data_Remediated_restraints_file_for_PDB_entry_1iyu # This BMRB archive file contains, for PDB entry 1iyu: # # - 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_1iyu _Entry.Title 'wwPDB remediated NMR restraints for PDB entry 1iyu' _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 1iyu' _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 1iyu 'Master copy' rr_1iyu stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID rr_1iyu _Assembly.ID 1 _Assembly.Name 1iyu _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass 8158.3676 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 'DIHYDROLIPOAMIDE ACETYLTRANSFERASE COMPONENT OF PYRUVATE DEHYDROGENASE COMPL' 1 $DIHYDROLIPOAMIDE_ACETYLTRANSFERASE_COMPONENT_OF_PYRUVATE_DEHYDROGENASE_COMPL A . no . . . . . . rr_1iyu 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_DIHYDROLIPOAMIDE_ACETYLTRANSFERASE_COMPONENT_OF_PYRUVATE_DEHYDROGENASE_COMPL _Entity.Sf_category entity _Entity.Sf_framecode DIHYDROLIPOAMIDE_ACETYLTRANSFERASE_COMPONENT_OF_PYRUVATE_DEHYDROGENASE_COMPL _Entity.Entry_ID rr_1iyu _Entity.ID 1 _Entity.Name DIHYDROLIPOAMIDE_ACETYLTRANSFERASE_COMPONENT_OF_PYRUVATE_DEHYDROGENASE_COMPL _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code ; SEIIRVPDIGGDGEVIELLV KTGDLIEVEQGLVVLESAKA SMEVPSPKAGVVKSVSVKLG DKLKEGDAIIELEPAAGAR ; _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 79 _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Parent_entity_ID 1 _Entity.Formula_weight 8158.3676 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 . SER . rr_1iyu 1 2 . GLU . rr_1iyu 1 3 . ILE . rr_1iyu 1 4 . ILE . rr_1iyu 1 5 . ARG . rr_1iyu 1 6 . VAL . rr_1iyu 1 7 . PRO . rr_1iyu 1 8 . ASP . rr_1iyu 1 9 . ILE . rr_1iyu 1 10 . GLY . rr_1iyu 1 11 . GLY . rr_1iyu 1 12 . ASP . rr_1iyu 1 13 . GLY . rr_1iyu 1 14 . GLU . rr_1iyu 1 15 . VAL . rr_1iyu 1 16 . ILE . rr_1iyu 1 17 . GLU . rr_1iyu 1 18 . LEU . rr_1iyu 1 19 . LEU . rr_1iyu 1 20 . VAL . rr_1iyu 1 21 . LYS . rr_1iyu 1 22 . THR . rr_1iyu 1 23 . GLY . rr_1iyu 1 24 . ASP . rr_1iyu 1 25 . LEU . rr_1iyu 1 26 . ILE . rr_1iyu 1 27 . GLU . rr_1iyu 1 28 . VAL . rr_1iyu 1 29 . GLU . rr_1iyu 1 30 . GLN . rr_1iyu 1 31 . GLY . rr_1iyu 1 32 . LEU . rr_1iyu 1 33 . VAL . rr_1iyu 1 34 . VAL . rr_1iyu 1 35 . LEU . rr_1iyu 1 36 . GLU . rr_1iyu 1 37 . SER . rr_1iyu 1 38 . ALA . rr_1iyu 1 39 . LYS . rr_1iyu 1 40 . ALA . rr_1iyu 1 41 . SER . rr_1iyu 1 42 . MET . rr_1iyu 1 43 . GLU . rr_1iyu 1 44 . VAL . rr_1iyu 1 45 . PRO . rr_1iyu 1 46 . SER . rr_1iyu 1 47 . PRO . rr_1iyu 1 48 . LYS . rr_1iyu 1 49 . ALA . rr_1iyu 1 50 . GLY . rr_1iyu 1 51 . VAL . rr_1iyu 1 52 . VAL . rr_1iyu 1 53 . LYS . rr_1iyu 1 54 . SER . rr_1iyu 1 55 . VAL . rr_1iyu 1 56 . SER . rr_1iyu 1 57 . VAL . rr_1iyu 1 58 . LYS . rr_1iyu 1 59 . LEU . rr_1iyu 1 60 . GLY . rr_1iyu 1 61 . ASP . rr_1iyu 1 62 . LYS . rr_1iyu 1 63 . LEU . rr_1iyu 1 64 . LYS . rr_1iyu 1 65 . GLU . rr_1iyu 1 66 . GLY . rr_1iyu 1 67 . ASP . rr_1iyu 1 68 . ALA . rr_1iyu 1 69 . ILE . rr_1iyu 1 70 . ILE . rr_1iyu 1 71 . GLU . rr_1iyu 1 72 . LEU . rr_1iyu 1 73 . GLU . rr_1iyu 1 74 . PRO . rr_1iyu 1 75 . ALA . rr_1iyu 1 76 . ALA . rr_1iyu 1 77 . GLY . rr_1iyu 1 78 . ALA . rr_1iyu 1 79 . ARG . rr_1iyu 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 . SER 1 1 rr_1iyu 1 . GLU 2 2 rr_1iyu 1 . ILE 3 3 rr_1iyu 1 . ILE 4 4 rr_1iyu 1 . ARG 5 5 rr_1iyu 1 . VAL 6 6 rr_1iyu 1 . PRO 7 7 rr_1iyu 1 . ASP 8 8 rr_1iyu 1 . ILE 9 9 rr_1iyu 1 . GLY 10 10 rr_1iyu 1 . GLY 11 11 rr_1iyu 1 . ASP 12 12 rr_1iyu 1 . GLY 13 13 rr_1iyu 1 . GLU 14 14 rr_1iyu 1 . VAL 15 15 rr_1iyu 1 . ILE 16 16 rr_1iyu 1 . GLU 17 17 rr_1iyu 1 . LEU 18 18 rr_1iyu 1 . LEU 19 19 rr_1iyu 1 . VAL 20 20 rr_1iyu 1 . LYS 21 21 rr_1iyu 1 . THR 22 22 rr_1iyu 1 . GLY 23 23 rr_1iyu 1 . ASP 24 24 rr_1iyu 1 . LEU 25 25 rr_1iyu 1 . ILE 26 26 rr_1iyu 1 . GLU 27 27 rr_1iyu 1 . VAL 28 28 rr_1iyu 1 . GLU 29 29 rr_1iyu 1 . GLN 30 30 rr_1iyu 1 . GLY 31 31 rr_1iyu 1 . LEU 32 32 rr_1iyu 1 . VAL 33 33 rr_1iyu 1 . VAL 34 34 rr_1iyu 1 . LEU 35 35 rr_1iyu 1 . GLU 36 36 rr_1iyu 1 . SER 37 37 rr_1iyu 1 . ALA 38 38 rr_1iyu 1 . LYS 39 39 rr_1iyu 1 . ALA 40 40 rr_1iyu 1 . SER 41 41 rr_1iyu 1 . MET 42 42 rr_1iyu 1 . GLU 43 43 rr_1iyu 1 . VAL 44 44 rr_1iyu 1 . PRO 45 45 rr_1iyu 1 . SER 46 46 rr_1iyu 1 . PRO 47 47 rr_1iyu 1 . LYS 48 48 rr_1iyu 1 . ALA 49 49 rr_1iyu 1 . GLY 50 50 rr_1iyu 1 . VAL 51 51 rr_1iyu 1 . VAL 52 52 rr_1iyu 1 . LYS 53 53 rr_1iyu 1 . SER 54 54 rr_1iyu 1 . VAL 55 55 rr_1iyu 1 . SER 56 56 rr_1iyu 1 . VAL 57 57 rr_1iyu 1 . LYS 58 58 rr_1iyu 1 . LEU 59 59 rr_1iyu 1 . GLY 60 60 rr_1iyu 1 . ASP 61 61 rr_1iyu 1 . LYS 62 62 rr_1iyu 1 . LEU 63 63 rr_1iyu 1 . LYS 64 64 rr_1iyu 1 . GLU 65 65 rr_1iyu 1 . GLY 66 66 rr_1iyu 1 . ASP 67 67 rr_1iyu 1 . ALA 68 68 rr_1iyu 1 . ILE 69 69 rr_1iyu 1 . ILE 70 70 rr_1iyu 1 . GLU 71 71 rr_1iyu 1 . LEU 72 72 rr_1iyu 1 . GLU 73 73 rr_1iyu 1 . PRO 74 74 rr_1iyu 1 . ALA 75 75 rr_1iyu 1 . ALA 76 76 rr_1iyu 1 . GLY 77 77 rr_1iyu 1 . ALA 78 78 rr_1iyu 1 . ARG 79 79 rr_1iyu 1 stop_ 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_1iyu _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_1iyu _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_1iyu 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_1iyu 1 stop_ loop_ _Atom_site.Assembly_ID _Atom_site.Model_ID _Atom_site.Model_site_ID _Atom_site.ID _Atom_site.Assembly_atom_ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Cartn_x_esd _Atom_site.Cartn_y_esd _Atom_site.Cartn_z_esd _Atom_site.Occupancy _Atom_site.Occupancy_esd _Atom_site.Uncertainty _Atom_site.Ordered_flag _Atom_site.Footnote_ID _Atom_site.PDBX_label_asym_ID _Atom_site.PDBX_label_seq_ID _Atom_site.PDBX_label_comp_ID _Atom_site.PDBX_label_atom_ID _Atom_site.PDBX_formal_charge _Atom_site.PDBX_label_entity_ID _Atom_site.PDB_record_ID _Atom_site.PDB_model_num _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Auth_entity_assembly_ID _Atom_site.Auth_asym_ID _Atom_site.Auth_chain_ID _Atom_site.Auth_seq_ID _Atom_site.Auth_comp_ID _Atom_site.Auth_atom_ID _Atom_site.Auth_alt_ID _Atom_site.Auth_atom_name _Atom_site.Details _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID . 1 . 1 . 1 1 1 SER C C 25.258 -1.844 28.318 . . . 1.0 . . . . . . . . . . . . A . 1 SER C . . . . . . . . . rr_1iyu 1 . 1 . 2 . 1 1 1 SER CA C 25.888 -1.498 29.669 . . . 1.0 . . . . . . . . . . . . A . 1 SER CA . . . . . . . . . rr_1iyu 1 . 1 . 3 . 1 1 1 SER CB C 24.792 -1.385 30.728 . . . 1.0 . . . . . . . . . . . . A . 1 SER CB . . . . . . . . . rr_1iyu 1 . 1 . 4 . 1 1 1 SER H1 H 26.992 -0.092 28.600 . . . 1.0 . . . . . . . . . . . . A . 1 SER H1 . . . . . . . . . rr_1iyu 1 . 1 . 5 . 1 1 1 SER H2 H 25.952 0.581 29.763 . . . 1.0 . . . . . . . . . . . . A . 1 SER H2 . . . . . . . . . rr_1iyu 1 . 1 . 6 . 1 1 1 SER H3 H 27.393 -0.179 30.246 . . . 1.0 . . . . . . . . . . . . A . 1 SER H3 . . . . . . . . . rr_1iyu 1 . 1 . 7 . 1 1 1 SER HA H 26.583 -2.274 29.951 . . . 1.0 . . . . . . . . . . . . A . 1 SER HA . . . . . . . . . rr_1iyu 1 . 1 . 8 . 1 1 1 SER HB2 H 24.315 -2.342 30.859 . . . 1.0 . . . . . . . . . . . . A . 1 SER HB2 . . . . . . . . . rr_1iyu 1 . 1 . 9 . 1 1 1 SER HB3 H 25.231 -1.072 31.667 . . . 1.0 . . . . . . . . . . . . A . 1 SER HB3 . . . . . . . . . rr_1iyu 1 . 1 . 10 . 1 1 1 SER HG H 23.488 0.016 31.082 . . . 1.0 . . . . . . . . . . . . A . 1 SER HG . . . . . . . . . rr_1iyu 1 . 1 . 11 . 1 1 1 SER N N 26.611 -0.199 29.561 . . . 1.0 . . . . . . . . . . . . A . 1 SER N . . . . . . . . . rr_1iyu 1 . 1 . 12 . 1 1 1 SER O O 25.117 -1.002 27.454 . . . 1.0 . . . . . . . . . . . . A . 1 SER O . . . . . . . . . rr_1iyu 1 . 1 . 13 . 1 1 1 SER OG O 23.824 -0.434 30.303 . . . 1.0 . . . . . . . . . . . . A . 1 SER OG . . . . . . . . . rr_1iyu 1 . 1 . 14 . 1 1 2 GLU C C 22.954 -4.229 27.104 . . . 1.0 . . . . . . . . . . . . A . 2 GLU C . . . . . . . . . rr_1iyu 1 . 1 . 15 . 1 1 2 GLU CA C 24.258 -3.477 26.834 . . . 1.0 . . . . . . . . . . . . A . 2 GLU CA . . . . . . . . . rr_1iyu 1 . 1 . 16 . 1 1 2 GLU CB C 25.221 -4.385 26.066 . . . 1.0 . . . . . . . . . . . . A . 2 GLU CB . . . . . . . . . rr_1iyu 1 . 1 . 17 . 1 1 2 GLU CD C 27.213 -4.361 24.557 . . . 1.0 . . . . . . . . . . . . A . 2 GLU CD . . . . . . . . . rr_1iyu 1 . 1 . 18 . 1 1 2 GLU CG C 26.439 -3.575 25.617 . . . 1.0 . . . . . . . . . . . . A . 2 GLU CG . . . . . . . . . rr_1iyu 1 . 1 . 19 . 1 1 2 GLU H H 25.001 -3.743 28.839 . . . 1.0 . . . . . . . . . . . . A . 2 GLU H . . . . . . . . . rr_1iyu 1 . 1 . 20 . 1 1 2 GLU HA H 24.051 -2.595 26.248 . . . 1.0 . . . . . . . . . . . . A . 2 GLU HA . . . . . . . . . rr_1iyu 1 . 1 . 21 . 1 1 2 GLU HB2 H 25.542 -5.194 26.707 . . . 1.0 . . . . . . . . . . . . A . 2 GLU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 22 . 1 1 2 GLU HB3 H 24.721 -4.789 25.199 . . . 1.0 . . . . . . . . . . . . A . 2 GLU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 23 . 1 1 2 GLU HG2 H 26.111 -2.634 25.200 . . . 1.0 . . . . . . . . . . . . A . 2 GLU HG2 . . . . . . . . . rr_1iyu 1 . 1 . 24 . 1 1 2 GLU HG3 H 27.081 -3.390 26.465 . . . 1.0 . . . . . . . . . . . . A . 2 GLU HG3 . . . . . . . . . rr_1iyu 1 . 1 . 25 . 1 1 2 GLU N N 24.879 -3.079 28.129 . . . 1.0 . . . . . . . . . . . . A . 2 GLU N . . . . . . . . . rr_1iyu 1 . 1 . 26 . 1 1 2 GLU O O 22.820 -4.926 28.090 . . . 1.0 . . . . . . . . . . . . A . 2 GLU O . . . . . . . . . rr_1iyu 1 . 1 . 27 . 1 1 2 GLU OE1 O 26.668 -5.327 24.048 . . . 1.0 . . . . . . . . . . . . A . 2 GLU OE1 . . . . . . . . . rr_1iyu 1 . 1 . 28 . 1 1 2 GLU OE2 O 28.338 -3.985 24.272 . . . 1.0 . . . . . . . . . . . . A . 2 GLU OE2 . . . . . . . . . rr_1iyu 1 . 1 . 29 . 1 1 3 ILE C C 20.760 -6.185 25.792 . . . 1.0 . . . . . . . . . . . . A . 3 ILE C . . . . . . . . . rr_1iyu 1 . 1 . 30 . 1 1 3 ILE CA C 20.695 -4.802 26.442 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CA . . . . . . . . . rr_1iyu 1 . 1 . 31 . 1 1 3 ILE CB C 19.564 -3.992 25.806 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CB . . . . . . . . . rr_1iyu 1 . 1 . 32 . 1 1 3 ILE CD1 C 19.112 -1.538 25.663 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CD1 . . . . . . . . . rr_1iyu 1 . 1 . 33 . 1 1 3 ILE CG1 C 19.335 -2.714 26.616 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG1 . . . . . . . . . rr_1iyu 1 . 1 . 34 . 1 1 3 ILE CG2 C 18.281 -4.826 25.797 . . . 1.0 . . . . . . . . . . . . A . 3 ILE CG2 . . . . . . . . . rr_1iyu 1 . 1 . 35 . 1 1 3 ILE H H 22.117 -3.528 25.445 . . . 1.0 . . . . . . . . . . . . A . 3 ILE H . . . . . . . . . rr_1iyu 1 . 1 . 36 . 1 1 3 ILE HA H 20.509 -4.910 27.500 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HA . . . . . . . . . rr_1iyu 1 . 1 . 37 . 1 1 3 ILE HB H 19.832 -3.735 24.791 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HB . . . . . . . . . rr_1iyu 1 . 1 . 38 . 1 1 3 ILE HD11 H 19.613 -1.734 24.726 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD11 . . . . . . . . . rr_1iyu 1 . 1 . 39 . 1 1 3 ILE HD12 H 18.054 -1.414 25.486 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD12 . . . . . . . . . rr_1iyu 1 . 1 . 40 . 1 1 3 ILE HD13 H 19.512 -0.637 26.103 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HD13 . . . . . . . . . rr_1iyu 1 . 1 . 41 . 1 1 3 ILE HG12 H 18.465 -2.838 27.246 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG12 . . . . . . . . . rr_1iyu 1 . 1 . 42 . 1 1 3 ILE HG13 H 20.200 -2.517 27.231 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG13 . . . . . . . . . rr_1iyu 1 . 1 . 43 . 1 1 3 ILE HG21 H 18.267 -5.474 26.661 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG21 . . . . . . . . . rr_1iyu 1 . 1 . 44 . 1 1 3 ILE HG22 H 17.424 -4.168 25.827 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG22 . . . . . . . . . rr_1iyu 1 . 