data_Remediated_restraints_file_for_PDB_entry_1a7i # This BMRB archive file contains, for PDB entry 1a7i: # # - 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_1a7i _Entry.Title 'wwPDB remediated NMR restraints for PDB entry 1a7i' _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 1a7i' _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 1a7i 'Master copy' rr_1a7i stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID rr_1a7i _Assembly.ID 1 _Assembly.Name 1a7i _Assembly.Number_of_components 3 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 2 _Assembly.Non_standard_bonds no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 8951.7495 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 'QCRP2 LIM1' 1 $QCRP2__LIM1_ A . no . . . . . . rr_1a7i 1 2 'ZINC ION' 2 $ZINC_ION B . no . . . . . . rr_1a7i 1 3 'ZINC ION' 2 $ZINC_ION C . no . . . . . . rr_1a7i 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_QCRP2__LIM1_ _Entity.Sf_category entity _Entity.Sf_framecode QCRP2__LIM1_ _Entity.Entry_ID rr_1a7i _Entity.ID 1 _Entity.Name QCRP2__LIM1_ _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code ; MPNWGGGNKCGACGRTVYHA EEVQCDGRSFHRCCFLCMVC RKNLDSTTVAIHDAEVYCKS CYGKKYGPKGYGYGQGAGTL N ; _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Number_of_monomers 81 _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Parent_entity_ID 1 _Entity.Formula_weight 8820.9895 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 . MET . rr_1a7i 1 2 . PRO . rr_1a7i 1 3 . ASN . rr_1a7i 1 4 . TRP . rr_1a7i 1 5 . GLY . rr_1a7i 1 6 . GLY . rr_1a7i 1 7 . GLY . rr_1a7i 1 8 . ASN . rr_1a7i 1 9 . LYS . rr_1a7i 1 10 . CYS . rr_1a7i 1 11 . GLY . rr_1a7i 1 12 . ALA . rr_1a7i 1 13 . CYS . rr_1a7i 1 14 . GLY . rr_1a7i 1 15 . ARG . rr_1a7i 1 16 . THR . rr_1a7i 1 17 . VAL . rr_1a7i 1 18 . TYR . rr_1a7i 1 19 . HIS . rr_1a7i 1 20 . ALA . rr_1a7i 1 21 . GLU . rr_1a7i 1 22 . GLU . rr_1a7i 1 23 . VAL . rr_1a7i 1 24 . GLN . rr_1a7i 1 25 . CYS . rr_1a7i 1 26 . ASP . rr_1a7i 1 27 . GLY . rr_1a7i 1 28 . ARG . rr_1a7i 1 29 . SER . rr_1a7i 1 30 . PHE . rr_1a7i 1 31 . HIS . rr_1a7i 1 32 . ARG . rr_1a7i 1 33 . CYS . rr_1a7i 1 34 . CYS . rr_1a7i 1 35 . PHE . rr_1a7i 1 36 . LEU . rr_1a7i 1 37 . CYS . rr_1a7i 1 38 . MET . rr_1a7i 1 39 . VAL . rr_1a7i 1 40 . CYS . rr_1a7i 1 41 . ARG . rr_1a7i 1 42 . LYS . rr_1a7i 1 43 . ASN . rr_1a7i 1 44 . LEU . rr_1a7i 1 45 . ASP . rr_1a7i 1 46 . SER . rr_1a7i 1 47 . THR . rr_1a7i 1 48 . THR . rr_1a7i 1 49 . VAL . rr_1a7i 1 50 . ALA . rr_1a7i 1 51 . ILE . rr_1a7i 1 52 . HIS . rr_1a7i 1 53 . ASP . rr_1a7i 1 54 . ALA . rr_1a7i 1 55 . GLU . rr_1a7i 1 56 . VAL . rr_1a7i 1 57 . TYR . rr_1a7i 1 58 . CYS . rr_1a7i 1 59 . LYS . rr_1a7i 1 60 . SER . rr_1a7i 1 61 . CYS . rr_1a7i 1 62 . TYR . rr_1a7i 1 63 . GLY . rr_1a7i 1 64 . LYS . rr_1a7i 1 65 . LYS . rr_1a7i 1 66 . TYR . rr_1a7i 1 67 . GLY . rr_1a7i 1 68 . PRO . rr_1a7i 1 69 . LYS . rr_1a7i 1 70 . GLY . rr_1a7i 1 71 . TYR . rr_1a7i 1 72 . GLY . rr_1a7i 1 73 . TYR . rr_1a7i 1 74 . GLY . rr_1a7i 1 75 . GLN . rr_1a7i 1 76 . GLY . rr_1a7i 1 77 . ALA . rr_1a7i 1 78 . GLY . rr_1a7i 1 79 . THR . rr_1a7i 1 80 . LEU . rr_1a7i 1 81 . ASN . rr_1a7i 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 . MET 1 1 rr_1a7i 1 . PRO 2 2 rr_1a7i 1 . ASN 3 3 rr_1a7i 1 . TRP 4 4 rr_1a7i 1 . GLY 5 5 rr_1a7i 1 . GLY 6 6 rr_1a7i 1 . GLY 7 7 rr_1a7i 1 . ASN 8 8 rr_1a7i 1 . LYS 9 9 rr_1a7i 1 . CYS 10 10 rr_1a7i 1 . GLY 11 11 rr_1a7i 1 . ALA 12 12 rr_1a7i 1 . CYS 13 13 rr_1a7i 1 . GLY 14 14 rr_1a7i 1 . ARG 15 15 rr_1a7i 1 . THR 16 16 rr_1a7i 1 . VAL 17 17 rr_1a7i 1 . TYR 18 18 rr_1a7i 1 . HIS 19 19 rr_1a7i 1 . ALA 20 20 rr_1a7i 1 . GLU 21 21 rr_1a7i 1 . GLU 22 22 rr_1a7i 1 . VAL 23 23 rr_1a7i 1 . GLN 24 24 rr_1a7i 1 . CYS 25 25 rr_1a7i 1 . ASP 26 26 rr_1a7i 1 . GLY 27 27 rr_1a7i 1 . ARG 28 28 rr_1a7i 1 . SER 29 29 rr_1a7i 1 . PHE 30 30 rr_1a7i 1 . HIS 31 31 rr_1a7i 1 . ARG 32 32 rr_1a7i 1 . CYS 33 33 rr_1a7i 1 . CYS 34 34 rr_1a7i 1 . PHE 35 35 rr_1a7i 1 . LEU 36 36 rr_1a7i 1 . CYS 37 37 rr_1a7i 1 . MET 38 38 rr_1a7i 1 . VAL 39 39 rr_1a7i 1 . CYS 40 40 rr_1a7i 1 . ARG 41 41 rr_1a7i 1 . LYS 42 42 rr_1a7i 1 . ASN 43 43 rr_1a7i 1 . LEU 44 44 rr_1a7i 1 . ASP 45 45 rr_1a7i 1 . SER 46 46 rr_1a7i 1 . THR 47 47 rr_1a7i 1 . THR 48 48 rr_1a7i 1 . VAL 49 49 rr_1a7i 1 . ALA 50 50 rr_1a7i 1 . ILE 51 51 rr_1a7i 1 . HIS 52 52 rr_1a7i 1 . ASP 53 53 rr_1a7i 1 . ALA 54 54 rr_1a7i 1 . GLU 55 55 rr_1a7i 1 . VAL 56 56 rr_1a7i 1 . TYR 57 57 rr_1a7i 1 . CYS 58 58 rr_1a7i 1 . LYS 59 59 rr_1a7i 1 . SER 60 60 rr_1a7i 1 . CYS 61 61 rr_1a7i 1 . TYR 62 62 rr_1a7i 1 . GLY 63 63 rr_1a7i 1 . LYS 64 64 rr_1a7i 1 . LYS 65 65 rr_1a7i 1 . TYR 66 66 rr_1a7i 1 . GLY 67 67 rr_1a7i 1 . PRO 68 68 rr_1a7i 1 . LYS 69 69 rr_1a7i 1 . GLY 70 70 rr_1a7i 1 . TYR 71 71 rr_1a7i 1 . GLY 72 72 rr_1a7i 1 . TYR 73 73 rr_1a7i 1 . GLY 74 74 rr_1a7i 1 . GLN 75 75 rr_1a7i 1 . GLY 76 76 rr_1a7i 1 . ALA 77 77 rr_1a7i 1 . GLY 78 78 rr_1a7i 1 . THR 79 79 rr_1a7i 1 . LEU 80 80 rr_1a7i 1 . ASN 81 81 rr_1a7i 1 stop_ save_ save_ZINC_ION _Entity.Sf_category entity _Entity.Sf_framecode ZINC_ION _Entity.Entry_ID rr_1a7i _Entity.ID 2 _Entity.Name ZINC_ION _Entity.Type non-polymer _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_chirality yes _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID ZN _Entity.Number_of_monomers 1 _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Parent_entity_ID 2 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 . ZN . rr_1a7i 2 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID rr_1a7i _Chem_comp.ID ZN _Chem_comp.Name 'ZINC ION' _Chem_comp.Type non-polymer _Chem_comp.PDB_code ZN _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic no _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.38 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_1a7i _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_1a7i _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_1a7i 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_1a7i 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 8 ASN C C -1.092 -11.107 8.199 . . . 1.0 . . . . . . . . . . . . A . 8 ASN C . . . . . . . . . rr_1a7i 1 . 1 . 2 . 1 1 8 ASN CA C -1.074 -12.451 7.539 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CA . . . . . . . . . rr_1a7i 1 . 1 . 3 . 1 1 8 ASN CB C 0.332 -13.101 7.667 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CB . . . . . . . . . rr_1a7i 1 . 1 . 4 . 1 1 8 ASN CG C 0.307 -14.514 7.076 . . . 1.0 . . . . . . . . . . . . A . 8 ASN CG . . . . . . . . . rr_1a7i 1 . 1 . 5 . 1 1 8 ASN H H -2.246 -11.600 6.044 . . . 1.0 . . . . . . . . . . . . A . 8 ASN H . . . . . . . . . rr_1a7i 1 . 1 . 6 . 1 1 8 ASN HA H -1.826 -13.067 8.011 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HA . . . . . . . . . rr_1a7i 1 . 1 . 7 . 1 1 8 ASN HB2 H 1.096 -12.512 7.115 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB2 . . . . . . . . . rr_1a7i 1 . 1 . 8 . 1 1 8 ASN HB3 H 0.638 -13.162 8.735 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HB3 . . . . . . . . . rr_1a7i 1 . 1 . 9 . 1 1 8 ASN HD21 H -0.898 -15.223 8.579 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD21 . . . . . . . . . rr_1a7i 1 . 1 . 10 . 1 1 8 ASN HD22 H -0.451 -16.397 7.386 . . . 1.0 . . . . . . . . . . . . A . 8 ASN HD22 . . . . . . . . . rr_1a7i 1 . 1 . 11 . 1 1 8 ASN N N -1.490 -12.235 6.186 . . . 1.0 . . . . . . . . . . . . A . 8 ASN N . . . . . . . . . rr_1a7i 1 . 1 . 12 . 1 1 8 ASN ND2 N -0.411 -15.462 7.739 . . . 1.0 . . . . . . . . . . . . A . 8 ASN ND2 . . . . . . . . . rr_1a7i 1 . 1 . 13 . 1 1 8 ASN O O -2.068 -10.752 8.866 . . . 1.0 . . . . . . . . . . . . A . 8 ASN O . . . . . . . . . rr_1a7i 1 . 1 . 14 . 1 1 8 ASN OD1 O 0.922 -14.761 6.040 . . . 1.0 . . . . . . . . . . . . A . 8 ASN OD1 . . . . . . . . . rr_1a7i 1 . 1 . 15 . 1 1 9 LYS C C 0.478 -7.980 7.700 . . . 1.0 . . . . . . . . . . . . A . 9 LYS C . . . . . . . . . rr_1a7i 1 . 1 . 16 . 1 1 9 LYS CA C 0.167 -9.062 8.687 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CA . . . . . . . . . rr_1a7i 1 . 1 . 17 . 1 1 9 LYS CB C 1.321 -9.111 9.716 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CB . . . . . . . . . rr_1a7i 1 . 1 . 18 . 1 1 9 LYS CD C 2.097 -10.032 11.993 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CD . . . . . . . . . rr_1a7i 1 . 1 . 19 . 1 1 9 LYS CE C 3.496 -10.512 11.574 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CE . . . . . . . . . rr_1a7i 1 . 1 . 20 . 1 1 9 LYS CG C 1.056 -10.089 10.868 . . . 1.0 . . . . . . . . . . . . A . 9 LYS CG . . . . . . . . . rr_1a7i 1 . 1 . 21 . 1 1 9 LYS H H 0.725 -10.576 7.384 . . . 1.0 . . . . . . . . . . . . A . 9 LYS H . . . . . . . . . rr_1a7i 1 . 1 . 22 . 1 1 9 LYS HA H -0.740 -8.788 9.204 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HA . . . . . . . . . rr_1a7i 1 . 1 . 23 . 1 1 9 LYS HB2 H 2.266 -9.395 9.203 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 24 . 1 1 9 LYS HB3 H 1.461 -8.105 10.168 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 25 . 1 1 9 LYS HD2 H 2.154 -8.988 12.371 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD2 . . . . . . . . . rr_1a7i 1 . 1 . 26 . 1 1 9 LYS HD3 H 1.732 -10.679 12.820 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HD3 . . . . . . . . . rr_1a7i 1 . 1 . 27 . 1 1 9 LYS HE2 H 3.453 -11.559 11.206 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE2 . . . . . . . . . rr_1a7i 1 . 1 . 28 . 1 1 9 LYS HE3 H 3.923 -9.862 10.780 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HE3 . . . . . . . . . rr_1a7i 1 . 1 . 29 . 1 1 9 LYS HG2 H 0.067 -9.835 11.307 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG2 . . . . . . . . . rr_1a7i 1 . 1 . 30 . 1 1 9 LYS HG3 H 1.001 -11.127 10.476 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HG3 . . . . . . . . . rr_1a7i 1 . 1 . 31 . 1 1 9 LYS HZ1 H 4.073 -11.096 13.479 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ1 . . . . . . . . . rr_1a7i 1 . 1 . 32 . 1 1 9 LYS HZ2 H 5.368 -10.810 12.418 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ2 . . . . . . . . . rr_1a7i 1 . 1 . 33 . 1 1 9 LYS HZ3 H 4.507 -9.504 13.079 . . . 1.0 . . . . . . . . . . . . A . 9 LYS HZ3 . . . . . . . . . rr_1a7i 1 . 1 . 34 . 1 1 9 LYS N N -0.023 -10.301 7.983 . . . 1.0 . . . . . . . . . . . . A . 9 LYS N . . . . . . . . . rr_1a7i 1 . 1 . 35 . 1 1 9 LYS NZ N 4.431 -10.478 12.723 . . . 1.0 . . . . . . . . . . . . A . 9 LYS NZ . . . . . . . . . rr_1a7i 1 . 1 . 36 . 1 1 9 LYS O O 1.197 -8.164 6.719 . . . 1.0 . . . . . . . . . . . . A . 9 LYS O . . . . . . . . . rr_1a7i 1 . 1 . 37 . 1 1 10 CYS C C 1.210 -4.861 7.571 . . . 1.0 . . . . . . . . . . . . A . 10 CYS C . . . . . . . . . rr_1a7i 1 . 1 . 38 . 1 1 10 CYS CA C -0.089 -5.562 7.290 . . . 1.0 . . . . . . . . . . . . A . 10 CYS CA . . . . . . . . . rr_1a7i 1 . 1 . 39 . 1 1 10 CYS CB C -1.312 -4.764 7.795 . . . 1.0 . . . . . . . . . . . . A . 10 CYS CB . . . . . . . . . rr_1a7i 1 . 1 . 40 . 1 1 10 CYS H H -0.726 -6.753 8.775 . . . 1.0 . . . . . . . . . . . . A . 10 CYS H . . . . . . . . . rr_1a7i 1 . 1 . 41 . 1 1 10 CYS HA H -0.184 -5.776 6.243 . . . 1.0 . . . . . . . . . . . . A . 10 CYS HA . . . . . . . . . rr_1a7i 1 . 1 . 42 . 1 1 10 CYS HB2 H -2.185 -5.358 7.452 . . . 1.0 . . . . . . . . . . . . A . 10 CYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 43 . 1 1 10 CYS HB3 H -1.308 -4.836 8.904 . . . 1.0 . . . . . . . . . . . . A . 10 CYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 44 . 1 1 10 CYS N N -0.126 -6.809 7.989 . . . 1.0 . . . . . . . . . . . . A . 10 CYS N . . . . . . . . . rr_1a7i 1 . 1 . 45 . 1 1 10 CYS O O 1.897 -5.153 8.549 . . . 1.0 . . . . . . . . . . . . A . 10 CYS O . . . . . . . . . rr_1a7i 1 . 1 . 46 . 1 1 10 CYS SG S -1.609 -3.019 7.361 . . . 1.0 . . . . . . . . . . . . A . 10 CYS SG . . . . . . . . . rr_1a7i 1 . 1 . 47 . 1 1 11 GLY C C 2.660 -1.996 7.716 . . . 1.0 . . . . . . . . . . . . A . 11 GLY C . . . . . . . . . rr_1a7i 1 . 1 . 48 . 1 1 11 GLY CA C 2.794 -3.148 6.760 . . . 1.0 . . . . . . . . . . . . A . 11 GLY CA . . . . . . . . . rr_1a7i 1 . 1 . 49 . 1 1 11 GLY H H 0.985 -3.714 5.897 . . . 1.0 . . . . . . . . . . . . A . 11 GLY H . . . . . . . . . rr_1a7i 1 . 1 . 50 . 1 1 11 GLY HA2 H 3.588 -3.797 7.101 . . . 1.0 . . . . . . . . . . . . A . 11 GLY HA2 . . . . . . . . . rr_1a7i 1 . 1 . 51 . 1 1 11 GLY HA3 H 2.970 -2.744 5.775 . . . 1.0 . . . . . . . . . . . . A . 11 GLY HA3 . . . . . . . . . rr_1a7i 1 . 1 . 52 . 1 1 11 GLY N N 1.571 -3.910 6.680 . . . 1.0 . . . . . . . . . . . . A . 11 GLY N . . . . . . . . . rr_1a7i 1 . 1 . 53 . 1 1 11 GLY O O 3.658 -1.517 8.254 . . . 1.0 . . . . . . . . . . . . A . 11 GLY O . . . . . . . . . rr_1a7i 1 . 1 . 54 . 1 1 12 ALA C C 0.879 -0.906 10.186 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_1a7i 1 . 1 . 55 . 1 1 12 ALA CA C 1.101 -0.413 8.805 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_1a7i 1 . 1 . 56 . 1 1 12 ALA CB C -0.089 0.405 8.299 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_1a7i 1 . 1 . 57 . 1 1 12 ALA H H 0.621 -1.949 7.505 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_1a7i 1 . 1 . 58 . 1 1 12 ALA HA H 1.922 0.248 8.871 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_1a7i 1 . 1 . 59 . 1 1 12 ALA HB1 H -0.893 -0.284 7.978 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_1a7i 1 . 1 . 60 . 1 1 12 ALA HB2 H -0.476 1.118 9.059 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_1a7i 1 . 1 . 61 . 1 1 12 ALA HB3 H 0.224 0.988 7.409 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_1a7i 1 . 1 . 62 . 1 1 12 ALA N N 1.411 -1.529 7.947 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_1a7i 1 . 1 . 63 . 1 1 12 ALA O O 1.785 -0.835 11.015 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_1a7i 1 . 1 . 64 . 1 1 13 CYS C C 0.170 -3.250 11.965 . . . 1.0 . . . . . . . . . . . . A . 13 CYS C . . . . . . . . . rr_1a7i 1 . 1 . 65 . 1 1 13 CYS CA C -0.661 -2.026 11.730 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CA . . . . . . . . . rr_1a7i 1 . 1 . 66 . 1 1 13 CYS CB C -2.144 -2.471 12.027 . . . 1.0 . . . . . . . . . . . . A . 13 CYS CB . . . . . . . . . rr_1a7i 1 . 1 . 67 . 1 1 13 CYS H H -1.029 -1.360 9.763 . . . 1.0 . . . . . . . . . . . . A . 13 CYS H . . . . . . . . . rr_1a7i 1 . 1 . 68 . 1 1 13 CYS HA H -0.381 -1.304 12.485 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HA . . . . . . . . . rr_1a7i 1 . 1 . 69 . 1 1 13 CYS HB2 H -2.235 -3.438 12.563 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 70 . 1 1 13 CYS HB3 H -2.347 -1.795 12.845 . . . 1.0 . . . . . . . . . . . . A . 13 CYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 71 . 1 1 13 CYS N N -0.333 -1.430 10.458 . . . 1.0 . . . . . . . . . . . . A . 13 CYS N . . . . . . . . . rr_1a7i 1 . 1 . 72 . 1 1 13 CYS O O 1.198 -3.227 12.640 . . . 1.0 . . . . . . . . . . . . A . 13 CYS O . . . . . . . . . rr_1a7i 1 . 1 . 73 . 1 1 13 CYS SG S -3.618 -2.279 10.962 . . . 1.0 . . . . . . . . . . . . A . 13 CYS SG . . . . . . . . . rr_1a7i 1 . 1 . 74 . 1 1 14 GLY C C -0.962 -6.462 12.186 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_1a7i 1 . 1 . 75 . 1 1 14 GLY CA C 0.169 -5.671 11.608 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_1a7i 1 . 1 . 76 . 1 1 14 GLY H H -1.169 -4.258 10.868 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_1a7i 1 . 1 . 77 . 1 1 14 GLY HA2 H 0.417 -6.074 10.639 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_1a7i 1 . 1 . 78 . 1 1 14 GLY HA3 H 0.990 -5.667 12.311 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_1a7i 1 . 1 . 79 . 1 1 14 GLY N N -0.328 -4.350 11.396 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_1a7i 1 . 1 . 80 . 1 1 14 GLY O O -0.734 -7.552 12.709 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_1a7i 1 . 1 . 81 . 1 1 15 ARG C C -3.619 -7.772 11.292 . . . 1.0 . . . . . . . . . . . . A . 15 ARG C . . . . . . . . . rr_1a7i 1 . 1 . 82 . 1 1 15 ARG CA C -3.413 -6.720 12.368 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CA . . . . . . . . . rr_1a7i 1 . 1 . 83 . 1 1 15 ARG CB C -4.615 -5.754 12.464 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CB . . . . . . . . . rr_1a7i 1 . 1 . 84 . 1 1 15 ARG CD C -4.997 -5.799 15.010 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CD . . . . . . . . . rr_1a7i 1 . 1 . 85 . 1 1 15 ARG CG C -4.683 -4.949 13.769 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CG . . . . . . . . . rr_1a7i 1 . 1 . 86 . 1 1 15 ARG CZ C -5.341 -5.359 17.461 . . . 1.0 . . . . . . . . . . . . A . 15 ARG CZ . . . . . . . . . rr_1a7i 1 . 1 . 87 . 1 1 15 ARG H H -2.467 -5.012 11.811 . . . 1.0 . . . . . . . . . . . . A . 15 ARG H . . . . . . . . . rr_1a7i 1 . 1 . 88 . 1 1 15 ARG HA H -3.273 -7.234 13.307 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HA . . . . . . . . . rr_1a7i 1 . 1 . 89 . 1 1 15 ARG HB2 H -4.550 -5.023 11.633 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB2 . . . . . . . . . rr_1a7i 1 . 1 . 90 . 1 1 15 ARG HB3 H -5.563 -6.287 12.337 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HB3 . . . . . . . . . rr_1a7i 1 . 1 . 91 . 1 1 15 ARG HD2 H -5.973 -6.318 14.890 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD2 . . . . . . . . . rr_1a7i 1 . 1 . 92 . 1 1 15 ARG HD3 H -4.195 -6.545 15.200 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HD3 . . . . . . . . . rr_1a7i 1 . 1 . 93 . 1 1 15 ARG HE H -4.951 -3.908 16.066 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HE . . . . . . . . . rr_1a7i 1 . 1 . 94 . 1 1 15 ARG HG2 H -3.721 -4.413 13.917 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG2 . . . . . . . . . rr_1a7i 1 . 1 . 95 . 1 1 15 ARG HG3 H -5.485 -4.188 13.647 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HG3 . . . . . . . . . rr_1a7i 1 . 1 . 96 . 1 1 15 ARG HH11 H -5.488 -7.348 16.958 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH11 . . . . . . . . . rr_1a7i 1 . 1 . 97 . 1 1 15 ARG HH12 H -5.718 -7.002 18.640 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH12 . . . . . . . . . rr_1a7i 1 . 1 . 98 . 1 1 15 ARG HH21 H -5.267 -3.498 18.330 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH21 . . . . . . . . . rr_1a7i 1 . 1 . 99 . 1 1 15 ARG HH22 H -5.591 -4.801 19.424 . . . 1.0 . . . . . . . . . . . . A . 15 ARG HH22 . . . . . . . . . rr_1a7i 1 . 1 . 100 . 1 1 15 ARG N N -2.230 -5.958 12.078 . . . 1.0 . . . . . . . . . . . . A . 15 ARG N . . . . . . . . . rr_1a7i 1 . 1 . 101 . 1 1 15 ARG NE N -5.085 -4.890 16.200 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NE . . . . . . . . . rr_1a7i 1 . 1 . 102 . 1 1 15 ARG NH1 N -5.533 -6.689 17.709 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH1 . . . . . . . . . rr_1a7i 1 . 1 . 103 . 1 1 15 ARG NH2 N -5.406 -4.474 18.497 . . . 1.0 . . . . . . . . . . . . A . 15 ARG NH2 . . . . . . . . . rr_1a7i 1 . 1 . 104 . 1 1 15 ARG O O -2.753 -7.991 10.446 . . . 1.0 . . . . . . . . . . . . A . 15 ARG O . . . . . . . . . rr_1a7i 1 . 1 . 105 . 1 1 16 THR C C -5.645 -9.285 9.120 . . . 1.0 . . . . . . . . . . . . A . 16 THR C . . . . . . . . . rr_1a7i 1 . 1 . 106 . 1 1 16 THR CA C -4.984 -9.616 10.440 . . . 1.0 . . . . . . . . . . . . A . 16 THR CA . . . . . . . . . rr_1a7i 1 . 1 . 107 . 1 1 16 THR CB C -5.788 -10.714 11.129 . . . 1.0 . . . . . . . . . . . . A . 16 THR CB . . . . . . . . . rr_1a7i 1 . 1 . 108 . 1 1 16 THR CG2 C -5.794 -12.005 10.270 . . . 1.0 . . . . . . . . . . . . A . 16 THR CG2 . . . . . . . . . rr_1a7i 1 . 1 . 109 . 1 1 16 THR H H -5.504 -8.283 11.956 . . . 1.0 . . . . . . . . . . . . A . 16 THR H . . . . . . . . . rr_1a7i 1 . 1 . 110 . 1 1 16 THR HA H -4.019 -10.050 10.224 . . . 1.0 . . . . . . . . . . . . A . 16 THR HA . . . . . . . . . rr_1a7i 1 . 1 . 111 . 1 1 16 THR HB H -6.831 -10.377 11.314 . . . 1.0 . . . . . . . . . . . . A . 16 THR HB . . . . . . . . . rr_1a7i 1 . 1 . 112 . 1 1 16 THR HG1 H -5.852 -11.559 12.856 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG1 . . . . . . . . . rr_1a7i 1 . 1 . 113 . 1 1 16 THR HG21 H -4.756 -12.334 10.047 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG21 . . . . . . . . . rr_1a7i 1 . 1 . 114 . 1 1 16 THR HG22 H -6.313 -12.826 10.808 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG22 . . . . . . . . . rr_1a7i 1 . 1 . 115 . 1 1 16 THR HG23 H -6.324 -11.849 9.307 . . . 1.0 . . . . . . . . . . . . A . 16 THR HG23 . . . . . . . . . rr_1a7i 1 . 1 . 116 . 1 1 16 THR N N -4.776 -8.474 11.302 . . . 1.0 . . . . . . . . . . . . A . 16 THR N . . . . . . . . . rr_1a7i 1 . 1 . 117 . 1 1 16 THR O O -6.853 -9.079 9.057 . . . 1.0 . . . . . . . . . . . . A . 16 THR O . . . . . . . . . rr_1a7i 1 . 1 . 118 . 1 1 16 THR OG1 O -5.209 -11.015 12.395 . . . 1.0 . . . . . . . . . . . . A . 16 THR OG1 . . . . . . . . . rr_1a7i 1 . 1 . 119 . 1 1 17 VAL C C -5.363 -10.773 6.366 . . . 1.0 . . . . . . . . . . . . A . 17 VAL C . . . . . . . . . rr_1a7i 1 . 1 . 120 . 1 1 17 VAL CA C -5.203 -9.293 6.636 . . . 1.0 . . . . . . . . . . . . A . 17 VAL CA . . . . . . . . . rr_1a7i 1 . 1 . 121 . 1 1 17 VAL CB C -4.140 -8.797 5.661 . . . 1.0 . . . . . . . . . . . . A . 17 VAL CB . . . . . . . . . rr_1a7i 1 . 1 . 122 . 1 1 17 VAL CG1 C -4.361 -7.383 5.180 . . . 1.0 . . . . . . . . . . . . A . 17 VAL CG1 . . . . . . . . . rr_1a7i 1 . 1 . 123 . 1 1 17 VAL CG2 C -2.830 -8.737 6.351 . . . 1.0 . . . . . . . . . . . . A . 17 VAL CG2 . . . . . . . . . rr_1a7i 1 . 1 . 124 . 1 1 17 VAL H H -3.883 -9.056 8.103 . . . 1.0 . . . . . . . . . . . . A . 17 VAL H . . . . . . . . . rr_1a7i 1 . 1 . 125 . 1 1 17 VAL HA H -6.066 -8.703 6.506 . . . 1.0 . . . . . . . . . . . . A . 17 VAL HA . . . . . . . . . rr_1a7i 1 . 1 . 126 . 1 1 17 VAL HB H -4.045 -9.451 4.774 . . . 1.0 . . . . . . . . . . . . A . 17 VAL HB . . . . . . . . . rr_1a7i 1 . 1 . 127 . 1 1 17 VAL HG11 H -5.354 -7.232 4.738 . . . 1.0 . . . . . . . . . . . . A . 17 VAL HG11 . . . . . . . . . rr_1a7i 1 . 1 . 128 . 1 1 17 VAL HG12 H -4.206 -6.650 5.997 . . . 1.0 . . . . . . . . . . . . A . 17 VAL HG12 . . . . . . . . . rr_1a7i 1 . 1 . 129 . 1 1 17 VAL HG13 H -3.613 -7.171 4.386 . . . 1.0 . . . . . . . . . . . . A . 17 VAL HG13 . . . . . . . . . rr_1a7i 1 . 1 . 130 . 1 1 17 VAL HG21 H -2.641 -9.750 6.720 . . . 1.0 . . . . . . . . . . . . A . 17 VAL HG21 . . . . . . . . . rr_1a7i 1 . 1 . 131 . 1 1 17 VAL HG22 H -2.048 -8.389 5.643 . . . 1.0 . . . . . . . . . . . . A . 17 VAL HG22 . . . . . . . . . rr_1a7i 1 . 1 . 132 . 1 1 17 VAL HG23 H -2.991 -8.003 7.166 . . . 1.0 . . . . . . . . . . . . A . 17 VAL HG23 . . . . . . . . . rr_1a7i 1 . 1 . 133 . 1 1 17 VAL N N -4.835 -9.304 8.026 . . . 1.0 . . . . . . . . . . . . A . 17 VAL N . . . . . . . . . rr_1a7i 1 . 1 . 134 . 1 1 17 VAL O O -4.597 -11.579 6.895 . . . 1.0 . . . . . . . . . . . . A . 17 VAL O . . . . . . . . . rr_1a7i 1 . 1 . 135 . 1 1 18 TYR C C -7.224 -12.780 4.013 . . . 1.0 . . . . . . . . . . . . A . 18 TYR C . . . . . . . . . rr_1a7i 1 . 1 . 136 . 1 1 18 TYR CA C -6.647 -12.584 5.386 . . . 1.0 . . . . . . . . . . . . A . 18 TYR CA . . . . . . . . . rr_1a7i 1 . 1 . 137 . 1 1 18 TYR CB C -7.593 -13.159 6.486 . . . 1.0 . . . . . . . . . . . . A . 18 TYR CB . . . . . . . . . rr_1a7i 1 . 1 . 138 . 1 1 18 TYR CD1 C -6.545 -15.445 6.776 . . . 1.0 . . . . . . . . . . . . A . 18 TYR CD1 . . . . . . . . . rr_1a7i 1 . 1 . 139 . 1 1 18 TYR CD2 C -8.849 -15.315 6.037 . . . 1.0 . . . . . . . . . . . . A . 18 TYR CD2 . . . . . . . . . rr_1a7i 1 . 1 . 140 . 1 1 18 TYR CE1 C -6.601 -16.845 6.716 . . . 1.0 . . . . . . . . . . . . A . 18 TYR CE1 . . . . . . . . . rr_1a7i 1 . 1 . 141 . 1 1 18 TYR CE2 C -8.911 -16.715 5.973 . . . 1.0 . . . . . . . . . . . . A . 18 TYR CE2 . . . . . . . . . rr_1a7i 1 . 1 . 142 . 1 1 18 TYR CG C -7.665 -14.664 6.434 . . . 1.0 . . . . . . . . . . . . A . 18 TYR CG . . . . . . . . . rr_1a7i 1 . 1 . 143 . 1 1 18 TYR CZ C -7.786 -17.482 6.313 . . . 1.0 . . . . . . . . . . . . A . 18 TYR CZ . . . . . . . . . rr_1a7i 1 . 1 . 144 . 1 1 18 TYR H H -6.983 -10.529 5.115 . . . 1.0 . . . . . . . . . . . . A . 18 TYR H . . . . . . . . . rr_1a7i 1 . 1 . 145 . 1 1 18 TYR HA H -5.705 -13.117 5.404 . . . 1.0 . . . . . . . . . . . . A . 18 TYR HA . . . . . . . . . rr_1a7i 1 . 1 . 146 . 1 1 18 TYR HB2 H -7.189 -12.893 7.486 . . . 1.0 . . . . . . . . . . . . A . 18 TYR HB2 . . . . . . . . . rr_1a7i 1 . 1 . 147 . 1 1 18 TYR HB3 H -8.621 -12.743 6.419 . . . 1.0 . . . . . . . . . . . . A . 18 TYR HB3 . . . . . . . . . rr_1a7i 1 . 1 . 148 . 1 1 18 TYR HD1 H -5.628 -14.963 7.086 . . . 1.0 . . . . . . . . . . . . A . 18 TYR HD1 . . . . . . . . . rr_1a7i 1 . 1 . 149 . 1 1 18 TYR HD2 H -9.718 -14.732 5.771 . . . 1.0 . . . . . . . . . . . . A . 18 TYR HD2 . . . . . . . . . rr_1a7i 1 . 1 . 150 . 1 1 18 TYR HE1 H -5.729 -17.425 6.981 . . . 1.0 . . . . . . . . . . . . A . 18 TYR HE1 . . . . . . . . . rr_1a7i 1 . 1 . 151 . 1 1 18 TYR HE2 H -9.829 -17.194 5.662 . . . 1.0 . . . . . . . . . . . . A . 18 TYR HE2 . . . . . . . . . rr_1a7i 1 . 1 . 152 . 1 1 18 TYR HH H -8.726 -19.138 5.958 . . . 1.0 . . . . . . . . . . . . A . 18 TYR HH . . . . . . . . . rr_1a7i 1 . 1 . 153 . 1 1 18 TYR N N -6.377 -11.176 5.569 . . . 1.0 . . . . . . . . . . . . A . 18 TYR N . . . . . . . . . rr_1a7i 1 . 1 . 154 . 1 1 18 TYR O O -6.526 -13.251 3.116 . . . 1.0 . . . . . . . . . . . . A . 18 TYR O . . . . . . . . . rr_1a7i 1 . 1 . 155 . 1 1 18 TYR OH O -7.846 -18.892 6.250 . . . 1.0 . . . . . . . . . . . . A . 18 TYR OH . . . . . . . . . rr_1a7i 1 . 1 . 156 . 1 1 19 HIS C C -10.047 -11.463 2.334 . . . 1.0 . . . . . . . . . . . . A . 19 HIS C . . . . . . . . . rr_1a7i 1 . 1 . 157 . 1 1 19 HIS CA C -9.224 -12.686 2.595 . . . 1.0 . . . . . . . . . . . . A . 19 HIS CA . . . . . . . . . rr_1a7i 1 . 1 . 158 . 1 1 19 HIS CB C -10.133 -13.942 2.680 . . . 1.0 . . . . . . . . . . . . A . 19 HIS CB . . . . . . . . . rr_1a7i 1 . 1 . 159 . 1 1 19 HIS CD2 C -10.475 -15.211 0.447 . . . 1.0 . . . . . . . . . . . . A . 19 HIS CD2 . . . . . . . . . rr_1a7i 1 . 1 . 160 . 1 1 19 HIS CE1 C -12.311 -14.228 -0.210 . . . 1.0 . . . . . . . . . . . . A . 19 HIS CE1 . . . . . . . . . rr_1a7i 1 . 1 . 161 . 1 1 19 HIS CG C -10.824 -14.304 1.390 . . . 1.0 . . . . . . . . . . . . A . 19 HIS CG . . . . . . . . . rr_1a7i 1 . 1 . 162 . 1 1 19 HIS H H -9.066 -12.045 4.562 . . . 1.0 . . . . . . . . . . . . A . 19 HIS H . . . . . . . . . rr_1a7i 1 . 1 . 163 . 1 1 19 HIS HA H -8.520 -12.797 1.782 . . . 1.0 . . . . . . . . . . . . A . 19 HIS HA . . . . . . . . . rr_1a7i 1 . 1 . 164 . 1 1 19 HIS HB2 H -9.481 -14.801 2.948 . . . 1.0 . . . . . . . . . . . . A . 19 HIS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 165 . 1 1 19 HIS HB3 H -10.885 -13.840 3.492 . . . 1.0 . . . . . . . . . . . . A . 19 HIS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 166 . 1 1 19 HIS HD1 H -12.471 -12.977 1.439 . . . 1.0 . . . . . . . . . . . . A . 19 HIS HD1 . . . . . . . . . rr_1a7i 1 . 1 . 167 . 1 1 19 HIS HD2 H -9.633 -15.890 0.406 . . . 1.0 . . . . . . . . . . . . A . 19 HIS HD2 . . . . . . . . . rr_1a7i 1 . 1 . 168 . 1 1 19 HIS HE1 H -13.167 -13.955 -0.791 . . . 1.0 . . . . . . . . . . . . A . 19 HIS HE1 . . . . . . . . . rr_1a7i 1 . 1 . 169 . 1 1 19 HIS N N -8.521 -12.443 3.828 . . . 1.0 . . . . . . . . . . . . A . 19 HIS N . . . . . . . . . rr_1a7i 1 . 1 . 170 . 1 1 19 HIS ND1 N -11.975 -13.700 0.958 . . . 1.0 . . . . . . . . . . . . A . 19 HIS ND1 . . . . . . . . . rr_1a7i 1 . 1 . 171 . 1 1 19 HIS NE2 N -11.417 -15.147 -0.542 . . . 1.0 . . . . . . . . . . . . A . 19 HIS NE2 . . . . . . . . . rr_1a7i 1 . 1 . 172 . 1 1 19 HIS O O -9.860 -10.785 1.324 . . . 1.0 . . . . . . . . . . . . A . 19 HIS O . . . . . . . . . rr_1a7i 1 . 1 . 173 . 1 1 20 ALA C C -11.232 -8.759 3.323 . . . 1.0 . . . . . . . . . . . . A . 20 ALA C . . . . . . . . . rr_1a7i 1 . 1 . 174 . 1 1 20 ALA CA C -11.927 -10.078 3.150 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CA . . . . . . . . . rr_1a7i 1 . 1 . 175 . 1 1 20 ALA CB C -13.046 -10.179 4.210 . . . 1.0 . . . . . . . . . . . . A . 20 ALA CB . . . . . . . . . rr_1a7i 1 . 1 . 176 . 1 1 20 ALA H H -11.134 -11.729 4.056 . . . 1.0 . . . . . . . . . . . . A . 20 ALA H . . . . . . . . . rr_1a7i 1 . 1 . 177 . 1 1 20 ALA HA H -12.361 -10.139 2.169 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HA . . . . . . . . . rr_1a7i 1 . 1 . 178 . 1 1 20 ALA HB1 H -12.633 -10.162 5.242 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB1 . . . . . . . . . rr_1a7i 1 . 1 . 179 . 1 1 20 ALA HB2 H -13.774 -9.345 4.106 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB2 . . . . . . . . . rr_1a7i 1 . 1 . 180 . 1 1 20 ALA HB3 H -13.598 -11.134 4.080 . . . 1.0 . . . . . . . . . . . . A . 20 ALA HB3 . . . . . . . . . rr_1a7i 1 . 1 . 181 . 1 1 20 ALA N N -10.989 -11.160 3.258 . . . 1.0 . . . . . . . . . . . . A . 20 ALA N . . . . . . . . . rr_1a7i 1 . 1 . 182 . 1 1 20 ALA O O -11.341 -7.876 2.475 . . . 1.0 . . . . . . . . . . . . A . 20 ALA O . . . . . . . . . rr_1a7i 1 . 1 . 183 . 1 1 21 GLU C C -8.442 -7.308 4.313 . . . 1.0 . . . . . . . . . . . . A . 21 GLU C . . . . . . . . . rr_1a7i 1 . 1 . 184 . 1 1 21 GLU CA C -9.843 -7.399 4.853 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CA . . . . . . . . . rr_1a7i 1 . 1 . 185 . 1 1 21 GLU CB C -9.784 -7.215 6.403 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CB . . . . . . . . . rr_1a7i 1 . 1 . 186 . 1 1 21 GLU CD C -10.227 -9.542 7.347 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CD . . . . . . . . . rr_1a7i 1 . 1 . 187 . 1 1 21 GLU CG C -9.215 -8.398 7.212 . . . 1.0 . . . . . . . . . . . . A . 21 GLU CG . . . . . . . . . rr_1a7i 1 . 1 . 188 . 1 1 21 GLU H H -10.392 -9.375 5.087 . . . 1.0 . . . . . . . . . . . . A . 21 GLU H . . . . . . . . . rr_1a7i 1 . 1 . 189 . 1 1 21 GLU HA H -10.405 -6.569 4.452 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HA . . . . . . . . . rr_1a7i 1 . 1 . 190 . 1 1 21 GLU HB2 H -9.142 -6.340 6.670 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HB2 . . . . . . . . . rr_1a7i 1 . 1 . 191 . 1 1 21 GLU HB3 H -10.807 -6.984 6.771 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HB3 . . . . . . . . . rr_1a7i 1 . 1 . 192 . 1 1 21 GLU HG2 H -8.260 -8.752 6.760 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HG2 . . . . . . . . . rr_1a7i 1 . 