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CB . . . . . . . . . rr_1qbf 1 . 1 . 27 . 1 1 2 PRO CD C -10.407 7.172 0.833 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CD . . . . . . . . . rr_1qbf 1 . 1 . 28 . 1 1 2 PRO CG C -9.683 8.186 -0.070 . . . 1.0 . . . . . . . . . . . . A . 2 PRO CG . . . . . . . . . rr_1qbf 1 . 1 . 29 . 1 1 2 PRO HA H -10.119 5.523 -2.009 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HA . . . . . . . . . rr_1qbf 1 . 1 . 30 . 1 1 2 PRO HB2 H -8.459 7.688 -1.797 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB2 . . . . . . . . . rr_1qbf 1 . 1 . 31 . 1 1 2 PRO HB3 H -10.192 7.830 -2.142 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HB3 . . . . . . . . . rr_1qbf 1 . 1 . 32 . 1 1 2 PRO HD2 H -9.840 6.993 1.735 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD2 . . . . . . . . . rr_1qbf 1 . 1 . 33 . 1 1 2 PRO HD3 H -11.402 7.507 1.065 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HD3 . . . . . . . . . rr_1qbf 1 . 1 . 34 . 1 1 2 PRO HG2 H -8.730 8.457 0.366 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG2 . . . . . . . . . rr_1qbf 1 . 1 . 35 . 1 1 2 PRO HG3 H -10.296 9.064 -0.199 . . . 1.0 . . . . . . . . . . . . A . 2 PRO HG3 . . . . . . . . . rr_1qbf 1 . 1 . 36 . 1 1 2 PRO N N -10.470 5.947 0.034 . . . 1.0 . . . . . . . . . . . . A . 2 PRO N . . . . . . . . . rr_1qbf 1 . 1 . 37 . 1 1 2 PRO O O -8.019 4.749 0.105 . . . 1.0 . . . . . . . . . . . . A . 2 PRO O . . . . . . . . . rr_1qbf 1 . 1 . 38 . 1 1 3 ALA C C -5.138 5.901 -0.884 . . . 1.0 . . . . . . . . . . . . A . 3 ALA C . . . . . . . . . rr_1qbf 1 . 1 . 39 . 1 1 3 ALA CA C -6.002 4.961 -1.708 . . . 1.0 . . . . . . . . . . . . A . 3 ALA CA . . . . . . . . . rr_1qbf 1 . 1 . 40 . 1 1 3 ALA CB C -5.390 4.811 -3.103 . . . 1.0 . . . . . . . . . . . . A . 3 ALA CB . . . . . . . . . rr_1qbf 1 . 1 . 41 . 1 1 3 ALA H H -7.590 6.023 -2.649 . . . 1.0 . . . . . . . . . . . . A . 3 ALA H . . . . . . . . . rr_1qbf 1 . 1 . 42 . 1 1 3 ALA HA H -6.057 4.004 -1.227 . . . 1.0 . . . . . . . . . . . . A . 3 ALA HA . . . . . . . . . rr_1qbf 1 . 1 . 43 . 1 1 3 ALA HB1 H -4.730 5.639 -3.299 . . . 1.0 . . . . . . . . . . . . A . 3 ALA HB1 . . . . . . . . . rr_1qbf 1 . 1 . 44 . 1 1 3 ALA HB2 H -6.169 4.812 -3.835 . . . 1.0 . . . . . . . . . . . . A . 3 ALA HB2 . . . . . . . . . rr_1qbf 1 . 1 . 45 . 1 1 3 ALA HB3 H -4.835 3.888 -3.158 . . . 1.0 . . . . . . . . . . . . A . 3 ALA HB3 . . . . . . . . . rr_1qbf 1 . 1 . 46 . 1 1 3 ALA N N -7.362 5.529 -1.845 . . . 1.0 . . . . . . . . . . . . A . 3 ALA N . . . . . . . . . rr_1qbf 1 . 1 . 47 . 1 1 3 ALA O O -5.577 6.466 0.098 . . . 1.0 . . . . . . . . . . . . A . 3 ALA O . . . . . . . . . rr_1qbf 1 . 1 . 48 . 1 1 4 LYS C C -2.450 6.264 0.725 . . . 1.0 . . . . . . . . . . . . A . 4 LYS C . . . . . . . . . rr_1qbf 1 . 1 . 49 . 1 1 4 LYS CA C -2.996 6.959 -0.538 . . . 1.0 . . . . . . . . . . . . A . 4 LYS CA . . . . . . . . . rr_1qbf 1 . 1 . 50 . 1 1 4 LYS CB C -3.758 8.236 -0.166 . . . 1.0 . . . . . . . . . . . . A . 4 LYS CB . . . . . . . . . rr_1qbf 1 . 1 . 51 . 1 1 4 LYS CD C -4.819 10.094 -1.475 . . . 1.0 . . . . . . . . . . . . A . 4 LYS CD . . . . . . . . . rr_1qbf 1 . 1 . 52 . 1 1 4 LYS CE C -6.261 10.573 -1.298 . . . 1.0 . . . . . . . . . . . . A . 4 LYS CE . . . . . . . . . rr_1qbf 1 . 1 . 53 . 1 1 4 LYS CG C -4.761 8.578 -1.284 . . . 1.0 . . . . . . . . . . . . A . 4 LYS CG . . . . . . . . . rr_1qbf 1 . 1 . 54 . 1 1 4 LYS H H -3.563 5.592 -2.060 . . . 1.0 . . . . . . . . . . . . A . 4 LYS H . . . . . . . . . rr_1qbf 1 . 1 . 55 . 1 1 4 LYS HA H -2.168 7.221 -1.179 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HA . . . . . . . . . rr_1qbf 1 . 1 . 56 . 1 1 4 LYS HB2 H -4.289 8.081 0.763 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HB2 . . . . . . . . . rr_1qbf 1 . 1 . 57 . 1 1 4 LYS HB3 H -3.059 9.051 -0.050 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HB3 . . . . . . . . . rr_1qbf 1 . 1 . 58 . 1 1 4 LYS HD2 H -4.187 10.575 -0.742 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HD2 . . . . . . . . . rr_1qbf 1 . 1 . 59 . 1 1 4 LYS HD3 H -4.477 10.347 -2.467 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HD3 . . . . . . . . . rr_1qbf 1 . 1 . 60 . 1 1 4 LYS HE2 H -6.665 10.168 -0.382 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HE2 . . . . . . . . . rr_1qbf 1 . 1 . 61 . 1 1 4 LYS HE3 H -6.278 11.652 -1.253 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HE3 . . . . . . . . . rr_1qbf 1 . 1 . 62 . 1 1 4 LYS HG2 H -4.450 8.103 -2.208 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HG2 . . . . . . . . . rr_1qbf 1 . 1 . 63 . 1 1 4 LYS HG3 H -5.745 8.211 -1.015 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HG3 . . . . . . . . . rr_1qbf 1 . 1 . 64 . 1 1 4 LYS HZ1 H -7.155 10.873 -3.155 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HZ1 . . . . . . . . . rr_1qbf 1 . 1 . 65 . 1 1 4 LYS HZ2 H -8.035 9.854 -2.118 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HZ2 . . . . . . . . . rr_1qbf 1 . 1 . 66 . 1 1 4 LYS HZ3 H -6.632 9.282 -2.888 . . . 1.0 . . . . . . . . . . . . A . 4 LYS HZ3 . . . . . . . . . rr_1qbf 1 . 1 . 67 . 1 1 4 LYS N N -3.902 6.067 -1.277 . . . 1.0 . . . . . . . . . . . . A . 4 LYS N . . . . . . . . . rr_1qbf 1 . 1 . 68 . 1 1 4 LYS NZ N -7.083 10.111 -2.452 . . . 1.0 . . . . . . . . . . . . A . 4 LYS NZ . . . . . . . . . rr_1qbf 1 . 1 . 69 . 1 1 4 LYS O O -2.108 6.939 1.676 . . . 1.0 . . . . . . . . . . . . A . 4 LYS O . . . . . . . . . rr_1qbf 1 . 1 . 70 . 1 1 5 PRO C C -0.274 4.415 1.927 . . . 1.0 . . . . . . . . . . . . A . 5 PRO C . . . . . . . . . rr_1qbf 1 . 1 . 71 . 1 1 5 PRO CA C -1.787 4.205 1.867 . . . 1.0 . . . . . . . . . . . . A . 5 PRO CA . . . . . . . . . rr_1qbf 1 . 1 . 72 . 1 1 5 PRO CB C -2.108 2.739 1.566 . . . 1.0 . . . . . . . . . . . . A . 5 PRO CB . . . . . . . . . rr_1qbf 1 . 1 . 73 . 1 1 5 PRO CD C -2.738 4.050 -0.419 . . . 1.0 . . . . . . . . . . . . A . 5 PRO CD . . . . . . . . . rr_1qbf 1 . 1 . 74 . 1 1 5 PRO CG C -2.298 2.649 0.037 . . . 1.0 . . . . . . . . . . . . A . 5 PRO CG . . . . . . . . . rr_1qbf 1 . 1 . 75 . 1 1 5 PRO HA H -2.260 4.513 2.785 . . . 1.0 . . . . . . . . . . . . A . 5 PRO HA . . . . . . . . . rr_1qbf 1 . 1 . 76 . 1 1 5 PRO HB2 H -1.288 2.107 1.882 . . . 1.0 . . . . . . . . . . . . A . 5 PRO HB2 . . . . . . . . . rr_1qbf 1 . 1 . 77 . 1 1 5 PRO HB3 H -3.019 2.447 2.064 . . . 1.0 . . . . . . . . . . . . A . 5 PRO HB3 . . . . . . . . . rr_1qbf 1 . 1 . 78 . 1 1 5 PRO HD2 H -2.240 4.330 -1.339 . . . 1.0 . . . . . . . . . . . . A . 5 PRO HD2 . . . . . . . . . rr_1qbf 1 . 1 . 79 . 1 1 5 PRO HD3 H -3.811 4.067 -0.550 . . . 1.0 . . . . . . . . . . . . A . 5 PRO HD3 . . . . . . . . . rr_1qbf 1 . 1 . 80 . 1 1 5 PRO HG2 H -1.363 2.377 -0.436 . . . 1.0 . . . . . . . . . . . . A . 5 PRO HG2 . . . . . . . . . rr_1qbf 1 . 1 . 81 . 1 1 5 PRO HG3 H -3.062 1.928 -0.204 . . . 1.0 . . . . . . . . . . . . A . 5 PRO HG3 . . . . . . . . . rr_1qbf 1 . 1 . 82 . 1 1 5 PRO N N -2.340 4.939 0.711 . . . 1.0 . . . . . . . . . . . . A . 5 PRO N . . . . . . . . . rr_1qbf 1 . 1 . 83 . 1 1 5 PRO O O 0.457 3.928 1.088 . . . 1.0 . . . . . . . . . . . . A . 5 PRO O . . . . . . . . . rr_1qbf 1 . 1 . 84 . 1 1 6 GLU C C 2.401 4.053 2.937 . . . 1.0 . . . . . . . . . . . . A . 6 GLU C . . . . . . . . . rr_1qbf 1 . 1 . 85 . 1 1 6 GLU CA C 1.673 5.379 2.970 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CA . . . . . . . . . rr_1qbf 1 . 1 . 86 . 1 1 6 GLU CB C 2.023 6.142 4.250 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CB . . . . . . . . . rr_1qbf 1 . 1 . 87 . 1 1 6 GLU CD C 1.782 6.088 6.737 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CD . . . . . . . . . rr_1qbf 1 . 1 . 88 . 1 1 6 GLU CG C 1.797 5.238 5.465 . . . 1.0 . . . . . . . . . . . . A . 6 GLU CG . . . . . . . . . rr_1qbf 1 . 1 . 89 . 1 1 6 GLU H H -0.387 5.541 3.558 . . . 1.0 . . . . . . . . . . . . A . 6 GLU H . . . . . . . . . rr_1qbf 1 . 1 . 90 . 1 1 6 GLU HA H 1.970 5.941 2.114 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HA . . . . . . . . . rr_1qbf 1 . 1 . 91 . 1 1 6 GLU HB2 H 3.060 6.446 4.215 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB2 . . . . . . . . . rr_1qbf 1 . 1 . 92 . 1 1 6 GLU HB3 H 1.395 7.015 4.333 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HB3 . . . . . . . . . rr_1qbf 1 . 1 . 93 . 1 1 6 GLU HG2 H 0.851 4.725 5.362 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG2 . . . . . . . . . rr_1qbf 1 . 1 . 94 . 1 1 6 GLU HG3 H 2.594 4.512 5.529 . . . 1.0 . . . . . . . . . . . . A . 6 GLU HG3 . . . . . . . . . rr_1qbf 1 . 1 . 95 . 1 1 6 GLU N N 0.208 5.144 2.895 . . . 1.0 . . . . . . . . . . . . A . 6 GLU N . . . . . . . . . rr_1qbf 1 . 1 . 96 . 1 1 6 GLU O O 3.553 3.972 2.560 . . . 1.0 . . . . . . . . . . . . A . 6 GLU O . . . . . . . . . rr_1qbf 1 . 1 . 97 . 1 1 6 GLU OE1 O 2.653 6.931 6.871 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE1 . . . . . . . . . rr_1qbf 1 . 1 . 98 . 1 1 6 GLU OE2 O 0.900 5.882 7.555 . . . 1.0 . . . . . . . . . . . . A . 6 GLU OE2 . . . . . . . . . rr_1qbf 1 . 1 . 99 . 1 1 7 ALA C C 3.594 1.624 4.155 . . . 1.0 . . . . . . . . . . . . A . 7 ALA C . . . . . . . . . rr_1qbf 1 . 1 . 100 . 1 1 7 ALA CA C 2.374 1.687 3.232 . . . 1.0 . . . . . . . . . . . . A . 7 ALA CA . . . . . . . . . rr_1qbf 1 . 1 . 101 . 1 1 7 ALA CB C 2.820 1.454 1.820 . . . 1.0 . . . . . . . . . . . . A . 7 ALA CB . . . . . . . . . rr_1qbf 1 . 1 . 102 . 1 1 7 ALA H H 0.798 3.089 3.554 . . . 1.0 . . . . . . . . . . . . A . 7 ALA H . . . . . . . . . rr_1qbf 1 . 1 . 103 . 1 1 7 ALA HA H 1.662 0.943 3.496 . . . 1.0 . . . . . . . . . . . . A . 7 ALA HA . . . . . . . . . rr_1qbf 1 . 1 . 104 . 1 1 7 ALA HB1 H 3.121 0.429 1.699 . . . 1.0 . . . . . . . . . . . . A . 7 ALA HB1 . . . . . . . . . rr_1qbf 1 . 1 . 105 . 1 1 7 ALA HB2 H 3.651 2.108 1.602 . . . 1.0 . . . . . . . . . . . . A . 7 ALA HB2 . . . . . . . . . rr_1qbf 1 . 1 . 106 . 1 1 7 ALA HB3 H 2.000 1.676 1.152 . . . 1.0 . . . . . . . . . . . . A . 7 ALA HB3 . . . . . . . . . rr_1qbf 1 . 1 . 107 . 1 1 7 ALA N N 1.733 3.009 3.286 . . . 1.0 . . . . . . . . . . . . A . 7 ALA N . . . . . . . . . rr_1qbf 1 . 1 . 108 . 1 1 7 ALA O O 4.261 2.616 4.368 . . . 1.0 . . . . . . . . . . . . A . 7 ALA O . . . . . . . . . rr_1qbf 1 . 1 . 109 . 1 1 8 PRO C C 6.286 -0.059 4.802 . . . 1.0 . . . . . . . . . . . . A . 8 PRO C . . . . . . . . . rr_1qbf 1 . 1 . 110 . 1 1 8 PRO CA C 4.982 0.209 5.580 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CA . . . . . . . . . rr_1qbf 1 . 1 . 111 . 1 1 8 PRO CB C 4.551 -1.044 6.349 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CB . . . . . . . . . rr_1qbf 1 . 1 . 112 . 1 1 8 PRO CD C 3.012 -0.741 4.425 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CD . . . . . . . . . rr_1qbf 1 . 1 . 113 . 1 1 8 PRO CG C 3.519 -1.772 5.449 . . . 1.0 . . . . . . . . . . . . A . 8 PRO CG . . . . . . . . . rr_1qbf 1 . 1 . 114 . 1 1 8 PRO HA H 5.103 1.036 6.252 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HA . . . . . . . . . rr_1qbf 1 . 1 . 115 . 1 1 8 PRO HB2 H 5.405 -1.680 6.534 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB2 . . . . . . . . . rr_1qbf 1 . 1 . 116 . 1 1 8 PRO HB3 H 4.085 -0.765 7.281 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HB3 . . . . . . . . . rr_1qbf 1 . 1 . 117 . 1 1 8 PRO HD2 H 3.155 -1.108 3.417 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD2 . . . . . . . . . rr_1qbf 1 . 1 . 118 . 1 1 8 PRO HD3 H 1.973 -0.511 4.604 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HD3 . . . . . . . . . rr_1qbf 1 . 1 . 119 . 1 1 8 PRO HG2 H 3.993 -2.598 4.937 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG2 . . . . . . . . . rr_1qbf 1 . 1 . 120 . 1 1 8 PRO HG3 H 2.694 -2.128 6.043 . . . 1.0 . . . . . . . . . . . . A . 8 PRO HG3 . . . . . . . . . rr_1qbf 1 . 1 . 121 . 1 1 8 PRO N N 3.848 0.449 4.673 . . . 1.0 . . . . . . . . . . . . A . 8 PRO N . . . . . . . . . rr_1qbf 1 . 1 . 122 . 1 1 8 PRO O O 7.012 0.852 4.457 . . . 1.0 . . . . . . . . . . . . A . 8 PRO O . . . . . . . . . rr_1qbf 1 . 1 . 123 . 1 1 9 GLY C C 9.008 -1.756 4.791 . . . 1.0 . . . . . . . . . . . . A . 9 GLY C . . . . . . . . . rr_1qbf 1 . 1 . 124 . 1 1 9 GLY CA C 7.839 -1.654 3.804 . . . 1.0 . . . . . . . . . . . . A . 9 GLY CA . . . . . . . . . rr_1qbf 1 . 1 . 125 . 1 1 9 GLY H H 6.001 -2.022 4.827 . . . 1.0 . . . . . . . . . . . . A . 9 GLY H . . . . . . . . . rr_1qbf 1 . 1 . 126 . 1 1 9 GLY HA2 H 7.704 -2.599 3.306 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA2 . . . . . . . . . rr_1qbf 1 . 1 . 127 . 1 1 9 GLY HA3 H 8.049 -0.893 3.083 . . . 1.0 . . . . . . . . . . . . A . 9 GLY HA3 . . . . . . . . . rr_1qbf 1 . 1 . 128 . 1 1 9 GLY N N 6.591 -1.309 4.539 . . . 1.0 . . . . . . . . . . . . A . 9 GLY N . . . . . . . . . rr_1qbf 1 . 1 . 129 . 1 1 9 GLY O O 8.899 -1.336 5.924 . . . 1.0 . . . . . . . . . . . . A . 9 GLY O . . . . . . . . . rr_1qbf 1 . 1 . 130 . 1 1 10 GLU C C 12.358 -3.386 4.801 . . . 1.0 . . . . . . . . . . . . A . 10 GLU C . . . . . . . . . rr_1qbf 1 . 1 . 131 . 1 1 10 GLU CA C 11.286 -2.409 5.320 . . . 1.0 . . . . . . . . . . . . A . 10 GLU CA . . . . . . . . . rr_1qbf 1 . 1 . 132 . 1 1 10 GLU CB C 10.782 -2.907 6.677 . . . 1.0 . . . . . . . . . . . . A . 10 GLU CB . . . . . . . . . rr_1qbf 1 . 1 . 133 . 1 1 10 GLU CD C 9.934 -5.121 7.469 . . . 1.0 . . . . . . . . . . . . A . 10 GLU CD . . . . . . . . . rr_1qbf 1 . 1 . 134 . 1 1 10 GLU CG C 9.726 -3.992 6.457 . . . 1.0 . . . . . . . . . . . . A . 10 GLU CG . . . . . . . . . rr_1qbf 1 . 1 . 135 . 1 1 10 GLU H H 10.209 -2.632 3.453 . . . 1.0 . . . . . . . . . . . . A . 10 GLU H . . . . . . . . . rr_1qbf 1 . 1 . 136 . 1 1 10 GLU HA H 11.727 -1.435 5.443 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HA . . . . . . . . . rr_1qbf 1 . 1 . 137 . 1 1 10 GLU HB2 H 11.608 -3.317 7.239 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HB2 . . . . . . . . . rr_1qbf 1 . 1 . 138 . 1 1 10 GLU HB3 H 10.345 -2.086 7.226 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HB3 . . . . . . . . . rr_1qbf 1 . 1 . 139 . 1 1 10 GLU HG2 H 8.741 -3.568 6.585 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HG2 . . . . . . . . . rr_1qbf 1 . 1 . 140 . 1 1 10 GLU HG3 H 9.821 -4.387 5.456 . . . 1.0 . . . . . . . . . . . . A . 10 GLU HG3 . . . . . . . . . rr_1qbf 1 . 1 . 141 . 1 1 10 GLU N N 10.129 -2.303 4.375 . . . 1.0 . . . . . . . . . . . . A . 10 GLU N . . . . . . . . . rr_1qbf 1 . 1 . 142 . 1 1 10 GLU O O 13.492 -3.349 5.234 . . . 1.0 . . . . . . . . . . . . A . 10 GLU O . . . . . . . . . rr_1qbf 1 . 1 . 143 . 1 1 10 GLU OE1 O 10.864 -5.889 7.287 . . . 1.0 . . . . . . . . . . . . A . 10 GLU OE1 . . . . . . . . . rr_1qbf 1 . 1 . 144 . 1 1 10 GLU OE2 O 9.158 -5.199 8.408 . . . 1.0 . . . . . . . . . . . . A . 10 GLU OE2 . . . . . . . . . rr_1qbf 1 . 1 . 145 . 1 1 11 ASP C C 14.283 -4.474 2.945 . . . 1.0 . . . . . . . . . . . . A . 11 ASP C . . . . . . . . . rr_1qbf 1 . 1 . 146 . 1 1 11 ASP CA C 13.030 -5.232 3.381 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CA . . . . . . . . . rr_1qbf 1 . 1 . 147 . 1 1 11 ASP CB C 12.451 -5.996 2.187 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CB . . . . . . . . . rr_1qbf 1 . 1 . 148 . 1 1 11 ASP CG C 12.891 -7.460 2.256 . . . 1.0 . . . . . . . . . . . . A . 11 ASP CG . . . . . . . . . rr_1qbf 1 . 1 . 149 . 1 1 11 ASP H H 11.113 -4.287 3.558 . . . 1.0 . . . . . . . . . . . . A . 11 ASP H . . . . . . . . . rr_1qbf 1 . 1 . 150 . 1 1 11 ASP HA H 13.283 -5.927 4.163 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HA . . . . . . . . . rr_1qbf 1 . 1 . 151 . 1 1 11 ASP HB2 H 11.372 -5.941 2.213 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB2 . . . . . . . . . rr_1qbf 1 . 1 . 152 . 1 1 11 ASP HB3 H 12.812 -5.557 1.269 . . . 1.0 . . . . . . . . . . . . A . 11 ASP HB3 . . . . . . . . . rr_1qbf 1 . 1 . 153 . 1 1 11 ASP N N 12.020 -4.261 3.895 . . . 1.0 . . . . . . . . . . . . A . 11 ASP N . . . . . . . . . rr_1qbf 1 . 1 . 154 . 1 1 11 ASP O O 15.397 -4.896 3.183 . . . 1.0 . . . . . . . . . . . . A . 11 ASP O . . . . . . . . . rr_1qbf 1 . 1 . 155 . 1 1 11 ASP OD1 O 13.759 -7.759 3.061 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD1 . . . . . . . . . rr_1qbf 1 . 1 . 156 . 1 1 11 ASP OD2 O 12.354 -8.257 1.505 . . . 1.0 . . . . . . . . . . . . A . 11 ASP OD2 . . . . . . . . . rr_1qbf 1 . 1 . 157 . 1 1 12 ALA C C 15.201 -1.213 2.624 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_1qbf 1 . 1 . 158 . 1 1 12 ALA CA C 15.255 -2.534 1.884 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_1qbf 1 . 1 . 159 . 1 1 12 ALA CB C 15.165 -2.250 0.379 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_1qbf 1 . 1 . 160 . 1 1 12 ALA H H 13.202 -3.027 2.165 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_1qbf 1 . 1 . 161 . 1 1 12 ALA HA H 16.163 -3.049 2.112 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_1qbf 1 . 1 . 162 . 1 1 12 ALA HB1 H 14.453 -1.451 0.207 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_1qbf 1 . 1 . 163 . 1 1 12 ALA HB2 H 14.835 -3.136 -0.140 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_1qbf 1 . 1 . 164 . 1 1 12 ALA HB3 H 16.131 -1.950 0.005 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_1qbf 1 . 1 . 165 . 1 1 12 ALA N N 14.101 -3.347 2.325 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_1qbf 1 . 1 . 166 . 1 1 12 ALA O O 16.179 -0.737 3.165 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_1qbf 1 . 1 . 167 . 1 1 13 SER C C 12.338 0.902 3.356 . . . 1.0 . . . . . . . . . . . . A . 13 SER C . . . . . . . . . rr_1qbf 1 . 1 . 168 . 1 1 13 SER CA C 13.862 0.688 3.293 . . . 1.0 . . . . . . . . . . . . A . 13 SER CA . . . . . . . . . rr_1qbf 1 . 1 . 169 . 1 1 13 SER CB C 14.578 1.724 2.428 . . . 1.0 . . . . . . . . . . . . A . 13 SER CB . . . . . . . . . rr_1qbf 1 . 1 . 170 . 1 1 13 SER H H 13.275 -1.039 2.162 . . . 1.0 . . . . . . . . . . . . A . 13 SER H . . . . . . . . . rr_1qbf 1 . 1 . 171 . 1 1 13 SER HA H 14.281 0.665 4.289 . . . 1.0 . . . . . . . . . . . . A . 13 SER HA . . . . . . . . . rr_1qbf 1 . 1 . 172 . 1 1 13 SER HB2 H 13.995 1.915 1.545 . . . 1.0 . . . . . . . . . . . . A . 13 SER HB2 . . . . . . . . . rr_1qbf 1 . 1 . 173 . 1 1 13 SER HB3 H 14.699 2.637 2.989 . . . 1.0 . . . . . . . . . . . . A . 13 SER HB3 . . . . . . . . . rr_1qbf 1 . 1 . 174 . 1 1 13 SER HG H 16.107 1.662 1.225 . . . 1.0 . . . . . . . . . . . . A . 13 SER HG . . . . . . . . . rr_1qbf 1 . 1 . 175 . 1 1 13 SER N N 14.046 -0.619 2.627 . . . 1.0 . . . . . . . . . . . . A . 13 SER N . . . . . . . . . rr_1qbf 1 . 1 . 176 . 1 1 13 SER O O 11.630 -0.076 3.485 . . . 1.0 . . . . . . . . . . . . A . 13 SER O . . . . . . . . . rr_1qbf 1 . 1 . 177 . 1 1 13 SER OG O 15.851 1.224 2.040 . . . 1.0 . . . . . . . . . . . . A . 13 SER OG . . . . . . . . . rr_1qbf 1 . 1 . 178 . 1 1 14 PRO C C 9.822 1.831 1.860 . . . 1.0 . . . . . . . . . . . . A . 14 PRO C . . . . . . . . . rr_1qbf 1 . 1 . 179 . 1 1 14 PRO CA C 10.367 2.277 3.224 . . . 1.0 . . . . . . . . . . . . A . 14 PRO CA . . . . . . . . . rr_1qbf 1 . 1 . 180 . 1 1 14 PRO CB C 10.160 3.774 3.471 . . . 1.0 . . . . . . . . . . . . A . 14 PRO CB . . . . . . . . . rr_1qbf 1 . 1 . 181 . 1 1 14 PRO CD C 12.565 3.385 3.057 . . . 1.0 . . . . . . . . . . . . A . 14 PRO CD . . . . . . . . . rr_1qbf 1 . 1 . 182 . 1 1 14 PRO CG C 11.471 4.470 3.051 . . . 1.0 . . . . . . . . . . . . A . 14 PRO CG . . . . . . . . . rr_1qbf 1 . 1 . 183 . 1 1 14 PRO HA H 9.922 1.701 4.020 . . . 1.0 . . . . . . . . . . . . A . 14 PRO HA . . . . . . . . . rr_1qbf 1 . 1 . 184 . 1 1 14 PRO HB2 H 9.334 4.137 2.875 . . . 1.0 . . . . . . . . . . . . A . 14 PRO HB2 . . . . . . . . . rr_1qbf 1 . 1 . 185 . 1 1 14 PRO HB3 H 9.972 3.955 4.518 . . . 1.0 . . . . . . . . . . . . A . 14 PRO HB3 . . . . . . . . . rr_1qbf 1 . 1 . 186 . 1 1 14 PRO HD2 H 13.095 3.403 2.118 . . . 1.0 . . . . . . . . . . . . A . 14 PRO HD2 . . . . . . . . . rr_1qbf 1 . 1 . 187 . 1 1 14 PRO HD3 H 13.244 3.531 3.883 . . . 1.0 . . . . . . . . . . . . A . 14 PRO HD3 . . . . . . . . . rr_1qbf 1 . 1 . 188 . 1 1 14 PRO HG2 H 11.366 4.889 2.060 . . . 1.0 . . . . . . . . . . . . A . 14 PRO HG2 . . . . . . . . . rr_1qbf 1 . 1 . 189 . 1 1 14 PRO HG3 H 11.723 5.245 3.758 . . . 1.0 . . . . . . . . . . . . A . 14 PRO HG3 . . . . . . . . . rr_1qbf 1 . 1 . 190 . 1 1 14 PRO N N 11.821 2.111 3.220 . . . 1.0 . . . . . . . . . . . . A . 14 PRO N . . . . . . . . . rr_1qbf 1 . 1 . 191 . 1 1 14 PRO O O 8.655 1.987 1.562 . . . 1.0 . . . . . . . . . . . . A . 14 PRO O . . . . . . . . . rr_1qbf 1 . 1 . 192 . 1 1 15 GLU C C 10.497 -0.664 -0.486 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_1qbf 1 . 1 . 193 . 1 1 15 GLU CA C 10.236 0.805 -0.304 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_1qbf 1 . 1 . 194 . 1 1 15 GLU CB C 10.995 1.532 -1.401 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_1qbf 1 . 1 . 195 . 1 1 15 GLU CD C 13.338 2.260 -1.869 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_1qbf 1 . 1 . 196 . 1 1 15 GLU CG C 12.456 1.085 -1.445 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_1qbf 1 . 1 . 197 . 1 1 15 GLU H H 11.598 1.154 1.277 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_1qbf 1 . 1 . 198 . 1 1 15 GLU HA H 9.199 0.979 -0.410 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_1qbf 1 . 1 . 199 . 1 1 15 GLU HB2 H 10.544 1.284 -2.334 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_1qbf 1 . 1 . 200 . 1 1 15 GLU HB3 H 10.948 2.587 -1.234 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_1qbf 1 . 1 . 201 . 1 1 15 GLU HG2 H 12.759 0.742 -0.473 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_1qbf 1 . 1 . 202 . 1 1 15 GLU HG3 H 12.562 0.283 -2.164 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_1qbf 1 . 1 . 203 . 1 1 15 GLU N N 10.676 1.268 1.027 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_1qbf 1 . 1 . 204 . 1 1 15 GLU O O 9.745 -1.315 -1.153 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_1qbf 1 . 1 . 205 . 1 1 15 GLU OE1 O 13.061 3.368 -1.441 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_1qbf 1 . 1 . 206 . 1 1 15 GLU OE2 O 14.275 2.032 -2.617 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_1qbf 1 . 1 . 207 . 1 1 16 GLU C C 12.053 -3.013 -1.522 . . . 1.0 . . . . . . . . . . . . A . 16 GLU C . . . . . . . . . rr_1qbf 1 . 1 . 208 . 1 1 16 GLU CA C 11.995 -2.568 -0.049 . . . 1.0 . . . . . . . . . . . . A . 16 GLU CA . . . . . . . . . rr_1qbf 1 . 1 . 209 . 1 1 16 GLU CB C 11.102 -3.509 0.772 . . . 1.0 . . . . . . . . . . . . A . 16 GLU CB . . . . . . . . . rr_1qbf 1 . 1 . 210 . 1 1 16 GLU CD C 8.866 -3.863 1.807 . . . 1.0 . . . . . . . . . . . . A . 16 GLU CD . . . . . . . . . rr_1qbf 1 . 1 . 211 . 1 1 16 GLU CG C 9.795 -2.832 1.158 . . . 1.0 . . . . . . . . . . . . A . 16 GLU CG . . . . . . . . . rr_1qbf 1 . 1 . 212 . 1 1 16 GLU H H 12.137 -0.543 0.573 . . . 1.0 . . . . . . . . . . . . A . 16 GLU H . . . . . . . . . rr_1qbf 1 . 1 . 213 . 1 1 16 GLU HA H 12.980 -2.626 0.346 . . . 1.0 . . . . . . . . . . . . A . 16 GLU HA . . . . . . . . . rr_1qbf 1 . 1 . 214 . 1 1 16 GLU HB2 H 10.892 -4.389 0.198 . . . 1.0 . . . . . . . . . . . . A . 16 GLU HB2 . . . . . . . . . rr_1qbf 1 . 1 . 215 . 1 1 16 GLU HB3 H 11.628 -3.794 1.671 . . . 1.0 . . . . . . . . . . . . A . 16 GLU HB3 . . . . . . . . . rr_1qbf 1 . 1 . 216 . 1 1 16 GLU HG2 H 9.998 -2.024 1.845 . . . 1.0 . . . . . . . . . . . . A . 16 GLU HG2 . . . . . . . . . rr_1qbf 1 . 1 . 217 . 1 1 16 GLU HG3 H 9.322 -2.445 0.286 . . . 1.0 . . . . . . . . . . . . A . 16 GLU HG3 . . . . . . . . . rr_1qbf 1 . 1 . 218 . 1 1 16 GLU N N 11.572 -1.144 0.073 . . . 1.0 . . . . . . . . . . . . A . 16 GLU N . . . . . . . . . rr_1qbf 1 . 1 . 219 . 1 1 16 GLU O O 13.095 -3.383 -2.027 . . . 1.0 . . . . . . . . . . . . A . 16 GLU O . . . . . . . . . rr_1qbf 1 . 1 . 220 . 1 1 16 GLU OE1 O 9.240 -4.421 2.822 . . . 1.0 . . . . . . . . . . . . A . 16 GLU OE1 . . . . . . . . . rr_1qbf 1 . 1 . 221 . 1 1 16 GLU OE2 O 7.792 -4.076 1.271 . . . 1.0 . . . . . . . . . . . . A . 16 GLU OE2 . . . . . . . . . rr_1qbf 1 . 1 . 222 . 1 1 17 LEU C C 10.281 -2.395 -4.554 . . . 1.0 . . . . . . . . . . . . A . 17 LEU C . . . . . . . . . rr_1qbf 1 . 1 . 223 . 