1 . 45 . 1 1 3 ILE HG23 H 18.246 -5.423 24.898 . . . 1.0 . . . . . . . . . . . . A . 3 ILE HG23 . . . . . . . . . rr_1iyu 1 . 1 . 46 . 1 1 3 ILE N N 21.990 -4.094 26.234 . . . 1.0 . . . . . . . . . . . . A . 3 ILE N . . . . . . . . . rr_1iyu 1 . 1 . 47 . 1 1 3 ILE O O 21.318 -6.355 24.726 . . . 1.0 . . . . . . . . . . . . A . 3 ILE O . . . . . . . . . rr_1iyu 1 . 1 . 48 . 1 1 4 ILE C C 18.806 -8.970 25.456 . . . 1.0 . . . . . . . . . . . . A . 4 ILE C . . . . . . . . . rr_1iyu 1 . 1 . 49 . 1 1 4 ILE CA C 20.225 -8.547 25.843 . . . 1.0 . . . . . . . . . . . . A . 4 ILE CA . . . . . . . . . rr_1iyu 1 . 1 . 50 . 1 1 4 ILE CB C 20.785 -9.527 26.875 . . . 1.0 . . . . . . . . . . . . A . 4 ILE CB . . . . . . . . . rr_1iyu 1 . 1 . 51 . 1 1 4 ILE CD1 C 22.646 -9.324 28.531 . . . 1.0 . . . . . . . . . . . . A . 4 ILE CD1 . . . . . . . . . rr_1iyu 1 . 1 . 52 . 1 1 4 ILE CG1 C 22.286 -9.284 27.045 . . . 1.0 . . . . . . . . . . . . A . 4 ILE CG1 . . . . . . . . . rr_1iyu 1 . 1 . 53 . 1 1 4 ILE CG2 C 20.553 -10.962 26.397 . . . 1.0 . . . . . . . . . . . . A . 4 ILE CG2 . . . . . . . . . rr_1iyu 1 . 1 . 54 . 1 1 4 ILE H H 19.749 -7.018 27.284 . . . 1.0 . . . . . . . . . . . . A . 4 ILE H . . . . . . . . . rr_1iyu 1 . 1 . 55 . 1 1 4 ILE HA H 20.853 -8.551 24.965 . . . 1.0 . . . . . . . . . . . . A . 4 ILE HA . . . . . . . . . rr_1iyu 1 . 1 . 56 . 1 1 4 ILE HB H 20.284 -9.378 27.821 . . . 1.0 . . . . . . . . . . . . A . 4 ILE HB . . . . . . . . . rr_1iyu 1 . 1 . 57 . 1 1 4 ILE HD11 H 22.371 -10.284 28.942 . . . 1.0 . . . . . . . . . . . . A . 4 ILE HD11 . . . . . . . . . rr_1iyu 1 . 1 . 58 . 1 1 4 ILE HD12 H 23.708 -9.173 28.649 . . . 1.0 . . . . . . . . . . . . A . 4 ILE HD12 . . . . . . . . . rr_1iyu 1 . 1 . 59 . 1 1 4 ILE HD13 H 22.111 -8.543 29.052 . . . 1.0 . . . . . . . . . . . . A . 4 ILE HD13 . . . . . . . . . rr_1iyu 1 . 1 . 60 . 1 1 4 ILE HG12 H 22.836 -10.052 26.519 . . . 1.0 . . . . . . . . . . . . A . 4 ILE HG12 . . . . . . . . . rr_1iyu 1 . 1 . 61 . 1 1 4 ILE HG13 H 22.542 -8.317 26.640 . . . 1.0 . . . . . . . . . . . . A . 4 ILE HG13 . . . . . . . . . rr_1iyu 1 . 1 . 62 . 1 1 4 ILE HG21 H 20.067 -10.945 25.432 . . . 1.0 . . . . . . . . . . . . A . 4 ILE HG21 . . . . . . . . . rr_1iyu 1 . 1 . 63 . 1 1 4 ILE HG22 H 21.501 -11.471 26.313 . . . 1.0 . . . . . . . . . . . . A . 4 ILE HG22 . . . . . . . . . rr_1iyu 1 . 1 . 64 . 1 1 4 ILE HG23 H 19.927 -11.481 27.107 . . . 1.0 . . . . . . . . . . . . A . 4 ILE HG23 . . . . . . . . . rr_1iyu 1 . 1 . 65 . 1 1 4 ILE N N 20.194 -7.176 26.425 . . . 1.0 . . . . . . . . . . . . A . 4 ILE N . . . . . . . . . rr_1iyu 1 . 1 . 66 . 1 1 4 ILE O O 17.998 -9.310 26.298 . . . 1.0 . . . . . . . . . . . . A . 4 ILE O . . . . . . . . . rr_1iyu 1 . 1 . 67 . 1 1 5 ARG C C 17.110 -10.852 23.452 . . . 1.0 . . . . . . . . . . . . A . 5 ARG C . . . . . . . . . rr_1iyu 1 . 1 . 68 . 1 1 5 ARG CA C 17.129 -9.352 23.750 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CA . . . . . . . . . rr_1iyu 1 . 1 . 69 . 1 1 5 ARG CB C 16.751 -8.576 22.486 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CB . . . . . . . . . rr_1iyu 1 . 1 . 70 . 1 1 5 ARG CD C 18.091 -7.585 20.624 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CD . . . . . . . . . rr_1iyu 1 . 1 . 71 . 1 1 5 ARG CG C 17.766 -8.874 21.381 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CG . . . . . . . . . rr_1iyu 1 . 1 . 72 . 1 1 5 ARG CZ C 19.364 -7.276 18.587 . . . 1.0 . . . . . . . . . . . . A . 5 ARG CZ . . . . . . . . . rr_1iyu 1 . 1 . 73 . 1 1 5 ARG H H 19.162 -8.674 23.526 . . . 1.0 . . . . . . . . . . . . A . 5 ARG H . . . . . . . . . rr_1iyu 1 . 1 . 74 . 1 1 5 ARG HA H 16.420 -9.131 24.533 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HA . . . . . . . . . rr_1iyu 1 . 1 . 75 . 1 1 5 ARG HB2 H 15.765 -8.876 22.162 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB2 . . . . . . . . . rr_1iyu 1 . 1 . 76 . 1 1 5 ARG HB3 H 16.754 -7.518 22.699 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HB3 . . . . . . . . . rr_1iyu 1 . 1 . 77 . 1 1 5 ARG HD2 H 17.241 -6.921 20.663 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD2 . . . . . . . . . rr_1iyu 1 . 1 . 78 . 1 1 5 ARG HD3 H 18.944 -7.105 21.080 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HD3 . . . . . . . . . rr_1iyu 1 . 1 . 79 . 1 1 5 ARG HE H 17.888 -8.595 18.732 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HE . . . . . . . . . rr_1iyu 1 . 1 . 80 . 1 1 5 ARG HG2 H 18.670 -9.273 21.819 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG2 . . . . . . . . . rr_1iyu 1 . 1 . 81 . 1 1 5 ARG HG3 H 17.350 -9.597 20.695 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HG3 . . . . . . . . . rr_1iyu 1 . 1 . 82 . 1 1 5 ARG HH11 H 18.990 -5.523 19.478 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH11 . . . . . . . . . rr_1iyu 1 . 1 . 83 . 1 1 5 ARG HH12 H 20.305 -5.525 18.351 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH12 . . . . . . . . . rr_1iyu 1 . 1 . 84 . 1 1 5 ARG HH21 H 19.963 -8.881 17.551 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH21 . . . . . . . . . rr_1iyu 1 . 1 . 85 . 1 1 5 ARG HH22 H 20.856 -7.426 17.260 . . . 1.0 . . . . . . . . . . . . A . 5 ARG HH22 . . . . . . . . . rr_1iyu 1 . 1 . 86 . 1 1 5 ARG N N 18.496 -8.951 24.189 . . . 1.0 . . . . . . . . . . . . A . 5 ARG N . . . . . . . . . rr_1iyu 1 . 1 . 87 . 1 1 5 ARG NE N 18.404 -7.908 19.203 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NE . . . . . . . . . rr_1iyu 1 . 1 . 88 . 1 1 5 ARG NH1 N 19.569 -6.009 18.824 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH1 . . . . . . . . . rr_1iyu 1 . 1 . 89 . 1 1 5 ARG NH2 N 20.120 -7.911 17.733 . . . 1.0 . . . . . . . . . . . . A . 5 ARG NH2 . . . . . . . . . rr_1iyu 1 . 1 . 90 . 1 1 5 ARG O O 18.108 -11.534 23.580 . . . 1.0 . . . . . . . . . . . . A . 5 ARG O . . . . . . . . . rr_1iyu 1 . 1 . 91 . 1 1 6 VAL C C 16.765 -13.142 21.527 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 92 . 1 1 6 VAL CA C 15.899 -12.829 22.751 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 93 . 1 1 6 VAL CB C 14.445 -13.205 22.458 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 94 . 1 1 6 VAL CG1 C 14.385 -14.633 21.910 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 95 . 1 1 6 VAL CG2 C 13.628 -13.121 23.749 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 96 . 1 1 6 VAL H H 15.187 -10.807 22.959 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 97 . 1 1 6 VAL HA H 16.253 -13.394 23.600 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 98 . 1 1 6 VAL HB H 14.038 -12.522 21.726 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 99 . 1 1 6 VAL HG11 H 15.122 -14.750 21.130 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 100 . 1 1 6 VAL HG12 H 14.589 -15.332 22.707 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 101 . 1 1 6 VAL HG13 H 13.401 -14.822 21.508 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 102 . 1 1 6 VAL HG21 H 14.150 -13.639 24.540 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 103 . 1 1 6 VAL HG22 H 13.494 -12.085 24.023 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 104 . 1 1 6 VAL HG23 H 12.663 -13.580 23.594 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 105 . 1 1 6 VAL N N 15.981 -11.373 23.056 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 106 . 1 1 6 VAL O O 16.788 -12.387 20.575 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 107 . 1 1 7 PRO C C 17.515 -15.331 19.374 . . . 1.0 . . . . . . . . . . . . A . 7 PRO C . . . . . . . . . rr_1iyu 1 . 1 . 108 . 1 1 7 PRO CA C 18.337 -14.706 20.505 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CA . . . . . . . . . rr_1iyu 1 . 1 . 109 . 1 1 7 PRO CB C 19.225 -15.755 21.179 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CB . . . . . . . . . rr_1iyu 1 . 1 . 110 . 1 1 7 PRO CD C 17.413 -15.158 22.758 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CD . . . . . . . . . rr_1iyu 1 . 1 . 111 . 1 1 7 PRO CG C 18.449 -16.248 22.424 . . . 1.0 . . . . . . . . . . . . A . 7 PRO CG . . . . . . . . . rr_1iyu 1 . 1 . 112 . 1 1 7 PRO HA H 18.940 -13.892 20.136 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HA . . . . . . . . . rr_1iyu 1 . 1 . 113 . 1 1 7 PRO HB2 H 19.407 -16.577 20.500 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB2 . . . . . . . . . rr_1iyu 1 . 1 . 114 . 1 1 7 PRO HB3 H 20.159 -15.311 21.486 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HB3 . . . . . . . . . rr_1iyu 1 . 1 . 115 . 1 1 7 PRO HD2 H 16.429 -15.594 22.869 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD2 . . . . . . . . . rr_1iyu 1 . 1 . 116 . 1 1 7 PRO HD3 H 17.697 -14.626 23.652 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HD3 . . . . . . . . . rr_1iyu 1 . 1 . 117 . 1 1 7 PRO HG2 H 17.950 -17.182 22.201 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG2 . . . . . . . . . rr_1iyu 1 . 1 . 118 . 1 1 7 PRO HG3 H 19.124 -16.377 23.255 . . . 1.0 . . . . . . . . . . . . A . 7 PRO HG3 . . . . . . . . . rr_1iyu 1 . 1 . 119 . 1 1 7 PRO N N 17.453 -14.252 21.592 . . . 1.0 . . . . . . . . . . . . A . 7 PRO N . . . . . . . . . rr_1iyu 1 . 1 . 120 . 1 1 7 PRO O O 16.303 -15.252 19.357 . . . 1.0 . . . . . . . . . . . . A . 7 PRO O . . . . . . . . . rr_1iyu 1 . 1 . 121 . 1 1 8 ASP C C 16.932 -17.968 17.728 . . . 1.0 . . . . . . . . . . . . A . 8 ASP C . . . . . . . . . rr_1iyu 1 . 1 . 122 . 1 1 8 ASP CA C 17.424 -16.583 17.302 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CA . . . . . . . . . rr_1iyu 1 . 1 . 123 . 1 1 8 ASP CB C 18.352 -16.721 16.093 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CB . . . . . . . . . rr_1iyu 1 . 1 . 124 . 1 1 8 ASP CG C 17.566 -17.286 14.908 . . . 1.0 . . . . . . . . . . . . A . 8 ASP CG . . . . . . . . . rr_1iyu 1 . 1 . 125 . 1 1 8 ASP H H 19.144 -16.006 18.463 . . . 1.0 . . . . . . . . . . . . A . 8 ASP H . . . . . . . . . rr_1iyu 1 . 1 . 126 . 1 1 8 ASP HA H 16.578 -15.966 17.039 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HA . . . . . . . . . rr_1iyu 1 . 1 . 127 . 1 1 8 ASP HB2 H 18.750 -15.751 15.833 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB2 . . . . . . . . . rr_1iyu 1 . 1 . 128 . 1 1 8 ASP HB3 H 19.163 -17.390 16.337 . . . 1.0 . . . . . . . . . . . . A . 8 ASP HB3 . . . . . . . . . rr_1iyu 1 . 1 . 129 . 1 1 8 ASP N N 18.167 -15.953 18.430 . . . 1.0 . . . . . . . . . . . . A . 8 ASP N . . . . . . . . . rr_1iyu 1 . 1 . 130 . 1 1 8 ASP O O 17.704 -18.894 17.873 . . . 1.0 . . . . . . . . . . . . A . 8 ASP O . . . . . . . . . rr_1iyu 1 . 1 . 131 . 1 1 8 ASP OD1 O 16.413 -17.634 15.099 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD1 . . . . . . . . . rr_1iyu 1 . 1 . 132 . 1 1 8 ASP OD2 O 18.132 -17.361 13.830 . . . 1.0 . . . . . . . . . . . . A . 8 ASP OD2 . . . . . . . . . rr_1iyu 1 . 1 . 133 . 1 1 9 ILE C C 14.354 -20.073 17.180 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_1iyu 1 . 1 . 134 . 1 1 9 ILE CA C 15.112 -19.441 18.349 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_1iyu 1 . 1 . 135 . 1 1 9 ILE CB C 14.160 -19.262 19.536 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_1iyu 1 . 1 . 136 . 1 1 9 ILE CD1 C 13.060 -17.603 21.049 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_1iyu 1 . 1 . 137 . 1 1 9 ILE CG1 C 14.008 -17.773 19.861 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_1iyu 1 . 1 . 138 . 1 1 9 ILE CG2 C 14.725 -19.991 20.756 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_1iyu 1 . 1 . 139 . 1 1 9 ILE H H 15.044 -17.357 17.810 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_1iyu 1 . 1 . 140 . 1 1 9 ILE HA H 15.929 -20.086 18.637 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_1iyu 1 . 