1 . 193 . 1 1 21 GLU HG3 H -8.987 -8.026 8.233 . . . 1.0 . . . . . . . . . . . . A . 21 GLU HG3 . . . . . . . . . rr_1a7i 1 . 1 . 194 . 1 1 21 GLU N N -10.487 -8.620 4.444 . . . 1.0 . . . . . . . . . . . . A . 21 GLU N . . . . . . . . . rr_1a7i 1 . 1 . 195 . 1 1 21 GLU O O -7.565 -6.810 5.011 . . . 1.0 . . . . . . . . . . . . A . 21 GLU O . . . . . . . . . rr_1a7i 1 . 1 . 196 . 1 1 21 GLU OE1 O -11.316 -9.308 7.937 . . . 1.0 . . . . . . . . . . . . A . 21 GLU OE1 . . . . . . . . . rr_1a7i 1 . 1 . 197 . 1 1 21 GLU OE2 O -9.925 -10.663 6.860 . . . 1.0 . . . . . . . . . . . . A . 21 GLU OE2 . . . . . . . . . rr_1a7i 1 . 1 . 198 . 1 1 22 GLU C C -7.128 -7.254 0.980 . . . 1.0 . . . . . . . . . . . . A . 22 GLU C . . . . . . . . . rr_1a7i 1 . 1 . 199 . 1 1 22 GLU CA C -6.912 -7.536 2.424 . . . 1.0 . . . . . . . . . . . . A . 22 GLU CA . . . . . . . . . rr_1a7i 1 . 1 . 200 . 1 1 22 GLU CB C -5.967 -8.760 2.588 . . . 1.0 . . . . . . . . . . . . A . 22 GLU CB . . . . . . . . . rr_1a7i 1 . 1 . 201 . 1 1 22 GLU CD C -6.104 -10.145 0.433 . . . 1.0 . . . . . . . . . . . . A . 22 GLU CD . . . . . . . . . rr_1a7i 1 . 1 . 202 . 1 1 22 GLU CG C -6.348 -10.101 1.940 . . . 1.0 . . . . . . . . . . . . A . 22 GLU CG . . . . . . . . . rr_1a7i 1 . 1 . 203 . 1 1 22 GLU H H -8.859 -8.210 2.498 . . . 1.0 . . . . . . . . . . . . A . 22 GLU H . . . . . . . . . rr_1a7i 1 . 1 . 204 . 1 1 22 GLU HA H -6.443 -6.665 2.855 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HA . . . . . . . . . rr_1a7i 1 . 1 . 205 . 1 1 22 GLU HB2 H -4.883 -8.513 2.420 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HB2 . . . . . . . . . rr_1a7i 1 . 1 . 206 . 1 1 22 GLU HB3 H -6.090 -8.994 3.660 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HB3 . . . . . . . . . rr_1a7i 1 . 1 . 207 . 1 1 22 GLU HG2 H -5.701 -10.873 2.410 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HG2 . . . . . . . . . rr_1a7i 1 . 1 . 208 . 1 1 22 GLU HG3 H -7.405 -10.338 2.176 . . . 1.0 . . . . . . . . . . . . A . 22 GLU HG3 . . . . . . . . . rr_1a7i 1 . 1 . 209 . 1 1 22 GLU N N -8.195 -7.716 3.045 . . . 1.0 . . . . . . . . . . . . A . 22 GLU N . . . . . . . . . rr_1a7i 1 . 1 . 210 . 1 1 22 GLU O O -8.147 -7.614 0.391 . . . 1.0 . . . . . . . . . . . . A . 22 GLU O . . . . . . . . . rr_1a7i 1 . 1 . 211 . 1 1 22 GLU OE1 O -4.955 -9.853 0.016 . . . 1.0 . . . . . . . . . . . . A . 22 GLU OE1 . . . . . . . . . rr_1a7i 1 . 1 . 212 . 1 1 22 GLU OE2 O -7.059 -10.474 -0.322 . . . 1.0 . . . . . . . . . . . . A . 22 GLU OE2 . . . . . . . . . rr_1a7i 1 . 1 . 213 . 1 1 23 VAL C C -4.581 -6.698 -1.244 . . . 1.0 . . . . . . . . . . . . A . 23 VAL C . . . . . . . . . rr_1a7i 1 . 1 . 214 . 1 1 23 VAL CA C -6.010 -6.325 -1.013 . . . 1.0 . . . . . . . . . . . . A . 23 VAL CA . . . . . . . . . rr_1a7i 1 . 1 . 215 . 1 1 23 VAL CB C -6.208 -4.874 -1.415 . . . 1.0 . . . . . . . . . . . . A . 23 VAL CB . . . . . . . . . rr_1a7i 1 . 1 . 216 . 1 1 23 VAL CG1 C -6.106 -4.700 -2.945 . . . 1.0 . . . . . . . . . . . . A . 23 VAL CG1 . . . . . . . . . rr_1a7i 1 . 1 . 217 . 1 1 23 VAL CG2 C -7.536 -4.355 -0.855 . . . 1.0 . . . . . . . . . . . . A . 23 VAL CG2 . . . . . . . . . rr_1a7i 1 . 1 . 218 . 1 1 23 VAL H H -5.351 -6.249 0.934 . . . 1.0 . . . . . . . . . . . . A . 23 VAL H . . . . . . . . . rr_1a7i 1 . 1 . 219 . 1 1 23 VAL HA H -6.660 -6.990 -1.566 . . . 1.0 . . . . . . . . . . . . A . 23 VAL HA . . . . . . . . . rr_1a7i 1 . 1 . 220 . 1 1 23 VAL HB H -5.431 -4.253 -0.940 . . . 1.0 . . . . . . . . . . . . A . 23 VAL HB . . . . . . . . . rr_1a7i 1 . 1 . 221 . 1 1 23 VAL HG11 H -6.841 -5.352 -3.463 . . . 1.0 . . . . . . . . . . . . A . 23 VAL HG11 . . . . . . . . . rr_1a7i 1 . 1 . 222 . 1 1 23 VAL HG12 H -6.312 -3.644 -3.220 . . . 1.0 . . . . . . . . . . . . A . 23 VAL HG12 . . . . . . . . . rr_1a7i 1 . 1 . 223 . 1 1 23 VAL HG13 H -5.086 -4.952 -3.305 . . . 1.0 . . . . . . . . . . . . A . 23 VAL HG13 . . . . . . . . . rr_1a7i 1 . 1 . 224 . 1 1 23 VAL HG21 H -8.376 -4.987 -1.211 . . . 1.0 . . . . . . . . . . . . A . 23 VAL HG21 . . . . . . . . . rr_1a7i 1 . 1 . 225 . 1 1 23 VAL HG22 H -7.507 -4.357 0.255 . . . 1.0 . . . . . . . . . . . . A . 23 VAL HG22 . . . . . . . . . rr_1a7i 1 . 1 . 226 . 1 1 23 VAL HG23 H -7.689 -3.307 -1.189 . . . 1.0 . . . . . . . . . . . . A . 23 VAL HG23 . . . . . . . . . rr_1a7i 1 . 1 . 227 . 1 1 23 VAL N N -6.127 -6.566 0.395 . . . 1.0 . . . . . . . . . . . . A . 23 VAL N . . . . . . . . . rr_1a7i 1 . 1 . 228 . 1 1 23 VAL O O -3.717 -6.350 -0.439 . . . 1.0 . . . . . . . . . . . . A . 23 VAL O . . . . . . . . . rr_1a7i 1 . 1 . 229 . 1 1 24 GLN C C -2.243 -6.843 -3.364 . . . 1.0 . . . . . . . . . . . . A . 24 GLN C . . . . . . . . . rr_1a7i 1 . 1 . 230 . 1 1 24 GLN CA C -2.973 -7.913 -2.623 . . . 1.0 . . . . . . . . . . . . A . 24 GLN CA . . . . . . . . . rr_1a7i 1 . 1 . 231 . 1 1 24 GLN CB C -2.936 -9.183 -3.504 . . . 1.0 . . . . . . . . . . . . A . 24 GLN CB . . . . . . . . . rr_1a7i 1 . 1 . 232 . 1 1 24 GLN CD C -3.514 -11.615 -3.769 . . . 1.0 . . . . . . . . . . . . A . 24 GLN CD . . . . . . . . . rr_1a7i 1 . 1 . 233 . 1 1 24 GLN CG C -3.615 -10.396 -2.849 . . . 1.0 . . . . . . . . . . . . A . 24 GLN CG . . . . . . . . . rr_1a7i 1 . 1 . 234 . 1 1 24 GLN H H -5.009 -7.634 -3.018 . . . 1.0 . . . . . . . . . . . . A . 24 GLN H . . . . . . . . . rr_1a7i 1 . 1 . 235 . 1 1 24 GLN HA H -2.464 -8.117 -1.689 . . . 1.0 . . . . . . . . . . . . A . 24 GLN HA . . . . . . . . . rr_1a7i 1 . 1 . 236 . 1 1 24 GLN HB2 H -3.435 -8.979 -4.477 . . . 1.0 . . . . . . . . . . . . A . 24 GLN HB2 . . . . . . . . . rr_1a7i 1 . 1 . 237 . 1 1 24 GLN HB3 H -1.871 -9.439 -3.702 . . . 1.0 . . . . . . . . . . . . A . 24 GLN HB3 . . . . . . . . . rr_1a7i 1 . 1 . 238 . 1 1 24 GLN HE21 H -1.496 -11.810 -3.443 . . . 1.0 . . . . . . . . . . . . A . 24 GLN HE21 . . . . . . . . . rr_1a7i 1 . 1 . 239 . 1 1 24 GLN HE22 H -2.181 -12.988 -4.512 . . . 1.0 . . . . . . . . . . . . A . 24 GLN HE22 . . . . . . . . . rr_1a7i 1 . 1 . 240 . 1 1 24 GLN HG2 H -3.129 -10.618 -1.874 . . . 1.0 . . . . . . . . . . . . A . 24 GLN HG2 . . . . . . . . . rr_1a7i 1 . 1 . 241 . 1 1 24 GLN HG3 H -4.688 -10.174 -2.668 . . . 1.0 . . . . . . . . . . . . A . 24 GLN HG3 . . . . . . . . . rr_1a7i 1 . 1 . 242 . 1 1 24 GLN N N -4.297 -7.405 -2.360 . . . 1.0 . . . . . . . . . . . . A . 24 GLN N . . . . . . . . . rr_1a7i 1 . 1 . 243 . 1 1 24 GLN NE2 N -2.289 -12.189 -3.921 . . . 1.0 . . . . . . . . . . . . A . 24 GLN NE2 . . . . . . . . . rr_1a7i 1 . 1 . 244 . 1 1 24 GLN O O -2.777 -6.216 -4.279 . . . 1.0 . . . . . . . . . . . . A . 24 GLN O . . . . . . . . . rr_1a7i 1 . 1 . 245 . 1 1 24 GLN OE1 O -4.517 -12.045 -4.336 . . . 1.0 . . . . . . . . . . . . A . 24 GLN OE1 . . . . . . . . . rr_1a7i 1 . 1 . 246 . 1 1 25 CYS C C 1.206 -6.129 -3.476 . . . 1.0 . . . . . . . . . . . . A . 25 CYS C . . . . . . . . . rr_1a7i 1 . 1 . 247 . 1 1 25 CYS CA C -0.176 -5.549 -3.445 . . . 1.0 . . . . . . . . . . . . A . 25 CYS CA . . . . . . . . . rr_1a7i 1 . 1 . 248 . 1 1 25 CYS CB C -0.215 -4.279 -2.550 . . . 1.0 . . . . . . . . . . . . A . 25 CYS CB . . . . . . . . . rr_1a7i 1 . 1 . 249 . 1 1 25 CYS H H -0.588 -7.147 -2.198 . . . 1.0 . . . . . . . . . . . . A . 25 CYS H . . . . . . . . . rr_1a7i 1 . 1 . 250 . 1 1 25 CYS HA H -0.479 -5.314 -4.457 . . . 1.0 . . . . . . . . . . . . A . 25 CYS HA . . . . . . . . . rr_1a7i 1 . 1 . 251 . 1 1 25 CYS HB2 H -1.273 -4.005 -2.342 . . . 1.0 . . . . . . . . . . . . A . 25 CYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 252 . 1 1 25 CYS HB3 H 0.225 -4.489 -1.548 . . . 1.0 . . . . . . . . . . . . A . 25 CYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 253 . 1 1 25 CYS HG H 0.409 -2.028 -2.342 . . . 1.0 . . . . . . . . . . . . A . 25 CYS HG . . . . . . . . . rr_1a7i 1 . 1 . 254 . 1 1 25 CYS N N -0.993 -6.601 -2.926 . . . 1.0 . . . . . . . . . . . . A . 25 CYS N . . . . . . . . . rr_1a7i 1 . 1 . 255 . 1 1 25 CYS O O 1.960 -5.985 -2.518 . . . 1.0 . . . . . . . . . . . . A . 25 CYS O . . . . . . . . . rr_1a7i 1 . 1 . 256 . 1 1 25 CYS SG S 0.616 -2.867 -3.347 . . . 1.0 . . . . . . . . . . . . A . 25 CYS SG . . . . . . . . . rr_1a7i 1 . 1 . 257 . 1 1 26 ASP C C 3.014 -8.632 -3.932 . . . 1.0 . . . . . . . . . . . . A . 26 ASP C . . . . . . . . . rr_1a7i 1 . 1 . 258 . 1 1 26 ASP CA C 2.833 -7.431 -4.838 . . . 1.0 . . . . . . . . . . . . A . 26 ASP CA . . . . . . . . . rr_1a7i 1 . 1 . 259 . 1 1 26 ASP CB C 4.031 -6.424 -4.814 . . . 1.0 . . . . . . . . . . . . A . 26 ASP CB . . . . . . . . . rr_1a7i 1 . 1 . 260 . 1 1 26 ASP CG C 5.329 -6.971 -5.440 . . . 1.0 . . . . . . . . . . . . A . 26 ASP CG . . . . . . . . . rr_1a7i 1 . 1 . 261 . 1 1 26 ASP H H 0.896 -6.913 -5.341 . . . 1.0 . . . . . . . . . . . . A . 26 ASP H . . . . . . . . . rr_1a7i 1 . 1 . 262 . 1 1 26 ASP HA H 2.750 -7.811 -5.846 . . . 1.0 . . . . . . . . . . . . A . 26 ASP HA . . . . . . . . . rr_1a7i 1 . 1 . 263 . 1 1 26 ASP HB2 H 3.733 -5.538 -5.413 . . . 1.0 . . . . . . . . . . . . A . 26 ASP HB2 . . . . . . . . . rr_1a7i 1 . 1 . 264 . 1 1 26 ASP HB3 H 4.236 -6.071 -3.780 . . . 1.0 . . . . . . . . . . . . A . 26 ASP HB3 . . . . . . . . . rr_1a7i 1 . 1 . 265 . 1 1 26 ASP N N 1.549 -6.812 -4.595 . . . 1.0 . . . . . . . . . . . . A . 26 ASP N . . . . . . . . . rr_1a7i 1 . 1 . 266 . 1 1 26 ASP O O 2.319 -9.635 -4.090 . . . 1.0 . . . . . . . . . . . . A . 26 ASP O . . . . . . . . . rr_1a7i 1 . 1 . 267 . 1 1 26 ASP OD1 O 5.323 -8.088 -6.025 . . . 1.0 . . . . . . . . . . . . A . 26 ASP OD1 . . . . . . . . . rr_1a7i 1 . 1 . 268 . 1 1 26 ASP OD2 O 6.358 -6.251 -5.336 . . . 1.0 . . . . . . . . . . . . A . 26 ASP OD2 . . . . . . . . . rr_1a7i 1 . 1 . 269 . 1 1 27 GLY C C 3.545 -9.711 -0.887 . . . 1.0 . . . . . . . . . . . . A . 27 GLY C . . . . . . . . . rr_1a7i 1 . 1 . 270 . 1 1 27 GLY CA C 4.362 -9.662 -2.139 . . . 1.0 . . . . . . . . . . . . A . 27 GLY CA . . . . . . . . . rr_1a7i 1 . 1 . 271 . 1 1 27 GLY H H 4.486 -7.713 -2.831 . . . 1.0 . . . . . . . . . . . . A . 27 GLY H . . . . . . . . . rr_1a7i 1 . 1 . 272 . 1 1 27 GLY HA2 H 4.224 -10.585 -2.686 . . . 1.0 . . . . . . . . . . . . A . 27 GLY HA2 . . . . . . . . . rr_1a7i 1 . 1 . 273 . 1 1 27 GLY HA3 H 5.390 -9.484 -1.862 . . . 1.0 . . . . . . . . . . . . A . 27 GLY HA3 . . . . . . . . . rr_1a7i 1 . 1 . 274 . 1 1 27 GLY N N 3.963 -8.551 -2.968 . . . 1.0 . . . . . . . . . . . . A . 27 GLY N . . . . . . . . . rr_1a7i 1 . 1 . 275 . 1 1 27 GLY O O 3.201 -10.791 -0.409 . . . 1.0 . . . . . . . . . . . . A . 27 GLY O . . . . . . . . . rr_1a7i 1 . 1 . 276 . 1 1 28 ARG C C 1.070 -8.079 0.501 . . . 1.0 . . . . . . . . . . . . A . 28 ARG C . . . . . . . . . rr_1a7i 1 . 1 . 277 . 1 1 28 ARG CA C 2.481 -8.385 0.903 . . . 1.0 . . . . . . . . . . . . A . 28 ARG CA . . . . . . . . . rr_1a7i 1 . 1 . 278 . 1 1 28 ARG CB C 3.024 -7.228 1.809 . . . 1.0 . . . . . . . . . . . . A . 28 ARG CB . . . . . . . . . rr_1a7i 1 . 1 . 279 . 1 1 28 ARG CD C 3.799 -5.373 0.090 . . . 1.0 . . . . . . . . . . . . A . 28 ARG CD . . . . . . . . . rr_1a7i 1 . 1 . 280 . 1 1 28 ARG CG C 2.893 -5.798 1.264 . . . 1.0 . . . . . . . . . . . . A . 28 ARG CG . . . . . . . . . rr_1a7i 1 . 1 . 281 . 1 1 28 ARG CZ C 6.248 -5.056 -0.339 . . . 1.0 . . . . . . . . . . . . A . 28 ARG CZ . . . . . . . . . rr_1a7i 1 . 1 . 282 . 1 1 28 ARG H H 3.451 -7.649 -0.742 . . . 1.0 . . . . . . . . . . . . A . 28 ARG H . . . . . . . . . rr_1a7i 1 . 1 . 283 . 1 1 28 ARG HA H 2.497 -9.312 1.459 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HA . . . . . . . . . rr_1a7i 1 . 1 . 284 . 1 1 28 ARG HB2 H 2.461 -7.183 2.768 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HB2 . . . . . . . . . rr_1a7i 1 . 1 . 285 . 1 1 28 ARG HB3 H 4.088 -7.411 2.066 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HB3 . . . . . . . . . rr_1a7i 1 . 1 . 286 . 1 1 28 ARG HD2 H 3.670 -6.032 -0.790 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HD2 . . . . . . . . . rr_1a7i 1 . 1 . 287 . 1 1 28 ARG HD3 H 3.567 -4.327 -0.205 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HD3 . . . . . . . . . rr_1a7i 1 . 1 . 288 . 1 1 28 ARG HE H 5.464 -5.787 1.412 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HE . . . . . . . . . rr_1a7i 1 . 1 . 289 . 1 1 28 ARG HG2 H 1.825 -5.676 0.986 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HG2 . . . . . . . . . rr_1a7i 1 . 1 . 290 . 1 1 28 ARG HG3 H 3.092 -5.115 2.116 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HG3 . . . . . . . . . rr_1a7i 1 . 1 . 291 . 1 1 28 ARG HH11 H 5.057 -4.473 -1.913 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HH11 . . . . . . . . . rr_1a7i 1 . 1 . 292 . 1 1 28 ARG HH12 H 6.760 -4.295 -2.181 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HH12 . . . . . . . . . rr_1a7i 1 . 1 . 293 . 1 1 28 ARG HH21 H 7.736 -5.529 0.998 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HH21 . . . . . . . . . rr_1a7i 1 . 1 . 294 . 1 1 28 ARG HH22 H 8.289 -4.899 -0.518 . . . 1.0 . . . . . . . . . . . . A . 28 ARG HH22 . . . . . . . . . rr_1a7i 1 . 1 . 295 . 1 1 28 ARG N N 3.223 -8.525 -0.319 . . . 1.0 . . . . . . . . . . . . A . 28 ARG N . . . . . . . . . rr_1a7i 1 . 1 . 296 . 1 1 28 ARG NE N 5.236 -5.434 0.505 . . . 1.0 . . . . . . . . . . . . A . 28 ARG NE . . . . . . . . . rr_1a7i 1 . 1 . 297 . 1 1 28 ARG NH1 N 6.000 -4.565 -1.590 . . . 1.0 . . . . . . . . . . . . A . 28 ARG NH1 . . . . . . . . . rr_1a7i 1 . 1 . 298 . 1 1 28 ARG NH2 N 7.540 -5.173 0.085 . . . 1.0 . . . . . . . . . . . . A . 28 ARG NH2 . . . . . . . . . rr_1a7i 1 . 1 . 299 . 1 1 28 ARG O O 0.740 -8.010 -0.682 . . . 1.0 . . . . . . . . . . . . A . 28 ARG O . . . . . . . . . rr_1a7i 1 . 1 . 300 . 1 1 29 SER C C -1.062 -6.299 2.444 . . . 1.0 . . . . . . . . . . . . A . 29 SER C . . . . . . . . . rr_1a7i 1 . 1 . 301 . 1 1 29 SER CA C -1.087 -7.346 1.383 . . . 1.0 . . . . . . . . . . . . A . 29 SER CA . . . . . . . . . rr_1a7i 1 . 1 . 302 . 1 1 29 SER CB C -2.204 -8.324 1.748 . . . 1.0 . . . . . . . . . . . . A . 29 SER CB . . . . . . . . . rr_1a7i 1 . 1 . 303 . 1 1 29 SER H H 0.362 -7.985 2.468 . . . 1.0 . . . . . . . . . . . . A . 29 SER H . . . . . . . . . rr_1a7i 1 . 1 . 304 . 1 1 29 SER HA H -1.226 -6.892 0.411 . . . 1.0 . . . . . . . . . . . . A . 29 SER HA . . . . . . . . . rr_1a7i 1 . 1 . 305 . 1 1 29 SER HB2 H -2.370 -8.609 2.815 . . . 1.0 . . . . . . . . . . . . A . 29 SER HB2 . . . . . . . . . rr_1a7i 1 . 1 . 306 . 1 1 29 SER HB3 H -3.045 -7.703 1.493 . . . 1.0 . . . . . . . . . . . . A . 29 SER HB3 . . . . . . . . . rr_1a7i 1 . 1 . 307 . 1 1 29 SER HG H -2.959 -9.984 1.143 . . . 1.0 . . . . . . . . . . . . A . 29 SER HG . . . . . . . . . rr_1a7i 1 . 1 . 308 . 1 1 29 SER N N 0.198 -7.884 1.506 . . . 1.0 . . . . . . . . . . . . A . 29 SER N . . . . . . . . . rr_1a7i 1 . 1 . 309 . 1 1 29 SER O O -0.188 -6.287 3.312 . . . 1.0 . . . . . . . . . . . . A . 29 SER O . . . . . . . . . rr_1a7i 1 . 1 . 310 . 1 1 29 SER OG O -2.174 -9.478 0.919 . . . 1.0 . . . . . . . . . . . . A . 29 SER OG . . . . . . . . . rr_1a7i 1 . 1 . 311 . 1 1 30 PHE C C -3.686 -4.642 3.786 . . . 1.0 . . . . . . . . . . . . A . 30 PHE C . . . . . . . . . rr_1a7i 1 . 1 . 312 . 1 1 30 PHE CA C -2.266 -4.494 3.504 . . . 1.0 . . . . . . . . . . . . A . 30 PHE CA . . . . . . . . . rr_1a7i 1 . 1 . 313 . 1 1 30 PHE CB C -2.147 -3.004 3.177 . . . 1.0 . . . . . . . . . . . . A . 30 PHE CB . . . . . . . . . rr_1a7i 1 . 1 . 314 . 1 1 30 PHE CD1 C 0.326 -2.824 3.364 . . . 1.0 . . . . . . . . . . . . A . 30 PHE CD1 . . . . . . . . . rr_1a7i 1 . 1 . 315 . 1 1 30 PHE CD2 C -0.632 -2.797 1.130 . . . 1.0 . . . . . . . . . . . . A . 30 PHE CD2 . . . . . . . . . rr_1a7i 1 . 1 . 316 . 1 1 30 PHE CE1 C 1.615 -2.792 2.819 . . . 1.0 . . . . . . . . . . . . A . 30 PHE CE1 . . . . . . . . . rr_1a7i 1 . 1 . 317 . 1 1 30 PHE CE2 C 0.656 -2.662 0.600 . . . 1.0 . . . . . . . . . . . . A . 30 PHE CE2 . . . . . . . . . rr_1a7i 1 . 1 . 318 . 1 1 30 PHE CG C -0.810 -2.811 2.530 . . . 1.0 . . . . . . . . . . . . A . 30 PHE CG . . . . . . . . . rr_1a7i 1 . 1 . 319 . 1 1 30 PHE CZ C 1.776 -2.646 1.439 . . . 1.0 . . . . . . . . . . . . A . 30 PHE CZ . . . . . . . . . rr_1a7i 1 . 1 . 320 . 1 1 30 PHE H H -2.730 -5.384 1.671 . . . 1.0 . . . . . . . . . . . . A . 30 PHE H . . . . . . . . . rr_1a7i 1 . 1 . 321 . 1 1 30 PHE HA H -1.692 -4.768 4.380 . . . 1.0 . . . . . . . . . . . . A . 30 PHE HA . . . . . . . . . rr_1a7i 1 . 1 . 322 . 1 1 30 PHE HB2 H -3.017 -2.699 2.543 . . . 1.0 . . . . . . . . . . . . A . 30 PHE HB2 . . . . . . . . . rr_1a7i 1 . 1 . 323 . 1 1 30 PHE HB3 H -2.169 -2.389 4.104 . . . 1.0 . . . . . . . . . . . . A . 30 PHE HB3 . . . . . . . . . rr_1a7i 1 . 1 . 324 . 1 1 30 PHE HD1 H 0.197 -2.906 4.434 . . . 1.0 . . . . . . . . . . . . A . 30 PHE HD1 . . . . . . . . . rr_1a7i 1 . 1 . 325 . 1 1 30 PHE HD2 H -1.460 -2.955 0.445 . . . 1.0 . . . . . . . . . . . . A . 30 PHE HD2 . . . . . . . . . rr_1a7i 1 . 1 . 326 . 1 1 30 PHE HE1 H 2.483 -2.926 3.448 . . . 1.0 . . . . . . . . . . . . A . 30 PHE HE1 . . . . . . . . . rr_1a7i 1 . 1 . 327 . 1 1 30 PHE HE2 H 0.790 -2.615 -0.465 . . . 1.0 . . . . . . . . . . . . A . 30 PHE HE2 . . . . . . . . . rr_1a7i 1 . 1 . 328 . 1 1 30 PHE HZ H 2.769 -2.583 1.021 . . . 1.0 . . . . . . . . . . . . A . 30 PHE HZ . . . . . . . . . rr_1a7i 1 . 1 . 329 . 1 1 30 PHE N N -2.051 -5.397 2.407 . . . 1.0 . . . . . . . . . . . . A . 30 PHE N . . . . . . . . . rr_1a7i 1 . 1 . 330 . 1 1 30 PHE O O -4.429 -5.210 2.984 . . . 1.0 . . . . . . . . . . . . A . 30 PHE O . . . . . . . . . rr_1a7i 1 . 1 . 331 . 1 1 31 HIS C C -6.252 -3.208 4.266 . . . 1.0 . . . . . . . . . . . . A . 31 HIS C . . . . . . . . . rr_1a7i 1 . 1 . 332 . 1 1 31 HIS CA C -5.511 -4.071 5.210 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CA . . . . . . . . . rr_1a7i 1 . 1 . 333 . 1 1 31 HIS CB C -5.947 -3.715 6.624 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CB . . . . . . . . . rr_1a7i 1 . 1 . 334 . 1 1 31 HIS CD2 C -5.538 -5.860 7.779 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CD2 . . . . . . . . . rr_1a7i 1 . 1 . 335 . 1 1 31 HIS CE1 C -4.054 -5.244 9.251 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CE1 . . . . . . . . . rr_1a7i 1 . 1 . 336 . 1 1 31 HIS CG C -5.276 -4.561 7.602 . . . 1.0 . . . . . . . . . . . . A . 31 HIS CG . . . . . . . . . rr_1a7i 1 . 1 . 337 . 1 1 31 HIS H H -3.506 -3.665 5.601 . . . 1.0 . . . . . . . . . . . . A . 31 HIS H . . . . . . . . . rr_1a7i 1 . 1 . 338 . 1 1 31 HIS HA H -5.843 -5.087 5.065 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HA . . . . . . . . . rr_1a7i 1 . 1 . 339 . 1 1 31 HIS HB2 H -5.854 -2.639 6.867 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 340 . 1 1 31 HIS HB3 H -6.993 -4.078 6.739 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 341 . 1 1 31 HIS HD2 H -6.151 -6.463 7.110 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HD2 . . . . . . . . . rr_1a7i 1 . 1 . 342 . 1 1 31 HIS HE1 H -3.361 -5.282 10.061 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HE1 . . . . . . . . . rr_1a7i 1 . 1 . 343 . 1 1 31 HIS HE2 H -4.706 -7.207 9.163 . . . 1.0 . . . . . . . . . . . . A . 31 HIS HE2 . . . . . . . . . rr_1a7i 1 . 1 . 344 . 1 1 31 HIS N N -4.118 -4.069 4.926 . . . 1.0 . . . . . . . . . . . . A . 31 HIS N . . . . . . . . . rr_1a7i 1 . 1 . 345 . 1 1 31 HIS ND1 N -4.324 -4.191 8.503 . . . 1.0 . . . . . . . . . . . . A . 31 HIS ND1 . . . . . . . . . rr_1a7i 1 . 1 . 346 . 1 1 31 HIS NE2 N -4.769 -6.270 8.820 . . . 1.0 . . . . . . . . . . . . A . 31 HIS NE2 . . . . . . . . . rr_1a7i 1 . 1 . 347 . 1 1 31 HIS O O -5.792 -2.192 3.761 . . . 1.0 . . . . . . . . . . . . A . 31 HIS O . . . . . . . . . rr_1a7i 1 . 1 . 348 . 1 1 32 ARG C C -8.698 -1.697 3.330 . . . 1.0 . . . . . . . . . . . . A . 32 ARG C . . . . . . . . . rr_1a7i 1 . 1 . 349 . 1 1 32 ARG CA C -8.485 -3.189 3.156 . . . 1.0 . . . . . . . . . . . . A . 32 ARG CA . . . . . . . . . rr_1a7i 1 . 1 . 350 . 1 1 32 ARG CB C -9.816 -3.937 3.379 . . . 1.0 . . . . . . . . . . . . A . 32 ARG CB . . . . . . . . . rr_1a7i 1 . 1 . 351 . 1 1 32 ARG CD C -12.222 -4.395 2.587 . . . 1.0 . . . . . . . . . . . . A . 32 ARG CD . . . . . . . . . rr_1a7i 1 . 1 . 352 . 1 1 32 ARG CG C -11.023 -3.433 2.568 . . . 1.0 . . . . . . . . . . . . A . 32 ARG CG . . . . . . . . . rr_1a7i 1 . 1 . 353 . 1 1 32 ARG CZ C -13.457 -5.697 4.354 . . . 1.0 . . . . . . . . . . . . A . 32 ARG CZ . . . . . . . . . rr_1a7i 1 . 1 . 354 . 1 1 32 ARG H H -7.476 -4.632 4.435 . . . 1.0 . . . . . . . . . . . . A . 32 ARG H . . . . . . . . . rr_1a7i 1 . 1 . 355 . 1 1 32 ARG HA H -8.166 -3.356 2.138 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HA . . . . . . . . . rr_1a7i 1 . 1 . 356 . 1 1 32 ARG HB2 H -9.644 -4.993 3.085 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HB2 . . . . . . . . . rr_1a7i 1 . 1 . 357 . 1 1 32 ARG HB3 H -10.068 -3.920 4.462 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HB3 . . . . . . . . . rr_1a7i 1 . 1 . 358 . 1 1 32 ARG HD2 H -13.102 -3.947 2.078 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HD2 . . . . . . . . . rr_1a7i 1 . 1 . 359 . 1 1 32 ARG HD3 H -11.944 -5.348 2.087 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HD3 . . . . . . . . . rr_1a7i 1 . 1 . 360 . 1 1 32 ARG HE H -12.135 -4.180 4.740 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HE . . . . . . . . . rr_1a7i 1 . 1 . 361 . 1 1 32 ARG HG2 H -11.342 -2.443 2.958 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HG2 . . . . . . . . . rr_1a7i 1 . 1 . 362 . 1 1 32 ARG HG3 H -10.712 -3.303 1.509 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HG3 . . . . . . . . . rr_1a7i 1 . 1 . 363 . 1 1 32 ARG HH11 H -13.974 -6.242 2.439 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HH11 . . . . . . . . . rr_1a7i 1 . 1 . 364 . 1 1 32 ARG HH12 H -14.740 -7.162 3.691 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HH12 . . . . . . . . . rr_1a7i 1 . 1 . 365 . 1 1 32 ARG HH21 H -13.183 -5.445 6.375 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HH21 . . . . . . . . . rr_1a7i 1 . 1 . 366 . 1 1 32 ARG HH22 H -14.288 -6.706 5.939 . . . 1.0 . . . . . . . . . . . . A . 32 ARG HH22 . . . . . . . . . rr_1a7i 1 . 1 . 367 . 1 1 32 ARG N N -7.440 -3.724 4.009 . . . 1.0 . . . . . . . . . . . . A . 32 ARG N . . . . . . . . . rr_1a7i 1 . 1 . 368 . 1 1 32 ARG NE N -12.592 -4.691 4.012 . . . 1.0 . . . . . . . . . . . . A . 32 ARG NE . . . . . . . . . rr_1a7i 1 . 1 . 369 . 1 1 32 ARG NH1 N -14.117 -6.432 3.410 . . . 1.0 . . . . . . . . . . . . A . 32 ARG NH1 . . . . . . . . . rr_1a7i 1 . 1 . 370 . 1 1 32 ARG NH2 N -13.662 -5.973 5.674 . . . 1.0 . . . . . . . . . . . . A . 32 ARG NH2 . . . . . . . . . rr_1a7i 1 . 1 . 371 . 1 1 32 ARG O O -8.663 -0.950 2.353 . . . 1.0 . . . . . . . . . . . . A . 32 ARG O . . . . . . . . . rr_1a7i 1 . 1 . 372 . 1 1 33 CYS C C -7.745 0.825 5.137 . . . 1.0 . . . . . . . . . . . . A . 33 CYS C . . . . . . . . . rr_1a7i 1 . 1 . 373 . 1 1 33 CYS CA C -9.072 0.168 4.903 . . . 1.0 . . . . . . . . . . . . A . 33 CYS CA . . . . . . . . . rr_1a7i 1 . 1 . 374 . 1 1 33 CYS CB C -9.850 0.394 6.210 . . . 1.0 . . . . . . . . . . . . A . 33 CYS CB . . . . . . . . . rr_1a7i 1 . 1 . 375 . 1 1 33 CYS H H -8.907 -1.851 5.371 . . . 1.0 . . . . . . . . . . . . A . 33 CYS H . . . . . . . . . rr_1a7i 1 . 1 . 376 . 1 1 33 CYS HA H -9.577 0.662 4.084 . . . 1.0 . . . . . . . . . . . . A . 33 CYS HA . . . . . . . . . rr_1a7i 1 . 1 . 377 . 1 1 33 CYS HB2 H -9.286 -0.077 7.044 . . . 1.0 . . . . . . . . . . . . A . 33 CYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 378 . 1 1 33 CYS HB3 H -9.871 1.490 6.400 . . . 1.0 . . . . . . . . . . . . A . 33 CYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 379 . 1 1 33 CYS HG H -11.868 0.096 7.363 . . . 1.0 . . . . . . . . . . . . A . 33 CYS HG . . . . . . . . . rr_1a7i 1 . 1 . 380 . 1 1 33 CYS N N -8.891 -1.232 4.589 . . . 1.0 . . . . . . . . . . . . A . 33 CYS N . . . . . . . . . rr_1a7i 1 . 1 . 381 . 1 1 33 CYS O O -7.491 1.917 4.630 . . . 1.0 . . . . . . . . . . . . A . 33 CYS O . . . . . . . . . rr_1a7i 1 . 1 . 382 . 1 1 33 CYS SG S -11.541 -0.277 6.134 . . . 1.0 . . . . . . . . . . . . A . 33 CYS SG . . . . . . . . . rr_1a7i 1 . 1 . 383 . 1 1 34 CYS C C -4.661 0.151 5.294 . . . 1.0 . . . . . . . . . . . . A . 34 CYS C . . . . . . . . . rr_1a7i 1 . 1 . 384 . 1 1 34 CYS CA C -5.589 0.626 6.374 . . . 1.0 . . . . . . . . . . . . A . 34 CYS CA . . . . . . . . . rr_1a7i 1 . 1 . 385 . 1 1 34 CYS CB C -5.263 0.092 7.809 . . . 1.0 . . . . . . . . . . . . A . 34 CYS CB . . . . . . . . . rr_1a7i 1 . 1 . 386 . 1 1 34 CYS H H -7.132 -0.742 6.304 . . . 1.0 . . . . . . . . . . . . A . 34 CYS H . . . . . . . . . rr_1a7i 1 . 1 . 387 . 1 1 34 CYS HA H -5.581 1.707 6.386 . . . 1.0 . . . . . . . . . . . . A . 34 CYS HA . . . . . . . . . rr_1a7i 1 . 1 . 388 . 1 1 34 CYS HB2 H -5.771 0.767 8.531 . . . 1.0 . . . . . . . . . . . . A . 34 CYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 389 . 1 1 34 CYS HB3 H -5.769 -0.889 7.915 . . . 1.0 . . . . . . . . . . . . A . 34 CYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 390 . 1 1 34 CYS N N -6.880 0.151 5.938 . . . 1.0 . . . . . . . . . . . . A . 34 CYS N . . . . . . . . . rr_1a7i 1 . 1 . 391 . 1 1 34 CYS O O -3.945 -0.841 5.414 . . . 1.0 . . . . . . . . . . . . A . 34 CYS O . . . . . . . . . rr_1a7i 1 . 1 . 392 . 1 1 34 CYS SG S -3.516 -0.134 8.311 . . . 1.0 . . . . . . . . . . . . A . 34 CYS SG . . . . . . . . . rr_1a7i 1 . 1 . 393 . 1 1 35 PHE C C -3.204 1.762 2.695 . . . 1.0 . . . . . . . . . . . . A . 35 PHE C . . . . . . . . . rr_1a7i 1 . 1 . 394 . 1 1 35 PHE CA C -4.057 0.554 2.941 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CA . . . . . . . . . rr_1a7i 1 . 1 . 395 . 1 1 35 PHE CB C -5.123 0.368 1.828 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CB . . . . . . . . . rr_1a7i 1 . 1 . 396 . 1 1 35 PHE CD1 C -4.404 -1.723 0.617 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CD1 . . . . . . . . . rr_1a7i 1 . 1 . 397 . 1 1 35 PHE CD2 C -4.205 0.401 -0.504 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CD2 . . . . . . . . . rr_1a7i 1 . 1 . 398 . 1 1 35 PHE CE1 C -3.824 -2.368 -0.480 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CE1 . . . . . . . . . rr_1a7i 1 . 1 . 399 . 1 1 35 PHE CE2 C -3.683 -0.237 -1.630 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CE2 . . . . . . . . . rr_1a7i 1 . 1 . 400 . 1 1 35 PHE CG C -4.566 -0.330 0.630 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CG . . . . . . . . . rr_1a7i 1 . 1 . 401 . 1 1 35 PHE CZ C -3.481 -1.624 -1.622 . . . 1.0 . . . . . . . . . . . . A . 35 PHE CZ . . . . . . . . . rr_1a7i 1 . 1 . 402 . 1 1 35 PHE H H -5.385 1.642 4.111 . . . 1.0 . . . . . . . . . . . . A . 35 PHE H . . . . . . . . . rr_1a7i 1 . 1 . 403 . 1 1 35 PHE HA H -3.439 -0.324 3.070 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HA . . . . . . . . . rr_1a7i 1 . 1 . 404 . 1 1 35 PHE HB2 H -5.952 -0.262 2.212 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HB2 . . . . . . . . . rr_1a7i 1 . 1 . 405 . 1 1 35 PHE HB3 H -5.567 1.335 1.519 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HB3 . . . . . . . . . rr_1a7i 1 . 1 . 406 . 1 1 35 PHE HD1 H -4.712 -2.309 1.467 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HD1 . . . . . . . . . rr_1a7i 1 . 1 . 407 . 1 1 35 PHE HD2 H -4.342 1.467 -0.502 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HD2 . . . . . . . . . rr_1a7i 1 . 1 . 408 . 1 1 35 PHE HE1 H -3.642 -3.434 -0.406 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HE1 . . . . . . . . . rr_1a7i 1 . 1 . 409 . 1 1 35 PHE HE2 H -3.430 0.356 -2.491 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HE2 . . . . . . . . . rr_1a7i 1 . 1 . 410 . 1 1 35 PHE HZ H -3.069 -2.098 -2.501 . . . 1.0 . . . . . . . . . . . . A . 35 PHE HZ . . . . . . . . . rr_1a7i 1 . 1 . 411 . 1 1 35 PHE N N -4.715 0.894 4.170 . . . 1.0 . . . . . . . . . . . . A . 35 PHE N . . . . . . . . . rr_1a7i 1 . 1 . 412 . 1 1 35 PHE O O -3.691 2.883 2.798 . . . 1.0 . . . . . . . . . . . . A . 35 PHE O . . . . . . . . . rr_1a7i 1 . 1 . 413 . 1 1 36 LEU C C 0.108 2.545 1.362 . . . 1.0 . . . . . . . . . . . . A . 36 LEU C . . . . . . . . . rr_1a7i 1 . 1 . 414 . 1 1 36 LEU CA C -0.982 2.671 2.390 . . . 1.0 . . . . . . . . . . . . A . 36 LEU CA . . . . . . . . . rr_1a7i 1 . 1 . 415 . 1 1 36 LEU CB C -0.291 2.696 3.780 . . . 1.0 . . . . . . . . . . . . A . 36 LEU CB . . . . . . . . . rr_1a7i 1 . 1 . 416 . 1 1 36 LEU CD1 C -0.777 0.284 4.882 . . . 1.0 . . . . . . . . . . . . A . 36 LEU CD1 . . . . . . . . . rr_1a7i 1 . 1 . 417 . 1 1 36 LEU CD2 C 1.419 0.658 3.634 . . . 1.0 . . . . . . . . . . . . A . 36 LEU CD2 . . . . . . . . . rr_1a7i 1 . 1 . 418 . 1 1 36 LEU CG C 0.239 1.332 4.362 . . . 1.0 . . . . . . . . . . . . A . 36 LEU CG . . . . . . . . . rr_1a7i 1 . 1 . 419 . 1 1 36 LEU H H -1.402 0.724 2.665 . . . 1.0 . . . . . . . . . . . . A . 36 LEU H . . . . . . . . . rr_1a7i 1 . 1 . 420 . 1 1 36 LEU HA H -1.500 3.603 2.210 . . . 1.0 . . . . . . . . . . . . A . 36 LEU HA . . . . . . . . . rr_1a7i 1 . 1 . 421 . 1 1 36 LEU HB2 H 0.534 3.442 3.796 . . . 1.0 . . . . . . . . . . . . A . 36 LEU HB2 . . . . . . . . . rr_1a7i 1 . 1 . 422 . 1 1 36 LEU HB3 H -1.050 3.064 4.503 . . . 1.0 . . . . . . . . . . . . A . 36 LEU HB3 . . . . . . . . . rr_1a7i 1 . 1 . 423 . 1 1 36 LEU HD11 H -1.574 0.774 5.481 . . . 1.0 . . . . . . . . . . . . A . 36 LEU HD11 . . . . . . . . . rr_1a7i 1 . 1 . 424 . 1 1 36 LEU HD12 H -1.246 -0.277 4.049 . . . 1.0 . . . . . . . . . . . . A . 36 LEU HD12 . . . . . . . . . rr_1a7i 1 . 1 . 425 . 1 1 36 LEU HD13 H -0.260 -0.459 5.526 . . . 1.0 . . . . . . . . . . . . A . 36 LEU HD13 . . . . . . . . . rr_1a7i 1 . 1 . 426 . 1 1 36 LEU HD21 H 2.206 1.399 3.385 . . . 1.0 . . . . . . . . . . . . A . 36 LEU HD21 . . . . . . . . . rr_1a7i 1 . 1 . 427 . 1 1 36 LEU HD22 H 1.872 -0.120 4.286 . . . 1.0 . . . . . . . . . . . . A . 36 LEU HD22 . . . . . . . . . rr_1a7i 1 . 1 . 428 . 1 1 36 LEU HD23 H 1.080 0.160 2.703 . . . 1.0 . . . . . . . . . . . . A . 36 LEU HD23 . . . . . . . . . rr_1a7i 1 . 1 . 429 . 1 1 36 LEU HG H 0.658 1.679 5.298 . . . 1.0 . . . . . . . . . . . . A . 