1 1 17 LEU CA C 10.916 -3.447 -3.618 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CA . . . . . . . . . rr_1qbf 1 . 1 . 224 . 1 1 17 LEU CB C 10.107 -4.747 -3.731 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CB . . . . . . . . . rr_1qbf 1 . 1 . 225 . 1 1 17 LEU CD1 C 9.201 -4.769 -1.403 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD1 . . . . . . . . . rr_1qbf 1 . 1 . 226 . 1 1 17 LEU CD2 C 8.100 -3.343 -3.122 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CD2 . . . . . . . . . rr_1qbf 1 . 1 . 227 . 1 1 17 LEU CG C 8.831 -4.668 -2.877 . . . 1.0 . . . . . . . . . . . . A . 17 LEU CG . . . . . . . . . rr_1qbf 1 . 1 . 228 . 1 1 17 LEU H H 10.146 -2.735 -1.758 . . . 1.0 . . . . . . . . . . . . A . 17 LEU H . . . . . . . . . rr_1qbf 1 . 1 . 229 . 1 1 17 LEU HA H 11.920 -3.637 -3.933 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HA . . . . . . . . . rr_1qbf 1 . 1 . 230 . 1 1 17 LEU HB2 H 9.836 -4.911 -4.763 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB2 . . . . . . . . . rr_1qbf 1 . 1 . 231 . 1 1 17 LEU HB3 H 10.712 -5.573 -3.387 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HB3 . . . . . . . . . rr_1qbf 1 . 1 . 232 . 1 1 17 LEU HD11 H 10.260 -4.961 -1.322 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD11 . . . . . . . . . rr_1qbf 1 . 1 . 233 . 1 1 17 LEU HD12 H 8.649 -5.569 -0.942 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD12 . . . . . . . . . rr_1qbf 1 . 1 . 234 . 1 1 17 LEU HD13 H 8.968 -3.835 -0.908 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD13 . . . . . . . . . rr_1qbf 1 . 1 . 235 . 1 1 17 LEU HD21 H 7.204 -3.318 -2.526 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD21 . . . . . . . . . rr_1qbf 1 . 1 . 236 . 1 1 17 LEU HD22 H 7.835 -3.262 -4.158 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD22 . . . . . . . . . rr_1qbf 1 . 1 . 237 . 1 1 17 LEU HD23 H 8.735 -2.512 -2.848 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HD23 . . . . . . . . . rr_1qbf 1 . 1 . 238 . 1 1 17 LEU HG H 8.179 -5.491 -3.136 . . . 1.0 . . . . . . . . . . . . A . 17 LEU HG . . . . . . . . . rr_1qbf 1 . 1 . 239 . 1 1 17 LEU N N 10.948 -3.005 -2.196 . . . 1.0 . . . . . . . . . . . . A . 17 LEU N . . . . . . . . . rr_1qbf 1 . 1 . 240 . 1 1 17 LEU O O 9.388 -2.712 -5.307 . . . 1.0 . . . . . . . . . . . . A . 17 LEU O . . . . . . . . . rr_1qbf 1 . 1 . 241 . 1 1 18 SER C C 9.003 0.555 -4.729 . . . 1.0 . . . . . . . . . . . . A . 18 SER C . . . . . . . . . rr_1qbf 1 . 1 . 242 . 1 1 18 SER CA C 10.144 -0.127 -5.425 . . . 1.0 . . . . . . . . . . . . A . 18 SER CA . . . . . . . . . rr_1qbf 1 . 1 . 243 . 1 1 18 SER CB C 9.694 -0.738 -6.745 . . . 1.0 . . . . . . . . . . . . A . 18 SER CB . . . . . . . . . rr_1qbf 1 . 1 . 244 . 1 1 18 SER H H 11.424 -0.906 -3.913 . . . 1.0 . . . . . . . . . . . . A . 18 SER H . . . . . . . . . rr_1qbf 1 . 1 . 245 . 1 1 18 SER HA H 10.878 0.599 -5.617 . . . 1.0 . . . . . . . . . . . . A . 18 SER HA . . . . . . . . . rr_1qbf 1 . 1 . 246 . 1 1 18 SER HB2 H 10.264 -1.633 -6.933 . . . 1.0 . . . . . . . . . . . . A . 18 SER HB2 . . . . . . . . . rr_1qbf 1 . 1 . 247 . 1 1 18 SER HB3 H 8.649 -0.984 -6.685 . . . 1.0 . . . . . . . . . . . . A . 18 SER HB3 . . . . . . . . . rr_1qbf 1 . 1 . 248 . 1 1 18 SER HG H 10.621 0.788 -7.523 . . . 1.0 . . . . . . . . . . . . A . 18 SER HG . . . . . . . . . rr_1qbf 1 . 1 . 249 . 1 1 18 SER N N 10.721 -1.161 -4.525 . . . 1.0 . . . . . . . . . . . . A . 18 SER N . . . . . . . . . rr_1qbf 1 . 1 . 250 . 1 1 18 SER O O 7.879 0.164 -4.853 . . . 1.0 . . . . . . . . . . . . A . 18 SER O . . . . . . . . . rr_1qbf 1 . 1 . 251 . 1 1 18 SER OG O 9.918 0.194 -7.796 . . . 1.0 . . . . . . . . . . . . A . 18 SER OG . . . . . . . . . rr_1qbf 1 . 1 . 252 . 1 1 19 ARG C C 7.251 1.382 -2.697 . . . 1.0 . . . . . . . . . . . . A . 19 ARG C . . . . . . . . . rr_1qbf 1 . 1 . 253 . 1 1 19 ARG CA C 8.320 2.342 -3.211 . . . 1.0 . . . . . . . . . . . . A . 19 ARG CA . . . . . . . . . rr_1qbf 1 . 1 . 254 . 1 1 19 ARG CB C 7.696 3.452 -4.065 . . . 1.0 . . . . . . . . . . . . A . 19 ARG CB . . . . . . . . . rr_1qbf 1 . 1 . 255 . 1 1 19 ARG CD C 6.639 2.357 -6.050 . . . 1.0 . . . . . . . . . . . . A . 19 ARG CD . . . . . . . . . rr_1qbf 1 . 1 . 256 . 1 1 19 ARG CG C 7.843 3.164 -5.565 . . . 1.0 . . . . . . . . . . . . A . 19 ARG CG . . . . . . . . . rr_1qbf 1 . 1 . 257 . 1 1 19 ARG CZ C 5.647 3.920 -7.614 . . . 1.0 . . . . . . . . . . . . A . 19 ARG CZ . . . . . . . . . rr_1qbf 1 . 1 . 258 . 1 1 19 ARG H H 10.263 1.833 -3.937 . . . 1.0 . . . . . . . . . . . . A . 19 ARG H . . . . . . . . . rr_1qbf 1 . 1 . 259 . 1 1 19 ARG HA H 8.814 2.792 -2.360 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HA . . . . . . . . . rr_1qbf 1 . 1 . 260 . 1 1 19 ARG HB2 H 6.653 3.534 -3.823 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HB2 . . . . . . . . . rr_1qbf 1 . 1 . 261 . 1 1 19 ARG HB3 H 8.193 4.382 -3.836 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HB3 . . . . . . . . . rr_1qbf 1 . 1 . 262 . 1 1 19 ARG HD2 H 6.930 1.742 -6.884 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HD2 . . . . . . . . . rr_1qbf 1 . 1 . 263 . 1 1 19 ARG HD3 H 6.279 1.729 -5.247 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HD3 . . . . . . . . . rr_1qbf 1 . 1 . 264 . 1 1 19 ARG HE H 4.767 3.400 -5.914 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HE . . . . . . . . . rr_1qbf 1 . 1 . 265 . 1 1 19 ARG HG2 H 7.884 4.101 -6.102 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HG2 . . . . . . . . . rr_1qbf 1 . 1 . 266 . 1 1 19 ARG HG3 H 8.747 2.611 -5.750 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HG3 . . . . . . . . . rr_1qbf 1 . 1 . 267 . 1 1 19 ARG HH11 H 7.593 3.516 -7.861 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HH11 . . . . . . . . . rr_1qbf 1 . 1 . 268 . 1 1 19 ARG HH12 H 6.860 4.458 -9.115 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HH12 . . . . . . . . . rr_1qbf 1 . 1 . 269 . 1 1 19 ARG HH21 H 3.721 4.471 -7.637 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HH21 . . . . . . . . . rr_1qbf 1 . 1 . 270 . 1 1 19 ARG HH22 H 4.668 5.002 -8.986 . . . 1.0 . . . . . . . . . . . . A . 19 ARG HH22 . . . . . . . . . rr_1qbf 1 . 1 . 271 . 1 1 19 ARG N N 9.328 1.576 -3.988 . . . 1.0 . . . . . . . . . . . . A . 19 ARG N . . . . . . . . . rr_1qbf 1 . 1 . 272 . 1 1 19 ARG NE N 5.554 3.280 -6.480 . . . 1.0 . . . . . . . . . . . . A . 19 ARG NE . . . . . . . . . rr_1qbf 1 . 1 . 273 . 1 1 19 ARG NH1 N 6.789 3.969 -8.246 . . . 1.0 . . . . . . . . . . . . A . 19 ARG NH1 . . . . . . . . . rr_1qbf 1 . 1 . 274 . 1 1 19 ARG NH2 N 4.597 4.510 -8.119 . . . 1.0 . . . . . . . . . . . . A . 19 ARG NH2 . . . . . . . . . rr_1qbf 1 . 1 . 275 . 1 1 19 ARG O O 6.071 1.674 -2.712 . . . 1.0 . . . . . . . . . . . . A . 19 ARG O . . . . . . . . . rr_1qbf 1 . 1 . 276 . 1 1 20 TYR C C 5.538 -0.835 -2.706 . . . 1.0 . . . . . . . . . . . . A . 20 TYR C . . . . . . . . . rr_1qbf 1 . 1 . 277 . 1 1 20 TYR CA C 6.721 -0.803 -1.759 . . . 1.0 . . . . . . . . . . . . A . 20 TYR CA . . . . . . . . . rr_1qbf 1 . 1 . 278 . 1 1 20 TYR CB C 6.270 -0.451 -0.354 . . . 1.0 . . . . . . . . . . . . A . 20 TYR CB . . . . . . . . . rr_1qbf 1 . 1 . 279 . 1 1 20 TYR CD1 C 4.052 0.668 -0.726 . . . 1.0 . . . . . . . . . . . . A . 20 TYR CD1 . . . . . . . . . rr_1qbf 1 . 1 . 280 . 1 1 20 TYR CD2 C 5.964 2.029 -0.132 . . . 1.0 . . . . . . . . . . . . A . 20 TYR CD2 . . . . . . . . . rr_1qbf 1 . 1 . 281 . 1 1 20 TYR CE1 C 3.253 1.798 -0.780 . . . 1.0 . . . . . . . . . . . . A . 20 TYR CE1 . . . . . . . . . rr_1qbf 1 . 1 . 282 . 1 1 20 TYR CE2 C 5.155 3.165 -0.182 . . . 1.0 . . . . . . . . . . . . A . 20 TYR CE2 . . . . . . . . . rr_1qbf 1 . 1 . 283 . 1 1 20 TYR CG C 5.411 0.778 -0.404 . . . 1.0 . . . . . . . . . . . . A . 20 TYR CG . . . . . . . . . rr_1qbf 1 . 1 . 284 . 1 1 20 TYR CZ C 3.799 3.041 -0.506 . . . 1.0 . . . . . . . . . . . . A . 20 TYR CZ . . . . . . . . . rr_1qbf 1 . 1 . 285 . 1 1 20 TYR H H 8.621 0.018 -2.285 . . . 1.0 . . . . . . . . . . . . A . 20 TYR H . . . . . . . . . rr_1qbf 1 . 1 . 286 . 1 1 20 TYR HA H 7.204 -1.761 -1.746 . . . 1.0 . . . . . . . . . . . . A . 20 TYR HA . . . . . . . . . rr_1qbf 1 . 1 . 287 . 1 1 20 TYR HB2 H 5.706 -1.275 0.053 . . . 1.0 . . . . . . . . . . . . A . 20 TYR HB2 . . . . . . . . . rr_1qbf 1 . 1 . 288 . 1 1 20 TYR HB3 H 7.136 -0.262 0.259 . . . 1.0 . . . . . . . . . . . . A . 20 TYR HB3 . . . . . . . . . rr_1qbf 1 . 1 . 289 . 1 1 20 TYR HD1 H 3.621 -0.292 -0.928 . . . 1.0 . . . . . . . . . . . . A . 20 TYR HD1 . . . . . . . . . rr_1qbf 1 . 1 . 290 . 1 1 20 TYR HD2 H 7.012 2.118 0.116 . . . 1.0 . . . . . . . . . . . . A . 20 TYR HD2 . . . . . . . . . rr_1qbf 1 . 1 . 291 . 1 1 20 TYR HE1 H 2.206 1.709 -1.024 . . . 1.0 . . . . . . . . . . . . A . 20 TYR HE1 . . . . . . . . . rr_1qbf 1 . 1 . 292 . 1 1 20 TYR HE2 H 5.576 4.138 0.027 . . . 1.0 . . . . . . . . . . . . A . 20 TYR HE2 . . . . . . . . . rr_1qbf 1 . 1 . 293 . 1 1 20 TYR HH H 3.524 4.913 -0.262 . . . 1.0 . . . . . . . . . . . . A . 20 TYR HH . . . . . . . . . rr_1qbf 1 . 1 . 294 . 1 1 20 TYR N N 7.674 0.219 -2.261 . . . 1.0 . . . . . . . . . . . . A . 20 TYR N . . . . . . . . . rr_1qbf 1 . 1 . 295 . 1 1 20 TYR O O 4.435 -1.172 -2.363 . . . 1.0 . . . . . . . . . . . . A . 20 TYR O . . . . . . . . . rr_1qbf 1 . 1 . 296 . 1 1 20 TYR OH O 3.000 4.165 -0.554 . . . 1.0 . . . . . . . . . . . . A . 20 TYR OH . . . . . . . . . rr_1qbf 1 . 1 . 297 . 1 1 21 TYR C C 3.924 -1.783 -4.765 . . . 1.0 . . . . . . . . . . . . A . 21 TYR C . . . . . . . . . rr_1qbf 1 . 1 . 298 . 1 1 21 TYR CA C 4.742 -0.491 -4.944 . . . 1.0 . . . . . . . . . . . . A . 21 TYR CA . . . . . . . . . rr_1qbf 1 . 1 . 299 . 1 1 21 TYR CB C 5.448 -0.480 -6.312 . . . 1.0 . . . . . . . . . . . . A . 21 TYR CB . . . . . . . . . rr_1qbf 1 . 1 . 300 . 1 1 21 TYR CD1 C 6.919 -2.465 -6.107 . . . 1.0 . . . . . . . . . . . . A . 21 TYR CD1 . . . . . . . . . rr_1qbf 1 . 1 . 301 . 1 1 21 TYR CD2 C 4.861 -2.673 -7.355 . . . 1.0 . . . . . . . . . . . . A . 21 TYR CD2 . . . . . . . . . rr_1qbf 1 . 1 . 302 . 1 1 21 TYR CE1 C 7.184 -3.814 -6.311 . . . 1.0 . . . . . . . . . . . . A . 21 TYR CE1 . . . . . . . . . rr_1qbf 1 . 1 . 303 . 1 1 21 TYR CE2 C 5.113 -4.028 -7.549 . . . 1.0 . . . . . . . . . . . . A . 21 TYR CE2 . . . . . . . . . rr_1qbf 1 . 1 . 304 . 1 1 21 TYR CG C 5.770 -1.898 -6.632 . . . 1.0 . . . . . . . . . . . . A . 21 TYR CG . . . . . . . . . rr_1qbf 1 . 1 . 305 . 1 1 21 TYR CZ C 6.276 -4.595 -7.026 . . . 1.0 . . . . . . . . . . . . A . 21 TYR CZ . . . . . . . . . rr_1qbf 1 . 1 . 306 . 1 1 21 TYR H H 6.696 -0.278 -4.161 . . . 1.0 . . . . . . . . . . . . A . 21 TYR H . . . . . . . . . rr_1qbf 1 . 1 . 307 . 1 1 21 TYR HA H 4.130 0.381 -4.826 . . . 1.0 . . . . . . . . . . . . A . 21 TYR HA . . . . . . . . . rr_1qbf 1 . 1 . 308 . 1 1 21 TYR HB2 H 4.813 -0.057 -7.065 . . . 1.0 . . . . . . . . . . . . A . 21 TYR HB2 . . . . . . . . . rr_1qbf 1 . 1 . 309 . 1 1 21 TYR HB3 H 6.360 0.085 -6.247 . . . 1.0 . . . . . . . . . . . . A . 21 TYR HB3 . . . . . . . . . rr_1qbf 1 . 1 . 310 . 1 1 21 TYR HD1 H 7.606 -1.854 -5.548 . . . 1.0 . . . . . . . . . . . . A . 21 TYR HD1 . . . . . . . . . rr_1qbf 1 . 1 . 311 . 1 1 21 TYR HD2 H 3.967 -2.222 -7.761 . . . 1.0 . . . . . . . . . . . . A . 21 TYR HD2 . . . . . . . . . rr_1qbf 1 . 1 . 312 . 1 1 21 TYR HE1 H 8.082 -4.257 -5.909 . . . 1.0 . . . . . . . . . . . . A . 21 TYR HE1 . . . . . . . . . rr_1qbf 1 . 1 . 313 . 1 1 21 TYR HE2 H 4.416 -4.636 -8.106 . . . 1.0 . . . . . . . . . . . . A . 21 TYR HE2 . . . . . . . . . rr_1qbf 1 . 1 . 314 . 1 1 21 TYR HH H 5.979 -6.245 -7.939 . . . 1.0 . . . . . . . . . . . . A . 21 TYR HH . . . . . . . . . rr_1qbf 1 . 1 . 315 . 1 1 21 TYR N N 5.793 -0.501 -3.918 . . . 1.0 . . . . . . . . . . . . A . 21 TYR N . . . . . . . . . rr_1qbf 1 . 1 . 316 . 1 1 21 TYR O O 2.713 -1.838 -4.920 . . . 1.0 . . . . . . . . . . . . A . 21 TYR O . . . . . . . . . rr_1qbf 1 . 1 . 317 . 1 1 21 TYR OH O 6.529 -5.938 -7.215 . . . 1.0 . . . . . . . . . . . . A . 21 TYR OH . . . . . . . . . rr_1qbf 1 . 1 . 318 . 1 1 22 ALA C C 2.944 -3.999 -3.110 . . . 1.0 . . . . . . . . . . . . A . 22 ALA C . . . . . . . . . rr_1qbf 1 . 1 . 319 . 1 1 22 ALA CA C 3.976 -4.137 -4.214 . . . 1.0 . . . . . . . . . . . . A . 22 ALA CA . . . . . . . . . rr_1qbf 1 . 1 . 320 . 1 1 22 ALA CB C 5.027 -5.176 -3.813 . . . 1.0 . . . . . . . . . . . . A . 22 ALA CB . . . . . . . . . rr_1qbf 1 . 1 . 321 . 1 1 22 ALA H H 5.591 -2.734 -4.295 . . . 1.0 . . . . . . . . . . . . A . 22 ALA H . . . . . . . . . rr_1qbf 1 . 1 . 322 . 1 1 22 ALA HA H 3.496 -4.444 -5.126 . . . 1.0 . . . . . . . . . . . . A . 22 ALA HA . . . . . . . . . rr_1qbf 1 . 1 . 323 . 1 1 22 ALA HB1 H 4.746 -6.142 -4.205 . . . 1.0 . . . . . . . . . . . . A . 22 ALA HB1 . . . . . . . . . rr_1qbf 1 . 1 . 324 . 1 1 22 ALA HB2 H 5.090 -5.229 -2.736 . . . 1.0 . . . . . . . . . . . . A . 22 ALA HB2 . . . . . . . . . rr_1qbf 1 . 1 . 325 . 1 1 22 ALA HB3 H 5.988 -4.890 -4.215 . . . 1.0 . . . . . . . . . . . . A . 22 ALA HB3 . . . . . . . . . rr_1qbf 1 . 1 . 326 . 1 1 22 ALA N N 4.625 -2.826 -4.422 . . . 1.0 . . . . . . . . . . . . A . 22 ALA N . . . . . . . . . rr_1qbf 1 . 1 . 327 . 1 1 22 ALA O O 1.824 -4.424 -3.242 . . . 1.0 . . . . . . . . . . . . A . 22 ALA O . . . . . . . . . rr_1qbf 1 . 1 . 328 . 1 1 23 SER C C 1.178 -2.381 -1.348 . . . 1.0 . . . . . . . . . . . . A . 23 SER C . . . . . . . . . rr_1qbf 1 . 1 . 329 . 1 1 23 SER CA C 2.357 -3.247 -0.902 . . . 1.0 . . . . . . . . . . . . A . 23 SER CA . . . . . . . . . rr_1qbf 1 . 1 . 330 . 1 1 23 SER CB C 3.058 -2.609 0.297 . . . 1.0 . . . . . . . . . . . . A . 23 SER CB . . . . . . . . . rr_1qbf 1 . 1 . 331 . 1 1 23 SER H H 4.228 -3.085 -1.926 . . . 1.0 . . . . . . . . . . . . A . 23 SER H . . . . . . . . . rr_1qbf 1 . 1 . 332 . 1 1 23 SER HA H 1.990 -4.210 -0.627 . . . 1.0 . . . . . . . . . . . . A . 23 SER HA . . . . . . . . . rr_1qbf 1 . 1 . 333 . 1 1 23 SER HB2 H 4.084 -2.935 0.332 . . . 1.0 . . . . . . . . . . . . A . 23 SER HB2 . . . . . . . . . rr_1qbf 1 . 1 . 334 . 1 1 23 SER HB3 H 3.028 -1.536 0.202 . . . 1.0 . . . . . . . . . . . . A . 23 SER HB3 . . . . . . . . . rr_1qbf 1 . 1 . 335 . 1 1 23 SER HG H 3.068 -3.142 2.169 . . . 1.0 . . . . . . . . . . . . A . 23 SER HG . . . . . . . . . rr_1qbf 1 . 1 . 336 . 1 1 23 SER N N 3.317 -3.410 -2.016 . . . 1.0 . . . . . . . . . . . . A . 23 SER N . . . . . . . . . rr_1qbf 1 . 1 . 337 . 1 1 23 SER O O 0.108 -2.468 -0.788 . . . 1.0 . . . . . . . . . . . . A . 23 SER O . . . . . . . . . rr_1qbf 1 . 1 . 338 . 1 1 23 SER OG O 2.400 -3.011 1.491 . . . 1.0 . . . . . . . . . . . . A . 23 SER OG . . . . . . . . . rr_1qbf 1 . 1 . 339 . 1 1 24 LEU C C -1.089 -1.428 -2.739 . . . 1.0 . . . . . . . . . . . . A . 24 LEU C . . . . . . . . . rr_1qbf 1 . 1 . 340 . 1 1 24 LEU CA C 0.247 -0.698 -2.866 . . . 1.0 . . . . . . . . . . . . A . 24 LEU CA . . . . . . . . . rr_1qbf 1 . 1 . 341 . 1 1 24 LEU CB C 0.495 -0.375 -4.336 . . . 1.0 . . . . . . . . . . . . A . 24 LEU CB . . . . . . . . . rr_1qbf 1 . 1 . 342 . 1 1 24 LEU CD1 C 2.111 0.640 -5.932 . . . 1.0 . . . . . . . . . . . . A . 24 LEU CD1 . . . . . . . . . rr_1qbf 1 . 1 . 343 . 1 1 24 LEU CD2 C 1.502 1.842 -3.827 . . . 1.0 . . . . . . . . . . . . A . 24 LEU CD2 . . . . . . . . . rr_1qbf 1 . 1 . 344 . 1 1 24 LEU CG C 1.754 0.475 -4.456 . . . 1.0 . . . . . . . . . . . . A . 24 LEU CG . . . . . . . . . rr_1qbf 1 . 1 . 345 . 1 1 24 LEU H H 2.237 -1.535 -2.801 . . . 1.0 . . . . . . . . . . . . A . 24 LEU H . . . . . . . . . rr_1qbf 1 . 1 . 346 . 1 1 24 LEU HA H 0.214 0.218 -2.298 . . . 1.0 . . . . . . . . . . . . A . 24 LEU HA . . . . . . . . . rr_1qbf 1 . 1 . 347 . 1 1 24 LEU HB2 H 0.624 -1.295 -4.889 . . . 1.0 . . . . . . . . . . . . A . 24 LEU HB2 . . . . . . . . . rr_1qbf 1 . 1 . 348 . 1 1 24 LEU HB3 H -0.346 0.171 -4.734 . . . 1.0 . . . . . . . . . . . . A . 24 LEU HB3 . . . . . . . . . rr_1qbf 1 . 1 . 349 . 1 1 24 LEU HD11 H 1.206 0.747 -6.511 . . . 1.0 . . . . . . . . . . . . A . 24 LEU HD11 . . . . . . . . . rr_1qbf 1 . 1 . 350 . 1 1 24 LEU HD12 H 2.653 -0.232 -6.270 . . . 1.0 . . . . . . . . . . . . A . 24 LEU HD12 . . . . . . . . . rr_1qbf 1 . 1 . 351 . 1 1 24 LEU HD13 H 2.726 1.517 -6.057 . . . 1.0 . . . . . . . . . . . . A . 24 LEU HD13 . . . . . . . . . rr_1qbf 1 . 1 . 352 . 1 1 24 LEU HD21 H 0.450 2.078 -3.891 . . . 1.0 . . . . . . . . . . . . A . 24 LEU HD21 . . . . . . . . . rr_1qbf 1 . 1 . 353 . 1 1 24 LEU HD22 H 2.075 2.591 -4.350 . . . 1.0 . . . . . . . . . . . . A . 24 LEU HD22 . . . . . . . . . rr_1qbf 1 . 1 . 354 . 1 1 24 LEU HD23 H 1.801 1.818 -2.792 . . . 1.0 . . . . . . . . . . . . A . 24 LEU HD23 . . . . . . . . . rr_1qbf 1 . 1 . 355 . 1 1 24 LEU HG H 2.567 -0.014 -3.940 . . . 1.0 . . . . . . . . . . . . A . 24 LEU HG . . . . . . . . . rr_1qbf 1 . 1 . 356 . 1 1 24 LEU N N 1.362 -1.567 -2.361 . . . 1.0 . . . . . . . . . . . . A . 24 LEU N . . . . . . . . . rr_1qbf 1 . 1 . 357 . 1 1 24 LEU O O -2.126 -0.823 -2.559 . . . 1.0 . . . . . . . . . . . . A . 24 LEU O . . . . . . . . . rr_1qbf 1 . 1 . 358 . 1 1 25 ARG C C -3.286 -2.891 -1.778 . . . 1.0 . . . . . . . . . . . . A . 25 ARG C . . . . . . . . . rr_1qbf 1 . 1 . 359 . 1 1 25 ARG CA C -2.299 -3.556 -2.728 . . . 1.0 . . . . . . . . . . . . A . 25 ARG CA . . . . . . . . . rr_1qbf 1 . 1 . 360 . 1 1 25 ARG CB C -1.971 -4.946 -2.151 . . . 1.0 . . . . . . . . . . . . A . 25 ARG CB . . . . . . . . . rr_1qbf 1 . 1 . 361 . 1 1 25 ARG CD C -0.334 -5.450 -3.996 . . . 1.0 . . . . . . . . . . . . A . 25 ARG CD . . . . . . . . . rr_1qbf 1 . 1 . 362 . 1 1 25 ARG CG C -0.527 -5.360 -2.476 . . . 1.0 . . . . . . . . . . . . A . 25 ARG CG . . . . . . . . . rr_1qbf 1 . 1 . 363 . 1 1 25 ARG CZ C -1.759 -6.668 -5.526 . . . 1.0 . . . . . . . . . . . . A . 25 ARG CZ . . . . . . . . . rr_1qbf 1 . 1 . 364 . 1 1 25 ARG H H -0.186 -3.157 -2.991 . . . 1.0 . . . . . . . . . . . . A . 25 ARG H . . . . . . . . . rr_1qbf 1 . 1 . 365 . 1 1 25 ARG HA H -2.752 -3.658 -3.698 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HA . . . . . . . . . rr_1qbf 1 . 1 . 366 . 1 1 25 ARG HB2 H -2.098 -4.922 -1.079 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HB2 . . . . . . . . . rr_1qbf 1 . 1 . 367 . 1 1 25 ARG HB3 H -2.651 -5.672 -2.571 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HB3 . . . . . . . . . rr_1qbf 1 . 1 . 368 . 1 1 25 ARG HD2 H 0.066 -4.515 -4.370 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HD2 . . . . . . . . . rr_1qbf 1 . 1 . 369 . 1 1 25 ARG HD3 H 0.357 -6.251 -4.229 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HD3 . . . . . . . . . rr_1qbf 1 . 1 . 370 . 1 1 25 ARG HE H -2.434 -5.201 -4.362 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HE . . . . . . . . . rr_1qbf 1 . 1 . 371 . 1 1 25 ARG HG2 H 0.156 -4.637 -2.061 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HG2 . . . . . . . . . rr_1qbf 1 . 1 . 372 . 1 1 25 ARG HG3 H -0.329 -6.326 -2.037 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HG3 . . . . . . . . . rr_1qbf 1 . 1 . 373 . 1 1 25 ARG HH11 H 0.080 -6.393 -6.269 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HH11 . . . . . . . . . rr_1qbf 1 . 1 . 374 . 1 1 25 ARG HH12 H -0.850 -7.649 -7.018 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HH12 . . . . . . . . . rr_1qbf 1 . 1 . 375 . 1 1 25 ARG HH21 H -3.620 -7.173 -4.985 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HH21 . . . . . . . . . rr_1qbf 1 . 1 . 376 . 1 1 25 ARG HH22 H -2.944 -8.091 -6.289 . . . 1.0 . . . . . . . . . . . . A . 25 ARG HH22 . . . . . . . . . rr_1qbf 1 . 1 . 377 . 1 1 25 ARG N N -1.050 -2.727 -2.839 . . . 1.0 . . . . . . . . . . . . A . 25 ARG N . . . . . . . . . rr_1qbf 1 . 1 . 378 . 1 1 25 ARG NE N -1.648 -5.723 -4.633 . . . 1.0 . . . . . . . . . . . . A . 25 ARG NE . . . . . . . . . rr_1qbf 1 . 1 . 379 . 1 1 25 ARG NH1 N -0.766 -6.922 -6.335 . . . 1.0 . . . . . . . . . . . . A . 25 ARG NH1 . . . . . . . . . rr_1qbf 1 . 1 . 380 . 1 1 25 ARG NH2 N -2.861 -7.364 -5.607 . . . 1.0 . . . . . . . . . . . . A . 25 ARG NH2 . . . . . . . . . rr_1qbf 1 . 1 . 381 . 1 1 25 ARG O O -4.443 -2.675 -2.103 . . . 1.0 . . . . . . . . . . . . A . 25 ARG O . . . . . . . . . rr_1qbf 1 . 1 . 382 . 1 1 26 HIS C C -4.834 -1.236 -0.168 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_1qbf 1 . 1 . 383 . 1 1 26 HIS CA C -3.676 -1.960 0.461 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_1qbf 1 . 1 . 384 . 1 1 26 HIS CB C -2.928 -0.864 1.230 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_1qbf 1 . 1 . 385 . 1 1 26 HIS CD2 C -0.940 -0.051 -0.258 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_1qbf 1 . 1 . 386 . 1 1 26 HIS CE1 C 0.683 -0.816 0.953 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_1qbf 1 . 1 . 387 . 1 1 26 HIS CG C -1.505 -0.719 0.795 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_1qbf 1 . 1 . 388 . 1 1 26 HIS H H -1.891 -2.833 -0.403 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_1qbf 1 . 1 . 389 . 1 1 26 HIS HA H -4.032 -2.699 1.154 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_1qbf 1 . 1 . 390 . 1 1 26 HIS HB2 H -3.430 0.083 1.052 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_1qbf 1 . 1 . 391 . 1 1 26 HIS HB3 H -2.964 -1.084 2.277 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_1qbf 1 . 1 . 392 . 1 1 26 HIS HD1 H -0.528 -1.735 2.371 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_1qbf 1 . 1 . 393 . 1 1 26 HIS HD2 H -1.489 0.462 -1.035 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_1qbf 1 . 1 . 394 . 1 1 26 HIS HE1 H 1.664 -1.050 1.319 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_1qbf 1 . 1 . 395 . 1 1 26 HIS N N -2.817 -2.602 -0.596 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_1qbf 1 . 1 . 396 . 1 1 26 HIS ND1 N -0.455 -1.204 1.550 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_1qbf 1 . 1 . 397 . 1 1 26 HIS NE2 N 0.446 -0.111 -0.156 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_1qbf 1 . 1 . 398 . 1 1 26 HIS O O -5.983 -1.449 0.135 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_1qbf 1 . 1 . 399 . 1 1 27 TYR C C -6.865 -0.136 -1.788 . . . 1.0 . . . . . . . . . . . . A . 27 TYR C . . . . . . . . . rr_1qbf 1 . 1 . 400 . 1 1 27 TYR CA C -5.503 0.540 -1.607 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CA . . . . . . . . . rr_1qbf 1 . 1 . 401 . 1 1 27 TYR CB C -5.030 1.037 -2.948 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CB . . . . . . . . . rr_1qbf 1 . 1 . 402 . 1 1 27 TYR CD1 C -7.078 2.469 -2.591 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CD1 . . . . . . . . . rr_1qbf 1 . 1 . 403 . 1 1 27 TYR CD2 C -6.073 2.368 -4.794 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CD2 . . . . . . . . . rr_1qbf 1 . 1 . 404 . 1 1 27 TYR CE1 C -8.043 3.332 -3.058 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CE1 . . . . . . . . . rr_1qbf 1 . 1 . 405 . 1 1 27 TYR CE2 C -7.052 3.242 -5.255 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CE2 . . . . . . . . . rr_1qbf 1 . 1 . 406 . 1 1 27 TYR CG C -6.080 1.977 -3.456 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CG . . . . . . . . . rr_1qbf 1 . 1 . 407 . 1 1 27 TYR CZ C -8.030 3.718 -4.375 . . . 1.0 . . . . . . . . . . . . A . 27 TYR CZ . . . . . . . . . rr_1qbf 1 . 1 . 408 . 1 1 27 TYR H H -3.548 -0.139 -1.149 . . . 1.0 . . . . . . . . . . . . A . 27 TYR H . . . . . . . . . rr_1qbf 1 . 1 . 409 . 1 1 27 TYR HA H -5.636 1.396 -0.967 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HA . . . . . . . . . rr_1qbf 1 . 1 . 410 . 1 1 27 TYR HB2 H -4.089 1.558 -2.837 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HB2 . . . . . . . . . rr_1qbf 1 . 1 . 411 . 1 1 27 TYR HB3 H -4.919 0.210 -3.633 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HB3 . . . . . . . . . rr_1qbf 1 . 1 . 412 . 1 1 27 TYR HD1 H -7.096 2.176 -1.555 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HD1 . . . . . . . . . rr_1qbf 1 . 1 . 413 . 1 1 27 TYR HD2 H -5.315 1.996 -5.466 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HD2 . . . . . . . . . rr_1qbf 1 . 1 . 414 . 1 1 27 TYR HE1 H -8.807 3.701 -2.395 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HE1 . . . . . . . . . rr_1qbf 1 . 1 . 415 . 1 1 27 TYR HE2 H -7.057 3.556 -6.289 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HE2 . . . . . . . . . rr_1qbf 1 . 