1 . 141 . 1 1 9 ILE HB H 13.194 -19.677 19.286 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_1iyu 1 . 1 . 142 . 1 1 9 ILE HD11 H 12.219 -18.271 20.937 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_1iyu 1 . 1 . 143 . 1 1 9 ILE HD12 H 13.584 -17.836 21.965 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_1iyu 1 . 1 . 144 . 1 1 9 ILE HD13 H 12.707 -16.583 21.085 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_1iyu 1 . 1 . 145 . 1 1 9 ILE HG12 H 14.975 -17.359 20.109 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_1iyu 1 . 1 . 146 . 1 1 9 ILE HG13 H 13.604 -17.257 19.004 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_1iyu 1 . 1 . 147 . 1 1 9 ILE HG21 H 15.781 -20.168 20.613 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_1iyu 1 . 1 . 148 . 1 1 9 ILE HG22 H 14.578 -19.385 21.638 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_1iyu 1 . 1 . 149 . 1 1 9 ILE HG23 H 14.216 -20.936 20.879 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_1iyu 1 . 1 . 150 . 1 1 9 ILE N N 15.651 -18.116 17.931 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_1iyu 1 . 1 . 151 . 1 1 9 ILE O O 14.297 -21.279 17.044 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_1iyu 1 . 1 . 152 . 1 1 10 GLY C C 11.526 -19.885 15.515 . . . 1.0 . . . . . . . . . . . . A . 10 GLY C . . . . . . . . . rr_1iyu 1 . 1 . 153 . 1 1 10 GLY CA C 13.016 -19.824 15.175 . . . 1.0 . . . . . . . . . . . . A . 10 GLY CA . . . . . . . . . rr_1iyu 1 . 1 . 154 . 1 1 10 GLY H H 13.827 -18.298 16.462 . . . 1.0 . . . . . . . . . . . . A . 10 GLY H . . . . . . . . . rr_1iyu 1 . 1 . 155 . 1 1 10 GLY HA2 H 13.165 -19.190 14.313 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA2 . . . . . . . . . rr_1iyu 1 . 1 . 156 . 1 1 10 GLY HA3 H 13.373 -20.819 14.957 . . . 1.0 . . . . . . . . . . . . A . 10 GLY HA3 . . . . . . . . . rr_1iyu 1 . 1 . 157 . 1 1 10 GLY N N 13.770 -19.268 16.335 . . . 1.0 . . . . . . . . . . . . A . 10 GLY N . . . . . . . . . rr_1iyu 1 . 1 . 158 . 1 1 10 GLY O O 10.741 -20.476 14.802 . . . 1.0 . . . . . . . . . . . . A . 10 GLY O . . . . . . . . . rr_1iyu 1 . 1 . 159 . 1 1 11 GLY C C 9.456 -18.339 18.150 . . . 1.0 . . . . . . . . . . . . A . 11 GLY C . . . . . . . . . rr_1iyu 1 . 1 . 160 . 1 1 11 GLY CA C 9.690 -19.301 16.984 . . . 1.0 . . . . . . . . . . . . A . 11 GLY CA . . . . . . . . . rr_1iyu 1 . 1 . 161 . 1 1 11 GLY H H 11.780 -18.805 17.162 . . . 1.0 . . . . . . . . . . . . A . 11 GLY H . . . . . . . . . rr_1iyu 1 . 1 . 162 . 1 1 11 GLY HA2 H 9.088 -18.999 16.139 . . . 1.0 . . . . . . . . . . . . A . 11 GLY HA2 . . . . . . . . . rr_1iyu 1 . 1 . 163 . 1 1 11 GLY HA3 H 9.414 -20.300 17.285 . . . 1.0 . . . . . . . . . . . . A . 11 GLY HA3 . . . . . . . . . rr_1iyu 1 . 1 . 164 . 1 1 11 GLY N N 11.130 -19.277 16.600 . . . 1.0 . . . . . . . . . . . . A . 11 GLY N . . . . . . . . . rr_1iyu 1 . 1 . 165 . 1 1 11 GLY O O 10.161 -17.362 18.313 . . . 1.0 . . . . . . . . . . . . A . 11 GLY O . . . . . . . . . rr_1iyu 1 . 1 . 166 . 1 1 12 ASP C C 8.923 -18.226 21.357 . . . 1.0 . . . . . . . . . . . . A . 12 ASP C . . . . . . . . . rr_1iyu 1 . 1 . 167 . 1 1 12 ASP CA C 8.192 -17.706 20.117 . . . 1.0 . . . . . . . . . . . . A . 12 ASP CA . . . . . . . . . rr_1iyu 1 . 1 . 168 . 1 1 12 ASP CB C 6.687 -17.675 20.388 . . . 1.0 . . . . . . . . . . . . A . 12 ASP CB . . . . . . . . . rr_1iyu 1 . 1 . 169 . 1 1 12 ASP CG C 6.026 -16.633 19.484 . . . 1.0 . . . . . . . . . . . . A . 12 ASP CG . . . . . . . . . rr_1iyu 1 . 1 . 170 . 1 1 12 ASP H H 7.914 -19.399 18.814 . . . 1.0 . . . . . . . . . . . . A . 12 ASP H . . . . . . . . . rr_1iyu 1 . 1 . 171 . 1 1 12 ASP HA H 8.538 -16.709 19.888 . . . 1.0 . . . . . . . . . . . . A . 12 ASP HA . . . . . . . . . rr_1iyu 1 . 1 . 172 . 1 1 12 ASP HB2 H 6.265 -18.649 20.186 . . . 1.0 . . . . . . . . . . . . A . 12 ASP HB2 . . . . . . . . . rr_1iyu 1 . 1 . 173 . 1 1 12 ASP HB3 H 6.512 -17.414 21.421 . . . 1.0 . . . . . . . . . . . . A . 12 ASP HB3 . . . . . . . . . rr_1iyu 1 . 1 . 174 . 1 1 12 ASP N N 8.471 -18.606 18.963 . . . 1.0 . . . . . . . . . . . . A . 12 ASP N . . . . . . . . . rr_1iyu 1 . 1 . 175 . 1 1 12 ASP O O 9.149 -19.410 21.505 . . . 1.0 . . . . . . . . . . . . A . 12 ASP O . . . . . . . . . rr_1iyu 1 . 1 . 176 . 1 1 12 ASP OD1 O 5.971 -15.481 19.882 . . . 1.0 . . . . . . . . . . . . A . 12 ASP OD1 . . . . . . . . . rr_1iyu 1 . 1 . 177 . 1 1 12 ASP OD2 O 5.587 -17.005 18.408 . . . 1.0 . . . . . . . . . . . . A . 12 ASP OD2 . . . . . . . . . rr_1iyu 1 . 1 . 178 . 1 1 13 GLY C C 9.174 -17.449 24.711 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_1iyu 1 . 1 . 179 . 1 1 13 GLY CA C 10.011 -17.794 23.478 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_1iyu 1 . 1 . 180 . 1 1 13 GLY H H 9.103 -16.398 22.111 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_1iyu 1 . 1 . 181 . 1 1 13 GLY HA2 H 10.168 -18.862 23.435 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_1iyu 1 . 1 . 182 . 1 1 13 GLY HA3 H 10.964 -17.291 23.542 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_1iyu 1 . 1 . 183 . 1 1 13 GLY N N 9.295 -17.349 22.249 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_1iyu 1 . 1 . 184 . 1 1 13 GLY O O 8.977 -16.295 25.036 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_1iyu 1 . 1 . 185 . 1 1 14 GLU C C 8.718 -18.338 27.863 . . . 1.0 . . . . . . . . . . . . A . 14 GLU C . . . . . . . . . rr_1iyu 1 . 1 . 186 . 1 1 14 GLU CA C 7.855 -18.167 26.611 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CA . . . . . . . . . rr_1iyu 1 . 1 . 187 . 1 1 14 GLU CB C 6.682 -19.149 26.662 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CB . . . . . . . . . rr_1iyu 1 . 1 . 188 . 1 1 14 GLU CD C 4.193 -19.331 26.781 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CD . . . . . . . . . rr_1iyu 1 . 1 . 189 . 1 1 14 GLU CG C 5.366 -18.379 26.542 . . . 1.0 . . . . . . . . . . . . A . 14 GLU CG . . . . . . . . . rr_1iyu 1 . 1 . 190 . 1 1 14 GLU H H 8.849 -19.364 25.121 . . . 1.0 . . . . . . . . . . . . A . 14 GLU H . . . . . . . . . rr_1iyu 1 . 1 . 191 . 1 1 14 GLU HA H 7.477 -17.156 26.570 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HA . . . . . . . . . rr_1iyu 1 . 1 . 192 . 1 1 14 GLU HB2 H 6.765 -19.851 25.845 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 193 . 1 1 14 GLU HB3 H 6.700 -19.683 27.600 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 194 . 1 1 14 GLU HG2 H 5.344 -17.587 27.276 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG2 . . . . . . . . . rr_1iyu 1 . 1 . 195 . 1 1 14 GLU HG3 H 5.286 -17.954 25.552 . . . 1.0 . . . . . . . . . . . . A . 14 GLU HG3 . . . . . . . . . rr_1iyu 1 . 1 . 196 . 1 1 14 GLU N N 8.679 -18.440 25.400 . . . 1.0 . . . . . . . . . . . . A . 14 GLU N . . . . . . . . . rr_1iyu 1 . 1 . 197 . 1 1 14 GLU O O 9.364 -19.350 28.051 . . . 1.0 . . . . . . . . . . . . A . 14 GLU O . . . . . . . . . rr_1iyu 1 . 1 . 198 . 1 1 14 GLU OE1 O 4.350 -20.511 26.515 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE1 . . . . . . . . . rr_1iyu 1 . 1 . 199 . 1 1 14 GLU OE2 O 3.158 -18.864 27.228 . . . 1.0 . . . . . . . . . . . . A . 14 GLU OE2 . . . . . . . . . rr_1iyu 1 . 1 . 200 . 1 1 15 VAL C C 8.925 -18.492 30.903 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 201 . 1 1 15 VAL CA C 9.555 -17.463 29.961 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 202 . 1 1 15 VAL CB C 9.610 -16.102 30.656 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 203 . 1 1 15 VAL CG1 C 10.543 -16.182 31.865 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 204 . 1 1 15 VAL CG2 C 10.136 -15.051 29.676 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 205 . 1 1 15 VAL H H 8.206 -16.548 28.553 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 206 . 1 1 15 VAL HA H 10.556 -17.777 29.703 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 207 . 1 1 15 VAL HB H 8.618 -15.826 30.985 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 208 . 1 1 15 VAL HG11 H 11.502 -16.571 31.555 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 209 . 1 1 15 VAL HG12 H 10.674 -15.196 32.285 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 210 . 1 1 15 VAL HG13 H 10.113 -16.836 32.609 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 211 . 1 1 15 VAL HG21 H 9.647 -15.172 28.721 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 212 . 1 1 15 VAL HG22 H 9.932 -14.064 30.062 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 213 . 1 1 15 VAL HG23 H 11.202 -15.176 29.552 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 214 . 1 1 15 VAL N N 8.734 -17.356 28.722 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 215 . 1 1 15 VAL O O 7.739 -18.463 31.166 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 216 . 1 1 16 ILE C C 9.503 -20.060 33.781 . . . 1.0 . . . . . . . . . . . . A . 16 ILE C . . . . . . . . . rr_1iyu 1 . 1 . 217 . 1 1 16 ILE CA C 9.155 -20.430 32.337 . . . 1.0 . . . . . . . . . . . . A . 16 ILE CA . . . . . . . . . rr_1iyu 1 . 1 . 218 . 1 1 16 ILE CB C 9.759 -21.795 32.001 . . . 1.0 . . . . . . . . . . . . A . 16 ILE CB . . . . . . . . . rr_1iyu 1 . 1 . 219 . 1 1 16 ILE CD1 C 7.904 -22.563 30.510 . . . 1.0 . . . . . . . . . . . . A . 16 ILE CD1 . . . . . . . . . rr_1iyu 1 . 1 . 220 . 1 1 16 ILE CG1 C 9.384 -22.178 30.567 . . . 1.0 . . . . . . . . . . . . A . 16 ILE CG1 . . . . . . . . . rr_1iyu 1 . 1 . 221 . 1 1 16 ILE CG2 C 9.213 -22.847 32.969 . . . 1.0 . . . . . . . . . . . . A . 16 ILE CG2 . . . . . . . . . rr_1iyu 1 . 1 . 222 . 1 1 16 ILE H H 10.664 -19.407 31.189 . . . 1.0 . . . . . . . . . . . . A . 16 ILE H . . . . . . . . . rr_1iyu 1 . 1 . 223 . 1 1 16 ILE HA H 8.082 -20.474 32.226 . . . 1.0 . . . . . . . . . . . . A . 16 ILE HA . . . . . . . . . rr_1iyu 1 . 1 . 224 . 1 1 16 ILE HB H 10.834 -21.745 32.093 . . . 1.0 . . . . . . . . . . . . A . 16 ILE HB . . . . . . . . . rr_1iyu 1 . 1 . 225 . 1 1 16 ILE HD11 H 7.341 -21.930 31.180 . . . 1.0 . . . . . . . . . . . . A . 16 ILE HD11 . . . . . . . . . rr_1iyu 1 . 1 . 226 . 1 1 16 ILE HD12 H 7.538 -22.436 29.502 . . . 1.0 . . . . . . . . . . . . A . 16 ILE HD12 . . . . . . . . . rr_1iyu 1 . 1 . 227 . 1 1 16 ILE HD13 H 7.789 -23.595 30.808 . . . 1.0 . . . . . . . . . . . . A . 16 ILE HD13 . . . . . . . . . rr_1iyu 1 . 1 . 228 . 1 1 16 ILE HG12 H 9.564 -21.338 29.912 . . . 1.0 . . . . . . . . . . . . A . 16 ILE HG12 . . . . . . . . . rr_1iyu 1 . 1 . 229 . 1 1 16 ILE HG13 H 9.984 -23.017 30.250 . . . 1.0 . . . . . . . . . . . . A . 16 ILE HG13 . . . . . . . . . rr_1iyu 1 . 1 . 230 . 1 1 16 ILE HG21 H 8.134 -22.856 32.920 . . . 1.0 . . . . . . . . . . . . A . 16 ILE HG21 . . . . . . . . . rr_1iyu 1 . 1 . 231 . 1 1 16 ILE HG22 H 9.594 -23.820 32.695 . . . 1.0 . . . . . . . . . . . . A . 16 ILE HG22 . . . . . . . . . rr_1iyu 1 . 1 . 232 . 1 1 16 ILE HG23 H 9.526 -22.608 33.974 . . . 1.0 . . . . . . . . . . . . A . 16 ILE HG23 . . . . . . . . . rr_1iyu 1 . 1 . 233 . 1 1 16 ILE N N 9.710 -19.401 31.413 . . . 1.0 . . . . . . . . . . . . A . 16 ILE N . . . . . . . . . rr_1iyu 1 . 1 . 234 . 1 1 16 ILE O O 8.646 -19.993 34.638 . . . 1.0 . . . . . . . . . . . . A . 16 ILE O . . . . . . . . . rr_1iyu 1 . 1 . 235 . 1 1 17 GLU C C 12.320 -18.461 35.394 . . . 1.0 . . . . . . . . . . . . A . 17 GLU C . . . . . . . . . rr_1iyu 1 . 1 . 236 . 1 1 17 GLU CA C 11.157 -19.455 35.444 . . . 1.0 . . . . . . . . . . . . A . 17 GLU CA . . . . . . . . . rr_1iyu 1 . 1 . 237 . 1 1 17 GLU CB C 11.595 -20.714 36.196 . . . 1.0 . . . . . . . . . . . . A . 17 GLU CB . . . . . . . . . rr_1iyu 1 . 1 . 238 . 1 1 17 GLU CD C 10.835 -21.978 38.213 . . . 1.0 . . . . . . . . . . . . A . 