36 LEU HG . . . . . . . . . rr_1a7i 1 . 1 . 430 . 1 1 36 LEU N N -1.886 1.571 2.444 . . . 1.0 . . . . . . . . . . . . A . 36 LEU N . . . . . . . . . rr_1a7i 1 . 1 . 431 . 1 1 36 LEU O O 0.353 1.491 0.775 . . . 1.0 . . . . . . . . . . . . A . 36 LEU O . . . . . . . . . rr_1a7i 1 . 1 . 432 . 1 1 37 CYS C C 3.077 3.370 1.417 . . . 1.0 . . . . . . . . . . . . A . 37 CYS C . . . . . . . . . rr_1a7i 1 . 1 . 433 . 1 1 37 CYS CA C 2.044 3.892 0.473 . . . 1.0 . . . . . . . . . . . . A . 37 CYS CA . . . . . . . . . rr_1a7i 1 . 1 . 434 . 1 1 37 CYS CB C 2.271 5.407 0.342 . . . 1.0 . . . . . . . . . . . . A . 37 CYS CB . . . . . . . . . rr_1a7i 1 . 1 . 435 . 1 1 37 CYS H H 0.368 4.570 1.414 . . . 1.0 . . . . . . . . . . . . A . 37 CYS H . . . . . . . . . rr_1a7i 1 . 1 . 436 . 1 1 37 CYS HA H 2.114 3.376 -0.470 . . . 1.0 . . . . . . . . . . . . A . 37 CYS HA . . . . . . . . . rr_1a7i 1 . 1 . 437 . 1 1 37 CYS HB2 H 1.353 5.799 -0.097 . . . 1.0 . . . . . . . . . . . . A . 37 CYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 438 . 1 1 37 CYS HB3 H 2.314 5.873 1.323 . . . 1.0 . . . . . . . . . . . . A . 37 CYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 439 . 1 1 37 CYS N N 0.788 3.700 1.154 . . . 1.0 . . . . . . . . . . . . A . 37 CYS N . . . . . . . . . rr_1a7i 1 . 1 . 440 . 1 1 37 CYS O O 3.061 3.697 2.598 . . . 1.0 . . . . . . . . . . . . A . 37 CYS O . . . . . . . . . rr_1a7i 1 . 1 . 441 . 1 1 37 CYS SG S 3.590 6.030 -0.709 . . . 1.0 . . . . . . . . . . . . A . 37 CYS SG . . . . . . . . . rr_1a7i 1 . 1 . 442 . 1 1 38 MET C C 6.166 3.064 1.832 . . . 1.0 . . . . . . . . . . . . A . 38 MET C . . . . . . . . . rr_1a7i 1 . 1 . 443 . 1 1 38 MET CA C 5.083 2.016 1.734 . . . 1.0 . . . . . . . . . . . . A . 38 MET CA . . . . . . . . . rr_1a7i 1 . 1 . 444 . 1 1 38 MET CB C 5.633 0.706 1.130 . . . 1.0 . . . . . . . . . . . . A . 38 MET CB . . . . . . . . . rr_1a7i 1 . 1 . 445 . 1 1 38 MET CE C 8.002 -2.304 2.686 . . . 1.0 . . . . . . . . . . . . A . 38 MET CE . . . . . . . . . rr_1a7i 1 . 1 . 446 . 1 1 38 MET CG C 6.573 -0.117 2.018 . . . 1.0 . . . . . . . . . . . . A . 38 MET CG . . . . . . . . . rr_1a7i 1 . 1 . 447 . 1 1 38 MET H H 4.020 2.266 -0.036 . . . 1.0 . . . . . . . . . . . . A . 38 MET H . . . . . . . . . rr_1a7i 1 . 1 . 448 . 1 1 38 MET HA H 4.703 1.806 2.724 . . . 1.0 . . . . . . . . . . . . A . 38 MET HA . . . . . . . . . rr_1a7i 1 . 1 . 449 . 1 1 38 MET HB2 H 4.755 0.054 0.933 . . . 1.0 . . . . . . . . . . . . A . 38 MET HB2 . . . . . . . . . rr_1a7i 1 . 1 . 450 . 1 1 38 MET HB3 H 6.121 0.919 0.157 . . . 1.0 . . . . . . . . . . . . A . 38 MET HB3 . . . . . . . . . rr_1a7i 1 . 1 . 451 . 1 1 38 MET HE1 H 7.421 -2.328 3.632 . . . 1.0 . . . . . . . . . . . . A . 38 MET HE1 . . . . . . . . . rr_1a7i 1 . 1 . 452 . 1 1 38 MET HE2 H 8.393 -3.327 2.498 . . . 1.0 . . . . . . . . . . . . A . 38 MET HE2 . . . . . . . . . rr_1a7i 1 . 1 . 453 . 1 1 38 MET HE3 H 8.871 -1.627 2.833 . . . 1.0 . . . . . . . . . . . . A . 38 MET HE3 . . . . . . . . . rr_1a7i 1 . 1 . 454 . 1 1 38 MET HG2 H 7.508 0.459 2.186 . . . 1.0 . . . . . . . . . . . . A . 38 MET HG2 . . . . . . . . . rr_1a7i 1 . 1 . 455 . 1 1 38 MET HG3 H 6.077 -0.252 3.003 . . . 1.0 . . . . . . . . . . . . A . 38 MET HG3 . . . . . . . . . rr_1a7i 1 . 1 . 456 . 1 1 38 MET N N 4.012 2.539 0.923 . . . 1.0 . . . . . . . . . . . . A . 38 MET N . . . . . . . . . rr_1a7i 1 . 1 . 457 . 1 1 38 MET O O 7.061 2.960 2.671 . . . 1.0 . . . . . . . . . . . . A . 38 MET O . . . . . . . . . rr_1a7i 1 . 1 . 458 . 1 1 38 MET SD S 6.969 -1.743 1.303 . . . 1.0 . . . . . . . . . . . . A . 38 MET SD . . . . . . . . . rr_1a7i 1 . 1 . 459 . 1 1 39 VAL C C 6.650 6.250 1.954 . . . 1.0 . . . . . . . . . . . . A . 39 VAL C . . . . . . . . . rr_1a7i 1 . 1 . 460 . 1 1 39 VAL CA C 7.068 5.192 0.981 . . . 1.0 . . . . . . . . . . . . A . 39 VAL CA . . . . . . . . . rr_1a7i 1 . 1 . 461 . 1 1 39 VAL CB C 7.344 5.882 -0.361 . . . 1.0 . . . . . . . . . . . . A . 39 VAL CB . . . . . . . . . rr_1a7i 1 . 1 . 462 . 1 1 39 VAL CG1 C 8.770 6.437 -0.329 . . . 1.0 . . . . . . . . . . . . A . 39 VAL CG1 . . . . . . . . . rr_1a7i 1 . 1 . 463 . 1 1 39 VAL CG2 C 7.017 4.939 -1.495 . . . 1.0 . . . . . . . . . . . . A . 39 VAL CG2 . . . . . . . . . rr_1a7i 1 . 1 . 464 . 1 1 39 VAL H H 5.295 4.215 0.364 . . . 1.0 . . . . . . . . . . . . A . 39 VAL H . . . . . . . . . rr_1a7i 1 . 1 . 465 . 1 1 39 VAL HA H 8.005 4.769 1.319 . . . 1.0 . . . . . . . . . . . . A . 39 VAL HA . . . . . . . . . rr_1a7i 1 . 1 . 466 . 1 1 39 VAL HB H 6.702 6.748 -0.620 . . . 1.0 . . . . . . . . . . . . A . 39 VAL HB . . . . . . . . . rr_1a7i 1 . 1 . 467 . 1 1 39 VAL HG11 H 9.507 5.629 -0.139 . . . 1.0 . . . . . . . . . . . . A . 39 VAL HG11 . . . . . . . . . rr_1a7i 1 . 1 . 468 . 1 1 39 VAL HG12 H 9.007 6.938 -1.291 . . . 1.0 . . . . . . . . . . . . A . 39 VAL HG12 . . . . . . . . . rr_1a7i 1 . 1 . 469 . 1 1 39 VAL HG13 H 8.824 7.188 0.489 . . . 1.0 . . . . . . . . . . . . A . 39 VAL HG13 . . . . . . . . . rr_1a7i 1 . 1 . 470 . 1 1 39 VAL HG21 H 7.466 3.932 -1.368 . . . 1.0 . . . . . . . . . . . . A . 39 VAL HG21 . . . . . . . . . rr_1a7i 1 . 1 . 471 . 1 1 39 VAL HG22 H 5.909 4.899 -1.462 . . . 1.0 . . . . . . . . . . . . A . 39 VAL HG22 . . . . . . . . . rr_1a7i 1 . 1 . 472 . 1 1 39 VAL HG23 H 7.323 5.380 -2.464 . . . 1.0 . . . . . . . . . . . . A . 39 VAL HG23 . . . . . . . . . rr_1a7i 1 . 1 . 473 . 1 1 39 VAL N N 6.078 4.131 0.990 . . . 1.0 . . . . . . . . . . . . A . 39 VAL N . . . . . . . . . rr_1a7i 1 . 1 . 474 . 1 1 39 VAL O O 7.102 6.275 3.098 . . . 1.0 . . . . . . . . . . . . A . 39 VAL O . . . . . . . . . rr_1a7i 1 . 1 . 475 . 1 1 40 CYS C C 4.420 8.063 3.305 . . . 1.0 . . . . . . . . . . . . A . 40 CYS C . . . . . . . . . rr_1a7i 1 . 1 . 476 . 1 1 40 CYS CA C 5.385 8.343 2.195 . . . 1.0 . . . . . . . . . . . . A . 40 CYS CA . . . . . . . . . rr_1a7i 1 . 1 . 477 . 1 1 40 CYS CB C 4.836 9.337 1.157 . . . 1.0 . . . . . . . . . . . . A . 40 CYS CB . . . . . . . . . rr_1a7i 1 . 1 . 478 . 1 1 40 CYS H H 5.407 7.108 0.538 . . . 1.0 . . . . . . . . . . . . A . 40 CYS H . . . . . . . . . rr_1a7i 1 . 1 . 479 . 1 1 40 CYS HA H 6.286 8.765 2.620 . . . 1.0 . . . . . . . . . . . . A . 40 CYS HA . . . . . . . . . rr_1a7i 1 . 1 . 480 . 1 1 40 CYS HB2 H 5.098 10.353 1.479 . . . 1.0 . . . . . . . . . . . . A . 40 CYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 481 . 1 1 40 CYS HB3 H 5.423 9.106 0.254 . . . 1.0 . . . . . . . . . . . . A . 40 CYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 482 . 1 1 40 CYS N N 5.764 7.157 1.487 . . . 1.0 . . . . . . . . . . . . A . 40 CYS N . . . . . . . . . rr_1a7i 1 . 1 . 483 . 1 1 40 CYS O O 4.551 8.598 4.405 . . . 1.0 . . . . . . . . . . . . A . 40 CYS O . . . . . . . . . rr_1a7i 1 . 1 . 484 . 1 1 40 CYS SG S 3.095 9.241 0.657 . . . 1.0 . . . . . . . . . . . . A . 40 CYS SG . . . . . . . . . rr_1a7i 1 . 1 . 485 . 1 1 41 ARG C C 1.170 7.654 3.675 . . . 1.0 . . . . . . . . . . . . A . 41 ARG C . . . . . . . . . rr_1a7i 1 . 1 . 486 . 1 1 41 ARG CA C 2.341 6.712 3.780 . . . 1.0 . . . . . . . . . . . . A . 41 ARG CA . . . . . . . . . rr_1a7i 1 . 1 . 487 . 1 1 41 ARG CB C 2.662 6.415 5.282 . . . 1.0 . . . . . . . . . . . . A . 41 ARG CB . . . . . . . . . rr_1a7i 1 . 1 . 488 . 1 1 41 ARG CD C 3.306 3.965 5.745 . . . 1.0 . . . . . . . . . . . . A . 41 ARG CD . . . . . . . . . rr_1a7i 1 . 1 . 489 . 1 1 41 ARG CG C 3.797 5.400 5.508 . . . 1.0 . . . . . . . . . . . . A . 41 ARG CG . . . . . . . . . rr_1a7i 1 . 1 . 490 . 1 1 41 ARG CZ C 4.401 1.706 5.904 . . . 1.0 . . . . . . . . . . . . A . 41 ARG CZ . . . . . . . . . rr_1a7i 1 . 1 . 491 . 1 1 41 ARG H H 3.454 6.931 1.991 . . . 1.0 . . . . . . . . . . . . A . 41 ARG H . . . . . . . . . rr_1a7i 1 . 1 . 492 . 1 1 41 ARG HA H 2.026 5.779 3.344 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HA . . . . . . . . . rr_1a7i 1 . 1 . 493 . 1 1 41 ARG HB2 H 2.959 7.359 5.787 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HB2 . . . . . . . . . rr_1a7i 1 . 1 . 494 . 1 1 41 ARG HB3 H 1.758 6.034 5.807 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HB3 . . . . . . . . . rr_1a7i 1 . 1 . 495 . 1 1 41 ARG HD2 H 2.888 3.863 6.771 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HD2 . . . . . . . . . rr_1a7i 1 . 1 . 496 . 1 1 41 ARG HD3 H 2.534 3.673 5.003 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HD3 . . . . . . . . . rr_1a7i 1 . 1 . 497 . 1 1 41 ARG HE H 5.318 3.390 5.185 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HE . . . . . . . . . rr_1a7i 1 . 1 . 498 . 1 1 41 ARG HG2 H 4.493 5.442 4.642 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HG2 . . . . . . . . . rr_1a7i 1 . 1 . 499 . 1 1 41 ARG HG3 H 4.368 5.704 6.411 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HG3 . . . . . . . . . rr_1a7i 1 . 1 . 500 . 1 1 41 ARG HH11 H 2.484 1.746 6.644 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HH11 . . . . . . . . . rr_1a7i 1 . 1 . 501 . 1 1 41 ARG HH12 H 3.248 0.192 6.684 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HH12 . . . . . . . . . rr_1a7i 1 . 1 . 502 . 1 1 41 ARG HH21 H 6.303 1.283 5.250 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HH21 . . . . . . . . . rr_1a7i 1 . 1 . 503 . 1 1 41 ARG HH22 H 5.431 -0.072 5.885 . . . 1.0 . . . . . . . . . . . . A . 41 ARG HH22 . . . . . . . . . rr_1a7i 1 . 1 . 504 . 1 1 41 ARG N N 3.442 7.200 2.965 . . . 1.0 . . . . . . . . . . . . A . 41 ARG N . . . . . . . . . rr_1a7i 1 . 1 . 505 . 1 1 41 ARG NE N 4.474 3.035 5.589 . . . 1.0 . . . . . . . . . . . . A . 41 ARG NE . . . . . . . . . rr_1a7i 1 . 1 . 506 . 1 1 41 ARG NH1 N 3.278 1.167 6.461 . . . 1.0 . . . . . . . . . . . . A . 41 ARG NH1 . . . . . . . . . rr_1a7i 1 . 1 . 507 . 1 1 41 ARG NH2 N 5.475 0.901 5.659 . . . 1.0 . . . . . . . . . . . . A . 41 ARG NH2 . . . . . . . . . rr_1a7i 1 . 1 . 508 . 1 1 41 ARG O O 0.745 8.193 4.696 . . . 1.0 . . . . . . . . . . . . A . 41 ARG O . . . . . . . . . rr_1a7i 1 . 1 . 509 . 1 1 42 LYS C C -1.760 7.697 2.575 . . . 1.0 . . . . . . . . . . . . A . 42 LYS C . . . . . . . . . rr_1a7i 1 . 1 . 510 . 1 1 42 LYS CA C -0.624 8.665 2.346 . . . 1.0 . . . . . . . . . . . . A . 42 LYS CA . . . . . . . . . rr_1a7i 1 . 1 . 511 . 1 1 42 LYS CB C -0.634 9.524 1.048 . . . 1.0 . . . . . . . . . . . . A . 42 LYS CB . . . . . . . . . rr_1a7i 1 . 1 . 512 . 1 1 42 LYS CD C -2.108 8.358 -0.647 . . . 1.0 . . . . . . . . . . . . A . 42 LYS CD . . . . . . . . . rr_1a7i 1 . 1 . 513 . 1 1 42 LYS CE C -2.928 8.591 -1.920 . . . 1.0 . . . . . . . . . . . . A . 42 LYS CE . . . . . . . . . rr_1a7i 1 . 1 . 514 . 1 1 42 LYS CG C -1.888 9.622 0.177 . . . 1.0 . . . . . . . . . . . . A . 42 LYS CG . . . . . . . . . rr_1a7i 1 . 1 . 515 . 1 1 42 LYS H H 0.829 7.470 1.559 . . . 1.0 . . . . . . . . . . . . A . 42 LYS H . . . . . . . . . rr_1a7i 1 . 1 . 516 . 1 1 42 LYS HA H -0.663 9.377 3.159 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HA . . . . . . . . . rr_1a7i 1 . 1 . 517 . 1 1 42 LYS HB2 H -0.351 10.558 1.341 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 518 . 1 1 42 LYS HB3 H 0.174 9.155 0.382 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 519 . 1 1 42 LYS HD2 H -1.089 8.006 -0.906 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HD2 . . . . . . . . . rr_1a7i 1 . 1 . 520 . 1 1 42 LYS HD3 H -2.563 7.561 -0.025 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HD3 . . . . . . . . . rr_1a7i 1 . 1 . 521 . 1 1 42 LYS HE2 H -2.464 9.384 -2.544 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HE2 . . . . . . . . . rr_1a7i 1 . 1 . 522 . 1 1 42 LYS HE3 H -2.994 7.658 -2.514 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HE3 . . . . . . . . . rr_1a7i 1 . 1 . 523 . 1 1 42 LYS HG2 H -2.791 9.900 0.761 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HG2 . . . . . . . . . rr_1a7i 1 . 1 . 524 . 1 1 42 LYS HG3 H -1.689 10.442 -0.547 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HG3 . . . . . . . . . rr_1a7i 1 . 1 . 525 . 1 1 42 LYS HZ1 H -4.774 8.275 -1.032 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HZ1 . . . . . . . . . rr_1a7i 1 . 1 . 526 . 1 1 42 LYS HZ2 H -4.286 9.901 -1.064 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HZ2 . . . . . . . . . rr_1a7i 1 . 1 . 527 . 1 1 42 LYS HZ3 H -4.842 9.154 -2.485 . . . 1.0 . . . . . . . . . . . . A . 42 LYS HZ3 . . . . . . . . . rr_1a7i 1 . 1 . 528 . 1 1 42 LYS N N 0.594 7.896 2.450 . . . 1.0 . . . . . . . . . . . . A . 42 LYS N . . . . . . . . . rr_1a7i 1 . 1 . 529 . 1 1 42 LYS NZ N -4.311 9.012 -1.602 . . . 1.0 . . . . . . . . . . . . A . 42 LYS NZ . . . . . . . . . rr_1a7i 1 . 1 . 530 . 1 1 42 LYS O O -1.553 6.484 2.522 . . . 1.0 . . . . . . . . . . . . A . 42 LYS O . . . . . . . . . rr_1a7i 1 . 1 . 531 . 1 1 43 ASN C C -4.660 6.878 1.767 . . . 1.0 . . . . . . . . . . . . A . 43 ASN C . . . . . . . . . rr_1a7i 1 . 1 . 532 . 1 1 43 ASN CA C -4.159 7.395 3.090 . . . 1.0 . . . . . . . . . . . . A . 43 ASN CA . . . . . . . . . rr_1a7i 1 . 1 . 533 . 1 1 43 ASN CB C -5.309 8.165 3.789 . . . 1.0 . . . . . . . . . . . . A . 43 ASN CB . . . . . . . . . rr_1a7i 1 . 1 . 534 . 1 1 43 ASN CG C -4.843 8.604 5.183 . . . 1.0 . . . . . . . . . . . . A . 43 ASN CG . . . . . . . . . rr_1a7i 1 . 1 . 535 . 1 1 43 ASN H H -3.134 9.193 2.908 . . . 1.0 . . . . . . . . . . . . A . 43 ASN H . . . . . . . . . rr_1a7i 1 . 1 . 536 . 1 1 43 ASN HA H -3.872 6.551 3.703 . . . 1.0 . . . . . . . . . . . . A . 43 ASN HA . . . . . . . . . rr_1a7i 1 . 1 . 537 . 1 1 43 ASN HB2 H -5.614 9.049 3.184 . . . 1.0 . . . . . . . . . . . . A . 43 ASN HB2 . . . . . . . . . rr_1a7i 1 . 1 . 538 . 1 1 43 ASN HB3 H -6.194 7.504 3.916 . . . 1.0 . . . . . . . . . . . . A . 43 ASN HB3 . . . . . . . . . rr_1a7i 1 . 1 . 539 . 1 1 43 ASN HD21 H -4.933 10.597 4.699 . . . 1.0 . . . . . . . . . . . . A . 43 ASN HD21 . . . . . . . . . rr_1a7i 1 . 1 . 540 . 1 1 43 ASN HD22 H -4.418 10.261 6.319 . . . 1.0 . . . . . . . . . . . . A . 43 ASN HD22 . . . . . . . . . rr_1a7i 1 . 1 . 541 . 1 1 43 ASN N N -2.986 8.209 2.857 . . . 1.0 . . . . . . . . . . . . A . 43 ASN N . . . . . . . . . rr_1a7i 1 . 1 . 542 . 1 1 43 ASN ND2 N -4.721 9.939 5.422 . . . 1.0 . . . . . . . . . . . . A . 43 ASN ND2 . . . . . . . . . rr_1a7i 1 . 1 . 543 . 1 1 43 ASN O O -5.385 7.558 1.042 . . . 1.0 . . . . . . . . . . . . A . 43 ASN O . . . . . . . . . rr_1a7i 1 . 1 . 544 . 1 1 43 ASN OD1 O -4.591 7.759 6.041 . . . 1.0 . . . . . . . . . . . . A . 43 ASN OD1 . . . . . . . . . rr_1a7i 1 . 1 . 545 . 1 1 44 LEU C C -5.621 4.027 0.453 . . . 1.0 . . . . . . . . . . . . A . 44 LEU C . . . . . . . . . rr_1a7i 1 . 1 . 546 . 1 1 44 LEU CA C -4.476 4.972 0.184 . . . 1.0 . . . . . . . . . . . . A . 44 LEU CA . . . . . . . . . rr_1a7i 1 . 1 . 547 . 1 1 44 LEU CB C -3.184 4.231 -0.265 . . . 1.0 . . . . . . . . . . . . A . 44 LEU CB . . . . . . . . . rr_1a7i 1 . 1 . 548 . 1 1 44 LEU CD1 C -3.212 4.851 -2.765 . . . 1.0 . . . . . . . . . . . . A . 44 LEU CD1 . . . . . . . . . rr_1a7i 1 . 1 . 549 . 1 1 44 LEU CD2 C -1.751 2.968 -1.895 . . . 1.0 . . . . . . . . . . . . A . 44 LEU CD2 . . . . . . . . . rr_1a7i 1 . 1 . 550 . 1 1 44 LEU CG C -3.077 3.732 -1.722 . . . 1.0 . . . . . . . . . . . . A . 44 LEU CG . . . . . . . . . rr_1a7i 1 . 1 . 551 . 1 1 44 LEU H H -3.664 5.121 2.069 . . . 1.0 . . . . . . . . . . . . A . 44 LEU H . . . . . . . . . rr_1a7i 1 . 1 . 552 . 1 1 44 LEU HA H -4.773 5.702 -0.556 . . . 1.0 . . . . . . . . . . . . A . 44 LEU HA . . . . . . . . . rr_1a7i 1 . 1 . 553 . 1 1 44 LEU HB2 H -2.325 4.922 -0.100 . . . 1.0 . . . . . . . . . . . . A . 44 LEU HB2 . . . . . . . . . rr_1a7i 1 . 1 . 554 . 1 1 44 LEU HB3 H -3.012 3.362 0.402 . . . 1.0 . . . . . . . . . . . . A . 44 LEU HB3 . . . . . . . . . rr_1a7i 1 . 1 . 555 . 1 1 44 LEU HD11 H -2.408 5.600 -2.609 . . . 1.0 . . . . . . . . . . . . A . 44 LEU HD11 . . . . . . . . . rr_1a7i 1 . 1 . 556 . 1 1 44 LEU HD12 H -3.111 4.437 -3.791 . . . 1.0 . . . . . . . . . . . . A . 44 LEU HD12 . . . . . . . . . rr_1a7i 1 . 1 . 557 . 1 1 44 LEU HD13 H -4.196 5.360 -2.689 . . . 1.0 . . . . . . . . . . . . A . 44 LEU HD13 . . . . . . . . . rr_1a7i 1 . 1 . 558 . 1 1 44 LEU HD21 H -0.890 3.603 -1.590 . . . 1.0 . . . . . . . . . . . . A . 44 LEU HD21 . . . . . . . . . rr_1a7i 1 . 1 . 559 . 1 1 44 LEU HD22 H -1.740 2.053 -1.266 . . . 1.0 . . . . . . . . . . . . A . 44 LEU HD22 . . . . . . . . . rr_1a7i 1 . 1 . 560 . 1 1 44 LEU HD23 H -1.608 2.674 -2.956 . . . 1.0 . . . . . . . . . . . . A . 44 LEU HD23 . . . . . . . . . rr_1a7i 1 . 1 . 561 . 1 1 44 LEU HG H -3.900 3.016 -1.922 . . . 1.0 . . . . . . . . . . . . A . 44 LEU HG . . . . . . . . . rr_1a7i 1 . 1 . 562 . 1 1 44 LEU N N -4.234 5.639 1.435 . . . 1.0 . . . . . . . . . . . . A . 44 LEU N . . . . . . . . . rr_1a7i 1 . 1 . 563 . 1 1 44 LEU O O -5.991 3.807 1.610 . . . 1.0 . . . . . . . . . . . . A . 44 LEU O . . . . . . . . . rr_1a7i 1 . 1 . 564 . 1 1 45 ASP C C -7.664 1.991 -1.754 . . . 1.0 . . . . . . . . . . . . A . 45 ASP C . . . . . . . . . rr_1a7i 1 . 1 . 565 . 1 1 45 ASP CA C -7.445 2.696 -0.448 . . . 1.0 . . . . . . . . . . . . A . 45 ASP CA . . . . . . . . . rr_1a7i 1 . 1 . 566 . 1 1 45 ASP CB C -8.702 3.516 0.022 . . . 1.0 . . . . . . . . . . . . A . 45 ASP CB . . . . . . . . . rr_1a7i 1 . 1 . 567 . 1 1 45 ASP CG C -9.054 4.720 -0.878 . . . 1.0 . . . . . . . . . . . . A . 45 ASP CG . . . . . . . . . rr_1a7i 1 . 1 . 568 . 1 1 45 ASP H H -5.891 3.550 -1.546 . . . 1.0 . . . . . . . . . . . . A . 45 ASP H . . . . . . . . . rr_1a7i 1 . 1 . 569 . 1 1 45 ASP HA H -7.249 1.931 0.289 . . . 1.0 . . . . . . . . . . . . A . 45 ASP HA . . . . . . . . . rr_1a7i 1 . 1 . 570 . 1 1 45 ASP HB2 H -9.585 2.847 0.124 . . . 1.0 . . . . . . . . . . . . A . 45 ASP HB2 . . . . . . . . . rr_1a7i 1 . 1 . 571 . 1 1 45 ASP HB3 H -8.501 3.919 1.037 . . . 1.0 . . . . . . . . . . . . A . 45 ASP HB3 . . . . . . . . . rr_1a7i 1 . 1 . 572 . 1 1 45 ASP N N -6.240 3.470 -0.612 . . . 1.0 . . . . . . . . . . . . A . 45 ASP N . . . . . . . . . rr_1a7i 1 . 1 . 573 . 1 1 45 ASP O O -6.705 1.599 -2.419 . . . 1.0 . . . . . . . . . . . . A . 45 ASP O . . . . . . . . . rr_1a7i 1 . 1 . 574 . 1 1 45 ASP OD1 O -8.234 5.672 -0.982 . . . 1.0 . . . . . . . . . . . . A . 45 ASP OD1 . . . . . . . . . rr_1a7i 1 . 1 . 575 . 1 1 45 ASP OD2 O -10.171 4.699 -1.462 . . . 1.0 . . . . . . . . . . . . A . 45 ASP OD2 . . . . . . . . . rr_1a7i 1 . 1 . 576 . 1 1 46 SER C C -9.587 2.310 -4.398 . . . 1.0 . . . . . . . . . . . . A . 46 SER C . . . . . . . . . rr_1a7i 1 . 1 . 577 . 1 1 46 SER CA C -9.347 1.212 -3.394 . . . 1.0 . . . . . . . . . . . . A . 46 SER CA . . . . . . . . . rr_1a7i 1 . 1 . 578 . 1 1 46 SER CB C -10.637 0.366 -3.245 . . . 1.0 . . . . . . . . . . . . A . 46 SER CB . . . . . . . . . rr_1a7i 1 . 1 . 579 . 1 1 46 SER H H -9.702 2.133 -1.579 . . . 1.0 . . . . . . . . . . . . A . 46 SER H . . . . . . . . . rr_1a7i 1 . 1 . 580 . 1 1 46 SER HA H -8.549 0.580 -3.760 . . . 1.0 . . . . . . . . . . . . A . 46 SER HA . . . . . . . . . rr_1a7i 1 . 1 . 581 . 1 1 46 SER HB2 H -11.482 0.992 -2.883 . . . 1.0 . . . . . . . . . . . . A . 46 SER HB2 . . . . . . . . . rr_1a7i 1 . 1 . 582 . 1 1 46 SER HB3 H -10.918 -0.092 -4.218 . . . 1.0 . . . . . . . . . . . . A . 46 SER HB3 . . . . . . . . . rr_1a7i 1 . 1 . 583 . 1 1 46 SER HG H -10.443 -0.278 -1.445 . . . 1.0 . . . . . . . . . . . . A . 46 SER HG . . . . . . . . . rr_1a7i 1 . 1 . 584 . 1 1 46 SER N N -8.947 1.815 -2.149 . . . 1.0 . . . . . . . . . . . . A . 46 SER N . . . . . . . . . rr_1a7i 1 . 1 . 585 . 1 1 46 SER O O -10.581 2.302 -5.123 . . . 1.0 . . . . . . . . . . . . A . 46 SER O . . . . . . . . . rr_1a7i 1 . 1 . 586 . 1 1 46 SER OG O -10.431 -0.687 -2.313 . . . 1.0 . . . . . . . . . . . . A . 46 SER OG . . . . . . . . . rr_1a7i 1 . 1 . 587 . 1 1 47 THR C C -7.799 3.546 -6.630 . . . 1.0 . . . . . . . . . . . . A . 47 THR C . . . . . . . . . rr_1a7i 1 . 1 . 588 . 1 1 47 THR CA C -8.544 4.258 -5.533 . . . 1.0 . . . . . . . . . . . . A . 47 THR CA . . . . . . . . . rr_1a7i 1 . 1 . 589 . 1 1 47 THR CB C -7.864 5.561 -5.119 . . . 1.0 . . . . . . . . . . . . A . 47 THR CB . . . . . . . . . rr_1a7i 1 . 1 . 590 . 1 1 47 THR CG2 C -8.925 6.456 -4.447 . . . 1.0 . . . . . . . . . . . . A . 47 THR CG2 . . . . . . . . . rr_1a7i 1 . 1 . 591 . 1 1 47 THR H H -7.865 3.278 -3.845 . . . 1.0 . . . . . . . . . . . . A . 47 THR H . . . . . . . . . rr_1a7i 1 . 1 . 592 . 1 1 47 THR HA H -9.537 4.481 -5.898 . . . 1.0 . . . . . . . . . . . . A . 47 THR HA . . . . . . . . . rr_1a7i 1 . 1 . 593 . 1 1 47 THR HB H -7.487 6.105 -6.013 . . . 1.0 . . . . . . . . . . . . A . 47 THR HB . . . . . . . . . rr_1a7i 1 . 1 . 594 . 1 1 47 THR HG1 H -6.316 6.193 -4.163 . . . 1.0 . . . . . . . . . . . . A . 47 THR HG1 . . . . . . . . . rr_1a7i 1 . 1 . 595 . 1 1 47 THR HG21 H -9.354 5.960 -3.552 . . . 1.0 . . . . . . . . . . . . A . 47 THR HG21 . . . . . . . . . rr_1a7i 1 . 1 . 596 . 1 1 47 THR HG22 H -8.477 7.424 -4.133 . . . 1.0 . . . . . . . . . . . . A . 47 THR HG22 . . . . . . . . . rr_1a7i 1 . 1 . 597 . 1 1 47 THR HG23 H -9.752 6.671 -5.156 . . . 1.0 . . . . . . . . . . . . A . 47 THR HG23 . . . . . . . . . rr_1a7i 1 . 1 . 598 . 1 1 47 THR N N -8.632 3.272 -4.482 . . . 1.0 . . . . . . . . . . . . A . 47 THR N . . . . . . . . . rr_1a7i 1 . 1 . 599 . 1 1 47 THR O O -8.423 2.974 -7.523 . . . 1.0 . . . . . . . . . . . . A . 47 THR O . . . . . . . . . rr_1a7i 1 . 1 . 600 . 1 1 47 THR OG1 O -6.782 5.355 -4.213 . . . 1.0 . . . . . . . . . . . . A . 47 THR OG1 . . . . . . . . . rr_1a7i 1 . 1 . 601 . 1 1 48 THR C C -4.749 2.098 -6.289 . . . 1.0 . . . . . . . . . . . . A . 48 THR C . . . . . . . . . rr_1a7i 1 . 1 . 602 . 1 1 48 THR CA C -5.626 2.693 -7.365 . . . 1.0 . . . . . . . . . . . . A . 48 THR CA . . . . . . . . . rr_1a7i 1 . 1 . 603 . 1 1 48 THR CB C -4.868 3.451 -8.463 . . . 1.0 . . . . . . . . . . . . A . 48 THR CB . . . . . . . . . rr_1a7i 1 . 1 . 604 . 1 1 48 THR CG2 C -5.874 3.841 -9.568 . . . 1.0 . . . . . . . . . . . . A . 48 THR CG2 . . . . . . . . . rr_1a7i 1 . 1 . 605 . 1 1 48 THR H H -5.889 4.004 -5.891 . . . 1.0 . . . . . . . . . . . . A . 48 THR H . . . . . . . . . rr_1a7i 1 . 1 . 606 . 1 1 48 THR HA H -6.205 1.889 -7.798 . . . 1.0 . . . . . . . . . . . . A . 48 THR HA . . . . . . . . . rr_1a7i 1 . 1 . 607 . 1 1 48 THR HB H -4.100 2.802 -8.937 . . . 1.0 . . . . . . . . . . . . A . 48 THR HB . . . . . . . . . rr_1a7i 1 . 1 . 608 . 1 1 48 THR HG1 H -3.653 4.931 -8.675 . . . 1.0 . . . . . . . . . . . . A . 48 THR HG1 . . . . . . . . . rr_1a7i 1 . 1 . 609 . 1 1 48 THR HG21 H -6.382 2.935 -9.963 . . . 1.0 . . . . . . . . . . . . A . 48 THR HG21 . . . . . . . . . rr_1a7i 1 . 1 . 610 . 1 1 48 THR HG22 H -6.649 4.538 -9.181 . . . 1.0 . . . . . . . . . . . . A . 48 THR HG22 . . . . . . . . . rr_1a7i 1 . 1 . 611 . 1 1 48 THR HG23 H -5.349 4.339 -10.411 . . . 1.0 . . . . . . . . . . . . A . 48 THR HG23 . . . . . . . . . rr_1a7i 1 . 1 . 612 . 1 1 48 THR N N -6.448 3.526 -6.562 . . . 1.0 . . . . . . . . . . . . A . 48 THR N . . . . . . . . . rr_1a7i 1 . 1 . 613 . 1 1 48 THR O O -5.238 1.685 -5.238 . . . 1.0 . . . . . . . . . . . . A . 48 THR O . . . . . . . . . rr_1a7i 1 . 1 . 614 . 1 1 48 THR OG1 O -4.238 4.634 -7.974 . . . 1.0 . . . . . . . . . . . . A . 48 THR OG1 . . . . . . . . . rr_1a7i 1 . 1 . 615 . 1 1 49 VAL C C -1.243 1.483 -7.049 . . . 1.0 . . . . . . . . . . . . A . 49 VAL C . . . . . . . . . rr_1a7i 1 . 1 . 616 . 1 1 49 VAL CA C -2.284 1.514 -5.955 . . . 1.0 . . . . . . . . . . . . A . 49 VAL CA . . . . . . . . . rr_1a7i 1 . 1 . 617 . 1 1 49 VAL CB C -2.489 0.231 -5.233 . . . 1.0 . . . . . . . . . . . . A . 49 VAL CB . . . . . . . . . rr_1a7i 1 . 1 . 618 . 1 1 49 VAL CG1 C -2.772 -0.812 -6.273 . . . 1.0 . . . . . . . . . . . . A . 49 VAL CG1 . . . . . . . . . rr_1a7i 1 . 1 . 619 . 1 1 49 VAL CG2 C -1.321 -0.124 -4.287 . . . 1.0 . . . . . . . . . . . . A . 49 VAL CG2 . . . . . . . . . rr_1a7i 1 . 1 . 620 . 1 1 49 VAL H H -3.228 2.497 -7.435 . . . 1.0 . . . . . . . . . . . . A . 49 VAL H . . . . . . . . . rr_1a7i 1 . 1 . 621 . 1 1 49 VAL HA H -1.979 2.165 -5.208 . . . 1.0 . . . . . . . . . . . . A . 49 VAL HA . . . . . . . . . rr_1a7i 1 . 1 . 622 . 1 1 49 VAL HB H -3.398 0.436 -4.645 . . . 1.0 . . . . . . . . . . . . A . 49 VAL HB . . . . . . . . . rr_1a7i 1 . 1 . 623 . 1 1 49 VAL HG11 H -3.481 -0.334 -6.971 . . . 1.0 . . . . . . . . . . . . A . 49 VAL HG11 . . . . . . . . . rr_1a7i 1 . 1 . 624 . 1 1 49 VAL HG12 H -1.815 -0.996 -6.789 . . . 1.0 . . . . . . . . . . . . A . 49 VAL HG12 . . . . . . . . . rr_1a7i 1 . 1 . 625 . 1 1 49 VAL HG13 H -3.182 -1.735 -5.823 . . . 1.0 . . . . . . . . . . . . A . 49 VAL HG13 . . . . . . . . . rr_1a7i 1 . 1 . 626 . 1 1 49 VAL HG21 H -1.092 0.713 -3.596 . . . 1.0 . . . . . . . . . . . . A . 49 VAL HG21 . . . . . . . . . rr_1a7i 1 . 1 . 627 . 1 1 49 VAL HG22 H -1.592 -1.009 -3.679 . . . 1.0 . . . . . . . . . . . . A . 49 VAL HG22 . . . . . . . . . rr_1a7i 1 . 1 . 628 . 1 1 49 VAL HG23 H -0.401 -0.376 -4.853 . . . 1.0 . . . . . . . . . . . . A . 49 VAL HG23 . . . . . . . . . rr_1a7i 1 . 1 . 629 . 1 1 49 VAL N N -3.442 2.070 -6.590 . . . 1.0 . . . . . . . . . . . . A . 49 VAL N . . . . . . . . . rr_1a7i 1 . 1 . 630 . 1 1 49 VAL O O -1.583 1.539 -8.231 . . . 1.0 . . . . . . . . . . . . A . 49 VAL O . . . . . . . . . rr_1a7i 1 . 1 . 631 . 1 1 50 ALA C C 2.187 0.436 -6.963 . . . 1.0 . . . . . . . . . . . . A . 50 ALA C . . . . . . . . . rr_1a7i 1 . 1 . 632 . 1 1 50 ALA CA C 1.095 1.187 -7.652 . . . 1.0 . . . . . . . . . . . . A . 50 ALA CA . . . . . . . . . rr_1a7i 1 . 1 . 633 . 1 1 50 ALA CB C 1.687 2.498 -8.198 . . . 1.0 . . . . . . . . . . . . A . 50 ALA CB . . . . . . . . . rr_1a7i 1 . 1 . 634 . 1 1 50 ALA H H 0.337 1.394 -5.731 . . . 1.0 . . . . . . . . . . . . A . 50 ALA H . . . . . . . . . rr_1a7i 1 . 1 . 635 . 1 1 50 ALA HA H 0.722 0.574 -8.462 . . . 1.0 . . . . . . . . . . . . A . 50 ALA HA . . . . . . . . . rr_1a7i 1 . 1 . 636 . 1 1 50 ALA HB1 H 2.113 3.119 -7.380 . . . 1.0 . . . . . . . . . . . . A . 50 ALA HB1 . . . . . . . . . rr_1a7i 1 . 1 . 637 . 1 1 50 ALA HB2 H 2.484 2.300 -8.947 . . . 1.0 . . . . . . . . . . . . A . 50 ALA HB2 . . . . . . . . . rr_1a7i 1 . 1 . 638 . 1 1 50 ALA HB3 H 0.890 3.090 -8.697 . . . 1.0 . . . . . . . . . . . . A . 50 ALA HB3 . . . . . . . . . rr_1a7i 1 . 1 . 639 . 1 1 50 ALA N N 0.053 1.396 -6.686 . . . 1.0 . . . . . . . . . . . . A . 50 ALA N . . . . . . . . . rr_1a7i 1 . 1 . 640 . 1 1 50 ALA O O 2.242 0.368 -5.738 . . . 1.0 . . . . . . . . . . . . A . 50 ALA O . . . . . . . . . rr_1a7i 1 . 1 . 641 . 1 1 51 ILE C C 5.389 -0.148 -8.092 . . . 1.0 . . . . . . . . . . . . A . 51 ILE C . . . . . . . . . rr_1a7i 1 . 1 . 642 . 1 1 51 ILE CA C 4.288 -0.788 -7.298 . . . 1.0 . . . . . . . . . . . . A . 51 ILE CA . . . . . . . . . rr_1a7i 1 . 1 . 643 . 1 1 51 ILE CB C 4.239 -2.305 -7.479 . . . 1.0 . . . . . . . . . . . . A . 51 ILE CB . . . . . . . . . rr_1a7i 1 . 1 . 644 . 1 1 51 ILE CD1 C 5.020 -2.903 -5.147 . . . 1.0 . . . . . . . . . . . . A . 51 ILE CD1 . . . . . . . . . rr_1a7i 1 . 1 . 645 . 1 1 51 ILE CG1 C 5.300 -3.040 -6.638 . . . 1.0 . . . . . . . . . . . . A . 51 ILE CG1 . . . . . . . . . rr_1a7i 1 . 1 . 646 . 1 1 51 ILE CG2 C 4.252 -2.726 -8.969 . . . 1.0 . . . . . . . . . . . . A . 51 ILE CG2 . . . . . . . . . rr_1a7i 1 . 1 . 647 . 1 1 51 ILE H H 3.003 -0.173 -8.750 . . . 1.0 . . . . . . . . . . . . A . 51 ILE H . . . . . . . . . rr_1a7i 1 . 1 . 648 . 1 1 51 ILE HA H 4.436 -0.523 -6.262 . . . 1.0 . . . . . . . . . . . . A . 51 ILE HA . . . . . . . . . rr_1a7i 1 . 1 . 649 . 1 1 51 ILE HB H 3.257 -2.636 -7.078 . . . 1.0 . . . . . . . . . . . . A . 51 ILE HB . . . . . . . . . rr_1a7i 1 . 1 . 650 . 1 1 51 ILE HD11 H 3.992 -3.264 -4.931 . . . 1.0 . . . . . . . . . . . . A . 51 ILE HD11 . . . . . . . . . rr_1a7i 1 . 1 . 651 . 1 1 51 ILE HD12 H 5.752 -3.480 -4.545 . . . 1.0 . . . . . . . . . . . . A . 51 ILE HD12 . . . . . . . . . rr_1a7i 1 . 1 . 652 . 1 1 51 ILE HD13 H 5.067 -1.837 -4.853 . . . 1.0 . . . . . . . . . . . . A . 51 ILE HD13 . . . . . . . . . rr_1a7i 1 . 1 . 653 . 1 1 51 ILE HG12 H 5.269 -4.120 -6.896 . . . 1.0 . . . . . . . . . . . . A . 51 ILE HG12 . . . . . . . . . rr_1a7i 1 . 1 . 654 . 1 1 51 ILE HG13 H 6.318 -2.662 -6.873 . . . 1.0 . . . . . . . . . . . . A . 51 ILE HG13 . . . . . . . . . rr_1a7i 1 . 1 . 655 . 1 1 51 ILE HG21 H 3.456 -2.203 -9.540 . . . 1.0 . . . . . . . . . . . . A . 51 ILE HG21 . . . . . . . . . rr_1a7i 1 . 1 . 656 . 1 1 51 ILE HG22 H 5.234 -2.508 -9.441 . . . 1.0 . . . . . . . . . . . . A . 51 ILE HG22 . . . . . . . . . rr_1a7i 1 . 1 . 657 . 1 1 51 ILE HG23 H 4.072 -3.820 -9.050 . . . 1.0 . . . . . . . . . . . . A . 51 ILE HG23 . . . . . . . . . rr_1a7i 1 . 1 . 658 . 1 1 51 ILE N N 3.096 -0.156 -7.765 . . . 1.0 . . . . . . . . . . . . A . 51 ILE N . . . . . . . . . rr_1a7i 1 . 1 . 659 . 1 1 51 ILE O O 5.206 0.200 -9.259 . . . 1.0 . . . . . . . . . . . . A . 51 ILE O . . . . . . . . . rr_1a7i 1 . 1 . 660 . 1 1 52 HIS C C 8.870 -0.149 -7.409 . . . 1.0 . . . . . . . . . . . . A . 52 HIS C . . . . . . . . . rr_1a7i 1 . 1 . 661 . 1 1 52 HIS CA C 7.740 0.446 -8.183 . . . 1.0 . . . . . . . . . . . . A . 52 HIS CA . . . . . . . . . rr_1a7i 1 . 1 . 662 . 1 1 52 HIS CB C 7.921 1.979 -8.314 . . . 1.0 . . . . . . . . . . . . A . 52 HIS CB . . . . . . . . . rr_1a7i 1 . 1 . 663 . 1 1 52 HIS CD2 C 8.842 2.864 -10.564 . . . 1.0 . . . . . . . . . . . . A . 52 HIS CD2 . . . . . . . . . rr_1a7i 1 . 1 . 664 . 1 1 52 HIS CE1 C 10.976 2.687 -10.138 . . . 1.0 . . . . . . . . . . . . A . 52 HIS CE1 . . . . . . . . . rr_1a7i 1 . 1 . 665 . 1 1 52 HIS CG C 8.978 2.382 -9.307 . . . 1.0 . . . . . . . . . . . . A . 52 HIS CG . . . . . . . . . rr_1a7i 1 . 1 . 666 . 1 1 52 HIS H H 6.700 -0.171 -6.496 . . . 1.0 . . . . . . . . . . . . A . 52 HIS H . . . . . . . . . rr_1a7i 1 . 1 . 667 . 1 1 52 HIS HA H 7.720 -0.004 -9.167 . . . 1.0 . . . . . . . . . . . . A . 52 HIS HA . . . . . . . . . rr_1a7i 1 . 1 . 668 . 1 1 52 HIS HB2 H 6.961 2.403 -8.675 . . . 1.0 . . . . . . . . . . . . A . 52 HIS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 669 . 1 1 52 HIS HB3 H 8.137 2.444 -7.331 . . . 1.0 . . . . . . . . . . . . A . 