1 . 416 . 1 1 27 TYR HH H -8.568 5.329 -5.249 . . . 1.0 . . . . . . . . . . . . A . 27 TYR HH . . . . . . . . . rr_1qbf 1 . 1 . 417 . 1 1 27 TYR N N -4.496 -0.314 -0.986 . . . 1.0 . . . . . . . . . . . . A . 27 TYR N . . . . . . . . . rr_1qbf 1 . 1 . 418 . 1 1 27 TYR O O -7.738 0.018 -0.968 . . . 1.0 . . . . . . . . . . . . A . 27 TYR O . . . . . . . . . rr_1qbf 1 . 1 . 419 . 1 1 27 TYR OH O -9.003 4.580 -4.837 . . . 1.0 . . . . . . . . . . . . A . 27 TYR OH . . . . . . . . . rr_1qbf 1 . 1 . 420 . 1 1 28 LEU C C -8.526 -2.806 -2.479 . . . 1.0 . . . . . . . . . . . . A . 28 LEU C . . . . . . . . . rr_1qbf 1 . 1 . 421 . 1 1 28 LEU CA C -8.438 -1.408 -3.073 . . . 1.0 . . . . . . . . . . . . A . 28 LEU CA . . . . . . . . . rr_1qbf 1 . 1 . 422 . 1 1 28 LEU CB C -8.824 -1.390 -4.545 . . . 1.0 . . . . . . . . . . . . A . 28 LEU CB . . . . . . . . . rr_1qbf 1 . 1 . 423 . 1 1 28 LEU CD1 C -11.042 -0.415 -3.892 . . . 1.0 . . . . . . . . . . . . A . 28 LEU CD1 . . . . . . . . . rr_1qbf 1 . 1 . 424 . 1 1 28 LEU CD2 C -9.121 1.095 -4.358 . . . 1.0 . . . . . . . . . . . . A . 28 LEU CD2 . . . . . . . . . rr_1qbf 1 . 1 . 425 . 1 1 28 LEU CG C -9.796 -0.220 -4.764 . . . 1.0 . . . . . . . . . . . . A . 28 LEU CG . . . . . . . . . rr_1qbf 1 . 1 . 426 . 1 1 28 LEU H H -6.416 -0.910 -3.555 . . . 1.0 . . . . . . . . . . . . A . 28 LEU H . . . . . . . . . rr_1qbf 1 . 1 . 427 . 1 1 28 LEU HA H -9.131 -0.783 -2.542 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HA . . . . . . . . . rr_1qbf 1 . 1 . 428 . 1 1 28 LEU HB2 H -7.940 -1.254 -5.153 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HB2 . . . . . . . . . rr_1qbf 1 . 1 . 429 . 1 1 28 LEU HB3 H -9.311 -2.317 -4.806 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HB3 . . . . . . . . . rr_1qbf 1 . 1 . 430 . 1 1 28 LEU HD11 H -10.830 -0.090 -2.882 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD11 . . . . . . . . . rr_1qbf 1 . 1 . 431 . 1 1 28 LEU HD12 H -11.320 -1.457 -3.883 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD12 . . . . . . . . . rr_1qbf 1 . 1 . 432 . 1 1 28 LEU HD13 H -11.858 0.172 -4.290 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD13 . . . . . . . . . rr_1qbf 1 . 1 . 433 . 1 1 28 LEU HD21 H -9.003 1.123 -3.283 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD21 . . . . . . . . . rr_1qbf 1 . 1 . 434 . 1 1 28 LEU HD22 H -9.735 1.928 -4.671 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD22 . . . . . . . . . rr_1qbf 1 . 1 . 435 . 1 1 28 LEU HD23 H -8.152 1.167 -4.828 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD23 . . . . . . . . . rr_1qbf 1 . 1 . 436 . 1 1 28 LEU HG H -10.084 -0.177 -5.805 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HG . . . . . . . . . rr_1qbf 1 . 1 . 437 . 1 1 28 LEU N N -7.093 -0.822 -2.874 . . . 1.0 . . . . . . . . . . . . A . 28 LEU N . . . . . . . . . rr_1qbf 1 . 1 . 438 . 1 1 28 LEU O O -9.331 -3.626 -2.868 . . . 1.0 . . . . . . . . . . . . A . 28 LEU O . . . . . . . . . rr_1qbf 1 . 1 . 439 . 1 1 29 ASN C C -7.745 -3.986 0.748 . . . 1.0 . . . . . . . . . . . . A . 29 ASN C . . . . . . . . . rr_1qbf 1 . 1 . 440 . 1 1 29 ASN CA C -7.798 -4.326 -0.761 . . . 1.0 . . . . . . . . . . . . A . 29 ASN CA . . . . . . . . . rr_1qbf 1 . 1 . 441 . 1 1 29 ASN CB C -6.660 -5.264 -1.220 . . . 1.0 . . . . . . . . . . . . A . 29 ASN CB . . . . . . . . . rr_1qbf 1 . 1 . 442 . 1 1 29 ASN CG C -5.619 -5.426 -0.121 . . . 1.0 . . . . . . . . . . . . A . 29 ASN CG . . . . . . . . . rr_1qbf 1 . 1 . 443 . 1 1 29 ASN H H -7.138 -2.348 -1.190 . . . 1.0 . . . . . . . . . . . . A . 29 ASN H . . . . . . . . . rr_1qbf 1 . 1 . 444 . 1 1 29 ASN HA H -8.742 -4.778 -0.970 . . . 1.0 . . . . . . . . . . . . A . 29 ASN HA . . . . . . . . . rr_1qbf 1 . 1 . 445 . 1 1 29 ASN HB2 H -7.072 -6.232 -1.464 . . . 1.0 . . . . . . . . . . . . A . 29 ASN HB2 . . . . . . . . . rr_1qbf 1 . 1 . 446 . 1 1 29 ASN HB3 H -6.189 -4.847 -2.099 . . . 1.0 . . . . . . . . . . . . A . 29 ASN HB3 . . . . . . . . . rr_1qbf 1 . 1 . 447 . 1 1 29 ASN HD21 H -5.532 -3.483 0.211 . . . 1.0 . . . . . . . . . . . . A . 29 ASN HD21 . . . . . . . . . rr_1qbf 1 . 1 . 448 . 1 1 29 ASN HD22 H -4.537 -4.441 1.196 . . . 1.0 . . . . . . . . . . . . A . 29 ASN HD22 . . . . . . . . . rr_1qbf 1 . 1 . 449 . 1 1 29 ASN N N -7.740 -3.043 -1.489 . . . 1.0 . . . . . . . . . . . . A . 29 ASN N . . . . . . . . . rr_1qbf 1 . 1 . 450 . 1 1 29 ASN ND2 N -5.186 -4.365 0.477 . . . 1.0 . . . . . . . . . . . . A . 29 ASN ND2 . . . . . . . . . rr_1qbf 1 . 1 . 451 . 1 1 29 ASN O O -7.633 -4.842 1.602 . . . 1.0 . . . . . . . . . . . . A . 29 ASN O . . . . . . . . . rr_1qbf 1 . 1 . 452 . 1 1 29 ASN OD1 O -5.203 -6.523 0.194 . . . 1.0 . . . . . . . . . . . . A . 29 ASN OD1 . . . . . . . . . rr_1qbf 1 . 1 . 453 . 1 1 30 LEU C C -8.963 -1.149 2.543 . . . 1.0 . . . . . . . . . . . . A . 30 LEU C . . . . . . . . . rr_1qbf 1 . 1 . 454 . 1 1 30 LEU CA C -7.844 -2.195 2.440 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CA . . . . . . . . . rr_1qbf 1 . 1 . 455 . 1 1 30 LEU CB C -6.461 -1.560 2.755 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CB . . . . . . . . . rr_1qbf 1 . 1 . 456 . 1 1 30 LEU CD1 C -6.534 0.264 4.471 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CD1 . . . . . . . . . rr_1qbf 1 . 1 . 457 . 1 1 30 LEU CD2 C -5.359 0.648 2.301 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CD2 . . . . . . . . . rr_1qbf 1 . 1 . 458 . 1 1 30 LEU CG C -6.550 -0.034 2.974 . . . 1.0 . . . . . . . . . . . . A . 30 LEU CG . . . . . . . . . rr_1qbf 1 . 1 . 459 . 1 1 30 LEU H H -7.954 -2.078 0.337 . . . 1.0 . . . . . . . . . . . . A . 30 LEU H . . . . . . . . . rr_1qbf 1 . 1 . 460 . 1 1 30 LEU HA H -8.041 -3.004 3.114 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HA . . . . . . . . . rr_1qbf 1 . 1 . 461 . 1 1 30 LEU HB2 H -6.065 -2.010 3.643 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HB2 . . . . . . . . . rr_1qbf 1 . 1 . 462 . 1 1 30 LEU HB3 H -5.786 -1.756 1.942 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HB3 . . . . . . . . . rr_1qbf 1 . 1 . 463 . 1 1 30 LEU HD11 H -7.110 -0.486 4.991 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD11 . . . . . . . . . rr_1qbf 1 . 1 . 464 . 1 1 30 LEU HD12 H -6.967 1.237 4.648 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD12 . . . . . . . . . rr_1qbf 1 . 1 . 465 . 1 1 30 LEU HD13 H -5.517 0.250 4.829 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD13 . . . . . . . . . rr_1qbf 1 . 1 . 466 . 1 1 30 LEU HD21 H -5.363 1.699 2.546 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD21 . . . . . . . . . rr_1qbf 1 . 1 . 467 . 1 1 30 LEU HD22 H -5.438 0.529 1.230 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD22 . . . . . . . . . rr_1qbf 1 . 1 . 468 . 1 1 30 LEU HD23 H -4.443 0.198 2.648 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HD23 . . . . . . . . . rr_1qbf 1 . 1 . 469 . 1 1 30 LEU HG H -7.457 0.353 2.552 . . . 1.0 . . . . . . . . . . . . A . 30 LEU HG . . . . . . . . . rr_1qbf 1 . 1 . 470 . 1 1 30 LEU N N -7.851 -2.709 1.046 . . . 1.0 . . . . . . . . . . . . A . 30 LEU N . . . . . . . . . rr_1qbf 1 . 1 . 471 . 1 1 30 LEU O O -9.584 -0.968 3.564 . . . 1.0 . . . . . . . . . . . . A . 30 LEU O . . . . . . . . . rr_1qbf 1 . 1 . 472 . 1 1 31 VAL C C -11.411 0.063 0.637 . . . 1.0 . . . . . . . . . . . . A . 31 VAL C . . . . . . . . . rr_1qbf 1 . 1 . 473 . 1 1 31 VAL CA C -10.219 0.605 1.430 . . . 1.0 . . . . . . . . . . . . A . 31 VAL CA . . . . . . . . . rr_1qbf 1 . 1 . 474 . 1 1 31 VAL CB C -9.631 1.838 0.715 . . . 1.0 . . . . . . . . . . . . A . 31 VAL CB . . . . . . . . . rr_1qbf 1 . 1 . 475 . 1 1 31 VAL CG1 C -8.141 1.969 1.042 . . . 1.0 . . . . . . . . . . . . A . 31 VAL CG1 . . . . . . . . . rr_1qbf 1 . 1 . 476 . 1 1 31 VAL CG2 C -9.773 1.674 -0.801 . . . 1.0 . . . . . . . . . . . . A . 31 VAL CG2 . . . . . . . . . rr_1qbf 1 . 1 . 477 . 1 1 31 VAL H H -8.658 -0.588 0.688 . . . 1.0 . . . . . . . . . . . . A . 31 VAL H . . . . . . . . . rr_1qbf 1 . 1 . 478 . 1 1 31 VAL HA H -10.509 0.849 2.417 . . . 1.0 . . . . . . . . . . . . A . 31 VAL HA . . . . . . . . . rr_1qbf 1 . 1 . 479 . 1 1 31 VAL HB H -10.147 2.726 1.034 . . . 1.0 . . . . . . . . . . . . A . 31 VAL HB . . . . . . . . . rr_1qbf 1 . 1 . 480 . 1 1 31 VAL HG11 H -7.651 1.025 0.861 . . . 1.0 . . . . . . . . . . . . A . 31 VAL HG11 . . . . . . . . . rr_1qbf 1 . 1 . 481 . 1 1 31 VAL HG12 H -8.018 2.247 2.076 . . . 1.0 . . . . . . . . . . . . A . 31 VAL HG12 . . . . . . . . . rr_1qbf 1 . 1 . 482 . 1 1 31 VAL HG13 H -7.700 2.726 0.411 . . . 1.0 . . . . . . . . . . . . A . 31 VAL HG13 . . . . . . . . . rr_1qbf 1 . 1 . 483 . 1 1 31 VAL HG21 H -9.753 0.624 -1.052 . . . 1.0 . . . . . . . . . . . . A . 31 VAL HG21 . . . . . . . . . rr_1qbf 1 . 1 . 484 . 1 1 31 VAL HG22 H -8.956 2.174 -1.289 . . . 1.0 . . . . . . . . . . . . A . 31 VAL HG22 . . . . . . . . . rr_1qbf 1 . 1 . 485 . 1 1 31 VAL HG23 H -10.706 2.103 -1.127 . . . 1.0 . . . . . . . . . . . . A . 31 VAL HG23 . . . . . . . . . rr_1qbf 1 . 1 . 486 . 1 1 31 VAL N N -9.186 -0.441 1.471 . . . 1.0 . . . . . . . . . . . . A . 31 VAL N . . . . . . . . . rr_1qbf 1 . 1 . 487 . 1 1 31 VAL O O -12.536 0.502 0.767 . . . 1.0 . . . . . . . . . . . . A . 31 VAL O . . . . . . . . . rr_1qbf 1 . 1 . 488 . 1 1 32 THR C C -13.478 -1.741 -0.354 . . . 1.0 . . . . . . . . . . . . A . 32 THR C . . . . . . . . . rr_1qbf 1 . 1 . 489 . 1 1 32 THR CA C -12.143 -1.501 -1.082 . . . 1.0 . . . . . . . . . . . . A . 32 THR CA . . . . . . . . . rr_1qbf 1 . 1 . 490 . 1 1 32 THR CB C -11.558 -2.815 -1.594 . . . 1.0 . . . . . . . . . . . . A . 32 THR CB . . . . . . . . . rr_1qbf 1 . 1 . 491 . 1 1 32 THR CG2 C -10.690 -3.444 -0.510 . . . 1.0 . . . . . . . . . . . . A . 32 THR CG2 . . . . . . . . . rr_1qbf 1 . 1 . 492 . 1 1 32 THR H H -10.199 -1.177 -0.283 . . . 1.0 . . . . . . . . . . . . A . 32 THR H . . . . . . . . . rr_1qbf 1 . 1 . 493 . 1 1 32 THR HA H -12.320 -0.851 -1.925 . . . 1.0 . . . . . . . . . . . . A . 32 THR HA . . . . . . . . . rr_1qbf 1 . 1 . 494 . 1 1 32 THR HB H -10.937 -2.611 -2.443 . . . 1.0 . . . . . . . . . . . . A . 32 THR HB . . . . . . . . . rr_1qbf 1 . 1 . 495 . 1 1 32 THR HG1 H -13.157 -3.258 -2.606 . . . 1.0 . . . . . . . . . . . . A . 32 THR HG1 . . . . . . . . . rr_1qbf 1 . 1 . 496 . 1 1 32 THR HG21 H -10.558 -4.491 -0.715 . . . 1.0 . . . . . . . . . . . . A . 32 THR HG21 . . . . . . . . . rr_1qbf 1 . 1 . 497 . 1 1 32 THR HG22 H -11.165 -3.316 0.441 . . . 1.0 . . . . . . . . . . . . A . 32 THR HG22 . . . . . . . . . rr_1qbf 1 . 1 . 498 . 1 1 32 THR HG23 H -9.726 -2.954 -0.497 . . . 1.0 . . . . . . . . . . . . A . 32 THR HG23 . . . . . . . . . rr_1qbf 1 . 1 . 499 . 1 1 32 THR N N -11.125 -0.878 -0.206 . . . 1.0 . . . . . . . . . . . . A . 32 THR N . . . . . . . . . rr_1qbf 1 . 1 . 500 . 1 1 32 THR O O -14.368 -0.916 -0.409 . . . 1.0 . . . . . . . . . . . . A . 32 THR O . . . . . . . . . rr_1qbf 1 . 1 . 501 . 1 1 32 THR OG1 O -12.602 -3.703 -1.961 . . . 1.0 . . . . . . . . . . . . A . 32 THR OG1 . . . . . . . . . rr_1qbf 1 . 1 . 502 . 1 1 33 ARG C C -14.822 -3.463 2.423 . . . 1.0 . . . . . . . . . . . . A . 33 ARG C . . . . . . . . . rr_1qbf 1 . 1 . 503 . 1 1 33 ARG CA C -14.979 -3.134 0.938 . . . 1.0 . . . . . . . . . . . . A . 33 ARG CA . . . . . . . . . rr_1qbf 1 . 1 . 504 . 1 1 33 ARG CB C -15.668 -4.320 0.254 . . . 1.0 . . . . . . . . . . . . A . 33 ARG CB . . . . . . . . . rr_1qbf 1 . 1 . 505 . 1 1 33 ARG CD C -14.263 -5.685 -1.296 . . . 1.0 . . . . . . . . . . . . A . 33 ARG CD . . . . . . . . . rr_1qbf 1 . 1 . 506 . 1 1 33 ARG CG C -15.174 -4.459 -1.188 . . . 1.0 . . . . . . . . . . . . A . 33 ARG CG . . . . . . . . . rr_1qbf 1 . 1 . 507 . 1 1 33 ARG CZ C -14.592 -8.086 -1.302 . . . 1.0 . . . . . . . . . . . . A . 33 ARG CZ . . . . . . . . . rr_1qbf 1 . 1 . 508 . 1 1 33 ARG H H -12.959 -3.556 0.293 . . . 1.0 . . . . . . . . . . . . A . 33 ARG H . . . . . . . . . rr_1qbf 1 . 1 . 509 . 1 1 33 ARG HA H -15.604 -2.260 0.835 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HA . . . . . . . . . rr_1qbf 1 . 1 . 510 . 1 1 33 ARG HB2 H -15.443 -5.226 0.798 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HB2 . . . . . . . . . rr_1qbf 1 . 1 . 511 . 1 1 33 ARG HB3 H -16.736 -4.161 0.252 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HB3 . . . . . . . . . rr_1qbf 1 . 1 . 512 . 1 1 33 ARG HD2 H -13.577 -5.552 -2.120 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HD2 . . . . . . . . . rr_1qbf 1 . 1 . 513 . 1 1 33 ARG HD3 H -13.705 -5.801 -0.378 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HD3 . . . . . . . . . rr_1qbf 1 . 1 . 514 . 1 1 33 ARG HE H -16.009 -6.812 -1.862 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HE . . . . . . . . . rr_1qbf 1 . 1 . 515 . 1 1 33 ARG HG2 H -16.021 -4.580 -1.844 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HG2 . . . . . . . . . rr_1qbf 1 . 1 . 516 . 1 1 33 ARG HG3 H -14.625 -3.576 -1.472 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HG3 . . . . . . . . . rr_1qbf 1 . 1 . 517 . 1 1 33 ARG HH11 H -14.098 -7.680 0.595 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HH11 . . . . . . . . . rr_1qbf 1 . 1 . 518 . 1 1 33 ARG HH12 H -13.713 -9.276 0.046 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HH12 . . . . . . . . . rr_1qbf 1 . 1 . 519 . 1 1 33 ARG HH21 H -14.976 -8.775 -3.143 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HH21 . . . . . . . . . rr_1qbf 1 . 1 . 520 . 1 1 33 ARG HH22 H -14.208 -9.897 -2.068 . . . 1.0 . . . . . . . . . . . . A . 33 ARG HH22 . . . . . . . . . rr_1qbf 1 . 1 . 521 . 1 1 33 ARG N N -13.659 -2.873 0.282 . . . 1.0 . . . . . . . . . . . . A . 33 ARG N . . . . . . . . . rr_1qbf 1 . 1 . 522 . 1 1 33 ARG NE N -15.090 -6.901 -1.532 . . . 1.0 . . . . . . . . . . . . A . 33 ARG NE . . . . . . . . . rr_1qbf 1 . 1 . 523 . 1 1 33 ARG NH1 N -14.096 -8.369 -0.129 . . . 1.0 . . . . . . . . . . . . A . 33 ARG NH1 . . . . . . . . . rr_1qbf 1 . 1 . 524 . 1 1 33 ARG NH2 N -14.593 -8.990 -2.244 . . . 1.0 . . . . . . . . . . . . A . 33 ARG NH2 . . . . . . . . . rr_1qbf 1 . 1 . 525 . 1 1 33 ARG O O -15.650 -3.090 3.231 . . . 1.0 . . . . . . . . . . . . A . 33 ARG O . . . . . . . . . rr_1qbf 1 . 1 . 526 . 1 1 34 GLN C C -13.551 -3.249 5.076 . . . 1.0 . . . . . . . . . . . . A . 34 GLN C . . . . . . . . . rr_1qbf 1 . 1 . 527 . 1 1 34 GLN CA C -13.659 -4.530 4.233 . . . 1.0 . . . . . . . . . . . . A . 34 GLN CA . . . . . . . . . rr_1qbf 1 . 1 . 528 . 1 1 34 GLN CB C -12.455 -5.478 4.419 . . . 1.0 . . . . . . . . . . . . A . 34 GLN CB . . . . . . . . . rr_1qbf 1 . 1 . 529 . 1 1 34 GLN CD C -11.120 -3.409 3.871 . . . 1.0 . . . . . . . . . . . . A . 34 GLN CD . . . . . . . . . rr_1qbf 1 . 1 . 530 . 1 1 34 GLN CG C -11.136 -4.726 4.636 . . . 1.0 . . . . . . . . . . . . A . 34 GLN CG . . . . . . . . . rr_1qbf 1 . 1 . 531 . 1 1 34 GLN H H -13.145 -4.496 2.153 . . . 1.0 . . . . . . . . . . . . A . 34 GLN H . . . . . . . . . rr_1qbf 1 . 1 . 532 . 1 1 34 GLN HA H -14.553 -5.053 4.530 . . . 1.0 . . . . . . . . . . . . A . 34 GLN HA . . . . . . . . . rr_1qbf 1 . 1 . 533 . 1 1 34 GLN HB2 H -12.640 -6.111 5.274 . . . 1.0 . . . . . . . . . . . . A . 34 GLN HB2 . . . . . . . . . rr_1qbf 1 . 1 . 534 . 1 1 34 GLN HB3 H -12.364 -6.099 3.540 . . . 1.0 . . . . . . . . . . . . A . 34 GLN HB3 . . . . . . . . . rr_1qbf 1 . 1 . 535 . 1 1 34 GLN HE21 H -11.312 -4.247 2.081 . . . 1.0 . . . . . . . . . . . . A . 34 GLN HE21 . . . . . . . . . rr_1qbf 1 . 1 . 536 . 1 1 34 GLN HE22 H -11.217 -2.551 2.085 . . . 1.0 . . . . . . . . . . . . A . 34 GLN HE22 . . . . . . . . . rr_1qbf 1 . 1 . 537 . 1 1 34 GLN HG2 H -11.012 -4.526 5.688 . . . 1.0 . . . . . . . . . . . . A . 34 GLN HG2 . . . . . . . . . rr_1qbf 1 . 1 . 538 . 1 1 34 GLN HG3 H -10.321 -5.343 4.292 . . . 1.0 . . . . . . . . . . . . A . 34 GLN HG3 . . . . . . . . . rr_1qbf 1 . 1 . 539 . 1 1 34 GLN N N -13.799 -4.178 2.801 . . . 1.0 . . . . . . . . . . . . A . 34 GLN N . . . . . . . . . rr_1qbf 1 . 1 . 540 . 1 1 34 GLN NE2 N -11.224 -3.403 2.573 . . . 1.0 . . . . . . . . . . . . A . 34 GLN NE2 . . . . . . . . . rr_1qbf 1 . 1 . 541 . 1 1 34 GLN O O -13.648 -3.281 6.287 . . . 1.0 . . . . . . . . . . . . A . 34 GLN O . . . . . . . . . rr_1qbf 1 . 1 . 542 . 1 1 34 GLN OE1 O -11.008 -2.369 4.473 . . . 1.0 . . . . . . . . . . . . A . 34 GLN OE1 . . . . . . . . . rr_1qbf 1 . 1 . 543 . 1 1 35 ARG C C -12.144 -0.865 6.184 . . . 1.0 . . . . . . . . . . . . A . 35 ARG C . . . . . . . . . rr_1qbf 1 . 1 . 544 . 1 1 35 ARG CA C -13.292 -0.830 5.181 . . . 1.0 . . . . . . . . . . . . A . 35 ARG CA . . . . . . . . . rr_1qbf 1 . 1 . 545 . 1 1 35 ARG CB C -14.598 -0.593 5.938 . . . 1.0 . . . . . . . . . . . . A . 35 ARG CB . . . . . . . . . rr_1qbf 1 . 1 . 546 . 1 1 35 ARG CD C -15.095 1.126 4.202 . . . 1.0 . . . . . . . . . . . . A . 35 ARG CD . . . . . . . . . rr_1qbf 1 . 1 . 547 . 1 1 35 ARG CG C -15.665 -0.048 4.992 . . . 1.0 . . . . . . . . . . . . A . 35 ARG CG . . . . . . . . . rr_1qbf 1 . 1 . 548 . 1 1 35 ARG CZ C -15.146 1.231 1.782 . . . 1.0 . . . . . . . . . . . . A . 35 ARG CZ . . . . . . . . . rr_1qbf 1 . 1 . 549 . 1 1 35 ARG H H -13.313 -2.108 3.457 . . . 1.0 . . . . . . . . . . . . A . 35 ARG H . . . . . . . . . rr_1qbf 1 . 1 . 550 . 1 1 35 ARG HA H -13.129 -0.024 4.484 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HA . . . . . . . . . rr_1qbf 1 . 1 . 551 . 1 1 35 ARG HB2 H -14.938 -1.525 6.360 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HB2 . . . . . . . . . rr_1qbf 1 . 1 . 552 . 1 1 35 ARG HB3 H -14.426 0.121 6.728 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HB3 . . . . . . . . . rr_1qbf 1 . 1 . 553 . 1 1 35 ARG HD2 H -15.843 1.898 4.107 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HD2 . . . . . . . . . rr_1qbf 1 . 1 . 554 . 1 1 35 ARG HD3 H -14.229 1.520 4.716 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HD3 . . . . . . . . . rr_1qbf 1 . 1 . 555 . 1 1 35 ARG HE H -14.106 -0.142 2.778 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HE . . . . . . . . . rr_1qbf 1 . 1 . 556 . 1 1 35 ARG HG2 H -15.969 -0.829 4.308 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HG2 . . . . . . . . . rr_1qbf 1 . 1 . 557 . 1 1 35 ARG HG3 H -16.518 0.283 5.563 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HG3 . . . . . . . . . rr_1qbf 1 . 1 . 558 . 1 1 35 ARG HH11 H -16.924 0.317 1.836 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HH11 . . . . . . . . . rr_1qbf 1 . 1 . 559 . 1 1 35 ARG HH12 H -16.690 1.420 0.522 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HH12 . . . . . . . . . rr_1qbf 1 . 1 . 560 . 1 1 35 ARG HH21 H -13.472 2.278 1.466 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HH21 . . . . . . . . . rr_1qbf 1 . 1 . 561 . 1 1 35 ARG HH22 H -14.741 2.535 0.318 . . . 1.0 . . . . . . . . . . . . A . 35 ARG HH22 . . . . . . . . . rr_1qbf 1 . 1 . 562 . 1 1 35 ARG N N -13.377 -2.116 4.435 . . . 1.0 . . . . . . . . . . . . A . 35 ARG N . . . . . . . . . rr_1qbf 1 . 1 . 563 . 1 1 35 ARG NE N -14.696 0.638 2.856 . . . 1.0 . . . . . . . . . . . . A . 35 ARG NE . . . . . . . . . rr_1qbf 1 . 1 . 564 . 1 1 35 ARG NH1 N -16.347 0.969 1.347 . . . 1.0 . . . . . . . . . . . . A . 35 ARG NH1 . . . . . . . . . rr_1qbf 1 . 1 . 565 . 1 1 35 ARG NH2 N -14.394 2.081 1.139 . . . 1.0 . . . . . . . . . . . . A . 35 ARG NH2 . . . . . . . . . rr_1qbf 1 . 1 . 566 . 1 1 35 ARG O O -11.720 -1.911 6.632 . . . 1.0 . . . . . . . . . . . . A . 35 ARG O . . . . . . . . . rr_1qbf 1 . 1 . 567 . 1 1 36 TYR C C -10.951 -0.417 8.779 . . . 1.0 . . . . . . . . . . . . A . 36 TYR C . . . . . . . . . rr_1qbf 1 . 1 . 568 . 1 1 36 TYR CA C -10.546 0.349 7.527 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CA . . . . . . . . . rr_1qbf 1 . 1 . 569 . 1 1 36 TYR CB C -10.299 1.809 7.892 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CB . . . . . . . . . rr_1qbf 1 . 1 . 570 . 1 1 36 TYR CD1 C -7.938 1.606 7.028 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CD1 . . . . . . . . . rr_1qbf 1 . 1 . 571 . 1 1 36 TYR CD2 C -8.314 2.729 9.144 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CD2 . . . . . . . . . rr_1qbf 1 . 1 . 572 . 1 1 36 TYR CE1 C -6.561 1.831 7.153 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CE1 . . . . . . . . . rr_1qbf 1 . 1 . 573 . 1 1 36 TYR CE2 C -6.937 2.954 9.269 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CE2 . . . . . . . . . rr_1qbf 1 . 1 . 574 . 1 1 36 TYR CG C -8.814 2.055 8.023 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CG . . . . . . . . . rr_1qbf 1 . 1 . 575 . 1 1 36 TYR CZ C -6.060 2.505 8.273 . . . 1.0 . . . . . . . . . . . . A . 36 TYR CZ . . . . . . . . . rr_1qbf 1 . 1 . 576 . 1 1 36 TYR H H -12.019 1.109 6.180 . . . 1.0 . . . . . . . . . . . . A . 36 TYR H . . . . . . . . . rr_1qbf 1 . 1 . 577 . 1 1 36 TYR HA H -9.655 -0.078 7.101 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HA . . . . . . . . . rr_1qbf 1 . 1 . 578 . 1 1 36 TYR HB2 H -10.709 2.441 7.120 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HB2 . . . . . . . . . rr_1qbf 1 . 1 . 579 . 1 1 36 TYR HB3 H -10.787 2.031 8.829 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HB3 . . . . . . . . . rr_1qbf 1 . 1 . 580 . 1 1 36 TYR HD1 H -8.323 1.086 6.163 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HD1 . . . . . . . . . rr_1qbf 1 . 1 . 581 . 1 1 36 TYR HD2 H -8.990 3.076 9.912 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HD2 . . . . . . . . . rr_1qbf 1 . 1 . 582 . 1 1 36 TYR HE1 H -5.885 1.485 6.385 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HE1 . . . . . . . . . rr_1qbf 1 . 1 . 583 . 1 1 36 TYR HE2 H -6.551 3.473 10.134 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HE2 . . . . . . . . . rr_1qbf 1 . 1 . 584 . 1 1 36 TYR HH H -4.540 3.660 8.250 . . . 1.0 . . . . . . . . . . . . A . 36 TYR HH . . . . . . . . . rr_1qbf 1 . 1 . 585 . 1 1 36 TYR N N -11.651 0.284 6.547 . . . 1.0 . . . . . . . . . . . . A . 36 TYR N . . . . . . . . . rr_1qbf 1 . 1 . 586 . 1 1 36 TYR O O -10.412 -1.463 9.076 . . . 1.0 . . . . . . . . . . . . A . 36 TYR O . . . . . . . . . rr_1qbf 1 . 1 . 587 . 1 1 36 TYR OH O -4.703 2.725 8.395 . . . 1.0 . . . . . . . . . . . . A . 36 TYR OH . . . . . . . . . rr_1qbf 1 . 1 . 588 . 1 1 37 NH2 HN1 H -12.331 0.915 9.275 . . . 1.0 . . . . . . . . . . . . A . 37 NH2 HN1 . . . . . . . . . rr_1qbf 1 . 1 . 589 . 1 1 37 NH2 HN2 H -12.189 -0.411 10.325 . . . 1.0 . . . . . . . . . . . . A . 37 NH2 HN2 . . . . . . . . . rr_1qbf 1 . 1 . 590 . 1 1 37 NH2 N N -11.902 0.068 9.524 . . . 1.0 . . . . . . . . . . . . A . 37 NH2 N . . . . . . . . . rr_1qbf 1 stop_ save_ ########################### # Constraint Statistics # ########################### save_constraint_statistics _Constraint_stat_list.Sf_framecode constraint_statistics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID rr_1qbf _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 1qbf.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 rr_1qbf 1 1 1qbf.mr . . XPLOR/CNS 2 distance NOE ambi 424 rr_1qbf 1 1 1qbf.mr . . n/a 3 comment 'Not applicable' 'Not applicable' 0 rr_1qbf 1 1 1qbf.mr . . 'MR format' 4 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 rr_1qbf 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2 _Gen_dist_constraint_list.Entry_ID rr_1qbf _Gen_dist_constraint_list.ID 1 _Gen_dist_constraint_list.Constraint_type NOE _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 2 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . rr_1qbf 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 1 1 TYR HA H . . . 1 1 1 1 TYR QD H . . . . . 2.5 1.8 3.7 . . . . . A . 1 TYR HA . . A . 1 TYR QD . . . 1 . HA . . . . . 1 . HD+ . . rr_1qbf 1 2 1 OR . 1 1 1 1 TYR CZ C . . . 1 1 1 1 TYR HB2 H . . . . . 3.0 1.8 6.5 . . . . . A . 1 TYR CZ . . A . 1 TYR HB2 . . . 1 . CZ . . . . . 1 . HB+ . . rr_1qbf 1 2 2 OR . 1 1 1 1 TYR HB3 H . . . 1 1 1 1 TYR CZ C . . . . . 3.0 1.8 6.5 . . . . . A . 1 TYR HB3 . . A . 1 TYR CZ . . . 1 . HB+ . . . . . 1 . CZ . . rr_1qbf 1 3 1 OR . 1 1 1 1 TYR HA H . . . 1 1 1 1 TYR HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 1 TYR HA . . A . 1 TYR HB2 . . . 1 . HA . . . . . 1 . HB+ . . rr_1qbf 1 3 2 OR . 1 1 1 1 TYR HA H . . . 1 1 1 1 TYR HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 1 TYR HA . . A . 