17 GLU CD . . . . . . . . . rr_1iyu 1 . 1 . 239 . 1 1 17 GLU CG C 11.195 -20.595 37.668 . . . 1.0 . . . . . . . . . . . . A . 17 GLU CG . . . . . . . . . rr_1iyu 1 . 1 . 240 . 1 1 17 GLU H H 11.433 -19.880 33.350 . . . 1.0 . . . . . . . . . . . . A . 17 GLU H . . . . . . . . . rr_1iyu 1 . 1 . 241 . 1 1 17 GLU HA H 10.319 -19.004 35.954 . . . 1.0 . . . . . . . . . . . . A . 17 GLU HA . . . . . . . . . rr_1iyu 1 . 1 . 242 . 1 1 17 GLU HB2 H 11.115 -21.578 35.760 . . . 1.0 . . . . . . . . . . . . A . 17 GLU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 243 . 1 1 17 GLU HB3 H 12.666 -20.823 36.124 . . . 1.0 . . . . . . . . . . . . A . 17 GLU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 244 . 1 1 17 GLU HG2 H 12.021 -20.188 38.233 . . . 1.0 . . . . . . . . . . . . A . 17 GLU HG2 . . . . . . . . . rr_1iyu 1 . 1 . 245 . 1 1 17 GLU HG3 H 10.340 -19.942 37.757 . . . 1.0 . . . . . . . . . . . . A . 17 GLU HG3 . . . . . . . . . rr_1iyu 1 . 1 . 246 . 1 1 17 GLU N N 10.756 -19.820 34.056 . . . 1.0 . . . . . . . . . . . . A . 17 GLU N . . . . . . . . . rr_1iyu 1 . 1 . 247 . 1 1 17 GLU O O 12.967 -18.299 34.379 . . . 1.0 . . . . . . . . . . . . A . 17 GLU O . . . . . . . . . rr_1iyu 1 . 1 . 248 . 1 1 17 GLU OE1 O 9.764 -22.462 37.884 . . . 1.0 . . . . . . . . . . . . A . 17 GLU OE1 . . . . . . . . . rr_1iyu 1 . 1 . 249 . 1 1 17 GLU OE2 O 11.636 -22.531 38.949 . . . 1.0 . . . . . . . . . . . . A . 17 GLU OE2 . . . . . . . . . rr_1iyu 1 . 1 . 250 . 1 1 18 LEU C C 14.647 -17.124 37.666 . . . 1.0 . . . . . . . . . . . . A . 18 LEU C . . . . . . . . . rr_1iyu 1 . 1 . 251 . 1 1 18 LEU CA C 13.709 -16.812 36.498 . . . 1.0 . . . . . . . . . . . . A . 18 LEU CA . . . . . . . . . rr_1iyu 1 . 1 . 252 . 1 1 18 LEU CB C 13.146 -15.399 36.660 . . . 1.0 . . . . . . . . . . . . A . 18 LEU CB . . . . . . . . . rr_1iyu 1 . 1 . 253 . 1 1 18 LEU CD1 C 13.284 -14.256 34.443 . . . 1.0 . . . . . . . . . . . . A . 18 LEU CD1 . . . . . . . . . rr_1iyu 1 . 1 . 254 . 1 1 18 LEU CD2 C 14.027 -13.067 36.510 . . . 1.0 . . . . . . . . . . . . A . 18 LEU CD2 . . . . . . . . . rr_1iyu 1 . 1 . 255 . 1 1 18 LEU CG C 13.958 -14.424 35.806 . . . 1.0 . . . . . . . . . . . . A . 18 LEU CG . . . . . . . . . rr_1iyu 1 . 1 . 256 . 1 1 18 LEU H H 12.055 -17.940 37.292 . . . 1.0 . . . . . . . . . . . . A . 18 LEU H . . . . . . . . . rr_1iyu 1 . 1 . 257 . 1 1 18 LEU HA H 14.257 -16.877 35.569 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HA . . . . . . . . . rr_1iyu 1 . 1 . 258 . 1 1 18 LEU HB2 H 12.113 -15.384 36.342 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 259 . 1 1 18 LEU HB3 H 13.207 -15.103 37.697 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 260 . 1 1 18 LEU HD11 H 12.472 -14.962 34.353 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD11 . . . . . . . . . rr_1iyu 1 . 1 . 261 . 1 1 18 LEU HD12 H 12.900 -13.251 34.353 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD12 . . . . . . . . . rr_1iyu 1 . 1 . 262 . 1 1 18 LEU HD13 H 14.006 -14.437 33.660 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD13 . . . . . . . . . rr_1iyu 1 . 1 . 263 . 1 1 18 LEU HD21 H 13.066 -12.838 36.947 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD21 . . . . . . . . . rr_1iyu 1 . 1 . 264 . 1 1 18 LEU HD22 H 14.777 -13.101 37.286 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD22 . . . . . . . . . rr_1iyu 1 . 1 . 265 . 1 1 18 LEU HD23 H 14.287 -12.302 35.792 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HD23 . . . . . . . . . rr_1iyu 1 . 1 . 266 . 1 1 18 LEU HG H 14.956 -14.812 35.669 . . . 1.0 . . . . . . . . . . . . A . 18 LEU HG . . . . . . . . . rr_1iyu 1 . 1 . 267 . 1 1 18 LEU N N 12.589 -17.795 36.484 . . . 1.0 . . . . . . . . . . . . A . 18 LEU N . . . . . . . . . rr_1iyu 1 . 1 . 268 . 1 1 18 LEU O O 14.274 -17.023 38.818 . . . 1.0 . . . . . . . . . . . . A . 18 LEU O . . . . . . . . . rr_1iyu 1 . 1 . 269 . 1 1 19 LEU C C 17.802 -16.661 38.645 . . . 1.0 . . . . . . . . . . . . A . 19 LEU C . . . . . . . . . rr_1iyu 1 . 1 . 270 . 1 1 19 LEU CA C 16.821 -17.823 38.472 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CA . . . . . . . . . rr_1iyu 1 . 1 . 271 . 1 1 19 LEU CB C 17.595 -19.095 38.118 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CB . . . . . . . . . rr_1iyu 1 . 1 . 272 . 1 1 19 LEU CD1 C 19.590 -19.366 36.638 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD1 . . . . . . . . . rr_1iyu 1 . 1 . 273 . 1 1 19 LEU CD2 C 17.317 -19.964 35.793 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CD2 . . . . . . . . . rr_1iyu 1 . 1 . 274 . 1 1 19 LEU CG C 18.106 -18.998 36.680 . . . 1.0 . . . . . . . . . . . . A . 19 LEU CG . . . . . . . . . rr_1iyu 1 . 1 . 275 . 1 1 19 LEU H H 16.143 -17.581 36.442 . . . 1.0 . . . . . . . . . . . . A . 19 LEU H . . . . . . . . . rr_1iyu 1 . 1 . 276 . 1 1 19 LEU HA H 16.279 -17.977 39.394 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HA . . . . . . . . . rr_1iyu 1 . 1 . 277 . 1 1 19 LEU HB2 H 18.433 -19.206 38.792 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 278 . 1 1 19 LEU HB3 H 16.943 -19.951 38.209 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 279 . 1 1 19 LEU HD11 H 19.855 -19.896 37.541 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD11 . . . . . . . . . rr_1iyu 1 . 1 . 280 . 1 1 19 LEU HD12 H 19.781 -19.996 35.782 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD12 . . . . . . . . . rr_1iyu 1 . 1 . 281 . 1 1 19 LEU HD13 H 20.182 -18.466 36.562 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD13 . . . . . . . . . rr_1iyu 1 . 1 . 282 . 1 1 19 LEU HD21 H 16.988 -20.806 36.383 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD21 . . . . . . . . . rr_1iyu 1 . 1 . 283 . 1 1 19 LEU HD22 H 16.459 -19.455 35.381 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD22 . . . . . . . . . rr_1iyu 1 . 1 . 284 . 1 1 19 LEU HD23 H 17.949 -20.312 34.989 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HD23 . . . . . . . . . rr_1iyu 1 . 1 . 285 . 1 1 19 LEU HG H 17.976 -17.987 36.319 . . . 1.0 . . . . . . . . . . . . A . 19 LEU HG . . . . . . . . . rr_1iyu 1 . 1 . 286 . 1 1 19 LEU N N 15.862 -17.505 37.378 . . . 1.0 . . . . . . . . . . . . A . 19 LEU N . . . . . . . . . rr_1iyu 1 . 1 . 287 . 1 1 19 LEU O O 18.969 -16.857 38.922 . . . 1.0 . . . . . . . . . . . . A . 19 LEU O . . . . . . . . . rr_1iyu 1 . 1 . 288 . 1 1 20 VAL C C 17.517 -13.171 39.405 . . . 1.0 . . . . . . . . . . . . A . 20 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 289 . 1 1 20 VAL CA C 18.244 -14.280 38.641 . . . 1.0 . . . . . . . . . . . . A . 20 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 290 . 1 1 20 VAL CB C 18.652 -13.763 37.260 . . . 1.0 . . . . . . . . . . . . A . 20 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 291 . 1 1 20 VAL CG1 C 19.627 -14.748 36.614 . . . 1.0 . . . . . . . . . . . . A . 20 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 292 . 1 1 20 VAL CG2 C 17.407 -13.628 36.379 . . . 1.0 . . . . . . . . . . . . A . 20 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 293 . 1 1 20 VAL H H 16.393 -15.315 38.262 . . . 1.0 . . . . . . . . . . . . A . 20 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 294 . 1 1 20 VAL HA H 19.126 -14.576 39.189 . . . 1.0 . . . . . . . . . . . . A . 20 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 295 . 1 1 20 VAL HB H 19.129 -12.799 37.363 . . . 1.0 . . . . . . . . . . . . A . 20 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 296 . 1 1 20 VAL HG11 H 20.217 -15.227 37.381 . . . 1.0 . . . . . . . . . . . . A . 20 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 297 . 1 1 20 VAL HG12 H 19.074 -15.497 36.066 . . . 1.0 . . . . . . . . . . . . A . 20 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 298 . 1 1 20 VAL HG13 H 20.280 -14.217 35.937 . . . 1.0 . . . . . . . . . . . . A . 20 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 299 . 1 1 20 VAL HG21 H 16.525 -13.825 36.970 . . . 1.0 . . . . . . . . . . . . A . 20 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 300 . 1 1 20 VAL HG22 H 17.357 -12.626 35.979 . . . 1.0 . . . . . . . . . . . . A . 20 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 301 . 1 1 20 VAL HG23 H 17.462 -14.338 35.567 . . . 1.0 . . . . . . . . . . . . A . 20 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 302 . 1 1 20 VAL N N 17.338 -15.452 38.485 . . . 1.0 . . . . . . . . . . . . A . 20 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 303 . 1 1 20 VAL O O 16.333 -13.257 39.665 . . . 1.0 . . . . . . . . . . . . A . 20 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 304 . 1 1 21 LYS C C 18.214 -9.690 40.123 . . . 1.0 . . . . . . . . . . . . A . 21 LYS C . . . . . . . . . rr_1iyu 1 . 1 . 305 . 1 1 21 LYS CA C 17.563 -11.019 40.514 . . . 1.0 . . . . . . . . . . . . A . 21 LYS CA . . . . . . . . . rr_1iyu 1 . 1 . 306 . 1 1 21 LYS CB C 17.732 -11.246 42.018 . . . 1.0 . . . . . . . . . . . . A . 21 LYS CB . . . . . . . . . rr_1iyu 1 . 1 . 307 . 1 1 21 LYS CD C 16.542 -12.003 44.081 . . . 1.0 . . . . . . . . . . . . A . 21 LYS CD . . . . . . . . . rr_1iyu 1 . 1 . 308 . 1 1 21 LYS CE C 15.259 -12.702 44.534 . . . 1.0 . . . . . . . . . . . . A . 21 LYS CE . . . . . . . . . rr_1iyu 1 . 1 . 309 . 1 1 21 LYS CG C 16.361 -11.473 42.658 . . . 1.0 . . . . . . . . . . . . A . 21 LYS CG . . . . . . . . . rr_1iyu 1 . 1 . 310 . 1 1 21 LYS H H 19.170 -12.080 39.548 . . . 1.0 . . . . . . . . . . . . A . 21 LYS H . . . . . . . . . rr_1iyu 1 . 1 . 311 . 1 1 21 LYS HA H 16.512 -10.990 40.271 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HA . . . . . . . . . rr_1iyu 1 . 1 . 312 . 1 1 21 LYS HB2 H 18.355 -12.113 42.183 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HB2 . . . . . . . . . rr_1iyu 1 . 1 . 313 . 1 1 21 LYS HB3 H 18.196 -10.379 42.464 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HB3 . . . . . . . . . rr_1iyu 1 . 1 . 314 . 1 1 21 LYS HD2 H 17.362 -12.706 44.101 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HD2 . . . . . . . . . rr_1iyu 1 . 1 . 315 . 1 1 21 LYS HD3 H 16.756 -11.181 44.747 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HD3 . . . . . . . . . rr_1iyu 1 . 1 . 316 . 1 1 21 LYS HE2 H 14.412 -12.265 44.024 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HE2 . . . . . . . . . rr_1iyu 1 . 1 . 317 . 1 1 21 LYS HE3 H 15.319 -13.754 44.297 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HE3 . . . . . . . . . rr_1iyu 1 . 1 . 318 . 1 1 21 LYS HG2 H 15.819 -10.538 42.687 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HG2 . . . . . . . . . rr_1iyu 1 . 1 . 319 . 1 1 21 LYS HG3 H 15.806 -12.193 42.075 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HG3 . . . . . . . . . rr_1iyu 1 . 1 . 320 . 1 1 21 LYS HZ1 H 15.352 -11.561 46.273 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HZ1 . . . . . . . . . rr_1iyu 1 . 1 . 321 . 1 1 21 LYS HZ2 H 14.103 -12.713 46.266 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HZ2 . . . . . . . . . rr_1iyu 1 . 1 . 322 . 1 1 21 LYS HZ3 H 15.708 -13.207 46.503 . . . 1.0 . . . . . . . . . . . . A . 21 LYS HZ3 . . . . . . . . . rr_1iyu 1 . 1 . 323 . 1 1 21 LYS N N 18.216 -12.131 39.767 . . . 1.0 . . . . . . . . . . . . A . 21 LYS N . . . . . . . . . rr_1iyu 1 . 1 . 324 . 1 1 21 LYS NZ N 15.093 -12.533 46.005 . . . 1.0 . . . . . . . . . . . . A . 21 LYS NZ . . . . . . . . . rr_1iyu 1 . 1 . 325 . 1 1 21 LYS O O 19.158 -9.652 39.359 . . . 1.0 . . . . . . . . . . . . A . 21 LYS O . . . . . . . . . rr_1iyu 1 . 1 . 326 . 1 1 22 THR C C 19.498 -6.995 41.218 . . . 1.0 . . . . . . . . . . . . A . 22 THR C . . . . . . . . . rr_1iyu 1 . 1 . 327 . 1 1 22 THR CA C 18.308 -7.276 40.298 . . . 1.0 . . . . . . . . . . . . A . 