52 HIS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 670 . 1 1 52 HIS HD1 H 10.736 1.939 -8.217 . . . 1.0 . . . . . . . . . . . . A . 52 HIS HD1 . . . . . . . . . rr_1a7i 1 . 1 . 671 . 1 1 52 HIS HD2 H 7.949 3.091 -11.134 . . . 1.0 . . . . . . . . . . . . A . 52 HIS HD2 . . . . . . . . . rr_1a7i 1 . 1 . 672 . 1 1 52 HIS HE1 H 12.040 2.721 -10.242 . . . 1.0 . . . . . . . . . . . . A . 52 HIS HE1 . . . . . . . . . rr_1a7i 1 . 1 . 673 . 1 1 52 HIS N N 6.567 0.044 -7.462 . . . 1.0 . . . . . . . . . . . . A . 52 HIS N . . . . . . . . . rr_1a7i 1 . 1 . 674 . 1 1 52 HIS ND1 N 10.321 2.277 -9.061 . . . 1.0 . . . . . . . . . . . . A . 52 HIS ND1 . . . . . . . . . rr_1a7i 1 . 1 . 675 . 1 1 52 HIS NE2 N 10.101 3.049 -11.065 . . . 1.0 . . . . . . . . . . . . A . 52 HIS NE2 . . . . . . . . . rr_1a7i 1 . 1 . 676 . 1 1 52 HIS O O 9.111 0.227 -6.263 . . . 1.0 . . . . . . . . . . . . A . 52 HIS O . . . . . . . . . rr_1a7i 1 . 1 . 677 . 1 1 53 ASP C C 10.292 -2.681 -6.338 . . . 1.0 . . . . . . . . . . . . A . 53 ASP C . . . . . . . . . rr_1a7i 1 . 1 . 678 . 1 1 53 ASP CA C 10.713 -1.816 -7.509 . . . 1.0 . . . . . . . . . . . . A . 53 ASP CA . . . . . . . . . rr_1a7i 1 . 1 . 679 . 1 1 53 ASP CB C 11.932 -0.876 -7.223 . . . 1.0 . . . . . . . . . . . . A . 53 ASP CB . . . . . . . . . rr_1a7i 1 . 1 . 680 . 1 1 53 ASP CG C 13.277 -1.617 -7.083 . . . 1.0 . . . . . . . . . . . . A . 53 ASP CG . . . . . . . . . rr_1a7i 1 . 1 . 681 . 1 1 53 ASP H H 9.319 -1.393 -8.969 . . . 1.0 . . . . . . . . . . . . A . 53 ASP H . . . . . . . . . rr_1a7i 1 . 1 . 682 . 1 1 53 ASP HA H 11.000 -2.487 -8.305 . . . 1.0 . . . . . . . . . . . . A . 53 ASP HA . . . . . . . . . rr_1a7i 1 . 1 . 683 . 1 1 53 ASP HB2 H 12.037 -0.184 -8.086 . . . 1.0 . . . . . . . . . . . . A . 53 ASP HB2 . . . . . . . . . rr_1a7i 1 . 1 . 684 . 1 1 53 ASP HB3 H 11.751 -0.251 -6.321 . . . 1.0 . . . . . . . . . . . . A . 53 ASP HB3 . . . . . . . . . rr_1a7i 1 . 1 . 685 . 1 1 53 ASP N N 9.571 -1.117 -8.044 . . . 1.0 . . . . . . . . . . . . A . 53 ASP N . . . . . . . . . rr_1a7i 1 . 1 . 686 . 1 1 53 ASP O O 9.470 -3.582 -6.496 . . . 1.0 . . . . . . . . . . . . A . 53 ASP O . . . . . . . . . rr_1a7i 1 . 1 . 687 . 1 1 53 ASP OD1 O 13.332 -2.864 -7.268 . . . 1.0 . . . . . . . . . . . . A . 53 ASP OD1 . . . . . . . . . rr_1a7i 1 . 1 . 688 . 1 1 53 ASP OD2 O 14.282 -0.917 -6.787 . . . 1.0 . . . . . . . . . . . . A . 53 ASP OD2 . . . . . . . . . rr_1a7i 1 . 1 . 689 . 1 1 54 ALA C C 9.609 -2.759 -3.070 . . . 1.0 . . . . . . . . . . . . A . 54 ALA C . . . . . . . . . rr_1a7i 1 . 1 . 690 . 1 1 54 ALA CA C 10.708 -3.249 -3.970 . . . 1.0 . . . . . . . . . . . . A . 54 ALA CA . . . . . . . . . rr_1a7i 1 . 1 . 691 . 1 1 54 ALA CB C 12.006 -3.260 -3.133 . . . 1.0 . . . . . . . . . . . . A . 54 ALA CB . . . . . . . . . rr_1a7i 1 . 1 . 692 . 1 1 54 ALA H H 11.497 -1.659 -5.031 . . . 1.0 . . . . . . . . . . . . A . 54 ALA H . . . . . . . . . rr_1a7i 1 . 1 . 693 . 1 1 54 ALA HA H 10.482 -4.261 -4.277 . . . 1.0 . . . . . . . . . . . . A . 54 ALA HA . . . . . . . . . rr_1a7i 1 . 1 . 694 . 1 1 54 ALA HB1 H 12.848 -3.632 -3.755 . . . 1.0 . . . . . . . . . . . . A . 54 ALA HB1 . . . . . . . . . rr_1a7i 1 . 1 . 695 . 1 1 54 ALA HB2 H 12.265 -2.236 -2.783 . . . 1.0 . . . . . . . . . . . . A . 54 ALA HB2 . . . . . . . . . rr_1a7i 1 . 1 . 696 . 1 1 54 ALA HB3 H 11.914 -3.926 -2.248 . . . 1.0 . . . . . . . . . . . . A . 54 ALA HB3 . . . . . . . . . rr_1a7i 1 . 1 . 697 . 1 1 54 ALA N N 10.865 -2.423 -5.140 . . . 1.0 . . . . . . . . . . . . A . 54 ALA N . . . . . . . . . rr_1a7i 1 . 1 . 698 . 1 1 54 ALA O O 9.213 -3.481 -2.157 . . . 1.0 . . . . . . . . . . . . A . 54 ALA O . . . . . . . . . rr_1a7i 1 . 1 . 699 . 1 1 55 GLU C C 6.974 -0.391 -3.121 . . . 1.0 . . . . . . . . . . . . A . 55 GLU C . . . . . . . . . rr_1a7i 1 . 1 . 700 . 1 1 55 GLU CA C 8.165 -0.907 -2.377 . . . 1.0 . . . . . . . . . . . . A . 55 GLU CA . . . . . . . . . rr_1a7i 1 . 1 . 701 . 1 1 55 GLU CB C 8.790 0.256 -1.552 . . . 1.0 . . . . . . . . . . . . A . 55 GLU CB . . . . . . . . . rr_1a7i 1 . 1 . 702 . 1 1 55 GLU CD C 10.781 1.064 -2.926 . . . 1.0 . . . . . . . . . . . . A . 55 GLU CD . . . . . . . . . rr_1a7i 1 . 1 . 703 . 1 1 55 GLU CG C 9.414 1.432 -2.333 . . . 1.0 . . . . . . . . . . . . A . 55 GLU CG . . . . . . . . . rr_1a7i 1 . 1 . 704 . 1 1 55 GLU H H 9.379 -0.965 -4.068 . . . 1.0 . . . . . . . . . . . . A . 55 GLU H . . . . . . . . . rr_1a7i 1 . 1 . 705 . 1 1 55 GLU HA H 7.795 -1.644 -1.677 . . . 1.0 . . . . . . . . . . . . A . 55 GLU HA . . . . . . . . . rr_1a7i 1 . 1 . 706 . 1 1 55 GLU HB2 H 8.000 0.704 -0.914 . . . 1.0 . . . . . . . . . . . . A . 55 GLU HB2 . . . . . . . . . rr_1a7i 1 . 1 . 707 . 1 1 55 GLU HB3 H 9.552 -0.169 -0.865 . . . 1.0 . . . . . . . . . . . . A . 55 GLU HB3 . . . . . . . . . rr_1a7i 1 . 1 . 708 . 1 1 55 GLU HG2 H 8.715 1.775 -3.125 . . . 1.0 . . . . . . . . . . . . A . 55 GLU HG2 . . . . . . . . . rr_1a7i 1 . 1 . 709 . 1 1 55 GLU HG3 H 9.571 2.275 -1.627 . . . 1.0 . . . . . . . . . . . . A . 55 GLU HG3 . . . . . . . . . rr_1a7i 1 . 1 . 710 . 1 1 55 GLU N N 9.092 -1.526 -3.294 . . . 1.0 . . . . . . . . . . . . A . 55 GLU N . . . . . . . . . rr_1a7i 1 . 1 . 711 . 1 1 55 GLU O O 6.982 -0.261 -4.343 . . . 1.0 . . . . . . . . . . . . A . 55 GLU O . . . . . . . . . rr_1a7i 1 . 1 . 712 . 1 1 55 GLU OE1 O 11.679 0.654 -2.142 . . . 1.0 . . . . . . . . . . . . A . 55 GLU OE1 . . . . . . . . . rr_1a7i 1 . 1 . 713 . 1 1 55 GLU OE2 O 10.950 1.195 -4.168 . . . 1.0 . . . . . . . . . . . . A . 55 GLU OE2 . . . . . . . . . rr_1a7i 1 . 1 . 714 . 1 1 56 VAL C C 4.708 1.845 -2.861 . . . 1.0 . . . . . . . . . . . . A . 56 VAL C . . . . . . . . . rr_1a7i 1 . 1 . 715 . 1 1 56 VAL CA C 4.624 0.361 -2.825 . . . 1.0 . . . . . . . . . . . . A . 56 VAL CA . . . . . . . . . rr_1a7i 1 . 1 . 716 . 1 1 56 VAL CB C 3.479 -0.031 -1.899 . . . 1.0 . . . . . . . . . . . . A . 56 VAL CB . . . . . . . . . rr_1a7i 1 . 1 . 717 . 1 1 56 VAL CG1 C 2.103 0.562 -2.329 . . . 1.0 . . . . . . . . . . . . A . 56 VAL CG1 . . . . . . . . . rr_1a7i 1 . 1 . 718 . 1 1 56 VAL CG2 C 3.483 -1.568 -1.827 . . . 1.0 . . . . . . . . . . . . A . 56 VAL CG2 . . . . . . . . . rr_1a7i 1 . 1 . 719 . 1 1 56 VAL H H 5.952 -0.212 -1.358 . . . 1.0 . . . . . . . . . . . . A . 56 VAL H . . . . . . . . . rr_1a7i 1 . 1 . 720 . 1 1 56 VAL HA H 4.448 -0.019 -3.822 . . . 1.0 . . . . . . . . . . . . A . 56 VAL HA . . . . . . . . . rr_1a7i 1 . 1 . 721 . 1 1 56 VAL HB H 3.678 0.347 -0.876 . . . 1.0 . . . . . . . . . . . . A . 56 VAL HB . . . . . . . . . rr_1a7i 1 . 1 . 722 . 1 1 56 VAL HG11 H 1.826 0.235 -3.350 . . . 1.0 . . . . . . . . . . . . A . 56 VAL HG11 . . . . . . . . . rr_1a7i 1 . 1 . 723 . 1 1 56 VAL HG12 H 1.306 0.214 -1.638 . . . 1.0 . . . . . . . . . . . . A . 56 VAL HG12 . . . . . . . . . rr_1a7i 1 . 1 . 724 . 1 1 56 VAL HG13 H 2.081 1.678 -2.307 . . . 1.0 . . . . . . . . . . . . A . 56 VAL HG13 . . . . . . . . . rr_1a7i 1 . 1 . 725 . 1 1 56 VAL HG21 H 3.391 -2.004 -2.843 . . . 1.0 . . . . . . . . . . . . A . 56 VAL HG21 . . . . . . . . . rr_1a7i 1 . 1 . 726 . 1 1 56 VAL HG22 H 4.409 -1.959 -1.355 . . . 1.0 . . . . . . . . . . . . A . 56 VAL HG22 . . . . . . . . . rr_1a7i 1 . 1 . 727 . 1 1 56 VAL HG23 H 2.626 -1.914 -1.220 . . . 1.0 . . . . . . . . . . . . A . 56 VAL HG23 . . . . . . . . . rr_1a7i 1 . 1 . 728 . 1 1 56 VAL N N 5.902 -0.098 -2.348 . . . 1.0 . . . . . . . . . . . . A . 56 VAL N . . . . . . . . . rr_1a7i 1 . 1 . 729 . 1 1 56 VAL O O 5.131 2.476 -1.897 . . . 1.0 . . . . . . . . . . . . A . 56 VAL O . . . . . . . . . rr_1a7i 1 . 1 . 730 . 1 1 57 TYR C C 2.578 3.932 -4.186 . . . 1.0 . . . . . . . . . . . . A . 57 TYR C . . . . . . . . . rr_1a7i 1 . 1 . 731 . 1 1 57 TYR CA C 4.062 3.835 -4.117 . . . 1.0 . . . . . . . . . . . . A . 57 TYR CA . . . . . . . . . rr_1a7i 1 . 1 . 732 . 1 1 57 TYR CB C 4.656 4.471 -5.403 . . . 1.0 . . . . . . . . . . . . A . 57 TYR CB . . . . . . . . . rr_1a7i 1 . 1 . 733 . 1 1 57 TYR CD1 C 7.057 3.654 -5.141 . . . 1.0 . . . . . . . . . . . . A . 57 TYR CD1 . . . . . . . . . rr_1a7i 1 . 1 . 734 . 1 1 57 TYR CD2 C 6.636 6.032 -5.260 . . . 1.0 . . . . . . . . . . . . A . 57 TYR CD2 . . . . . . . . . rr_1a7i 1 . 1 . 735 . 1 1 57 TYR CE1 C 8.429 3.903 -5.001 . . . 1.0 . . . . . . . . . . . . A . 57 TYR CE1 . . . . . . . . . rr_1a7i 1 . 1 . 736 . 1 1 57 TYR CE2 C 8.007 6.290 -5.128 . . . 1.0 . . . . . . . . . . . . A . 57 TYR CE2 . . . . . . . . . rr_1a7i 1 . 1 . 737 . 1 1 57 TYR CG C 6.137 4.715 -5.260 . . . 1.0 . . . . . . . . . . . . A . 57 TYR CG . . . . . . . . . rr_1a7i 1 . 1 . 738 . 1 1 57 TYR CZ C 8.906 5.222 -4.989 . . . 1.0 . . . . . . . . . . . . A . 57 TYR CZ . . . . . . . . . rr_1a7i 1 . 1 . 739 . 1 1 57 TYR H H 3.999 1.880 -4.783 . . . 1.0 . . . . . . . . . . . . A . 57 TYR H . . . . . . . . . rr_1a7i 1 . 1 . 740 . 1 1 57 TYR HA H 4.379 4.363 -3.229 . . . 1.0 . . . . . . . . . . . . A . 57 TYR HA . . . . . . . . . rr_1a7i 1 . 1 . 741 . 1 1 57 TYR HB2 H 4.494 3.810 -6.283 . . . 1.0 . . . . . . . . . . . . A . 57 TYR HB2 . . . . . . . . . rr_1a7i 1 . 1 . 742 . 1 1 57 TYR HB3 H 4.175 5.453 -5.607 . . . 1.0 . . . . . . . . . . . . A . 57 TYR HB3 . . . . . . . . . rr_1a7i 1 . 1 . 743 . 1 1 57 TYR HD1 H 6.717 2.629 -5.161 . . . 1.0 . . . . . . . . . . . . A . 57 TYR HD1 . . . . . . . . . rr_1a7i 1 . 1 . 744 . 1 1 57 TYR HD2 H 5.953 6.861 -5.359 . . . 1.0 . . . . . . . . . . . . A . 57 TYR HD2 . . . . . . . . . rr_1a7i 1 . 1 . 745 . 1 1 57 TYR HE1 H 9.111 3.071 -4.903 . . . 1.0 . . . . . . . . . . . . A . 57 TYR HE1 . . . . . . . . . rr_1a7i 1 . 1 . 746 . 1 1 57 TYR HE2 H 8.361 7.311 -5.126 . . . 1.0 . . . . . . . . . . . . A . 57 TYR HE2 . . . . . . . . . rr_1a7i 1 . 1 . 747 . 1 1 57 TYR HH H 10.734 4.625 -4.759 . . . 1.0 . . . . . . . . . . . . A . 57 TYR HH . . . . . . . . . rr_1a7i 1 . 1 . 748 . 1 1 57 TYR N N 4.287 2.425 -3.999 . . . 1.0 . . . . . . . . . . . . A . 57 TYR N . . . . . . . . . rr_1a7i 1 . 1 . 749 . 1 1 57 TYR O O 1.897 3.029 -4.667 . . . 1.0 . . . . . . . . . . . . A . 57 TYR O . . . . . . . . . rr_1a7i 1 . 1 . 750 . 1 1 57 TYR OH O 10.288 5.471 -4.837 . . . 1.0 . . . . . . . . . . . . A . 57 TYR OH . . . . . . . . . rr_1a7i 1 . 1 . 751 . 1 1 58 CYS C C 0.089 5.813 -4.831 . . . 1.0 . . . . . . . . . . . . A . 58 CYS C . . . . . . . . . rr_1a7i 1 . 1 . 752 . 1 1 58 CYS CA C 0.625 5.261 -3.547 . . . 1.0 . . . . . . . . . . . . A . 58 CYS CA . . . . . . . . . rr_1a7i 1 . 1 . 753 . 1 1 58 CYS CB C 0.498 6.286 -2.376 . . . 1.0 . . . . . . . . . . . . A . 58 CYS CB . . . . . . . . . rr_1a7i 1 . 1 . 754 . 1 1 58 CYS H H 2.543 5.677 -3.081 . . . 1.0 . . . . . . . . . . . . A . 58 CYS H . . . . . . . . . rr_1a7i 1 . 1 . 755 . 1 1 58 CYS HA H 0.147 4.324 -3.314 . . . 1.0 . . . . . . . . . . . . A . 58 CYS HA . . . . . . . . . rr_1a7i 1 . 1 . 756 . 1 1 58 CYS HB2 H -0.194 6.226 -1.485 . . . 1.0 . . . . . . . . . . . . A . 58 CYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 757 . 1 1 58 CYS HB3 H 1.263 5.745 -1.869 . . . 1.0 . . . . . . . . . . . . A . 58 CYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 758 . 1 1 58 CYS N N 2.037 5.063 -3.702 . . . 1.0 . . . . . . . . . . . . A . 58 CYS N . . . . . . . . . rr_1a7i 1 . 1 . 759 . 1 1 58 CYS O O 0.574 5.510 -5.919 . . . 1.0 . . . . . . . . . . . . A . 58 CYS O . . . . . . . . . rr_1a7i 1 . 1 . 760 . 1 1 58 CYS SG S 1.231 7.935 -2.649 . . . 1.0 . . . . . . . . . . . . A . 58 CYS SG . . . . . . . . . rr_1a7i 1 . 1 . 761 . 1 1 59 LYS C C -0.788 8.501 -6.212 . . . 1.0 . . . . . . . . . . . . A . 59 LYS C . . . . . . . . . rr_1a7i 1 . 1 . 762 . 1 1 59 LYS CA C -1.588 7.277 -5.841 . . . 1.0 . . . . . . . . . . . . A . 59 LYS CA . . . . . . . . . rr_1a7i 1 . 1 . 763 . 1 1 59 LYS CB C -3.043 7.685 -5.533 . . . 1.0 . . . . . . . . . . . . A . 59 LYS CB . . . . . . . . . rr_1a7i 1 . 1 . 764 . 1 1 59 LYS CD C -5.318 8.400 -6.415 . . . 1.0 . . . . . . . . . . . . A . 59 LYS CD . . . . . . . . . rr_1a7i 1 . 1 . 765 . 1 1 59 LYS CE C -6.174 8.717 -7.648 . . . 1.0 . . . . . . . . . . . . A . 59 LYS CE . . . . . . . . . rr_1a7i 1 . 1 . 766 . 1 1 59 LYS CG C -3.846 8.151 -6.751 . . . 1.0 . . . . . . . . . . . . A . 59 LYS CG . . . . . . . . . rr_1a7i 1 . 1 . 767 . 1 1 59 LYS H H -1.300 6.774 -3.787 . . . 1.0 . . . . . . . . . . . . A . 59 LYS H . . . . . . . . . rr_1a7i 1 . 1 . 768 . 1 1 59 LYS HA H -1.593 6.590 -6.677 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HA . . . . . . . . . rr_1a7i 1 . 1 . 769 . 1 1 59 LYS HB2 H -3.559 6.792 -5.123 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 770 . 1 1 59 LYS HB3 H -3.067 8.477 -4.755 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 771 . 1 1 59 LYS HD2 H -5.712 7.484 -5.927 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HD2 . . . . . . . . . rr_1a7i 1 . 1 . 772 . 1 1 59 LYS HD3 H -5.381 9.236 -5.685 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HD3 . . . . . . . . . rr_1a7i 1 . 1 . 773 . 1 1 59 LYS HE2 H -5.825 9.650 -8.139 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HE2 . . . . . . . . . rr_1a7i 1 . 1 . 774 . 1 1 59 LYS HE3 H -6.130 7.879 -8.376 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HE3 . . . . . . . . . rr_1a7i 1 . 1 . 775 . 1 1 59 LYS HG2 H -3.404 9.082 -7.168 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HG2 . . . . . . . . . rr_1a7i 1 . 1 . 776 . 1 1 59 LYS HG3 H -3.790 7.361 -7.530 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HG3 . . . . . . . . . rr_1a7i 1 . 1 . 777 . 1 1 59 LYS HZ1 H -7.952 8.040 -6.819 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HZ1 . . . . . . . . . rr_1a7i 1 . 1 . 778 . 1 1 59 LYS HZ2 H -7.670 9.700 -6.599 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HZ2 . . . . . . . . . rr_1a7i 1 . 1 . 779 . 1 1 59 LYS HZ3 H -8.156 9.115 -8.118 . . . 1.0 . . . . . . . . . . . . A . 59 LYS HZ3 . . . . . . . . . rr_1a7i 1 . 1 . 780 . 1 1 59 LYS N N -0.960 6.628 -4.713 . . . 1.0 . . . . . . . . . . . . A . 59 LYS N . . . . . . . . . rr_1a7i 1 . 1 . 781 . 1 1 59 LYS NZ N -7.594 8.907 -7.268 . . . 1.0 . . . . . . . . . . . . A . 59 LYS NZ . . . . . . . . . rr_1a7i 1 . 1 . 782 . 1 1 59 LYS O O -0.418 8.691 -7.371 . . . 1.0 . . . . . . . . . . . . A . 59 LYS O . . . . . . . . . rr_1a7i 1 . 1 . 783 . 1 1 60 SER C C 1.557 10.534 -5.780 . . . 1.0 . . . . . . . . . . . . A . 60 SER C . . . . . . . . . rr_1a7i 1 . 1 . 784 . 1 1 60 SER CA C 0.119 10.642 -5.327 . . . 1.0 . . . . . . . . . . . . A . 60 SER CA . . . . . . . . . rr_1a7i 1 . 1 . 785 . 1 1 60 SER CB C 0.041 11.434 -3.991 . . . 1.0 . . . . . . . . . . . . A . 60 SER CB . . . . . . . . . rr_1a7i 1 . 1 . 786 . 1 1 60 SER H H -0.777 9.122 -4.264 . . . 1.0 . . . . . . . . . . . . A . 60 SER H . . . . . . . . . rr_1a7i 1 . 1 . 787 . 1 1 60 SER HA H -0.437 11.180 -6.084 . . . 1.0 . . . . . . . . . . . . A . 60 SER HA . . . . . . . . . rr_1a7i 1 . 1 . 788 . 1 1 60 SER HB2 H -1.012 11.430 -3.637 . . . 1.0 . . . . . . . . . . . . A . 60 SER HB2 . . . . . . . . . rr_1a7i 1 . 1 . 789 . 1 1 60 SER HB3 H 0.667 10.962 -3.203 . . . 1.0 . . . . . . . . . . . . A . 60 SER HB3 . . . . . . . . . rr_1a7i 1 . 1 . 790 . 1 1 60 SER HG H 0.344 13.197 -3.282 . . . 1.0 . . . . . . . . . . . . A . 60 SER HG . . . . . . . . . rr_1a7i 1 . 1 . 791 . 1 1 60 SER N N -0.501 9.348 -5.195 . . . 1.0 . . . . . . . . . . . . A . 60 SER N . . . . . . . . . rr_1a7i 1 . 1 . 792 . 1 1 60 SER O O 1.899 11.044 -6.844 . . . 1.0 . . . . . . . . . . . . A . 60 SER O . . . . . . . . . rr_1a7i 1 . 1 . 793 . 1 1 60 SER OG O 0.437 12.793 -4.148 . . . 1.0 . . . . . . . . . . . . A . 60 SER OG . . . . . . . . . rr_1a7i 1 . 1 . 794 . 1 1 61 CYS C C 4.253 9.012 -6.406 . . . 1.0 . . . . . . . . . . . . A . 61 CYS C . . . . . . . . . rr_1a7i 1 . 1 . 795 . 1 1 61 CYS CA C 3.857 9.844 -5.222 . . . 1.0 . . . . . . . . . . . . A . 61 CYS CA . . . . . . . . . rr_1a7i 1 . 1 . 796 . 1 1 61 CYS CB C 4.612 9.284 -4.003 . . . 1.0 . . . . . . . . . . . . A . 61 CYS CB . . . . . . . . . rr_1a7i 1 . 1 . 797 . 1 1 61 CYS H H 2.193 9.422 -4.118 . . . 1.0 . . . . . . . . . . . . A . 61 CYS H . . . . . . . . . rr_1a7i 1 . 1 . 798 . 1 1 61 CYS HA H 4.175 10.863 -5.394 . . . 1.0 . . . . . . . . . . . . A . 61 CYS HA . . . . . . . . . rr_1a7i 1 . 1 . 799 . 1 1 61 CYS HB2 H 4.442 8.186 -3.941 . . . 1.0 . . . . . . . . . . . . A . 61 CYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 800 . 1 1 61 CYS HB3 H 5.705 9.439 -4.112 . . . 1.0 . . . . . . . . . . . . A . 61 CYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 801 . 1 1 61 CYS N N 2.435 9.866 -4.987 . . . 1.0 . . . . . . . . . . . . A . 61 CYS N . . . . . . . . . rr_1a7i 1 . 1 . 802 . 1 1 61 CYS O O 5.368 9.156 -6.897 . . . 1.0 . . . . . . . . . . . . A . 61 CYS O . . . . . . . . . rr_1a7i 1 . 1 . 803 . 1 1 61 CYS SG S 4.006 10.026 -2.468 . . . 1.0 . . . . . . . . . . . . A . 61 CYS SG . . . . . . . . . rr_1a7i 1 . 1 . 804 . 1 1 62 TYR C C 3.528 8.232 -9.298 . . . 1.0 . . . . . . . . . . . . A . 62 TYR C . . . . . . . . . rr_1a7i 1 . 1 . 805 . 1 1 62 TYR CA C 3.642 7.344 -8.087 . . . 1.0 . . . . . . . . . . . . A . 62 TYR CA . . . . . . . . . rr_1a7i 1 . 1 . 806 . 1 1 62 TYR CB C 2.680 6.131 -8.253 . . . 1.0 . . . . . . . . . . . . A . 62 TYR CB . . . . . . . . . rr_1a7i 1 . 1 . 807 . 1 1 62 TYR CD1 C 4.398 4.637 -9.335 . . . 1.0 . . . . . . . . . . . . A . 62 TYR CD1 . . . . . . . . . rr_1a7i 1 . 1 . 808 . 1 1 62 TYR CD2 C 2.334 5.056 -10.530 . . . 1.0 . . . . . . . . . . . . A . 62 TYR CD2 . . . . . . . . . rr_1a7i 1 . 1 . 809 . 1 1 62 TYR CE1 C 4.891 3.916 -10.428 . . . 1.0 . . . . . . . . . . . . A . 62 TYR CE1 . . . . . . . . . rr_1a7i 1 . 1 . 810 . 1 1 62 TYR CE2 C 2.806 4.297 -11.613 . . . 1.0 . . . . . . . . . . . . A . 62 TYR CE2 . . . . . . . . . rr_1a7i 1 . 1 . 811 . 1 1 62 TYR CG C 3.130 5.241 -9.384 . . . 1.0 . . . . . . . . . . . . A . 62 TYR CG . . . . . . . . . rr_1a7i 1 . 1 . 812 . 1 1 62 TYR CZ C 4.093 3.736 -11.567 . . . 1.0 . . . . . . . . . . . . A . 62 TYR CZ . . . . . . . . . rr_1a7i 1 . 1 . 813 . 1 1 62 TYR H H 2.449 8.009 -6.511 . . . 1.0 . . . . . . . . . . . . A . 62 TYR H . . . . . . . . . rr_1a7i 1 . 1 . 814 . 1 1 62 TYR HA H 4.661 6.990 -8.005 . . . 1.0 . . . . . . . . . . . . A . 62 TYR HA . . . . . . . . . rr_1a7i 1 . 1 . 815 . 1 1 62 TYR HB2 H 2.701 5.516 -7.330 . . . 1.0 . . . . . . . . . . . . A . 62 TYR HB2 . . . . . . . . . rr_1a7i 1 . 1 . 816 . 1 1 62 TYR HB3 H 1.631 6.457 -8.430 . . . 1.0 . . . . . . . . . . . . A . 62 TYR HB3 . . . . . . . . . rr_1a7i 1 . 1 . 817 . 1 1 62 TYR HD1 H 5.035 4.775 -8.474 . . . 1.0 . . . . . . . . . . . . A . 62 TYR HD1 . . . . . . . . . rr_1a7i 1 . 1 . 818 . 1 1 62 TYR HD2 H 1.360 5.517 -10.588 . . . 1.0 . . . . . . . . . . . . A . 62 TYR HD2 . . . . . . . . . rr_1a7i 1 . 1 . 819 . 1 1 62 TYR HE1 H 5.906 3.554 -10.388 . . . 1.0 . . . . . . . . . . . . A . 62 TYR HE1 . . . . . . . . . rr_1a7i 1 . 1 . 820 . 1 1 62 TYR HE2 H 2.185 4.173 -12.488 . . . 1.0 . . . . . . . . . . . . A . 62 TYR HE2 . . . . . . . . . rr_1a7i 1 . 1 . 821 . 1 1 62 TYR HH H 5.484 2.720 -12.454 . . . 1.0 . . . . . . . . . . . . A . 62 TYR HH . . . . . . . . . rr_1a7i 1 . 1 . 822 . 1 1 62 TYR N N 3.357 8.129 -6.911 . . . 1.0 . . . . . . . . . . . . A . 62 TYR N . . . . . . . . . rr_1a7i 1 . 1 . 823 . 1 1 62 TYR O O 4.417 8.248 -10.148 . . . 1.0 . . . . . . . . . . . . A . 62 TYR O . . . . . . . . . rr_1a7i 1 . 1 . 824 . 1 1 62 TYR OH O 4.596 3.013 -12.672 . . . 1.0 . . . . . . . . . . . . A . 62 TYR OH . . . . . . . . . rr_1a7i 1 . 1 . 825 . 1 1 63 GLY C C 2.868 11.078 -10.616 . . . 1.0 . . . . . . . . . . . . A . 63 GLY C . . . . . . . . . rr_1a7i 1 . 1 . 826 . 1 1 63 GLY CA C 2.109 9.784 -10.553 . . . 1.0 . . . . . . . . . . . . A . 63 GLY CA . . . . . . . . . rr_1a7i 1 . 1 . 827 . 1 1 63 GLY H H 1.719 8.992 -8.673 . . . 1.0 . . . . . . . . . . . . A . 63 GLY H . . . . . . . . . rr_1a7i 1 . 1 . 828 . 1 1 63 GLY HA2 H 2.345 9.201 -11.433 . . . 1.0 . . . . . . . . . . . . A . 63 GLY HA2 . . . . . . . . . rr_1a7i 1 . 1 . 829 . 1 1 63 GLY HA3 H 1.058 10.024 -10.482 . . . 1.0 . . . . . . . . . . . . A . 63 GLY HA3 . . . . . . . . . rr_1a7i 1 . 1 . 830 . 1 1 63 GLY N N 2.417 8.996 -9.388 . . . 1.0 . . . . . . . . . . . . A . 63 GLY N . . . . . . . . . rr_1a7i 1 . 1 . 831 . 1 1 63 GLY O O 2.807 11.758 -11.636 . . . 1.0 . . . . . . . . . . . . A . 63 GLY O . . . . . . . . . rr_1a7i 1 . 1 . 832 . 1 1 64 LYS C C 5.707 12.595 -9.533 . . . 1.0 . . . . . . . . . . . . A . 64 LYS C . . . . . . . . . rr_1a7i 1 . 1 . 833 . 1 1 64 LYS CA C 4.225 12.772 -9.447 . . . 1.0 . . . . . . . . . . . . A . 64 LYS CA . . . . . . . . . rr_1a7i 1 . 1 . 834 . 1 1 64 LYS CB C 3.854 13.548 -8.159 . . . 1.0 . . . . . . . . . . . . A . 64 LYS CB . . . . . . . . . rr_1a7i 1 . 1 . 835 . 1 1 64 LYS CD C 1.414 13.755 -9.050 . . . 1.0 . . . . . . . . . . . . A . 64 LYS CD . . . . . . . . . rr_1a7i 1 . 1 . 836 . 1 1 64 LYS CE C 0.142 14.611 -9.065 . . . 1.0 . . . . . . . . . . . . A . 64 LYS CE . . . . . . . . . rr_1a7i 1 . 1 . 837 . 1 1 64 LYS CG C 2.588 14.416 -8.311 . . . 1.0 . . . . . . . . . . . . A . 64 LYS CG . . . . . . . . . rr_1a7i 1 . 1 . 838 . 1 1 64 LYS H H 3.600 10.929 -8.696 . . . 1.0 . . . . . . . . . . . . A . 64 LYS H . . . . . . . . . rr_1a7i 1 . 1 . 839 . 1 1 64 LYS HA H 3.950 13.385 -10.294 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HA . . . . . . . . . rr_1a7i 1 . 1 . 840 . 1 1 64 LYS HB2 H 3.723 12.822 -7.328 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 841 . 1 1 64 LYS HB3 H 4.662 14.253 -7.863 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 842 . 1 1 64 LYS HD2 H 1.737 13.542 -10.099 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HD2 . . . . . . . . . rr_1a7i 1 . 1 . 843 . 1 1 64 LYS HD3 H 1.198 12.778 -8.569 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HD3 . . . . . . . . . rr_1a7i 1 . 1 . 844 . 1 1 64 LYS HE2 H -0.207 14.809 -8.029 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HE2 . . . . . . . . . rr_1a7i 1 . 1 . 845 . 1 1 64 LYS HE3 H 0.327 15.577 -9.582 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HE3 . . . . . . . . . rr_1a7i 1 . 1 . 846 . 1 1 64 LYS HG2 H 2.258 14.734 -7.298 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HG2 . . . . . . . . . rr_1a7i 1 . 1 . 847 . 1 1 64 LYS HG3 H 2.861 15.328 -8.884 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HG3 . . . . . . . . . rr_1a7i 1 . 1 . 848 . 1 1 64 LYS HZ1 H -1.159 13.013 -9.309 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HZ1 . . . . . . . . . rr_1a7i 1 . 1 . 849 . 1 1 64 LYS HZ2 H -1.803 14.512 -9.781 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HZ2 . . . . . . . . . rr_1a7i 1 . 1 . 850 . 1 1 64 LYS HZ3 H -0.659 13.731 -10.765 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HZ3 . . . . . . . . . rr_1a7i 1 . 1 . 851 . 1 1 64 LYS N N 3.569 11.480 -9.527 . . . 1.0 . . . . . . . . . . . . A . 64 LYS N . . . . . . . . . rr_1a7i 1 . 1 . 852 . 1 1 64 LYS NZ N -0.952 13.915 -9.784 . . . 1.0 . . . . . . . . . . . . A . 64 LYS NZ . . . . . . . . . rr_1a7i 1 . 1 . 853 . 1 1 64 LYS O O 6.391 13.446 -10.102 . . . 1.0 . . . . . . . . . . . . A . 64 LYS O . . . . . . . . . rr_1a7i 1 . 1 . 854 . 1 1 65 LYS C C 7.967 10.740 -10.479 . . . 1.0 . . . . . . . . . . . . A . 65 LYS C . . . . . . . . . rr_1a7i 1 . 1 . 855 . 1 1 65 LYS CA C 7.655 11.169 -9.073 . . . 1.0 . . . . . . . . . . . . A . 65 LYS CA . . . . . . . . . rr_1a7i 1 . 1 . 856 . 1 1 65 LYS CB C 8.069 10.027 -8.107 . . . 1.0 . . . . . . . . . . . . A . 65 LYS CB . . . . . . . . . rr_1a7i 1 . 1 . 857 . 1 1 65 LYS CD C 10.491 10.768 -7.594 . . . 1.0 . . . . . . . . . . . . A . 65 LYS CD . . . . . . . . . rr_1a7i 1 . 1 . 858 . 1 1 65 LYS CE C 11.956 10.319 -7.516 . . . 1.0 . . . . . . . . . . . . A . 65 LYS CE . . . . . . . . . rr_1a7i 1 . 1 . 859 . 1 1 65 LYS CG C 9.561 9.653 -8.084 . . . 1.0 . . . . . . . . . . . . A . 65 LYS CG . . . . . . . . . rr_1a7i 1 . 1 . 860 . 1 1 65 LYS H H 5.681 10.796 -8.532 . . . 1.0 . . . . . . . . . . . . A . 65 LYS H . . . . . . . . . rr_1a7i 1 . 1 . 861 . 1 1 65 LYS HA H 8.212 12.066 -8.841 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HA . . . . . . . . . rr_1a7i 1 . 1 . 862 . 1 1 65 LYS HB2 H 7.787 10.328 -7.075 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HB2 . . . . . . . . . rr_1a7i 1 . 1 . 863 . 1 1 65 LYS HB3 H 7.496 9.107 -8.355 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HB3 . . . . . . . . . rr_1a7i 1 . 1 . 864 . 1 1 65 LYS HD2 H 10.413 11.635 -8.285 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HD2 . . . . . . . . . rr_1a7i 1 . 1 . 865 . 1 1 65 LYS HD3 H 10.150 11.092 -6.587 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HD3 . . . . . . . . . rr_1a7i 1 . 1 . 866 . 1 1 65 LYS HE2 H 12.066 9.469 -6.810 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HE2 . . . . . . . . . rr_1a7i 1 . 1 . 867 . 1 1 65 LYS HE3 H 12.323 10.012 -8.519 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HE3 . . . . . . . . . rr_1a7i 1 . 1 . 868 . 1 1 65 LYS HG2 H 9.678 8.785 -7.400 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HG2 . . . . . . . . . rr_1a7i 1 . 1 . 869 . 1 1 65 LYS HG3 H 9.884 9.330 -9.096 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HG3 . . . . . . . . . rr_1a7i 1 . 1 . 870 . 1 1 65 LYS HZ1 H 12.755 12.226 -7.691 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HZ1 . . . . . . . . . rr_1a7i 1 . 1 . 871 . 1 1 65 LYS HZ2 H 12.514 11.717 -6.089 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HZ2 . . . . . . . . . rr_1a7i 1 . 1 . 872 . 1 1 65 LYS HZ3 H 13.809 11.092 -6.993 . . . 1.0 . . . . . . . . . . . . A . 65 LYS HZ3 . . . . . . . . . rr_1a7i 1 . 1 . 873 . 1 1 65 LYS N N 6.245 11.476 -8.993 . . . 1.0 . . . . . . . . . . . . A . 65 LYS N . . . . . . . . . rr_1a7i 1 . 1 . 874 . 1 1 65 LYS NZ N 12.823 11.421 -7.037 . . . 1.0 . . . . . . . . . . . . A . 65 LYS NZ . . . . . . . . . rr_1a7i 1 . 1 . 875 . 1 1 65 LYS O O 8.939 11.205 -11.075 . . . 1.0 . . . . . . . . . . . . A . 65 LYS O . . . . . . . . . rr_1a7i 1 . 1 . 876 . 1 1 66 TYR C C 6.521 9.858 -13.384 . . . 1.0 . . . . . . . . . . . . A . 66 TYR C . . . . . . . . . rr_1a7i 1 . 1 . 877 . 1 1 66 TYR CA C 7.360 9.221 -12.309 . . . 1.0 . . . . . . . . . . . . A . 66 TYR CA . . . . . . . . . rr_1a7i 1 . 1 . 878 . 1 1 66 TYR CB C 7.110 7.685 -12.290 . . . 1.0 . . . . . . . . . . . . A . 66 TYR CB . . . . . . . . . rr_1a7i 1 . 1 . 879 . 1 1 66 TYR CD1 C 9.384 7.189 -11.256 . . . 1.0 . . . . . . . . . . . . A . 66 TYR CD1 . . . . . . . . . rr_1a7i 1 . 1 . 880 . 1 1 66 TYR CD2 C 7.408 6.321 -10.170 . . . 1.0 . . . . . . . . . . . . A . 66 TYR CD2 . . . . . . . . . rr_1a7i 1 . 1 . 881 . 1 1 66 TYR CE1 C 10.182 6.662 -10.230 . . . 1.0 . . . . . . . . . . . . A . 66 TYR CE1 . . . . . . . . . rr_1a7i 1 . 1 . 882 . 1 1 66 TYR CE2 C 8.195 5.800 -9.134 . . . 1.0 . . . . . . . . . . . . A . 66 TYR CE2 . . . . . . . . . rr_1a7i 1 . 1 . 883 . 1 1 66 TYR CG C 7.982 7.045 -11.231 . . . 1.0 . . . . . . . . . . . . A . 66 TYR CG . . . . . . . . . rr_1a7i 1 . 1 . 884 . 1 1 66 TYR CZ C 9.586 5.978 -9.160 . . . 1.0 . . . . . . . . . . . . A . 66 TYR CZ . . . . . . . . . rr_1a7i 1 . 1 . 885 . 1 1 66 TYR H H 6.317 9.514 -10.542 . . . 1.0 . . . . . . . . . . . . A . 66 TYR H . . . . . . . . . rr_1a7i 1 . 1 . 886 . 1 1 66 TYR HA H 8.392 9.382 -12.590 . . . 1.0 . . . . . . . . . . . . A . 66 TYR HA . . . . . . . . . rr_1a7i 1 . 1 . 887 . 1 1 66 TYR HB2 H 6.044 7.461 -12.064 . . . 1.0 . . . . . . . . . . . . A . 66 TYR HB2 . . . . . . . . . rr_1a7i 1 . 1 . 888 . 1 1 66 TYR HB3 H 7.375 7.224 -13.266 . . . 1.0 . . . . . . . . . . . . A . 66 TYR HB3 . . . . . . . . . rr_1a7i 1 . 1 . 889 . 1 1 66 TYR HD1 H 9.861 7.728 -12.061 . . . 1.0 . . . . . . . . . . . . A . 66 TYR HD1 . . . . . . . . . rr_1a7i 1 . 1 . 890 . 1 1 66 TYR HD2 H 6.343 6.170 -10.146 . . . 1.0 . . . . . . . . . . . . A . 66 TYR HD2 . . . . . . . . . rr_1a7i 1 . 1 . 891 . 1 1 66 TYR HE1 H 11.254 6.798 -10.264 . . . 1.0 . . . . . . . . . . . . A . 66 TYR HE1 . . . . . . . . . rr_1a7i 1 . 1 . 892 . 1 1 66 TYR HE2 H 7.723 5.263 -8.323 . . . 1.0 . . . . . . . . . . . . A . 66 TYR HE2 . . . . . . . . . rr_1a7i 1 . 1 . 893 . 1 1 66 TYR HH H 11.301 5.681 -8.312 . . . 1.0 . . . . . . . . . . . . A . 66 TYR HH . . . . . . . . . rr_1a7i 1 . 1 . 894 . 1 1 66 TYR N N 7.122 9.840 -11.032 . . . 1.0 . . . . . . . . . . . . A . 66 TYR N . . . . . . . . . rr_1a7i 1 . 1 . 895 . 1 1 66 TYR O O 6.867 9.711 -14.556 . . . 1.0 . . . . . . . . . . . . A . 66 TYR O . . . . . . . . . rr_1a7i 1 . 1 . 896 . 1 1 66 TYR OH O 10.386 5.464 -8.117 . . . 1.0 . . . . . . . . . . . . A . 66 TYR OH . . . . . . . . . rr_1a7i 1 . 1 . 897 . 1 1 67 GLY C C 3.508 10.364 -14.494 . . . 1.0 . . . . . . . . . . . . A . 67 GLY C . . . . . . . . . rr_1a7i 1 . 1 . 898 . 1 1 67 GLY CA C 4.645 11.250 -14.086 . . . 1.0 . . . . . . . . . . . . A . 67 GLY CA . . . . . . . . . rr_1a7i 1 . 1 . 899 . 1 1 67 GLY H H 5.071 10.760 -12.124 . . . 1.0 . . . . . . . . . . . . A . 67 GLY H . . . . . . . . . rr_1a7i 1 . 1 . 900 . 1 1 67 GLY HA2 H 4.238 12.149 -13.647 . . . 1.0 . . . . . . . . . . . . A . 67 GLY HA2 . . . . . . . . . rr_1a7i 1 . 1 . 901 . 1 1 67 GLY HA3 H 5.259 11.457 -14.951 . . . 1.0 . . . . . . . . . . . . A . 67 GLY HA3 . . . . . . . . . rr_1a7i 1 . 1 . 902 . 1 1 67 GLY N N 5.417 10.593 -13.054 . . . 1.0 . . . . . . . . . . . . A . 67 GLY N . . . . . . . . . rr_1a7i 1 . 1 . 903 . 1 1 67 GLY O O 3.315 9.273 -13.959 . . . 1.0 . . . . . . . . . . . . A . 67 GLY O . . . . . . . . . rr_1a7i 1 . 1 . 904 . 2 2 1 ZN ZN Zn -3.286 -2.431 8.741 . . . 1.0 . . . . . . . . . . . . A . 82 ZN ZN . . . . . . . . . rr_1a7i 1 . 1 . 905 . 3 2 1 ZN ZN Zn 3.023 8.236 -1.325 . . . 1.0 . . . . . . . . . . . . A . 83 ZN ZN . . . . . . . . . rr_1a7i 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_1a7i _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 1a7i.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 rr_1a7i 1 1 1a7i.mr . . XPLOR/CNS 2 distance NOE simple 465 rr_1a7i 1 1 1a7i.mr . . n/a 3 comment 'Not applicable' 'Not applicable' 0 rr_1a7i 1 1 1a7i.mr . . 