1 TYR HB3 . . . 1 . HA . . . . . 1 . HB+ . . rr_1qbf 1 4 1 OR . 1 1 1 1 TYR CG C . . . 1 1 2 2 PRO HD2 H . . . . . 2.5 1.8 5.7 . . . . . A . 1 TYR CG . . A . 2 PRO HD2 . . . 1 . CG . . . . . 2 . HD+ . . rr_1qbf 1 4 2 OR . 1 1 1 1 TYR CG C . . . 1 1 2 2 PRO HD3 H . . . . . 2.5 1.8 5.7 . . . . . A . 1 TYR CG . . A . 2 PRO HD3 . . . 1 . CG . . . . . 2 . HD+ . . rr_1qbf 1 5 1 OR . 1 1 1 1 TYR HB3 H . . . 1 1 2 2 PRO HD2 H . . . . . 4.0 1.8 7.0 . . . . . A . 1 TYR HB3 . . A . 2 PRO HD2 . . . 1 . HB+ . . . . . 2 . HD+ . . rr_1qbf 1 5 2 OR . 1 1 1 1 TYR HB2 H . . . 1 1 2 2 PRO HD2 H . . . . . 4.0 1.8 7.0 . . . . . A . 1 TYR HB2 . . A . 2 PRO HD2 . . . 1 . HB+ . . . . . 2 . HD+ . . rr_1qbf 1 5 3 OR . 1 1 2 2 PRO HD3 H . . . 1 1 1 1 TYR HB2 H . . . . . 4.0 1.8 7.0 . . . . . A . 2 PRO HD3 . . A . 1 TYR HB2 . . . 2 . HD+ . . . . . 1 . HB+ . . rr_1qbf 1 5 4 OR . 1 1 1 1 TYR HB3 H . . . 1 1 2 2 PRO HD3 H . . . . . 4.0 1.8 7.0 . . . . . A . 1 TYR HB3 . . A . 2 PRO HD3 . . . 1 . HB+ . . . . . 2 . HD+ . . rr_1qbf 1 6 1 OR . 1 1 1 1 TYR HA H . . . 1 1 2 2 PRO HD2 H . . . . . 2.5 1.8 3.7 . . . . . A . 1 TYR HA . . A . 2 PRO HD2 . . . 1 . HA . . . . . 2 . HD+ . . rr_1qbf 1 6 2 OR . 1 1 1 1 TYR HA H . . . 1 1 2 2 PRO HD3 H . . . . . 2.5 1.8 3.7 . . . . . A . 1 TYR HA . . A . 2 PRO HD3 . . . 1 . HA . . . . . 2 . HD+ . . rr_1qbf 1 7 1 OR . 1 1 1 1 TYR CZ C . . . 1 1 2 2 PRO HD2 H . . . . . 4.0 1.8 8.0 . . . . . A . 1 TYR CZ . . A . 2 PRO HD2 . . . 1 . CZ . . . . . 2 . HD+ . . rr_1qbf 1 7 2 OR . 1 1 1 1 TYR CZ C . . . 1 1 2 2 PRO HD3 H . . . . . 4.0 1.8 8.0 . . . . . A . 1 TYR CZ . . A . 2 PRO HD3 . . . 1 . CZ . . . . . 2 . HD+ . . rr_1qbf 1 8 1 . . 1 1 1 1 TYR CZ C . . . 1 1 31 31 VAL HA H . . . . . 4.0 1.8 7.0 . . . . . A . 1 TYR CZ . . A . 31 VAL HA . . . 1 . CZ . . . . . 31 . HA . . rr_1qbf 1 9 1 OR . 1 1 1 1 TYR HA H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 7.9 . . . . . A . 1 TYR HA . . A . 30 LEU MD1 . . . 1 . HA . . . . . 30 . HD++ . . rr_1qbf 1 9 2 OR . 1 1 1 1 TYR HA H . . . 1 1 30 30 LEU MD2 H . . . . . 4.0 1.8 7.9 . . . . . A . 1 TYR HA . . A . 30 LEU MD2 . . . 1 . HA . . . . . 30 . HD++ . . rr_1qbf 1 10 1 OR . 1 1 1 1 TYR HA H . . . 1 1 28 28 LEU MD1 H . . . . . 4.0 1.8 8.4 . . . . . A . 1 TYR HA . . A . 28 LEU MD1 . . . 1 . HA . . . . . 28 . HD++ . . rr_1qbf 1 10 2 OR . 1 1 1 1 TYR HA H . . . 1 1 28 28 LEU MD2 H . . . . . 4.0 1.8 8.4 . . . . . A . 1 TYR HA . . A . 28 LEU MD2 . . . 1 . HA . . . . . 28 . HD++ . . rr_1qbf 1 11 1 OR . 1 1 2 2 PRO HD3 H . . . 1 1 2 2 PRO HG2 H . . . . . 2.5 1.8 4.7 . . . . . A . 2 PRO HD3 . . A . 2 PRO HG2 . . . 2 . HD+ . . . . . 2 . HG+ . . rr_1qbf 1 11 2 OR . 1 1 2 2 PRO HD2 H . . . 1 1 2 2 PRO HG2 H . . . . . 2.5 1.8 4.7 . . . . . A . 2 PRO HD2 . . A . 2 PRO HG2 . . . 2 . HD+ . . . . . 2 . HG+ . . rr_1qbf 1 11 3 OR . 1 1 2 2 PRO HG3 H . . . 1 1 2 2 PRO HD2 H . . . . . 2.5 1.8 4.7 . . . . . A . 2 PRO HG3 . . A . 2 PRO HD2 . . . 2 . HG+ . . . . . 2 . HD+ . . rr_1qbf 1 11 4 OR . 1 1 2 2 PRO HD3 H . . . 1 1 2 2 PRO HG3 H . . . . . 2.5 1.8 4.7 . . . . . A . 2 PRO HD3 . . A . 2 PRO HG3 . . . 2 . HD+ . . . . . 2 . HG+ . . rr_1qbf 1 12 1 . . 1 1 2 2 PRO HA H . . . 1 1 3 3 ALA H H . . . . . 3.0 1.8 3.5 . . . . . A . 2 PRO HA . . A . 3 ALA H . . . 2 . HA . . . . . 3 . HN . . rr_1qbf 1 13 1 OR . 1 1 2 2 PRO HD2 H . . . 1 1 28 28 LEU MD1 H . . . . . 4.0 1.8 8.4 . . . . . A . 2 PRO HD2 . . A . 28 LEU MD1 . . . 2 . HD+ . . . . . 28 . HD++ . . rr_1qbf 1 13 2 OR . 1 1 2 2 PRO HD3 H . . . 1 1 28 28 LEU MD1 H . . . . . 4.0 1.8 8.4 . . . . . A . 2 PRO HD3 . . A . 28 LEU MD1 . . . 2 . HD+ . . . . . 28 . HD++ . . rr_1qbf 1 13 3 OR . 1 1 28 28 LEU MD2 H . . . 1 1 2 2 PRO HD2 H . . . . . 4.0 1.8 8.4 . . . . . A . 28 LEU MD2 . . A . 2 PRO HD2 . . . 28 . HD++ . . . . . 2 . HD+ . . rr_1qbf 1 13 4 OR . 1 1 2 2 PRO HD3 H . . . 1 1 28 28 LEU MD2 H . . . . . 4.0 1.8 8.4 . . . . . A . 2 PRO HD3 . . A . 28 LEU MD2 . . . 2 . HD+ . . . . . 28 . HD++ . . rr_1qbf 1 14 1 OR . 1 1 2 2 PRO HD3 H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 8.4 . . . . . A . 2 PRO HD3 . . A . 30 LEU MD1 . . . 2 . HD+ . . . . . 30 . HD++ . . rr_1qbf 1 14 2 OR . 1 1 2 2 PRO HD2 H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 8.4 . . . . . A . 2 PRO HD2 . . A . 30 LEU MD1 . . . 2 . HD+ . . . . . 30 . HD++ . . rr_1qbf 1 14 3 OR . 1 1 30 30 LEU MD2 H . . . 1 1 2 2 PRO HD2 H . . . . . 4.0 1.8 8.4 . . . . . A . 30 LEU MD2 . . A . 2 PRO HD2 . . . 30 . HD++ . . . . . 2 . HD+ . . rr_1qbf 1 14 4 OR . 1 1 2 2 PRO HD3 H . . . 1 1 30 30 LEU MD2 H . . . . . 4.0 1.8 8.4 . . . . . A . 2 PRO HD3 . . A . 30 LEU MD2 . . . 2 . HD+ . . . . . 30 . HD++ . . rr_1qbf 1 15 1 OR . 1 1 2 2 PRO HD3 H . . . 1 1 31 31 VAL MG2 H . . . . . 3.0 1.8 6.9 . . . . . A . 2 PRO HD3 . . A . 31 VAL MG2 . . . 2 . HD+ . . . . . 31 . HG++ . . rr_1qbf 1 15 2 OR . 1 1 2 2 PRO HD2 H . . . 1 1 31 31 VAL MG2 H . . . . . 3.0 1.8 6.9 . . . . . A . 2 PRO HD2 . . A . 31 VAL MG2 . . . 2 . HD+ . . . . . 31 . HG++ . . rr_1qbf 1 15 3 OR . 1 1 31 31 VAL MG1 H . . . 1 1 2 2 PRO HD2 H . . . . . 3.0 1.8 6.9 . . . . . A . 31 VAL MG1 . . A . 2 PRO HD2 . . . 31 . HG++ . . . . . 2 . HD+ . . rr_1qbf 1 15 4 OR . 1 1 2 2 PRO HD3 H . . . 1 1 31 31 VAL MG1 H . . . . . 3.0 1.8 6.9 . . . . . A . 2 PRO HD3 . . A . 31 VAL MG1 . . . 2 . HD+ . . . . . 31 . HG++ . . rr_1qbf 1 16 1 . . 1 1 3 3 ALA HA H . . . 1 1 3 3 ALA MB H . . . . . 2.5 1.8 3.7 . . . . . A . 3 ALA HA . . A . 3 ALA MB . . . 3 . HA . . . . . 3 . HB+ . . rr_1qbf 1 17 1 . . 1 1 3 3 ALA H H . . . 1 1 3 3 ALA HA H . . . . . 2.5 1.8 2.7 . . . . . A . 3 ALA H . . A . 3 ALA HA . . . 3 . HN . . . . . 3 . HA . . rr_1qbf 1 18 1 . . 1 1 3 3 ALA H H . . . 1 1 3 3 ALA MB H . . . . . 2.5 1.8 3.3 . . . . . A . 3 ALA H . . A . 3 ALA MB . . . 3 . HN . . . . . 3 . HB+ . . rr_1qbf 1 19 1 . . 1 1 3 3 ALA MB H . . . 1 1 4 4 LYS H H . . . . . 2.5 1.8 3.7 . . . . . A . 3 ALA MB . . A . 4 LYS H . . . 3 . HB+ . . . . . 4 . HN . . rr_1qbf 1 20 1 . . 1 1 3 3 ALA MB H . . . 1 1 4 4 LYS HA H . . . . . 3.0 1.8 4.5 . . . . . A . 3 ALA MB . . A . 4 LYS HA . . . 3 . HB+ . . . . . 4 . HA . . rr_1qbf 1 21 1 . . 1 1 3 3 ALA H H . . . 1 1 27 27 TYR CG C . . . . . 4.0 1.8 7.0 . . . . . A . 3 ALA H . . A . 27 TYR CG . . . 3 . HN . . . . . 27 . CG . . rr_1qbf 1 22 1 . . 1 1 3 3 ALA MB H . . . 1 1 28 28 LEU H H . . . . . 4.0 1.8 6.0 . . . . . A . 3 ALA MB . . A . 28 LEU H . . . 3 . HB+ . . . . . 28 . HN . . rr_1qbf 1 23 1 . . 1 1 3 3 ALA MB H . . . 1 1 27 27 TYR CZ C . . . . . 3.0 1.8 6.5 . . . . . A . 3 ALA MB . . A . 27 TYR CZ . . . 3 . HB+ . . . . . 27 . CZ . . rr_1qbf 1 24 1 OR . 1 1 3 3 ALA HA H . . . 1 1 26 26 HIS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 3 ALA HA . . A . 26 HIS HB2 . . . 3 . HA . . . . . 26 . HB+ . . rr_1qbf 1 24 2 OR . 1 1 3 3 ALA HA H . . . 1 1 26 26 HIS HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 3 ALA HA . . A . 26 HIS HB3 . . . 3 . HA . . . . . 26 . HB+ . . rr_1qbf 1 25 1 OR . 1 1 3 3 ALA HA H . . . 1 1 27 27 TYR HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 3 ALA HA . . A . 27 TYR HB2 . . . 3 . HA . . . . . 27 . HB+ . . rr_1qbf 1 25 2 OR . 1 1 3 3 ALA HA H . . . 1 1 27 27 TYR HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 3 ALA HA . . A . 27 TYR HB3 . . . 3 . HA . . . . . 27 . HB+ . . rr_1qbf 1 26 1 OR . 1 1 3 3 ALA HA H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 7.4 . . . . . A . 3 ALA HA . . A . 30 LEU MD1 . . . 3 . HA . . . . . 30 . HD++ . . rr_1qbf 1 26 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 3 3 ALA HA H . . . . . 4.0 1.8 7.4 . . . . . A . 30 LEU MD2 . . A . 3 ALA HA . . . 30 . HD++ . . . . . 3 . HA . . rr_1qbf 1 27 1 . . 1 1 4 4 LYS H H . . . 1 1 4 4 LYS HA H . . . . . 3.0 1.8 3.5 . . . . . A . 4 LYS H . . A . 4 LYS HA . . . 4 . HN . . . . . 4 . HA . . rr_1qbf 1 28 1 OR . 1 1 4 4 LYS H H . . . 1 1 4 4 LYS HB2 H . . . . . 3.0 1.8 4.1 . . . . . A . 4 LYS H . . A . 4 LYS HB2 . . . 4 . HN . . . . . 4 . HB+ . . rr_1qbf 1 28 2 OR . 1 1 4 4 LYS H H . . . 1 1 4 4 LYS HB3 H . . . . . 3.0 1.8 4.1 . . . . . A . 4 LYS H . . A . 4 LYS HB3 . . . 4 . HN . . . . . 4 . HB+ . . rr_1qbf 1 29 1 OR . 1 1 4 4 LYS H H . . . 1 1 4 4 LYS HG2 H . . . . . 3.0 1.8 4.5 . . . . . A . 4 LYS H . . A . 4 LYS HG2 . . . 4 . HN . . . . . 4 . HG+ . . rr_1qbf 1 29 2 OR . 1 1 4 4 LYS H H . . . 1 1 4 4 LYS HG3 H . . . . . 3.0 1.8 4.5 . . . . . A . 4 LYS H . . A . 4 LYS HG3 . . . 4 . HN . . . . . 4 . HG+ . . rr_1qbf 1 30 1 OR . 1 1 4 4 LYS HA H . . . 1 1 4 4 LYS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 4 LYS HA . . A . 4 LYS HB2 . . . 4 . HA . . . . . 4 . HB+ . . rr_1qbf 1 30 2 OR . 1 1 4 4 LYS HA H . . . 1 1 4 4 LYS HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 4 LYS HA . . A . 4 LYS HB3 . . . 4 . HA . . . . . 4 . HB+ . . rr_1qbf 1 31 1 OR . 1 1 27 27 TYR CZ C . . . 1 1 4 4 LYS HG2 H . . . . . 2.5 1.8 5.7 . . . . . A . 27 TYR CZ . . A . 4 LYS HG2 . . . 27 . CZ . . . . . 4 . HG+ . . rr_1qbf 1 31 2 OR . 1 1 27 27 TYR CZ C . . . 1 1 4 4 LYS HG3 H . . . . . 2.5 1.8 5.7 . . . . . A . 27 TYR CZ . . A . 4 LYS HG3 . . . 27 . CZ . . . . . 4 . HG+ . . rr_1qbf 1 32 1 OR . 1 1 6 6 GLU HA H . . . 1 1 5 5 PRO HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 6 GLU HA . . A . 5 PRO HD2 . . . 6 . HA . . . . . 5 . HD+ . . rr_1qbf 1 32 2 OR . 1 1 5 5 PRO HD3 H . . . 1 1 6 6 GLU HA H . . . . . 4.0 1.8 6.0 . . . . . A . 5 PRO HD3 . . A . 6 GLU HA . . . 5 . HD+ . . . . . 6 . HA . . rr_1qbf 1 33 1 OR . 1 1 20 20 TYR CZ C . . . 1 1 5 5 PRO HB2 H . . . . . 3.0 1.8 6.5 . . . . . A . 20 TYR CZ . . A . 5 PRO HB2 . . . 20 . CZ . . . . . 5 . HB+ . . rr_1qbf 1 33 2 OR . 1 1 5 5 PRO HB3 H . . . 1 1 20 20 TYR CZ C . . . . . 3.0 1.8 6.5 . . . . . A . 5 PRO HB3 . . A . 20 TYR CZ . . . 5 . HB+ . . . . . 20 . CZ . . rr_1qbf 1 34 1 OR . 1 1 20 20 TYR CZ C . . . 1 1 5 5 PRO HG2 H . . . . . 3.0 1.8 6.5 . . . . . A . 20 TYR CZ . . A . 5 PRO HG2 . . . 20 . CZ . . . . . 5 . HG+ . . rr_1qbf 1 34 2 OR . 1 1 20 20 TYR CZ C . . . 1 1 5 5 PRO HG3 H . . . . . 3.0 1.8 6.5 . . . . . A . 20 TYR CZ . . A . 5 PRO HG3 . . . 20 . CZ . . . . . 5 . HG+ . . rr_1qbf 1 35 1 OR . 1 1 27 27 TYR CZ C . . . 1 1 5 5 PRO HD2 H . . . . . 2.5 1.8 5.7 . . . . . A . 27 TYR CZ . . A . 5 PRO HD2 . . . 27 . CZ . . . . . 5 . HD+ . . rr_1qbf 1 35 2 OR . 1 1 27 27 TYR CZ C . . . 1 1 5 5 PRO HD3 H . . . . . 2.5 1.8 5.7 . . . . . A . 27 TYR CZ . . A . 5 PRO HD3 . . . 27 . CZ . . . . . 5 . HD+ . . rr_1qbf 1 36 1 OR . 1 1 27 27 TYR CG C . . . 1 1 5 5 PRO HD2 H . . . . . 3.0 1.8 6.5 . . . . . A . 27 TYR CG . . A . 5 PRO HD2 . . . 27 . CG . . . . . 5 . HD+ . . rr_1qbf 1 36 2 OR . 1 1 27 27 TYR CG C . . . 1 1 5 5 PRO HD3 H . . . . . 3.0 1.8 6.5 . . . . . A . 27 TYR CG . . A . 5 PRO HD3 . . . 27 . CG . . . . . 5 . HD+ . . rr_1qbf 1 37 1 OR . 1 1 5 5 PRO HB3 H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 8.4 . . . . . A . 5 PRO HB3 . . A . 30 LEU MD1 . . . 5 . HB+ . . . . . 30 . HD++ . . rr_1qbf 1 37 2 OR . 1 1 5 5 PRO HB2 H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 8.4 . . . . . A . 5 PRO HB2 . . A . 30 LEU MD1 . . . 5 . HB+ . . . . . 30 . HD++ . . rr_1qbf 1 37 3 OR . 1 1 30 30 LEU MD2 H . . . 1 1 5 5 PRO HB2 H . . . . . 4.0 1.8 8.4 . . . . . A . 30 LEU MD2 . . A . 5 PRO HB2 . . . 30 . HD++ . . . . . 5 . HB+ . . rr_1qbf 1 37 4 OR . 1 1 30 30 LEU MD2 H . . . 1 1 5 5 PRO HB3 H . . . . . 4.0 1.8 8.4 . . . . . A . 30 LEU MD2 . . A . 5 PRO HB3 . . . 30 . HD++ . . . . . 5 . HB+ . . rr_1qbf 1 38 1 . . 1 1 5 5 PRO HA H . . . 1 1 6 6 GLU H H . . . . . 2.5 1.8 2.7 . . . . . A . 5 PRO HA . . A . 6 GLU H . . . 5 . HA . . . . . 6 . HN . . rr_1qbf 1 39 1 OR . 1 1 26 26 HIS HE1 H . . . 1 1 5 5 PRO HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 26 HIS HE1 . . A . 5 PRO HB2 . . . 26 . HE1 . . . . . 5 . HB+ . . rr_1qbf 1 39 2 OR . 1 1 5 5 PRO HB3 H . . . 1 1 26 26 HIS HE1 H . . . . . 4.0 1.8 6.0 . . . . . A . 5 PRO HB3 . . A . 26 HIS HE1 . . . 5 . HB+ . . . . . 26 . HE1 . . rr_1qbf 1 40 1 OR . 1 1 5 5 PRO HD2 H . . . 1 1 26 26 HIS HB2 H . . . . . 3.0 1.8 6.2 . . . . . A . 5 PRO HD2 . . A . 26 HIS HB2 . . . 5 . HD+ . . . . . 26 . HB+ . . rr_1qbf 1 40 2 OR . 1 1 5 5 PRO HD3 H . . . 1 1 26 26 HIS HB2 H . . . . . 3.0 1.8 6.2 . . . . . A . 5 PRO HD3 . . A . 26 HIS HB2 . . . 5 . HD+ . . . . . 26 . HB+ . . rr_1qbf 1 40 3 OR . 1 1 26 26 HIS HB3 H . . . 1 1 5 5 PRO HD2 H . . . . . 3.0 1.8 6.2 . . . . . A . 26 HIS HB3 . . A . 5 PRO HD2 . . . 26 . HB+ . . . . . 5 . HD+ . . rr_1qbf 1 40 4 OR . 1 1 26 26 HIS HB3 H . . . 1 1 5 5 PRO HD3 H . . . . . 3.0 1.8 6.2 . . . . . A . 26 HIS HB3 . . A . 5 PRO HD3 . . . 26 . HB+ . . . . . 5 . HD+ . . rr_1qbf 1 41 1 . . 1 1 6 6 GLU HA H . . . 1 1 6 6 GLU H H . . . . . 2.5 1.8 2.7 . . . . . A . 6 GLU HA . . A . 6 GLU H . . . 6 . HA . . . . . 6 . HN . . rr_1qbf 1 42 1 OR . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HB2 H . . . . . 2.5 1.8 3.3 . . . . . A . 6 GLU H . . A . 6 GLU HB2 . . . 6 . HN . . . . . 6 . HB+ . . rr_1qbf 1 42 2 OR . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HB3 H . . . . . 2.5 1.8 3.3 . . . . . A . 6 GLU H . . A . 6 GLU HB3 . . . 6 . HN . . . . . 6 . HB+ . . rr_1qbf 1 43 1 OR . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 6 GLU H . . A . 6 GLU HG2 . . . 6 . HN . . . . . 6 . HG+ . . rr_1qbf 1 43 2 OR . 1 1 6 6 GLU H H . . . 1 1 6 6 GLU HG3 H . . . . . 2.5 1.8 3.7 . . . . . A . 6 GLU H . . A . 6 GLU HG3 . . . 6 . HN . . . . . 6 . HG+ . . rr_1qbf 1 44 1 OR . 1 1 6 6 GLU HA H . . . 1 1 6 6 GLU HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 6 GLU HA . . A . 6 GLU HB2 . . . 6 . HA . . . . . 6 . HB+ . . rr_1qbf 1 44 2 OR . 1 1 6 6 GLU HA H . . . 1 1 6 6 GLU HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 6 GLU HA . . A . 6 GLU HB3 . . . 6 . HA . . . . . 6 . HB+ . . rr_1qbf 1 45 1 OR . 1 1 6 6 GLU HA H . . . 1 1 6 6 GLU HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 6 GLU HA . . A . 6 GLU HG2 . . . 6 . HA . . . . . 6 . HG+ . . rr_1qbf 1 45 2 OR . 1 1 6 6 GLU HA H . . . 1 1 6 6 GLU HG3 H . . . . . 2.5 1.8 3.7 . . . . . A . 6 GLU HA . . A . 6 GLU HG3 . . . 6 . HA . . . . . 6 . HG+ . . rr_1qbf 1 46 1 . . 1 1 6 6 GLU HA H . . . 1 1 7 7 ALA H H . . . . . 3.0 1.8 3.5 . . . . . A . 6 GLU HA . . A . 7 ALA H . . . 6 . HA . . . . . 7 . HN . . rr_1qbf 1 47 1 . . 1 1 6 6 GLU H H . . . 1 1 7 7 ALA H H . . . . . 2.5 1.8 2.7 . . . . . A . 6 GLU H . . A . 7 ALA H . . . 6 . HN . . . . . 7 . HN . . rr_1qbf 1 48 1 OR . 1 1 7 7 ALA H H . . . 1 1 6 6 GLU HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 7 ALA H . . A . 6 GLU HG2 . . . 7 . HN . . . . . 6 . HG+ . . rr_1qbf 1 48 2 OR . 1 1 6 6 GLU HG3 H . . . 1 1 7 7 ALA H H . . . . . 2.5 1.8 3.7 . . . . . A . 6 GLU HG3 . . A . 7 ALA H . . . 6 . HG+ . . . . . 7 . HN . . rr_1qbf 1 49 1 . . 1 1 6 6 GLU HA H . . . 1 1 7 7 ALA HA H . . . . . 4.0 1.8 5.0 . . . . . A . 6 GLU HA . . A . 7 ALA HA . . . 6 . HA . . . . . 7 . HA . . rr_1qbf 1 50 1 . . 1 1 6 6 GLU HA H . . . 1 1 7 7 ALA MB H . . . . . 3.0 1.8 4.5 . . . . . A . 6 GLU HA . . A . 7 ALA MB . . . 6 . HA . . . . . 7 . HB+ . . rr_1qbf 1 51 1 OR . 1 1 26 26 HIS HE1 H . . . 1 1 6 6 GLU HG2 H . . . . . 4.0 1.8 7.0 . . . . . A . 26 HIS HE1 . . A . 6 GLU HG2 . . . 26 . HE1 . . . . . 6 . HG+ . . rr_1qbf 1 51 2 OR . 1 1 26 26 HIS HE1 H . . . 1 1 6 6 GLU HG3 H . . . . . 4.0 1.8 7.0 . . . . . A . 26 HIS HE1 . . A . 6 GLU HG3 . . . 26 . HE1 . . . . . 6 . HG+ . . rr_1qbf 1 52 1 . . 1 1 7 7 ALA H H . . . 1 1 7 7 ALA MB H . . . . . 2.5 1.8 3.3 . . . . . A . 7 ALA H . . A . 7 ALA MB . . . 7 . HN . . . . . 7 . HB+ . . rr_1qbf 1 53 1 . . 1 1 7 7 ALA HA H . . . 1 1 7 7 ALA MB H . . . . . 2.5 1.8 3.7 . . . . . A . 7 ALA HA . . A . 7 ALA MB . . . 7 . HA . . . . . 7 . HB+ . . rr_1qbf 1 54 1 OR . 1 1 7 7 ALA HA H . . . 1 1 8 8 PRO HD2 H . . . . . 3.0 1.8 4.5 . . . . . A . 7 ALA HA . . A . 8 PRO HD2 . . . 7 . HA . . . . . 8 . HD+ . . rr_1qbf 1 54 2 OR . 1 1 7 7 ALA HA H . . . 1 1 8 8 PRO HD3 H . . . . . 3.0 1.8 4.5 . . . . . A . 7 ALA HA . . A . 8 PRO HD3 . . . 7 . HA . . . . . 8 . HD+ . . rr_1qbf 1 55 1 . . 1 1 20 20 TYR CZ C . . . 1 1 7 7 ALA HA H . . . . . 2.5 1.8 4.7 . . . . . A . 20 TYR CZ . . A . 7 ALA HA . . . 20 . CZ . . . . . 7 . HA . . rr_1qbf 1 56 1 . . 1 1 7 7 ALA MB H . . . 1 1 24 24 LEU H H . . . . . 4.0 1.8 6.0 . . . . . A . 7 ALA MB . . A . 24 LEU H . . . 7 . HB+ . . . . . 24 . HN . . rr_1qbf 1 57 1 . . 1 1 7 7 ALA MB H . . . 1 1 26 26 HIS HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 7 ALA MB . . A . 26 HIS HD2 . . . 7 . HB+ . . . . . 26 . HD2 . . rr_1qbf 1 58 1 . . 1 1 20 20 TYR CZ C . . . 1 1 7 7 ALA MB H . . . . . 2.5 1.8 5.7 . . . . . A . 20 TYR CZ . . A . 7 ALA MB . . . 20 . CZ . . . . . 7 . HB+ . . rr_1qbf 1 59 1 OR . 1 1 7 7 ALA HA H . . . 1 1 8 8 PRO HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 7 ALA HA . . A . 8 PRO HB2 . . . 7 . HA . . . . . 8 . HB+ . . rr_1qbf 1 59 2 OR . 1 1 7 7 ALA HA H . . . 1 1 8 8 PRO HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 7 ALA HA . . A . 8 PRO HB3 . . . 7 . HA . . . . . 8 . HB+ . . rr_1qbf 1 60 1 OR . 1 1 9 9 GLY H H . . . 1 1 8 8 PRO HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 9 GLY H . . A . 8 PRO HB2 . . . 9 . HN . . . . . 8 . HB+ . . rr_1qbf 1 60 2 OR . 1 1 8 8 PRO HB3 H . . . 1 1 9 9 GLY H H . . . . . 2.5 1.8 3.7 . . . . . A . 8 PRO HB3 . . A . 9 GLY H . . . 8 . HB+ . . . . . 9 . HN . . rr_1qbf 1 61 1 OR . 1 1 20 20 TYR CZ C . . . 1 1 8 8 PRO HD2 H . . . . . 4.0 1.8 8.0 . . . . . A . 20 TYR CZ . . A . 8 PRO HD2 . . . 20 . CZ . . . . . 8 . HD+ . . rr_1qbf 1 61 2 OR . 1 1 20 20 TYR CZ C . . . 1 1 8 8 PRO HD3 H . . . . . 4.0 1.8 8.0 . . . . . A . 20 TYR CZ . . A . 8 PRO HD3 . . . 20 . CZ . . . . . 8 . HD+ . . rr_1qbf 1 62 1 OR . 1 1 20 20 TYR CG C . . . 1 1 8 8 PRO HD2 H . . . . . 2.5 1.8 5.7 . . . . . A . 20 TYR CG . . A . 8 PRO HD2 . . . 20 . CG . . . . . 8 . HD+ . . rr_1qbf 1 62 2 OR . 1 1 8 8 PRO HD3 H . . . 1 1 20 20 TYR CG C . . . . . 2.5 1.8 5.7 . . . . . A . 8 PRO HD3 . . A . 20 TYR CG . . . 8 . HD+ . . . . . 20 . CG . . rr_1qbf 1 63 1 . . 1 1 20 20 TYR CZ C . . . 1 1 8 8 PRO HA H . . . . . 4.0 1.8 7.0 . . . . . A . 20 TYR CZ . . A . 8 PRO HA . . . 20 . CZ . . . . . 8 . HA . . rr_1qbf 1 64 1 OR . 1 1 20 20 TYR CZ C . . . 1 1 8 8 PRO HG2 H . . . . . 4.0 1.8 8.0 . . . . . A . 20 TYR CZ . . A . 8 PRO HG2 . . . 20 . CZ . . . . . 8 . HG+ . . rr_1qbf 1 64 2 OR . 1 1 20 20 TYR CZ C . . . 1 1 8 8 PRO HG3 H . . . . . 4.0 1.8 8.0 . . . . . A . 20 TYR CZ . . A . 8 PRO HG3 . . . 20 . CZ . . . . . 8 . HG+ . . rr_1qbf 1 65 1 . . 1 1 9 9 GLY H H . . . 1 1 9 9 GLY HA3 H . . . . . 2.5 1.8 2.7 . . . . . A . 9 GLY H . . A . 9 GLY HA3 . . . 9 . HN . . . . . 9 . HA1 . . rr_1qbf 1 66 1 . . 1 1 9 9 GLY H H . . . 1 1 9 9 GLY HA2 H . . . . . 2.5 1.8 2.7 . . . . . A . 9 GLY H . . A . 9 GLY HA2 . . . 9 . HN . . . . . 9 . HA2 . . rr_1qbf 1 67 1 . . 1 1 10 10 GLU H H . . . 1 1 9 9 GLY HA3 H . . . . . 2.5 1.8 2.7 . . . . . A . 10 GLU H . . A . 9 GLY HA3 . . . 10 . HN . . . . . 9 . HA1 . . rr_1qbf 1 68 1 . . 1 1 10 10 GLU H H . . . 1 1 9 9 GLY HA2 H . . . . . 2.5 1.8 2.7 . . . . . A . 10 GLU H . . A . 9 GLY HA2 . . . 10 . HN . . . . . 9 . HA2 . . rr_1qbf 1 69 1 . . 1 1 9 9 GLY H H . . . 1 1 10 10 GLU H H . . . . . 4.0 1.8 5.0 . . . . . A . 9 GLY H . . A . 10 GLU H . . . 9 . HN . . . . . 10 . HN . . rr_1qbf 1 70 1 OR . 1 1 11 11 ASP H H . . . 1 1 9 9 GLY HA2 H . . . . . 3.0 1.8 4.5 . . . . . A . 11 ASP H . . A . 9 GLY HA2 . . . 11 . HN . . . . . 9 . HA+ . . rr_1qbf 1 70 2 OR . 1 1 9 9 GLY HA3 H . . . 1 1 11 11 ASP H H . . . . . 3.0 1.8 4.5 . . . . . A . 9 GLY HA3 . . A . 11 ASP H . . . 9 . HA+ . . . . . 11 . HN . . rr_1qbf 1 71 1 OR . 1 1 9 9 GLY H H . . . 1 1 10 10 GLU HG2 H . . . . . 3.0 1.8 4.5 . . . . . A . 9 GLY H . . A . 10 GLU HG2 . . . 9 . HN . . . . . 10 . HG+ . . rr_1qbf 1 71 2 OR . 1 1 9 9 GLY H H . . . 1 1 10 10 GLU HG3 H . . . . . 3.0 1.8 4.5 . . . . . A . 9 GLY H . . A . 10 GLU HG3 . . . 9 . HN . . . . . 10 . HG+ . . rr_1qbf 1 72 1 OR . 1 1 15 15 GLU HA H . . . 1 1 9 9 GLY HA2 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 GLU HA . . A . 9 GLY HA2 . . . 15 . HA . . . . . 9 . HA+ . . rr_1qbf 1 72 2 OR . 1 1 9 9 GLY HA3 H . . . 1 1 15 15 GLU HA H . . . . . 4.0 1.8 6.0 . . . . . A . 9 GLY HA3 . . A . 15 GLU HA . . . 9 . HA+ . . . . . 15 . HA . . rr_1qbf 1 73 1 . . 1 1 10 10 GLU H H . . . 1 1 10 10 GLU HA H . . . . . 2.5 1.8 2.7 . . . . . A . 10 GLU H . . A . 10 GLU HA . . . 10 . HN . . . . . 10 . HA . . rr_1qbf 1 74 1 OR . 1 1 10 10 GLU H H . . . 1 1 10 10 GLU HB2 H . . . . . 3.0 1.8 4.1 . . . . . A . 10 GLU H . . A . 10 GLU HB2 . . . 10 . HN . . . . . 10 . HB+ . . rr_1qbf 1 74 2 OR . 1 1 10 10 GLU H H . . . 1 1 10 10 GLU HB3 H . . . . . 3.0 1.8 4.1 . . . . . A . 10 GLU H . . A . 10 GLU HB3 . . . 10 . HN . . . . . 10 . HB+ . . rr_1qbf 1 75 1 OR . 1 1 10 10 GLU H H . . . 1 1 10 10 GLU HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 10 GLU H . . A . 10 GLU HG2 . . . 10 . HN . . . . . 10 . HG+ . . rr_1qbf 1 75 2 OR . 1 1 10 10 GLU H H . . . 1 1 10 10 GLU HG3 H . . . . . 2.5 1.8 3.7 . . . . . A . 10 GLU H . . A . 10 GLU HG3 . . . 10 . HN . . . . . 10 . HG+ . . rr_1qbf 1 76 1 OR . 1 1 10 10 GLU HA H . . . 1 1 10 10 GLU HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 10 GLU HA . . A . 10 GLU HG2 . . . 10 . HA . . . . . 10 . HG+ . . rr_1qbf 1 76 2 OR . 1 1 10 10 GLU HG3 H . . . 1 1 10 10 GLU HA H . . . . . 2.5 1.8 3.7 . . . . . A . 10 GLU HG3 . . A . 10 GLU HA . . . 10 . HG+ . . . . . 10 . HA . . rr_1qbf 1 77 1 OR . 1 1 10 10 GLU HA H . . . 1 1 10 10 GLU HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 10 GLU HA . . A . 10 GLU HB2 . . . 10 . HA . . . . . 10 . HB+ . . rr_1qbf 1 77 2 OR . 1 1 10 10 GLU HA H . . . 1 1 10 10 GLU HB3 H . . . . . 3.0 1.8 4.5 . . . . . A . 10 GLU HA . . A . 10 GLU HB3 . . . 10 . HA . . . . . 10 . HB+ . . rr_1qbf 1 78 1 . . 1 1 11 11 ASP H H . . . 1 1 10 10 GLU HA H . . . . . 3.0 1.8 3.5 . . . . . A . 11 ASP H . . A . 10 GLU HA . . . 11 . HN . . . . . 10 . HA . . rr_1qbf 1 79 1 OR . 1 1 10 10 GLU HA H . . . 1 1 11 11 ASP HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 10 GLU HA . . A . 11 ASP HB2 . . . 10 . HA . . . . . 11 . HB+ . . rr_1qbf 1 79 2 OR . 1 1 10 10 GLU HA H . . . 1 1 11 11 ASP HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 10 GLU HA . . A . 11 ASP HB3 . . . 10 . HA . . . . . 11 . HB+ . . rr_1qbf 1 80 1 . . 1 1 10 10 GLU H H . . . 1 1 17 17 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 GLU H . . A . 17 LEU H . . . 10 . HN . . . . . 17 . HN . . rr_1qbf 1 81 1 . . 1 1 10 10 GLU HA H . . . 1 1 16 16 GLU H H . . . . . 4.0 1.8 5.5 . . . . . A . 10 GLU HA . . A . 16 GLU H . . . 10 . HA . . . . . 16 . HN . . rr_1qbf 1 82 1 . . 1 1 10 10 GLU H H . . . 1 1 12 12 ALA MB H . . . . . 4.0 1.8 6.0 . . . . . A . 10 GLU H . . A . 12 ALA MB . . . 10 . HN . . . . . 12 . HB+ . . rr_1qbf 1 83 1 OR . 1 1 11 11 ASP H H . . . 1 1 10 10 GLU HG2 H . . . . . 3.0 1.8 4.5 . . . . . A . 11 ASP H . . A . 10 GLU HG2 . . . 11 . HN . . . . . 10 . HG+ . . rr_1qbf 1 83 2 OR . 1 1 11 11 ASP H H . . . 1 1 10 10 GLU HG3 H . . . . . 3.0 1.8 4.5 . . . . . A . 11 ASP H . . A . 10 GLU HG3 . . . 11 . HN . . . . . 10 . HG+ . . rr_1qbf 1 84 1 OR . 1 1 11 11 ASP H H . . . 1 1 10 10 GLU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 11 ASP H . . A . 10 GLU HB2 . . . 11 . HN . . . . . 10 . HB+ . . rr_1qbf 1 84 2 OR . 1 1 11 11 ASP H H . . . 1 1 10 10 GLU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 11 ASP H . . A . 10 GLU HB3 . . . 11 . HN . . . . . 10 . HB+ . . rr_1qbf 1 85 1 . . 1 1 11 11 ASP H H . . . 1 1 11 11 ASP HA H . . . . . 2.5 1.8 2.7 . . . . . A . 11 ASP H . . A . 11 ASP HA . . . 11 . HN . . . . . 11 . HA . . rr_1qbf 1 86 1 OR . 1 1 11 11 ASP H H . . . 1 1 11 11 ASP HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 11 ASP H . . A . 11 ASP HB2 . . . 11 . HN . . . . . 11 . HB+ . . rr_1qbf 1 86 2 OR . 1 1 11 11 ASP H H . . . 1 1 11 11 ASP HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 11 ASP H . . A . 11 ASP HB3 . . . 11 . HN . . . . . 11 . HB+ . . rr_1qbf 1 87 1 OR . 1 1 11 11 ASP HA H . . . 1 1 11 11 ASP HB2 H . . . . . 4.0 1.8 5.6 . . . . . A . 11 ASP HA . . A . 11 ASP HB2 . . . 11 . HA . . . . . 11 . HB+ . . rr_1qbf 1 87 2 OR . 1 1 11 11 ASP HB3 H . . . 1 1 11 11 ASP HA H . . . . . 