22 THR CA . . . . . . . . . rr_1iyu 1 . 1 . 328 . 1 1 22 THR CB C 17.252 -6.183 40.482 . . . 1.0 . . . . . . . . . . . . A . 22 THR CB . . . . . . . . . rr_1iyu 1 . 1 . 329 . 1 1 22 THR CG2 C 17.919 -4.809 40.417 . . . 1.0 . . . . . . . . . . . . A . 22 THR CG2 . . . . . . . . . rr_1iyu 1 . 1 . 330 . 1 1 22 THR H H 16.955 -8.653 41.255 . . . 1.0 . . . . . . . . . . . . A . 22 THR H . . . . . . . . . rr_1iyu 1 . 1 . 331 . 1 1 22 THR HA H 18.641 -7.285 39.271 . . . 1.0 . . . . . . . . . . . . A . 22 THR HA . . . . . . . . . rr_1iyu 1 . 1 . 332 . 1 1 22 THR HB H 16.774 -6.302 41.442 . . . 1.0 . . . . . . . . . . . . A . 22 THR HB . . . . . . . . . rr_1iyu 1 . 1 . 333 . 1 1 22 THR HG1 H 15.583 -5.655 39.634 . . . 1.0 . . . . . . . . . . . . A . 22 THR HG1 . . . . . . . . . rr_1iyu 1 . 1 . 334 . 1 1 22 THR HG21 H 18.510 -4.738 39.516 . . . 1.0 . . . . . . . . . . . . A . 22 THR HG21 . . . . . . . . . rr_1iyu 1 . 1 . 335 . 1 1 22 THR HG22 H 17.161 -4.040 40.412 . . . 1.0 . . . . . . . . . . . . A . 22 THR HG22 . . . . . . . . . rr_1iyu 1 . 1 . 336 . 1 1 22 THR HG23 H 18.559 -4.679 41.278 . . . 1.0 . . . . . . . . . . . . A . 22 THR HG23 . . . . . . . . . rr_1iyu 1 . 1 . 337 . 1 1 22 THR N N 17.717 -8.600 40.641 . . . 1.0 . . . . . . . . . . . . A . 22 THR N . . . . . . . . . rr_1iyu 1 . 1 . 338 . 1 1 22 THR O O 19.429 -7.190 42.415 . . . 1.0 . . . . . . . . . . . . A . 22 THR O . . . . . . . . . rr_1iyu 1 . 1 . 339 . 1 1 22 THR OG1 O 16.279 -6.289 39.451 . . . 1.0 . . . . . . . . . . . . A . 22 THR OG1 . . . . . . . . . rr_1iyu 1 . 1 . 340 . 1 1 23 GLY C C 22.592 -7.525 41.719 . . . 1.0 . . . . . . . . . . . . A . 23 GLY C . . . . . . . . . rr_1iyu 1 . 1 . 341 . 1 1 23 GLY CA C 21.782 -6.244 41.511 . . . 1.0 . . . . . . . . . . . . A . 23 GLY CA . . . . . . . . . rr_1iyu 1 . 1 . 342 . 1 1 23 GLY H H 20.624 -6.386 39.700 . . . 1.0 . . . . . . . . . . . . A . 23 GLY H . . . . . . . . . rr_1iyu 1 . 1 . 343 . 1 1 23 GLY HA2 H 22.397 -5.503 41.018 . . . 1.0 . . . . . . . . . . . . A . 23 GLY HA2 . . . . . . . . . rr_1iyu 1 . 1 . 344 . 1 1 23 GLY HA3 H 21.462 -5.865 42.470 . . . 1.0 . . . . . . . . . . . . A . 23 GLY HA3 . . . . . . . . . rr_1iyu 1 . 1 . 345 . 1 1 23 GLY N N 20.589 -6.537 40.668 . . . 1.0 . . . . . . . . . . . . A . 23 GLY N . . . . . . . . . rr_1iyu 1 . 1 . 346 . 1 1 23 GLY O O 23.636 -7.517 42.340 . . . 1.0 . . . . . . . . . . . . A . 23 GLY O . . . . . . . . . rr_1iyu 1 . 1 . 347 . 1 1 24 ASP C C 23.927 -10.027 40.282 . . . 1.0 . . . . . . . . . . . . A . 24 ASP C . . . . . . . . . rr_1iyu 1 . 1 . 348 . 1 1 24 ASP CA C 22.863 -9.907 41.374 . . . 1.0 . . . . . . . . . . . . A . 24 ASP CA . . . . . . . . . rr_1iyu 1 . 1 . 349 . 1 1 24 ASP CB C 21.888 -11.082 41.268 . . . 1.0 . . . . . . . . . . . . A . 24 ASP CB . . . . . . . . . rr_1iyu 1 . 1 . 350 . 1 1 24 ASP CG C 21.159 -11.263 42.601 . . . 1.0 . . . . . . . . . . . . A . 24 ASP CG . . . . . . . . . rr_1iyu 1 . 1 . 351 . 1 1 24 ASP H H 21.275 -8.614 40.707 . . . 1.0 . . . . . . . . . . . . A . 24 ASP H . . . . . . . . . rr_1iyu 1 . 1 . 352 . 1 1 24 ASP HA H 23.339 -9.921 42.344 . . . 1.0 . . . . . . . . . . . . A . 24 ASP HA . . . . . . . . . rr_1iyu 1 . 1 . 353 . 1 1 24 ASP HB2 H 21.169 -10.883 40.487 . . . 1.0 . . . . . . . . . . . . A . 24 ASP HB2 . . . . . . . . . rr_1iyu 1 . 1 . 354 . 1 1 24 ASP HB3 H 22.435 -11.983 41.034 . . . 1.0 . . . . . . . . . . . . A . 24 ASP HB3 . . . . . . . . . rr_1iyu 1 . 1 . 355 . 1 1 24 ASP N N 22.119 -8.628 41.205 . . . 1.0 . . . . . . . . . . . . A . 24 ASP N . . . . . . . . . rr_1iyu 1 . 1 . 356 . 1 1 24 ASP O O 23.657 -9.829 39.114 . . . 1.0 . . . . . . . . . . . . A . 24 ASP O . . . . . . . . . rr_1iyu 1 . 1 . 357 . 1 1 24 ASP OD1 O 21.217 -10.355 43.413 . . . 1.0 . . . . . . . . . . . . A . 24 ASP OD1 . . . . . . . . . rr_1iyu 1 . 1 . 358 . 1 1 24 ASP OD2 O 20.556 -12.307 42.786 . . . 1.0 . . . . . . . . . . . . A . 24 ASP OD2 . . . . . . . . . rr_1iyu 1 . 1 . 359 . 1 1 25 LEU C C 26.214 -11.908 39.072 . . . 1.0 . . . . . . . . . . . . A . 25 LEU C . . . . . . . . . rr_1iyu 1 . 1 . 360 . 1 1 25 LEU CA C 26.216 -10.485 39.634 . . . 1.0 . . . . . . . . . . . . A . 25 LEU CA . . . . . . . . . rr_1iyu 1 . 1 . 361 . 1 1 25 LEU CB C 27.570 -10.195 40.286 . . . 1.0 . . . . . . . . . . . . A . 25 LEU CB . . . . . . . . . rr_1iyu 1 . 1 . 362 . 1 1 25 LEU CD1 C 28.790 -8.157 39.512 . . . 1.0 . . . . . . . . . . . . A . 25 LEU CD1 . . . . . . . . . rr_1iyu 1 . 1 . 363 . 1 1 25 LEU CD2 C 29.857 -10.406 39.306 . . . 1.0 . . . . . . . . . . . . A . 25 LEU CD2 . . . . . . . . . rr_1iyu 1 . 1 . 364 . 1 1 25 LEU CG C 28.534 -9.640 39.237 . . . 1.0 . . . . . . . . . . . . A . 25 LEU CG . . . . . . . . . rr_1iyu 1 . 1 . 365 . 1 1 25 LEU H H 25.333 -10.508 41.599 . . . 1.0 . . . . . . . . . . . . A . 25 LEU H . . . . . . . . . rr_1iyu 1 . 1 . 366 . 1 1 25 LEU HA H 26.045 -9.781 38.833 . . . 1.0 . . . . . . . . . . . . A . 25 LEU HA . . . . . . . . . rr_1iyu 1 . 1 . 367 . 1 1 25 LEU HB2 H 27.441 -9.471 41.077 . . . 1.0 . . . . . . . . . . . . A . 25 LEU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 368 . 1 1 25 LEU HB3 H 27.974 -11.108 40.696 . . . 1.0 . . . . . . . . . . . . A . 25 LEU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 369 . 1 1 25 LEU HD11 H 28.162 -7.829 40.326 . . . 1.0 . . . . . . . . . . . . A . 25 LEU HD11 . . . . . . . . . rr_1iyu 1 . 1 . 370 . 1 1 25 LEU HD12 H 29.827 -8.014 39.776 . . . 1.0 . . . . . . . . . . . . A . 25 LEU HD12 . . . . . . . . . rr_1iyu 1 . 1 . 371 . 1 1 25 LEU HD13 H 28.562 -7.583 38.626 . . . 1.0 . . . . . . . . . . . . A . 25 LEU HD13 . . . . . . . . . rr_1iyu 1 . 1 . 372 . 1 1 25 LEU HD21 H 29.658 -11.467 39.337 . . . 1.0 . . . . . . . . . . . . A . 25 LEU HD21 . . . . . . . . . rr_1iyu 1 . 1 . 373 . 1 1 25 LEU HD22 H 30.452 -10.177 38.434 . . . 1.0 . . . . . . . . . . . . A . 25 LEU HD22 . . . . . . . . . rr_1iyu 1 . 1 . 374 . 1 1 25 LEU HD23 H 30.396 -10.115 40.196 . . . 1.0 . . . . . . . . . . . . A . 25 LEU HD23 . . . . . . . . . rr_1iyu 1 . 1 . 375 . 1 1 25 LEU HG H 28.101 -9.754 38.254 . . . 1.0 . . . . . . . . . . . . A . 25 LEU HG . . . . . . . . . rr_1iyu 1 . 1 . 376 . 1 1 25 LEU N N 25.136 -10.352 40.652 . . . 1.0 . . . . . . . . . . . . A . 25 LEU N . . . . . . . . . rr_1iyu 1 . 1 . 377 . 1 1 25 LEU O O 26.356 -12.872 39.797 . . . 1.0 . . . . . . . . . . . . A . 25 LEU O . . . . . . . . . rr_1iyu 1 . 1 . 378 . 1 1 26 ILE C C 27.449 -13.756 36.692 . . . 1.0 . . . . . . . . . . . . A . 26 ILE C . . . . . . . . . rr_1iyu 1 . 1 . 379 . 1 1 26 ILE CA C 26.041 -13.405 37.177 . . . 1.0 . . . . . . . . . . . . A . 26 ILE CA . . . . . . . . . rr_1iyu 1 . 1 . 380 . 1 1 26 ILE CB C 25.074 -13.412 35.994 . . . 1.0 . . . . . . . . . . . . A . 26 ILE CB . . . . . . . . . rr_1iyu 1 . 1 . 381 . 1 1 26 ILE CD1 C 22.929 -12.481 35.112 . . . 1.0 . . . . . . . . . . . . A . 26 ILE CD1 . . . . . . . . . rr_1iyu 1 . 1 . 382 . 1 1 26 ILE CG1 C 23.873 -12.519 36.315 . . . 1.0 . . . . . . . . . . . . A . 26 ILE CG1 . . . . . . . . . rr_1iyu 1 . 1 . 383 . 1 1 26 ILE CG2 C 24.590 -14.839 35.732 . . . 1.0 . . . . . . . . . . . . A . 26 ILE CG2 . . . . . . . . . rr_1iyu 1 . 1 . 384 . 1 1 26 ILE H H 25.939 -11.259 37.214 . . . 1.0 . . . . . . . . . . . . A . 26 ILE H . . . . . . . . . rr_1iyu 1 . 1 . 385 . 1 1 26 ILE HA H 25.720 -14.129 37.911 . . . 1.0 . . . . . . . . . . . . A . 26 ILE HA . . . . . . . . . rr_1iyu 1 . 1 . 386 . 1 1 26 ILE HB H 25.581 -13.034 35.120 . . . 1.0 . . . . . . . . . . . . A . 26 ILE HB . . . . . . . . . rr_1iyu 1 . 1 . 387 . 1 1 26 ILE HD11 H 23.496 -12.634 34.205 . . . 1.0 . . . . . . . . . . . . A . 26 ILE HD11 . . . . . . . . . rr_1iyu 1 . 1 . 388 . 1 1 26 ILE HD12 H 22.189 -13.261 35.210 . . . 1.0 . . . . . . . . . . . . A . 26 ILE HD12 . . . . . . . . . rr_1iyu 1 . 1 . 389 . 1 1 26 ILE HD13 H 22.437 -11.521 35.071 . . . 1.0 . . . . . . . . . . . . A . 26 ILE HD13 . . . . . . . . . rr_1iyu 1 . 1 . 390 . 1 1 26 ILE HG12 H 23.349 -12.916 37.173 . . . 1.0 . . . . . . . . . . . . A . 26 ILE HG12 . . . . . . . . . rr_1iyu 1 . 1 . 391 . 1 1 26 ILE HG13 H 24.216 -11.519 36.533 . . . 1.0 . . . . . . . . . . . . A . 26 ILE HG13 . . . . . . . . . rr_1iyu 1 . 1 . 392 . 1 1 26 ILE HG21 H 24.749 -15.441 36.614 . . . 1.0 . . . . . . . . . . . . A . 26 ILE HG21 . . . . . . . . . rr_1iyu 1 . 1 . 393 . 1 1 26 ILE HG22 H 23.537 -14.823 35.492 . . . 1.0 . . . . . . . . . . . . A . 26 ILE HG22 . . . . . . . . . rr_1iyu 1 . 1 . 394 . 1 1 26 ILE HG23 H 25.141 -15.259 34.904 . . . 1.0 . . . . . . . . . . . . A . 26 ILE HG23 . . . . . . . . . rr_1iyu 1 . 1 . 395 . 1 1 26 ILE N N 26.053 -12.048 37.784 . . . 1.0 . . . . . . . . . . . . A . 26 ILE N . . . . . . . . . rr_1iyu 1 . 1 . 396 . 1 1 26 ILE O O 28.404 -13.059 36.971 . . . 1.0 . . . . . . . . . . . . A . 26 ILE O . . . . . . . . . rr_1iyu 1 . 1 . 397 . 1 1 27 GLU C C 28.806 -15.765 34.038 . . . 1.0 . . . . . . . . . . . . A . 27 GLU C . . . . . . . . . rr_1iyu 1 . 1 . 398 . 1 1 27 GLU CA C 28.932 -15.226 35.465 . . . 1.0 . . . . . . . . . . . . A . 27 GLU CA . . . . . . . . . rr_1iyu 1 . 1 . 399 . 1 1 27 GLU CB C 29.516 -16.313 36.370 . . . 1.0 . . . . . . . . . . . . A . 27 GLU CB . . . . . . . . . rr_1iyu 1 . 1 . 400 . 1 1 27 GLU CD C 30.949 -16.723 38.376 . . . 1.0 . . . . . . . . . . . . A . 27 GLU CD . . . . . . . . . rr_1iyu 1 . 1 . 401 . 1 1 27 GLU CG C 30.179 -15.663 37.586 . . . 1.0 . . . . . . . . . . . . A . 27 GLU CG . . . . . . . . . rr_1iyu 1 . 1 . 402 . 1 1 27 GLU H H 26.803 -15.380 35.754 . . . 1.0 . . . . . . . . . . . . A . 27 GLU H . . . . . . . . . rr_1iyu 1 . 1 . 403 . 1 1 27 GLU HA H 29.584 -14.366 35.469 . . . 1.0 . . . . . . . . . . . . A . 27 GLU HA . . . . . . . . . rr_1iyu 1 . 1 . 404 . 1 1 27 GLU HB2 H 28.725 -16.971 36.699 . . . 1.0 . . . . . . . . . . . . A . 27 GLU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 405 . 1 1 27 GLU HB3 H 30.252 -16.881 35.822 . . . 1.0 . . . . . . . . . . . . A . 27 GLU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 406 . 1 1 27 GLU HG2 H 30.861 -14.893 37.255 . . . 1.0 . . . . . . . . . . . . A . 27 GLU HG2 . . . . . . . . . rr_1iyu 1 . 1 . 407 . 1 1 27 GLU HG3 H 29.422 -15.226 38.219 . . . 1.0 . . . . . . . . . . . . A . 27 GLU HG3 . . . . . . . . . rr_1iyu 1 . 1 . 408 . 1 1 27 GLU N N 27.586 -14.832 35.968 . . . 1.0 . . . . . . . . . . . . A . 27 GLU N . . . . . . . . . rr_1iyu 1 . 1 . 409 . 1 1 27 GLU O O 27.721 -16.024 33.556 . . . 1.0 . . . . . . . . . . . . A . 27 GLU O . . . . . . . . . rr_1iyu 1 . 1 . 410 . 1 1 27 GLU OE1 O 30.334 -17.696 38.780 . . . 1.0 . . . . . . . . . . . . A . 27 GLU OE1 . . . . . . . . . rr_1iyu 1 . 1 . 411 . 1 1 27 GLU OE2 O 32.142 -16.544 38.563 . . . 1.0 . . . . . . . . . . . . A . 27 GLU OE2 . . . . . . . . . rr_1iyu 1 . 1 . 412 . 1 1 28 VAL C C 29.672 -17.976 31.995 . . . 1.0 . . . . . . . . . . . . A . 28 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 413 . 1 1 28 VAL CA C 29.848 -16.456 31.964 . . . 1.0 . . . . . . . . . . . . A . 28 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 414 . 1 1 28 VAL CB C 31.147 -16.108 31.235 . . . 1.0 . . . . . . . . . . . . A . 28 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 415 . 1 1 28 VAL CG1 C 32.328 -16.762 31.953 . . . 1.0 . . . . . . . . . . . . A . 28 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 416 . 1 1 28 VAL CG2 C 31.077 -16.626 29.796 . . . 1.0 . . . . . . . . . . . . A . 28 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 417 . 1 1 28 VAL H H 30.772 -15.720 33.766 . . . 1.0 . . . . . . . . . . . . A . 28 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 418 . 1 1 28 VAL HA H 29.013 -16.008 31.447 . . . 