'MR format' 4 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 rr_1a7i 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_1a7i _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_1a7i 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 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 9 LYS H . . A . 9 LYS HB2 . . . 9 . HN . . . . . 9 . HB# . . rr_1a7i 1 1 2 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 9 LYS H . . A . 9 LYS HB3 . . . 9 . HN . . . . . 9 . HB# . . rr_1a7i 1 2 1 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 9 LYS H . . A . 9 LYS HG2 . . . 9 . HN . . . . . 9 . HG# . . rr_1a7i 1 2 2 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HG3 H . . . . . 4.0 1.8 5.0 . . . . . A . 9 LYS H . . A . 9 LYS HG3 . . . 9 . HN . . . . . 9 . HG# . . rr_1a7i 1 3 1 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HE2 H . . . . . 4.0 1.8 5.0 . . . . . A . 9 LYS H . . A . 9 LYS HE2 . . . 9 . HN . . . . . 9 . HE# . . rr_1a7i 1 3 2 OR . 1 1 9 9 LYS H H . . . 1 1 9 9 LYS HE3 H . . . . . 4.0 1.8 5.0 . . . . . A . 9 LYS H . . A . 9 LYS HE3 . . . 9 . HN . . . . . 9 . HE# . . rr_1a7i 1 4 1 OR . 1 1 10 10 CYS H H . . . 1 1 9 9 LYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 10 CYS H . . A . 9 LYS HB2 . . . 10 . HN . . . . . 9 . HB# . . rr_1a7i 1 4 2 OR . 1 1 9 9 LYS HB3 H . . . 1 1 10 10 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 9 LYS HB3 . . A . 10 CYS H . . . 9 . HB# . . . . . 10 . HN . . rr_1a7i 1 5 1 . . 1 1 10 10 CYS H H . . . 1 1 10 10 CYS HA H . . . . . 2.5 1.8 2.7 . . . . . A . 10 CYS H . . A . 10 CYS HA . . . 10 . HN . . . . . 10 . HA . . rr_1a7i 1 6 1 . . 1 1 10 10 CYS H H . . . 1 1 10 10 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 10 CYS H . . A . 10 CYS HB3 . . . 10 . HN . . . . . 10 . HB1 . . rr_1a7i 1 7 1 . . 1 1 10 10 CYS H H . . . 1 1 11 11 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 CYS H . . A . 11 GLY H . . . 10 . HN . . . . . 11 . HN . . rr_1a7i 1 8 1 . . 1 1 10 10 CYS HA H . . . 1 1 11 11 GLY H H . . . . . 2.5 1.8 2.7 . . . . . A . 10 CYS HA . . A . 11 GLY H . . . 10 . HA . . . . . 11 . HN . . rr_1a7i 1 9 1 . . 1 1 10 10 CYS HB3 H . . . 1 1 11 11 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 CYS HB3 . . A . 11 GLY H . . . 10 . HB1 . . . . . 11 . HN . . rr_1a7i 1 10 1 . . 1 1 10 10 CYS HA H . . . 1 1 12 12 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 CYS HA . . A . 12 ALA H . . . 10 . HA . . . . . 12 . HN . . rr_1a7i 1 11 1 . . 1 1 10 10 CYS HB3 H . . . 1 1 12 12 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 CYS HB3 . . A . 12 ALA H . . . 10 . HB1 . . . . . 12 . HN . . rr_1a7i 1 12 1 . . 1 1 10 10 CYS HA H . . . 1 1 13 13 CYS H H . . . . . 4.0 1.8 6.0 . . . . . A . 10 CYS HA . . A . 13 CYS H . . . 10 . HA . . . . . 13 . HN . . rr_1a7i 1 13 1 . . 1 1 10 10 CYS HB3 H . . . 1 1 13 13 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 CYS HB3 . . A . 13 CYS H . . . 10 . HB1 . . . . . 13 . HN . . rr_1a7i 1 14 1 . . 1 1 10 10 CYS HB3 H . . . 1 1 14 14 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 CYS HB3 . . A . 14 GLY H . . . 10 . HB1 . . . . . 14 . HN . . rr_1a7i 1 15 1 . . 1 1 10 10 CYS HB3 H . . . 1 1 15 15 ARG H H . . . . . 4.0 1.8 5.0 . . . . . A . 10 CYS HB3 . . A . 15 ARG H . . . 10 . HB1 . . . . . 15 . HN . . rr_1a7i 1 16 1 . . 1 1 10 10 CYS H H . . . 1 1 17 17 VAL H H . . . . . 4.0 1.8 6.0 . . . . . A . 10 CYS H . . A . 17 VAL H . . . 10 . HN . . . . . 17 . HN . . rr_1a7i 1 17 1 . . 1 1 10 10 CYS H H . . . 1 1 17 17 VAL MG1 H . . . . . 4.0 1.8 6.0 . . . . . A . 10 CYS H . . A . 17 VAL MG1 . . . 10 . HN . . . . . 17 . HG1# . . rr_1a7i 1 18 1 . . 1 1 10 10 CYS H H . . . 1 1 17 17 VAL MG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 10 CYS H . . A . 17 VAL MG2 . . . 10 . HN . . . . . 17 . HG2# . . rr_1a7i 1 19 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 10 10 CYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG1 . . A . 10 CYS HB2 . . . 17 . HG1# . . . . . 10 . HB2 . . rr_1a7i 1 20 1 . . 1 1 17 17 VAL MG2 H . . . 1 1 10 10 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 17 VAL MG2 . . A . 10 CYS HB2 . . . 17 . HG2# . . . . . 10 . HB2 . . rr_1a7i 1 21 1 . . 1 1 10 10 CYS HA H . . . 1 1 30 30 PHE HA H . . . . . 3.0 1.8 3.3 . . . . . A . 10 CYS HA . . A . 30 PHE HA . . . 10 . HA . . . . . 30 . HA . . rr_1a7i 1 22 1 . . 1 1 10 10 CYS HB2 H . . . 1 1 31 31 HIS HE1 H . . . . . 3.0 1.8 3.3 . . . . . A . 10 CYS HB2 . . A . 31 HIS HE1 . . . 10 . HB2 . . . . . 31 . HE1 . . rr_1a7i 1 23 1 . . 1 1 11 11 GLY H H . . . 1 1 11 11 GLY HA3 H . . . . . 3.0 1.8 3.3 . . . . . A . 11 GLY H . . A . 11 GLY HA3 . . . 11 . HN . . . . . 11 . HA1 . . rr_1a7i 1 24 1 . . 1 1 11 11 GLY H H . . . 1 1 11 11 GLY HA2 H . . . . . 3.0 1.8 3.3 . . . . . A . 11 GLY H . . A . 11 GLY HA2 . . . 11 . HN . . . . . 11 . HA2 . . rr_1a7i 1 25 1 . . 1 1 11 11 GLY H H . . . 1 1 12 12 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 11 GLY H . . A . 12 ALA H . . . 11 . HN . . . . . 12 . HN . . rr_1a7i 1 26 1 . . 1 1 11 11 GLY H H . . . 1 1 12 12 ALA MB H . . . . . 4.0 1.8 6.0 . . . . . A . 11 GLY H . . A . 12 ALA MB . . . 11 . HN . . . . . 12 . HB# . . rr_1a7i 1 27 1 . . 1 1 12 12 ALA H H . . . 1 1 11 11 GLY HA3 H . . . . . 4.0 1.8 5.0 . . . . . A . 12 ALA H . . A . 11 GLY HA3 . . . 12 . HN . . . . . 11 . HA1 . . rr_1a7i 1 28 1 . . 1 1 12 12 ALA H H . . . 1 1 11 11 GLY HA2 H . . . . . 4.0 1.8 5.0 . . . . . A . 12 ALA H . . A . 11 GLY HA2 . . . 12 . HN . . . . . 11 . HA2 . . rr_1a7i 1 29 1 . . 1 1 11 11 GLY H H . . . 1 1 17 17 VAL MG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 11 GLY H . . A . 17 VAL MG2 . . . 11 . HN . . . . . 17 . HG2# . . rr_1a7i 1 30 1 . . 1 1 11 11 GLY H H . . . 1 1 30 30 PHE HA H . . . . . 4.0 1.8 5.0 . . . . . A . 11 GLY H . . A . 30 PHE HA . . . 11 . HN . . . . . 30 . HA . . rr_1a7i 1 31 1 . . 1 1 11 11 GLY H H . . . 1 1 30 30 PHE QD H . . . . . 4.0 1.8 7.2 . . . . . A . 11 GLY H . . A . 30 PHE QD . . . 11 . HN . . . . . 30 . HD# . . rr_1a7i 1 32 1 . . 1 1 11 11 GLY H H . . . 1 1 30 30 PHE QE H . . . . . 4.0 1.8 7.2 . . . . . A . 11 GLY H . . A . 30 PHE QE . . . 11 . HN . . . . . 30 . HE# . . rr_1a7i 1 33 1 . . 1 1 12 12 ALA H H . . . 1 1 12 12 ALA HA H . . . . . 3.0 1.8 3.3 . . . . . A . 12 ALA H . . A . 12 ALA HA . . . 12 . HN . . . . . 12 . HA . . rr_1a7i 1 34 1 . . 1 1 12 12 ALA H H . . . 1 1 12 12 ALA MB H . . . . . 3.0 1.8 3.3 . . . . . A . 12 ALA H . . A . 12 ALA MB . . . 12 . HN . . . . . 12 . HB# . . rr_1a7i 1 35 1 . . 1 1 12 12 ALA H H . . . 1 1 13 13 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 12 ALA H . . A . 13 CYS H . . . 12 . HN . . . . . 13 . HN . . rr_1a7i 1 36 1 . . 1 1 13 13 CYS H H . . . 1 1 12 12 ALA HA H . . . . . 3.0 1.8 3.3 . . . . . A . 13 CYS H . . A . 12 ALA HA . . . 13 . HN . . . . . 12 . HA . . rr_1a7i 1 37 1 . . 1 1 13 13 CYS H H . . . 1 1 12 12 ALA MB H . . . . . 3.0 1.8 3.3 . . . . . A . 13 CYS H . . A . 12 ALA MB . . . 13 . HN . . . . . 12 . HB# . . rr_1a7i 1 38 1 . . 1 1 12 12 ALA H H . . . 1 1 14 14 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 12 ALA H . . A . 14 GLY H . . . 12 . HN . . . . . 14 . HN . . rr_1a7i 1 39 1 . . 1 1 14 14 GLY H H . . . 1 1 12 12 ALA MB H . . . . . 4.0 1.8 6.0 . . . . . A . 14 GLY H . . A . 12 ALA MB . . . 14 . HN . . . . . 12 . HB# . . rr_1a7i 1 40 1 . . 1 1 12 12 ALA H H . . . 1 1 30 30 PHE HA H . . . . . 4.0 1.8 5.0 . . . . . A . 12 ALA H . . A . 30 PHE HA . . . 12 . HN . . . . . 30 . HA . . rr_1a7i 1 41 1 . . 1 1 12 12 ALA H H . . . 1 1 30 30 PHE QD H . . . . . 3.0 1.8 5.5 . . . . . A . 12 ALA H . . A . 30 PHE QD . . . 12 . HN . . . . . 30 . HD# . . rr_1a7i 1 42 1 . . 1 1 12 12 ALA H H . . . 1 1 30 30 PHE QE H . . . . . 4.0 1.8 7.2 . . . . . A . 12 ALA H . . A . 30 PHE QE . . . 12 . HN . . . . . 30 . HE# . . rr_1a7i 1 43 1 . . 1 1 12 12 ALA MB H . . . 1 1 30 30 PHE QD H . . . . . 3.0 1.8 5.5 . . . . . A . 12 ALA MB . . A . 30 PHE QD . . . 12 . HB# . . . . . 30 . HD# . . rr_1a7i 1 44 1 . . 1 1 13 13 CYS H H . . . 1 1 13 13 CYS HA H . . . . . 3.0 1.8 3.3 . . . . . A . 13 CYS H . . A . 13 CYS HA . . . 13 . HN . . . . . 13 . HA . . rr_1a7i 1 45 1 . . 1 1 13 13 CYS H H . . . 1 1 13 13 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 13 CYS H . . A . 13 CYS HB3 . . . 13 . HN . . . . . 13 . HB1 . . rr_1a7i 1 46 1 . . 1 1 13 13 CYS H H . . . 1 1 13 13 CYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 13 CYS H . . A . 13 CYS HB2 . . . 13 . HN . . . . . 13 . HB2 . . rr_1a7i 1 47 1 . . 1 1 13 13 CYS HA H . . . 1 1 13 13 CYS HB3 H . . . . . 2.5 1.8 2.7 . . . . . A . 13 CYS HA . . A . 13 CYS HB3 . . . 13 . HA . . . . . 13 . HB1 . . rr_1a7i 1 48 1 . . 1 1 13 13 CYS HA H . . . 1 1 13 13 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 13 CYS HA . . A . 13 CYS HB2 . . . 13 . HA . . . . . 13 . HB2 . . rr_1a7i 1 49 1 . . 1 1 13 13 CYS H H . . . 1 1 14 14 GLY H H . . . . . 3.0 1.8 3.3 . . . . . A . 13 CYS H . . A . 14 GLY H . . . 13 . HN . . . . . 14 . HN . . rr_1a7i 1 50 1 . . 1 1 13 13 CYS H H . . . 1 1 14 14 GLY HA2 H . . . . . 4.0 1.8 5.0 . . . . . A . 13 CYS H . . A . 14 GLY HA2 . . . 13 . HN . . . . . 14 . HA2 . . rr_1a7i 1 51 1 . . 1 1 14 14 GLY H H . . . 1 1 13 13 CYS HA H . . . . . 4.0 1.8 5.0 . . . . . A . 14 GLY H . . A . 13 CYS HA . . . 14 . HN . . . . . 13 . HA . . rr_1a7i 1 52 1 . . 1 1 14 14 GLY H H . . . 1 1 13 13 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 14 GLY H . . A . 13 CYS HB3 . . . 14 . HN . . . . . 13 . HB1 . . rr_1a7i 1 53 1 . . 1 1 15 15 ARG H H . . . 1 1 13 13 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 15 ARG H . . A . 13 CYS HB3 . . . 15 . HN . . . . . 13 . HB1 . . rr_1a7i 1 54 1 . . 1 1 14 14 GLY H H . . . 1 1 14 14 GLY HA3 H . . . . . 3.0 1.8 3.3 . . . . . A . 14 GLY H . . A . 14 GLY HA3 . . . 14 . HN . . . . . 14 . HA1 . . rr_1a7i 1 55 1 . . 1 1 14 14 GLY H H . . . 1 1 14 14 GLY HA2 H . . . . . 3.0 1.8 3.3 . . . . . A . 14 GLY H . . A . 14 GLY HA2 . . . 14 . HN . . . . . 14 . HA2 . . rr_1a7i 1 56 1 . . 1 1 14 14 GLY H H . . . 1 1 15 15 ARG H H . . . . . 3.0 1.8 3.3 . . . . . A . 14 GLY H . . A . 15 ARG H . . . 14 . HN . . . . . 15 . HN . . rr_1a7i 1 57 1 . . 1 1 15 15 ARG H H . . . 1 1 14 14 GLY HA3 H . . . . . 4.0 1.8 5.0 . . . . . A . 15 ARG H . . A . 14 GLY HA3 . . . 15 . HN . . . . . 14 . HA1 . . rr_1a7i 1 58 1 . . 1 1 15 15 ARG H H . . . 1 1 14 14 GLY HA2 H . . . . . 3.0 1.8 3.3 . . . . . A . 15 ARG H . . A . 14 GLY HA2 . . . 15 . HN . . . . . 14 . HA2 . . rr_1a7i 1 59 1 . . 1 1 15 15 ARG H H . . . 1 1 15 15 ARG HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 15 ARG H . . A . 15 ARG HB3 . . . 15 . HN . . . . . 15 . HB1 . . rr_1a7i 1 60 1 . . 1 1 15 15 ARG H H . . . 1 1 15 15 ARG HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 15 ARG H . . A . 15 ARG HB2 . . . 15 . HN . . . . . 15 . HB2 . . rr_1a7i 1 61 1 OR . 1 1 15 15 ARG H H . . . 1 1 15 15 ARG HG2 H . . . . . 3.0 1.8 3.3 . . . . . A . 15 ARG H . . A . 15 ARG HG2 . . . 15 . HN . . . . . 15 . HG# . . rr_1a7i 1 61 2 OR . 1 1 15 15 ARG H H . . . 1 1 15 15 ARG HG3 H . . . . . 3.0 1.8 3.3 . . . . . A . 15 ARG H . . A . 15 ARG HG3 . . . 15 . HN . . . . . 15 . HG# . . rr_1a7i 1 62 1 . . 1 1 15 15 ARG HB3 H . . . 1 1 16 16 THR H H . . . . . 4.0 1.8 5.0 . . . . . A . 15 ARG HB3 . . A . 16 THR H . . . 15 . HB1 . . . . . 16 . HN . . rr_1a7i 1 63 1 . . 1 1 15 15 ARG HB2 H . . . 1 1 16 16 THR H H . . . . . 4.0 1.8 6.0 . . . . . A . 15 ARG HB2 . . A . 16 THR H . . . 15 . HB2 . . . . . 16 . HN . . rr_1a7i 1 64 1 . . 1 1 15 15 ARG H H . . . 1 1 31 31 HIS HE1 H . . . . . 3.0 1.8 3.3 . . . . . A . 15 ARG H . . A . 31 HIS HE1 . . . 15 . HN . . . . . 31 . HE1 . . rr_1a7i 1 65 1 . . 1 1 31 31 HIS HE1 H . . . 1 1 15 15 ARG HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 31 HIS HE1 . . A . 15 ARG HB3 . . . 31 . HE1 . . . . . 15 . HB1 . . rr_1a7i 1 66 1 . . 1 1 31 31 HIS HE1 H . . . 1 1 15 15 ARG HB2 H . . . . . 2.5 1.8 2.7 . . . . . A . 31 HIS HE1 . . A . 15 ARG HB2 . . . 31 . HE1 . . . . . 15 . HB2 . . rr_1a7i 1 67 1 . . 1 1 16 16 THR H H . . . 1 1 16 16 THR HB H . . . . . 4.0 1.8 5.0 . . . . . A . 16 THR H . . A . 16 THR HB . . . 16 . HN . . . . . 16 . HB . . rr_1a7i 1 68 1 . . 1 1 17 17 VAL H H . . . 1 1 16 16 THR HB H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL H . . A . 16 THR HB . . . 17 . HN . . . . . 16 . HB . . rr_1a7i 1 69 1 . . 1 1 17 17 VAL H H . . . 1 1 16 16 THR MG H . . . . . 4.0 1.8 6.0 . . . . . A . 17 VAL H . . A . 16 THR MG . . . 17 . HN . . . . . 16 . HG2# . . rr_1a7i 1 70 1 . . 1 1 16 16 THR MG H . . . 1 1 18 18 TYR H H . . . . . 4.0 1.8 6.0 . . . . . A . 16 THR MG . . A . 18 TYR H . . . 16 . HG2# . . . . . 18 . HN . . rr_1a7i 1 71 1 . . 1 1 17 17 VAL H H . . . 1 1 17 17 VAL HB H . . . . . 3.0 1.8 3.3 . . . . . A . 17 VAL H . . A . 17 VAL HB . . . 17 . HN . . . . . 17 . HB . . rr_1a7i 1 72 1 . . 1 1 17 17 VAL H H . . . 1 1 17 17 VAL MG1 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL H . . A . 17 VAL MG1 . . . 17 . HN . . . . . 17 . HG1# . . rr_1a7i 1 73 1 . . 1 1 17 17 VAL H H . . . 1 1 17 17 VAL MG2 H . . . . . 3.0 1.8 3.3 . . . . . A . 17 VAL H . . A . 17 VAL MG2 . . . 17 . HN . . . . . 17 . HG2# . . rr_1a7i 1 74 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 17 17 VAL HA H . . . . . 3.0 1.8 3.3 . . . . . A . 17 VAL MG1 . . A . 17 VAL HA . . . 17 . HG1# . . . . . 17 . HA . . rr_1a7i 1 75 1 . . 1 1 17 17 VAL MG2 H . . . 1 1 17 17 VAL HA H . . . . . 3.0 1.8 3.3 . . . . . A . 17 VAL MG2 . . A . 17 VAL HA . . . 17 . HG2# . . . . . 17 . HA . . rr_1a7i 1 76 1 . . 1 1 18 18 TYR H H . . . 1 1 17 17 VAL HA H . . . . . 3.0 1.8 3.3 . . . . . A . 18 TYR H . . A . 17 VAL HA . . . 18 . HN . . . . . 17 . HA . . rr_1a7i 1 77 1 . . 1 1 18 18 TYR H H . . . 1 1 17 17 VAL HB H . . . . . 4.0 1.8 5.0 . . . . . A . 18 TYR H . . A . 17 VAL HB . . . 18 . HN . . . . . 17 . HB . . rr_1a7i 1 78 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 18 18 TYR H H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG1 . . A . 18 TYR H . . . 17 . HG1# . . . . . 18 . HN . . rr_1a7i 1 79 1 . . 1 1 17 17 VAL MG2 H . . . 1 1 18 18 TYR H H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG2 . . A . 18 TYR H . . . 17 . HG2# . . . . . 18 . HN . . rr_1a7i 1 80 1 OR . 1 1 17 17 VAL MG1 H . . . 1 1 21 21 GLU HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG1 . . A . 21 GLU HG2 . . . 17 . HG1# . . . . . 21 . HG# . . rr_1a7i 1 80 2 OR . 1 1 17 17 VAL MG1 H . . . 1 1 21 21 GLU HG3 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG1 . . A . 21 GLU HG3 . . . 17 . HG1# . . . . . 21 . HG# . . rr_1a7i 1 81 1 OR . 1 1 17 17 VAL MG2 H . . . 1 1 21 21 GLU HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 17 VAL MG2 . . A . 21 GLU HG2 . . . 17 . HG2# . . . . . 21 . HG# . . rr_1a7i 1 81 2 OR . 1 1 17 17 VAL MG2 H . . . 1 1 21 21 GLU HG3 H . . . . . 4.0 1.8 6.0 . . . . . A . 17 VAL MG2 . . A . 21 GLU HG3 . . . 17 . HG2# . . . . . 21 . HG# . . rr_1a7i 1 82 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 22 22 GLU H H . . . . . 4.0 1.8 6.0 . . . . . A . 17 VAL MG1 . . A . 22 GLU H . . . 17 . HG1# . . . . . 22 . HN . . rr_1a7i 1 83 1 OR . 1 1 17 17 VAL MG1 H . . . 1 1 22 22 GLU HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 17 VAL MG1 . . A . 22 GLU HB2 . . . 17 . HG1# . . . . . 22 . HB# . . rr_1a7i 1 83 2 OR . 1 1 17 17 VAL MG1 H . . . 1 1 22 22 GLU HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 17 VAL MG1 . . A . 22 GLU HB3 . . . 17 . HG1# . . . . . 22 . HB# . . rr_1a7i 1 84 1 OR . 1 1 17 17 VAL MG1 H . . . 1 1 22 22 GLU HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG1 . . A . 22 GLU HG2 . . . 17 . HG1# . . . . . 22 . HG# . . rr_1a7i 1 84 2 OR . 1 1 17 17 VAL MG1 H . . . 1 1 22 22 GLU HG3 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG1 . . A . 22 GLU HG3 . . . 17 . HG1# . . . . . 22 . HG# . . rr_1a7i 1 85 1 OR . 1 1 17 17 VAL MG2 H . . . 1 1 22 22 GLU HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG2 . . A . 22 GLU HB2 . . . 17 . HG2# . . . . . 22 . HB# . . rr_1a7i 1 85 2 OR . 1 1 17 17 VAL MG2 H . . . 1 1 22 22 GLU HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG2 . . A . 22 GLU HB3 . . . 17 . HG2# . . . . . 22 . HB# . . rr_1a7i 1 86 1 OR . 1 1 17 17 VAL MG2 H . . . 1 1 22 22 GLU HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 17 VAL MG2 . . A . 22 GLU HG2 . . . 17 . HG2# . . . . . 22 . HG# . . rr_1a7i 1 86 2 OR . 1 1 17 17 VAL MG2 H . . . 1 1 22 22 GLU HG3 H . . . . . 4.0 1.8 6.0 . . . . . A . 17 VAL MG2 . . A . 22 GLU HG3 . . . 17 . HG2# . . . . . 22 . HG# . . rr_1a7i 1 87 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 23 23 VAL H H . . . . . 4.0 1.8 6.0 . . . . . A . 17 VAL MG1 . . A . 23 VAL H . . . 17 . HG1# . . . . . 23 . HN . . rr_1a7i 1 88 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 29 29 SER HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 17 VAL MG1 . . A . 29 SER HB2 . . . 17 . HG1# . . . . . 29 . HB2 . . rr_1a7i 1 89 1 . . 1 1 17 17 VAL MG2 H . . . 1 1 29 29 SER HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 17 VAL MG2 . . A . 29 SER HB2 . . . 17 . HG2# . . . . . 29 . HB2 . . rr_1a7i 1 90 1 . . 1 1 17 17 VAL MG2 H . . . 1 1 30 30 PHE HA H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG2 . . A . 30 PHE HA . . . 17 . HG2# . . . . . 30 . HA . . rr_1a7i 1 91 1 . . 1 1 17 17 VAL H H . . . 1 1 31 31 HIS HD2 H . . . . . 3.0 1.8 3.3 . . . . . A . 17 VAL H . . A . 31 HIS HD2 . . . 17 . HN . . . . . 31 . HD2 . . rr_1a7i 1 92 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 31 31 HIS HA H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG1 . . A . 31 HIS HA . . . 17 . HG1# . . . . . 31 . HA . . rr_1a7i 1 93 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 31 31 HIS HD2 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG1 . . A . 31 HIS HD2 . . . 17 . HG1# . . . . . 31 . HD2 . . rr_1a7i 1 94 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 31 31 HIS HE1 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG1 . . A . 31 HIS HE1 . . . 17 . HG1# . . . . . 31 . HE1 . . rr_1a7i 1 95 1 . . 1 1 17 17 VAL MG2 H . . . 1 1 31 31 HIS H H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG2 . . A . 31 HIS H . . . 17 . HG2# . . . . . 31 . HN . . rr_1a7i 1 96 1 . . 1 1 17 17 VAL MG2 H . . . 1 1 31 31 HIS HA H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG2 . . A . 31 HIS HA . . . 17 . HG2# . . . . . 31 . HA . . rr_1a7i 1 97 1 . . 1 1 17 17 VAL MG2 H . . . 1 1 31 31 HIS HD2 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG2 . . A . 31 HIS HD2 . . . 17 . HG2# . . . . . 31 . HD2 . . rr_1a7i 1 98 1 . . 1 1 17 17 VAL MG2 H . . . 1 1 31 31 HIS HE1 H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG2 . . A . 31 HIS HE1 . . . 17 . HG2# . . . . . 31 . HE1 . . rr_1a7i 1 99 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 32 32 ARG H H . . . . . 4.0 1.8 5.0 . . . . . A . 17 VAL MG1 . . A . 32 ARG H . . . 17 . HG1# . . . . . 32 . HN . . rr_1a7i 1 100 1 . . 1 1 17 17 VAL MG1 H . . . 1 1 35 35 PHE QE H . . . . . 4.0 1.8 7.2 . . . . . A . 17 VAL MG1 . . A . 35 PHE QE . . . 17 . HG1# . . . . . 35 . HE# . . rr_1a7i 1 101 1 OR . 1 1 18 18 TYR H H . . . 1 1 18 18 TYR HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 18 TYR H . . A . 18 TYR HB2 . . . 18 . HN . . . . . 18 . HB# . . rr_1a7i 1 101 2 OR . 1 1 18 18 TYR H H . . . 1 1 18 18 TYR HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 18 TYR H . . A . 18 TYR HB3 . . . 18 . HN . . . . . 18 . HB# . . rr_1a7i 1 102 1 . . 1 1 18 18 TYR H H . . . 1 1 18 18 TYR QD H . . . . . 4.0 1.8 7.2 . . . . . A . 18 TYR H . . A . 18 TYR QD . . . 18 . HN . . . . . 18 . HD# . . rr_1a7i 1 103 1 OR . 1 1 18 18 TYR QD H . . . 1 1 18 18 TYR HB2 H . . . . . 2.5 1.8 4.9 . . . . . A . 18 TYR QD . . A . 18 TYR HB2 . . . 18 . HD# . . . . . 18 . HB# . . rr_1a7i 1 103 2 OR . 1 1 18 18 TYR HB3 H . . . 1 1 18 18 TYR QD H . . . . . 2.5 1.8 4.9 . . . . . A . 18 TYR HB3 . . A . 18 TYR QD . . . 18 . HB# . . . . . 18 . HD# . . rr_1a7i 1 104 1 . . 1 1 20 20 ALA H H . . . 1 1 20 20 ALA HA H . . . . . 2.5 1.8 2.7 . . . . . A . 20 ALA H . . A . 20 ALA HA . . . 20 . HN . . . . . 20 . HA . . rr_1a7i 1 105 1 . . 1 1 20 20 ALA H H . . . 1 1 20 20 ALA MB H . . . . . 4.0 1.8 6.0 . . . . . A . 20 ALA H . . A . 20 ALA MB . . . 20 . HN . . . . . 20 . HB# . . rr_1a7i 1 106 1 . . 1 1 20 20 ALA MB H . . . 1 1 21 21 GLU H H . . . . . 4.0 1.8 5.0 . . . . . A . 20 ALA MB . . A . 21 GLU H . . . 20 . HB# . . . . . 21 . HN . . rr_1a7i 1 107 1 OR . 1 1 21 21 GLU H H . . . 1 1 21 21 GLU HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 21 GLU H . . A . 21 GLU HB2 . . . 21 . HN . . . . . 21 . HB# . . rr_1a7i 1 107 2 OR . 1 1 21 21 GLU H H . . . 1 1 21 21 GLU HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 21 GLU H . . A . 21 GLU HB3 . . . 21 . HN . . . . . 21 . HB# . . rr_1a7i 1 108 1 OR . 1 1 21 21 GLU H H . . . 1 1 21 21 GLU HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 21 GLU H . . A . 21 GLU HG2 . . . 21 . HN . . . . . 21 . HG# . . rr_1a7i 1 108 2 OR . 1 1 21 21 GLU HG3 H . . . 1 1 21 21 GLU H H . . . . . 4.0 1.8 5.0 . . . . . A . 21 GLU HG3 . . A . 21 GLU H . . . 21 . HG# . . . . . 21 . HN . . rr_1a7i 1 109 1 . . 1 1 22 22 GLU H H . . . 1 1 21 21 GLU H H . . . . . 3.0 1.8 3.3 . . . . . A . 22 GLU H . . A . 21 GLU H . . . 22 . HN . . . . . 21 . HN . . rr_1a7i 1 110 1 . . 1 1 22 22 GLU H H . . . 1 1 21 21 GLU HA H . . . . . 4.0 1.8 5.0 . . . . . A . 22 GLU H . . A . 21 GLU HA . . . 22 . HN . . . . . 21 . HA . . rr_1a7i 1 111 1 OR . 1 1 22 22 GLU H H . . . 1 1 21 21 GLU HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 22 GLU H . . A . 21 GLU HB2 . . . 22 . HN . . . . . 21 . HB# . . rr_1a7i 1 111 2 OR . 1 1 22 22 GLU H H . . . 1 1 21 21 GLU HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 22 GLU H . . A . 21 GLU HB3 . . . 22 . HN . . . . . 21 . HB# . . rr_1a7i 1 112 1 OR . 1 1 31 31 HIS HD2 H . . . 1 1 21 21 GLU HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 31 HIS HD2 . . A . 21 GLU HB2 . . . 31 . HD2 . . . . . 21 . HB# . . rr_1a7i 1 112 2 OR . 1 1 31 31 HIS HD2 H . . . 1 1 21 21 GLU HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 31 HIS HD2 . . A . 21 GLU HB3 . . . 31 . HD2 . . . . . 21 . HB# . . rr_1a7i 1 113 1 OR . 1 1 31 31 HIS HD2 H . . . 1 1 21 21 GLU HG2 H . . . . . 3.0 1.8 3.3 . . . . . A . 31 HIS HD2 . . A . 21 GLU HG2 . . . 31 . HD2 . . . . . 21 . HG# . . rr_1a7i 1 113 2 OR . 1 1 21 21 GLU HG3 H . . . 1 1 31 31 HIS HD2 H . . . . . 3.0 1.8 3.3 . . . . . A . 21 GLU HG3 . . A . 31 HIS HD2 . . . 21 . HG# . . . . . 31 . HD2 . . rr_1a7i 1 114 1 OR . 1 1 32 32 ARG H H . . . 1 1 21 21 GLU HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 32 ARG H . . A . 21 GLU HG2 . . . 32 . HN . . . . . 21 . HG# . . rr_1a7i 1 114 2 OR . 1 1 21 21 GLU HG3 H . . . 1 1 32 32 ARG H H . . . . . 4.0 1.8 5.0 . . . . . A . 21 GLU HG3 . . A . 32 ARG H . . . 21 . HG# . . . . . 32 . HN . . rr_1a7i 1 115 1 . . 1 1 22 22 GLU H H . . . 1 1 22 22 GLU HA H . . . . . 3.0 1.8 3.3 . . . . . A . 22 GLU H . . A . 22 GLU HA . . . 22 . HN . . . . . 22 . HA . . rr_1a7i 1 116 1 OR . 1 1 22 22 GLU H H . . . 1 1 22 22 GLU HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 22 GLU H . . A . 22 GLU HB2 . . . 22 . HN . . . . . 22 . HB# . . rr_1a7i 1 116 2 OR . 1 1 22 22 GLU H H . . . 1 1 22 22 GLU HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 22 GLU H . . A . 22 GLU HB3 . . . 22 . HN . . . . . 22 . HB# . . rr_1a7i 1 117 1 OR . 1 1 22 22 GLU H H . . . 1 1 22 22 GLU HG2 H . . . . . 3.0 1.8 3.3 . . . . . A . 22 GLU H . . A . 22 GLU HG2 . . . 22 . HN . . . . . 22 . HG# . . rr_1a7i 1 117 2 OR . 1 1 22 22 GLU H H . . . 1 1 22 22 GLU HG3 H . . . . . 3.0 1.8 3.3 . . . . . A . 22 GLU H . . A . 22 GLU HG3 . . . 22 . HN . . . . . 22 . HG# . . rr_1a7i 1 118 1 . . 1 1 22 22 GLU H H . . . 1 1 23 23 VAL H H . . . . . 4.0 1.8 5.0 . . . . . A . 22 GLU H . . A . 23 VAL H . . . 22 . HN . . . . . 23 . HN . . rr_1a7i 1 119 1 . . 1 1 23 23 VAL H H . . . 1 1 22 22 GLU HA H . . . . . 2.5 1.8 2.7 . . . . . A . 23 VAL H . . A . 22 GLU HA . . . 23 . HN . . . . . 22 . HA . . rr_1a7i 1 120 1 OR . 1 1 23 23 VAL H H . . . 1 1 22 22 GLU HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 23 VAL H . . A . 22 GLU HB2 . . . 23 . HN . . . . . 22 . HB# . . rr_1a7i 1 120 2 OR . 1 1 22 22 GLU HB3 H . . . 1 1 23 23 VAL H H . . . . . 3.0 1.8 3.3 . . . . . A . 22 GLU HB3 . . A . 23 VAL H . . . 22 . HB# . . . . . 23 . HN . . rr_1a7i 1 121 1 OR . 1 1 23 23 VAL H H . . . 1 1 22 22 GLU HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 23 VAL H . . A . 22 GLU HG2 . . . 23 . HN . . . . . 22 . HG# . . rr_1a7i 1 121 2 OR . 1 1 22 22 GLU HG3 H . . . 1 1 23 23 VAL H H . . . . . 4.0 1.8 5.0 . . . . . A . 22 GLU HG3 . . A . 23 VAL H . . . 22 . HG# . . . . . 23 . HN . . rr_1a7i 1 122 1 OR . 1 1 29 29 SER HB2 H . . . 1 1 22 22 GLU HB2 H . . . . . 2.5 1.8 2.7 . . . . . A . 29 SER HB2 . . A . 22 GLU HB2 . . . 29 . HB2 . . . . . 22 . HB# . . rr_1a7i 1 122 2 OR . 1 1 22 22 GLU HB3 H . . . 1 1 29 29 SER HB2 H . . . . . 2.5 1.8 2.7 . . . . . A . 22 GLU HB3 . . A . 29 SER HB2 . . . 22 . HB# . . . . . 29 . HB2 . . rr_1a7i 1 123 1 . . 1 1 23 23 VAL H H . . . 1 1 23 23 VAL HB H . . . . . 3.0 1.8 3.3 . . . . . A . 23 VAL H . . A . 23 VAL HB . . . 23 . HN . . . . . 23 . HB . . rr_1a7i 1 124 1 . . 1 1 23 23 VAL H H . . . 1 1 23 23 VAL MG1 H . . . . . 4.0 1.8 5.0 . . . . . A . 23 VAL H . . A . 23 VAL MG1 . . . 23 . HN . . . . . 23 . HG1# . . rr_1a7i 1 125 1 . . 1 1 23 23 VAL H H . . . 1 1 23 23 VAL MG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 23 VAL H . . A . 23 VAL MG2 . . . 23 . HN . . . . . 23 . HG2# . . rr_1a7i 1 126 1 . . 1 1 23 23 VAL MG1 H . . . 1 1 23 23 VAL HA H . . . . . 4.0 1.8 5.0 . . . . . A . 23 VAL MG1 . . A . 23 VAL HA . . . 23 . HG1# . . . . . 23 . HA . . rr_1a7i 1 127 1 . . 1 1 23 23 VAL MG2 H . . . 1 1 23 23 VAL HA H . . . . . 4.0 1.8 5.0 . . . . . A . 23 VAL MG2 . . A . 23 VAL HA . . . 23 . HG2# . . . . . 23 . HA . . rr_1a7i 1 128 1 . . 1 1 23 23 VAL HA H . . . 1 1 24 24 GLN H H . . . . . 2.5 1.8 2.7 . . . . . A . 23 VAL HA . . A . 24 GLN H . . . 23 . HA . . . . . 24 . HN . . rr_1a7i 1 129 1 . . 1 1 23 23 VAL HB H . . . 1 1 24 24 GLN H H . . . . . 4.0 1.8 5.0 . . . . . A . 23 VAL HB . . A . 24 GLN H . . . 23 . HB . . . . . 24 . HN . . rr_1a7i 1 130 1 . . 1 1 23 23 VAL MG1 H . . . 1 1 24 24 GLN H H . . . . . 4.0 1.8 5.0 . . . . . A . 23 VAL MG1 . . A . 24 GLN H . . . 23 . HG1# . . . . . 24 . HN . . rr_1a7i 1 131 1 . . 1 1 23 23 VAL MG1 H . . . 1 1 24 24 GLN HA H . . . . . 4.0 1.8 5.0 . . . . . A . 23 VAL MG1 . . A . 24 GLN HA . . . 23 . HG1# . . . . . 24 . HA . . rr_1a7i 1 132 1 . . 1 1 23 23 VAL MG2 H . . . 1 1 24 24 GLN H H . . . . . 4.0 1.8 5.0 . . . . . A . 23 VAL MG2 . . A . 24 GLN H . . . 23 . HG2# . . . . . 24 . HN . . rr_1a7i 1 133 1 . . 1 1 23 23 VAL H H . . . 1 1 30 30 PHE H H . . . . . 4.0 1.8 5.0 . . . . . A . 23 VAL H . . A . 30 PHE H . . . 23 . HN . . . . . 30 . HN . . rr_1a7i 1 134 1 . . 1 1 23 23 VAL MG1 H . . . 1 1 30 30 PHE H H . . . . . 4.0 1.8 6.0 . . . . . A . 23 VAL MG1 . . A . 30 PHE H . . . 23 . HG1# . . . . . 30 . HN . . rr_1a7i 1 135 1 . . 1 1 30 30 PHE QD H . . . 1 1 23 23 VAL MG1 H . . . . . 4.0 1.8 7.2 . . . . . A . 30 PHE QD . . A . 23 VAL MG1 . . . 30 . HD# . . . . . 23 . HG1# . . rr_1a7i 1 136 1 . . 1 1 30 30 PHE QD H . . . 1 1 23 23 VAL MG2 H . . . . . 4.0 1.8 7.2 . . . . . A . 30 PHE QD . . A . 23 VAL MG2 . . . 30 . HD# . . . . . 23 . HG2# . . rr_1a7i 1 137 1 . . 1 1 32 32 ARG H H . . . 1 1 23 23 VAL MG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 32 ARG H . . A . 23 VAL MG2 . . . 32 . HN . . . . . 23 . HG2# . . rr_1a7i 1 138 1 . . 1 1 23 23 VAL MG1 H . . . 1 1 35 35 PHE HZ H . . . . . 4.0 1.8 5.0 . . . . . A . 23 VAL MG1 . . A . 35 PHE HZ . . . 23 . HG1# . . . . . 35 . HZ . . rr_1a7i 1 139 1 . . 1 1 23 23 VAL MG1 H . . . 1 1 35 35 PHE QD H . . . . . 4.0 1.8 7.2 . . . . . A . 23 VAL MG1 . . A . 35 PHE QD . . . 23 . HG1# . . . . . 35 . HD# . . rr_1a7i 1 140 1 . . 1 1 35 35 PHE QE H . . . 1 1 23 23 VAL MG1 H . . . . . 4.0 1.8 7.2 . . . . . A . 35 PHE QE . . A . 23 VAL MG1 . . . 35 . HE# . . . . . 23 . HG1# . . rr_1a7i 1 141 1 OR . 1 1 24 24 GLN H H . . . 1 1 24 24 GLN HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 24 GLN H . . A . 24 GLN HB2 . . . 24 . HN . . . . . 24 . HB# . . rr_1a7i 1 141 2 OR . 1 1 24 24 GLN H H . . . 1 1 24 24 GLN HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 24 GLN H . . A . 24 GLN HB3 . . . 24 . HN . . . . . 24 . HB# . . rr_1a7i 1 142 1 OR . 1 1 24 24 GLN H H . . . 1 1 24 24 GLN HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 24 GLN H . . A . 24 GLN HG2 . . . 24 . HN . . . . . 24 . HG# . . rr_1a7i 1 142 2 OR . 1 1 24 24 GLN H H . . . 1 1 24 24 GLN HG3 H . . . . . 4.0 1.8 5.0 . . . . . A . 24 GLN H . . A . 24 GLN HG3 . . . 24 . HN . . . . . 24 . HG# . . rr_1a7i 1 143 1 OR . 1 1 24 24 GLN HA H . . . 1 1 24 24 GLN HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 24 GLN HA . . A . 24 GLN HB2 . . . 24 . HA . . . . . 24 . HB# . . rr_1a7i 1 143 2 OR . 1 1 24 24 GLN HA H . . . 1 1 24 24 GLN HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 24 GLN HA . . A . 24 GLN HB3 . . . 24 . HA . . . . . 24 . HB# . . rr_1a7i 1 144 1 OR . 1 1 24 24 GLN HA H . . . 1 1 24 24 GLN HG2 H . . . . . 3.0 1.8 3.3 . . . . . A . 24 GLN HA . . A . 24 GLN HG2 . . . 24 . HA . . . . . 24 . HG# . . rr_1a7i 1 144 2 OR . 1 1 24 24 GLN HA H . . . 1 1 24 24 GLN HG3 H . . . . . 3.0 1.8 3.3 . . . . . A . 24 GLN HA . . A . 24 GLN HG3 . . . 24 . HA . . . . . 24 . HG# . . rr_1a7i 1 145 1 . . 1 1 24 24 GLN H H . . . 1 1 25 25 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 24 GLN H . . A . 25 CYS H . . . 24 . HN . . . . . 25 . HN . . rr_1a7i 1 146 1 . . 1 1 24 24 GLN HA H . . . 1 1 25 25 CYS H H . . . . . 2.5 1.8 2.7 . . . . . A . 24 GLN HA . . A . 25 CYS H . . . 24 . HA . . . . . 25 . HN . . rr_1a7i 1 147 1 OR . 1 1 25 25 CYS H H . . . 1 1 24 24 GLN HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 25 CYS H . . A . 24 GLN HB2 . . . 25 . HN . . . . . 24 . HB# . . rr_1a7i 1 147 2 OR . 