4.0 1.8 5.6 . . . . . A . 11 ASP HB3 . . A . 11 ASP HA . . . 11 . HB+ . . . . . 11 . HA . . rr_1qbf 1 88 1 OR . 1 1 12 12 ALA H H . . . 1 1 11 11 ASP HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 12 ALA H . . A . 11 ASP HB2 . . . 12 . HN . . . . . 11 . HB+ . . rr_1qbf 1 88 2 OR . 1 1 11 11 ASP HB3 H . . . 1 1 12 12 ALA H H . . . . . 3.0 1.8 4.5 . . . . . A . 11 ASP HB3 . . A . 12 ALA H . . . 11 . HB+ . . . . . 12 . HN . . rr_1qbf 1 89 1 . . 1 1 11 11 ASP H H . . . 1 1 12 12 ALA H H . . . . . 2.5 1.8 2.7 . . . . . A . 11 ASP H . . A . 12 ALA H . . . 11 . HN . . . . . 12 . HN . . rr_1qbf 1 90 1 . . 1 1 12 12 ALA H H . . . 1 1 12 12 ALA HA H . . . . . 2.5 1.8 2.7 . . . . . A . 12 ALA H . . A . 12 ALA HA . . . 12 . HN . . . . . 12 . HA . . rr_1qbf 1 91 1 . . 1 1 12 12 ALA MB H . . . 1 1 12 12 ALA HA H . . . . . 2.5 1.8 3.7 . . . . . A . 12 ALA MB . . A . 12 ALA HA . . . 12 . HB+ . . . . . 12 . HA . . rr_1qbf 1 92 1 . . 1 1 12 12 ALA HA H . . . 1 1 13 13 SER H H . . . . . 3.0 1.8 3.5 . . . . . A . 12 ALA HA . . A . 13 SER H . . . 12 . HA . . . . . 13 . HN . . rr_1qbf 1 93 1 . . 1 1 12 12 ALA MB H . . . 1 1 13 13 SER H H . . . . . 2.5 1.8 3.7 . . . . . A . 12 ALA MB . . A . 13 SER H . . . 12 . HB+ . . . . . 13 . HN . . rr_1qbf 1 94 1 OR . 1 1 12 12 ALA MB H . . . 1 1 15 15 GLU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 12 ALA MB . . A . 15 GLU HB2 . . . 12 . HB+ . . . . . 15 . HB+ . . rr_1qbf 1 94 2 OR . 1 1 12 12 ALA MB H . . . 1 1 15 15 GLU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 12 ALA MB . . A . 15 GLU HB3 . . . 12 . HB+ . . . . . 15 . HB+ . . rr_1qbf 1 95 1 OR . 1 1 12 12 ALA MB H . . . 1 1 15 15 GLU HG2 H . . . . . 4.0 1.8 6.5 . . . . . A . 12 ALA MB . . A . 15 GLU HG2 . . . 12 . HB+ . . . . . 15 . HG+ . . rr_1qbf 1 95 2 OR . 1 1 12 12 ALA MB H . . . 1 1 15 15 GLU HG3 H . . . . . 4.0 1.8 6.5 . . . . . A . 12 ALA MB . . A . 15 GLU HG3 . . . 12 . HB+ . . . . . 15 . HG+ . . rr_1qbf 1 96 1 OR . 1 1 12 12 ALA MB H . . . 1 1 16 16 GLU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 12 ALA MB . . A . 16 GLU HB2 . . . 12 . HB+ . . . . . 16 . HB+ . . rr_1qbf 1 96 2 OR . 1 1 12 12 ALA MB H . . . 1 1 16 16 GLU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 12 ALA MB . . A . 16 GLU HB3 . . . 12 . HB+ . . . . . 16 . HB+ . . rr_1qbf 1 97 1 OR . 1 1 12 12 ALA MB H . . . 1 1 17 17 LEU MD2 H . . . . . 4.0 1.8 8.4 . . . . . A . 12 ALA MB . . A . 17 LEU MD2 . . . 12 . HB+ . . . . . 17 . HD++ . . rr_1qbf 1 97 2 OR . 1 1 12 12 ALA MB H . . . 1 1 17 17 LEU MD1 H . . . . . 4.0 1.8 8.4 . . . . . A . 12 ALA MB . . A . 17 LEU MD1 . . . 12 . HB+ . . . . . 17 . HD++ . . rr_1qbf 1 98 1 . . 1 1 12 12 ALA H H . . . 1 1 13 13 SER H H . . . . . 2.5 1.8 2.7 . . . . . A . 12 ALA H . . A . 13 SER H . . . 12 . HN . . . . . 13 . HN . . rr_1qbf 1 99 1 . . 1 1 16 16 GLU H H . . . 1 1 12 12 ALA MB H . . . . . 4.0 1.8 6.0 . . . . . A . 16 GLU H . . A . 12 ALA MB . . . 16 . HN . . . . . 12 . HB+ . . rr_1qbf 1 100 1 OR . 1 1 13 13 SER H H . . . 1 1 13 13 SER HB2 H . . . . . 2.5 1.8 3.3 . . . . . A . 13 SER H . . A . 13 SER HB2 . . . 13 . HN . . . . . 13 . HB+ . . rr_1qbf 1 100 2 OR . 1 1 13 13 SER H H . . . 1 1 13 13 SER HB3 H . . . . . 2.5 1.8 3.3 . . . . . A . 13 SER H . . A . 13 SER HB3 . . . 13 . HN . . . . . 13 . HB+ . . rr_1qbf 1 101 1 OR . 1 1 14 14 PRO HA H . . . 1 1 13 13 SER HB2 H . . . . . 4.0 1.8 5.2 . . . . . A . 14 PRO HA . . A . 13 SER HB2 . . . 14 . HA . . . . . 13 . HB+ . . rr_1qbf 1 101 2 OR . 1 1 13 13 SER HB3 H . . . 1 1 14 14 PRO HA H . . . . . 4.0 1.8 5.2 . . . . . A . 13 SER HB3 . . A . 14 PRO HA . . . 13 . HB+ . . . . . 14 . HA . . rr_1qbf 1 102 1 . . 1 1 16 16 GLU H H . . . 1 1 13 13 SER H H . . . . . 2.5 1.8 2.7 . . . . . A . 16 GLU H . . A . 13 SER H . . . 16 . HN . . . . . 13 . HN . . rr_1qbf 1 103 1 OR . 1 1 13 13 SER H H . . . 1 1 16 16 GLU HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 13 SER H . . A . 16 GLU HB2 . . . 13 . HN . . . . . 16 . HB+ . . rr_1qbf 1 103 2 OR . 1 1 13 13 SER H H . . . 1 1 16 16 GLU HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 13 SER H . . A . 16 GLU HB3 . . . 13 . HN . . . . . 16 . HB+ . . rr_1qbf 1 104 1 OR . 1 1 13 13 SER H H . . . 1 1 16 16 GLU HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 13 SER H . . A . 16 GLU HG2 . . . 13 . HN . . . . . 16 . HG+ . . rr_1qbf 1 104 2 OR . 1 1 13 13 SER H H . . . 1 1 16 16 GLU HG3 H . . . . . 2.5 1.8 3.7 . . . . . A . 13 SER H . . A . 16 GLU HG3 . . . 13 . HN . . . . . 16 . HG+ . . rr_1qbf 1 105 1 . . 1 1 14 14 PRO HA H . . . 1 1 15 15 GLU H H . . . . . 3.0 1.8 3.5 . . . . . A . 14 PRO HA . . A . 15 GLU H . . . 14 . HA . . . . . 15 . HN . . rr_1qbf 1 106 1 . . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU H H . . . . . 2.5 1.8 2.7 . . . . . A . 15 GLU HA . . A . 15 GLU H . . . 15 . HA . . . . . 15 . HN . . rr_1qbf 1 107 1 OR . 1 1 15 15 GLU H H . . . 1 1 15 15 GLU HB2 H . . . . . 2.5 1.8 3.3 . . . . . A . 15 GLU H . . A . 15 GLU HB2 . . . 15 . HN . . . . . 15 . HB+ . . rr_1qbf 1 107 2 OR . 1 1 15 15 GLU HB3 H . . . 1 1 15 15 GLU H H . . . . . 2.5 1.8 3.3 . . . . . A . 15 GLU HB3 . . A . 15 GLU H . . . 15 . HB+ . . . . . 15 . HN . . rr_1qbf 1 108 1 OR . 1 1 15 15 GLU H H . . . 1 1 15 15 GLU HG2 H . . . . . 3.0 1.8 4.5 . . . . . A . 15 GLU H . . A . 15 GLU HG2 . . . 15 . HN . . . . . 15 . HG+ . . rr_1qbf 1 108 2 OR . 1 1 15 15 GLU HG3 H . . . 1 1 15 15 GLU H H . . . . . 3.0 1.8 4.5 . . . . . A . 15 GLU HG3 . . A . 15 GLU H . . . 15 . HG+ . . . . . 15 . HN . . rr_1qbf 1 109 1 OR . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 15 GLU HA . . A . 15 GLU HG2 . . . 15 . HA . . . . . 15 . HG+ . . rr_1qbf 1 109 2 OR . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU HG3 H . . . . . 2.5 1.8 3.7 . . . . . A . 15 GLU HA . . A . 15 GLU HG3 . . . 15 . HA . . . . . 15 . HG+ . . rr_1qbf 1 110 1 OR . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 15 GLU HA . . A . 15 GLU HB2 . . . 15 . HA . . . . . 15 . HB+ . . rr_1qbf 1 110 2 OR . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 15 GLU HA . . A . 15 GLU HB3 . . . 15 . HA . . . . . 15 . HB+ . . rr_1qbf 1 111 1 . . 1 1 15 15 GLU HA H . . . 1 1 16 16 GLU HA H . . . . . 4.0 1.8 5.0 . . . . . A . 15 GLU HA . . A . 16 GLU HA . . . 15 . HA . . . . . 16 . HA . . rr_1qbf 1 112 1 . . 1 1 16 16 GLU H H . . . 1 1 15 15 GLU H H . . . . . 2.5 1.8 2.7 . . . . . A . 16 GLU H . . A . 15 GLU H . . . 16 . HN . . . . . 15 . HN . . rr_1qbf 1 113 1 OR . 1 1 16 16 GLU H H . . . 1 1 15 15 GLU HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 16 GLU H . . A . 15 GLU HB2 . . . 16 . HN . . . . . 15 . HB+ . . rr_1qbf 1 113 2 OR . 1 1 16 16 GLU H H . . . 1 1 15 15 GLU HB3 H . . . . . 3.0 1.8 4.5 . . . . . A . 16 GLU H . . A . 15 GLU HB3 . . . 16 . HN . . . . . 15 . HB+ . . rr_1qbf 1 114 1 OR . 1 1 15 15 GLU HB3 H . . . 1 1 17 17 LEU MD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 GLU HB3 . . A . 17 LEU MD2 . . . 15 . HB+ . . . . . 17 . HD++ . . rr_1qbf 1 114 2 OR . 1 1 17 17 LEU MD1 H . . . 1 1 15 15 GLU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 17 LEU MD1 . . A . 15 GLU HB2 . . . 17 . HD++ . . . . . 15 . HB+ . . rr_1qbf 1 114 3 OR . 1 1 15 15 GLU HB3 H . . . 1 1 17 17 LEU MD1 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 GLU HB3 . . A . 17 LEU MD1 . . . 15 . HB+ . . . . . 17 . HD++ . . rr_1qbf 1 114 4 OR . 1 1 15 15 GLU HB2 H . . . 1 1 17 17 LEU MD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 GLU HB2 . . A . 17 LEU MD2 . . . 15 . HB+ . . . . . 17 . HD++ . . rr_1qbf 1 115 1 OR . 1 1 15 15 GLU HG3 H . . . 1 1 17 17 LEU MD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 GLU HG3 . . A . 17 LEU MD2 . . . 15 . HG+ . . . . . 17 . HD++ . . rr_1qbf 1 115 2 OR . 1 1 15 15 GLU HG2 H . . . 1 1 17 17 LEU MD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 GLU HG2 . . A . 17 LEU MD2 . . . 15 . HG+ . . . . . 17 . HD++ . . rr_1qbf 1 115 3 OR . 1 1 17 17 LEU MD1 H . . . 1 1 15 15 GLU HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 17 LEU MD1 . . A . 15 GLU HG2 . . . 17 . HD++ . . . . . 15 . HG+ . . rr_1qbf 1 115 4 OR . 1 1 15 15 GLU HG3 H . . . 1 1 17 17 LEU MD1 H . . . . . 4.0 1.8 6.0 . . . . . A . 15 GLU HG3 . . A . 17 LEU MD1 . . . 15 . HG+ . . . . . 17 . HD++ . . rr_1qbf 1 116 1 OR . 1 1 19 19 ARG H H . . . 1 1 15 15 GLU HG2 H . . . . . 4.0 1.8 6.5 . . . . . A . 19 ARG H . . A . 15 GLU HG2 . . . 19 . HN . . . . . 15 . HG+ . . rr_1qbf 1 116 2 OR . 1 1 15 15 GLU HG3 H . . . 1 1 19 19 ARG H H . . . . . 4.0 1.8 6.5 . . . . . A . 15 GLU HG3 . . A . 19 ARG H . . . 15 . HG+ . . . . . 19 . HN . . rr_1qbf 1 117 1 OR . 1 1 15 15 GLU HA H . . . 1 1 17 17 LEU MD2 H . . . . . 2.5 1.8 5.1 . . . . . A . 15 GLU HA . . A . 17 LEU MD2 . . . 15 . HA . . . . . 17 . HD++ . . rr_1qbf 1 117 2 OR . 1 1 15 15 GLU HA H . . . 1 1 17 17 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 15 GLU HA . . A . 17 LEU MD1 . . . 15 . HA . . . . . 17 . HD++ . . rr_1qbf 1 118 1 OR . 1 1 18 18 SER HA H . . . 1 1 15 15 GLU HG2 H . . . . . 3.0 1.8 4.5 . . . . . A . 18 SER HA . . A . 15 GLU HG2 . . . 18 . HA . . . . . 15 . HG+ . . rr_1qbf 1 118 2 OR . 1 1 15 15 GLU HG3 H . . . 1 1 18 18 SER HA H . . . . . 3.0 1.8 4.5 . . . . . A . 15 GLU HG3 . . A . 18 SER HA . . . 15 . HG+ . . . . . 18 . HA . . rr_1qbf 1 119 1 OR . 1 1 16 16 GLU HA H . . . 1 1 15 15 GLU HG2 H . . . . . 3.0 1.8 4.5 . . . . . A . 16 GLU HA . . A . 15 GLU HG2 . . . 16 . HA . . . . . 15 . HG+ . . rr_1qbf 1 119 2 OR . 1 1 15 15 GLU HG3 H . . . 1 1 16 16 GLU HA H . . . . . 3.0 1.8 4.5 . . . . . A . 15 GLU HG3 . . A . 16 GLU HA . . . 15 . HG+ . . . . . 16 . HA . . rr_1qbf 1 120 1 . . 1 1 16 16 GLU H H . . . 1 1 16 16 GLU HA H . . . . . 2.5 1.8 2.7 . . . . . A . 16 GLU H . . A . 16 GLU HA . . . 16 . HN . . . . . 16 . HA . . rr_1qbf 1 121 1 OR . 1 1 16 16 GLU H H . . . 1 1 16 16 GLU HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 16 GLU H . . A . 16 GLU HB2 . . . 16 . HN . . . . . 16 . HB+ . . rr_1qbf 1 121 2 OR . 1 1 16 16 GLU H H . . . 1 1 16 16 GLU HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 16 GLU H . . A . 16 GLU HB3 . . . 16 . HN . . . . . 16 . HB+ . . rr_1qbf 1 122 1 OR . 1 1 16 16 GLU H H . . . 1 1 16 16 GLU HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 16 GLU H . . A . 16 GLU HG2 . . . 16 . HN . . . . . 16 . HG+ . . rr_1qbf 1 122 2 OR . 1 1 16 16 GLU H H . . . 1 1 16 16 GLU HG3 H . . . . . 2.5 1.8 3.7 . . . . . A . 16 GLU H . . A . 16 GLU HG3 . . . 16 . HN . . . . . 16 . HG+ . . rr_1qbf 1 123 1 OR . 1 1 16 16 GLU HA H . . . 1 1 16 16 GLU HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 16 GLU HA . . A . 16 GLU HB2 . . . 16 . HA . . . . . 16 . HB+ . . rr_1qbf 1 123 2 OR . 1 1 16 16 GLU HB3 H . . . 1 1 16 16 GLU HA H . . . . . 2.5 1.8 3.7 . . . . . A . 16 GLU HB3 . . A . 16 GLU HA . . . 16 . HB+ . . . . . 16 . HA . . rr_1qbf 1 124 1 OR . 1 1 16 16 GLU HA H . . . 1 1 16 16 GLU HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 16 GLU HA . . A . 16 GLU HG2 . . . 16 . HA . . . . . 16 . HG+ . . rr_1qbf 1 124 2 OR . 1 1 16 16 GLU HG3 H . . . 1 1 16 16 GLU HA H . . . . . 2.5 1.8 3.7 . . . . . A . 16 GLU HG3 . . A . 16 GLU HA . . . 16 . HG+ . . . . . 16 . HA . . rr_1qbf 1 125 1 . . 1 1 17 17 LEU H H . . . 1 1 16 16 GLU H H . . . . . 3.0 1.8 3.5 . . . . . A . 17 LEU H . . A . 16 GLU H . . . 17 . HN . . . . . 16 . HN . . rr_1qbf 1 126 1 OR . 1 1 17 17 LEU H H . . . 1 1 16 16 GLU HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 17 LEU H . . A . 16 GLU HB2 . . . 17 . HN . . . . . 16 . HB+ . . rr_1qbf 1 126 2 OR . 1 1 17 17 LEU H H . . . 1 1 16 16 GLU HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 17 LEU H . . A . 16 GLU HB3 . . . 17 . HN . . . . . 16 . HB+ . . rr_1qbf 1 127 1 OR . 1 1 17 17 LEU H H . . . 1 1 16 16 GLU HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 17 LEU H . . A . 16 GLU HG2 . . . 17 . HN . . . . . 16 . HG+ . . rr_1qbf 1 127 2 OR . 1 1 17 17 LEU H H . . . 1 1 16 16 GLU HG3 H . . . . . 2.5 1.8 3.7 . . . . . A . 17 LEU H . . A . 16 GLU HG3 . . . 17 . HN . . . . . 16 . HG+ . . rr_1qbf 1 128 1 OR . 1 1 20 20 TYR H H . . . 1 1 16 16 GLU HB2 H . . . . . 4.0 1.8 6.4 . . . . . A . 20 TYR H . . A . 16 GLU HB2 . . . 20 . HN . . . . . 16 . HB+ . . rr_1qbf 1 128 2 OR . 1 1 16 16 GLU HG3 H . . . 1 1 20 20 TYR H H . . . . . 4.0 1.8 6.4 . . . . . A . 16 GLU HG3 . . A . 20 TYR H . . . 16 . HG+ . . . . . 20 . HN . . rr_1qbf 1 128 3 OR . 1 1 16 16 GLU HB3 H . . . 1 1 20 20 TYR H H . . . . . 4.0 1.8 6.4 . . . . . A . 16 GLU HB3 . . A . 20 TYR H . . . 16 . HB+ . . . . . 20 . HN . . rr_1qbf 1 128 4 OR . 1 1 20 20 TYR H H . . . 1 1 16 16 GLU HG2 H . . . . . 4.0 1.8 6.4 . . . . . A . 20 TYR H . . A . 16 GLU HG2 . . . 20 . HN . . . . . 16 . HG+ . . rr_1qbf 1 129 1 OR . 1 1 16 16 GLU H H . . . 1 1 17 17 LEU MD2 H . . . . . 4.0 3.3 7.4 . . . . . A . 16 GLU H . . A . 17 LEU MD2 . . . 16 . HN . . . . . 17 . HD++ . . rr_1qbf 1 129 2 OR . 1 1 16 16 GLU H H . . . 1 1 17 17 LEU MD1 H . . . . . 4.0 3.3 7.4 . . . . . A . 16 GLU H . . A . 17 LEU MD1 . . . 16 . HN . . . . . 17 . HD++ . . rr_1qbf 1 130 1 . . 1 1 17 17 LEU H H . . . 1 1 17 17 LEU HA H . . . . . 2.5 1.8 2.7 . . . . . A . 17 LEU H . . A . 17 LEU HA . . . 17 . HN . . . . . 17 . HA . . rr_1qbf 1 131 1 OR . 1 1 17 17 LEU H H . . . 1 1 17 17 LEU HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 17 LEU H . . A . 17 LEU HB2 . . . 17 . HN . . . . . 17 . HB+ . . rr_1qbf 1 131 2 OR . 1 1 17 17 LEU H H . . . 1 1 17 17 LEU HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 17 LEU H . . A . 17 LEU HB3 . . . 17 . HN . . . . . 17 . HB+ . . rr_1qbf 1 132 1 . . 1 1 17 17 LEU H H . . . 1 1 17 17 LEU HG H . . . . . 2.5 1.8 3.7 . . . . . A . 17 LEU H . . A . 17 LEU HG . . . 17 . HN . . . . . 17 . HG . . rr_1qbf 1 133 1 . . 1 1 17 17 LEU H H . . . 1 1 17 17 LEU MD1 H . . . . . 2.5 1.8 3.7 . . . . . A . 17 LEU H . . A . 17 LEU MD1 . . . 17 . HN . . . . . 17 . HD1+ . . rr_1qbf 1 134 1 . . 1 1 17 17 LEU H H . . . 1 1 17 17 LEU MD2 H . . . . . 2.5 1.8 3.7 . . . . . A . 17 LEU H . . A . 17 LEU MD2 . . . 17 . HN . . . . . 17 . HD2+ . . rr_1qbf 1 135 1 OR . 1 1 17 17 LEU HA H . . . 1 1 17 17 LEU MD2 H . . . . . 2.5 1.8 5.1 . . . . . A . 17 LEU HA . . A . 17 LEU MD2 . . . 17 . HA . . . . . 17 . HD++ . . rr_1qbf 1 135 2 OR . 1 1 17 17 LEU MD1 H . . . 1 1 17 17 LEU HA H . . . . . 2.5 1.8 5.1 . . . . . A . 17 LEU MD1 . . A . 17 LEU HA . . . 17 . HD++ . . . . . 17 . HA . . rr_1qbf 1 136 1 OR . 1 1 18 18 SER H H . . . 1 1 17 17 LEU MD2 H . . . . . 4.0 3.3 7.4 . . . . . A . 18 SER H . . A . 17 LEU MD2 . . . 18 . HN . . . . . 17 . HD++ . . rr_1qbf 1 136 2 OR . 1 1 17 17 LEU MD1 H . . . 1 1 18 18 SER H H . . . . . 4.0 3.3 7.4 . . . . . A . 17 LEU MD1 . . A . 18 SER H . . . 17 . HD++ . . . . . 18 . HN . . rr_1qbf 1 137 1 . . 1 1 17 17 LEU H H . . . 1 1 18 18 SER HA H . . . . . 4.0 1.8 5.5 . . . . . A . 17 LEU H . . A . 18 SER HA . . . 17 . HN . . . . . 18 . HA . . rr_1qbf 1 138 1 . . 1 1 17 17 LEU H H . . . 1 1 20 20 TYR H H . . . . . 4.0 1.8 5.0 . . . . . A . 17 LEU H . . A . 20 TYR H . . . 17 . HN . . . . . 20 . HN . . rr_1qbf 1 139 1 . . 1 1 17 17 LEU H H . . . 1 1 18 18 SER H H . . . . . 4.0 1.8 5.0 . . . . . A . 17 LEU H . . A . 18 SER H . . . 17 . HN . . . . . 18 . HN . . rr_1qbf 1 140 1 OR . 1 1 17 17 LEU H H . . . 1 1 20 20 TYR HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 17 LEU H . . A . 20 TYR HB2 . . . 17 . HN . . . . . 20 . HB+ . . rr_1qbf 1 140 2 OR . 1 1 17 17 LEU H H . . . 1 1 20 20 TYR HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 17 LEU H . . A . 20 TYR HB3 . . . 17 . HN . . . . . 20 . HB+ . . rr_1qbf 1 141 1 OR . 1 1 18 18 SER HA H . . . 1 1 17 17 LEU MD2 H . . . . . 3.0 1.8 5.9 . . . . . A . 18 SER HA . . A . 17 LEU MD2 . . . 18 . HA . . . . . 17 . HD++ . . rr_1qbf 1 141 2 OR . 1 1 17 17 LEU MD1 H . . . 1 1 18 18 SER HA H . . . . . 3.0 1.8 5.9 . . . . . A . 17 LEU MD1 . . A . 18 SER HA . . . 17 . HD++ . . . . . 18 . HA . . rr_1qbf 1 142 1 . . 1 1 17 17 LEU O O . . . 1 1 21 21 TYR H H . . . . . 3.0 1.8 3.5 . . . . . A . 17 LEU O . . A . 21 TYR H . . . 17 . O . . . . . 21 . HN . . rr_1qbf 1 143 1 . . 1 1 18 18 SER HA H . . . 1 1 18 18 SER H H . . . . . 2.5 1.8 2.7 . . . . . A . 18 SER HA . . A . 18 SER H . . . 18 . HA . . . . . 18 . HN . . rr_1qbf 1 144 1 OR . 1 1 18 18 SER H H . . . 1 1 18 18 SER HB2 H . . . . . 2.5 1.8 3.3 . . . . . A . 18 SER H . . A . 18 SER HB2 . . . 18 . HN . . . . . 18 . HB+ . . rr_1qbf 1 144 2 OR . 1 1 18 18 SER H H . . . 1 1 18 18 SER HB3 H . . . . . 2.5 1.8 3.3 . . . . . A . 18 SER H . . A . 18 SER HB3 . . . 18 . HN . . . . . 18 . HB+ . . rr_1qbf 1 145 1 OR . 1 1 18 18 SER HA H . . . 1 1 18 18 SER HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 18 SER HA . . A . 18 SER HB2 . . . 18 . HA . . . . . 18 . HB+ . . rr_1qbf 1 145 2 OR . 1 1 18 18 SER HA H . . . 1 1 18 18 SER HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 18 SER HA . . A . 18 SER HB3 . . . 18 . HA . . . . . 18 . HB+ . . rr_1qbf 1 146 1 . . 1 1 19 19 ARG H H . . . 1 1 18 18 SER H H . . . . . 2.5 1.8 2.7 . . . . . A . 19 ARG H . . A . 18 SER H . . . 19 . HN . . . . . 18 . HN . . rr_1qbf 1 147 1 . . 1 1 19 19 ARG H H . . . 1 1 18 18 SER HA H . . . . . 4.0 1.8 5.0 . . . . . A . 19 ARG H . . A . 18 SER HA . . . 19 . HN . . . . . 18 . HA . . rr_1qbf 1 148 1 OR . 1 1 18 18 SER HB3 H . . . 1 1 19 19 ARG HD3 H . . . . . 2.5 1.8 4.7 . . . . . A . 18 SER HB3 . . A . 19 ARG HD3 . . . 18 . HB+ . . . . . 19 . HD+ . . rr_1qbf 1 148 2 OR . 1 1 18 18 SER HB2 H . . . 1 1 19 19 ARG HD3 H . . . . . 2.5 1.8 4.7 . . . . . A . 18 SER HB2 . . A . 19 ARG HD3 . . . 18 . HB+ . . . . . 19 . HD+ . . rr_1qbf 1 148 3 OR . 1 1 19 19 ARG HD2 H . . . 1 1 18 18 SER HB2 H . . . . . 2.5 1.8 4.7 . . . . . A . 19 ARG HD2 . . A . 18 SER HB2 . . . 19 . HD+ . . . . . 18 . HB+ . . rr_1qbf 1 148 4 OR . 1 1 18 18 SER HB3 H . . . 1 1 19 19 ARG HD2 H . . . . . 2.5 1.8 4.7 . . . . . A . 18 SER HB3 . . A . 19 ARG HD2 . . . 18 . HB+ . . . . . 19 . HD+ . . rr_1qbf 1 149 1 OR . 1 1 19 19 ARG H H . . . 1 1 18 18 SER HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 19 ARG H . . A . 18 SER HB2 . . . 19 . HN . . . . . 18 . HB+ . . rr_1qbf 1 149 2 OR . 1 1 19 19 ARG H H . . . 1 1 18 18 SER HB3 H . . . . . 3.0 1.8 4.5 . . . . . A . 19 ARG H . . A . 18 SER HB3 . . . 19 . HN . . . . . 18 . HB+ . . rr_1qbf 1 150 1 . . 1 1 18 18 SER HA H . . . 1 1 19 19 ARG HA H . . . . . 4.0 1.8 5.0 . . . . . A . 18 SER HA . . A . 19 ARG HA . . . 18 . HA . . . . . 19 . HA . . rr_1qbf 1 151 1 . . 1 1 20 20 TYR H H . . . 1 1 18 18 SER H H . . . . . 4.0 1.8 5.0 . . . . . A . 20 TYR H . . A . 18 SER H . . . 20 . HN . . . . . 18 . HN . . rr_1qbf 1 152 1 . . 1 1 18 18 SER HA H . . . 1 1 21 21 TYR CG C . . . . . 3.0 1.8 5.5 . . . . . A . 18 SER HA . . A . 21 TYR CG . . . 18 . HA . . . . . 21 . CG . . rr_1qbf 1 153 1 . . 1 1 18 18 SER HA H . . . 1 1 21 21 TYR HB3 H . . . . . 4.0 1.8 5.5 . . . . . A . 18 SER HA . . A . 21 TYR HB3 . . . 18 . HA . . . . . 21 . HB1 . . rr_1qbf 1 154 1 . . 1 1 18 18 SER HA H . . . 1 1 21 21 TYR HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 18 SER HA . . A . 21 TYR HB2 . . . 18 . HA . . . . . 21 . HB2 . . rr_1qbf 1 155 1 . . 1 1 20 20 TYR CG C . . . 1 1 18 18 SER H H . . . . . 4.0 1.8 7.0 . . . . . A . 20 TYR CG . . A . 18 SER H . . . 20 . CG . . . . . 18 . HN . . rr_1qbf 1 156 1 . . 1 1 18 18 SER H H . . . 1 1 21 21 TYR CG C . . . . . 4.0 1.8 7.0 . . . . . A . 18 SER H . . A . 21 TYR CG . . . 18 . HN . . . . . 21 . CG . . rr_1qbf 1 157 1 OR . 1 1 18 18 SER HA H . . . 1 1 19 19 ARG HG2 H . . . . . 4.0 1.8 6.4 . . . . . A . 18 SER HA . . A . 19 ARG HG2 . . . 18 . HA . . . . . 19 . HG+ . . rr_1qbf 1 157 2 OR . 1 1 18 18 SER HA H . . . 1 1 19 19 ARG HB2 H . . . . . 4.0 1.8 6.4 . . . . . A . 18 SER HA . . A . 19 ARG HB2 . . . 18 . HA . . . . . 19 . HB+ . . rr_1qbf 1 157 3 OR . 1 1 18 18 SER HA H . . . 1 1 19 19 ARG HG3 H . . . . . 4.0 1.8 6.4 . . . . . A . 18 SER HA . . A . 19 ARG HG3 . . . 18 . HA . . . . . 19 . HG+ . . rr_1qbf 1 157 4 OR . 1 1 18 18 SER HA H . . . 1 1 19 19 ARG HB3 H . . . . . 4.0 1.8 6.4 . . . . . A . 18 SER HA . . A . 19 ARG HB3 . . . 18 . HA . . . . . 19 . HB+ . . rr_1qbf 1 158 1 . . 1 1 18 18 SER O O . . . 1 1 22 22 ALA H H . . . . . 3.0 1.8 3.5 . . . . . A . 18 SER O . . A . 22 ALA H . . . 18 . O . . . . . 22 . HN . . rr_1qbf 1 159 1 OR . 1 1 19 19 ARG H H . . . 1 1 19 19 ARG HB2 H . . . . . 2.5 1.8 3.3 . . . . . A . 19 ARG H . . A . 19 ARG HB2 . . . 19 . HN . . . . . 19 . HB+ . . rr_1qbf 1 159 2 OR . 1 1 19 19 ARG H H . . . 1 1 19 19 ARG HB3 H . . . . . 2.5 1.8 3.3 . . . . . A . 19 ARG H . . A . 19 ARG HB3 . . . 19 . HN . . . . . 19 . HB+ . . rr_1qbf 1 160 1 OR . 1 1 19 19 ARG H H . . . 1 1 19 19 ARG HD3 H . . . . . 4.0 1.8 6.0 . . . . . A . 19 ARG H . . A . 19 ARG HD3 . . . 19 . HN . . . . . 19 . HD+ . . rr_1qbf 1 160 2 OR . 1 1 19 19 ARG H H . . . 1 1 19 19 ARG HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 19 ARG H . . A . 19 ARG HD2 . . . 19 . HN . . . . . 19 . HD+ . . rr_1qbf 1 161 1 . . 1 1 19 19 ARG HE H . . . 1 1 19 19 ARG HD3 H . . . . . 2.5 1.8 2.8 . . . . . A . 19 ARG HE . . A . 19 ARG HD3 . . . 19 . HE . . . . . 19 . HD1 . . rr_1qbf 1 162 1 . . 1 1 19 19 ARG HD2 H . . . 1 1 19 19 ARG HE H . . . . . 2.5 1.8 2.8 . . . . . A . 19 ARG HD2 . . A . 19 ARG HE . . . 19 . HD2 . . . . . 19 . HE . . rr_1qbf 1 163 1 OR . 1 1 19 19 ARG HE H . . . 1 1 19 19 ARG HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 19 ARG HE . . A . 19 ARG HB2 . . . 19 . HE . . . . . 19 . HB+ . . rr_1qbf 1 163 2 OR . 1 1 19 19 ARG HB3 H . . . 1 1 19 19 ARG HE H . . . . . 2.5 1.8 3.7 . . . . . A . 19 ARG HB3 . . A . 19 ARG HE . . . 19 . HB+ . . . . . 19 . HE . . rr_1qbf 1 164 1 OR . 1 1 19 19 ARG HE H . . . 1 1 19 19 ARG HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 19 ARG HE . . A . 19 ARG HG2 . . . 19 . HE . . . . . 19 . HG+ . . rr_1qbf 1 164 2 OR . 1 1 19 19 ARG HG3 H . . . 1 1 19 19 ARG HE H . . . . . 2.5 1.8 3.7 . . . . . A . 19 ARG HG3 . . A . 19 ARG HE . . . 19 . HG+ . . . . . 19 . HE . . rr_1qbf 1 165 1 OR . 1 1 19 19 ARG HA H . . . 1 1 20 20 TYR HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 19 ARG HA . . A . 20 TYR HB2 . . . 19 . HA . . . . . 20 . HB+ . . rr_1qbf 1 165 2 OR . 1 1 20 20 TYR HB3 H . . . 1 1 19 19 ARG HA H . . . . . 4.0 1.8 6.0 . . . . . A . 20 TYR HB3 . . A . 19 ARG HA . . . 20 . HB+ . . . . . 19 . HA . . rr_1qbf 1 166 1 . . 1 1 19 19 ARG H H . . . 1 1 22 22 ALA H H . . . . . 4.0 1.8 6.5 . . . . . A . 19 ARG H . . A . 22 ALA H . . . 19 . HN . . . . . 22 . HN . . rr_1qbf 1 167 1 . . 1 1 19 19 ARG O O . . . 1 1 23 23 SER H H . . . . . 3.0 1.8 5.5 . . . . . A . 19 ARG O . . A . 23 SER H . . . 19 . O . . . . . 23 . HN . . rr_1qbf 1 168 1 . . 1 1 20 20 TYR H H . . . 1 1 20 20 TYR HA H . . . . . 2.5 1.8 2.7 . . . . . A . 20 TYR H . . A . 20 TYR HA . . . 20 . HN . . . . . 20 . HA . . rr_1qbf 1 169 1 OR . 1 1 20 20 TYR H H . . . 1 1 20 20 TYR HB2 H . . . . . 2.5 1.8 3.3 . . . . . A . 20 TYR H . . A . 20 TYR HB2 . . . 20 . HN . . . . . 20 . HB+ . . rr_1qbf 1 169 2 OR . 1 1 20 20 TYR H H . . . 1 1 20 20 TYR HB3 H . . . . . 2.5 1.8 3.3 . . . . . A . 20 TYR H . . A . 20 TYR HB3 . . . 20 . HN . . . . . 20 . HB+ . . rr_1qbf 1 170 1 . . 1 1 20 20 TYR HA H . . . 1 1 20 20 TYR QD H . . . . . 2.5 1.8 3.7 . . . . . A . 20 TYR HA . . A . 20 TYR QD . . . 20 . HA . . . . . 20 . HD+ . . rr_1qbf 1 171 1 . . 1 1 20 20 TYR CG C . . . 1 1 20 20 TYR H H . . . . . 3.0 1.8 5.5 . . . . . A . 20 TYR CG . . A . 20 TYR H . . . 20 . CG . . . . . 20 . HN . . rr_1qbf 1 172 1 OR . 1 1 20 20 TYR CG C . . . 1 1 20 20 TYR HB2 H . . . . . 2.5 1.8 5.7 . . . . . A . 20 TYR CG . . A . 20 TYR HB2 . . . 20 . CG . . . . . 20 . HB+ . . rr_1qbf 1 172 2 OR . 1 1 20 20 TYR CG C . . . 1 1 20 20 TYR HB3 H . . . . . 2.5 1.8 5.7 . . . . . A . 20 TYR CG . . A . 20 TYR HB3 . . . 20 . CG . . . . . 20 . HB+ . . rr_1qbf 1 173 1 OR . 1 1 21 21 TYR HA H . . . 1 1 20 20 TYR HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 21 TYR HA . . A . 20 TYR HB2 . . . 21 . HA . . . . . 20 . HB+ . . rr_1qbf 1 173 2 OR . 1 1 20 20 TYR HB3 H . . . 1 1 21 21 TYR HA H . . . . . 4.0 1.8 6.0 . . . . . A . 20 TYR HB3 . . A . 21 TYR HA . . . 20 . HB+ . . . . . 21 . HA . . rr_1qbf 1 174 1 OR . 