1.0 . . . . . . . . . . . . A . 28 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 419 . 1 1 28 VAL HB H 31.279 -15.036 31.228 . . . 1.0 . . . . . . . . . . . . A . 28 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 420 . 1 1 28 VAL HG11 H 32.126 -16.804 33.013 . . . 1.0 . . . . . . . . . . . . A . 28 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 421 . 1 1 28 VAL HG12 H 32.470 -17.764 31.574 . . . 1.0 . . . . . . . . . . . . A . 28 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 422 . 1 1 28 VAL HG13 H 33.222 -16.181 31.779 . . . 1.0 . . . . . . . . . . . . A . 28 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 423 . 1 1 28 VAL HG21 H 30.422 -17.483 29.754 . . . 1.0 . . . . . . . . . . . . A . 28 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 424 . 1 1 28 VAL HG22 H 30.694 -15.848 29.152 . . . 1.0 . . . . . . . . . . . . A . 28 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 425 . 1 1 28 VAL HG23 H 32.065 -16.911 29.468 . . . 1.0 . . . . . . . . . . . . A . 28 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 426 . 1 1 28 VAL N N 29.907 -15.935 33.359 . . . 1.0 . . . . . . . . . . . . A . 28 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 427 . 1 1 28 VAL O O 30.603 -18.723 31.767 . . . 1.0 . . . . . . . . . . . . A . 28 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 428 . 1 1 29 GLU C C 26.956 -20.191 33.091 . . . 1.0 . . . . . . . . . . . . A . 29 GLU C . . . . . . . . . rr_1iyu 1 . 1 . 429 . 1 1 29 GLU CA C 28.245 -19.908 32.318 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CA . . . . . . . . . rr_1iyu 1 . 1 . 430 . 1 1 29 GLU CB C 29.419 -20.599 33.014 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CB . . . . . . . . . rr_1iyu 1 . 1 . 431 . 1 1 29 GLU CD C 30.848 -22.621 32.676 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CD . . . . . . . . . rr_1iyu 1 . 1 . 432 . 1 1 29 GLU CG C 30.215 -21.410 31.989 . . . 1.0 . . . . . . . . . . . . A . 29 GLU CG . . . . . . . . . rr_1iyu 1 . 1 . 433 . 1 1 29 GLU H H 27.747 -17.820 32.451 . . . 1.0 . . . . . . . . . . . . A . 29 GLU H . . . . . . . . . rr_1iyu 1 . 1 . 434 . 1 1 29 GLU HA H 28.150 -20.284 31.311 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HA . . . . . . . . . rr_1iyu 1 . 1 . 435 . 1 1 29 GLU HB2 H 30.061 -19.853 33.462 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 436 . 1 1 29 GLU HB3 H 29.045 -21.260 33.781 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 437 . 1 1 29 GLU HG2 H 29.554 -21.745 31.203 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG2 . . . . . . . . . rr_1iyu 1 . 1 . 438 . 1 1 29 GLU HG3 H 30.993 -20.792 31.566 . . . 1.0 . . . . . . . . . . . . A . 29 GLU HG3 . . . . . . . . . rr_1iyu 1 . 1 . 439 . 1 1 29 GLU N N 28.484 -18.439 32.273 . . . 1.0 . . . . . . . . . . . . A . 29 GLU N . . . . . . . . . rr_1iyu 1 . 1 . 440 . 1 1 29 GLU O O 26.108 -20.941 32.650 . . . 1.0 . . . . . . . . . . . . A . 29 GLU O . . . . . . . . . rr_1iyu 1 . 1 . 441 . 1 1 29 GLU OE1 O 31.521 -22.427 33.675 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE1 . . . . . . . . . rr_1iyu 1 . 1 . 442 . 1 1 29 GLU OE2 O 30.648 -23.723 32.192 . . . 1.0 . . . . . . . . . . . . A . 29 GLU OE2 . . . . . . . . . rr_1iyu 1 . 1 . 443 . 1 1 30 GLN C C 24.336 -19.562 34.174 . . . 1.0 . . . . . . . . . . . . A . 30 GLN C . . . . . . . . . rr_1iyu 1 . 1 . 444 . 1 1 30 GLN CA C 25.566 -19.833 35.043 . . . 1.0 . . . . . . . . . . . . A . 30 GLN CA . . . . . . . . . rr_1iyu 1 . 1 . 445 . 1 1 30 GLN CB C 25.553 -18.893 36.251 . . . 1.0 . . . . . . . . . . . . A . 30 GLN CB . . . . . . . . . rr_1iyu 1 . 1 . 446 . 1 1 30 GLN CD C 24.161 -18.874 38.325 . . . 1.0 . . . . . . . . . . . . A . 30 GLN CD . . . . . . . . . rr_1iyu 1 . 1 . 447 . 1 1 30 GLN CG C 25.170 -19.680 37.506 . . . 1.0 . . . . . . . . . . . . A . 30 GLN CG . . . . . . . . . rr_1iyu 1 . 1 . 448 . 1 1 30 GLN H H 27.496 -18.995 34.581 . . . 1.0 . . . . . . . . . . . . A . 30 GLN H . . . . . . . . . rr_1iyu 1 . 1 . 449 . 1 1 30 GLN HA H 25.548 -20.857 35.384 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HA . . . . . . . . . rr_1iyu 1 . 1 . 450 . 1 1 30 GLN HB2 H 26.535 -18.461 36.381 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HB2 . . . . . . . . . rr_1iyu 1 . 1 . 451 . 1 1 30 GLN HB3 H 24.833 -18.106 36.087 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HB3 . . . . . . . . . rr_1iyu 1 . 1 . 452 . 1 1 30 GLN HE21 H 24.859 -17.116 37.721 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HE21 . . . . . . . . . rr_1iyu 1 . 1 . 453 . 1 1 30 GLN HE22 H 23.550 -17.045 38.799 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HE22 . . . . . . . . . rr_1iyu 1 . 1 . 454 . 1 1 30 GLN HG2 H 24.730 -20.624 37.218 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HG2 . . . . . . . . . rr_1iyu 1 . 1 . 455 . 1 1 30 GLN HG3 H 26.052 -19.860 38.101 . . . 1.0 . . . . . . . . . . . . A . 30 GLN HG3 . . . . . . . . . rr_1iyu 1 . 1 . 456 . 1 1 30 GLN N N 26.801 -19.597 34.243 . . . 1.0 . . . . . . . . . . . . A . 30 GLN N . . . . . . . . . rr_1iyu 1 . 1 . 457 . 1 1 30 GLN NE2 N 24.193 -17.570 38.278 . . . 1.0 . . . . . . . . . . . . A . 30 GLN NE2 . . . . . . . . . rr_1iyu 1 . 1 . 458 . 1 1 30 GLN O O 24.342 -18.692 33.326 . . . 1.0 . . . . . . . . . . . . A . 30 GLN O . . . . . . . . . rr_1iyu 1 . 1 . 459 . 1 1 30 GLN OE1 O 23.335 -19.436 39.016 . . . 1.0 . . . . . . . . . . . . A . 30 GLN OE1 . . . . . . . . . rr_1iyu 1 . 1 . 460 . 1 1 31 GLY C C 21.428 -18.737 33.923 . . . 1.0 . . . . . . . . . . . . A . 31 GLY C . . . . . . . . . rr_1iyu 1 . 1 . 461 . 1 1 31 GLY CA C 22.052 -20.086 33.561 . . . 1.0 . . . . . . . . . . . . A . 31 GLY CA . . . . . . . . . rr_1iyu 1 . 1 . 462 . 1 1 31 GLY H H 23.295 -20.999 35.065 . . . 1.0 . . . . . . . . . . . . A . 31 GLY H . . . . . . . . . rr_1iyu 1 . 1 . 463 . 1 1 31 GLY HA2 H 22.311 -20.095 32.512 . . . 1.0 . . . . . . . . . . . . A . 31 GLY HA2 . . . . . . . . . rr_1iyu 1 . 1 . 464 . 1 1 31 GLY HA3 H 21.342 -20.873 33.764 . . . 1.0 . . . . . . . . . . . . A . 31 GLY HA3 . . . . . . . . . rr_1iyu 1 . 1 . 465 . 1 1 31 GLY N N 23.280 -20.302 34.377 . . . 1.0 . . . . . . . . . . . . A . 31 GLY N . . . . . . . . . rr_1iyu 1 . 1 . 466 . 1 1 31 GLY O O 21.791 -18.117 34.903 . . . 1.0 . . . . . . . . . . . . A . 31 GLY O . . . . . . . . . rr_1iyu 1 . 1 . 467 . 1 1 32 LEU C C 18.325 -17.137 33.438 . . . 1.0 . . . . . . . . . . . . A . 32 LEU C . . . . . . . . . rr_1iyu 1 . 1 . 468 . 1 1 32 LEU CA C 19.846 -16.968 33.438 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CA . . . . . . . . . rr_1iyu 1 . 1 . 469 . 1 1 32 LEU CB C 20.246 -15.946 32.371 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CB . . . . . . . . . rr_1iyu 1 . 1 . 470 . 1 1 32 LEU CD1 C 21.765 -13.970 32.535 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CD1 . . . . . . . . . rr_1iyu 1 . 1 . 471 . 1 1 32 LEU CD2 C 19.289 -13.656 32.646 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CD2 . . . . . . . . . rr_1iyu 1 . 1 . 472 . 1 1 32 LEU CG C 20.450 -14.579 33.025 . . . 1.0 . . . . . . . . . . . . A . 32 LEU CG . . . . . . . . . rr_1iyu 1 . 1 . 473 . 1 1 32 LEU H H 20.213 -18.792 32.353 . . . 1.0 . . . . . . . . . . . . A . 32 LEU H . . . . . . . . . rr_1iyu 1 . 1 . 474 . 1 1 32 LEU HA H 20.170 -16.620 34.408 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HA . . . . . . . . . rr_1iyu 1 . 1 . 475 . 1 1 32 LEU HB2 H 21.164 -16.262 31.898 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 476 . 1 1 32 LEU HB3 H 19.464 -15.876 31.630 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 477 . 1 1 32 LEU HD11 H 22.577 -14.651 32.743 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD11 . . . . . . . . . rr_1iyu 1 . 1 . 478 . 1 1 32 LEU HD12 H 21.706 -13.794 31.471 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD12 . . . . . . . . . rr_1iyu 1 . 1 . 479 . 1 1 32 LEU HD13 H 21.940 -13.034 33.045 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD13 . . . . . . . . . rr_1iyu 1 . 1 . 480 . 1 1 32 LEU HD21 H 18.434 -14.251 32.362 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD21 . . . . . . . . . rr_1iyu 1 . 1 . 481 . 1 1 32 LEU HD22 H 19.032 -13.036 33.492 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD22 . . . . . . . . . rr_1iyu 1 . 1 . 482 . 1 1 32 LEU HD23 H 19.583 -13.029 31.817 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HD23 . . . . . . . . . rr_1iyu 1 . 1 . 483 . 1 1 32 LEU HG H 20.485 -14.695 34.098 . . . 1.0 . . . . . . . . . . . . A . 32 LEU HG . . . . . . . . . rr_1iyu 1 . 1 . 484 . 1 1 32 LEU N N 20.492 -18.277 33.139 . . . 1.0 . . . . . . . . . . . . A . 32 LEU N . . . . . . . . . rr_1iyu 1 . 1 . 485 . 1 1 32 LEU O O 17.643 -16.698 34.343 . . . 1.0 . . . . . . . . . . . . A . 32 LEU O . . . . . . . . . rr_1iyu 1 . 1 . 486 . 1 1 33 VAL C C 16.000 -19.311 31.720 . . . 1.0 . . . . . . . . . . . . A . 33 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 487 . 1 1 33 VAL CA C 16.313 -17.964 32.375 . . . 1.0 . . . . . . . . . . . . A . 33 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 488 . 1 1 33 VAL CB C 15.681 -16.840 31.553 . . . 1.0 . . . . . . . . . . . . A . 33 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 489 . 1 1 33 VAL CG1 C 15.963 -15.495 32.225 . . . 1.0 . . . . . . . . . . . . A . 33 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 490 . 1 1 33 VAL CG2 C 16.280 -16.841 30.145 . . . 1.0 . . . . . . . . . . . . A . 33 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 491 . 1 1 33 VAL H H 18.356 -18.115 31.711 . . . 1.0 . . . . . . . . . . . . A . 33 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 492 . 1 1 33 VAL HA H 15.909 -17.949 33.377 . . . 1.0 . . . . . . . . . . . . A . 33 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 493 . 1 1 33 VAL HB H 14.613 -16.995 31.493 . . . 1.0 . . . . . . . . . . . . A . 33 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 494 . 1 1 33 VAL HG11 H 16.159 -15.651 33.275 . . . 1.0 . . . . . . . . . . . . A . 33 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 495 . 1 1 33 VAL HG12 H 16.823 -15.035 31.762 . . . 1.0 . . . . . . . . . . . . A . 33 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 496 . 1 1 33 VAL HG13 H 15.105 -14.849 32.112 . . . 1.0 . . . . . . . . . . . . A . 33 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 497 . 1 1 33 VAL HG21 H 16.853 -17.744 29.998 . . . 1.0 . . . . . . . . . . . . A . 33 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 498 . 1 1 33 VAL HG22 H 15.484 -16.796 29.415 . . . 1.0 . . . . . . . . . . . . A . 33 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 499 . 1 1 33 VAL HG23 H 16.924 -15.982 30.027 . . . 1.0 . . . . . . . . . . . . A . 33 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 500 . 1 1 33 VAL N N 17.789 -17.769 32.431 . . . 1.0 . . . . . . . . . . . . A . 33 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 501 . 1 1 33 VAL O O 16.872 -19.974 31.195 . . . 1.0 . . . . . . . . . . . . A . 33 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 502 . 1 1 34 VAL C C 13.219 -20.819 30.168 . . . 1.0 . . . . . . . . . . . . A . 34 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 503 . 1 1 34 VAL CA C 14.394 -21.024 31.127 . . . 1.0 . . . . . . . . . . . . A . 34 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 504 . 1 1 34 VAL CB C 13.993 -22.015 32.220 . . . 1.0 . . . . . . . . . . . . A . 34 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 505 . 1 1 34 VAL CG1 C 13.521 -23.321 31.579 . . . 1.0 . . . . . . . . . . . . A . 34 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 506 . 1 1 34 VAL CG2 C 15.200 -22.297 33.119 . . . 