1 1 24 24 GLN HB3 H . . . 1 1 25 25 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 24 GLN HB3 . . A . 25 CYS H . . . 24 . HB# . . . . . 25 . HN . . rr_1a7i 1 148 1 OR . 1 1 25 25 CYS H H . . . 1 1 24 24 GLN HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 25 CYS H . . A . 24 GLN HG2 . . . 25 . HN . . . . . 24 . HG# . . rr_1a7i 1 148 2 OR . 1 1 24 24 GLN HG3 H . . . 1 1 25 25 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 24 GLN HG3 . . A . 25 CYS H . . . 24 . HG# . . . . . 25 . HN . . rr_1a7i 1 149 1 . . 1 1 24 24 GLN HA H . . . 1 1 28 28 ARG H H . . . . . 4.0 1.8 6.0 . . . . . A . 24 GLN HA . . A . 28 ARG H . . . 24 . HA . . . . . 28 . HN . . rr_1a7i 1 150 1 . . 1 1 24 24 GLN HA H . . . 1 1 30 30 PHE H H . . . . . 4.0 1.8 5.0 . . . . . A . 24 GLN HA . . A . 30 PHE H . . . 24 . HA . . . . . 30 . HN . . rr_1a7i 1 151 1 OR . 1 1 25 25 CYS H H . . . 1 1 25 25 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 25 CYS H . . A . 25 CYS HB2 . . . 25 . HN . . . . . 25 . HB# . . rr_1a7i 1 151 2 OR . 1 1 25 25 CYS H H . . . 1 1 25 25 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 25 CYS H . . A . 25 CYS HB3 . . . 25 . HN . . . . . 25 . HB# . . rr_1a7i 1 152 1 . . 1 1 25 25 CYS H H . . . 1 1 28 28 ARG H H . . . . . 4.0 1.8 5.0 . . . . . A . 25 CYS H . . A . 28 ARG H . . . 25 . HN . . . . . 28 . HN . . rr_1a7i 1 153 1 OR . 1 1 28 28 ARG H H . . . 1 1 25 25 CYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 28 ARG H . . A . 25 CYS HB2 . . . 28 . HN . . . . . 25 . HB# . . rr_1a7i 1 153 2 OR . 1 1 28 28 ARG H H . . . 1 1 25 25 CYS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 28 ARG H . . A . 25 CYS HB3 . . . 28 . HN . . . . . 25 . HB# . . rr_1a7i 1 154 1 . . 1 1 25 25 CYS H H . . . 1 1 29 29 SER H H . . . . . 4.0 1.8 6.0 . . . . . A . 25 CYS H . . A . 29 SER H . . . 25 . HN . . . . . 29 . HN . . rr_1a7i 1 155 1 . . 1 1 25 25 CYS H H . . . 1 1 29 29 SER HA H . . . . . 4.0 1.8 5.0 . . . . . A . 25 CYS H . . A . 29 SER HA . . . 25 . HN . . . . . 29 . HA . . rr_1a7i 1 156 1 . . 1 1 30 30 PHE QE H . . . 1 1 25 25 CYS H H . . . . . 4.0 1.8 7.2 . . . . . A . 30 PHE QE . . A . 25 CYS H . . . 30 . HE# . . . . . 25 . HN . . rr_1a7i 1 157 1 OR . 1 1 30 30 PHE QD H . . . 1 1 25 25 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 30 PHE QD . . A . 25 CYS HB2 . . . 30 . HD# . . . . . 25 . HB# . . rr_1a7i 1 157 2 OR . 1 1 30 30 PHE QD H . . . 1 1 25 25 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 30 PHE QD . . A . 25 CYS HB3 . . . 30 . HD# . . . . . 25 . HB# . . rr_1a7i 1 158 1 OR . 1 1 30 30 PHE QE H . . . 1 1 25 25 CYS HB2 H . . . . . 3.0 1.8 5.5 . . . . . A . 30 PHE QE . . A . 25 CYS HB2 . . . 30 . HE# . . . . . 25 . HB# . . rr_1a7i 1 158 2 OR . 1 1 30 30 PHE QE H . . . 1 1 25 25 CYS HB3 H . . . . . 3.0 1.8 5.5 . . . . . A . 30 PHE QE . . A . 25 CYS HB3 . . . 30 . HE# . . . . . 25 . HB# . . rr_1a7i 1 159 1 OR . 1 1 35 35 PHE HZ H . . . 1 1 25 25 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 35 PHE HZ . . A . 25 CYS HB2 . . . 35 . HZ . . . . . 25 . HB# . . rr_1a7i 1 159 2 OR . 1 1 35 35 PHE HZ H . . . 1 1 25 25 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 35 PHE HZ . . A . 25 CYS HB3 . . . 35 . HZ . . . . . 25 . HB# . . rr_1a7i 1 160 1 . . 1 1 28 28 ARG H H . . . 1 1 27 27 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 28 ARG H . . A . 27 GLY H . . . 28 . HN . . . . . 27 . HN . . rr_1a7i 1 161 1 OR . 1 1 28 28 ARG H H . . . 1 1 27 27 GLY HA2 H . . . . . 4.0 1.8 5.0 . . . . . A . 28 ARG H . . A . 27 GLY HA2 . . . 28 . HN . . . . . 27 . HA# . . rr_1a7i 1 161 2 OR . 1 1 28 28 ARG H H . . . 1 1 27 27 GLY HA3 H . . . . . 4.0 1.8 5.0 . . . . . A . 28 ARG H . . A . 27 GLY HA3 . . . 28 . HN . . . . . 27 . HA# . . rr_1a7i 1 162 1 . . 1 1 28 28 ARG H H . . . 1 1 28 28 ARG HA H . . . . . 3.0 1.8 3.3 . . . . . A . 28 ARG H . . A . 28 ARG HA . . . 28 . HN . . . . . 28 . HA . . rr_1a7i 1 163 1 OR . 1 1 28 28 ARG H H . . . 1 1 28 28 ARG HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 28 ARG H . . A . 28 ARG HB2 . . . 28 . HN . . . . . 28 . HB# . . rr_1a7i 1 163 2 OR . 1 1 28 28 ARG H H . . . 1 1 28 28 ARG HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 28 ARG H . . A . 28 ARG HB3 . . . 28 . HN . . . . . 28 . HB# . . rr_1a7i 1 164 1 OR . 1 1 28 28 ARG H H . . . 1 1 28 28 ARG HG2 H . . . . . 3.0 1.8 3.3 . . . . . A . 28 ARG H . . A . 28 ARG HG2 . . . 28 . HN . . . . . 28 . HG# . . rr_1a7i 1 164 2 OR . 1 1 28 28 ARG H H . . . 1 1 28 28 ARG HG3 H . . . . . 3.0 1.8 3.3 . . . . . A . 28 ARG H . . A . 28 ARG HG3 . . . 28 . HN . . . . . 28 . HG# . . rr_1a7i 1 165 1 OR . 1 1 28 28 ARG H H . . . 1 1 28 28 ARG HD2 H . . . . . 4.0 1.8 7.2 . . . . . A . 28 ARG H . . A . 28 ARG HD2 . . . 28 . HN . . . . . 28 . HD# . . rr_1a7i 1 165 2 OR . 1 1 28 28 ARG H H . . . 1 1 28 28 ARG HD3 H . . . . . 4.0 1.8 7.2 . . . . . A . 28 ARG H . . A . 28 ARG HD3 . . . 28 . HN . . . . . 28 . HD# . . rr_1a7i 1 166 1 . . 1 1 29 29 SER H H . . . 1 1 28 28 ARG HA H . . . . . 2.5 1.8 2.7 . . . . . A . 29 SER H . . A . 28 ARG HA . . . 29 . HN . . . . . 28 . HA . . rr_1a7i 1 167 1 OR . 1 1 29 29 SER H H . . . 1 1 28 28 ARG HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 29 SER H . . A . 28 ARG HB2 . . . 29 . HN . . . . . 28 . HB# . . rr_1a7i 1 167 2 OR . 1 1 29 29 SER H H . . . 1 1 28 28 ARG HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 29 SER H . . A . 28 ARG HB3 . . . 29 . HN . . . . . 28 . HB# . . rr_1a7i 1 168 1 OR . 1 1 29 29 SER H H . . . 1 1 28 28 ARG HG2 H . . . . . 3.0 1.8 3.3 . . . . . A . 29 SER H . . A . 28 ARG HG2 . . . 29 . HN . . . . . 28 . HG# . . rr_1a7i 1 168 2 OR . 1 1 29 29 SER H H . . . 1 1 28 28 ARG HG3 H . . . . . 3.0 1.8 3.3 . . . . . A . 29 SER H . . A . 28 ARG HG3 . . . 29 . HN . . . . . 28 . HG# . . rr_1a7i 1 169 1 . . 1 1 30 30 PHE QE H . . . 1 1 28 28 ARG H H . . . . . 4.0 1.8 7.2 . . . . . A . 30 PHE QE . . A . 28 ARG H . . . 30 . HE# . . . . . 28 . HN . . rr_1a7i 1 170 1 OR . 1 1 30 30 PHE QE H . . . 1 1 28 28 ARG HB2 H . . . . . 2.5 1.8 4.9 . . . . . A . 30 PHE QE . . A . 28 ARG HB2 . . . 30 . HE# . . . . . 28 . HB# . . rr_1a7i 1 170 2 OR . 1 1 30 30 PHE QE H . . . 1 1 28 28 ARG HB3 H . . . . . 2.5 1.8 4.9 . . . . . A . 30 PHE QE . . A . 28 ARG HB3 . . . 30 . HE# . . . . . 28 . HB# . . rr_1a7i 1 171 1 OR . 1 1 30 30 PHE H H . . . 1 1 28 28 ARG HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 30 PHE H . . A . 28 ARG HG2 . . . 30 . HN . . . . . 28 . HG# . . rr_1a7i 1 171 2 OR . 1 1 30 30 PHE H H . . . 1 1 28 28 ARG HG3 H . . . . . 4.0 1.8 5.0 . . . . . A . 30 PHE H . . A . 28 ARG HG3 . . . 30 . HN . . . . . 28 . HG# . . rr_1a7i 1 172 1 OR . 1 1 30 30 PHE QE H . . . 1 1 28 28 ARG HG2 H . . . . . 2.5 1.8 4.9 . . . . . A . 30 PHE QE . . A . 28 ARG HG2 . . . 30 . HE# . . . . . 28 . HG# . . rr_1a7i 1 172 2 OR . 1 1 30 30 PHE QE H . . . 1 1 28 28 ARG HG3 H . . . . . 2.5 1.8 4.9 . . . . . A . 30 PHE QE . . A . 28 ARG HG3 . . . 30 . HE# . . . . . 28 . HG# . . rr_1a7i 1 173 1 . . 1 1 29 29 SER H H . . . 1 1 29 29 SER HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 29 SER H . . A . 29 SER HB3 . . . 29 . HN . . . . . 29 . HB1 . . rr_1a7i 1 174 1 . . 1 1 29 29 SER HB2 H . . . 1 1 29 29 SER H H . . . . . 4.0 1.8 5.0 . . . . . A . 29 SER HB2 . . A . 29 SER H . . . 29 . HB2 . . . . . 29 . HN . . rr_1a7i 1 175 1 . . 1 1 30 30 PHE H H . . . 1 1 29 29 SER HA H . . . . . 2.5 1.8 2.7 . . . . . A . 30 PHE H . . A . 29 SER HA . . . 30 . HN . . . . . 29 . HA . . rr_1a7i 1 176 1 . . 1 1 30 30 PHE H H . . . 1 1 29 29 SER HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 30 PHE H . . A . 29 SER HB3 . . . 30 . HN . . . . . 29 . HB1 . . rr_1a7i 1 177 1 . . 1 1 30 30 PHE QD H . . . 1 1 29 29 SER HB3 H . . . . . 3.0 1.8 5.5 . . . . . A . 30 PHE QD . . A . 29 SER HB3 . . . 30 . HD# . . . . . 29 . HB1 . . rr_1a7i 1 178 1 . . 1 1 29 29 SER HB2 H . . . 1 1 30 30 PHE H H . . . . . 4.0 1.8 5.0 . . . . . A . 29 SER HB2 . . A . 30 PHE H . . . 29 . HB2 . . . . . 30 . HN . . rr_1a7i 1 179 1 . . 1 1 30 30 PHE H H . . . 1 1 30 30 PHE HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 30 PHE H . . A . 30 PHE HB3 . . . 30 . HN . . . . . 30 . HB1 . . rr_1a7i 1 180 1 . . 1 1 30 30 PHE H H . . . 1 1 30 30 PHE HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 30 PHE H . . A . 30 PHE HB2 . . . 30 . HN . . . . . 30 . HB2 . . rr_1a7i 1 181 1 . . 1 1 30 30 PHE QD H . . . 1 1 30 30 PHE H H . . . . . 3.0 1.8 5.5 . . . . . A . 30 PHE QD . . A . 30 PHE H . . . 30 . HD# . . . . . 30 . HN . . rr_1a7i 1 182 1 . . 1 1 30 30 PHE HA H . . . 1 1 30 30 PHE QD H . . . . . 3.0 1.8 5.5 . . . . . A . 30 PHE HA . . A . 30 PHE QD . . . 30 . HA . . . . . 30 . HD# . . rr_1a7i 1 183 1 . . 1 1 30 30 PHE QD H . . . 1 1 30 30 PHE HB3 H . . . . . 2.5 1.8 4.9 . . . . . A . 30 PHE QD . . A . 30 PHE HB3 . . . 30 . HD# . . . . . 30 . HB1 . . rr_1a7i 1 184 1 . . 1 1 30 30 PHE QD H . . . 1 1 30 30 PHE HB2 H . . . . . 2.5 1.8 4.9 . . . . . A . 30 PHE QD . . A . 30 PHE HB2 . . . 30 . HD# . . . . . 30 . HB2 . . rr_1a7i 1 185 1 . . 1 1 30 30 PHE HA H . . . 1 1 31 31 HIS H H . . . . . 3.0 1.8 3.3 . . . . . A . 30 PHE HA . . A . 31 HIS H . . . 30 . HA . . . . . 31 . HN . . rr_1a7i 1 186 1 . . 1 1 31 31 HIS H H . . . 1 1 30 30 PHE HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 31 HIS H . . A . 30 PHE HB3 . . . 31 . HN . . . . . 30 . HB1 . . rr_1a7i 1 187 1 . . 1 1 31 31 HIS H H . . . 1 1 30 30 PHE HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 31 HIS H . . A . 30 PHE HB2 . . . 31 . HN . . . . . 30 . HB2 . . rr_1a7i 1 188 1 . . 1 1 30 30 PHE QD H . . . 1 1 31 31 HIS H H . . . . . 4.0 1.8 7.2 . . . . . A . 30 PHE QD . . A . 31 HIS H . . . 30 . HD# . . . . . 31 . HN . . rr_1a7i 1 189 1 . . 1 1 32 32 ARG H H . . . 1 1 30 30 PHE HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 32 ARG H . . A . 30 PHE HB2 . . . 32 . HN . . . . . 30 . HB2 . . rr_1a7i 1 190 1 . . 1 1 30 30 PHE QD H . . . 1 1 35 35 PHE QD H . . . . . 3.0 1.8 5.5 . . . . . A . 30 PHE QD . . A . 35 PHE QD . . . 30 . HD# . . . . . 35 . HD# . . rr_1a7i 1 191 1 . . 1 1 30 30 PHE QE H . . . 1 1 51 51 ILE MD H . . . . . 4.0 1.8 7.2 . . . . . A . 30 PHE QE . . A . 51 ILE MD . . . 30 . HE# . . . . . 51 . HD1# . . rr_1a7i 1 192 1 OR . 1 1 30 30 PHE QE H . . . 1 1 56 56 VAL MG1 H . . . . . 4.0 1.8 8.7 . . . . . A . 30 PHE QE . . A . 56 VAL MG1 . . . 30 . HE# . . . . . 56 . HG# . . rr_1a7i 1 192 2 OR . 1 1 30 30 PHE QE H . . . 1 1 56 56 VAL MG2 H . . . . . 4.0 1.8 8.7 . . . . . A . 30 PHE QE . . A . 56 VAL MG2 . . . 30 . HE# . . . . . 56 . HG# . . rr_1a7i 1 193 1 OR . 1 1 31 31 HIS H H . . . 1 1 31 31 HIS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 31 HIS H . . A . 31 HIS HB2 . . . 31 . HN . . . . . 31 . HB# . . rr_1a7i 1 193 2 OR . 1 1 31 31 HIS H H . . . 1 1 31 31 HIS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 31 HIS H . . A . 31 HIS HB3 . . . 31 . HN . . . . . 31 . HB# . . rr_1a7i 1 194 1 OR . 1 1 31 31 HIS HD2 H . . . 1 1 31 31 HIS HB2 H . . . . . 2.5 1.8 2.7 . . . . . A . 31 HIS HD2 . . A . 31 HIS HB2 . . . 31 . HD2 . . . . . 31 . HB# . . rr_1a7i 1 194 2 OR . 1 1 31 31 HIS HD2 H . . . 1 1 31 31 HIS HB3 H . . . . . 2.5 1.8 2.7 . . . . . A . 31 HIS HD2 . . A . 31 HIS HB3 . . . 31 . HD2 . . . . . 31 . HB# . . rr_1a7i 1 195 1 . . 1 1 31 31 HIS HA H . . . 1 1 32 32 ARG H H . . . . . 2.5 1.8 2.7 . . . . . A . 31 HIS HA . . A . 32 ARG H . . . 31 . HA . . . . . 32 . HN . . rr_1a7i 1 196 1 . . 1 1 31 31 HIS HD2 H . . . 1 1 32 32 ARG H H . . . . . 3.0 1.8 3.3 . . . . . A . 31 HIS HD2 . . A . 32 ARG H . . . 31 . HD2 . . . . . 32 . HN . . rr_1a7i 1 197 1 OR . 1 1 32 32 ARG H H . . . 1 1 31 31 HIS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 32 ARG H . . A . 31 HIS HB2 . . . 32 . HN . . . . . 31 . HB# . . rr_1a7i 1 197 2 OR . 1 1 32 32 ARG H H . . . 1 1 31 31 HIS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 32 ARG H . . A . 31 HIS HB3 . . . 32 . HN . . . . . 31 . HB# . . rr_1a7i 1 198 1 . . 1 1 31 31 HIS H H . . . 1 1 34 34 CYS H H . . . . . 4.0 1.8 6.0 . . . . . A . 31 HIS H . . A . 34 CYS H . . . 31 . HN . . . . . 34 . HN . . rr_1a7i 1 199 1 OR . 1 1 31 31 HIS H H . . . 1 1 34 34 CYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 31 HIS H . . A . 34 CYS HB2 . . . 31 . HN . . . . . 34 . HB# . . rr_1a7i 1 199 2 OR . 1 1 31 31 HIS H H . . . 1 1 34 34 CYS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 31 HIS H . . A . 34 CYS HB3 . . . 31 . HN . . . . . 34 . HB# . . rr_1a7i 1 200 1 OR . 1 1 34 34 CYS H H . . . 1 1 31 31 HIS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 34 CYS H . . A . 31 HIS HB2 . . . 34 . HN . . . . . 31 . HB# . . rr_1a7i 1 200 2 OR . 1 1 31 31 HIS HB3 H . . . 1 1 34 34 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 31 HIS HB3 . . A . 34 CYS H . . . 31 . HB# . . . . . 34 . HN . . rr_1a7i 1 201 1 . . 1 1 32 32 ARG H H . . . 1 1 32 32 ARG HA H . . . . . 3.0 1.8 3.3 . . . . . A . 32 ARG H . . A . 32 ARG HA . . . 32 . HN . . . . . 32 . HA . . rr_1a7i 1 202 1 OR . 1 1 32 32 ARG H H . . . 1 1 32 32 ARG HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 32 ARG H . . A . 32 ARG HB2 . . . 32 . HN . . . . . 32 . HB# . . rr_1a7i 1 202 2 OR . 1 1 32 32 ARG H H . . . 1 1 32 32 ARG HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 32 ARG H . . A . 32 ARG HB3 . . . 32 . HN . . . . . 32 . HB# . . rr_1a7i 1 203 1 OR . 1 1 32 32 ARG H H . . . 1 1 32 32 ARG HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 32 ARG H . . A . 32 ARG HG2 . . . 32 . HN . . . . . 32 . HG# . . rr_1a7i 1 203 2 OR . 1 1 32 32 ARG H H . . . 1 1 32 32 ARG HG3 H . . . . . 4.0 1.8 5.0 . . . . . A . 32 ARG H . . A . 32 ARG HG3 . . . 32 . HN . . . . . 32 . HG# . . rr_1a7i 1 204 1 OR . 1 1 33 33 CYS H H . . . 1 1 33 33 CYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 33 CYS H . . A . 33 CYS HB2 . . . 33 . HN . . . . . 33 . HB# . . rr_1a7i 1 204 2 OR . 1 1 33 33 CYS H H . . . 1 1 33 33 CYS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 33 CYS H . . A . 33 CYS HB3 . . . 33 . HN . . . . . 33 . HB# . . rr_1a7i 1 205 1 OR . 1 1 35 35 PHE H H . . . 1 1 33 33 CYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 35 PHE H . . A . 33 CYS HB2 . . . 35 . HN . . . . . 33 . HB# . . rr_1a7i 1 205 2 OR . 1 1 33 33 CYS HB3 H . . . 1 1 35 35 PHE H H . . . . . 4.0 1.8 5.0 . . . . . A . 33 CYS HB3 . . A . 35 PHE H . . . 33 . HB# . . . . . 35 . HN . . rr_1a7i 1 206 1 . . 1 1 34 34 CYS H H . . . 1 1 34 34 CYS HA H . . . . . 3.0 1.8 3.3 . . . . . A . 34 CYS H . . A . 34 CYS HA . . . 34 . HN . . . . . 34 . HA . . rr_1a7i 1 207 1 OR . 1 1 34 34 CYS H H . . . 1 1 34 34 CYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 34 CYS H . . A . 34 CYS HB2 . . . 34 . HN . . . . . 34 . HB# . . rr_1a7i 1 207 2 OR . 1 1 34 34 CYS H H . . . 1 1 34 34 CYS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 34 CYS H . . A . 34 CYS HB3 . . . 34 . HN . . . . . 34 . HB# . . rr_1a7i 1 208 1 . . 1 1 35 35 PHE H H . . . 1 1 34 34 CYS HA H . . . . . 3.0 1.8 3.3 . . . . . A . 35 PHE H . . A . 34 CYS HA . . . 35 . HN . . . . . 34 . HA . . rr_1a7i 1 209 1 . . 1 1 35 35 PHE H H . . . 1 1 35 35 PHE HA H . . . . . 3.0 1.8 3.3 . . . . . A . 35 PHE H . . A . 35 PHE HA . . . 35 . HN . . . . . 35 . HA . . rr_1a7i 1 210 1 . . 1 1 35 35 PHE H H . . . 1 1 35 35 PHE HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 35 PHE H . . A . 35 PHE HB3 . . . 35 . HN . . . . . 35 . HB1 . . rr_1a7i 1 211 1 . . 1 1 35 35 PHE H H . . . 1 1 35 35 PHE HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 35 PHE H . . A . 35 PHE HB2 . . . 35 . HN . . . . . 35 . HB2 . . rr_1a7i 1 212 1 . . 1 1 35 35 PHE QD H . . . 1 1 35 35 PHE H H . . . . . 4.0 1.8 7.2 . . . . . A . 35 PHE QD . . A . 35 PHE H . . . 35 . HD# . . . . . 35 . HN . . rr_1a7i 1 213 1 . . 1 1 35 35 PHE QD H . . . 1 1 35 35 PHE HA H . . . . . 3.0 1.8 5.5 . . . . . A . 35 PHE QD . . A . 35 PHE HA . . . 35 . HD# . . . . . 35 . HA . . rr_1a7i 1 214 1 OR . 1 1 35 35 PHE QD H . . . 1 1 35 35 PHE HB3 H . . . . . 3.0 1.8 5.5 . . . . . A . 35 PHE QD . . A . 35 PHE HB3 . . . 35 . HD# . . . . . 35 . HB# . . rr_1a7i 1 214 2 OR . 1 1 35 35 PHE QD H . . . 1 1 35 35 PHE HB2 H . . . . . 3.0 1.8 5.5 . . . . . A . 35 PHE QD . . A . 35 PHE HB2 . . . 35 . HD# . . . . . 35 . HB# . . rr_1a7i 1 215 1 OR . 1 1 35 35 PHE QE H . . . 1 1 35 35 PHE HB3 H . . . . . 3.0 1.8 5.5 . . . . . A . 35 PHE QE . . A . 35 PHE HB3 . . . 35 . HE# . . . . . 35 . HB# . . rr_1a7i 1 215 2 OR . 1 1 35 35 PHE QE H . . . 1 1 35 35 PHE HB2 H . . . . . 3.0 1.8 5.5 . . . . . A . 35 PHE QE . . A . 35 PHE HB2 . . . 35 . HE# . . . . . 35 . HB# . . rr_1a7i 1 216 1 . . 1 1 35 35 PHE H H . . . 1 1 36 36 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 35 PHE H . . A . 36 LEU H . . . 35 . HN . . . . . 36 . HN . . rr_1a7i 1 217 1 OR . 1 1 35 35 PHE H H . . . 1 1 36 36 LEU MD1 H . . . . . 4.0 1.8 8.2 . . . . . A . 35 PHE H . . A . 36 LEU MD1 . . . 35 . HN . . . . . 36 . HD# . . rr_1a7i 1 217 2 OR . 1 1 35 35 PHE H H . . . 1 1 36 36 LEU MD2 H . . . . . 4.0 1.8 8.2 . . . . . A . 35 PHE H . . A . 36 LEU MD2 . . . 35 . HN . . . . . 36 . HD# . . rr_1a7i 1 218 1 . . 1 1 35 35 PHE HA H . . . 1 1 36 36 LEU H H . . . . . 2.5 1.8 2.7 . . . . . A . 35 PHE HA . . A . 36 LEU H . . . 35 . HA . . . . . 36 . HN . . rr_1a7i 1 219 1 . . 1 1 36 36 LEU H H . . . 1 1 35 35 PHE HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 36 LEU H . . A . 35 PHE HB3 . . . 36 . HN . . . . . 35 . HB1 . . rr_1a7i 1 220 1 . . 1 1 35 35 PHE HB2 H . . . 1 1 36 36 LEU H H . . . . . 4.0 1.8 5.0 . . . . . A . 35 PHE HB2 . . A . 36 LEU H . . . 35 . HB2 . . . . . 36 . HN . . rr_1a7i 1 221 1 . . 1 1 35 35 PHE QD H . . . 1 1 36 36 LEU H H . . . . . 4.0 1.8 8.2 . . . . . A . 35 PHE QD . . A . 36 LEU H . . . 35 . HD# . . . . . 36 . HN . . rr_1a7i 1 222 1 . . 1 1 35 35 PHE QD H . . . 1 1 44 44 LEU H H . . . . . 4.0 1.8 8.2 . . . . . A . 35 PHE QD . . A . 44 LEU H . . . 35 . HD# . . . . . 44 . HN . . rr_1a7i 1 223 1 OR . 1 1 35 35 PHE QD H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 8.7 . . . . . A . 35 PHE QD . . A . 44 LEU MD1 . . . 35 . HD# . . . . . 44 . HD# . . rr_1a7i 1 223 2 OR . 1 1 35 35 PHE QD H . . . 1 1 44 44 LEU MD2 H . . . . . 4.0 1.8 8.7 . . . . . A . 35 PHE QD . . A . 44 LEU MD2 . . . 35 . HD# . . . . . 44 . HD# . . rr_1a7i 1 224 1 . . 1 1 35 35 PHE HZ H . . . 1 1 49 49 VAL HB H . . . . . 3.0 1.8 3.3 . . . . . A . 35 PHE HZ . . A . 49 VAL HB . . . 35 . HZ . . . . . 49 . HB . . rr_1a7i 1 225 1 . . 1 1 35 35 PHE HZ H . . . 1 1 49 49 VAL MG1 H . . . . . 4.0 1.8 5.0 . . . . . A . 35 PHE HZ . . A . 49 VAL MG1 . . . 35 . HZ . . . . . 49 . HG1# . . rr_1a7i 1 226 1 . . 1 1 35 35 PHE HZ H . . . 1 1 49 49 VAL MG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 35 PHE HZ . . A . 49 VAL MG2 . . . 35 . HZ . . . . . 49 . HG2# . . rr_1a7i 1 227 1 . . 1 1 35 35 PHE QD H . . . 1 1 49 49 VAL MG2 H . . . . . 4.0 1.8 7.2 . . . . . A . 35 PHE QD . . A . 49 VAL MG2 . . . 35 . HD# . . . . . 49 . HG2# . . rr_1a7i 1 228 1 . . 1 1 35 35 PHE QE H . . . 1 1 49 49 VAL MG1 H . . . . . 4.0 1.8 7.2 . . . . . A . 35 PHE QE . . A . 49 VAL MG1 . . . 35 . HE# . . . . . 49 . HG1# . . rr_1a7i 1 229 1 . . 1 1 35 35 PHE QE H . . . 1 1 49 49 VAL MG2 H . . . . . 4.0 1.8 7.2 . . . . . A . 35 PHE QE . . A . 49 VAL MG2 . . . 35 . HE# . . . . . 49 . HG2# . . rr_1a7i 1 230 1 OR . 1 1 35 35 PHE HZ H . . . 1 1 56 56 VAL MG1 H . . . . . 4.0 1.8 6.5 . . . . . A . 35 PHE HZ . . A . 56 VAL MG1 . . . 35 . HZ . . . . . 56 . HG# . . rr_1a7i 1 230 2 OR . 1 1 35 35 PHE HZ H . . . 1 1 56 56 VAL MG2 H . . . . . 4.0 1.8 6.5 . . . . . A . 35 PHE HZ . . A . 56 VAL MG2 . . . 35 . HZ . . . . . 56 . HG# . . rr_1a7i 1 231 1 OR . 1 1 35 35 PHE QD H . . . 1 1 56 56 VAL MG1 H . . . . . 4.0 1.8 8.7 . . . . . A . 35 PHE QD . . A . 56 VAL MG1 . . . 35 . HD# . . . . . 56 . HG# . . rr_1a7i 1 231 2 OR . 1 1 35 35 PHE QD H . . . 1 1 56 56 VAL MG2 H . . . . . 4.0 1.8 8.7 . . . . . A . 35 PHE QD . . A . 56 VAL MG2 . . . 35 . HD# . . . . . 56 . HG# . . rr_1a7i 1 232 1 OR . 1 1 35 35 PHE QE H . . . 1 1 56 56 VAL MG1 H . . . . . 4.0 1.8 8.7 . . . . . A . 35 PHE QE . . A . 56 VAL MG1 . . . 35 . HE# . . . . . 56 . HG# . . rr_1a7i 1 232 2 OR . 1 1 35 35 PHE QE H . . . 1 1 56 56 VAL MG2 H . . . . . 4.0 1.8 8.7 . . . . . A . 35 PHE QE . . A . 56 VAL MG2 . . . 35 . HE# . . . . . 56 . HG# . . rr_1a7i 1 233 1 . . 1 1 36 36 LEU H H . . . 1 1 36 36 LEU HG H . . . . . 3.0 1.8 3.3 . . . . . A . 36 LEU H . . A . 36 LEU HG . . . 36 . HN . . . . . 36 . HG . . rr_1a7i 1 234 1 OR . 1 1 36 36 LEU H H . . . 1 1 36 36 LEU HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 36 LEU H . . A . 36 LEU HB2 . . . 36 . HN . . . . . 36 . HB# . . rr_1a7i 1 234 2 OR . 1 1 36 36 LEU H H . . . 1 1 36 36 LEU HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 36 LEU H . . A . 36 LEU HB3 . . . 36 . HN . . . . . 36 . HB# . . rr_1a7i 1 235 1 OR . 1 1 36 36 LEU H H . . . 1 1 36 36 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 36 LEU H . . A . 36 LEU MD1 . . . 36 . HN . . . . . 36 . HD# . . rr_1a7i 1 235 2 OR . 1 1 36 36 LEU H H . . . 1 1 36 36 LEU MD2 H . . . . . 4.0 1.8 6.5 . . . . . A . 36 LEU H . . A . 36 LEU MD2 . . . 36 . HN . . . . . 36 . HD# . . rr_1a7i 1 236 1 . . 1 1 36 36 LEU HA H . . . 1 1 37 37 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 36 LEU HA . . A . 37 CYS H . . . 36 . HA . . . . . 37 . HN . . rr_1a7i 1 237 1 OR . 1 1 37 37 CYS H H . . . 1 1 36 36 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 37 CYS H . . A . 36 LEU MD1 . . . 37 . HN . . . . . 36 . HD# . . rr_1a7i 1 237 2 OR . 1 1 36 36 LEU MD2 H . . . 1 1 37 37 CYS H H . . . . . 4.0 1.8 6.5 . . . . . A . 36 LEU MD2 . . A . 37 CYS H . . . 36 . HD# . . . . . 37 . HN . . rr_1a7i 1 238 1 OR . 1 1 41 41 ARG H H . . . 1 1 36 36 LEU MD1 H . . . . . 4.0 1.8 7.5 . . . . . A . 41 ARG H . . A . 36 LEU MD1 . . . 41 . HN . . . . . 36 . HD# . . rr_1a7i 1 238 2 OR . 1 1 36 36 LEU MD2 H . . . 1 1 41 41 ARG H H . . . . . 4.0 1.8 7.5 . . . . . A . 36 LEU MD2 . . A . 41 ARG H . . . 36 . HD# . . . . . 41 . HN . . rr_1a7i 1 239 1 OR . 1 1 36 36 LEU H H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 7.5 . . . . . A . 36 LEU H . . A . 44 LEU MD1 . . . 36 . HN . . . . . 44 . HD# . . rr_1a7i 1 239 2 OR . 1 1 36 36 LEU H H . . . 1 1 44 44 LEU MD2 H . . . . . 4.0 1.8 7.5 . . . . . A . 36 LEU H . . A . 44 LEU MD2 . . . 36 . HN . . . . . 44 . HD# . . rr_1a7i 1 240 1 . . 1 1 44 44 LEU H H . . . 1 1 36 36 LEU HA H . . . . . 4.0 1.8 5.0 . . . . . A . 44 LEU H . . A . 36 LEU HA . . . 44 . HN . . . . . 36 . HA . . rr_1a7i 1 241 1 OR . 1 1 44 44 LEU H H . . . 1 1 36 36 LEU MD1 H . . . . . 4.0 1.8 7.5 . . . . . A . 44 LEU H . . A . 36 LEU MD1 . . . 44 . HN . . . . . 36 . HD# . . rr_1a7i 1 241 2 OR . 1 1 36 36 LEU MD2 H . . . 1 1 44 44 LEU H H . . . . . 4.0 1.8 7.5 . . . . . A . 36 LEU MD2 . . A . 44 LEU H . . . 36 . HD# . . . . . 44 . HN . . rr_1a7i 1 242 1 OR . 1 1 36 36 LEU MD2 H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 9.0 . . . . . A . 36 LEU MD2 . . A . 44 LEU MD1 . . . 36 . HD# . . . . . 44 . HD# . . rr_1a7i 1 242 2 OR . 1 1 36 36 LEU MD1 H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 9.0 . . . . . A . 36 LEU MD1 . . A . 44 LEU MD1 . . . 36 . HD# . . . . . 44 . HD# . . rr_1a7i 1 242 3 OR . 1 1 44 44 LEU MD2 H . . . 1 1 36 36 LEU MD1 H . . . . . 4.0 1.8 9.0 . . . . . A . 44 LEU MD2 . . A . 36 LEU MD1 . . . 44 . HD# . . . . . 36 . HD# . . rr_1a7i 1 242 4 OR . 1 1 36 36 LEU MD2 H . . . 1 1 44 44 LEU MD2 H . . . . . 4.0 1.8 9.0 . . . . . A . 36 LEU MD2 . . A . 44 LEU MD2 . . . 36 . HD# . . . . . 44 . HD# . . rr_1a7i 1 243 1 OR . 1 1 36 36 LEU H H . . . 1 1 56 56 VAL MG1 H . . . . . 4.0 1.8 9.0 . . . . . A . 36 LEU H . . A . 56 VAL MG1 . . . 36 . HN . . . . . 56 . HG# . . rr_1a7i 1 243 2 OR . 1 1 56 56 VAL MG2 H . . . 1 1 36 36 LEU H H . . . . . 4.0 1.8 9.0 . . . . . A . 56 VAL MG2 . . A . 36 LEU H . . . 56 . HG# . . . . . 36 . HN . . rr_1a7i 1 244 1 OR . 1 1 37 37 CYS H H . . . 1 1 37 37 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 37 CYS H . . A . 37 CYS HB2 . . . 37 . HN . . . . . 37 . HB# . . rr_1a7i 1 244 2 OR . 1 1 37 37 CYS H H . . . 1 1 37 37 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 37 CYS H . . A . 37 CYS HB3 . . . 37 . HN . . . . . 37 . HB# . . rr_1a7i 1 245 1 . . 1 1 37 37 CYS H H . . . 1 1 38 38 MET H H . . . . . 4.0 1.8 5.0 . . . . . A . 37 CYS H . . A . 38 MET H . . . 37 . HN . . . . . 38 . HN . . rr_1a7i 1 246 1 . . 1 1 38 38 MET H H . . . 1 1 37 37 CYS HA H . . . . . 3.0 1.8 3.3 . . . . . A . 38 MET H . . A . 37 CYS HA . . . 38 . HN . . . . . 37 . HA . . rr_1a7i 1 247 1 . . 1 1 37 37 CYS HA H . . . 1 1 39 39 VAL H H . . . . . 3.0 1.8 3.3 . . . . . A . 37 CYS HA . . A . 39 VAL H . . . 37 . HA . . . . . 39 . HN . . rr_1a7i 1 248 1 OR . 1 1 39 39 VAL H H . . . 1 1 37 37 CYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 39 VAL H . . A . 37 CYS HB2 . . . 39 . HN . . . . . 37 . HB# . . rr_1a7i 1 248 2 OR . 1 1 37 37 CYS HB3 H . . . 1 1 39 39 VAL H H . . . . . 4.0 1.8 5.0 . . . . . A . 37 CYS HB3 . . A . 39 VAL H . . . 37 . HB# . . . . . 39 . HN . . rr_1a7i 1 249 1 . . 1 1 37 37 CYS H H . . . 1 1 41 41 ARG HA H . . . . . 4.0 1.8 5.0 . . . . . A . 37 CYS H . . A . 41 ARG HA . . . 37 . HN . . . . . 41 . HA . . rr_1a7i 1 250 1 OR . 1 1 42 42 LYS H H . . . 1 1 37 37 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 42 LYS H . . A . 37 CYS HB2 . . . 42 . HN . . . . . 37 . HB# . . rr_1a7i 1 250 2 OR . 1 1 37 37 CYS HB3 H . . . 1 1 42 42 LYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 37 CYS HB3 . . A . 42 LYS H . . . 37 . HB# . . . . . 42 . HN . . rr_1a7i 1 251 1 . . 1 1 44 44 LEU H H . . . 1 1 37 37 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 44 LEU H . . A . 37 CYS H . . . 44 . HN . . . . . 37 . HN . . rr_1a7i 1 252 1 OR . 1 1 37 37 CYS H H . . . 1 1 44 44 LEU HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 37 CYS H . . A . 44 LEU HB2 . . . 37 . HN . . . . . 44 . HB# . . rr_1a7i 1 252 2 OR . 1 1 37 37 CYS H H . . . 1 1 44 44 LEU HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 37 CYS H . . A . 44 LEU HB3 . . . 37 . HN . . . . . 44 . HB# . . rr_1a7i 1 253 1 OR . 1 1 37 37 CYS H H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 37 CYS H . . A . 44 LEU MD1 . . . 37 . HN . . . . . 44 . HD# . . rr_1a7i 1 253 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 37 37 CYS H H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU MD2 . . A . 37 CYS H . . . 44 . HD# . . . . . 37 . HN . . rr_1a7i 1 254 1 OR . 1 1 37 37 CYS HA H . . . 1 1 44 44 LEU MD1 H . . . . . 3.0 1.8 4.8 . . . . . A . 37 CYS HA . . A . 44 LEU MD1 . . . 37 . HA . . . . . 44 . HD# . . rr_1a7i 1 254 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 37 37 CYS HA H . . . . . 3.0 1.8 4.8 . . . . . A . 44 LEU MD2 . . A . 37 CYS HA . . . 44 . HD# . . . . . 37 . HA . . rr_1a7i 1 255 1 OR . 1 1 37 37 CYS HB3 H . . . 1 1 44 44 LEU MD1 H . . . . . 3.0 1.8 4.8 . . . . . A . 37 CYS HB3 . . A . 44 LEU MD1 . . . 37 . HB# . . . . . 44 . HD# . . rr_1a7i 1 255 2 OR . 1 1 37 37 CYS HB2 H . . . 1 1 44 44 LEU MD1 H . . . . . 3.0 1.8 4.8 . . . . . A . 37 CYS HB2 . . A . 44 LEU MD1 . . . 37 . HB# . . . . . 44 . HD# . . rr_1a7i 1 255 3 OR . 1 1 44 44 LEU MD2 H . . . 1 1 37 37 CYS HB2 H . . . . . 3.0 1.8 4.8 . . . . . A . 44 LEU MD2 . . A . 37 CYS HB2 . . . 44 . HD# . . . . . 37 . HB# . . rr_1a7i 1 255 4 OR . 1 1 44 44 LEU MD2 H . . . 1 1 37 37 CYS HB3 H . . . . . 3.0 1.8 4.8 . . . . . A . 44 LEU MD2 . . A . 37 CYS HB3 . . . 44 . HD# . . . . . 37 . HB# . . rr_1a7i 1 256 1 . . 1 1 37 37 CYS H H . . . 1 1 58 58 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 37 CYS H . . A . 58 CYS HB2 . . . 37 . HN . . . . . 58 . HB2 . . rr_1a7i 1 257 1 . . 1 1 37 37 CYS HA H . . . 1 1 58 58 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 37 CYS HA . . A . 58 CYS H . . . 37 . HA . . . . . 58 . HN . . rr_1a7i 1 258 1 OR . 1 1 58 58 CYS H H . . . 1 1 37 37 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 58 CYS H . . A . 37 CYS HB2 . . . 58 . HN . . . . . 37 . HB# . . rr_1a7i 1 258 2 OR . 1 1 37 37 CYS HB3 H . . . 1 1 58 58 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 37 CYS HB3 . . A . 58 CYS H . . . 37 . HB# . . . . . 58 . HN . . rr_1a7i 1 259 1 OR . 1 1 38 38 MET H H . . . 1 1 38 38 MET HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 38 MET H . . A . 38 MET HB2 . . . 38 . HN . . . . . 38 . HB# . . rr_1a7i 1 259 2 OR . 1 1 38 38 MET H H . . . 1 1 38 38 MET HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 38 MET H . . A . 38 MET HB3 . . . 38 . HN . . . . . 38 . HB# . . rr_1a7i 1 260 1 OR . 1 1 38 38 MET H H . . . 1 1 38 38 MET HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 38 MET H . . A . 38 MET HG2 . . . 38 . HN . . . . . 38 . HG# . . rr_1a7i 1 260 2 OR . 1 1 38 38 MET H H . . . 1 1 38 38 MET HG3 H . . . . . 4.0 1.8 5.0 . . . . . A . 38 MET H . . A . 38 MET HG3 . . . 38 . HN . . . . . 38 . HG# . . rr_1a7i 1 261 1 OR . 1 1 39 39 VAL H H . . . 1 1 38 38 MET HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 39 VAL H . . A . 38 MET HB2 . . . 39 . HN . . . . . 38 . HB# . . rr_1a7i 1 261 2 OR . 1 1 39 39 VAL H H . . . 1 1 38 38 MET HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 39 VAL H . . A . 38 MET HB3 . . . 39 . HN . . . . . 38 . HB# . . rr_1a7i 1 262 1 OR . 1 1 38 38 MET H H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 38 MET H . . A . 44 LEU MD1 . . . 38 . HN . . . . . 44 . HD# . . rr_1a7i 1 262 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 38 38 MET H H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU MD2 . . A . 38 MET H . . . 44 . HD# . . . . . 38 . HN . . rr_1a7i 1 263 1 . . 1 1 38 38 MET H H . . . 1 1 57 57 TYR HA H . . . . . 4.0 1.8 5.0 . . . . . A . 38 MET H . . A . 57 TYR HA . . . 38 . HN . . . . . 57 . HA . . rr_1a7i 1 264 1 . . 1 1 39 39 VAL H H . . . 1 1 39 39 VAL HA H . . . . . 3.0 1.8 3.3 . . . . . A . 39 VAL H . . A . 39 VAL HA . . . 39 . HN . . . . . 39 . HA . . rr_1a7i 1 265 1 . . 1 1 39 39 VAL H H . . . 1 1 39 39 VAL HB H . . . . . 3.0 1.8 3.3 . . . . . A . 