1 1 21 21 TYR H H . . . 1 1 20 20 TYR HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 21 TYR H . . A . 20 TYR HB2 . . . 21 . HN . . . . . 20 . HB+ . . rr_1qbf 1 174 2 OR . 1 1 20 20 TYR HB3 H . . . 1 1 21 21 TYR H H . . . . . 3.0 1.8 4.5 . . . . . A . 20 TYR HB3 . . A . 21 TYR H . . . 20 . HB+ . . . . . 21 . HN . . rr_1qbf 1 175 1 . . 1 1 20 20 TYR H H . . . 1 1 21 21 TYR H H . . . . . 2.5 1.8 2.7 . . . . . A . 20 TYR H . . A . 21 TYR H . . . 20 . HN . . . . . 21 . HN . . rr_1qbf 1 176 1 . . 1 1 20 20 TYR H H . . . 1 1 21 21 TYR HA H . . . . . 4.0 1.8 5.0 . . . . . A . 20 TYR H . . A . 21 TYR HA . . . 20 . HN . . . . . 21 . HA . . rr_1qbf 1 177 1 . . 1 1 20 20 TYR CG C . . . 1 1 21 21 TYR HA H . . . . . 3.0 1.8 5.5 . . . . . A . 20 TYR CG . . A . 21 TYR HA . . . 20 . CG . . . . . 21 . HA . . rr_1qbf 1 178 1 . . 1 1 20 20 TYR CZ C . . . 1 1 21 21 TYR HA H . . . . . 4.0 1.8 7.0 . . . . . A . 20 TYR CZ . . A . 21 TYR HA . . . 20 . CZ . . . . . 21 . HA . . rr_1qbf 1 179 1 . . 1 1 20 20 TYR CG C . . . 1 1 21 21 TYR H H . . . . . 2.5 1.8 4.7 . . . . . A . 20 TYR CG . . A . 21 TYR H . . . 20 . CG . . . . . 21 . HN . . rr_1qbf 1 180 1 . . 1 1 20 20 TYR H H . . . 1 1 21 21 TYR CG C . . . . . 4.0 1.8 7.0 . . . . . A . 20 TYR H . . A . 21 TYR CG . . . 20 . HN . . . . . 21 . CG . . rr_1qbf 1 181 1 . . 1 1 20 20 TYR CZ C . . . 1 1 21 21 TYR CZ C . . . . . 4.0 1.8 10.0 . . . . . A . 20 TYR CZ . . A . 21 TYR CZ . . . 20 . CZ . . . . . 21 . CZ . . rr_1qbf 1 182 1 . . 1 1 20 20 TYR CZ C . . . 1 1 21 21 TYR CG C . . . . . 4.0 1.8 9.0 . . . . . A . 20 TYR CZ . . A . 21 TYR CG . . . 20 . CZ . . . . . 21 . CG . . rr_1qbf 1 183 1 OR . 1 1 22 22 ALA H H . . . 1 1 20 20 TYR HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 22 ALA H . . A . 20 TYR HB2 . . . 22 . HN . . . . . 20 . HB+ . . rr_1qbf 1 183 2 OR . 1 1 20 20 TYR HB3 H . . . 1 1 22 22 ALA H H . . . . . 4.0 1.8 6.0 . . . . . A . 20 TYR HB3 . . A . 22 ALA H . . . 20 . HB+ . . . . . 22 . HN . . rr_1qbf 1 184 1 OR . 1 1 21 21 TYR CZ C . . . 1 1 20 20 TYR HB2 H . . . . . 4.0 1.8 8.0 . . . . . A . 21 TYR CZ . . A . 20 TYR HB2 . . . 21 . CZ . . . . . 20 . HB+ . . rr_1qbf 1 184 2 OR . 1 1 20 20 TYR HB3 H . . . 1 1 21 21 TYR CZ C . . . . . 4.0 1.8 8.0 . . . . . A . 20 TYR HB3 . . A . 21 TYR CZ . . . 20 . HB+ . . . . . 21 . CZ . . rr_1qbf 1 185 1 . . 1 1 20 20 TYR HA H . . . 1 1 21 21 TYR CZ C . . . . . 4.0 1.8 7.5 . . . . . A . 20 TYR HA . . A . 21 TYR CZ . . . 20 . HA . . . . . 21 . CZ . . rr_1qbf 1 186 1 OR . 1 1 20 20 TYR CZ C . . . 1 1 21 21 TYR HB3 H . . . . . 4.0 1.8 8.0 . . . . . A . 20 TYR CZ . . A . 21 TYR HB3 . . . 20 . CZ . . . . . 21 . HB+ . . rr_1qbf 1 186 2 OR . 1 1 20 20 TYR CZ C . . . 1 1 21 21 TYR HB2 H . . . . . 4.0 1.8 8.0 . . . . . A . 20 TYR CZ . . A . 21 TYR HB2 . . . 20 . CZ . . . . . 21 . HB+ . . rr_1qbf 1 187 1 OR . 1 1 20 20 TYR CZ C . . . 1 1 23 23 SER HB2 H . . . . . 4.0 1.8 8.0 . . . . . A . 20 TYR CZ . . A . 23 SER HB2 . . . 20 . CZ . . . . . 23 . HB+ . . rr_1qbf 1 187 2 OR . 1 1 20 20 TYR CZ C . . . 1 1 23 23 SER HB3 H . . . . . 4.0 1.8 8.0 . . . . . A . 20 TYR CZ . . A . 23 SER HB3 . . . 20 . CZ . . . . . 23 . HB+ . . rr_1qbf 1 188 1 OR . 1 1 20 20 TYR H H . . . 1 1 24 24 LEU MD1 H . . . . . 4.0 1.8 7.9 . . . . . A . 20 TYR H . . A . 24 LEU MD1 . . . 20 . HN . . . . . 24 . HD++ . . rr_1qbf 1 188 2 OR . 1 1 20 20 TYR H H . . . 1 1 24 24 LEU MD2 H . . . . . 4.0 1.8 7.9 . . . . . A . 20 TYR H . . A . 24 LEU MD2 . . . 20 . HN . . . . . 24 . HD++ . . rr_1qbf 1 189 1 . . 1 1 20 20 TYR CZ C . . . 1 1 24 24 LEU HG H . . . . . 4.0 1.8 7.0 . . . . . A . 20 TYR CZ . . A . 24 LEU HG . . . 20 . CZ . . . . . 24 . HG . . rr_1qbf 1 190 1 . . 1 1 24 24 LEU H H . . . 1 1 20 20 TYR O O . . . . . 3.0 1.8 3.5 . . . . . A . 24 LEU H . . A . 20 TYR O . . . 24 . HN . . . . . 20 . O . . rr_1qbf 1 191 1 . . 1 1 21 21 TYR H H . . . 1 1 21 21 TYR HA H . . . . . 2.5 1.8 2.7 . . . . . A . 21 TYR H . . A . 21 TYR HA . . . 21 . HN . . . . . 21 . HA . . rr_1qbf 1 192 1 OR . 1 1 21 21 TYR H H . . . 1 1 21 21 TYR HB3 H . . . . . 2.5 1.8 3.3 . . . . . A . 21 TYR H . . A . 21 TYR HB3 . . . 21 . HN . . . . . 21 . HB+ . . rr_1qbf 1 192 2 OR . 1 1 21 21 TYR H H . . . 1 1 21 21 TYR HB2 H . . . . . 2.5 1.8 3.3 . . . . . A . 21 TYR H . . A . 21 TYR HB2 . . . 21 . HN . . . . . 21 . HB+ . . rr_1qbf 1 193 1 OR . 1 1 21 21 TYR HA H . . . 1 1 21 21 TYR HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 21 TYR HA . . A . 21 TYR HB3 . . . 21 . HA . . . . . 21 . HB+ . . rr_1qbf 1 193 2 OR . 1 1 21 21 TYR HA H . . . 1 1 21 21 TYR HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 21 TYR HA . . A . 21 TYR HB2 . . . 21 . HA . . . . . 21 . HB+ . . rr_1qbf 1 194 1 . . 1 1 21 21 TYR H H . . . 1 1 21 21 TYR CG C . . . . . 3.0 1.8 5.5 . . . . . A . 21 TYR H . . A . 21 TYR CG . . . 21 . HN . . . . . 21 . CG . . rr_1qbf 1 195 1 OR . 1 1 21 21 TYR CG C . . . 1 1 21 21 TYR HB3 H . . . . . 2.5 1.8 5.7 . . . . . A . 21 TYR CG . . A . 21 TYR HB3 . . . 21 . CG . . . . . 21 . HB+ . . rr_1qbf 1 195 2 OR . 1 1 21 21 TYR CG C . . . 1 1 21 21 TYR HB2 H . . . . . 2.5 1.8 5.7 . . . . . A . 21 TYR CG . . A . 21 TYR HB2 . . . 21 . CG . . . . . 21 . HB+ . . rr_1qbf 1 196 1 . . 1 1 21 21 TYR CG C . . . 1 1 21 21 TYR HA H . . . . . 2.5 1.8 4.7 . . . . . A . 21 TYR CG . . A . 21 TYR HA . . . 21 . CG . . . . . 21 . HA . . rr_1qbf 1 197 1 OR . 1 1 21 21 TYR CZ C . . . 1 1 21 21 TYR HB3 H . . . . . 3.0 1.8 6.5 . . . . . A . 21 TYR CZ . . A . 21 TYR HB3 . . . 21 . CZ . . . . . 21 . HB+ . . rr_1qbf 1 197 2 OR . 1 1 21 21 TYR CZ C . . . 1 1 21 21 TYR HB2 H . . . . . 3.0 1.8 6.5 . . . . . A . 21 TYR CZ . . A . 21 TYR HB2 . . . 21 . CZ . . . . . 21 . HB+ . . rr_1qbf 1 198 1 . . 1 1 21 21 TYR HA H . . . 1 1 21 21 TYR CZ C . . . . . 4.0 1.8 7.0 . . . . . A . 21 TYR HA . . A . 21 TYR CZ . . . 21 . HA . . . . . 21 . CZ . . rr_1qbf 1 199 1 . . 1 1 21 21 TYR H H . . . 1 1 22 22 ALA H H . . . . . 3.0 1.8 3.5 . . . . . A . 21 TYR H . . A . 22 ALA H . . . 21 . HN . . . . . 22 . HN . . rr_1qbf 1 200 1 . . 1 1 22 22 ALA H H . . . 1 1 21 21 TYR HA H . . . . . 3.0 1.8 3.5 . . . . . A . 22 ALA H . . A . 21 TYR HA . . . 22 . HN . . . . . 21 . HA . . rr_1qbf 1 201 1 OR . 1 1 22 22 ALA H H . . . 1 1 21 21 TYR HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 22 ALA H . . A . 21 TYR HB3 . . . 22 . HN . . . . . 21 . HB+ . . rr_1qbf 1 201 2 OR . 1 1 22 22 ALA H H . . . 1 1 21 21 TYR HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 22 ALA H . . A . 21 TYR HB2 . . . 22 . HN . . . . . 21 . HB+ . . rr_1qbf 1 202 1 . . 1 1 21 21 TYR H H . . . 1 1 23 23 SER H H . . . . . 4.0 1.8 5.0 . . . . . A . 21 TYR H . . A . 23 SER H . . . 21 . HN . . . . . 23 . HN . . rr_1qbf 1 203 1 OR . 1 1 23 23 SER H H . . . 1 1 21 21 TYR HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 23 SER H . . A . 21 TYR HB3 . . . 23 . HN . . . . . 21 . HB+ . . rr_1qbf 1 203 2 OR . 1 1 23 23 SER H H . . . 1 1 21 21 TYR HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 23 SER H . . A . 21 TYR HB2 . . . 23 . HN . . . . . 21 . HB+ . . rr_1qbf 1 204 1 . . 1 1 21 21 TYR CG C . . . 1 1 22 22 ALA H H . . . . . 3.0 1.8 5.5 . . . . . A . 21 TYR CG . . A . 22 ALA H . . . 21 . CG . . . . . 22 . HN . . rr_1qbf 1 205 1 OR . 1 1 21 21 TYR CZ C . . . 1 1 25 25 ARG HD2 H . . . . . 3.0 1.8 6.5 . . . . . A . 21 TYR CZ . . A . 25 ARG HD2 . . . 21 . CZ . . . . . 25 . HD+ . . rr_1qbf 1 205 2 OR . 1 1 21 21 TYR CZ C . . . 1 1 25 25 ARG HD3 H . . . . . 3.0 1.8 6.5 . . . . . A . 21 TYR CZ . . A . 25 ARG HD3 . . . 21 . CZ . . . . . 25 . HD+ . . rr_1qbf 1 206 1 . . 1 1 21 21 TYR CG C . . . 1 1 24 24 LEU HG H . . . . . 4.0 1.8 7.0 . . . . . A . 21 TYR CG . . A . 24 LEU HG . . . 21 . CG . . . . . 24 . HG . . rr_1qbf 1 207 1 . . 1 1 21 21 TYR CG C . . . 1 1 22 22 ALA MB H . . . . . 4.0 1.8 8.0 . . . . . A . 21 TYR CG . . A . 22 ALA MB . . . 21 . CG . . . . . 22 . HB+ . . rr_1qbf 1 208 1 OR . 1 1 21 21 TYR CG C . . . 1 1 24 24 LEU HB2 H . . . . . 4.0 1.8 8.5 . . . . . A . 21 TYR CG . . A . 24 LEU HB2 . . . 21 . CG . . . . . 24 . HB+ . . rr_1qbf 1 208 2 OR . 1 1 21 21 TYR CG C . . . 1 1 24 24 LEU HB3 H . . . . . 4.0 1.8 8.5 . . . . . A . 21 TYR CG . . A . 24 LEU HB3 . . . 21 . CG . . . . . 24 . HB+ . . rr_1qbf 1 209 1 . . 1 1 21 21 TYR CZ C . . . 1 1 22 22 ALA MB H . . . . . 4.0 1.8 8.5 . . . . . A . 21 TYR CZ . . A . 22 ALA MB . . . 21 . CZ . . . . . 22 . HB+ . . rr_1qbf 1 210 1 . . 1 1 21 21 TYR O O . . . 1 1 25 25 ARG H H . . . . . 3.0 1.8 3.5 . . . . . A . 21 TYR O . . A . 25 ARG H . . . 21 . O . . . . . 25 . HN . . rr_1qbf 1 211 1 . . 1 1 22 22 ALA H H . . . 1 1 22 22 ALA HA H . . . . . 2.5 1.8 2.7 . . . . . A . 22 ALA H . . A . 22 ALA HA . . . 22 . HN . . . . . 22 . HA . . rr_1qbf 1 212 1 . . 1 1 22 22 ALA MB H . . . 1 1 22 22 ALA HA H . . . . . 2.5 1.8 3.7 . . . . . A . 22 ALA MB . . A . 22 ALA HA . . . 22 . HB+ . . . . . 22 . HA . . rr_1qbf 1 213 1 . . 1 1 22 22 ALA H H . . . 1 1 22 22 ALA MB H . . . . . 2.5 1.8 3.3 . . . . . A . 22 ALA H . . A . 22 ALA MB . . . 22 . HN . . . . . 22 . HB+ . . rr_1qbf 1 214 1 . . 1 1 23 23 SER H H . . . 1 1 22 22 ALA MB H . . . . . 3.0 1.8 4.5 . . . . . A . 23 SER H . . A . 22 ALA MB . . . 23 . HN . . . . . 22 . HB+ . . rr_1qbf 1 215 1 . . 1 1 22 22 ALA H H . . . 1 1 23 23 SER H H . . . . . 2.5 1.8 2.7 . . . . . A . 22 ALA H . . A . 23 SER H . . . 22 . HN . . . . . 23 . HN . . rr_1qbf 1 216 1 . . 1 1 22 22 ALA MB H . . . 1 1 25 25 ARG H H . . . . . 4.0 1.8 6.0 . . . . . A . 22 ALA MB . . A . 25 ARG H . . . 22 . HB+ . . . . . 25 . HN . . rr_1qbf 1 217 1 . . 1 1 23 23 SER H H . . . 1 1 23 23 SER HA H . . . . . 2.5 1.8 2.7 . . . . . A . 23 SER H . . A . 23 SER HA . . . 23 . HN . . . . . 23 . HA . . rr_1qbf 1 218 1 OR . 1 1 23 23 SER H H . . . 1 1 23 23 SER HB2 H . . . . . 2.5 1.8 3.3 . . . . . A . 23 SER H . . A . 23 SER HB2 . . . 23 . HN . . . . . 23 . HB+ . . rr_1qbf 1 218 2 OR . 1 1 23 23 SER H H . . . 1 1 23 23 SER HB3 H . . . . . 2.5 1.8 3.3 . . . . . A . 23 SER H . . A . 23 SER HB3 . . . 23 . HN . . . . . 23 . HB+ . . rr_1qbf 1 219 1 OR . 1 1 23 23 SER HA H . . . 1 1 23 23 SER HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 23 SER HA . . A . 23 SER HB2 . . . 23 . HA . . . . . 23 . HB+ . . rr_1qbf 1 219 2 OR . 1 1 23 23 SER HB3 H . . . 1 1 23 23 SER HA H . . . . . 2.5 1.8 3.7 . . . . . A . 23 SER HB3 . . A . 23 SER HA . . . 23 . HB+ . . . . . 23 . HA . . rr_1qbf 1 220 1 . . 1 1 24 24 LEU H H . . . 1 1 23 23 SER HA H . . . . . 3.0 1.8 3.5 . . . . . A . 24 LEU H . . A . 23 SER HA . . . 24 . HN . . . . . 23 . HA . . rr_1qbf 1 221 1 OR . 1 1 24 24 LEU H H . . . 1 1 23 23 SER HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 24 LEU H . . A . 23 SER HB2 . . . 24 . HN . . . . . 23 . HB+ . . rr_1qbf 1 221 2 OR . 1 1 24 24 LEU H H . . . 1 1 23 23 SER HB3 H . . . . . 3.0 1.8 4.5 . . . . . A . 24 LEU H . . A . 23 SER HB3 . . . 24 . HN . . . . . 23 . HB+ . . rr_1qbf 1 222 1 OR . 1 1 23 23 SER H H . . . 1 1 25 25 ARG HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 23 SER H . . A . 25 ARG HD2 . . . 23 . HN . . . . . 25 . HD+ . . rr_1qbf 1 222 2 OR . 1 1 23 23 SER H H . . . 1 1 25 25 ARG HD3 H . . . . . 4.0 1.8 6.0 . . . . . A . 23 SER H . . A . 25 ARG HD3 . . . 23 . HN . . . . . 25 . HD+ . . rr_1qbf 1 223 1 OR . 1 1 23 23 SER H H . . . 1 1 24 24 LEU MD1 H . . . . . 3.0 1.8 5.9 . . . . . A . 23 SER H . . A . 24 LEU MD1 . . . 23 . HN . . . . . 24 . HD++ . . rr_1qbf 1 223 2 OR . 1 1 23 23 SER H H . . . 1 1 24 24 LEU MD2 H . . . . . 3.0 1.8 5.9 . . . . . A . 23 SER H . . A . 24 LEU MD2 . . . 23 . HN . . . . . 24 . HD++ . . rr_1qbf 1 224 1 OR . 1 1 23 23 SER HA H . . . 1 1 24 24 LEU MD1 H . . . . . 4.0 1.8 6.9 . . . . . A . 23 SER HA . . A . 24 LEU MD1 . . . 23 . HA . . . . . 24 . HD++ . . rr_1qbf 1 224 2 OR . 1 1 24 24 LEU MD2 H . . . 1 1 23 23 SER HA H . . . . . 4.0 1.8 6.9 . . . . . A . 24 LEU MD2 . . A . 23 SER HA . . . 24 . HD++ . . . . . 23 . HA . . rr_1qbf 1 225 1 . . 1 1 24 24 LEU H H . . . 1 1 24 24 LEU HA H . . . . . 3.0 1.8 3.5 . . . . . A . 24 LEU H . . A . 24 LEU HA . . . 24 . HN . . . . . 24 . HA . . rr_1qbf 1 226 1 OR . 1 1 24 24 LEU H H . . . 1 1 24 24 LEU HB2 H . . . . . 2.5 1.8 3.3 . . . . . A . 24 LEU H . . A . 24 LEU HB2 . . . 24 . HN . . . . . 24 . HB+ . . rr_1qbf 1 226 2 OR . 1 1 24 24 LEU H H . . . 1 1 24 24 LEU HB3 H . . . . . 2.5 1.8 3.3 . . . . . A . 24 LEU H . . A . 24 LEU HB3 . . . 24 . HN . . . . . 24 . HB+ . . rr_1qbf 1 227 1 . . 1 1 24 24 LEU H H . . . 1 1 24 24 LEU HG H . . . . . 2.5 1.8 2.7 . . . . . A . 24 LEU H . . A . 24 LEU HG . . . 24 . HN . . . . . 24 . HG . . rr_1qbf 1 228 1 OR . 1 1 24 24 LEU H H . . . 1 1 24 24 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 24 LEU H . . A . 24 LEU MD1 . . . 24 . HN . . . . . 24 . HD++ . . rr_1qbf 1 228 2 OR . 1 1 24 24 LEU H H . . . 1 1 24 24 LEU MD2 H . . . . . 2.5 1.8 5.1 . . . . . A . 24 LEU H . . A . 24 LEU MD2 . . . 24 . HN . . . . . 24 . HD++ . . rr_1qbf 1 229 1 OR . 1 1 24 24 LEU HA H . . . 1 1 24 24 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 24 LEU HA . . A . 24 LEU MD1 . . . 24 . HA . . . . . 24 . HD++ . . rr_1qbf 1 229 2 OR . 1 1 24 24 LEU MD2 H . . . 1 1 24 24 LEU HA H . . . . . 2.5 1.8 5.1 . . . . . A . 24 LEU MD2 . . A . 24 LEU HA . . . 24 . HD++ . . . . . 24 . HA . . rr_1qbf 1 230 1 . . 1 1 24 24 LEU HG H . . . 1 1 24 24 LEU HA H . . . . . 3.0 1.8 3.5 . . . . . A . 24 LEU HG . . A . 24 LEU HA . . . 24 . HG . . . . . 24 . HA . . rr_1qbf 1 231 1 . . 1 1 24 24 LEU H H . . . 1 1 25 25 ARG H H . . . . . 3.0 1.8 3.5 . . . . . A . 24 LEU H . . A . 25 ARG H . . . 24 . HN . . . . . 25 . HN . . rr_1qbf 1 232 1 . . 1 1 26 26 HIS HE1 H . . . 1 1 24 24 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 26 HIS HE1 . . A . 24 LEU H . . . 26 . HE1 . . . . . 24 . HN . . rr_1qbf 1 233 1 OR . 1 1 24 24 LEU H H . . . 1 1 25 25 ARG HB2 H . . . . . 4.0 1.8 6.4 . . . . . A . 24 LEU H . . A . 25 ARG HB2 . . . 24 . HN . . . . . 25 . HB+ . . rr_1qbf 1 233 2 OR . 1 1 24 24 LEU H H . . . 1 1 25 25 ARG HG3 H . . . . . 4.0 1.8 6.4 . . . . . A . 24 LEU H . . A . 25 ARG HG3 . . . 24 . HN . . . . . 25 . HG+ . . rr_1qbf 1 233 3 OR . 1 1 24 24 LEU H H . . . 1 1 25 25 ARG HB3 H . . . . . 4.0 1.8 6.4 . . . . . A . 24 LEU H . . A . 25 ARG HB3 . . . 24 . HN . . . . . 25 . HB+ . . rr_1qbf 1 233 4 OR . 1 1 24 24 LEU H H . . . 1 1 25 25 ARG HG2 H . . . . . 4.0 1.8 6.4 . . . . . A . 24 LEU H . . A . 25 ARG HG2 . . . 24 . HN . . . . . 25 . HG+ . . rr_1qbf 1 234 1 . . 1 1 24 24 LEU HG H . . . 1 1 27 27 TYR H H . . . . . 4.0 1.8 7.1 . . . . . A . 24 LEU HG . . A . 27 TYR H . . . 24 . HG . . . . . 27 . HN . . rr_1qbf 1 235 1 OR . 1 1 25 25 ARG H H . . . 1 1 24 24 LEU MD1 H . . . . . 4.0 3.3 7.4 . . . . . A . 25 ARG H . . A . 24 LEU MD1 . . . 25 . HN . . . . . 24 . HD++ . . rr_1qbf 1 235 2 OR . 1 1 24 24 LEU MD2 H . . . 1 1 25 25 ARG H H . . . . . 4.0 3.3 7.4 . . . . . A . 24 LEU MD2 . . A . 25 ARG H . . . 24 . HD++ . . . . . 25 . HN . . rr_1qbf 1 236 1 . . 1 1 24 24 LEU HG H . . . 1 1 25 25 ARG H H . . . . . 4.0 1.8 5.1 . . . . . A . 24 LEU HG . . A . 25 ARG H . . . 24 . HG . . . . . 25 . HN . . rr_1qbf 1 237 1 . . 1 1 25 25 ARG H H . . . 1 1 25 25 ARG HA H . . . . . 2.5 1.8 2.7 . . . . . A . 25 ARG H . . A . 25 ARG HA . . . 25 . HN . . . . . 25 . HA . . rr_1qbf 1 238 1 OR . 1 1 25 25 ARG H H . . . 1 1 25 25 ARG HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 25 ARG H . . A . 25 ARG HG2 . . . 25 . HN . . . . . 25 . HG+ . . rr_1qbf 1 238 2 OR . 1 1 25 25 ARG H H . . . 1 1 25 25 ARG HG3 H . . . . . 2.5 1.8 3.7 . . . . . A . 25 ARG H . . A . 25 ARG HG3 . . . 25 . HN . . . . . 25 . HG+ . . rr_1qbf 1 239 1 OR . 1 1 25 25 ARG HE H . . . 1 1 25 25 ARG HD2 H . . . . . 2.5 1.8 3.7 . . . . . A . 25 ARG HE . . A . 25 ARG HD2 . . . 25 . HE . . . . . 25 . HD+ . . rr_1qbf 1 239 2 OR . 1 1 25 25 ARG HD3 H . . . 1 1 25 25 ARG HE H . . . . . 2.5 1.8 3.7 . . . . . A . 25 ARG HD3 . . A . 25 ARG HE . . . 25 . HD+ . . . . . 25 . HE . . rr_1qbf 1 240 1 . . 1 1 25 25 ARG H H . . . 1 1 25 25 ARG HE H . . . . . 4.0 1.8 6.5 . . . . . A . 25 ARG H . . A . 25 ARG HE . . . 25 . HN . . . . . 25 . HE . . rr_1qbf 1 241 1 OR . 1 1 25 25 ARG HE H . . . 1 1 25 25 ARG HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 25 ARG HE . . A . 25 ARG HB2 . . . 25 . HE . . . . . 25 . HB+ . . rr_1qbf 1 241 2 OR . 1 1 25 25 ARG HB3 H . . . 1 1 25 25 ARG HE H . . . . . 2.5 1.8 3.7 . . . . . A . 25 ARG HB3 . . A . 25 ARG HE . . . 25 . HB+ . . . . . 25 . HE . . rr_1qbf 1 242 1 OR . 1 1 25 25 ARG HA H . . . 1 1 25 25 ARG HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 25 ARG HA . . A . 25 ARG HG2 . . . 25 . HA . . . . . 25 . HG+ . . rr_1qbf 1 242 2 OR . 1 1 25 25 ARG HG3 H . . . 1 1 25 25 ARG HA H . . . . . 2.5 1.8 3.7 . . . . . A . 25 ARG HG3 . . A . 25 ARG HA . . . 25 . HG+ . . . . . 25 . HA . . rr_1qbf 1 243 1 . . 1 1 27 27 TYR CG C . . . 1 1 25 25 ARG H H . . . . . 4.0 1.8 8.0 . . . . . A . 27 TYR CG . . A . 25 ARG H . . . 27 . CG . . . . . 25 . HN . . rr_1qbf 1 244 1 . . 1 1 26 26 HIS HE1 H . . . 1 1 25 25 ARG H H . . . . . 4.0 1.8 5.0 . . . . . A . 26 HIS HE1 . . A . 25 ARG H . . . 26 . HE1 . . . . . 25 . HN . . rr_1qbf 1 245 1 . . 1 1 25 25 ARG HE H . . . 1 1 26 26 HIS H H . . . . . 4.0 3.3 4.2 . . . . . A . 25 ARG HE . . A . 26 HIS H . . . 25 . HE . . . . . 26 . HN . . rr_1qbf 1 246 1 OR . 1 1 25 25 ARG H H . . . 1 1 26 26 HIS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 25 ARG H . . A . 26 HIS HB2 . . . 25 . HN . . . . . 26 . HB+ . . rr_1qbf 1 246 2 OR . 1 1 26 26 HIS HB3 H . . . 1 1 25 25 ARG H H . . . . . 4.0 1.8 6.0 . . . . . A . 26 HIS HB3 . . A . 25 ARG H . . . 26 . HB+ . . . . . 25 . HN . . rr_1qbf 1 247 1 OR . 1 1 26 26 HIS H H . . . 1 1 25 25 ARG HB2 H . . . . . 2.5 1.8 4.1 . . . . . A . 26 HIS H . . A . 25 ARG HB2 . . . 26 . HN . . . . . 25 . HB+ . . rr_1qbf 1 247 2 OR . 1 1 25 25 ARG HG3 H . . . 1 1 26 26 HIS H H . . . . . 2.5 1.8 4.1 . . . . . A . 25 ARG HG3 . . A . 26 HIS H . . . 25 . HG+ . . . . . 26 . HN . . rr_1qbf 1 247 3 OR . 1 1 25 25 ARG HB3 H . . . 1 1 26 26 HIS H H . . . . . 2.5 1.8 4.1 . . . . . A . 25 ARG HB3 . . A . 26 HIS H . . . 25 . HB+ . . . . . 26 . HN . . rr_1qbf 1 247 4 OR . 1 1 26 26 HIS H H . . . 1 1 25 25 ARG HG2 H . . . . . 2.5 1.8 4.1 . . . . . A . 26 HIS H . . A . 25 ARG HG2 . . . 26 . HN . . . . . 25 . HG+ . . rr_1qbf 1 248 1 OR . 1 1 27 27 TYR CG C . . . 1 1 25 25 ARG HB2 H . . . . . 4.0 1.8 8.9 . . . . . A . 27 TYR CG . . A . 25 ARG HB2 . . . 27 . CG . . . . . 25 . HB+ . . rr_1qbf 1 248 2 OR . 1 1 27 27 TYR CG C . . . 1 1 25 25 ARG HG3 H . . . . . 4.0 1.8 8.9 . . . . . A . 27 TYR CG . . A . 25 ARG HG3 . . . 27 . CG . . . . . 25 . HG+ . . rr_1qbf 1 248 3 OR . 1 1 27 27 TYR CG C . . . 1 1 25 25 ARG HB3 H . . . . . 4.0 1.8 8.9 . . . . . A . 27 TYR CG . . A . 25 ARG HB3 . . . 27 . CG . . . . . 25 . HB+ . . rr_1qbf 1 248 4 OR . 1 1 27 27 TYR CG C . . . 1 1 25 25 ARG HG2 H . . . . . 4.0 1.8 8.9 . . . . . A . 27 TYR CG . . A . 25 ARG HG2 . . . 27 . CG . . . . . 25 . HG+ . . rr_1qbf 1 249 1 OR . 1 1 25 25 ARG HB3 H . . . 1 1 29 29 ASN HD21 H . . . . . 4.0 1.8 8.8 . . . . . A . 25 ARG HB3 . . A . 29 ASN HD21 . . . 25 . HB+ . . . . . 29 . HD++ . . rr_1qbf 1 249 2 OR . 1 1 25 25 ARG HG3 H . . . 1 1 29 29 ASN HD22 H . . . . . 4.0 1.8 8.8 . . . . . A . 25 ARG HG3 . . A . 29 ASN HD22 . . . 25 . HG+ . . . . . 29 . HD++ . . rr_1qbf 1 249 3 OR . 1 1 25 25 ARG HG3 H . . . 1 1 29 29 ASN HD21 H . . . . . 4.0 1.8 8.8 . . . . . A . 25 ARG HG3 . . A . 29 ASN HD21 . . . 25 . HG+ . . . . . 29 . HD++ . . rr_1qbf 1 249 4 OR . 1 1 25 25 ARG HG2 H . . . 1 1 29 29 ASN HD21 H . . . . . 4.0 1.8 8.8 . . . . . A . 25 ARG HG2 . . A . 29 ASN HD21 . . . 25 . HG+ . . . . . 29 . HD++ . . rr_1qbf 1 249 5 OR . 1 1 25 25 ARG HB3 H . . . 1 1 29 29 ASN HD22 H . . . . . 4.0 1.8 8.8 . . . . . A . 25 ARG HB3 . . A . 29 ASN HD22 . . . 25 . HB+ . . . . . 29 . HD++ . . rr_1qbf 1 249 6 OR . 1 1 25 25 ARG HB2 H . . . 1 1 29 29 ASN HD21 H . . . . . 4.0 1.8 8.8 . . . . . A . 25 ARG HB2 . . A . 29 ASN HD21 . . . 25 . HB+ . . . . . 29 . HD++ . . rr_1qbf 1 249 7 OR . 1 1 29 29 ASN HD22 H . . . 1 1 25 25 ARG HG2 H . . . . . 4.0 1.8 8.8 . . . . . A . 29 ASN HD22 . . A . 25 ARG HG2 . . . 29 . HD++ . . . . . 25 . HG+ . . rr_1qbf 1 249 8 OR . 1 1 29 29 ASN HD22 H . . . 1 1 25 25 ARG HB2 H . . . . . 4.0 1.8 8.8 . . . . . A . 29 ASN HD22 . . A . 25 ARG HB2 . . . 29 . HD++ . . . . . 25 . HB+ . . rr_1qbf 1 250 1 . . 1 1 25 25 ARG O O . . . 1 1 29 29 ASN H H . . . . . 2.5 1.8 2.7 . . . . . A . 25 ARG O . . A . 29 ASN H . . . 25 . O . . . . . 29 . HN . . rr_1qbf 1 251 1 . . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HA H . . . . . 2.5 1.8 2.7 . . . . . A . 26 HIS H . . A . 26 HIS HA . . . 26 . HN . . . . . 26 . HA . . rr_1qbf 1 252 1 OR . 1 1 26 26 HIS HA H . . . 1 1 26 26 HIS HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 26 HIS HA . . A . 26 HIS HB2 . . . 26 . HA . . . . . 26 . HB+ . . rr_1qbf 1 252 2 OR . 1 1 26 26 HIS HB3 H . . . 1 1 26 26 HIS HA H . . . . . 2.5 1.8 3.7 . . . . . A . 26 HIS HB3 . . A . 26 HIS HA . . . 26 . HB+ . . . . . 26 . HA . . rr_1qbf 1 253 1 OR . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HB2 H . . . . . 3.0 1.8 4.1 . . . . . A . 26 HIS H . . A . 26 HIS HB2 . . . 26 . HN . . . . . 26 . HB+ . . rr_1qbf 1 253 2 OR . 1 1 26 26 HIS HB3 H . . . 1 1 26 26 HIS H H . . . . . 3.0 1.8 4.1 . . . . . A . 26 HIS HB3 . . A . 26 HIS H . . . 26 . HB+ . . . . . 26 . HN . . rr_1qbf 1 254 1 OR . 1 1 26 26 HIS HE1 H . . . 1 1 26 26 HIS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 26 HIS HE1 . . A . 26 HIS HB2 . . . 26 . HE1 . . . . . 26 . HB+ . . rr_1qbf 1 254 2 OR . 1 1 26 26 HIS HB3 H . . . 1 1 26 26 HIS HE1 H . . . . . 4.0 1.8 6.0 . . . . . A . 26 HIS HB3 . . A . 26 HIS HE1 . . . 26 . HB+ . . . . . 26 . HE1 . . rr_1qbf 1 255 1 . . 1 1 27 27 TYR H H . . . 1 1 26 26 HIS H H . . . . . 3.0 1.8 3.5 . . . . . A . 27 TYR H . . A . 26 HIS H . . . 27 . HN . . . . . 26 . HN . . rr_1qbf 1 256 1 OR . 1 1 27 27 TYR CG C . . . 1 1 26 26 HIS HB2 H . . . . . 4.0 1.8 8.0 . . . . . A . 27 TYR CG . . A . 26 HIS HB2 . . . 27 . CG . . . . . 26 . HB+ . . rr_1qbf 1 256 2 OR . 1 1 27 27 TYR CG C . . . 1 1 26 26 HIS HB3 H . . . . . 4.0 1.8 8.0 . . . . . A . 27 TYR CG . . A . 26 HIS HB3 . . . 27 . CG . . . . . 26 . HB+ . . rr_1qbf 1 257 1 OR . 1 1 27 27 TYR CZ C . . . 1 1 26 26 HIS HB2 H . . . . . 4.0 1.8 8.5 . . . . . A . 27 TYR CZ . . A . 26 HIS HB2 . . . 27 . CZ . . . . . 26 . HB+ . . rr_1qbf 1 257 2 OR . 1 1 27 27 TYR CZ C . . . 1 1 26 26 HIS HB3 H . . . . . 4.0 1.8 8.5 . . . . . A . 27 TYR CZ . . A . 26 HIS HB3 . . . 27 . CZ . . . . . 26 . HB+ . . rr_1qbf 1 258 1 OR . 1 1 26 26 HIS HE1 H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 7.9 . . . . . A . 26 HIS HE1 . . A . 30 LEU MD1 . . . 26 . HE1 . . . . . 30 . HD++ . . rr_1qbf 1 258 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 26 26 HIS HE1 H . . . . . 4.0 1.8 7.9 . . . . . A . 30 LEU MD2 . . A . 26 HIS HE1 . . . 30 . HD++ . . . . . 26 . HE1 . . rr_1qbf 1 259 1 OR . 1 1 26 26 HIS HD2 H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 7.9 . . . . . A . 26 HIS HD2 . . A . 30 LEU MD1 . . . 26 . HD2 . . . . . 30 . HD++ . . rr_1qbf 1 259 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 26 26 HIS HD2 H . . . . . 4.0 1.8 7.9 . . . . . A . 30 LEU MD2 . . A . 26 HIS HD2 . . . 30 . HD++ . . . . . 26 . HD2 . . rr_1qbf 1 260 1 OR . 1 1 26 26 HIS HD2 H . . . 1 1 31 31 VAL MG2 H . . . . . 4.0 1.8 7.4 . . . . . A . 26 HIS HD2 . . A . 31 VAL MG2 . . . 26 . HD2 . . . . . 31 . HG++ . . rr_1qbf 1 260 2 OR . 1 1 31 31 VAL MG1 H . . . 1 1 26 26 HIS HD2 H . . . . . 4.0 1.8 7.4 . . . . . A . 31 VAL MG1 . . A . 26 HIS HD2 . . . 31 . HG++ . . . . . 26 . HD2 . . rr_1qbf 1 261 1 . . 1 1 26 26 HIS O O . . . 1 1 30 30 LEU H H . . . . . 3.0 1.8 3.5 . . . . . A . 26 HIS O . . A . 30 LEU H . . . 26 . O . . . . . 30 . HN . . rr_1qbf 1 262 1 OR . 1 1 27 27 TYR HA H . . . 1 1 27 27 TYR HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 27 TYR HA . . A . 27 TYR HB2 . . . 27 . HA . . . . . 27 . HB+ . . rr_1qbf 1 262 2 OR . 1 1 27 27 TYR HB3 H . . . 1 1 27 27 TYR HA H . . . . . 2.5 1.8 3.7 . . . . . A . 27 TYR HB3 . . A . 27 TYR HA . . . 27 . HB+ . . . . . 27 . HA . . rr_1qbf 1 263 1 . . 