1.0 . . . . . . . . . . . . A . 34 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 507 . 1 1 34 VAL H H 14.073 -19.171 32.176 . . . 1.0 . . . . . . . . . . . . A . 34 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 508 . 1 1 34 VAL HA H 15.240 -21.414 30.580 . . . 1.0 . . . . . . . . . . . . A . 34 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 509 . 1 1 34 VAL HB H 13.192 -21.594 32.811 . . . 1.0 . . . . . . . . . . . . A . 34 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 510 . 1 1 34 VAL HG11 H 13.503 -23.209 30.505 . . . 1.0 . . . . . . . . . . . . A . 34 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 511 . 1 1 34 VAL HG12 H 14.199 -24.119 31.846 . . . 1.0 . . . . . . . . . . . . A . 34 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 512 . 1 1 34 VAL HG13 H 12.529 -23.558 31.933 . . . 1.0 . . . . . . . . . . . . A . 34 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 513 . 1 1 34 VAL HG21 H 16.076 -22.450 32.507 . . . 1.0 . . . . . . . . . . . . A . 34 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 514 . 1 1 34 VAL HG22 H 15.363 -21.456 33.777 . . . 1.0 . . . . . . . . . . . . A . 34 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 515 . 1 1 34 VAL HG23 H 15.012 -23.183 33.707 . . . 1.0 . . . . . . . . . . . . A . 34 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 516 . 1 1 34 VAL N N 14.761 -19.721 31.748 . . . 1.0 . . . . . . . . . . . . A . 34 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 517 . 1 1 34 VAL O O 12.070 -20.875 30.559 . . . 1.0 . . . . . . . . . . . . A . 34 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 518 . 1 1 35 LEU C C 11.995 -21.718 27.324 . . . 1.0 . . . . . . . . . . . . A . 35 LEU C . . . . . . . . . rr_1iyu 1 . 1 . 519 . 1 1 35 LEU CA C 12.396 -20.373 27.934 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CA . . . . . . . . . rr_1iyu 1 . 1 . 520 . 1 1 35 LEU CB C 12.871 -19.432 26.826 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CB . . . . . . . . . rr_1iyu 1 . 1 . 521 . 1 1 35 LEU CD1 C 14.764 -17.805 26.925 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CD1 . . . . . . . . . rr_1iyu 1 . 1 . 522 . 1 1 35 LEU CD2 C 12.407 -16.989 27.055 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CD2 . . . . . . . . . rr_1iyu 1 . 1 . 523 . 1 1 35 LEU CG C 13.360 -18.121 27.444 . . . 1.0 . . . . . . . . . . . . A . 35 LEU CG . . . . . . . . . rr_1iyu 1 . 1 . 524 . 1 1 35 LEU H H 14.431 -20.541 28.620 . . . 1.0 . . . . . . . . . . . . A . 35 LEU H . . . . . . . . . rr_1iyu 1 . 1 . 525 . 1 1 35 LEU HA H 11.544 -19.938 28.436 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HA . . . . . . . . . rr_1iyu 1 . 1 . 526 . 1 1 35 LEU HB2 H 13.679 -19.898 26.280 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 527 . 1 1 35 LEU HB3 H 12.053 -19.227 26.152 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 528 . 1 1 35 LEU HD11 H 15.057 -18.551 26.201 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD11 . . . . . . . . . rr_1iyu 1 . 1 . 529 . 1 1 35 LEU HD12 H 14.764 -16.831 26.458 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD12 . . . . . . . . . rr_1iyu 1 . 1 . 530 . 1 1 35 LEU HD13 H 15.462 -17.809 27.749 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD13 . . . . . . . . . rr_1iyu 1 . 1 . 531 . 1 1 35 LEU HD21 H 12.070 -17.134 26.040 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD21 . . . . . . . . . rr_1iyu 1 . 1 . 532 . 1 1 35 LEU HD22 H 11.557 -16.990 27.721 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD22 . . . . . . . . . rr_1iyu 1 . 1 . 533 . 1 1 35 LEU HD23 H 12.922 -16.043 27.131 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HD23 . . . . . . . . . rr_1iyu 1 . 1 . 534 . 1 1 35 LEU HG H 13.388 -18.219 28.519 . . . 1.0 . . . . . . . . . . . . A . 35 LEU HG . . . . . . . . . rr_1iyu 1 . 1 . 535 . 1 1 35 LEU N N 13.497 -20.582 28.916 . . . 1.0 . . . . . . . . . . . . A . 35 LEU N . . . . . . . . . rr_1iyu 1 . 1 . 536 . 1 1 35 LEU O O 12.815 -22.596 27.140 . . . 1.0 . . . . . . . . . . . . A . 35 LEU O . . . . . . . . . rr_1iyu 1 . 1 . 537 . 1 1 36 GLU C C 9.951 -22.961 24.934 . . . 1.0 . . . . . . . . . . . . A . 36 GLU C . . . . . . . . . rr_1iyu 1 . 1 . 538 . 1 1 36 GLU CA C 10.289 -23.175 26.411 . . . 1.0 . . . . . . . . . . . . A . 36 GLU CA . . . . . . . . . rr_1iyu 1 . 1 . 539 . 1 1 36 GLU CB C 9.046 -23.674 27.152 . . . 1.0 . . . . . . . . . . . . A . 36 GLU CB . . . . . . . . . rr_1iyu 1 . 1 . 540 . 1 1 36 GLU CD C 7.454 -25.582 27.412 . . . 1.0 . . . . . . . . . . . . A . 36 GLU CD . . . . . . . . . rr_1iyu 1 . 1 . 541 . 1 1 36 GLU CG C 8.704 -25.088 26.680 . . . 1.0 . . . . . . . . . . . . A . 36 GLU CG . . . . . . . . . rr_1iyu 1 . 1 . 542 . 1 1 36 GLU H H 10.094 -21.167 27.165 . . . 1.0 . . . . . . . . . . . . A . 36 GLU H . . . . . . . . . rr_1iyu 1 . 1 . 543 . 1 1 36 GLU HA H 11.078 -23.908 26.498 . . . 1.0 . . . . . . . . . . . . A . 36 GLU HA . . . . . . . . . rr_1iyu 1 . 1 . 544 . 1 1 36 GLU HB2 H 9.241 -23.685 28.214 . . . 1.0 . . . . . . . . . . . . A . 36 GLU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 545 . 1 1 36 GLU HB3 H 8.215 -23.016 26.944 . . . 1.0 . . . . . . . . . . . . A . 36 GLU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 546 . 1 1 36 GLU HG2 H 8.518 -25.077 25.615 . . . 1.0 . . . . . . . . . . . . A . 36 GLU HG2 . . . . . . . . . rr_1iyu 1 . 1 . 547 . 1 1 36 GLU HG3 H 9.529 -25.749 26.895 . . . 1.0 . . . . . . . . . . . . A . 36 GLU HG3 . . . . . . . . . rr_1iyu 1 . 1 . 548 . 1 1 36 GLU N N 10.740 -21.887 27.009 . . . 1.0 . . . . . . . . . . . . A . 36 GLU N . . . . . . . . . rr_1iyu 1 . 1 . 549 . 1 1 36 GLU O O 9.451 -21.924 24.546 . . . 1.0 . . . . . . . . . . . . A . 36 GLU O . . . . . . . . . rr_1iyu 1 . 1 . 550 . 1 1 36 GLU OE1 O 7.535 -25.782 28.613 . . . 1.0 . . . . . . . . . . . . A . 36 GLU OE1 . . . . . . . . . rr_1iyu 1 . 1 . 551 . 1 1 36 GLU OE2 O 6.438 -25.753 26.759 . . . 1.0 . . . . . . . . . . . . A . 36 GLU OE2 . . . . . . . . . rr_1iyu 1 . 1 . 552 . 1 1 37 SER C C 8.685 -24.628 22.306 . . . 1.0 . . . . . . . . . . . . A . 37 SER C . . . . . . . . . rr_1iyu 1 . 1 . 553 . 1 1 37 SER CA C 9.913 -23.785 22.657 . . . 1.0 . . . . . . . . . . . . A . 37 SER CA . . . . . . . . . rr_1iyu 1 . 1 . 554 . 1 1 37 SER CB C 11.109 -24.259 21.830 . . . 1.0 . . . . . . . . . . . . A . 37 SER CB . . . . . . . . . rr_1iyu 1 . 1 . 555 . 1 1 37 SER H H 10.623 -24.764 24.440 . . . 1.0 . . . . . . . . . . . . A . 37 SER H . . . . . . . . . rr_1iyu 1 . 1 . 556 . 1 1 37 SER HA H 9.712 -22.747 22.437 . . . 1.0 . . . . . . . . . . . . A . 37 SER HA . . . . . . . . . rr_1iyu 1 . 1 . 557 . 1 1 37 SER HB2 H 11.090 -25.333 21.748 . . . 1.0 . . . . . . . . . . . . A . 37 SER HB2 . . . . . . . . . rr_1iyu 1 . 1 . 558 . 1 1 37 SER HB3 H 11.056 -23.824 20.840 . . . 1.0 . . . . . . . . . . . . A . 37 SER HB3 . . . . . . . . . rr_1iyu 1 . 1 . 559 . 1 1 37 SER HG H 12.569 -23.005 22.118 . . . 1.0 . . . . . . . . . . . . A . 37 SER HG . . . . . . . . . rr_1iyu 1 . 1 . 560 . 1 1 37 SER N N 10.220 -23.935 24.107 . . . 1.0 . . . . . . . . . . . . A . 37 SER N . . . . . . . . . rr_1iyu 1 . 1 . 561 . 1 1 37 SER O O 8.044 -25.196 23.168 . . . 1.0 . . . . . . . . . . . . A . 37 SER O . . . . . . . . . rr_1iyu 1 . 1 . 562 . 1 1 37 SER OG O 12.312 -23.860 22.473 . . . 1.0 . . . . . . . . . . . . A . 37 SER OG . . . . . . . . . rr_1iyu 1 . 1 . 563 . 1 1 38 ALA C C 7.566 -26.982 20.478 . . . 1.0 . . . . . . . . . . . . A . 38 ALA C . . . . . . . . . rr_1iyu 1 . 1 . 564 . 1 1 38 ALA CA C 7.163 -25.515 20.644 . . . 1.0 . . . . . . . . . . . . A . 38 ALA CA . . . . . . . . . rr_1iyu 1 . 1 . 565 . 1 1 38 ALA CB C 6.616 -24.984 19.317 . . . 1.0 . . . . . . . . . . . . A . 38 ALA CB . . . . . . . . . rr_1iyu 1 . 1 . 566 . 1 1 38 ALA H H 8.880 -24.244 20.368 . . . 1.0 . . . . . . . . . . . . A . 38 ALA H . . . . . . . . . rr_1iyu 1 . 1 . 567 . 1 1 38 ALA HA H 6.400 -25.436 21.404 . . . 1.0 . . . . . . . . . . . . A . 38 ALA HA . . . . . . . . . rr_1iyu 1 . 1 . 568 . 1 1 38 ALA HB1 H 7.205 -24.137 18.998 . . . 1.0 . . . . . . . . . . . . A . 38 ALA HB1 . . . . . . . . . rr_1iyu 1 . 1 . 569 . 1 1 38 ALA HB2 H 6.668 -25.762 18.569 . . . 1.0 . . . . . . . . . . . . A . 38 ALA HB2 . . . . . . . . . rr_1iyu 1 . 1 . 570 . 1 1 38 ALA HB3 H 5.588 -24.679 19.448 . . . 1.0 . . . . . . . . . . . . A . 38 ALA HB3 . . . . . . . . . rr_1iyu 1 . 1 . 571 . 1 1 38 ALA N N 8.350 -24.711 21.048 . . . 1.0 . . . . . . . . . . . . A . 38 ALA N . . . . . . . . . rr_1iyu 1 . 1 . 572 . 1 1 38 ALA O O 6.740 -27.837 20.226 . . . 1.0 . . . . . . . . . . . . A . 38 ALA O . . . . . . . . . rr_1iyu 1 . 1 . 573 . 1 1 39 LYS C C 10.510 -28.942 21.333 . . . 1.0 . . . . . . . . . . . . A . 39 LYS C . . . . . . . . . rr_1iyu 1 . 1 . 574 . 1 1 39 LYS CA C 9.278 -28.695 20.461 . . . 1.0 . . . . . . . . . . . . A . 39 LYS CA . . . . . . . . . rr_1iyu 1 . 1 . 575 . 1 1 39 LYS CB C 9.629 -28.961 18.995 . . . 1.0 . . . . . . . . . . . . A . 39 LYS CB . . . . . . . . . rr_1iyu 1 . 1 . 576 . 1 1 39 LYS CD C 8.726 -28.872 16.667 . . . 1.0 . . . . . . . . . . . . A . 39 LYS CD . . . . . . . . . rr_1iyu 1 . 1 . 577 . 1 1 39 LYS CE C 9.196 -30.250 16.200 . . . 1.0 . . . . . . . . . . . . A . 39 LYS CE . . . . . . . . . rr_1iyu 1 . 1 . 578 . 1 1 39 LYS CG C 8.355 -28.933 18.150 . . . 1.0 . . . . . . . . . . . . A . 39 LYS CG . . . . . . . . . rr_1iyu 1 . 1 . 579 . 1 1 39 LYS H H 9.482 -26.579 20.816 . . . 1.0 . . . . . . . . . . . . A . 39 LYS H . . . . . . . . . rr_1iyu 1 . 1 . 580 . 1 1 39 LYS HA H 8.482 -29.359 20.765 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HA . . . . . . . . . rr_1iyu 1 . 1 . 581 . 1 1 39 LYS HB2 H 10.312 -28.200 18.645 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HB2 . . . . . . . . . rr_1iyu 1 . 1 . 582 . 1 1 39 LYS HB3 H 10.096 -29.931 18.907 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HB3 . . . . . . . . . rr_1iyu 1 . 1 . 583 . 1 1 39 LYS HD2 H 7.862 -28.571 16.092 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HD2 . . . . . . . . . rr_1iyu 1 . 1 . 584 . 1 1 39 LYS HD3 H 9.521 -28.155 16.524 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HD3 . . . . . . . . . rr_1iyu 1 . 1 . 585 . 1 1 39 LYS HE2 H 9.290 -30.254 15.124 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HE2 . . . . . . . . . rr_1iyu 1 . 1 . 586 . 1 1 39 LYS HE3 H 10.154 -30.474 16.646 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HE3 . . . . . . . . . rr_1iyu 1 . 1 . 587 . 1 1 39 LYS HG2 H 7.777 -29.826 18.341 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HG2 . . . . . . . . . rr_1iyu 1 . 1 . 588 . 1 1 39 LYS HG3 H 7.770 -28.063 18.409 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HG3 . . . . . . . . . rr_1iyu 1 . 1 . 589 . 1 1 39 LYS HZ1 H 7.285 -30.826 16.794 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HZ1 . . . . . . . . . rr_1iyu 1 . 1 . 590 . 1 1 39 LYS HZ2 H 8.099 -31.987 15.857 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HZ2 . . . . . . . . . rr_1iyu 1 . 1 . 591 . 1 1 39 LYS HZ3 H 8.530 -31.749 17.484 . . . 1.0 . . . . . . . . . . . . A . 39 LYS HZ3 . . . . . . . . . rr_1iyu 1 . 1 . 592 . 1 1 39 LYS N N 8.830 -27.282 20.614 . . . 1.0 . . . . . . . . . . . . A . 39 LYS N . . . . . . . . . rr_1iyu 1 . 1 . 593 . 1 1 39 LYS NZ N 8.202 -31.281 16.615 . . . 1.0 . . . . . . . . . . . . A . 39 LYS NZ . . . . . . . . . rr_1iyu 1 . 1 . 594 . 1 1 39 LYS O O 11.262 -29.870 21.111 . . . 1.0 . . . . . . . . . . . . A . 39 LYS O . . . . . . . . . rr_1iyu 1 . 1 . 595 . 1 1 40 ALA C C 12.163 -27.041 24.014 . . . 1.0 . . . . . . . . . . . . A . 40 ALA C . . . . . . . . . rr_1iyu 1 . 1 . 596 . 