39 VAL H . . A . 39 VAL HB . . . 39 . HN . . . . . 39 . HB . . rr_1a7i 1 266 1 . . 1 1 39 39 VAL H H . . . 1 1 39 39 VAL MG1 H . . . . . 4.0 1.8 5.0 . . . . . A . 39 VAL H . . A . 39 VAL MG1 . . . 39 . HN . . . . . 39 . HG1# . . rr_1a7i 1 267 1 . . 1 1 39 39 VAL H H . . . 1 1 39 39 VAL MG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 39 VAL H . . A . 39 VAL MG2 . . . 39 . HN . . . . . 39 . HG2# . . rr_1a7i 1 268 1 . . 1 1 39 39 VAL HA H . . . 1 1 39 39 VAL MG1 H . . . . . 3.0 1.8 3.3 . . . . . A . 39 VAL HA . . A . 39 VAL MG1 . . . 39 . HA . . . . . 39 . HG1# . . rr_1a7i 1 269 1 . . 1 1 39 39 VAL HA H . . . 1 1 39 39 VAL MG2 H . . . . . 3.0 1.8 3.3 . . . . . A . 39 VAL HA . . A . 39 VAL MG2 . . . 39 . HA . . . . . 39 . HG2# . . rr_1a7i 1 270 1 . . 1 1 39 39 VAL H H . . . 1 1 40 40 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 39 VAL H . . A . 40 CYS H . . . 39 . HN . . . . . 40 . HN . . rr_1a7i 1 271 1 . . 1 1 39 39 VAL HA H . . . 1 1 40 40 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 39 VAL HA . . A . 40 CYS H . . . 39 . HA . . . . . 40 . HN . . rr_1a7i 1 272 1 . . 1 1 39 39 VAL HB H . . . 1 1 40 40 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 39 VAL HB . . A . 40 CYS H . . . 39 . HB . . . . . 40 . HN . . rr_1a7i 1 273 1 . . 1 1 39 39 VAL MG1 H . . . 1 1 40 40 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 39 VAL MG1 . . A . 40 CYS H . . . 39 . HG1# . . . . . 40 . HN . . rr_1a7i 1 274 1 . . 1 1 39 39 VAL MG2 H . . . 1 1 40 40 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 39 VAL MG2 . . A . 40 CYS H . . . 39 . HG2# . . . . . 40 . HN . . rr_1a7i 1 275 1 . . 1 1 41 41 ARG H H . . . 1 1 39 39 VAL H H . . . . . 4.0 1.8 5.0 . . . . . A . 41 ARG H . . A . 39 VAL H . . . 41 . HN . . . . . 39 . HN . . rr_1a7i 1 276 1 . . 1 1 41 41 ARG H H . . . 1 1 39 39 VAL MG1 H . . . . . 4.0 1.8 6.0 . . . . . A . 41 ARG H . . A . 39 VAL MG1 . . . 41 . HN . . . . . 39 . HG1# . . rr_1a7i 1 277 1 . . 1 1 41 41 ARG H H . . . 1 1 39 39 VAL MG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 41 ARG H . . A . 39 VAL MG2 . . . 41 . HN . . . . . 39 . HG2# . . rr_1a7i 1 278 1 . . 1 1 39 39 VAL H H . . . 1 1 57 57 TYR QD H . . . . . 4.0 1.8 7.2 . . . . . A . 39 VAL H . . A . 57 TYR QD . . . 39 . HN . . . . . 57 . HD# . . rr_1a7i 1 279 1 . . 1 1 39 39 VAL MG2 H . . . 1 1 57 57 TYR QD H . . . . . 3.0 1.8 5.5 . . . . . A . 39 VAL MG2 . . A . 57 TYR QD . . . 39 . HG2# . . . . . 57 . HD# . . rr_1a7i 1 280 1 . . 1 1 39 39 VAL MG2 H . . . 1 1 57 57 TYR QE H . . . . . 3.0 1.8 5.5 . . . . . A . 39 VAL MG2 . . A . 57 TYR QE . . . 39 . HG2# . . . . . 57 . HE# . . rr_1a7i 1 281 1 . . 1 1 39 39 VAL H H . . . 1 1 58 58 CYS H H . . . . . 4.0 1.8 6.0 . . . . . A . 39 VAL H . . A . 58 CYS H . . . 39 . HN . . . . . 58 . HN . . rr_1a7i 1 282 1 . . 1 1 40 40 CYS H H . . . 1 1 40 40 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 40 CYS H . . A . 40 CYS HB3 . . . 40 . HN . . . . . 40 . HB1 . . rr_1a7i 1 283 1 . . 1 1 40 40 CYS H H . . . 1 1 40 40 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 40 CYS H . . A . 40 CYS HB2 . . . 40 . HN . . . . . 40 . HB2 . . rr_1a7i 1 284 1 . . 1 1 41 41 ARG H H . . . 1 1 40 40 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 41 ARG H . . A . 40 CYS H . . . 41 . HN . . . . . 40 . HN . . rr_1a7i 1 285 1 . . 1 1 41 41 ARG H H . . . 1 1 40 40 CYS HA H . . . . . 4.0 1.8 5.0 . . . . . A . 41 ARG H . . A . 40 CYS HA . . . 41 . HN . . . . . 40 . HA . . rr_1a7i 1 286 1 . . 1 1 41 41 ARG H H . . . 1 1 40 40 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 41 ARG H . . A . 40 CYS HB3 . . . 41 . HN . . . . . 40 . HB1 . . rr_1a7i 1 287 1 . . 1 1 42 42 LYS H H . . . 1 1 40 40 CYS H H . . . . . 4.0 1.8 6.0 . . . . . A . 42 LYS H . . A . 40 CYS H . . . 42 . HN . . . . . 40 . HN . . rr_1a7i 1 288 1 . . 1 1 40 40 CYS H H . . . 1 1 61 61 CYS H H . . . . . 4.0 1.8 6.0 . . . . . A . 40 CYS H . . A . 61 CYS H . . . 40 . HN . . . . . 61 . HN . . rr_1a7i 1 289 1 . . 1 1 41 41 ARG H H . . . 1 1 41 41 ARG HA H . . . . . 2.5 1.8 2.7 . . . . . A . 41 ARG H . . A . 41 ARG HA . . . 41 . HN . . . . . 41 . HA . . rr_1a7i 1 290 1 OR . 1 1 41 41 ARG H H . . . 1 1 41 41 ARG HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 41 ARG H . . A . 41 ARG HB2 . . . 41 . HN . . . . . 41 . HB# . . rr_1a7i 1 290 2 OR . 1 1 41 41 ARG H H . . . 1 1 41 41 ARG HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 41 ARG H . . A . 41 ARG HB3 . . . 41 . HN . . . . . 41 . HB# . . rr_1a7i 1 291 1 OR . 1 1 41 41 ARG H H . . . 1 1 41 41 ARG HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 41 ARG H . . A . 41 ARG HG2 . . . 41 . HN . . . . . 41 . HG# . . rr_1a7i 1 291 2 OR . 1 1 41 41 ARG H H . . . 1 1 41 41 ARG HG3 H . . . . . 4.0 1.8 5.0 . . . . . A . 41 ARG H . . A . 41 ARG HG3 . . . 41 . HN . . . . . 41 . HG# . . rr_1a7i 1 292 1 OR . 1 1 41 41 ARG H H . . . 1 1 41 41 ARG HD2 H . . . . . 4.0 1.8 5.0 . . . . . A . 41 ARG H . . A . 41 ARG HD2 . . . 41 . HN . . . . . 41 . HD# . . rr_1a7i 1 292 2 OR . 1 1 41 41 ARG H H . . . 1 1 41 41 ARG HD3 H . . . . . 4.0 1.8 5.0 . . . . . A . 41 ARG H . . A . 41 ARG HD3 . . . 41 . HN . . . . . 41 . HD# . . rr_1a7i 1 293 1 . . 1 1 41 41 ARG H H . . . 1 1 42 42 LYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 41 ARG H . . A . 42 LYS H . . . 41 . HN . . . . . 42 . HN . . rr_1a7i 1 294 1 . . 1 1 41 41 ARG H H . . . 1 1 58 58 CYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 41 ARG H . . A . 58 CYS HB2 . . . 41 . HN . . . . . 58 . HB2 . . rr_1a7i 1 295 1 . . 1 1 42 42 LYS H H . . . 1 1 42 42 LYS HA H . . . . . 3.0 1.8 3.3 . . . . . A . 42 LYS H . . A . 42 LYS HA . . . 42 . HN . . . . . 42 . HA . . rr_1a7i 1 296 1 OR . 1 1 42 42 LYS H H . . . 1 1 42 42 LYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 42 LYS H . . A . 42 LYS HB2 . . . 42 . HN . . . . . 42 . HB# . . rr_1a7i 1 296 2 OR . 1 1 42 42 LYS H H . . . 1 1 42 42 LYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 42 LYS H . . A . 42 LYS HB3 . . . 42 . HN . . . . . 42 . HB# . . rr_1a7i 1 297 1 OR . 1 1 42 42 LYS H H . . . 1 1 42 42 LYS HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 42 LYS H . . A . 42 LYS HG2 . . . 42 . HN . . . . . 42 . HG# . . rr_1a7i 1 297 2 OR . 1 1 42 42 LYS H H . . . 1 1 42 42 LYS HG3 H . . . . . 4.0 1.8 5.0 . . . . . A . 42 LYS H . . A . 42 LYS HG3 . . . 42 . HN . . . . . 42 . HG# . . rr_1a7i 1 298 1 OR . 1 1 42 42 LYS H H . . . 1 1 42 42 LYS HD2 H . . . . . 3.0 1.8 3.3 . . . . . A . 42 LYS H . . A . 42 LYS HD2 . . . 42 . HN . . . . . 42 . HD# . . rr_1a7i 1 298 2 OR . 1 1 42 42 LYS H H . . . 1 1 42 42 LYS HD3 H . . . . . 3.0 1.8 3.3 . . . . . A . 42 LYS H . . A . 42 LYS HD3 . . . 42 . HN . . . . . 42 . HD# . . rr_1a7i 1 299 1 . . 1 1 42 42 LYS HA H . . . 1 1 43 43 ASN H H . . . . . 2.5 1.8 2.7 . . . . . A . 42 LYS HA . . A . 43 ASN H . . . 42 . HA . . . . . 43 . HN . . rr_1a7i 1 300 1 OR . 1 1 43 43 ASN H H . . . 1 1 42 42 LYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 43 ASN H . . A . 42 LYS HB2 . . . 43 . HN . . . . . 42 . HB# . . rr_1a7i 1 300 2 OR . 1 1 42 42 LYS HB3 H . . . 1 1 43 43 ASN H H . . . . . 4.0 1.8 5.0 . . . . . A . 42 LYS HB3 . . A . 43 ASN H . . . 42 . HB# . . . . . 43 . HN . . rr_1a7i 1 301 1 OR . 1 1 43 43 ASN H H . . . 1 1 42 42 LYS HG2 H . . . . . 3.0 1.8 3.3 . . . . . A . 43 ASN H . . A . 42 LYS HG2 . . . 43 . HN . . . . . 42 . HG# . . rr_1a7i 1 301 2 OR . 1 1 42 42 LYS HG3 H . . . 1 1 43 43 ASN H H . . . . . 3.0 1.8 3.3 . . . . . A . 42 LYS HG3 . . A . 43 ASN H . . . 42 . HG# . . . . . 43 . HN . . rr_1a7i 1 302 1 OR . 1 1 43 43 ASN H H . . . 1 1 42 42 LYS HD2 H . . . . . 4.0 1.8 5.0 . . . . . A . 43 ASN H . . A . 42 LYS HD2 . . . 43 . HN . . . . . 42 . HD# . . rr_1a7i 1 302 2 OR . 1 1 42 42 LYS HD3 H . . . 1 1 43 43 ASN H H . . . . . 4.0 1.8 5.0 . . . . . A . 42 LYS HD3 . . A . 43 ASN H . . . 42 . HD# . . . . . 43 . HN . . rr_1a7i 1 303 1 . . 1 1 42 42 LYS H H . . . 1 1 58 58 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 42 LYS H . . A . 58 CYS HB2 . . . 42 . HN . . . . . 58 . HB2 . . rr_1a7i 1 304 1 OR . 1 1 43 43 ASN H H . . . 1 1 43 43 ASN HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 43 ASN H . . A . 43 ASN HB2 . . . 43 . HN . . . . . 43 . HB# . . rr_1a7i 1 304 2 OR . 1 1 43 43 ASN H H . . . 1 1 43 43 ASN HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 43 ASN H . . A . 43 ASN HB3 . . . 43 . HN . . . . . 43 . HB# . . rr_1a7i 1 305 1 . . 1 1 44 44 LEU H H . . . 1 1 43 43 ASN HA H . . . . . 2.5 1.8 2.7 . . . . . A . 44 LEU H . . A . 43 ASN HA . . . 44 . HN . . . . . 43 . HA . . rr_1a7i 1 306 1 OR . 1 1 44 44 LEU H H . . . 1 1 43 43 ASN HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 44 LEU H . . A . 43 ASN HB2 . . . 44 . HN . . . . . 43 . HB# . . rr_1a7i 1 306 2 OR . 1 1 44 44 LEU H H . . . 1 1 43 43 ASN HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 44 LEU H . . A . 43 ASN HB3 . . . 44 . HN . . . . . 43 . HB# . . rr_1a7i 1 307 1 OR . 1 1 44 44 LEU H H . . . 1 1 44 44 LEU HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 44 LEU H . . A . 44 LEU HB2 . . . 44 . HN . . . . . 44 . HB# . . rr_1a7i 1 307 2 OR . 1 1 44 44 LEU H H . . . 1 1 44 44 LEU HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 44 LEU H . . A . 44 LEU HB3 . . . 44 . HN . . . . . 44 . HB# . . rr_1a7i 1 308 1 OR . 1 1 44 44 LEU H H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU H . . A . 44 LEU MD1 . . . 44 . HN . . . . . 44 . HD# . . rr_1a7i 1 308 2 OR . 1 1 44 44 LEU H H . . . 1 1 44 44 LEU MD2 H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU H . . A . 44 LEU MD2 . . . 44 . HN . . . . . 44 . HD# . . rr_1a7i 1 309 1 . . 1 1 44 44 LEU HA H . . . 1 1 45 45 ASP H H . . . . . 3.0 1.8 3.3 . . . . . A . 44 LEU HA . . A . 45 ASP H . . . 44 . HA . . . . . 45 . HN . . rr_1a7i 1 310 1 OR . 1 1 45 45 ASP H H . . . 1 1 44 44 LEU HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 45 ASP H . . A . 44 LEU HB2 . . . 45 . HN . . . . . 44 . HB# . . rr_1a7i 1 310 2 OR . 1 1 44 44 LEU HB3 H . . . 1 1 45 45 ASP H H . . . . . 4.0 1.8 5.0 . . . . . A . 44 LEU HB3 . . A . 45 ASP H . . . 44 . HB# . . . . . 45 . HN . . rr_1a7i 1 311 1 OR . 1 1 45 45 ASP H H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 45 ASP H . . A . 44 LEU MD1 . . . 45 . HN . . . . . 44 . HD# . . rr_1a7i 1 311 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 45 45 ASP H H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU MD2 . . A . 45 ASP H . . . 44 . HD# . . . . . 45 . HN . . rr_1a7i 1 312 1 OR . 1 1 49 49 VAL H H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 49 VAL H . . A . 44 LEU MD1 . . . 49 . HN . . . . . 44 . HD# . . rr_1a7i 1 312 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 49 49 VAL H H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU MD2 . . A . 49 VAL H . . . 44 . HD# . . . . . 49 . HN . . rr_1a7i 1 313 1 OR . 1 1 49 49 VAL HB H . . . 1 1 44 44 LEU MD1 H . . . . . 3.0 1.8 4.8 . . . . . A . 49 VAL HB . . A . 44 LEU MD1 . . . 49 . HB . . . . . 44 . HD# . . rr_1a7i 1 313 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 49 49 VAL HB H . . . . . 3.0 1.8 4.8 . . . . . A . 44 LEU MD2 . . A . 49 VAL HB . . . 44 . HD# . . . . . 49 . HB . . rr_1a7i 1 314 1 OR . 1 1 49 49 VAL MG1 H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 49 VAL MG1 . . A . 44 LEU MD1 . . . 49 . HG1# . . . . . 44 . HD# . . rr_1a7i 1 314 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 49 49 VAL MG1 H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU MD2 . . A . 49 VAL MG1 . . . 44 . HD# . . . . . 49 . HG1# . . rr_1a7i 1 315 1 OR . 1 1 44 44 LEU MD2 H . . . 1 1 49 49 VAL MG2 H . . . . . 4.0 1.8 5.5 . . . . . A . 44 LEU MD2 . . A . 49 VAL MG2 . . . 44 . HD# . . . . . 49 . HG2# . . rr_1a7i 1 315 2 OR . 1 1 44 44 LEU MD1 H . . . 1 1 49 49 VAL MG2 H . . . . . 4.0 1.8 5.5 . . . . . A . 44 LEU MD1 . . A . 49 VAL MG2 . . . 44 . HD# . . . . . 49 . HG2# . . rr_1a7i 1 316 1 OR . 1 1 44 44 LEU MD2 H . . . 1 1 49 49 VAL MG2 H . . . . . 4.0 1.8 8.0 . . . . . A . 44 LEU MD2 . . A . 49 VAL MG2 . . . 44 . HD# . . . . . 49 . HG# . . rr_1a7i 1 316 2 OR . 1 1 44 44 LEU MD1 H . . . 1 1 49 49 VAL MG2 H . . . . . 4.0 1.8 8.0 . . . . . A . 44 LEU MD1 . . A . 49 VAL MG2 . . . 44 . HD# . . . . . 49 . HG# . . rr_1a7i 1 316 3 OR . 1 1 49 49 VAL MG1 H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 8.0 . . . . . A . 49 VAL MG1 . . A . 44 LEU MD1 . . . 49 . HG# . . . . . 44 . HD# . . rr_1a7i 1 316 4 OR . 1 1 44 44 LEU MD2 H . . . 1 1 49 49 VAL MG1 H . . . . . 4.0 1.8 8.0 . . . . . A . 44 LEU MD2 . . A . 49 VAL MG1 . . . 44 . HD# . . . . . 49 . HG# . . rr_1a7i 1 317 1 OR . 1 1 50 50 ALA H H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 50 ALA H . . A . 44 LEU MD1 . . . 50 . HN . . . . . 44 . HD# . . rr_1a7i 1 317 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 50 50 ALA H H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU MD2 . . A . 50 ALA H . . . 44 . HD# . . . . . 50 . HN . . rr_1a7i 1 318 1 OR . 1 1 56 56 VAL HB H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 56 VAL HB . . A . 44 LEU MD1 . . . 56 . HB . . . . . 44 . HD# . . rr_1a7i 1 318 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 56 56 VAL HB H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU MD2 . . A . 56 VAL HB . . . 44 . HD# . . . . . 56 . HB . . rr_1a7i 1 319 1 OR . 1 1 44 44 LEU MD2 H . . . 1 1 56 56 VAL MG1 H . . . . . 4.0 1.8 8.0 . . . . . A . 44 LEU MD2 . . A . 56 VAL MG1 . . . 44 . HD# . . . . . 56 . HG# . . rr_1a7i 1 319 2 OR . 1 1 44 44 LEU MD1 H . . . 1 1 56 56 VAL MG1 H . . . . . 4.0 1.8 8.0 . . . . . A . 44 LEU MD1 . . A . 56 VAL MG1 . . . 44 . HD# . . . . . 56 . HG# . . rr_1a7i 1 319 3 OR . 1 1 56 56 VAL MG2 H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 8.0 . . . . . A . 56 VAL MG2 . . A . 44 LEU MD1 . . . 56 . HG# . . . . . 44 . HD# . . rr_1a7i 1 319 4 OR . 1 1 56 56 VAL MG2 H . . . 1 1 44 44 LEU MD2 H . . . . . 4.0 1.8 8.0 . . . . . A . 56 VAL MG2 . . A . 44 LEU MD2 . . . 56 . HG# . . . . . 44 . HD# . . rr_1a7i 1 320 1 OR . 1 1 57 57 TYR HA H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 57 TYR HA . . A . 44 LEU MD1 . . . 57 . HA . . . . . 44 . HD# . . rr_1a7i 1 320 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 57 57 TYR HA H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU MD2 . . A . 57 TYR HA . . . 44 . HD# . . . . . 57 . HA . . rr_1a7i 1 321 1 OR . 1 1 58 58 CYS H H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 58 CYS H . . A . 44 LEU MD1 . . . 58 . HN . . . . . 44 . HD# . . rr_1a7i 1 321 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 58 58 CYS H H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU MD2 . . A . 58 CYS H . . . 44 . HD# . . . . . 58 . HN . . rr_1a7i 1 322 1 OR . 1 1 58 58 CYS HA H . . . 1 1 44 44 LEU MD1 H . . . . . 3.0 1.8 4.8 . . . . . A . 58 CYS HA . . A . 44 LEU MD1 . . . 58 . HA . . . . . 44 . HD# . . rr_1a7i 1 322 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 58 58 CYS HA H . . . . . 3.0 1.8 4.8 . . . . . A . 44 LEU MD2 . . A . 58 CYS HA . . . 44 . HD# . . . . . 58 . HA . . rr_1a7i 1 323 1 OR . 1 1 58 58 CYS HB2 H . . . 1 1 44 44 LEU MD1 H . . . . . 4.0 1.8 6.5 . . . . . A . 58 CYS HB2 . . A . 44 LEU MD1 . . . 58 . HB2 . . . . . 44 . HD# . . rr_1a7i 1 323 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 58 58 CYS HB2 H . . . . . 4.0 1.8 6.5 . . . . . A . 44 LEU MD2 . . A . 58 CYS HB2 . . . 44 . HD# . . . . . 58 . HB2 . . rr_1a7i 1 324 1 OR . 1 1 45 45 ASP H H . . . 1 1 45 45 ASP HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 45 ASP H . . A . 45 ASP HB2 . . . 45 . HN . . . . . 45 . HB# . . rr_1a7i 1 324 2 OR . 1 1 45 45 ASP H H . . . 1 1 45 45 ASP HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 45 ASP H . . A . 45 ASP HB3 . . . 45 . HN . . . . . 45 . HB# . . rr_1a7i 1 325 1 . . 1 1 49 49 VAL HB H . . . 1 1 45 45 ASP H H . . . . . 4.0 1.8 5.0 . . . . . A . 49 VAL HB . . A . 45 ASP H . . . 49 . HB . . . . . 45 . HN . . rr_1a7i 1 326 1 . . 1 1 47 47 THR H H . . . 1 1 47 47 THR MG H . . . . . 4.0 1.8 6.0 . . . . . A . 47 THR H . . A . 47 THR MG . . . 47 . HN . . . . . 47 . HG2# . . rr_1a7i 1 327 1 . . 1 1 47 47 THR H H . . . 1 1 48 48 THR H H . . . . . 4.0 1.8 5.0 . . . . . A . 47 THR H . . A . 48 THR H . . . 47 . HN . . . . . 48 . HN . . rr_1a7i 1 328 1 . . 1 1 48 48 THR H H . . . 1 1 48 48 THR HA H . . . . . 3.0 1.8 3.3 . . . . . A . 48 THR H . . A . 48 THR HA . . . 48 . HN . . . . . 48 . HA . . rr_1a7i 1 329 1 . . 1 1 48 48 THR H H . . . 1 1 48 48 THR MG H . . . . . 4.0 1.8 5.0 . . . . . A . 48 THR H . . A . 48 THR MG . . . 48 . HN . . . . . 48 . HG2# . . rr_1a7i 1 330 1 . . 1 1 49 49 VAL H H . . . 1 1 48 48 THR H H . . . . . 3.0 1.8 3.3 . . . . . A . 49 VAL H . . A . 48 THR H . . . 49 . HN . . . . . 48 . HN . . rr_1a7i 1 331 1 . . 1 1 49 49 VAL MG1 H . . . 1 1 48 48 THR H H . . . . . 4.0 1.8 6.0 . . . . . A . 49 VAL MG1 . . A . 48 THR H . . . 49 . HG1# . . . . . 48 . HN . . rr_1a7i 1 332 1 . . 1 1 49 49 VAL H H . . . 1 1 48 48 THR MG H . . . . . 4.0 1.8 6.0 . . . . . A . 49 VAL H . . A . 48 THR MG . . . 49 . HN . . . . . 48 . HG2# . . rr_1a7i 1 333 1 . . 1 1 49 49 VAL HB H . . . 1 1 49 49 VAL H H . . . . . 3.0 1.8 3.3 . . . . . A . 49 VAL HB . . A . 49 VAL H . . . 49 . HB . . . . . 49 . HN . . rr_1a7i 1 334 1 . . 1 1 49 49 VAL H H . . . 1 1 49 49 VAL MG1 H . . . . . 3.0 1.8 3.3 . . . . . A . 49 VAL H . . A . 49 VAL MG1 . . . 49 . HN . . . . . 49 . HG1# . . rr_1a7i 1 335 1 . . 1 1 49 49 VAL H H . . . 1 1 49 49 VAL MG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 49 VAL H . . A . 49 VAL MG2 . . . 49 . HN . . . . . 49 . HG2# . . rr_1a7i 1 336 1 . . 1 1 49 49 VAL MG1 H . . . 1 1 49 49 VAL HA H . . . . . 3.0 1.8 3.3 . . . . . A . 49 VAL MG1 . . A . 49 VAL HA . . . 49 . HG1# . . . . . 49 . HA . . rr_1a7i 1 337 1 . . 1 1 49 49 VAL HA H . . . 1 1 49 49 VAL MG2 H . . . . . 2.5 1.8 2.7 . . . . . A . 49 VAL HA . . A . 49 VAL MG2 . . . 49 . HA . . . . . 49 . HG2# . . rr_1a7i 1 338 1 . . 1 1 49 49 VAL H H . . . 1 1 50 50 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 49 VAL H . . A . 50 ALA H . . . 49 . HN . . . . . 50 . HN . . rr_1a7i 1 339 1 . . 1 1 50 50 ALA H H . . . 1 1 49 49 VAL HA H . . . . . 2.5 1.8 2.7 . . . . . A . 50 ALA H . . A . 49 VAL HA . . . 50 . HN . . . . . 49 . HA . . rr_1a7i 1 340 1 . . 1 1 49 49 VAL HB H . . . 1 1 50 50 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 49 VAL HB . . A . 50 ALA H . . . 49 . HB . . . . . 50 . HN . . rr_1a7i 1 341 1 . . 1 1 49 49 VAL MG1 H . . . 1 1 50 50 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 49 VAL MG1 . . A . 50 ALA H . . . 49 . HG1# . . . . . 50 . HN . . rr_1a7i 1 342 1 . . 1 1 50 50 ALA H H . . . 1 1 49 49 VAL MG2 H . . . . . 3.0 1.8 3.3 . . . . . A . 50 ALA H . . A . 49 VAL MG2 . . . 50 . HN . . . . . 49 . HG2# . . rr_1a7i 1 343 1 . . 1 1 50 50 ALA H H . . . 1 1 50 50 ALA MB H . . . . . 4.0 1.8 5.0 . . . . . A . 50 ALA H . . A . 50 ALA MB . . . 50 . HN . . . . . 50 . HB# . . rr_1a7i 1 344 1 . . 1 1 50 50 ALA MB H . . . 1 1 51 51 ILE H H . . . . . 4.0 1.8 5.0 . . . . . A . 50 ALA MB . . A . 51 ILE H . . . 50 . HB# . . . . . 51 . HN . . rr_1a7i 1 345 1 . . 1 1 50 50 ALA H H . . . 1 1 57 57 TYR H H . . . . . 4.0 1.8 5.0 . . . . . A . 50 ALA H . . A . 57 TYR H . . . 50 . HN . . . . . 57 . HN . . rr_1a7i 1 346 1 . . 1 1 50 50 ALA H H . . . 1 1 58 58 CYS HA H . . . . . 4.0 1.8 5.0 . . . . . A . 50 ALA H . . A . 58 CYS HA . . . 50 . HN . . . . . 58 . HA . . rr_1a7i 1 347 1 . . 1 1 50 50 ALA MB H . . . 1 1 62 62 TYR H H . . . . . 4.0 1.8 6.0 . . . . . A . 50 ALA MB . . A . 62 TYR H . . . 50 . HB# . . . . . 62 . HN . . rr_1a7i 1 348 1 . . 1 1 51 51 ILE H H . . . 1 1 51 51 ILE HB H . . . . . 3.0 1.8 3.3 . . . . . A . 51 ILE H . . A . 51 ILE HB . . . 51 . HN . . . . . 51 . HB . . rr_1a7i 1 349 1 . . 1 1 51 51 ILE H H . . . 1 1 51 51 ILE MG H . . . . . 4.0 1.8 5.0 . . . . . A . 51 ILE H . . A . 51 ILE MG . . . 51 . HN . . . . . 51 . HG2# . . rr_1a7i 1 350 1 . . 1 1 51 51 ILE MD H . . . 1 1 51 51 ILE H H . . . . . 4.0 1.8 5.0 . . . . . A . 51 ILE MD . . A . 51 ILE H . . . 51 . HD1# . . . . . 51 . HN . . rr_1a7i 1 351 1 OR . 1 1 51 51 ILE H H . . . 1 1 51 51 ILE HG12 H . . . . . 4.0 1.8 5.0 . . . . . A . 51 ILE H . . A . 51 ILE HG12 . . . 51 . HN . . . . . 51 . HG1# . . rr_1a7i 1 351 2 OR . 1 1 51 51 ILE H H . . . 1 1 51 51 ILE HG13 H . . . . . 4.0 1.8 5.0 . . . . . A . 51 ILE H . . A . 51 ILE HG13 . . . 51 . HN . . . . . 51 . HG1# . . rr_1a7i 1 352 1 . . 1 1 51 51 ILE MD H . . . 1 1 51 51 ILE HA H . . . . . 4.0 1.8 5.0 . . . . . A . 51 ILE MD . . A . 51 ILE HA . . . 51 . HD1# . . . . . 51 . HA . . rr_1a7i 1 353 1 . . 1 1 51 51 ILE HA H . . . 1 1 52 52 HIS H H . . . . . 2.5 1.8 2.7 . . . . . A . 51 ILE HA . . A . 52 HIS H . . . 51 . HA . . . . . 52 . HN . . rr_1a7i 1 354 1 . . 1 1 51 51 ILE HB H . . . 1 1 52 52 HIS H H . . . . . 4.0 1.8 5.0 . . . . . A . 51 ILE HB . . A . 52 HIS H . . . 51 . HB . . . . . 52 . HN . . rr_1a7i 1 355 1 . . 1 1 51 51 ILE MG H . . . 1 1 52 52 HIS H H . . . . . 4.0 1.8 6.0 . . . . . A . 51 ILE MG . . A . 52 HIS H . . . 51 . HG2# . . . . . 52 . HN . . rr_1a7i 1 356 1 . . 1 1 51 51 ILE MD H . . . 1 1 52 52 HIS H H . . . . . 4.0 1.8 5.0 . . . . . A . 51 ILE MD . . A . 52 HIS H . . . 51 . HD1# . . . . . 52 . HN . . rr_1a7i 1 357 1 . . 1 1 51 51 ILE MD H . . . 1 1 55 55 GLU H H . . . . . 4.0 1.8 6.0 . . . . . A . 51 ILE MD . . A . 55 GLU H . . . 51 . HD1# . . . . . 55 . HN . . rr_1a7i 1 358 1 . . 1 1 57 57 TYR H H . . . 1 1 51 51 ILE HA H . . . . . 4.0 1.8 5.0 . . . . . A . 57 TYR H . . A . 51 ILE HA . . . 57 . HN . . . . . 51 . HA . . rr_1a7i 1 359 1 OR . 1 1 52 52 HIS H H . . . 1 1 52 52 HIS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 52 HIS H . . A . 52 HIS HB2 . . . 52 . HN . . . . . 52 . HB# . . rr_1a7i 1 359 2 OR . 1 1 52 52 HIS H H . . . 1 1 52 52 HIS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 52 HIS H . . A . 52 HIS HB3 . . . 52 . HN . . . . . 52 . HB# . . rr_1a7i 1 360 1 . . 1 1 52 52 HIS H H . . . 1 1 55 55 GLU H H . . . . . 4.0 1.8 5.0 . . . . . A . 52 HIS H . . A . 55 GLU H . . . 52 . HN . . . . . 55 . HN . . rr_1a7i 1 361 1 OR . 1 1 52 52 HIS H H . . . 1 1 55 55 GLU HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 52 HIS H . . A . 55 GLU HB2 . . . 52 . HN . . . . . 55 . HB# . . rr_1a7i 1 361 2 OR . 1 1 52 52 HIS H H . . . 1 1 55 55 GLU HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 52 HIS H . . A . 55 GLU HB3 . . . 52 . HN . . . . . 55 . HB# . . rr_1a7i 1 362 1 . . 1 1 52 52 HIS H H . . . 1 1 56 56 VAL HA H . . . . . 4.0 1.8 5.0 . . . . . A . 52 HIS H . . A . 56 VAL HA . . . 52 . HN . . . . . 56 . HA . . rr_1a7i 1 363 1 . . 1 1 57 57 TYR QD H . . . 1 1 52 52 HIS H H . . . . . 4.0 1.8 7.2 . . . . . A . 57 TYR QD . . A . 52 HIS H . . . 57 . HD# . . . . . 52 . HN . . rr_1a7i 1 364 1 . . 1 1 57 57 TYR QE H . . . 1 1 52 52 HIS H H . . . . . 4.0 1.8 8.2 . . . . . A . 57 TYR QE . . A . 52 HIS H . . . 57 . HE# . . . . . 52 . HN . . rr_1a7i 1 365 1 . . 1 1 53 53 ASP HA H . . . 1 1 54 54 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 53 ASP HA . . A . 54 ALA H . . . 53 . HA . . . . . 54 . HN . . rr_1a7i 1 366 1 OR . 1 1 54 54 ALA H H . . . 1 1 53 53 ASP HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 54 ALA H . . A . 53 ASP HB2 . . . 54 . HN . . . . . 53 . HB# . . rr_1a7i 1 366 2 OR . 1 1 54 54 ALA H H . . . 1 1 53 53 ASP HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 54 ALA H . . A . 53 ASP HB3 . . . 54 . HN . . . . . 53 . HB# . . rr_1a7i 1 367 1 OR . 1 1 55 55 GLU H H . . . 1 1 53 53 ASP HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 55 GLU H . . A . 53 ASP HB2 . . . 55 . HN . . . . . 53 . HB# . . rr_1a7i 1 367 2 OR . 1 1 55 55 GLU H H . . . 1 1 53 53 ASP HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 55 GLU H . . A . 53 ASP HB3 . . . 55 . HN . . . . . 53 . HB# . . rr_1a7i 1 368 1 . . 1 1 54 54 ALA H H . . . 1 1 54 54 ALA HA H . . . . . 3.0 1.8 3.3 . . . . . A . 54 ALA H . . A . 54 ALA HA . . . 54 . HN . . . . . 54 . HA . . rr_1a7i 1 369 1 . . 1 1 54 54 ALA H H . . . 1 1 54 54 ALA MB H . . . . . 3.0 1.8 3.3 . . . . . A . 54 ALA H . . A . 54 ALA MB . . . 54 . HN . . . . . 54 . HB# . . rr_1a7i 1 370 1 . . 1 1 55 55 GLU H H . . . 1 1 54 54 ALA H H . . . . . 4.0 1.8 5.0 . . . . . A . 55 GLU H . . A . 54 ALA H . . . 55 . HN . . . . . 54 . HN . . rr_1a7i 1 371 1 . . 1 1 55 55 GLU H H . . . 1 1 54 54 ALA MB H . . . . . 4.0 1.8 6.0 . . . . . A . 55 GLU H . . A . 54 ALA MB . . . 55 . HN . . . . . 54 . HB# . . rr_1a7i 1 372 1 . . 1 1 55 55 GLU H H . . . 1 1 55 55 GLU HA H . . . . . 3.0 1.8 3.3 . . . . . A . 55 GLU H . . A . 55 GLU HA . . . 55 . HN . . . . . 55 . HA . . rr_1a7i 1 373 1 OR . 1 1 55 55 GLU H H . . . 1 1 55 55 GLU HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 55 GLU H . . A . 55 GLU HB2 . . . 55 . HN . . . . . 55 . HB# . . rr_1a7i 1 373 2 OR . 1 1 55 55 GLU H H . . . 1 1 55 55 GLU HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 55 GLU H . . A . 55 GLU HB3 . . . 55 . HN . . . . . 55 . HB# . . rr_1a7i 1 374 1 OR . 1 1 55 55 GLU H H . . . 1 1 55 55 GLU HG2 H . . . . . 3.0 1.8 4.8 . . . . . A . 55 GLU H . . A . 55 GLU HG2 . . . 55 . HN . . . . . 55 . HG# . . rr_1a7i 1 374 2 OR . 1 1 55 55 GLU H H . . . 1 1 55 55 GLU HG3 H . . . . . 3.0 1.8 4.8 . . . . . A . 55 GLU H . . A . 55 GLU HG3 . . . 55 . HN . . . . . 55 . HG# . . rr_1a7i 1 375 1 . . 1 1 55 55 GLU H H . . . 1 1 56 56 VAL H H . . . . . 4.0 1.8 6.0 . . . . . A . 55 GLU H . . A . 56 VAL H . . . 55 . HN . . . . . 56 . HN . . rr_1a7i 1 376 1 . . 1 1 55 55 GLU HA H . . . 1 1 56 56 VAL H H . . . . . 2.5 1.8 2.7 . . . . . A . 55 GLU HA . . A . 56 VAL H . . . 55 . HA . . . . . 56 . HN . . rr_1a7i 1 377 1 OR . 1 1 56 56 VAL H H . . . 1 1 55 55 GLU HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 56 VAL H . . A . 55 GLU HB2 . . . 56 . HN . . . . . 55 . HB# . . rr_1a7i 1 377 2 OR . 1 1 55 55 GLU HB3 H . . . 1 1 56 56 VAL H H . . . . . 4.0 1.8 5.0 . . . . . A . 55 GLU HB3 . . A . 56 VAL H . . . 55 . HB# . . . . . 56 . HN . . rr_1a7i 1 378 1 OR . 1 1 56 56 VAL H H . . . 1 1 55 55 GLU HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 56 VAL H . . A . 55 GLU HG2 . . . 56 . HN . . . . . 55 . HG# . . rr_1a7i 1 378 2 OR . 1 1 55 55 GLU HG3 H . . . 1 1 56 56 VAL H H . . . . . 4.0 1.8 5.0 . . . . . A . 55 GLU HG3 . . A . 56 VAL H . . . 55 . HG# . . . . . 56 . HN . . rr_1a7i 1 379 1 . . 1 1 57 57 TYR QE H . . . 1 1 55 55 GLU H H . . . . . 4.0 1.8 7.2 . . . . . A . 57 TYR QE . . A . 55 GLU H . . . 57 . HE# . . . . . 55 . HN . . rr_1a7i 1 380 1 OR . 1 1 57 57 TYR QE H . . . 1 1 55 55 GLU HB2 H . . . . . 3.0 1.8 5.5 . . . . . A . 57 TYR QE . . A . 55 GLU HB2 . . . 57 . HE# . . . . . 55 . HB# . . rr_1a7i 1 380 2 OR . 1 1 57 57 TYR QE H . . . 1 1 55 55 GLU HB3 H . . . . . 3.0 1.8 5.5 . . . . . A . 57 TYR QE . . A . 55 GLU HB3 . . . 57 . HE# . . . . . 55 . HB# . . rr_1a7i 1 381 1 OR . 1 1 57 57 TYR QE H . . . 1 1 55 55 GLU HG2 H . . . . . 3.0 1.8 5.5 . . . . . A . 57 TYR QE . . A . 55 GLU HG2 . . . 57 . HE# . . . . . 55 . HG# . . rr_1a7i 1 381 2 OR . 1 1 57 57 TYR QE H . . . 1 1 55 55 GLU HG3 H . . . . . 3.0 1.8 5.5 . . . . . A . 57 TYR QE . . A . 55 GLU HG3 . . . 57 . HE# . . . . . 55 . HG# . . rr_1a7i 1 382 1 . . 1 1 56 56 VAL HB H . . . 1 1 56 56 VAL H H . . . . . 3.0 1.8 3.3 . . . . . A . 56 VAL HB . . A . 56 VAL H . . . 56 . HB . . . . . 56 . HN . . rr_1a7i 1 383 1 OR . 1 1 56 56 VAL H H . . . 1 1 56 56 VAL MG1 H . . . . . 4.0 1.8 6.5 . . . . . A . 56 VAL H . . A . 56 VAL MG1 . . . 56 . HN . . . . . 56 . HG# . . rr_1a7i 1 383 2 OR . 1 1 56 56 VAL MG2 H . . . 1 1 56 56 VAL H H . . . . . 4.0 1.8 6.5 . . . . . A . 56 VAL MG2 . . A . 56 VAL H . . . 56 . HG# . . . . . 56 . HN . . rr_1a7i 1 384 1 OR . 1 1 56 56 VAL HA H . . . 1 1 56 56 VAL MG1 H . . . . . 3.0 1.8 4.8 . . . . . A . 56 VAL HA . . A . 56 VAL MG1 . . . 56 . HA . . . . . 56 . HG# . . rr_1a7i 1 384 2 OR . 1 1 56 56 VAL MG2 H . . . 1 1 56 56 VAL HA H . . . . . 3.0 1.8 4.8 . . . . . A . 56 VAL MG2 . . A . 56 VAL HA . . . 56 . HG# . . . . . 56 . HA . . rr_1a7i 1 385 1 . . 1 1 57 57 TYR H H . . . 1 1 56 56 VAL HA H . . . . . 2.5 1.8 2.7 . . . . . A . 57 TYR H . . A . 56 VAL HA . . . 57 . HN . . . . . 56 . HA . . rr_1a7i 1 386 1 OR . 1 1 57 57 TYR H H . . . 1 1 56 56 VAL MG1 H . . . . . 4.0 1.8 6.5 . . . . . A . 57 TYR H . . A . 56 VAL MG1 . . . 57 . HN . . . . . 56 . HG# . . rr_1a7i 1 386 2 OR . 1 1 56 56 VAL MG2 H . . . 1 1 57 57 TYR H H . . . . . 4.0 1.8 6.5 . . . . . A . 56 VAL MG2 . . A . 57 TYR H . . . 56 . HG# . . . . . 57 . HN . . rr_1a7i 1 387 1 OR . 1 1 59 59 LYS H H . . . 1 1 56 56 VAL MG1 H . . . . . 4.0 1.8 7.5 . . . . . A . 59 LYS H . . A . 56 VAL MG1 . . . 59 . HN . . . . . 56 . HG# . . rr_1a7i 1 387 2 OR . 1 1 56 56 VAL MG2 H . . . 1 1 59 59 LYS H H . . . . . 4.0 1.8 7.5 . . . . . A . 56 VAL MG2 . . A . 59 LYS H . . . 56 . HG# . . . . . 59 . HN . . rr_1a7i 1 388 1 . . 1 1 57 57 TYR H H . . . 1 1 57 57 TYR HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 57 TYR H . . A . 57 TYR HB3 . . . 57 . HN . . . . . 57 . HB1 . . rr_1a7i 1 389 1 . . 1 1 57 57 TYR H H . . . 1 1 57 57 TYR HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 57 TYR H . . A . 57 TYR HB2 . . . 57 . HN . . . . . 57 . HB2 . . rr_1a7i 1 390 1 . . 1 1 57 57 TYR QD H . . . 1 1 57 57 TYR H H . . . . . 4.0 1.8 7.2 . . . . . A . 57 TYR QD . . A . 57 TYR H . . . 57 . HD# . . . . . 57 . HN . . rr_1a7i 1 391 1 . . 1 1 57 57 TYR HA H . . . 1 1 57 57 TYR QD H . . . . . 3.0 1.8 5.5 . . . . . A . 57 TYR HA . . A . 57 TYR QD . . . 57 . HA . . . . . 57 . HD# . . rr_1a7i 1 392 1 . . 1 1 58 58 CYS H H . . . 1 1 57 57 TYR HA H . . . . . 3.0 1.8 3.3 . . . . . A . 58 CYS H . . A . 57 TYR HA . . . 58 . HN . . . . . 57 . HA . . rr_1a7i 1 393 1 . . 1 1 58 58 CYS H H . . . 1 1 57 57 TYR HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 58 CYS H . . A . 57 TYR HB3 . . . 58 . HN . . . . . 57 . HB1 . . rr_1a7i 1 394 1 . . 1 1 58 58 CYS H H . . . 1 1 57 57 TYR QD H . . . . . 4.0 1.8 7.2 . . . . . A . 58 CYS H . . A . 57 TYR QD . . . 