1 1 27 27 TYR HA H . . . 1 1 27 27 TYR QD H . . . . . 3.0 1.8 4.5 . . . . . A . 27 TYR HA . . A . 27 TYR QD . . . 27 . HA . . . . . 27 . HD+ . . rr_1qbf 1 264 1 . . 1 1 27 27 TYR CG C . . . 1 1 27 27 TYR H H . . . . . 2.5 1.8 4.7 . . . . . A . 27 TYR CG . . A . 27 TYR H . . . 27 . CG . . . . . 27 . HN . . rr_1qbf 1 265 1 OR . 1 1 27 27 TYR CG C . . . 1 1 27 27 TYR HB2 H . . . . . 2.5 1.8 5.7 . . . . . A . 27 TYR CG . . A . 27 TYR HB2 . . . 27 . CG . . . . . 27 . HB+ . . rr_1qbf 1 265 2 OR . 1 1 27 27 TYR CG C . . . 1 1 27 27 TYR HB3 H . . . . . 2.5 1.8 5.7 . . . . . A . 27 TYR CG . . A . 27 TYR HB3 . . . 27 . CG . . . . . 27 . HB+ . . rr_1qbf 1 266 1 OR . 1 1 28 28 LEU H H . . . 1 1 27 27 TYR HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 28 LEU H . . A . 27 TYR HB2 . . . 28 . HN . . . . . 27 . HB+ . . rr_1qbf 1 266 2 OR . 1 1 28 28 LEU H H . . . 1 1 27 27 TYR HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 28 LEU H . . A . 27 TYR HB3 . . . 28 . HN . . . . . 27 . HB+ . . rr_1qbf 1 267 1 . . 1 1 28 28 LEU H H . . . 1 1 27 27 TYR H H . . . . . 4.0 1.8 5.0 . . . . . A . 28 LEU H . . A . 27 TYR H . . . 28 . HN . . . . . 27 . HN . . rr_1qbf 1 268 1 . . 1 1 27 27 TYR H H . . . 1 1 28 28 LEU HA H . . . . . 4.0 1.8 6.0 . . . . . A . 27 TYR H . . A . 28 LEU HA . . . 27 . HN . . . . . 28 . HA . . rr_1qbf 1 269 1 OR . 1 1 27 27 TYR CZ C . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 9.4 . . . . . A . 27 TYR CZ . . A . 30 LEU MD1 . . . 27 . CZ . . . . . 30 . HD++ . . rr_1qbf 1 269 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 27 27 TYR CZ C . . . . . 4.0 1.8 9.4 . . . . . A . 30 LEU MD2 . . A . 27 TYR CZ . . . 30 . HD++ . . . . . 27 . CZ . . rr_1qbf 1 270 1 OR . 1 1 27 27 TYR CG C . . . 1 1 30 30 LEU MD1 H . . . . . 2.5 1.8 7.1 . . . . . A . 27 TYR CG . . A . 30 LEU MD1 . . . 27 . CG . . . . . 30 . HD++ . . rr_1qbf 1 270 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 27 27 TYR CG C . . . . . 2.5 1.8 7.1 . . . . . A . 30 LEU MD2 . . A . 27 TYR CG . . . 30 . HD++ . . . . . 27 . CG . . rr_1qbf 1 271 1 . . 1 1 31 31 VAL MG1 H . . . 1 1 27 27 TYR CZ C . . . . . 2.5 1.8 5.7 . . . . . A . 31 VAL MG1 . . A . 27 TYR CZ . . . 31 . HG1+ . . . . . 27 . CZ . . rr_1qbf 1 272 1 . . 1 1 27 27 TYR CZ C . . . 1 1 31 31 VAL MG2 H . . . . . 3.0 1.8 6.5 . . . . . A . 27 TYR CZ . . A . 31 VAL MG2 . . . 27 . CZ . . . . . 31 . HG2+ . . rr_1qbf 1 273 1 . . 1 1 31 31 VAL MG1 H . . . 1 1 27 27 TYR CG C . . . . . 2.5 1.8 5.7 . . . . . A . 31 VAL MG1 . . A . 27 TYR CG . . . 31 . HG1+ . . . . . 27 . CG . . rr_1qbf 1 274 1 . . 1 1 27 27 TYR CG C . . . 1 1 31 31 VAL MG2 H . . . . . 2.5 1.8 5.7 . . . . . A . 27 TYR CG . . A . 31 VAL MG2 . . . 27 . CG . . . . . 31 . HG2+ . . rr_1qbf 1 275 1 . . 1 1 27 27 TYR CZ C . . . 1 1 32 32 THR MG H . . . . . 4.0 1.8 8.5 . . . . . A . 27 TYR CZ . . A . 32 THR MG . . . 27 . CZ . . . . . 32 . HG2+ . . rr_1qbf 1 276 1 . . 1 1 28 28 LEU H H . . . 1 1 27 27 TYR CZ C . . . . . 3.0 1.8 5.5 . . . . . A . 28 LEU H . . A . 27 TYR CZ . . . 28 . HN . . . . . 27 . CZ . . rr_1qbf 1 277 1 . . 1 1 27 27 TYR H H . . . 1 1 30 30 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 27 TYR H . . A . 30 LEU H . . . 27 . HN . . . . . 30 . HN . . rr_1qbf 1 278 1 . . 1 1 27 27 TYR CG C . . . 1 1 29 29 ASN H H . . . . . 4.0 1.8 7.0 . . . . . A . 27 TYR CG . . A . 29 ASN H . . . 27 . CG . . . . . 29 . HN . . rr_1qbf 1 279 1 . . 1 1 27 27 TYR CG C . . . 1 1 31 31 VAL H H . . . . . 4.0 1.8 7.0 . . . . . A . 27 TYR CG . . A . 31 VAL H . . . 27 . CG . . . . . 31 . HN . . rr_1qbf 1 280 1 OR . 1 1 30 30 LEU H H . . . 1 1 27 27 TYR HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 30 LEU H . . A . 27 TYR HB2 . . . 30 . HN . . . . . 27 . HB+ . . rr_1qbf 1 280 2 OR . 1 1 27 27 TYR HB3 H . . . 1 1 30 30 LEU H H . . . . . 4.0 1.8 6.0 . . . . . A . 27 TYR HB3 . . A . 30 LEU H . . . 27 . HB+ . . . . . 30 . HN . . rr_1qbf 1 281 1 . . 1 1 27 27 TYR CG C . . . 1 1 28 28 LEU HA H . . . . . 3.0 1.8 5.5 . . . . . A . 27 TYR CG . . A . 28 LEU HA . . . 27 . CG . . . . . 28 . HA . . rr_1qbf 1 282 1 . . 1 1 27 27 TYR CZ C . . . 1 1 28 28 LEU HA H . . . . . 4.0 1.8 7.0 . . . . . A . 27 TYR CZ . . A . 28 LEU HA . . . 27 . CZ . . . . . 28 . HA . . rr_1qbf 1 283 1 OR . 1 1 27 27 TYR H H . . . 1 1 28 28 LEU MD1 H . . . . . 4.0 1.8 7.4 . . . . . A . 27 TYR H . . A . 28 LEU MD1 . . . 27 . HN . . . . . 28 . HD++ . . rr_1qbf 1 283 2 OR . 1 1 28 28 LEU MD2 H . . . 1 1 27 27 TYR H H . . . . . 4.0 1.8 7.4 . . . . . A . 28 LEU MD2 . . A . 27 TYR H . . . 28 . HD++ . . . . . 27 . HN . . rr_1qbf 1 284 1 OR . 1 1 27 27 TYR CG C . . . 1 1 28 28 LEU MD1 H . . . . . 2.5 1.8 7.1 . . . . . A . 27 TYR CG . . A . 28 LEU MD1 . . . 27 . CG . . . . . 28 . HD++ . . rr_1qbf 1 284 2 OR . 1 1 28 28 LEU MD2 H . . . 1 1 27 27 TYR CG C . . . . . 2.5 1.8 7.1 . . . . . A . 28 LEU MD2 . . A . 27 TYR CG . . . 28 . HD++ . . . . . 27 . CG . . rr_1qbf 1 285 1 . . 1 1 27 27 TYR CG C . . . 1 1 32 32 THR MG H . . . . . 4.0 1.8 8.0 . . . . . A . 27 TYR CG . . A . 32 THR MG . . . 27 . CG . . . . . 32 . HG2+ . . rr_1qbf 1 286 1 . . 1 1 27 27 TYR CG C . . . 1 1 28 28 LEU HG H . . . . . 4.0 1.8 7.0 . . . . . A . 27 TYR CG . . A . 28 LEU HG . . . 27 . CG . . . . . 28 . HG . . rr_1qbf 1 287 1 OR . 1 1 27 27 TYR CG C . . . 1 1 30 30 LEU HB2 H . . . . . 4.0 1.8 7.0 . . . . . A . 27 TYR CG . . A . 30 LEU HB2 . . . 27 . CG . . . . . 30 . HB+ . . rr_1qbf 1 287 2 OR . 1 1 27 27 TYR CG C . . . 1 1 30 30 LEU HB3 H . . . . . 4.0 1.8 7.0 . . . . . A . 27 TYR CG . . A . 30 LEU HB3 . . . 27 . CG . . . . . 30 . HB+ . . rr_1qbf 1 288 1 OR . 1 1 27 27 TYR CZ C . . . 1 1 28 28 LEU MD1 H . . . . . 2.5 1.8 7.1 . . . . . A . 27 TYR CZ . . A . 28 LEU MD1 . . . 27 . CZ . . . . . 28 . HD++ . . rr_1qbf 1 288 2 OR . 1 1 28 28 LEU MD2 H . . . 1 1 27 27 TYR CZ C . . . . . 2.5 1.8 7.1 . . . . . A . 28 LEU MD2 . . A . 27 TYR CZ . . . 28 . HD++ . . . . . 27 . CZ . . rr_1qbf 1 289 1 . . 1 1 27 27 TYR CZ C . . . 1 1 31 31 VAL HB H . . . . . 4.0 1.8 7.5 . . . . . A . 27 TYR CZ . . A . 31 VAL HB . . . 27 . CZ . . . . . 31 . HB . . rr_1qbf 1 290 1 . . 1 1 31 31 VAL H H . . . 1 1 27 27 TYR O O . . . . . 4.0 1.8 5.0 . . . . . A . 31 VAL H . . A . 27 TYR O . . . 31 . HN . . . . . 27 . O . . rr_1qbf 1 291 1 . . 1 1 28 28 LEU H H . . . 1 1 28 28 LEU HA H . . . . . 2.5 1.8 2.7 . . . . . A . 28 LEU H . . A . 28 LEU HA . . . 28 . HN . . . . . 28 . HA . . rr_1qbf 1 292 1 OR . 1 1 28 28 LEU H H . . . 1 1 28 28 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 28 LEU H . . A . 28 LEU MD1 . . . 28 . HN . . . . . 28 . HD++ . . rr_1qbf 1 292 2 OR . 1 1 28 28 LEU MD2 H . . . 1 1 28 28 LEU H H . . . . . 2.5 1.8 5.1 . . . . . A . 28 LEU MD2 . . A . 28 LEU H . . . 28 . HD++ . . . . . 28 . HN . . rr_1qbf 1 293 1 . . 1 1 28 28 LEU H H . . . 1 1 28 28 LEU HG H . . . . . 4.0 2.8 5.0 . . . . . A . 28 LEU H . . A . 28 LEU HG . . . 28 . HN . . . . . 28 . HG . . rr_1qbf 1 294 1 OR . 1 1 28 28 LEU HA H . . . 1 1 28 28 LEU HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 28 LEU HA . . A . 28 LEU HB2 . . . 28 . HA . . . . . 28 . HB+ . . rr_1qbf 1 294 2 OR . 1 1 28 28 LEU HA H . . . 1 1 28 28 LEU HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 28 LEU HA . . A . 28 LEU HB3 . . . 28 . HA . . . . . 28 . HB+ . . rr_1qbf 1 295 1 OR . 1 1 28 28 LEU HA H . . . 1 1 28 28 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 28 LEU HA . . A . 28 LEU MD1 . . . 28 . HA . . . . . 28 . HD++ . . rr_1qbf 1 295 2 OR . 1 1 28 28 LEU MD2 H . . . 1 1 28 28 LEU HA H . . . . . 2.5 1.8 5.1 . . . . . A . 28 LEU MD2 . . A . 28 LEU HA . . . 28 . HD++ . . . . . 28 . HA . . rr_1qbf 1 296 1 . . 1 1 28 28 LEU H H . . . 1 1 29 29 ASN H H . . . . . 2.5 1.8 2.7 . . . . . A . 28 LEU H . . A . 29 ASN H . . . 28 . HN . . . . . 29 . HN . . rr_1qbf 1 297 1 OR . 1 1 29 29 ASN H H . . . 1 1 28 28 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 29 ASN H . . A . 28 LEU MD1 . . . 29 . HN . . . . . 28 . HD++ . . rr_1qbf 1 297 2 OR . 1 1 28 28 LEU MD2 H . . . 1 1 29 29 ASN H H . . . . . 2.5 1.8 5.1 . . . . . A . 28 LEU MD2 . . A . 29 ASN H . . . 28 . HD++ . . . . . 29 . HN . . rr_1qbf 1 298 1 OR . 1 1 29 29 ASN H H . . . 1 1 28 28 LEU HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 29 ASN H . . A . 28 LEU HB2 . . . 29 . HN . . . . . 28 . HB+ . . rr_1qbf 1 298 2 OR . 1 1 29 29 ASN H H . . . 1 1 28 28 LEU HB3 H . . . . . 3.0 1.8 4.5 . . . . . A . 29 ASN H . . A . 28 LEU HB3 . . . 29 . HN . . . . . 28 . HB+ . . rr_1qbf 1 299 1 OR . 1 1 28 28 LEU MD2 H . . . 1 1 31 31 VAL MG1 H . . . . . 3.0 1.8 6.9 . . . . . A . 28 LEU MD2 . . A . 31 VAL MG1 . . . 28 . HD++ . . . . . 31 . HG1+ . . rr_1qbf 1 299 2 OR . 1 1 31 31 VAL MG1 H . . . 1 1 28 28 LEU MD1 H . . . . . 3.0 1.8 6.9 . . . . . A . 31 VAL MG1 . . A . 28 LEU MD1 . . . 31 . HG1+ . . . . . 28 . HD++ . . rr_1qbf 1 300 1 OR . 1 1 28 28 LEU MD2 H . . . 1 1 31 31 VAL MG2 H . . . . . 2.5 1.8 6.1 . . . . . A . 28 LEU MD2 . . A . 31 VAL MG2 . . . 28 . HD++ . . . . . 31 . HG2+ . . rr_1qbf 1 300 2 OR . 1 1 28 28 LEU MD1 H . . . 1 1 31 31 VAL MG2 H . . . . . 2.5 1.8 6.1 . . . . . A . 28 LEU MD1 . . A . 31 VAL MG2 . . . 28 . HD++ . . . . . 31 . HG2+ . . rr_1qbf 1 301 1 . . 1 1 28 28 LEU H H . . . 1 1 32 32 THR HB H . . . . . 4.0 1.8 5.0 . . . . . A . 28 LEU H . . A . 32 THR HB . . . 28 . HN . . . . . 32 . HB . . rr_1qbf 1 302 1 OR . 1 1 28 28 LEU H H . . . 1 1 31 31 VAL MG2 H . . . . . 2.5 1.8 5.1 . . . . . A . 28 LEU H . . A . 31 VAL MG2 . . . 28 . HN . . . . . 31 . HG++ . . rr_1qbf 1 302 2 OR . 1 1 31 31 VAL MG1 H . . . 1 1 28 28 LEU H H . . . . . 2.5 1.8 5.1 . . . . . A . 31 VAL MG1 . . A . 28 LEU H . . . 31 . HG++ . . . . . 28 . HN . . rr_1qbf 1 303 1 OR . 1 1 35 35 ARG H H . . . 1 1 28 28 LEU MD1 H . . . . . 4.0 1.8 8.4 . . . . . A . 35 ARG H . . A . 28 LEU MD1 . . . 35 . HN . . . . . 28 . HD++ . . rr_1qbf 1 303 2 OR . 1 1 28 28 LEU MD2 H . . . 1 1 35 35 ARG H H . . . . . 4.0 1.8 8.4 . . . . . A . 28 LEU MD2 . . A . 35 ARG H . . . 28 . HD++ . . . . . 35 . HN . . rr_1qbf 1 304 1 OR . 1 1 31 31 VAL H H . . . 1 1 28 28 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 31 VAL H . . A . 28 LEU MD1 . . . 31 . HN . . . . . 28 . HD++ . . rr_1qbf 1 304 2 OR . 1 1 28 28 LEU MD2 H . . . 1 1 31 31 VAL H H . . . . . 2.5 1.8 5.1 . . . . . A . 28 LEU MD2 . . A . 31 VAL H . . . 28 . HD++ . . . . . 31 . HN . . rr_1qbf 1 305 1 OR . 1 1 32 32 THR H H . . . 1 1 28 28 LEU MD1 H . . . . . 3.0 1.8 5.9 . . . . . A . 32 THR H . . A . 28 LEU MD1 . . . 32 . HN . . . . . 28 . HD++ . . rr_1qbf 1 305 2 OR . 1 1 28 28 LEU MD2 H . . . 1 1 32 32 THR H H . . . . . 3.0 1.8 5.9 . . . . . A . 28 LEU MD2 . . A . 32 THR H . . . 28 . HD++ . . . . . 32 . HN . . rr_1qbf 1 306 1 . . 1 1 32 32 THR H H . . . 1 1 28 28 LEU O O . . . . . 4.0 1.8 5.0 . . . . . A . 32 THR H . . A . 28 LEU O . . . 32 . HN . . . . . 28 . O . . rr_1qbf 1 307 1 . . 1 1 29 29 ASN H H . . . 1 1 29 29 ASN HA H . . . . . 2.5 1.8 2.7 . . . . . A . 29 ASN H . . A . 29 ASN HA . . . 29 . HN . . . . . 29 . HA . . rr_1qbf 1 308 1 OR . 1 1 29 29 ASN H H . . . 1 1 29 29 ASN HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 29 ASN H . . A . 29 ASN HB2 . . . 29 . HN . . . . . 29 . HB+ . . rr_1qbf 1 308 2 OR . 1 1 29 29 ASN H H . . . 1 1 29 29 ASN HB3 H . . . . . 3.0 1.8 4.5 . . . . . A . 29 ASN H . . A . 29 ASN HB3 . . . 29 . HN . . . . . 29 . HB+ . . rr_1qbf 1 309 1 OR . 1 1 29 29 ASN HA H . . . 1 1 29 29 ASN HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 29 ASN HA . . A . 29 ASN HB2 . . . 29 . HA . . . . . 29 . HB+ . . rr_1qbf 1 309 2 OR . 1 1 29 29 ASN HA H . . . 1 1 29 29 ASN HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 29 ASN HA . . A . 29 ASN HB3 . . . 29 . HA . . . . . 29 . HB+ . . rr_1qbf 1 310 1 OR . 1 1 29 29 ASN HB3 H . . . 1 1 29 29 ASN HD21 H . . . . . 2.5 1.8 3.7 . . . . . A . 29 ASN HB3 . . A . 29 ASN HD21 . . . 29 . HB1 . . . . . 29 . HD2+ . . rr_1qbf 1 310 2 OR . 1 1 29 29 ASN HD22 H . . . 1 1 29 29 ASN HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 29 ASN HD22 . . A . 29 ASN HB3 . . . 29 . HD2+ . . . . . 29 . HB1 . . rr_1qbf 1 311 1 OR . 1 1 29 29 ASN HB2 H . . . 1 1 29 29 ASN HD21 H . . . . . 3.0 1.8 4.5 . . . . . A . 29 ASN HB2 . . A . 29 ASN HD21 . . . 29 . HB2 . . . . . 29 . HD2+ . . rr_1qbf 1 311 2 OR . 1 1 29 29 ASN HD22 H . . . 1 1 29 29 ASN HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 29 ASN HD22 . . A . 29 ASN HB2 . . . 29 . HD2+ . . . . . 29 . HB2 . . rr_1qbf 1 312 1 OR . 1 1 29 29 ASN HD22 H . . . 1 1 29 29 ASN H H . . . . . 4.0 1.8 6.0 . . . . . A . 29 ASN HD22 . . A . 29 ASN H . . . 29 . HD2+ . . . . . 29 . HN . . rr_1qbf 1 312 2 OR . 1 1 29 29 ASN H H . . . 1 1 29 29 ASN HD21 H . . . . . 4.0 1.8 6.0 . . . . . A . 29 ASN H . . A . 29 ASN HD21 . . . 29 . HN . . . . . 29 . HD2+ . . rr_1qbf 1 313 1 . . 1 1 29 29 ASN H H . . . 1 1 30 30 LEU H H . . . . . 2.5 1.8 2.7 . . . . . A . 29 ASN H . . A . 30 LEU H . . . 29 . HN . . . . . 30 . HN . . rr_1qbf 1 314 1 . . 1 1 30 30 LEU H H . . . 1 1 29 29 ASN HA H . . . . . 3.0 1.8 3.5 . . . . . A . 30 LEU H . . A . 29 ASN HA . . . 30 . HN . . . . . 29 . HA . . rr_1qbf 1 315 1 OR . 1 1 30 30 LEU H H . . . 1 1 29 29 ASN HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 30 LEU H . . A . 29 ASN HB2 . . . 30 . HN . . . . . 29 . HB+ . . rr_1qbf 1 315 2 OR . 1 1 30 30 LEU H H . . . 1 1 29 29 ASN HB3 H . . . . . 3.0 1.8 4.5 . . . . . A . 30 LEU H . . A . 29 ASN HB3 . . . 30 . HN . . . . . 29 . HB+ . . rr_1qbf 1 316 1 . . 1 1 31 31 VAL HA H . . . 1 1 29 29 ASN H H . . . . . 4.0 1.8 5.7 . . . . . A . 31 VAL HA . . A . 29 ASN H . . . 31 . HA . . . . . 29 . HN . . rr_1qbf 1 317 1 OR . 1 1 31 31 VAL H H . . . 1 1 29 29 ASN HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 31 VAL H . . A . 29 ASN HB2 . . . 31 . HN . . . . . 29 . HB+ . . rr_1qbf 1 317 2 OR . 1 1 31 31 VAL H H . . . 1 1 29 29 ASN HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 31 VAL H . . A . 29 ASN HB3 . . . 31 . HN . . . . . 29 . HB+ . . rr_1qbf 1 318 1 OR . 1 1 29 29 ASN HD22 H . . . 1 1 30 30 LEU H H . . . . . 3.0 1.8 4.5 . . . . . A . 29 ASN HD22 . . A . 30 LEU H . . . 29 . HD2+ . . . . . 30 . HN . . rr_1qbf 1 318 2 OR . 1 1 30 30 LEU H H . . . 1 1 29 29 ASN HD21 H . . . . . 3.0 1.8 4.5 . . . . . A . 30 LEU H . . A . 29 ASN HD21 . . . 30 . HN . . . . . 29 . HD2+ . . rr_1qbf 1 319 1 OR . 1 1 29 29 ASN HD22 H . . . 1 1 30 30 LEU HA H . . . . . 3.0 1.8 4.5 . . . . . A . 29 ASN HD22 . . A . 30 LEU HA . . . 29 . HD2+ . . . . . 30 . HA . . rr_1qbf 1 319 2 OR . 1 1 30 30 LEU HA H . . . 1 1 29 29 ASN HD21 H . . . . . 3.0 1.8 4.5 . . . . . A . 30 LEU HA . . A . 29 ASN HD21 . . . 30 . HA . . . . . 29 . HD2+ . . rr_1qbf 1 320 1 OR . 1 1 29 29 ASN HD22 H . . . 1 1 32 32 THR HB H . . . . . 4.0 1.8 6.5 . . . . . A . 29 ASN HD22 . . A . 32 THR HB . . . 29 . HD2+ . . . . . 32 . HB . . rr_1qbf 1 320 2 OR . 1 1 32 32 THR HB H . . . 1 1 29 29 ASN HD21 H . . . . . 4.0 1.8 6.5 . . . . . A . 32 THR HB . . A . 29 ASN HD21 . . . 32 . HB . . . . . 29 . HD2+ . . rr_1qbf 1 321 1 OR . 1 1 29 29 ASN H H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 7.4 . . . . . A . 29 ASN H . . A . 30 LEU MD1 . . . 29 . HN . . . . . 30 . HD++ . . rr_1qbf 1 321 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 29 29 ASN H H . . . . . 4.0 1.8 7.4 . . . . . A . 30 LEU MD2 . . A . 29 ASN H . . . 30 . HD++ . . . . . 29 . HN . . rr_1qbf 1 322 1 OR . 1 1 29 29 ASN HA H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 7.4 . . . . . A . 29 ASN HA . . A . 30 LEU MD1 . . . 29 . HA . . . . . 30 . HD++ . . rr_1qbf 1 322 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 29 29 ASN HA H . . . . . 4.0 1.8 7.4 . . . . . A . 30 LEU MD2 . . A . 29 ASN HA . . . 30 . HD++ . . . . . 29 . HA . . rr_1qbf 1 323 1 OR . 1 1 29 29 ASN HD22 H . . . 1 1 32 32 THR MG H . . . . . 4.0 1.8 7.0 . . . . . A . 29 ASN HD22 . . A . 32 THR MG . . . 29 . HD2+ . . . . . 32 . HG2+ . . rr_1qbf 1 323 2 OR . 1 1 32 32 THR MG H . . . 1 1 29 29 ASN HD21 H . . . . . 4.0 1.8 7.0 . . . . . A . 32 THR MG . . A . 29 ASN HD21 . . . 32 . HG2+ . . . . . 29 . HD2+ . . rr_1qbf 1 324 1 . . 1 1 29 29 ASN O O . . . 1 1 33 33 ARG H H . . . . . 2.5 1.8 2.7 . . . . . A . 29 ASN O . . A . 33 ARG H . . . 29 . O . . . . . 33 . HN . . rr_1qbf 1 325 1 . . 1 1 30 30 LEU H H . . . 1 1 30 30 LEU HA H . . . . . 2.5 1.8 2.7 . . . . . A . 30 LEU H . . A . 30 LEU HA . . . 30 . HN . . . . . 30 . HA . . rr_1qbf 1 326 1 OR . 1 1 30 30 LEU H H . . . 1 1 30 30 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 30 LEU H . . A . 30 LEU MD1 . . . 30 . HN . . . . . 30 . HD++ . . rr_1qbf 1 326 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 30 30 LEU H H . . . . . 2.5 1.8 5.1 . . . . . A . 30 LEU MD2 . . A . 30 LEU H . . . 30 . HD++ . . . . . 30 . HN . . rr_1qbf 1 327 1 . . 1 1 30 30 LEU H H . . . 1 1 30 30 LEU HG H . . . . . 3.0 1.8 3.5 . . . . . A . 30 LEU H . . A . 30 LEU HG . . . 30 . HN . . . . . 30 . HG . . rr_1qbf 1 328 1 OR . 1 1 30 30 LEU H H . . . 1 1 30 30 LEU HB2 H . . . . . 3.0 1.8 3.6 . . . . . A . 30 LEU H . . A . 30 LEU HB2 . . . 30 . HN . . . . . 30 . HB+ . . rr_1qbf 1 328 2 OR . 1 1 30 30 LEU H H . . . 1 1 30 30 LEU HB3 H . . . . . 3.0 1.8 3.6 . . . . . A . 30 LEU H . . A . 30 LEU HB3 . . . 30 . HN . . . . . 30 . HB+ . . rr_1qbf 1 329 1 OR . 1 1 30 30 LEU HB2 H . . . 1 1 30 30 LEU MD1 H . . . . . 2.5 1.8 6.1 . . . . . A . 30 LEU HB2 . . A . 30 LEU MD1 . . . 30 . HB+ . . . . . 30 . HD++ . . rr_1qbf 1 329 2 OR . 1 1 30 30 LEU HB3 H . . . 1 1 30 30 LEU MD1 H . . . . . 2.5 1.8 6.1 . . . . . A . 30 LEU HB3 . . A . 30 LEU MD1 . . . 30 . HB+ . . . . . 30 . HD++ . . rr_1qbf 1 329 3 OR . 1 1 30 30 LEU MD2 H . . . 1 1 30 30 LEU HB2 H . . . . . 2.5 1.8 6.1 . . . . . A . 30 LEU MD2 . . A . 30 LEU HB2 . . . 30 . HD++ . . . . . 30 . HB+ . . rr_1qbf 1 329 4 OR . 1 1 30 30 LEU MD2 H . . . 1 1 30 30 LEU HB3 H . . . . . 2.5 1.8 6.1 . . . . . A . 30 LEU MD2 . . A . 30 LEU HB3 . . . 30 . HD++ . . . . . 30 . HB+ . . rr_1qbf 1 330 1 OR . 1 1 30 30 LEU HG H . . . 1 1 30 30 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 30 LEU HG . . A . 30 LEU MD1 . . . 30 . HG . . . . . 30 . HD++ . . rr_1qbf 1 330 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 30 30 LEU HG H . . . . . 2.5 1.8 5.1 . . . . . A . 30 LEU MD2 . . A . 30 LEU HG . . . 30 . HD++ . . . . . 30 . HG . . rr_1qbf 1 331 1 OR . 1 1 30 30 LEU HA H . . . 1 1 30 30 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 30 LEU HA . . A . 30 LEU MD1 . . . 30 . HA . . . . . 30 . HD++ . . rr_1qbf 1 331 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 30 30 LEU HA H . . . . . 2.5 1.8 5.1 . . . . . A . 30 LEU MD2 . . A . 30 LEU HA . . . 30 . HD++ . . . . . 30 . HA . . rr_1qbf 1 332 1 . . 1 1 30 30 LEU HA H . . . 1 1 30 30 LEU HG H . . . . . 3.0 1.8 3.5 . . . . . A . 30 LEU HA . . A . 30 LEU HG . . . 30 . HA . . . . . 30 . HG . . rr_1qbf 1 333 1 OR . 1 1 30 30 LEU HA H . . . 1 1 30 30 LEU HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 30 LEU HA . . A . 30 LEU HB2 . . . 30 . HA . . . . . 30 . HB+ . . rr_1qbf 1 333 2 OR . 1 1 30 30 LEU HB3 H . . . 1 1 30 30 LEU HA H . . . . . 2.5 1.8 3.7 . . . . . A . 30 LEU HB3 . . A . 30 LEU HA . . . 30 . HB+ . . . . . 30 . HA . . rr_1qbf 1 334 1 . . 1 1 31 31 VAL HA H . . . 1 1 30 30 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 31 VAL HA . . A . 30 LEU H . . . 31 . HA . . . . . 30 . HN . . rr_1qbf 1 335 1 . . 1 1 31 31 VAL H H . . . 1 1 30 30 LEU HA H . . . . . 3.0 1.8 3.5 . . . . . A . 31 VAL H . . A . 30 LEU HA . . . 31 . HN . . . . . 30 . HA . . rr_1qbf 1 336 1 OR . 1 1 31 31 VAL H H . . . 1 1 30 30 LEU MD1 H . . . . . 2.5 1.8 5.1 . . . . . A . 31 VAL H . . A . 30 LEU MD1 . . . 31 . HN . . . . . 30 . HD++ . . rr_1qbf 1 336 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 31 31 VAL H H . . . . . 2.5 1.8 5.1 . . . . . A . 30 LEU MD2 . . A . 31 VAL H . . . 30 . HD++ . . . . . 31 . HN . . rr_1qbf 1 337 1 . . 1 1 31 31 VAL H H . . . 1 1 30 30 LEU HG H . . . . . 3.0 1.8 3.5 . . . . . A . 31 VAL H . . A . 30 LEU HG . . . 31 . HN . . . . . 30 . HG . . rr_1qbf 1 338 1 OR . 1 1 31 31 VAL MG1 H . . . 1 1 30 30 LEU MD1 H . . . . . 2.5 1.8 6.1 . . . . . A . 31 VAL MG1 . . A . 30 LEU MD1 . . . 31 . HG1+ . . . . . 30 . HD++ . . rr_1qbf 1 338 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 31 31 VAL MG1 H . . . . . 2.5 1.8 6.1 . . . . . A . 30 LEU MD2 . . A . 31 VAL MG1 . . . 30 . HD++ . . . . . 31 . HG1+ . . rr_1qbf 1 339 1 OR . 1 1 30 30 LEU MD1 H . . . 1 1 31 31 VAL MG2 H . . . . . 4.0 1.8 8.4 . . . . . A . 30 LEU MD1 . . A . 31 VAL MG2 . . . 30 . HD++ . . . . . 31 . HG2+ . . rr_1qbf 1 339 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 31 31 VAL MG2 H . . . . . 4.0 1.8 8.4 . . . . . A . 30 LEU MD2 . . A . 31 VAL MG2 . . . 30 . HD++ . . . . . 31 . HG2+ . . rr_1qbf 1 340 1 . . 1 1 30 30 LEU H H . . . 1 1 32 32 THR HA H . . . . . 4.0 1.8 6.0 . . . . . A . 30 LEU H . . A . 32 THR HA . . . 30 . HN . . . . . 32 . HA . . rr_1qbf 1 341 1 OR . 1 1 30 30 LEU HB2 H . . . 1 1 31 31 VAL MG2 H . . . . . 4.0 1.8 8.4 . . . . . A . 30 LEU HB2 . . A . 31 VAL MG2 . . . 30 . HB+ . . . . . 31 . HG++ . . rr_1qbf 1 341 2 OR . 1 1 30 30 LEU HB3 H . . . 1 1 31 31 VAL MG2 H . . . . . 4.0 1.8 8.4 . . . . . A . 30 LEU HB3 . . A . 31 VAL MG2 . . . 30 . HB+ . . . . . 31 . HG++ . . rr_1qbf 1 341 3 OR . 1 1 31 31 VAL MG1 H . . . 1 1 30 30 LEU HB2 H . . . . . 4.0 1.8 8.4 . . . . . A . 31 VAL MG1 . . A . 30 LEU HB2 . . . 31 . HG++ . . . . . 30 . HB+ . . rr_1qbf 1 341 4 OR . 1 1 31 31 VAL MG1 H . . . 1 1 30 30 LEU HB3 H . . . . . 4.0 1.8 8.4 . . . . . A . 31 VAL MG1 . . A . 30 LEU HB3 . . . 31 . HG++ . . . . . 30 . HB+ . . rr_1qbf 1 342 1 . . 1 1 30 30 LEU H H . . . 1 1 31 31 VAL H H . . . . . 2.5 1.8 2.7 . . . . . A . 30 LEU H . . A . 31 VAL H . . . 30 . HN . . . . . 31 . HN . . rr_1qbf 1 343 1 OR . 1 1 30 30 LEU HA H . . . 1 1 34 34 GLN HE22 H . . . . . 4.0 1.8 7.0 . . . . . A . 30 LEU HA . . A . 34 GLN HE22 . . . 30 . HA . . . . . 34 . HE2+ . . rr_1qbf 1 343 2 OR . 1 1 30 30 LEU HA H . . . 1 1 34 34 GLN HE21 H . . . . . 4.0 1.8 7.0 . . . . . A . 30 LEU HA . . A . 34 GLN HE21 . . . 30 . HA . . . . . 34 . HE2+ . . rr_1qbf 1 344 1 OR . 1 1 35 35 ARG H H . . . 1 1 30 30 LEU MD1 H . . . . . 4.0 1.8 7.9 . . . . . A . 35 ARG H . . A . 30 LEU MD1 . . . 35 . HN . . . . . 30 . HD++ . . rr_1qbf 1 344 2 OR . 1 1 30 30 LEU MD2 H . . . 1 1 35 35 ARG H H . . . . . 4.0 1.8 7.9 . . . . . A . 30 LEU MD2 . . A . 35 ARG H . . . 30 . HD++ . . . . . 35 . HN . . rr_1qbf 1 345 1 . . 1 1 30 30 LEU O O . . . 1 1 34 34 GLN H H . . . . . 2.5 1.8 2.7 . . . . . A . 30 LEU O . . A . 34 GLN H . . . 30 . O . . . . . 34 . HN . . rr_1qbf 1 346 1 . . 1 1 31 31 VAL MG1 H . . . 1 1 31 31 VAL H H . . . . . 3.0 1.8 4.5 . . . . . A . 31 VAL MG1 . . A . 31 VAL H . . . 31 . HG1+ . . . . . 31 . HN . . rr_1qbf 1 347 1 . . 1 1 31 31 VAL H H . . . 1 1 31 31 VAL MG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 31 VAL H . . A . 31 VAL MG2 . . . 31 . HN . . . . . 31 . HG2+ . . rr_1qbf 1 348 1 . . 1 1 31 31 VAL MG1 H . . . 1 1 31 31 VAL HB H . . . . . 2.5 1.8 3.7 . . . . . A . 31 VAL MG1 . . A . 31 VAL HB . . . 31 . HG1+ . . . . . 31 . HB . . rr_1qbf 1 349 1 . . 1 1 31 31 VAL HB H . . . 1 1 31 31 VAL MG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 31 VAL HB . . A . 31 VAL MG2 . . . 31 . HB . . . . . 31 . HG2+ . . rr_1qbf 1 350 1 . . 1 1 31 31 VAL HA H . . . 1 1 31 31 VAL H H . . . . . 2.5 1.8 2.7 . . . . . A . 31 VAL HA . . A . 31 VAL H . . . 31 . HA . . . . . 31 . HN . . rr_1qbf 1 351 1 OR . 1 1 31 31 VAL H H . . . 1 1 31 31 VAL MG2 H . . . . . 2.5 1.8 5.4 . . . . . A . 31 VAL H . . A . 31 VAL MG2 . . . 31 . HN . . . . . 31 . HG++ . . rr_1qbf 1 351 2 OR . 1 1 31 31 VAL MG1 H . . . 1 1 31 31 VAL H H . . . . . 2.5 1.8 5.4 . . . . . A . 31 VAL MG1 . . A . 31 VAL H . . . 31 . HG++ . . . . . 31 . HN . . rr_1qbf 1 352 1 . . 1 1 31 31 VAL HA H . . . 1 1 31 31 VAL HB H . . . . . 2.5 1.8 2.7 . . . . . A . 31 VAL HA . . A . 31 VAL HB . . . 31 . HA . . . . . 31 . HB . . rr_1qbf 1 353 1 . . 1 1 31 31 VAL HA H . . . 1 1 31 31 VAL MG1 H . . . . . 2.5 1.8 3.7 . . . . . A . 31 VAL HA . . A . 31 VAL MG1 . . . 31 . HA . . . . . 31 . HG1+ . . rr_1qbf 1 354 1 . . 1 1 31 31 VAL HA H . . . 