58 . HN . . . . . 57 . HD# . . rr_1a7i 1 395 1 . . 1 1 62 62 TYR H H . . . 1 1 57 57 TYR HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 62 TYR H . . A . 57 TYR HB3 . . . 62 . HN . . . . . 57 . HB1 . . rr_1a7i 1 396 1 . . 1 1 57 57 TYR QD H . . . 1 1 62 62 TYR H H . . . . . 4.0 1.8 7.2 . . . . . A . 57 TYR QD . . A . 62 TYR H . . . 57 . HD# . . . . . 62 . HN . . rr_1a7i 1 397 1 . . 1 1 57 57 TYR QE H . . . 1 1 66 66 TYR QE H . . . . . 3.0 1.8 5.5 . . . . . A . 57 TYR QE . . A . 66 TYR QE . . . 57 . HE# . . . . . 66 . HE# . . rr_1a7i 1 398 1 . . 1 1 58 58 CYS H H . . . 1 1 58 58 CYS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 58 CYS H . . A . 58 CYS HB3 . . . 58 . HN . . . . . 58 . HB1 . . rr_1a7i 1 399 1 . . 1 1 58 58 CYS HB2 H . . . 1 1 58 58 CYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 58 CYS HB2 . . A . 58 CYS H . . . 58 . HB2 . . . . . 58 . HN . . rr_1a7i 1 400 1 . . 1 1 58 58 CYS HA H . . . 1 1 58 58 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 58 CYS HA . . A . 58 CYS HB3 . . . 58 . HA . . . . . 58 . HB1 . . rr_1a7i 1 401 1 . . 1 1 58 58 CYS HB2 H . . . 1 1 58 58 CYS HA H . . . . . 3.0 1.8 3.3 . . . . . A . 58 CYS HB2 . . A . 58 CYS HA . . . 58 . HB2 . . . . . 58 . HA . . rr_1a7i 1 402 1 . . 1 1 58 58 CYS H H . . . 1 1 59 59 LYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 58 CYS H . . A . 59 LYS H . . . 58 . HN . . . . . 59 . HN . . rr_1a7i 1 403 1 . . 1 1 58 58 CYS HA H . . . 1 1 59 59 LYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 58 CYS HA . . A . 59 LYS H . . . 58 . HA . . . . . 59 . HN . . rr_1a7i 1 404 1 . . 1 1 59 59 LYS H H . . . 1 1 58 58 CYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 59 LYS H . . A . 58 CYS HB3 . . . 59 . HN . . . . . 58 . HB1 . . rr_1a7i 1 405 1 . . 1 1 58 58 CYS HB2 H . . . 1 1 59 59 LYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 58 CYS HB2 . . A . 59 LYS H . . . 58 . HB2 . . . . . 59 . HN . . rr_1a7i 1 406 1 . . 1 1 58 58 CYS H H . . . 1 1 61 61 CYS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 58 CYS H . . A . 61 CYS HB3 . . . 58 . HN . . . . . 61 . HB1 . . rr_1a7i 1 407 1 . . 1 1 61 61 CYS H H . . . 1 1 58 58 CYS HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 61 CYS H . . A . 58 CYS HB3 . . . 61 . HN . . . . . 58 . HB1 . . rr_1a7i 1 408 1 . . 1 1 58 58 CYS HB2 H . . . 1 1 61 61 CYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 58 CYS HB2 . . A . 61 CYS H . . . 58 . HB2 . . . . . 61 . HN . . rr_1a7i 1 409 1 . . 1 1 59 59 LYS H H . . . 1 1 59 59 LYS HA H . . . . . 3.0 1.8 3.3 . . . . . A . 59 LYS H . . A . 59 LYS HA . . . 59 . HN . . . . . 59 . HA . . rr_1a7i 1 410 1 OR . 1 1 59 59 LYS H H . . . 1 1 59 59 LYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 59 LYS H . . A . 59 LYS HB2 . . . 59 . HN . . . . . 59 . HB# . . rr_1a7i 1 410 2 OR . 1 1 59 59 LYS H H . . . 1 1 59 59 LYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 59 LYS H . . A . 59 LYS HB3 . . . 59 . HN . . . . . 59 . HB# . . rr_1a7i 1 411 1 OR . 1 1 62 62 TYR H H . . . 1 1 59 59 LYS HB2 H . . . . . 4.0 1.8 6.0 . . . . . A . 62 TYR H . . A . 59 LYS HB2 . . . 62 . HN . . . . . 59 . HB# . . rr_1a7i 1 411 2 OR . 1 1 62 62 TYR H H . . . 1 1 59 59 LYS HB3 H . . . . . 4.0 1.8 6.0 . . . . . A . 62 TYR H . . A . 59 LYS HB3 . . . 62 . HN . . . . . 59 . HB# . . rr_1a7i 1 412 1 . . 1 1 61 61 CYS H H . . . 1 1 60 60 SER H H . . . . . 4.0 1.8 6.0 . . . . . A . 61 CYS H . . A . 60 SER H . . . 61 . HN . . . . . 60 . HN . . rr_1a7i 1 413 1 . . 1 1 61 61 CYS H H . . . 1 1 60 60 SER HA H . . . . . 4.0 1.8 5.0 . . . . . A . 61 CYS H . . A . 60 SER HA . . . 61 . HN . . . . . 60 . HA . . rr_1a7i 1 414 1 OR . 1 1 61 61 CYS H H . . . 1 1 60 60 SER HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 61 CYS H . . A . 60 SER HB2 . . . 61 . HN . . . . . 60 . HB# . . rr_1a7i 1 414 2 OR . 1 1 61 61 CYS H H . . . 1 1 60 60 SER HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 61 CYS H . . A . 60 SER HB3 . . . 61 . HN . . . . . 60 . HB# . . rr_1a7i 1 415 1 . . 1 1 61 61 CYS H H . . . 1 1 61 61 CYS HA H . . . . . 3.0 1.8 3.3 . . . . . A . 61 CYS H . . A . 61 CYS HA . . . 61 . HN . . . . . 61 . HA . . rr_1a7i 1 416 1 . . 1 1 61 61 CYS H H . . . 1 1 61 61 CYS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 61 CYS H . . A . 61 CYS HB3 . . . 61 . HN . . . . . 61 . HB1 . . rr_1a7i 1 417 1 . . 1 1 61 61 CYS H H . . . 1 1 61 61 CYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 61 CYS H . . A . 61 CYS HB2 . . . 61 . HN . . . . . 61 . HB2 . . rr_1a7i 1 418 1 . . 1 1 61 61 CYS H H . . . 1 1 62 62 TYR H H . . . . . 3.0 1.8 3.3 . . . . . A . 61 CYS H . . A . 62 TYR H . . . 61 . HN . . . . . 62 . HN . . rr_1a7i 1 419 1 . . 1 1 62 62 TYR H H . . . 1 1 61 61 CYS HA H . . . . . 4.0 1.8 5.0 . . . . . A . 62 TYR H . . A . 61 CYS HA . . . 62 . HN . . . . . 61 . HA . . rr_1a7i 1 420 1 . . 1 1 62 62 TYR H H . . . 1 1 61 61 CYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 62 TYR H . . A . 61 CYS HB2 . . . 62 . HN . . . . . 61 . HB2 . . rr_1a7i 1 421 1 . . 1 1 62 62 TYR H H . . . 1 1 62 62 TYR HA H . . . . . 3.0 1.8 3.3 . . . . . A . 62 TYR H . . A . 62 TYR HA . . . 62 . HN . . . . . 62 . HA . . rr_1a7i 1 422 1 OR . 1 1 62 62 TYR H H . . . 1 1 62 62 TYR HB2 H . . . . . 2.5 1.8 2.7 . . . . . A . 62 TYR H . . A . 62 TYR HB2 . . . 62 . HN . . . . . 62 . HB# . . rr_1a7i 1 422 2 OR . 1 1 62 62 TYR H H . . . 1 1 62 62 TYR HB3 H . . . . . 2.5 1.8 2.7 . . . . . A . 62 TYR H . . A . 62 TYR HB3 . . . 62 . HN . . . . . 62 . HB# . . rr_1a7i 1 423 1 . . 1 1 62 62 TYR H H . . . 1 1 62 62 TYR QD H . . . . . 4.0 1.8 7.2 . . . . . A . 62 TYR H . . A . 62 TYR QD . . . 62 . HN . . . . . 62 . HD# . . rr_1a7i 1 424 1 . . 1 1 62 62 TYR HA H . . . 1 1 62 62 TYR QD H . . . . . 3.0 1.8 5.5 . . . . . A . 62 TYR HA . . A . 62 TYR QD . . . 62 . HA . . . . . 62 . HD# . . rr_1a7i 1 425 1 OR . 1 1 62 62 TYR QD H . . . 1 1 62 62 TYR HB2 H . . . . . 2.5 1.8 4.9 . . . . . A . 62 TYR QD . . A . 62 TYR HB2 . . . 62 . HD# . . . . . 62 . HB# . . rr_1a7i 1 425 2 OR . 1 1 62 62 TYR HB3 H . . . 1 1 62 62 TYR QD H . . . . . 2.5 1.8 4.9 . . . . . A . 62 TYR HB3 . . A . 62 TYR QD . . . 62 . HB# . . . . . 62 . HD# . . rr_1a7i 1 426 1 . . 1 1 62 62 TYR H H . . . 1 1 63 63 GLY H H . . . . . 3.0 1.8 3.3 . . . . . A . 62 TYR H . . A . 63 GLY H . . . 62 . HN . . . . . 63 . HN . . rr_1a7i 1 427 1 . . 1 1 62 62 TYR HA H . . . 1 1 63 63 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 62 TYR HA . . A . 63 GLY H . . . 62 . HA . . . . . 63 . HN . . rr_1a7i 1 428 1 OR . 1 1 63 63 GLY H H . . . 1 1 62 62 TYR HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 63 GLY H . . A . 62 TYR HB2 . . . 63 . HN . . . . . 62 . HB# . . rr_1a7i 1 428 2 OR . 1 1 62 62 TYR HB3 H . . . 1 1 63 63 GLY H H . . . . . 3.0 1.8 3.3 . . . . . A . 62 TYR HB3 . . A . 63 GLY H . . . 62 . HB# . . . . . 63 . HN . . rr_1a7i 1 429 1 . . 1 1 62 62 TYR QD H . . . 1 1 63 63 GLY H H . . . . . 4.0 1.8 7.2 . . . . . A . 62 TYR QD . . A . 63 GLY H . . . 62 . HD# . . . . . 63 . HN . . rr_1a7i 1 430 1 . . 1 1 62 62 TYR HA H . . . 1 1 65 65 LYS H H . . . . . 4.0 1.8 5.0 . . . . . A . 62 TYR HA . . A . 65 LYS H . . . 62 . HA . . . . . 65 . HN . . rr_1a7i 1 431 1 . . 1 1 62 62 TYR HA H . . . 1 1 66 66 TYR H H . . . . . 4.0 1.8 5.0 . . . . . A . 62 TYR HA . . A . 66 TYR H . . . 62 . HA . . . . . 66 . HN . . rr_1a7i 1 432 1 . . 1 1 62 62 TYR QD H . . . 1 1 66 66 TYR QD H . . . . . 3.0 1.8 5.5 . . . . . A . 62 TYR QD . . A . 66 TYR QD . . . 62 . HD# . . . . . 66 . HD# . . rr_1a7i 1 433 1 . . 1 1 66 66 TYR QE H . . . 1 1 62 62 TYR QD H . . . . . 3.0 1.8 5.5 . . . . . A . 66 TYR QE . . A . 62 TYR QD . . . 66 . HE# . . . . . 62 . HD# . . rr_1a7i 1 434 1 . . 1 1 66 66 TYR QD H . . . 1 1 62 62 TYR QE H . . . . . 3.0 1.8 3.3 . . . . . A . 66 TYR QD . . A . 62 TYR QE . . . 66 . HD# . . . . . 62 . HE# . . rr_1a7i 1 435 1 . . 1 1 63 63 GLY H H . . . 1 1 63 63 GLY HA3 H . . . . . 3.0 1.8 3.3 . . . . . A . 63 GLY H . . A . 63 GLY HA3 . . . 63 . HN . . . . . 63 . HA1 . . rr_1a7i 1 436 1 . . 1 1 63 63 GLY H H . . . 1 1 63 63 GLY HA2 H . . . . . 3.0 1.8 3.3 . . . . . A . 63 GLY H . . A . 63 GLY HA2 . . . 63 . HN . . . . . 63 . HA2 . . rr_1a7i 1 437 1 . . 1 1 63 63 GLY H H . . . 1 1 64 64 LYS H H . . . . . 3.0 1.8 3.3 . . . . . A . 63 GLY H . . A . 64 LYS H . . . 63 . HN . . . . . 64 . HN . . rr_1a7i 1 438 1 . . 1 1 63 63 GLY HA3 H . . . 1 1 67 67 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 63 GLY HA3 . . A . 67 GLY H . . . 63 . HA1 . . . . . 67 . HN . . rr_1a7i 1 439 1 . . 1 1 63 63 GLY HA2 H . . . 1 1 67 67 GLY H H . . . . . 4.0 1.8 5.0 . . . . . A . 63 GLY HA2 . . A . 67 GLY H . . . 63 . HA2 . . . . . 67 . HN . . rr_1a7i 1 440 1 . . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HA H . . . . . 3.0 1.8 3.3 . . . . . A . 64 LYS H . . A . 64 LYS HA . . . 64 . HN . . . . . 64 . HA . . rr_1a7i 1 441 1 OR . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 64 LYS H . . A . 64 LYS HB2 . . . 64 . HN . . . . . 64 . HB# . . rr_1a7i 1 441 2 OR . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 64 LYS H . . A . 64 LYS HB3 . . . 64 . HN . . . . . 64 . HB# . . rr_1a7i 1 442 1 OR . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HG2 H . . . . . 4.0 1.8 5.0 . . . . . A . 64 LYS H . . A . 64 LYS HG2 . . . 64 . HN . . . . . 64 . HG# . . rr_1a7i 1 442 2 OR . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HG3 H . . . . . 4.0 1.8 5.0 . . . . . A . 64 LYS H . . A . 64 LYS HG3 . . . 64 . HN . . . . . 64 . HG# . . rr_1a7i 1 443 1 OR . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HD2 H . . . . . 3.0 1.8 3.3 . . . . . A . 64 LYS H . . A . 64 LYS HD2 . . . 64 . HN . . . . . 64 . HD# . . rr_1a7i 1 443 2 OR . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HD3 H . . . . . 3.0 1.8 3.3 . . . . . A . 64 LYS H . . A . 64 LYS HD3 . . . 64 . HN . . . . . 64 . HD# . . rr_1a7i 1 444 1 OR . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HE2 H . . . . . 4.0 1.8 7.2 . . . . . A . 64 LYS H . . A . 64 LYS HE2 . . . 64 . HN . . . . . 64 . HE# . . rr_1a7i 1 444 2 OR . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HE3 H . . . . . 4.0 1.8 7.2 . . . . . A . 64 LYS H . . A . 64 LYS HE3 . . . 64 . HN . . . . . 64 . HE# . . rr_1a7i 1 445 1 . . 1 1 64 64 LYS H H . . . 1 1 65 65 LYS HA H . . . . . 4.0 1.8 5.0 . . . . . A . 64 LYS H . . A . 65 LYS HA . . . 64 . HN . . . . . 65 . HA . . rr_1a7i 1 446 1 . . 1 1 65 65 LYS H H . . . 1 1 64 64 LYS HA H . . . . . 4.0 1.8 5.0 . . . . . A . 65 LYS H . . A . 64 LYS HA . . . 65 . HN . . . . . 64 . HA . . rr_1a7i 1 447 1 OR . 1 1 65 65 LYS H H . . . 1 1 64 64 LYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 65 LYS H . . A . 64 LYS HB2 . . . 65 . HN . . . . . 64 . HB# . . rr_1a7i 1 447 2 OR . 1 1 65 65 LYS H H . . . 1 1 64 64 LYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 65 LYS H . . A . 64 LYS HB3 . . . 65 . HN . . . . . 64 . HB# . . rr_1a7i 1 448 1 OR . 1 1 65 65 LYS H H . . . 1 1 64 64 LYS HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 65 LYS H . . A . 64 LYS HG2 . . . 65 . HN . . . . . 64 . HG# . . rr_1a7i 1 448 2 OR . 1 1 65 65 LYS H H . . . 1 1 64 64 LYS HG3 H . . . . . 4.0 1.8 6.0 . . . . . A . 65 LYS H . . A . 64 LYS HG3 . . . 65 . HN . . . . . 64 . HG# . . rr_1a7i 1 449 1 OR . 1 1 65 65 LYS H H . . . 1 1 64 64 LYS HD2 H . . . . . 4.0 1.8 5.0 . . . . . A . 65 LYS H . . A . 64 LYS HD2 . . . 65 . HN . . . . . 64 . HD# . . rr_1a7i 1 449 2 OR . 1 1 65 65 LYS H H . . . 1 1 64 64 LYS HD3 H . . . . . 4.0 1.8 5.0 . . . . . A . 65 LYS H . . A . 64 LYS HD3 . . . 65 . HN . . . . . 64 . HD# . . rr_1a7i 1 450 1 OR . 1 1 67 67 GLY H H . . . 1 1 64 64 LYS HD2 H . . . . . 4.0 1.8 5.0 . . . . . A . 67 GLY H . . A . 64 LYS HD2 . . . 67 . HN . . . . . 64 . HD# . . rr_1a7i 1 450 2 OR . 1 1 67 67 GLY H H . . . 1 1 64 64 LYS HD3 H . . . . . 4.0 1.8 5.0 . . . . . A . 67 GLY H . . A . 64 LYS HD3 . . . 67 . HN . . . . . 64 . HD# . . rr_1a7i 1 451 1 . . 1 1 65 65 LYS H H . . . 1 1 65 65 LYS HA H . . . . . 3.0 1.8 3.3 . . . . . A . 65 LYS H . . A . 65 LYS HA . . . 65 . HN . . . . . 65 . HA . . rr_1a7i 1 452 1 OR . 1 1 65 65 LYS H H . . . 1 1 65 65 LYS HB2 H . . . . . 3.0 1.8 3.3 . . . . . A . 65 LYS H . . A . 65 LYS HB2 . . . 65 . HN . . . . . 65 . HB# . . rr_1a7i 1 452 2 OR . 1 1 65 65 LYS H H . . . 1 1 65 65 LYS HB3 H . . . . . 3.0 1.8 3.3 . . . . . A . 65 LYS H . . A . 65 LYS HB3 . . . 65 . HN . . . . . 65 . HB# . . rr_1a7i 1 453 1 OR . 1 1 65 65 LYS H H . . . 1 1 65 65 LYS HG2 H . . . . . 4.0 1.8 6.0 . . . . . A . 65 LYS H . . A . 65 LYS HG2 . . . 65 . HN . . . . . 65 . HG# . . rr_1a7i 1 453 2 OR . 1 1 65 65 LYS H H . . . 1 1 65 65 LYS HG3 H . . . . . 4.0 1.8 6.0 . . . . . A . 65 LYS H . . A . 65 LYS HG3 . . . 65 . HN . . . . . 65 . HG# . . rr_1a7i 1 454 1 OR . 1 1 65 65 LYS H H . . . 1 1 65 65 LYS HD2 H . . . . . 4.0 1.8 6.0 . . . . . A . 65 LYS H . . A . 65 LYS HD2 . . . 65 . HN . . . . . 65 . HD# . . rr_1a7i 1 454 2 OR . 1 1 65 65 LYS H H . . . 1 1 65 65 LYS HD3 H . . . . . 4.0 1.8 6.0 . . . . . A . 65 LYS H . . A . 65 LYS HD3 . . . 65 . HN . . . . . 65 . HD# . . rr_1a7i 1 455 1 . . 1 1 65 65 LYS H H . . . 1 1 66 66 TYR H H . . . . . 3.0 1.8 3.3 . . . . . A . 65 LYS H . . A . 66 TYR H . . . 65 . HN . . . . . 66 . HN . . rr_1a7i 1 456 1 . . 1 1 65 65 LYS H H . . . 1 1 66 66 TYR QD H . . . . . 4.0 1.8 8.2 . . . . . A . 65 LYS H . . A . 66 TYR QD . . . 65 . HN . . . . . 66 . HD# . . rr_1a7i 1 457 1 . . 1 1 66 66 TYR H H . . . 1 1 65 65 LYS HA H . . . . . 4.0 1.8 5.0 . . . . . A . 66 TYR H . . A . 65 LYS HA . . . 66 . HN . . . . . 65 . HA . . rr_1a7i 1 458 1 OR . 1 1 66 66 TYR H H . . . 1 1 65 65 LYS HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 66 TYR H . . A . 65 LYS HB2 . . . 66 . HN . . . . . 65 . HB# . . rr_1a7i 1 458 2 OR . 1 1 66 66 TYR H H . . . 1 1 65 65 LYS HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 66 TYR H . . A . 65 LYS HB3 . . . 66 . HN . . . . . 65 . HB# . . rr_1a7i 1 459 1 OR . 1 1 66 66 TYR H H . . . 1 1 66 66 TYR HB2 H . . . . . 4.0 1.8 5.0 . . . . . A . 66 TYR H . . A . 66 TYR HB2 . . . 66 . HN . . . . . 66 . HB# . . rr_1a7i 1 459 2 OR . 1 1 66 66 TYR H H . . . 1 1 66 66 TYR HB3 H . . . . . 4.0 1.8 5.0 . . . . . A . 66 TYR H . . A . 66 TYR HB3 . . . 66 . HN . . . . . 66 . HB# . . rr_1a7i 1 460 1 . . 1 1 66 66 TYR H H . . . 1 1 66 66 TYR QD H . . . . . 4.0 1.8 7.2 . . . . . A . 66 TYR H . . A . 66 TYR QD . . . 66 . HN . . . . . 66 . HD# . . rr_1a7i 1 461 1 . . 1 1 66 66 TYR QD H . . . 1 1 66 66 TYR HA H . . . . . 3.0 1.8 5.5 . . . . . A . 66 TYR QD . . A . 66 TYR HA . . . 66 . HD# . . . . . 66 . HA . . rr_1a7i 1 462 1 OR . 1 1 66 66 TYR QD H . . . 1 1 66 66 TYR HB2 H . . . . . 3.0 1.8 5.5 . . . . . A . 66 TYR QD . . A . 66 TYR HB2 . . . 66 . HD# . . . . . 66 . HB# . . rr_1a7i 1 462 2 OR . 1 1 66 66 TYR QD H . . . 1 1 66 66 TYR HB3 H . . . . . 3.0 1.8 5.5 . . . . . A . 66 TYR QD . . A . 66 TYR HB3 . . . 66 . HD# . . . . . 66 . HB# . . rr_1a7i 1 463 1 . . 1 1 66 66 TYR H H . . . 1 1 67 67 GLY H H . . . . . 3.0 1.8 3.3 . . . . . A . 66 TYR H . . A . 67 GLY H . . . 66 . HN . . . . . 67 . HN . . rr_1a7i 1 464 1 OR . 1 1 66 66 TYR H H . . . 1 1 67 67 GLY HA2 H . . . . . 4.0 1.8 5.0 . . . . . A . 66 TYR H . . A . 67 GLY HA2 . . . 66 . HN . . . . . 67 . HA# . . rr_1a7i 1 464 2 OR . 1 1 66 66 TYR H H . . . 1 1 67 67 GLY HA3 H . . . . . 4.0 1.8 5.0 . . . . . A . 66 TYR H . . A . 67 GLY HA3 . . . 66 . HN . . . . . 67 . HA# . . rr_1a7i 1 465 1 OR . 1 1 67 67 GLY H H . . . 1 1 67 67 GLY HA2 H . . . . . 2.5 1.8 2.7 . . . . . A . 67 GLY H . . A . 67 GLY HA2 . . . 67 . HN . . . . . 67 . HA# . . rr_1a7i 1 465 2 OR . 1 1 67 67 GLY H H . . . 1 1 67 67 GLY HA3 H . . . . . 2.5 1.8 2.7 . . . . . A . 67 GLY H . . A . 67 GLY HA3 . . . 67 . HN . . . . . 67 . HA# . . rr_1a7i 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 ; ambigous: ! ANSIG v3.3 XPLOR distance restraints file No distance corrections applied. Trivial distances not output. residue 1 Met , intraresidue NOEs residue 1 Met , NOEs forward in sequence residue 2 Pro , intraresidue NOEs residue 2 Pro , NOEs forward in sequence residue 3 Asn , intraresidue NOEs residue 3 Asn , NOEs forward in sequence residue 4 Trp , intraresidue NOEs residue 4 Trp , NOEs forward in sequence residue 5 Gly , intraresidue NOEs residue 5 Gly , NOEs forward in sequence residue 6 Gly , intraresidue NOEs residue 6 Gly , NOEs forward in sequence residue 7 Gly , intraresidue NOEs residue 7 Gly , NOEs forward in sequence residue 8 Asn , intraresidue NOEs residue 8 Asn , NOEs forward in sequence residue 9 Lys , intraresidue NOEs trivial: assi (resi 9 and name HN ) (resi 9 and name HA ) 4.00 2.20 1.00 ; 1 1 38 86 rr_1a7i 1 2 'residue 9 Lys , NOEs forward in sequence' 43 1 43 46 rr_1a7i 1 3 'residue 10 Cys , intraresidue NOEs' 46 1 46 39 rr_1a7i 1 4 'residue 10 Cys , NOEs forward in sequence' 50 1 50 46 rr_1a7i 1 5 'residue 11 Gly , intraresidue NOEs' 68 1 68 39 rr_1a7i 1 6 'residue 11 Gly , NOEs forward in sequence' 72 1 72 46 rr_1a7i 1 7 'residue 12 Ala , intraresidue NOEs' 82 1 82 39 rr_1a7i 1 8 ; trivial: assi (resi 12 and name HA ) (resi 12 and name HB# ) 3.00 1.20 0.30 residue 12 Ala , NOEs forward in sequence ; 85 1 87 46 rr_1a7i 1 9 'ambigous: assi (resi 12 and name HB# ) (resi 30 and name HN ) 4.00 2.20 2.00' 96 1 96 87 rr_1a7i 1 10 'residue 13 Cys , intraresidue NOEs' 99 1 99 39 rr_1a7i 1 11 'residue 13 Cys , NOEs forward in sequence' 106 1 106 46 rr_1a7i 1 12 'residue 14 Gly , intraresidue NOEs' 113 1 113 39 rr_1a7i 1 13 'residue 14 Gly , NOEs forward in sequence' 117 1 117 46 rr_1a7i 1 14 'residue 15 Arg , intraresidue NOEs' 122 1 122 39 rr_1a7i 1 15 'residue 15 Arg , NOEs forward in sequence' 127 1 127 46 rr_1a7i 1 16 ; residue 16 Thr , intraresidue NOEs trivial: assi (resi 16 and name HN ) (resi 16 and name HA ) 4.00 2.20 2.00 ; 134 1 135 86 rr_1a7i 1 17 'residue 16 Thr , NOEs forward in sequence' 138 1 138 46 rr_1a7i 1 18 'residue 17 Val , intraresidue NOEs' 143 1 143 39 rr_1a7i 1 19 ; trivial: assi (resi 17 and name HB ) (resi 17 and name HG1#) 3.00 1.20 0.30 trivial: assi (resi 17 and name HB ) (resi 17 and name HG2#) 3.00 1.20 0.30 trivial: assi (resi 17 and name HG1#) (resi 17 and name HG2#) 4.00 2.20 1.00 residue 17 Val , NOEs forward in sequence ; 149 1 153 46 rr_1a7i 1 20 'ambigous: assi (resi 17 and name HG1#) (resi 31 and name HN ) 4.00 2.20 2.00' 170 1 170 87 rr_1a7i 1 21 'residue 18 Tyr , intraresidue NOEs' 181 1 181 39 rr_1a7i 1 22 ; trivial: assi (resi 18 and name HD# ) (resi 18 and name HE# ) 2.50 0.70 0.20 residue 18 Tyr , NOEs forward in sequence residue 19 His , intraresidue NOEs residue 19 His , NOEs forward in sequence residue 20 Ala , intraresidue NOEs ; 185 1 193 39 rr_1a7i 1 23 'residue 20 Ala , NOEs forward in sequence' 197 1 197 46 rr_1a7i 1 24 ; residue 21 Glu , intraresidue NOEs trivial: assi (resi 21 and name HN ) (resi 21 and name HA ) 4.00 2.20 1.00 ; 200 1 201 86 rr_1a7i 1 25 'residue 21 Glu , NOEs forward in sequence' 205 1 205 46 rr_1a7i 1 26 'residue 22 Glu , intraresidue NOEs' 213 1 213 39 rr_1a7i 1 27 'residue 22 Glu , NOEs forward in sequence' 218 1 218 46 rr_1a7i 1 28 'residue 23 Val , intraresidue NOEs' 225 1 225 39 rr_1a7i 1 29 ; trivial: assi (resi 23 and name HB ) (resi 23 and name HG1#) 4.00 2.20 1.00 trivial: assi (resi 23 and name HB ) (resi 23 and name HG2#) 3.00 1.20 0.30 trivial: assi (resi 23 and name HG1#) (resi 23 and name HG2#) 4.00 2.20 1.00 residue 23 Val , NOEs forward in sequence ; 231 1 235 46 rr_1a7i 1 30 ; residue 24 Gln , intraresidue NOEs trivial: assi (resi 24 and name HN ) (resi 24 and name HA ) 4.00 2.20 1.00 ; 250 1 251 86 rr_1a7i 1 31 'residue 24 Gln , NOEs forward in sequence' 257 1 257 46 rr_1a7i 1 32 'residue 25 Cys , intraresidue NOEs' 265 1 265 39 rr_1a7i 1 33 'residue 25 Cys , NOEs forward in sequence' 268 1 268 46 rr_1a7i 1 34 ; residue 26 Asp , intraresidue NOEs residue 26 Asp , NOEs forward in sequence residue 27 Gly , intraresidue NOEs trivial: assi (resi 27 and name HN ) (resi 27 and name HA# ) 4.00 2.20 1.00 residue 27 Gly , NOEs forward in sequence ; 278 1 285 46 rr_1a7i 1 35 'residue 28 Arg , intraresidue NOEs' 289 1 289 39 rr_1a7i 1 36 'residue 28 Arg , NOEs forward in sequence' 295 1 295 46 rr_1a7i 1 37 ; residue 29 Ser , intraresidue NOEs trivial: assi (resi 29 and name HN ) (resi 29 and name HA ) 4.00 2.20 1.00 ; 304 1 305 86 rr_1a7i 1 38 'residue 29 Ser , NOEs forward in sequence' 309 1 309 46 rr_1a7i 1 39 ; residue 30 Phe , intraresidue NOEs trivial: assi (resi 30 and name HN ) (resi 30 and name HA ) 4.00 2.20 1.00 ; 315 1 316 86 rr_1a7i 1 40 'trivial: assi (resi 30 and name HA ) (resi 30 and name HB2 ) 4.00 2.20 1.00' 320 1 320 86 rr_1a7i 1 41 ; trivial: assi (resi 30 and name HD# ) (resi 30 and name HE# ) 2.50 0.70 0.20 residue 30 Phe , NOEs forward in sequence ; 324 1 326 46 rr_1a7i 1 42 'residue 31 His , intraresidue NOEs' 336 1 336 39 rr_1a7i 1 43 'residue 31 His , NOEs forward in sequence' 340 1 340 46 rr_1a7i 1 44 'residue 32 Arg , intraresidue NOEs' 348 1 348 39 rr_1a7i 1 45 ; residue 32 Arg , NOEs forward in sequence residue 33 Cys , intraresidue NOEs trivial: assi (resi 33 and name HN ) (resi 33 and name HA ) 4.00 2.20 1.00 ; 353 1 356 86 rr_1a7i 1 46 'residue 33 Cys , NOEs forward in sequence' 359 1 359 46 rr_1a7i 1 47 'residue 34 Cys , intraresidue NOEs' 362 1 362 39 rr_1a7i 1 48 'residue 34 Cys , NOEs forward in sequence' 366 1 366 46 rr_1a7i 1 49 'residue 35 Phe , intraresidue NOEs' 369 1 369 39 rr_1a7i 1 50 'trivial: assi (resi 35 and name HZ ) (resi 35 and name HE# ) 2.50 0.70 0.20' 375 1 375 86 rr_1a7i 1 51 'residue 35 Phe , NOEs forward in sequence' 379 1 379 46 rr_1a7i 1 52 ; residue 36 Leu , intraresidue NOEs trivial: assi (resi 36 and name HN ) (resi 36 and name HA ) 4.00 2.20 1.00 ; 398 1 399 86 rr_1a7i 1 53 'residue 36 Leu , NOEs forward in sequence' 404 1 404 46 rr_1a7i 1 54 ; residue 37 Cys , intraresidue NOEs trivial: assi (resi 37 and name HN ) (resi 37 and name HA ) 4.00 2.20 1.00 ; 414 1 415 86 rr_1a7i 1 55 'residue 37 Cys , NOEs forward in sequence' 418 1 418 46 rr_1a7i 1 56 'residue 38 Met , intraresidue NOEs' 434 1 434 39 rr_1a7i 1 57 'residue 38 Met , NOEs forward in sequence' 438 1 438 46 rr_1a7i 1 58 'residue 39 Val , intraresidue NOEs' 443 1 443 39 rr_1a7i 1 59 ; trivial: assi (resi 39 and name HB ) (resi 39 and name HG1#) 3.00 1.20 0.30 trivial: assi (resi 39 and name HB ) (resi 39 and name HG2#) 3.00 1.20 0.30 trivial: assi (resi 39 and name HG1#) (resi 39 and name HG2#) 3.00 1.20 0.30 residue 39 Val , NOEs forward in sequence ; 450 1 454 46 rr_1a7i 1 60 ; residue 40 Cys , intraresidue NOEs trivial: assi (resi 40 and name HN ) (resi 40 and name HA ) 4.00 2.20 1.00 ; 468 1 469 86 rr_1a7i 1 61 'residue 40 Cys , NOEs forward in sequence' 473 1 473 46 rr_1a7i 1 62 'residue 41 Arg , intraresidue NOEs' 480 1 480 39 rr_1a7i 1 63 'residue 41 Arg , NOEs forward in sequence' 486 1 486 46 rr_1a7i 1 64 'residue 42 Lys , intraresidue NOEs' 490 1 490 39 rr_1a7i 1 65 'residue 42 Lys , NOEs forward in sequence' 496 1 496 46 rr_1a7i 1 66 ; residue 43 Asn , intraresidue NOEs trivial: assi (resi 43 and name HN ) (resi 43 and name HA ) 4.00 2.20 1.00 ; 503 1 504 86 rr_1a7i 1 67 'residue 43 Asn , NOEs forward in sequence' 507 1 507 46 rr_1a7i 1 68 ; residue 44 Leu , intraresidue NOEs trivial: assi (resi 44 and name HN ) (resi 44 and name HA ) 4.00 2.20 1.00 ; 511 1 512 86 rr_1a7i 1 69 ; trivial: assi (resi 44 and name HD# ) (resi 44 and name HD# ) 3.00 1.20 0.30 residue 44 Leu , NOEs forward in sequence ; 515 1 517 46 rr_1a7i 1 70 'residue 45 Asp , intraresidue NOEs' 534 1 534 39 rr_1a7i 1 71 'residue 45 Asp , NOEs forward in sequence' 537 1 537 46 rr_1a7i 1 72 ; residue 46 Ser , intraresidue NOEs residue 46 Ser , NOEs forward in sequence residue 47 Thr , intraresidue NOEs trivial: assi (resi 47 and name HN ) (resi 47 and name HA ) 4.00 2.20 2.00 ; 540 1 545 86 rr_1a7i 1 73 'residue 47 Thr , NOEs forward in sequence' 548 1 548 46 rr_1a7i 1 74 'residue 48 Thr , intraresidue NOEs' 551 1 551 39 rr_1a7i 1 75 'residue 48 Thr , NOEs forward in sequence' 555 1 555 46 rr_1a7i 1 76 'residue 49 Val , intraresidue NOEs' 560 1 560 39 rr_1a7i 1 77 ; trivial: assi (resi 49 and name HB ) (resi 49 and name HG1#) 3.00 1.20 0.30 trivial: assi (resi 49 and name HB ) (resi 49 and name HG2#) 3.00 1.20 0.30 trivial: assi (resi 49 and name HG1#) (resi 49 and name HG2#) 3.00 1.20 0.30 residue 49 Val , NOEs forward in sequence ; 566 1 570 46 rr_1a7i 1 78 'residue 50 Ala , intraresidue NOEs' 577 1 577 39 rr_1a7i 1 79 'residue 50 Ala , NOEs forward in sequence' 580 1 580 46 rr_1a7i 1 80 ; residue 51 Ile , intraresidue NOEs trivial: assi (resi 51 and name HN ) (resi 51 and name HA ) 4.00 2.20 1.00 ; 586 1 587 86 rr_1a7i 1 81 'residue 51 Ile , NOEs forward in sequence' 594 1 594 46 rr_1a7i 1 82 'residue 52 His , intraresidue NOEs' 602 1 602 39 rr_1a7i 1 83 'residue 52 His , NOEs forward in sequence' 605 1 605 46 rr_1a7i 1 84 ; residue 53 Asp , intraresidue NOEs residue 53 Asp , NOEs forward in sequence ; 612 1 614 46 rr_1a7i 1 85 'residue 54 Ala , intraresidue NOEs' 619 1 619 39 rr_1a7i 1 86 'residue 54 Ala , NOEs forward in sequence' 623 1 623 46 rr_1a7i 1 87 'residue 55 Glu , intraresidue NOEs' 627 1 627 39 rr_1a7i 1 88 'residue 55 Glu , NOEs forward in sequence' 632 1 632 46 rr_1a7i 1 89 'residue 56 Val , intraresidue NOEs' 641 1 641 39 rr_1a7i 1 90 ; trivial: assi (resi 56 and name HB ) (resi 56 and name HG# ) 3.00 1.20 0.30 trivial: assi (resi 56 and name HG# ) (resi 56 and name HG# ) 3.00 1.20 0.30 residue 56 Val , NOEs forward in sequence ; 645 1 648 46 rr_1a7i 1 91 ; assi (resi 56 and name HG# ) (resi 63 and name HN ) 4.00 2.20 3.50 residue 57 Tyr , intraresidue NOEs trivial: assi (resi 57 and name HN ) (resi 57 and name HA ) 4.00 2.20 1.00 ; 652 1 655 86 rr_1a7i 1 92 ; trivial: assi (resi 57 and name HD# ) (resi 57 and name HE# ) 2.50 0.70 0.20 residue 57 Tyr , NOEs forward in sequence ; 660 1 662 46 rr_1a7i 1 93 'ambigous: assi (resi 57 and name HA ) (resi 61 and name HA ) 3.00 1.20 0.30' 666 1 666 87 rr_1a7i 1 94 ; residue 58 Cys , intraresidue NOEs trivial: assi (resi 58 and name HN ) (resi 58 and name HA ) 4.00 2.20 1.00 ; 671 1 672 86 rr_1a7i 1 95 'residue 58 Cys , NOEs forward in sequence' 678 1 678 46 rr_1a7i 1 96 'residue 59 Lys , intraresidue NOEs' 687 1 687 39 rr_1a7i 1 97 'residue 59 Lys , NOEs forward in sequence' 691 1 691 46 rr_1a7i 1 98 ; residue 60 Ser , intraresidue NOEs trivial: assi (resi 60 and name HN ) (resi 60 and name HA ) 2.50 0.70 0.20 trivial: assi (resi 60 and name HN ) (resi 60 and name HB# ) 4.00 2.20 1.00 residue 60 Ser , NOEs forward in sequence ; 694 1 698 46 rr_1a7i 1 99 'residue 61 Cys , intraresidue NOEs' 703 1 703 39 rr_1a7i 1 100 'residue 61 Cys , NOEs forward in sequence' 708 1 708 46 rr_1a7i 1 101 'residue 62 Tyr , intraresidue NOEs' 713 1 713 39 rr_1a7i 1 102 ; trivial: assi (resi 62 and name HD# ) (resi 62 and name HE# ) 2.50 0.70 0.20 residue 62 Tyr , NOEs forward in sequence ; 719 1 721 46 rr_1a7i 1 103 'residue 63 Gly , intraresidue NOEs' 732 1 732 39 rr_1a7i 1 104 'residue 63 Gly , NOEs forward in sequence' 736 1 736 46 rr_1a7i 1 105 'residue 64 Lys , intraresidue NOEs' 741 1 741 39 rr_1a7i 1 106 'residue 64 Lys , NOEs forward in sequence' 748 1 748 46 rr_1a7i 1 107 'residue 65 Lys , intraresidue NOEs' 756 1 756 39 rr_1a7i 1 108 'residue 65 Lys , NOEs forward in sequence' 762 1 762 46 rr_1a7i 1 109 ; residue 66 Tyr , intraresidue NOEs trivial: assi (resi 66 and name HN ) (resi 66 and name HA ) 4.00 2.20 1.00 ; 768 1 769 86 rr_1a7i 1 110 'residue 66 Tyr , NOEs forward in sequence' 775 1 775 46 rr_1a7i 1 111 'residue 67 Gly , intraresidue NOEs' 779 1 779 39 rr_1a7i 1 112 ; residue 67 Gly , NOEs forward in sequence residue 68 Pro , intraresidue NOEs residue 68 Pro , NOEs forward in sequence residue 69 Lys , intraresidue NOEs residue 69 Lys , NOEs forward in sequence residue 70 Gly , intraresidue NOEs residue 70 Gly , NOEs forward in sequence residue 71 Tyr , intraresidue NOEs residue 71 Tyr , NOEs forward in sequence residue 72 Gly , intraresidue NOEs residue 72 Gly , NOEs forward in sequence residue 73 Tyr , intraresidue NOEs residue 73 Tyr , NOEs forward in sequence residue 74 Gly , intraresidue NOEs residue 74 Gly , NOEs forward in sequence residue 75 Gln , intraresidue NOEs residue 75 Gln , NOEs forward in sequence residue 76 Gly , intraresidue NOEs residue 76 Gly , NOEs forward in sequence residue 77 Ala , intraresidue NOEs residue 77 Ala , NOEs forward in sequence residue 78 Gly , intraresidue NOEs residue 78 Gly , NOEs forward in sequence residue 79 Thr , intraresidue NOEs residue 79 Thr , NOEs forward in sequence residue 80 Leu , intraresidue NOEs residue 80 Leu , NOEs forward in sequence residue 81 Asn , intraresidue NOEs ; 782 1 837 2 rr_1a7i 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_1a7i _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 LIM DOMAIN CONTAINING PROTEINS 15-MAR-98 1A7I *TITLE AMINO-TERMINAL LIM DOMAIN FROM QUAIL CYSTEINE AND *TITLE 2 GLYCINE-RICH PROTEIN, NMR, MINIMIZED AVERAGE STRUCTURE *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: QCRP2 (LIM1); *COMPND 3 CHAIN: NULL; *COMPND 4 FRAGMENT: N-TERMINAL LIM DOMAIN; *COMPND 5 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: COTURNIX COTURNIX JAPONICA; *SOURCE 3 ORGANISM_COMMON: JAPANESE QUAIL; *SOURCE 4 PLASMID: PET3DQCRP2(LIM1); *SOURCE 5 GENE: CSRP2; *SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; *SOURCE 7 EXPRESSION_SYSTEM_PLASMID: PET *KEYWDS LIM DOMAIN CONTAINING PROTEINS, METAL-BINDING PROTEIN, ZINC *KEYWDS 2 FINGER *EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE *AUTHOR G.KONTAXIS,R.KONRAT,B.KRAEUTLER,R.WEISKIRCHEN,K.BISTER *REVDAT 1 27-MAY-98 1A7I 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_1a7i _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 ; ! number of restraints as function of range ! |i-j| = 0 : 158 ! |i-j| = 1 : 143 ! |i-j| = 2 : 22 ! |i-j| = 3 : 16 ! |i-j| = 4 : 17 ! |i-j| > 4 : 117 ! total : 473 ; save_