1 1 31 31 VAL MG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 31 VAL HA . . A . 31 VAL MG2 . . . 31 . HA . . . . . 31 . HG2+ . . rr_1qbf 1 355 1 . . 1 1 31 31 VAL HA H . . . 1 1 32 32 THR HA H . . . . . 4.0 1.8 5.0 . . . . . A . 31 VAL HA . . A . 32 THR HA . . . 31 . HA . . . . . 32 . HA . . rr_1qbf 1 356 1 . . 1 1 31 31 VAL MG1 H . . . 1 1 32 32 THR H H . . . . . 3.0 1.8 4.5 . . . . . A . 31 VAL MG1 . . A . 32 THR H . . . 31 . HG1+ . . . . . 32 . HN . . rr_1qbf 1 357 1 . . 1 1 32 32 THR H H . . . 1 1 31 31 VAL MG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 32 THR H . . A . 31 VAL MG2 . . . 32 . HN . . . . . 31 . HG2+ . . rr_1qbf 1 358 1 . . 1 1 31 31 VAL MG1 H . . . 1 1 32 32 THR MG H . . . . . 4.0 1.8 7.0 . . . . . A . 31 VAL MG1 . . A . 32 THR MG . . . 31 . HG1+ . . . . . 32 . HG2+ . . rr_1qbf 1 359 1 . . 1 1 32 32 THR MG H . . . 1 1 31 31 VAL MG2 H . . . . . 3.0 1.8 5.5 . . . . . A . 32 THR MG . . A . 31 VAL MG2 . . . 32 . HG2+ . . . . . 31 . HG2+ . . rr_1qbf 1 360 1 . . 1 1 31 31 VAL HA H . . . 1 1 32 32 THR HB H . . . . . 4.0 1.8 6.0 . . . . . A . 31 VAL HA . . A . 32 THR HB . . . 31 . HA . . . . . 32 . HB . . rr_1qbf 1 361 1 . . 1 1 31 31 VAL HA H . . . 1 1 35 35 ARG H H . . . . . 4.0 1.8 5.6 . . . . . A . 31 VAL HA . . A . 35 ARG H . . . 31 . HA . . . . . 35 . HN . . rr_1qbf 1 362 1 OR . 1 1 35 35 ARG HE H . . . 1 1 31 31 VAL MG2 H . . . . . 4.0 1.8 7.4 . . . . . A . 35 ARG HE . . A . 31 VAL MG2 . . . 35 . HE . . . . . 31 . HG++ . . rr_1qbf 1 362 2 OR . 1 1 31 31 VAL MG1 H . . . 1 1 35 35 ARG HE H . . . . . 4.0 1.8 7.4 . . . . . A . 31 VAL MG1 . . A . 35 ARG HE . . . 31 . HG++ . . . . . 35 . HE . . rr_1qbf 1 363 1 . . 1 1 31 31 VAL HB H . . . 1 1 32 32 THR H H . . . . . 4.0 1.8 5.0 . . . . . A . 31 VAL HB . . A . 32 THR H . . . 31 . HB . . . . . 32 . HN . . rr_1qbf 1 364 1 OR . 1 1 31 31 VAL HA H . . . 1 1 32 32 THR MG H . . . . . 2.5 1.8 5.1 . . . . . A . 31 VAL HA . . A . 32 THR MG . . . 31 . HA . . . . . 32 . HG++ . . rr_1qbf 1 364 2 OR . 1 1 31 31 VAL HA H . . . 1 1 32 32 THR HG1 H . . . . . 2.5 1.8 5.1 . . . . . A . 31 VAL HA . . A . 32 THR HG1 . . . 31 . HA . . . . . 32 . HG++ . . rr_1qbf 1 365 1 . . 1 1 31 31 VAL MG1 H . . . 1 1 32 32 THR HA H . . . . . 4.0 1.8 6.5 . . . . . A . 31 VAL MG1 . . A . 32 THR HA . . . 31 . HG1+ . . . . . 32 . HA . . rr_1qbf 1 366 1 . . 1 1 32 32 THR HA H . . . 1 1 31 31 VAL MG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 32 THR HA . . A . 31 VAL MG2 . . . 32 . HA . . . . . 31 . HG2+ . . rr_1qbf 1 367 1 OR . 1 1 32 32 THR HB H . . . 1 1 31 31 VAL MG2 H . . . . . 4.0 1.8 7.4 . . . . . A . 32 THR HB . . A . 31 VAL MG2 . . . 32 . HB . . . . . 31 . HG++ . . rr_1qbf 1 367 2 OR . 1 1 31 31 VAL MG1 H . . . 1 1 32 32 THR HB H . . . . . 4.0 1.8 7.4 . . . . . A . 31 VAL MG1 . . A . 32 THR HB . . . 31 . HG++ . . . . . 32 . HB . . rr_1qbf 1 368 1 . . 1 1 32 32 THR H H . . . 1 1 32 32 THR HA H . . . . . 2.5 1.8 2.7 . . . . . A . 32 THR H . . A . 32 THR HA . . . 32 . HN . . . . . 32 . HA . . rr_1qbf 1 369 1 . . 1 1 32 32 THR HB H . . . 1 1 32 32 THR H H . . . . . 3.0 1.8 3.5 . . . . . A . 32 THR HB . . A . 32 THR H . . . 32 . HB . . . . . 32 . HN . . rr_1qbf 1 370 1 . . 1 1 32 32 THR H H . . . 1 1 32 32 THR MG H . . . . . 2.5 1.8 3.7 . . . . . A . 32 THR H . . A . 32 THR MG . . . 32 . HN . . . . . 32 . HG2+ . . rr_1qbf 1 371 1 OR . 1 1 32 32 THR HA H . . . 1 1 32 32 THR MG H . . . . . 2.5 1.8 5.1 . . . . . A . 32 THR HA . . A . 32 THR MG . . . 32 . HA . . . . . 32 . HG++ . . rr_1qbf 1 371 2 OR . 1 1 32 32 THR HA H . . . 1 1 32 32 THR HG1 H . . . . . 2.5 1.8 5.1 . . . . . A . 32 THR HA . . A . 32 THR HG1 . . . 32 . HA . . . . . 32 . HG++ . . rr_1qbf 1 372 1 OR . 1 1 32 32 THR HB H . . . 1 1 32 32 THR MG H . . . . . 2.5 1.8 5.1 . . . . . A . 32 THR HB . . A . 32 THR MG . . . 32 . HB . . . . . 32 . HG++ . . rr_1qbf 1 372 2 OR . 1 1 32 32 THR HB H . . . 1 1 32 32 THR HG1 H . . . . . 2.5 1.8 5.1 . . . . . A . 32 THR HB . . A . 32 THR HG1 . . . 32 . HB . . . . . 32 . HG++ . . rr_1qbf 1 373 1 . . 1 1 33 33 ARG H H . . . 1 1 32 32 THR HA H . . . . . 4.0 1.8 5.0 . . . . . A . 33 ARG H . . A . 32 THR HA . . . 33 . HN . . . . . 32 . HA . . rr_1qbf 1 374 1 . . 1 1 32 32 THR HB H . . . 1 1 33 33 ARG H H . . . . . 4.0 1.8 5.0 . . . . . A . 32 THR HB . . A . 33 ARG H . . . 32 . HB . . . . . 33 . HN . . rr_1qbf 1 375 1 OR . 1 1 32 32 THR HB H . . . 1 1 33 33 ARG HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 32 THR HB . . A . 33 ARG HD2 . . . 32 . HB . . . . . 33 . HD+ . . rr_1qbf 1 375 2 OR . 1 1 32 32 THR HB H . . . 1 1 33 33 ARG HD3 H . . . . . 4.0 1.8 6.0 . . . . . A . 32 THR HB . . A . 33 ARG HD3 . . . 32 . HB . . . . . 33 . HD+ . . rr_1qbf 1 376 1 . . 1 1 32 32 THR H H . . . 1 1 34 34 GLN H H . . . . . 4.0 1.8 5.0 . . . . . A . 32 THR H . . A . 34 GLN H . . . 32 . HN . . . . . 34 . HN . . rr_1qbf 1 377 1 OR . 1 1 32 32 THR HB H . . . 1 1 34 34 GLN HE22 H . . . . . 3.0 1.8 4.5 . . . . . A . 32 THR HB . . A . 34 GLN HE22 . . . 32 . HB . . . . . 34 . HE2+ . . rr_1qbf 1 377 2 OR . 1 1 32 32 THR HB H . . . 1 1 34 34 GLN HE21 H . . . . . 3.0 1.8 4.5 . . . . . A . 32 THR HB . . A . 34 GLN HE21 . . . 32 . HB . . . . . 34 . HE2+ . . rr_1qbf 1 378 1 . . 1 1 34 34 GLN H H . . . 1 1 32 32 THR MG H . . . . . 4.0 1.8 6.0 . . . . . A . 34 GLN H . . A . 32 THR MG . . . 34 . HN . . . . . 32 . HG2+ . . rr_1qbf 1 379 1 OR . 1 1 32 32 THR H H . . . 1 1 33 33 ARG HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 32 THR H . . A . 33 ARG HG2 . . . 32 . HN . . . . . 33 . HG+ . . rr_1qbf 1 379 2 OR . 1 1 32 32 THR H H . . . 1 1 33 33 ARG HG3 H . . . . . 4.0 1.8 6.0 . . . . . A . 32 THR H . . A . 33 ARG HG3 . . . 32 . HN . . . . . 33 . HG+ . . rr_1qbf 1 380 1 OR . 1 1 33 33 ARG H H . . . 1 1 33 33 ARG HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 33 ARG H . . A . 33 ARG HD2 . . . 33 . HN . . . . . 33 . HD+ . . rr_1qbf 1 380 2 OR . 1 1 33 33 ARG H H . . . 1 1 33 33 ARG HD3 H . . . . . 4.0 1.8 6.0 . . . . . A . 33 ARG H . . A . 33 ARG HD3 . . . 33 . HN . . . . . 33 . HD+ . . rr_1qbf 1 381 1 OR . 1 1 33 33 ARG HE H . . . 1 1 33 33 ARG HB2 H . . . . . 3.0 1.8 4.5 . . . . . A . 33 ARG HE . . A . 33 ARG HB2 . . . 33 . HE . . . . . 33 . HB+ . . rr_1qbf 1 381 2 OR . 1 1 33 33 ARG HB3 H . . . 1 1 33 33 ARG HE H . . . . . 3.0 1.8 4.5 . . . . . A . 33 ARG HB3 . . A . 33 ARG HE . . . 33 . HB+ . . . . . 33 . HE . . rr_1qbf 1 382 1 OR . 1 1 33 33 ARG HE H . . . 1 1 33 33 ARG HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 33 ARG HE . . A . 33 ARG HG2 . . . 33 . HE . . . . . 33 . HG+ . . rr_1qbf 1 382 2 OR . 1 1 33 33 ARG HG3 H . . . 1 1 33 33 ARG HE H . . . . . 2.5 1.8 3.7 . . . . . A . 33 ARG HG3 . . A . 33 ARG HE . . . 33 . HG+ . . . . . 33 . HE . . rr_1qbf 1 383 1 OR . 1 1 33 33 ARG HA H . . . 1 1 33 33 ARG HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 33 ARG HA . . A . 33 ARG HD2 . . . 33 . HA . . . . . 33 . HD+ . . rr_1qbf 1 383 2 OR . 1 1 33 33 ARG HD3 H . . . 1 1 33 33 ARG HA H . . . . . 4.0 1.8 6.0 . . . . . A . 33 ARG HD3 . . A . 33 ARG HA . . . 33 . HD+ . . . . . 33 . HA . . rr_1qbf 1 384 1 . . 1 1 35 35 ARG H H . . . 1 1 33 33 ARG H H . . . . . 3.0 1.8 3.5 . . . . . A . 35 ARG H . . A . 33 ARG H . . . 35 . HN . . . . . 33 . HN . . rr_1qbf 1 385 1 . . 1 1 33 33 ARG H H . . . 1 1 34 34 GLN H H . . . . . 2.5 1.8 2.7 . . . . . A . 33 ARG H . . A . 34 GLN H . . . 33 . HN . . . . . 34 . HN . . rr_1qbf 1 386 1 OR . 1 1 34 34 GLN H H . . . 1 1 33 33 ARG HD2 H . . . . . 3.0 1.8 4.5 . . . . . A . 34 GLN H . . A . 33 ARG HD2 . . . 34 . HN . . . . . 33 . HD+ . . rr_1qbf 1 386 2 OR . 1 1 34 34 GLN H H . . . 1 1 33 33 ARG HD3 H . . . . . 3.0 1.8 4.5 . . . . . A . 34 GLN H . . A . 33 ARG HD3 . . . 34 . HN . . . . . 33 . HD+ . . rr_1qbf 1 387 1 . . 1 1 33 33 ARG H H . . . 1 1 34 34 GLN HA H . . . . . 4.0 1.8 5.0 . . . . . A . 33 ARG H . . A . 34 GLN HA . . . 33 . HN . . . . . 34 . HA . . rr_1qbf 1 388 1 OR . 1 1 33 33 ARG HD3 H . . . 1 1 34 34 GLN HE22 H . . . . . 2.5 1.8 4.7 . . . . . A . 33 ARG HD3 . . A . 34 GLN HE22 . . . 33 . HD+ . . . . . 34 . HE2+ . . rr_1qbf 1 388 2 OR . 1 1 33 33 ARG HD2 H . . . 1 1 34 34 GLN HE22 H . . . . . 2.5 1.8 4.7 . . . . . A . 33 ARG HD2 . . A . 34 GLN HE22 . . . 33 . HD+ . . . . . 34 . HE2+ . . rr_1qbf 1 388 3 OR . 1 1 34 34 GLN HE21 H . . . 1 1 33 33 ARG HD2 H . . . . . 2.5 1.8 4.7 . . . . . A . 34 GLN HE21 . . A . 33 ARG HD2 . . . 34 . HE2+ . . . . . 33 . HD+ . . rr_1qbf 1 388 4 OR . 1 1 34 34 GLN HE21 H . . . 1 1 33 33 ARG HD3 H . . . . . 2.5 1.8 4.7 . . . . . A . 34 GLN HE21 . . A . 33 ARG HD3 . . . 34 . HE2+ . . . . . 33 . HD+ . . rr_1qbf 1 389 1 OR . 1 1 35 35 ARG HE H . . . 1 1 33 33 ARG HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 35 ARG HE . . A . 33 ARG HG2 . . . 35 . HE . . . . . 33 . HG+ . . rr_1qbf 1 389 2 OR . 1 1 35 35 ARG HE H . . . 1 1 33 33 ARG HG3 H . . . . . 4.0 1.8 6.0 . . . . . A . 35 ARG HE . . A . 33 ARG HG3 . . . 35 . HE . . . . . 33 . HG+ . . rr_1qbf 1 390 1 OR . 1 1 33 33 ARG HB2 H . . . 1 1 34 34 GLN HE22 H . . . . . 3.0 1.8 5.5 . . . . . A . 33 ARG HB2 . . A . 34 GLN HE22 . . . 33 . HB+ . . . . . 34 . HE2+ . . rr_1qbf 1 390 2 OR . 1 1 34 34 GLN HE21 H . . . 1 1 33 33 ARG HB2 H . . . . . 3.0 1.8 5.5 . . . . . A . 34 GLN HE21 . . A . 33 ARG HB2 . . . 34 . HE2+ . . . . . 33 . HB+ . . rr_1qbf 1 390 3 OR . 1 1 34 34 GLN HE21 H . . . 1 1 33 33 ARG HB3 H . . . . . 3.0 1.8 5.5 . . . . . A . 34 GLN HE21 . . A . 33 ARG HB3 . . . 34 . HE2+ . . . . . 33 . HB+ . . rr_1qbf 1 390 4 OR . 1 1 33 33 ARG HB3 H . . . 1 1 34 34 GLN HE22 H . . . . . 3.0 1.8 5.5 . . . . . A . 33 ARG HB3 . . A . 34 GLN HE22 . . . 33 . HB+ . . . . . 34 . HE2+ . . rr_1qbf 1 391 1 OR . 1 1 33 33 ARG HG2 H . . . 1 1 34 34 GLN HE22 H . . . . . 3.0 1.8 5.5 . . . . . A . 33 ARG HG2 . . A . 34 GLN HE22 . . . 33 . HG+ . . . . . 34 . HE2+ . . rr_1qbf 1 391 2 OR . 1 1 33 33 ARG HG3 H . . . 1 1 34 34 GLN HE22 H . . . . . 3.0 1.8 5.5 . . . . . A . 33 ARG HG3 . . A . 34 GLN HE22 . . . 33 . HG+ . . . . . 34 . HE2+ . . rr_1qbf 1 391 3 OR . 1 1 34 34 GLN HE21 H . . . 1 1 33 33 ARG HG2 H . . . . . 3.0 1.8 5.5 . . . . . A . 34 GLN HE21 . . A . 33 ARG HG2 . . . 34 . HE2+ . . . . . 33 . HG+ . . rr_1qbf 1 391 4 OR . 1 1 34 34 GLN HE21 H . . . 1 1 33 33 ARG HG3 H . . . . . 3.0 1.8 5.5 . . . . . A . 34 GLN HE21 . . A . 33 ARG HG3 . . . 34 . HE2+ . . . . . 33 . HG+ . . rr_1qbf 1 392 1 . . 1 1 34 34 GLN H H . . . 1 1 34 34 GLN HA H . . . . . 2.5 1.8 2.7 . . . . . A . 34 GLN H . . A . 34 GLN HA . . . 34 . HN . . . . . 34 . HA . . rr_1qbf 1 393 1 OR . 1 1 34 34 GLN H H . . . 1 1 34 34 GLN HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 34 GLN H . . A . 34 GLN HB2 . . . 34 . HN . . . . . 34 . HB+ . . rr_1qbf 1 393 2 OR . 1 1 34 34 GLN H H . . . 1 1 34 34 GLN HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 34 GLN H . . A . 34 GLN HB3 . . . 34 . HN . . . . . 34 . HB+ . . rr_1qbf 1 394 1 OR . 1 1 34 34 GLN H H . . . 1 1 34 34 GLN HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 34 GLN H . . A . 34 GLN HG2 . . . 34 . HN . . . . . 34 . HG+ . . rr_1qbf 1 394 2 OR . 1 1 34 34 GLN H H . . . 1 1 34 34 GLN HG3 H . . . . . 2.5 1.8 3.7 . . . . . A . 34 GLN H . . A . 34 GLN HG3 . . . 34 . HN . . . . . 34 . HG+ . . rr_1qbf 1 395 1 OR . 1 1 34 34 GLN HA H . . . 1 1 34 34 GLN HE22 H . . . . . 3.0 1.8 4.5 . . . . . A . 34 GLN HA . . A . 34 GLN HE22 . . . 34 . HA . . . . . 34 . HE2+ . . rr_1qbf 1 395 2 OR . 1 1 34 34 GLN HE21 H . . . 1 1 34 34 GLN HA H . . . . . 3.0 1.8 4.5 . . . . . A . 34 GLN HE21 . . A . 34 GLN HA . . . 34 . HE2+ . . . . . 34 . HA . . rr_1qbf 1 396 1 OR . 1 1 34 34 GLN HB2 H . . . 1 1 34 34 GLN HE22 H . . . . . 2.5 1.8 4.7 . . . . . A . 34 GLN HB2 . . A . 34 GLN HE22 . . . 34 . HB+ . . . . . 34 . HE2+ . . rr_1qbf 1 396 2 OR . 1 1 34 34 GLN HB3 H . . . 1 1 34 34 GLN HE22 H . . . . . 2.5 1.8 4.7 . . . . . A . 34 GLN HB3 . . A . 34 GLN HE22 . . . 34 . HB+ . . . . . 34 . HE2+ . . rr_1qbf 1 396 3 OR . 1 1 34 34 GLN HE21 H . . . 1 1 34 34 GLN HB2 H . . . . . 2.5 1.8 4.7 . . . . . A . 34 GLN HE21 . . A . 34 GLN HB2 . . . 34 . HE2+ . . . . . 34 . HB+ . . rr_1qbf 1 396 4 OR . 1 1 34 34 GLN HE21 H . . . 1 1 34 34 GLN HB3 H . . . . . 2.5 1.8 4.7 . . . . . A . 34 GLN HE21 . . A . 34 GLN HB3 . . . 34 . HE2+ . . . . . 34 . HB+ . . rr_1qbf 1 397 1 OR . 1 1 34 34 GLN HE21 H . . . 1 1 34 34 GLN HG2 H . . . . . 2.5 1.8 4.7 . . . . . A . 34 GLN HE21 . . A . 34 GLN HG2 . . . 34 . HE2+ . . . . . 34 . HG+ . . rr_1qbf 1 397 2 OR . 1 1 34 34 GLN HE22 H . . . 1 1 34 34 GLN HG2 H . . . . . 2.5 1.8 4.7 . . . . . A . 34 GLN HE22 . . A . 34 GLN HG2 . . . 34 . HE2+ . . . . . 34 . HG+ . . rr_1qbf 1 397 3 OR . 1 1 34 34 GLN HG3 H . . . 1 1 34 34 GLN HE22 H . . . . . 2.5 1.8 4.7 . . . . . A . 34 GLN HG3 . . A . 34 GLN HE22 . . . 34 . HG+ . . . . . 34 . HE2+ . . rr_1qbf 1 397 4 OR . 1 1 34 34 GLN HE21 H . . . 1 1 34 34 GLN HG3 H . . . . . 2.5 1.8 4.7 . . . . . A . 34 GLN HE21 . . A . 34 GLN HG3 . . . 34 . HE2+ . . . . . 34 . HG+ . . rr_1qbf 1 398 1 OR . 1 1 34 34 GLN HA H . . . 1 1 34 34 GLN HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 34 GLN HA . . A . 34 GLN HB2 . . . 34 . HA . . . . . 34 . HB+ . . rr_1qbf 1 398 2 OR . 1 1 34 34 GLN HA H . . . 1 1 34 34 GLN HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 34 GLN HA . . A . 34 GLN HB3 . . . 34 . HA . . . . . 34 . HB+ . . rr_1qbf 1 399 1 OR . 1 1 34 34 GLN H H . . . 1 1 35 35 ARG HG2 H . . . . . 4.0 1.8 6.4 . . . . . A . 34 GLN H . . A . 35 ARG HG2 . . . 34 . HN . . . . . 35 . HG+ . . rr_1qbf 1 399 2 OR . 1 1 34 34 GLN H H . . . 1 1 35 35 ARG HB2 H . . . . . 4.0 1.8 6.4 . . . . . A . 34 GLN H . . A . 35 ARG HB2 . . . 34 . HN . . . . . 35 . HB+ . . rr_1qbf 1 399 3 OR . 1 1 34 34 GLN H H . . . 1 1 35 35 ARG HG3 H . . . . . 4.0 1.8 6.4 . . . . . A . 34 GLN H . . A . 35 ARG HG3 . . . 34 . HN . . . . . 35 . HG+ . . rr_1qbf 1 399 4 OR . 1 1 34 34 GLN H H . . . 1 1 35 35 ARG HB3 H . . . . . 4.0 1.8 6.4 . . . . . A . 34 GLN H . . A . 35 ARG HB3 . . . 34 . HN . . . . . 35 . HB+ . . rr_1qbf 1 400 1 OR . 1 1 35 35 ARG H H . . . 1 1 34 34 GLN HE22 H . . . . . 4.0 1.8 6.0 . . . . . A . 35 ARG H . . A . 34 GLN HE22 . . . 35 . HN . . . . . 34 . HE2+ . . rr_1qbf 1 400 2 OR . 1 1 35 35 ARG H H . . . 1 1 34 34 GLN HE21 H . . . . . 4.0 1.8 6.0 . . . . . A . 35 ARG H . . A . 34 GLN HE21 . . . 35 . HN . . . . . 34 . HE2+ . . rr_1qbf 1 401 1 OR . 1 1 34 34 GLN HE21 H . . . 1 1 35 35 ARG HD2 H . . . . . 4.0 1.8 7.0 . . . . . A . 34 GLN HE21 . . A . 35 ARG HD2 . . . 34 . HE2+ . . . . . 35 . HD+ . . rr_1qbf 1 401 2 OR . 1 1 34 34 GLN HE22 H . . . 1 1 35 35 ARG HD2 H . . . . . 4.0 1.8 7.0 . . . . . A . 34 GLN HE22 . . A . 35 ARG HD2 . . . 34 . HE2+ . . . . . 35 . HD+ . . rr_1qbf 1 401 3 OR . 1 1 35 35 ARG HD3 H . . . 1 1 34 34 GLN HE22 H . . . . . 4.0 1.8 7.0 . . . . . A . 35 ARG HD3 . . A . 34 GLN HE22 . . . 35 . HD+ . . . . . 34 . HE2+ . . rr_1qbf 1 401 4 OR . 1 1 34 34 GLN HE21 H . . . 1 1 35 35 ARG HD3 H . . . . . 4.0 1.8 7.0 . . . . . A . 34 GLN HE21 . . A . 35 ARG HD3 . . . 34 . HE2+ . . . . . 35 . HD+ . . rr_1qbf 1 402 1 OR . 1 1 35 35 ARG HE H . . . 1 1 34 34 GLN HB2 H . . . . . 4.0 1.8 6.4 . . . . . A . 35 ARG HE . . A . 34 GLN HB2 . . . 35 . HE . . . . . 34 . HB+ . . rr_1qbf 1 402 2 OR . 1 1 35 35 ARG HE H . . . 1 1 34 34 GLN HG2 H . . . . . 4.0 1.8 6.4 . . . . . A . 35 ARG HE . . A . 34 GLN HG2 . . . 35 . HE . . . . . 34 . HG+ . . rr_1qbf 1 402 3 OR . 1 1 35 35 ARG HE H . . . 1 1 34 34 GLN HG3 H . . . . . 4.0 1.8 6.4 . . . . . A . 35 ARG HE . . A . 34 GLN HG3 . . . 35 . HE . . . . . 34 . HG+ . . rr_1qbf 1 402 4 OR . 1 1 35 35 ARG HE H . . . 1 1 34 34 GLN HB3 H . . . . . 4.0 1.8 6.4 . . . . . A . 35 ARG HE . . A . 34 GLN HB3 . . . 35 . HE . . . . . 34 . HB+ . . rr_1qbf 1 403 1 . . 1 1 35 35 ARG H H . . . 1 1 35 35 ARG HA H . . . . . 2.5 1.8 2.7 . . . . . A . 35 ARG H . . A . 35 ARG HA . . . 35 . HN . . . . . 35 . HA . . rr_1qbf 1 404 1 OR . 1 1 35 35 ARG HA H . . . 1 1 35 35 ARG HD2 H . . . . . 3.0 1.8 4.5 . . . . . A . 35 ARG HA . . A . 35 ARG HD2 . . . 35 . HA . . . . . 35 . HD+ . . rr_1qbf 1 404 2 OR . 1 1 35 35 ARG HD3 H . . . 1 1 35 35 ARG HA H . . . . . 3.0 1.8 4.5 . . . . . A . 35 ARG HD3 . . A . 35 ARG HA . . . 35 . HD+ . . . . . 35 . HA . . rr_1qbf 1 405 1 OR . 1 1 35 35 ARG H H . . . 1 1 35 35 ARG HB2 H . . . . . 3.0 1.8 4.1 . . . . . A . 35 ARG H . . A . 35 ARG HB2 . . . 35 . HN . . . . . 35 . HB+ . . rr_1qbf 1 405 2 OR . 1 1 35 35 ARG H H . . . 1 1 35 35 ARG HB3 H . . . . . 3.0 1.8 4.1 . . . . . A . 35 ARG H . . A . 35 ARG HB3 . . . 35 . HN . . . . . 35 . HB+ . . rr_1qbf 1 406 1 OR . 1 1 35 35 ARG H H . . . 1 1 35 35 ARG HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 35 ARG H . . A . 35 ARG HG2 . . . 35 . HN . . . . . 35 . HG+ . . rr_1qbf 1 406 2 OR . 1 1 35 35 ARG H H . . . 1 1 35 35 ARG HG3 H . . . . . 2.5 1.8 3.7 . . . . . A . 35 ARG H . . A . 35 ARG HG3 . . . 35 . HN . . . . . 35 . HG+ . . rr_1qbf 1 407 1 OR . 1 1 35 35 ARG H H . . . 1 1 35 35 ARG HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 35 ARG H . . A . 35 ARG HD2 . . . 35 . HN . . . . . 35 . HD+ . . rr_1qbf 1 407 2 OR . 1 1 35 35 ARG H H . . . 1 1 35 35 ARG HD3 H . . . . . 4.0 1.8 6.0 . . . . . A . 35 ARG H . . A . 35 ARG HD3 . . . 35 . HN . . . . . 35 . HD+ . . rr_1qbf 1 408 1 . . 1 1 35 35 ARG HE H . . . 1 1 35 35 ARG HA H . . . . . 2.5 1.8 3.5 . . . . . A . 35 ARG HE . . A . 35 ARG HA . . . 35 . HE . . . . . 35 . HA . . rr_1qbf 1 409 1 OR . 1 1 35 35 ARG HE H . . . 1 1 35 35 ARG HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 35 ARG HE . . A . 35 ARG HB2 . . . 35 . HE . . . . . 35 . HB+ . . rr_1qbf 1 409 2 OR . 1 1 35 35 ARG HE H . . . 1 1 35 35 ARG HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 35 ARG HE . . A . 35 ARG HB3 . . . 35 . HE . . . . . 35 . HB+ . . rr_1qbf 1 410 1 OR . 1 1 35 35 ARG HA H . . . 1 1 35 35 ARG HB2 H . . . . . 2.5 1.8 3.7 . . . . . A . 35 ARG HA . . A . 35 ARG HB2 . . . 35 . HA . . . . . 35 . HB+ . . rr_1qbf 1 410 2 OR . 1 1 35 35 ARG HB3 H . . . 1 1 35 35 ARG HA H . . . . . 2.5 1.8 3.7 . . . . . A . 35 ARG HB3 . . A . 35 ARG HA . . . 35 . HB+ . . . . . 35 . HA . . rr_1qbf 1 411 1 OR . 1 1 35 35 ARG HA H . . . 1 1 35 35 ARG HG2 H . . . . . 2.5 1.8 3.7 . . . . . A . 35 ARG HA . . A . 35 ARG HG2 . . . 35 . HA . . . . . 35 . HG+ . . rr_1qbf 1 411 2 OR . 1 1 35 35 ARG HG3 H . . . 1 1 35 35 ARG HA H . . . . . 2.5 1.8 3.7 . . . . . A . 35 ARG HG3 . . A . 35 ARG HA . . . 35 . HG+ . . . . . 35 . HA . . rr_1qbf 1 412 1 . . 1 1 35 35 ARG HA H . . . 1 1 36 36 TYR H H . . . . . 2.5 1.8 2.7 . . . . . A . 35 ARG HA . . A . 36 TYR H . . . 35 . HA . . . . . 36 . HN . . rr_1qbf 1 413 1 OR . 1 1 35 35 ARG HD3 H . . . 1 1 36 36 TYR HB3 H . . . . . 3.0 1.8 5.5 . . . . . A . 35 ARG HD3 . . A . 36 TYR HB3 . . . 35 . HD+ . . . . . 36 . HB+ . . rr_1qbf 1 413 2 OR . 1 1 35 35 ARG HD2 H . . . 1 1 36 36 TYR HB3 H . . . . . 3.0 1.8 5.5 . . . . . A . 35 ARG HD2 . . A . 36 TYR HB3 . . . 35 . HD+ . . . . . 36 . HB+ . . rr_1qbf 1 413 3 OR . 1 1 36 36 TYR HB2 H . . . 1 1 35 35 ARG HD2 H . . . . . 3.0 1.8 5.5 . . . . . A . 36 TYR HB2 . . A . 35 ARG HD2 . . . 36 . HB+ . . . . . 35 . HD+ . . rr_1qbf 1 413 4 OR . 1 1 35 35 ARG HD3 H . . . 1 1 36 36 TYR HB2 H . . . . . 3.0 1.8 5.5 . . . . . A . 35 ARG HD3 . . A . 36 TYR HB2 . . . 35 . HD+ . . . . . 36 . HB+ . . rr_1qbf 1 414 1 . . 1 1 36 36 TYR HA H . . . 1 1 36 36 TYR H H . . . . . 2.5 1.8 2.7 . . . . . A . 36 TYR HA . . A . 36 TYR H . . . 36 . HA . . . . . 36 . HN . . rr_1qbf 1 415 1 OR . 1 1 36 36 TYR HB2 H . . . 1 1 36 36 TYR H H . . . . . 2.5 1.8 3.7 . . . . . A . 36 TYR HB2 . . A . 36 TYR H . . . 36 . HB+ . . . . . 36 . HN . . rr_1qbf 1 415 2 OR . 1 1 36 36 TYR H H . . . 1 1 36 36 TYR HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 36 TYR H . . A . 36 TYR HB3 . . . 36 . HN . . . . . 36 . HB+ . . rr_1qbf 1 416 1 . . 1 1 36 36 TYR CG C . . . 1 1 36 36 TYR HB3 H . . . . . 2.5 1.8 4.7 . . . . . A . 36 TYR CG . . A . 36 TYR HB3 . . . 36 . CG . . . . . 36 . HB1 . . rr_1qbf 1 417 1 . . 1 1 36 36 TYR HB2 H . . . 1 1 36 36 TYR CG C . . . . . 2.5 1.8 4.7 . . . . . A . 36 TYR HB2 . . A . 36 TYR CG . . . 36 . HB2 . . . . . 36 . CG . . rr_1qbf 1 418 1 . . 1 1 36 36 TYR HA H . . . 1 1 36 36 TYR H H . . . . . 3.0 1.8 4.5 . . . . . A . 36 TYR HA . . A . 36 TYR H . . . 36 . HA . . . . . 36 . H+ . . rr_1qbf 1 419 1 . . 1 1 36 36 TYR H H . . . 1 1 36 36 TYR HB3 H . . . . . 2.5 1.8 3.7 . . . . . A . 36 TYR H . . A . 36 TYR HB3 . . . 36 . H+ . . . . . 36 . HB1 . . rr_1qbf 1 420 1 . . 1 1 36 36 TYR HB2 H . . . 1 1 36 36 TYR H H . . . . . 2.5 1.8 3.7 . . . . . A . 36 TYR HB2 . . A . 36 TYR H . . . 36 . HB2 . . . . . 36 . H+ . . rr_1qbf 1 421 1 . . 1 1 36 36 TYR CG C . . . 1 1 36 36 TYR H H . . . . . 2.5 1.8 4.7 . . . . . A . 36 TYR CG . . A . 36 TYR H . . . 36 . CG . . . . . 36 . HN . . rr_1qbf 1 422 1 . . 1 1 36 36 TYR HA H . . . 1 1 36 36 TYR CG C . . . . . 2.5 1.8 4.7 . . . . . A . 36 TYR HA . . A . 36 TYR CG . . . 36 . HA . . . . . 36 . CG . . rr_1qbf 1 423 1 OR . 1 1 36 36 TYR CZ C . . . 1 1 36 36 TYR HB3 H . . . . . 4.0 1.8 8.0 . . . . . A . 36 TYR CZ . . A . 36 TYR HB3 . . . 36 . CZ . . . . . 36 . HB+ . . rr_1qbf 1 423 2 OR . 1 1 36 36 TYR HB2 H . . . 1 1 36 36 TYR CZ C . . . . . 4.0 1.8 8.0 . . . . . A . 36 TYR HB2 . . A . 36 TYR CZ . . . 36 . HB+ . . . . . 36 . CZ . . rr_1qbf 1 stop_ loop_ _Gen_dist_constraint_comment_org.ID _Gen_dist_constraint_comment_org.Comment_text _Gen_dist_constraint_comment_org.Comment_begin_line _Gen_dist_constraint_comment_org.Comment_begin_column _Gen_dist_constraint_comment_org.Comment_end_line _Gen_dist_constraint_comment_org.Comment_end_column _Gen_dist_constraint_comment_org.Entry_ID _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID 1 ; 11/12/98 Y1 ; 1 1 2 5 rr_1qbf 1 2 P2 14 1 14 5 rr_1qbf 1 3 A3 21 1 21 5 rr_1qbf 1 4 K4 34 1 34 5 rr_1qbf 1 5 P5 41 1 41 5 rr_1qbf 1 6 E6 52 1 52 5 rr_1qbf 1 7 A7 65 1 65 5 rr_1qbf 1 8 P8 75 1 75 5 rr_1qbf 1 9 G9 82 1 82 5 rr_1qbf 1 10 E10 92 1 92 6 rr_1qbf 1 11 D11 106 1 106 6 rr_1qbf 1 12 A12 113 1 113 6 rr_1qbf 1 13 S13 125 1 125 6 rr_1qbf 1 14 P14 132 1 132 6 rr_1qbf 1 15 E15 135 1 135 6 rr_1qbf 1 16 E16 151 1 151 6 rr_1qbf 1 17 L17 163 1 163 6 rr_1qbf 1 18 S18 178 1 178 6 rr_1qbf 1 19 R19 196 1 196 6 rr_1qbf 1 20 Y20 207 1 207 6 rr_1qbf 1 21 Y21 232 1 232 6 rr_1qbf 1 22 A22 254 1 254 6 rr_1qbf 1 23 S23 262 1 262 6 rr_1qbf 1 24 L24 272 1 272 6 rr_1qbf 1 25 R25 286 1 286 6 rr_1qbf 1 26 H26 302 1 302 6 rr_1qbf 1 27 Y27 315 1 315 6 rr_1qbf 1 28 L28 346 1 346 6 rr_1qbf 1 29 N29 364 1 364 6 rr_1qbf 1 30 L30 383 1 383 6 rr_1qbf 1 31 V31 406 1 406 6 rr_1qbf 1 32 T32 430 1 430 6 rr_1qbf 1 33 R33 444 1 444 6 rr_1qbf 1 34 Q34 458 1 458 6 rr_1qbf 1 35 R35 471 1 471 6 rr_1qbf 1 36 Y36 484 1 484 6 rr_1qbf 1 stop_ loop_ _Gen_dist_constraint_parse_err.ID _Gen_dist_constraint_parse_err.Content _Gen_dist_constraint_parse_err.Begin_line _Gen_dist_constraint_parse_err.Begin_column _Gen_dist_constraint_parse_err.End_line _Gen_dist_constraint_parse_err.End_column _Gen_dist_constraint_parse_err.Entry_ID _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID 1 ` 115 77 115 77 rr_1qbf 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_framecode MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID rr_1qbf _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details 'Generated by Wattos' _Org_constr_file_comment.Comment '*HEADER INHIBITOR/HORMONE 16-APR-99 1QBF *TITLE NMR SOLUTION STRUCTURE OF PORCINE PEPTIDE YY *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: PEPTIDE YY; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: PORCINE PYY; *COMPND 5 SYNONYM: PYY; *COMPND 6 ENGINEERED: YES; *COMPND 7 OTHER_DETAILS: SYNTHETIC *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 OTHER_DETAILS: PORCINE SEQUENCE *KEYWDS PP-FOLD, PANCREATIC HORMONE, *EXPDTA NMR *AUTHOR D.A.KEIRE, M.KOBAYASHI, T.E.SOLOMON, J.R.REEVE JR. *REVDAT 1 16-AUG-00 1QBF 0' save_ save_MR_file_comment_3 _Org_constr_file_comment.Sf_framecode MR_file_comment_3 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID rr_1qbf _Org_constr_file_comment.ID 2 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 3 _Org_constr_file_comment.Details 'Generated by Wattos' _Org_constr_file_comment.Comment END save_