1 1 40 ALA CA C 11.909 -28.317 23.209 . . . 1.0 . . . . . . . . . . . . A . 40 ALA CA . . . . . . . . . rr_1iyu 1 . 1 . 597 . 1 1 40 ALA CB C 13.138 -28.631 22.352 . . . 1.0 . . . . . . . . . . . . A . 40 ALA CB . . . . . . . . . rr_1iyu 1 . 1 . 598 . 1 1 40 ALA H H 10.106 -27.380 22.491 . . . 1.0 . . . . . . . . . . . . A . 40 ALA H . . . . . . . . . rr_1iyu 1 . 1 . 599 . 1 1 40 ALA HA H 11.723 -29.138 23.885 . . . 1.0 . . . . . . . . . . . . A . 40 ALA HA . . . . . . . . . rr_1iyu 1 . 1 . 600 . 1 1 40 ALA HB1 H 13.117 -28.026 21.458 . . . 1.0 . . . . . . . . . . . . A . 40 ALA HB1 . . . . . . . . . rr_1iyu 1 . 1 . 601 . 1 1 40 ALA HB2 H 14.034 -28.412 22.914 . . . 1.0 . . . . . . . . . . . . A . 40 ALA HB2 . . . . . . . . . rr_1iyu 1 . 1 . 602 . 1 1 40 ALA HB3 H 13.129 -29.676 22.081 . . . 1.0 . . . . . . . . . . . . A . 40 ALA HB3 . . . . . . . . . rr_1iyu 1 . 1 . 603 . 1 1 40 ALA N N 10.725 -28.122 22.326 . . . 1.0 . . . . . . . . . . . . A . 40 ALA N . . . . . . . . . rr_1iyu 1 . 1 . 604 . 1 1 40 ALA O O 12.085 -25.944 23.498 . . . 1.0 . . . . . . . . . . . . A . 40 ALA O . . . . . . . . . rr_1iyu 1 . 1 . 605 . 1 1 41 SER C C 14.233 -25.702 26.166 . . . 1.0 . . . . . . . . . . . . A . 41 SER C . . . . . . . . . rr_1iyu 1 . 1 . 606 . 1 1 41 SER CA C 12.728 -25.970 26.112 . . . 1.0 . . . . . . . . . . . . A . 41 SER CA . . . . . . . . . rr_1iyu 1 . 1 . 607 . 1 1 41 SER CB C 12.201 -26.208 27.527 . . . 1.0 . . . . . . . . . . . . A . 41 SER CB . . . . . . . . . rr_1iyu 1 . 1 . 608 . 1 1 41 SER H H 12.528 -28.069 25.673 . . . 1.0 . . . . . . . . . . . . A . 41 SER H . . . . . . . . . rr_1iyu 1 . 1 . 609 . 1 1 41 SER HA H 12.226 -25.117 25.679 . . . 1.0 . . . . . . . . . . . . A . 41 SER HA . . . . . . . . . rr_1iyu 1 . 1 . 610 . 1 1 41 SER HB2 H 12.979 -26.634 28.137 . . . 1.0 . . . . . . . . . . . . A . 41 SER HB2 . . . . . . . . . rr_1iyu 1 . 1 . 611 . 1 1 41 SER HB3 H 11.886 -25.266 27.956 . . . 1.0 . . . . . . . . . . . . A . 41 SER HB3 . . . . . . . . . rr_1iyu 1 . 1 . 612 . 1 1 41 SER HG H 10.982 -27.482 28.350 . . . 1.0 . . . . . . . . . . . . A . 41 SER HG . . . . . . . . . rr_1iyu 1 . 1 . 613 . 1 1 41 SER N N 12.468 -27.176 25.276 . . . 1.0 . . . . . . . . . . . . A . 41 SER N . . . . . . . . . rr_1iyu 1 . 1 . 614 . 1 1 41 SER O O 15.025 -26.597 26.383 . . . 1.0 . . . . . . . . . . . . A . 41 SER O . . . . . . . . . rr_1iyu 1 . 1 . 615 . 1 1 41 SER OG O 11.103 -27.109 27.473 . . . 1.0 . . . . . . . . . . . . A . 41 SER OG . . . . . . . . . rr_1iyu 1 . 1 . 616 . 1 1 42 MET C C 16.361 -23.172 27.154 . . . 1.0 . . . . . . . . . . . . A . 42 MET C . . . . . . . . . rr_1iyu 1 . 1 . 617 . 1 1 42 MET CA C 16.088 -24.152 26.011 . . . 1.0 . . . . . . . . . . . . A . 42 MET CA . . . . . . . . . rr_1iyu 1 . 1 . 618 . 1 1 42 MET CB C 16.507 -23.516 24.684 . . . 1.0 . . . . . . . . . . . . A . 42 MET CB . . . . . . . . . rr_1iyu 1 . 1 . 619 . 1 1 42 MET CE C 17.776 -25.017 21.340 . . . 1.0 . . . . . . . . . . . . A . 42 MET CE . . . . . . . . . rr_1iyu 1 . 1 . 620 . 1 1 42 MET CG C 16.275 -24.512 23.546 . . . 1.0 . . . . . . . . . . . . A . 42 MET CG . . . . . . . . . rr_1iyu 1 . 1 . 621 . 1 1 42 MET H H 13.979 -23.767 25.797 . . . 1.0 . . . . . . . . . . . . A . 42 MET H . . . . . . . . . rr_1iyu 1 . 1 . 622 . 1 1 42 MET HA H 16.654 -25.058 26.171 . . . 1.0 . . . . . . . . . . . . A . 42 MET HA . . . . . . . . . rr_1iyu 1 . 1 . 623 . 1 1 42 MET HB2 H 15.919 -22.626 24.510 . . . 1.0 . . . . . . . . . . . . A . 42 MET HB2 . . . . . . . . . rr_1iyu 1 . 1 . 624 . 1 1 42 MET HB3 H 17.553 -23.255 24.723 . . . 1.0 . . . . . . . . . . . . A . 42 MET HB3 . . . . . . . . . rr_1iyu 1 . 1 . 625 . 1 1 42 MET HE1 H 17.235 -25.952 21.280 . . . 1.0 . . . . . . . . . . . . A . 42 MET HE1 . . . . . . . . . rr_1iyu 1 . 1 . 626 . 1 1 42 MET HE2 H 18.130 -24.746 20.358 . . . 1.0 . . . . . . . . . . . . A . 42 MET HE2 . . . . . . . . . rr_1iyu 1 . 1 . 627 . 1 1 42 MET HE3 H 18.619 -25.124 22.008 . . . 1.0 . . . . . . . . . . . . A . 42 MET HE3 . . . . . . . . . rr_1iyu 1 . 1 . 628 . 1 1 42 MET HG2 H 16.908 -25.375 23.688 . . . 1.0 . . . . . . . . . . . . A . 42 MET HG2 . . . . . . . . . rr_1iyu 1 . 1 . 629 . 1 1 42 MET HG3 H 15.240 -24.821 23.543 . . . 1.0 . . . . . . . . . . . . A . 42 MET HG3 . . . . . . . . . rr_1iyu 1 . 1 . 630 . 1 1 42 MET N N 14.634 -24.475 25.971 . . . 1.0 . . . . . . . . . . . . A . 42 MET N . . . . . . . . . rr_1iyu 1 . 1 . 631 . 1 1 42 MET O O 15.482 -22.462 27.599 . . . 1.0 . . . . . . . . . . . . A . 42 MET O . . . . . . . . . rr_1iyu 1 . 1 . 632 . 1 1 42 MET SD S 16.674 -23.725 21.965 . . . 1.0 . . . . . . . . . . . . A . 42 MET SD . . . . . . . . . rr_1iyu 1 . 1 . 633 . 1 1 43 GLU C C 18.898 -21.142 28.253 . . . 1.0 . . . . . . . . . . . . A . 43 GLU C . . . . . . . . . rr_1iyu 1 . 1 . 634 . 1 1 43 GLU CA C 17.903 -22.195 28.747 . . . 1.0 . . . . . . . . . . . . A . 43 GLU CA . . . . . . . . . rr_1iyu 1 . 1 . 635 . 1 1 43 GLU CB C 18.523 -22.979 29.905 . . . 1.0 . . . . . . . . . . . . A . 43 GLU CB . . . . . . . . . rr_1iyu 1 . 1 . 636 . 1 1 43 GLU CD C 18.559 -25.193 31.063 . . . 1.0 . . . . . . . . . . . . A . 43 GLU CD . . . . . . . . . rr_1iyu 1 . 1 . 637 . 1 1 43 GLU CG C 17.812 -24.327 30.048 . . . 1.0 . . . . . . . . . . . . A . 43 GLU CG . . . . . . . . . rr_1iyu 1 . 1 . 638 . 1 1 43 GLU H H 18.270 -23.710 27.260 . . . 1.0 . . . . . . . . . . . . A . 43 GLU H . . . . . . . . . rr_1iyu 1 . 1 . 639 . 1 1 43 GLU HA H 17.001 -21.707 29.085 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HA . . . . . . . . . rr_1iyu 1 . 1 . 640 . 1 1 43 GLU HB2 H 19.572 -23.144 29.707 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 641 . 1 1 43 GLU HB3 H 18.413 -22.418 30.820 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 642 . 1 1 43 GLU HG2 H 16.799 -24.165 30.387 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HG2 . . . . . . . . . rr_1iyu 1 . 1 . 643 . 1 1 43 GLU HG3 H 17.796 -24.829 29.092 . . . 1.0 . . . . . . . . . . . . A . 43 GLU HG3 . . . . . . . . . rr_1iyu 1 . 1 . 644 . 1 1 43 GLU N N 17.575 -23.129 27.633 . . . 1.0 . . . . . . . . . . . . A . 43 GLU N . . . . . . . . . rr_1iyu 1 . 1 . 645 . 1 1 43 GLU O O 19.642 -21.367 27.320 . . . 1.0 . . . . . . . . . . . . A . 43 GLU O . . . . . . . . . rr_1iyu 1 . 1 . 646 . 1 1 43 GLU OE1 O 18.926 -24.670 32.103 . . . 1.0 . . . . . . . . . . . . A . 43 GLU OE1 . . . . . . . . . rr_1iyu 1 . 1 . 647 . 1 1 43 GLU OE2 O 18.752 -26.365 30.785 . . . 1.0 . . . . . . . . . . . . A . 43 GLU OE2 . . . . . . . . . rr_1iyu 1 . 1 . 648 . 1 1 44 VAL C C 20.609 -18.383 29.660 . . . 1.0 . . . . . . . . . . . . A . 44 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 649 . 1 1 44 VAL CA C 19.862 -18.927 28.439 . . . 1.0 . . . . . . . . . . . . A . 44 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 650 . 1 1 44 VAL CB C 19.080 -17.793 27.774 . . . 1.0 . . . . . . . . . . . . A . 44 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 651 . 1 1 44 VAL CG1 C 20.057 -16.794 27.154 . . . 1.0 . . . . . . . . . . . . A . 44 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 652 . 1 1 44 VAL CG2 C 18.179 -18.370 26.680 . . . 1.0 . . . . . . . . . . . . A . 44 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 653 . 1 1 44 VAL H H 18.306 -19.832 29.623 . . . 1.0 . . . . . . . . . . . . A . 44 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 654 . 1 1 44 VAL HA H 20.568 -19.338 27.734 . . . 1.0 . . . . . . . . . . . . A . 44 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 655 . 1 1 44 VAL HB H 18.474 -17.292 28.515 . . . 1.0 . . . . . . . . . . . . A . 44 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 656 . 1 1 44 VAL HG11 H 21.001 -17.283 26.964 . . . 1.0 . . . . . . . . . . . . A . 44 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 657 . 1 1 44 VAL HG12 H 19.651 -16.422 26.224 . . . 1.0 . . . . . . . . . . . . A . 44 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 658 . 1 1 44 VAL HG13 H 20.210 -15.969 27.835 . . . 1.0 . . . . . . . . . . . . A . 44 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 659 . 1 1 44 VAL HG21 H 18.384 -19.424 26.563 . . . 1.0 . . . . . . . . . . . . A . 44 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 660 . 1 1 44 VAL HG22 H 17.144 -18.233 26.957 . . . 1.0 . . . . . . . . . . . . A . 44 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 661 . 1 1 44 VAL HG23 H 18.373 -17.860 25.748 . . . 1.0 . . . . . . . . . . . . A . 44 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 662 . 1 1 44 VAL N N 18.916 -19.993 28.873 . . . 1.0 . . . . . . . . . . . . A . 44 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 663 . 1 1 44 VAL O O 20.024 -17.725 30.498 . . . 1.0 . . . . . . . . . . . . A . 44 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 664 . 1 1 45 PRO C C 23.124 -16.757 30.654 . . . 1.0 . . . . . . . . . . . . A . 45 PRO C . . . . . . . . . rr_1iyu 1 . 1 . 665 . 1 1 45 PRO CA C 22.744 -18.229 30.830 . . . 1.0 . . . . . . . . . . . . A . 45 PRO CA . . . . . . . . . rr_1iyu 1 . 1 . 666 . 1 1 45 PRO CB C 23.977 -19.128 30.710 . . . 1.0 . . . . . . . . . . . . A . 45 PRO CB . . . . . . . . . rr_1iyu 1 . 1 . 667 . 1 1 45 PRO CD C 22.580 -19.474 28.696 . . . 1.0 . . . . . . . . . . . . A . 45 PRO CD . . . . . . . . . rr_1iyu 1 . 1 . 668 . 1 1 45 PRO CG C 24.011 -19.626 29.247 . . . 1.0 . . . . . . . . . . . . A . 45 PRO CG . . . . . . . . . rr_1iyu 1 . 1 . 669 . 1 1 45 PRO HA H 22.262 -18.388 31.780 . . . 1.0 . . . . . . . . . . . . A . 45 PRO HA . . . . . . . . . rr_1iyu 1 . 1 . 670 . 1 1 45 PRO HB2 H 24.871 -18.562 30.936 . . . 1.0 . . . . . . . . . . . . A . 45 PRO HB2 . . . . . . . . . rr_1iyu 1 . 1 . 671 . 1 1 45 PRO HB3 H 23.890 -19.970 31.379 . . . 1.0 . . . . . . . . . . . . A . 45 PRO HB3 . . . . . . . . . rr_1iyu 1 . 1 . 672 . 1 1 45 PRO HD2 H 22.594 -18.951 27.750 . . . 1.0 . . . . . . . . . . . . A . 45 PRO HD2 . . . . . . . . . rr_1iyu 1 . 1 . 673 . 1 1 45 PRO HD3 H 22.109 -20.439 28.592 . . . 1.0 . . . . . . . . . . . . A . 45 PRO HD3 . . . . . . . . . rr_1iyu 1 . 1 . 674 . 1 1 45 PRO HG2 H 24.700 -19.024 28.669 . . . 1.0 . . . . . . . . . . . . A . 45 PRO HG2 . . . . . . . . . rr_1iyu 1 . 1 . 675 . 1 1 45 PRO HG3 H 24.306 -20.663 29.214 . . . 1.0 . . . . . . . . . . . . A . 45 PRO HG3 . . . . . . . . . rr_1iyu 1 . 1 . 676 . 1 1 45 PRO N N 21.882 -18.674 29.723 . . . 1.0 . . . . . . . . . . . . A . 45 PRO N . . . . . . . . . rr_1iyu 1 . 1 . 677 . 1 1 45 PRO O O 22.569 -16.055 29.832 . . . 1.0 . . . . . . . . . . . . A . 45 PRO O . . . . . . . . . rr_1iyu 1 . 1 . 678 . 1 1 46 SER C C 25.531 -14.726 30.192 . . . 1.0 . . . . . . . . . . . . A . 46 SER C . . . . . . . . . rr_1iyu 1 . 1 . 679 . 1 1 46 SER CA C 24.484 -14.861 31.302 . . . 1.0 . . . . . . . . . . . . A . 46 SER CA . . . . . . . . . rr_1iyu 1 . 1 . 680 . 1 1 46 SER CB C 25.088 -14.396 32.628 . . . 1.0 . . . . . . . . . . . . A . 46 SER CB . . . . . . . . . rr_1iyu 1 . 1 . 681 . 1 1 46 SER H H 24.499 -16.872 32.078 . . . 1.0 . . . . . . . . . . . . A . 46 SER H . . . . . . . . . rr_1iyu 1 . 1 . 682 . 1 1 46 SER HA H 23.624 -14.254 31.067 . . . 1.0 . . . . . . . . . . . . A . 46 SER HA . . . . . . . . . rr_1iyu 1 . 1 . 683 . 1 1 46 SER HB2 H 24.304 -14.055 33.283 . . . 1.0 . . . . . . . . . . . . A . 46 SER HB2 . . . . . . . . . rr_1iyu 1 . 1 . 684 . 1 1 46 SER HB3 H 25.609 -15.222 33.094 . . . 1.0 . . . . . . . . . . . . A . 46 SER HB3 . . . . . . . . . rr_1iyu 1 . 1 . 685 . 1 1 46 SER HG H 25.683 -12.560 32.872 . . . 1.0 . . . . . . . . . . . . A . 46 SER HG . . . . . . . . . rr_1iyu 1 . 1 . 686 . 1 1 46 SER N N 24.066 -16.286 31.422 . . . 1.0 . . . . . . . . . . . . A . 46 SER N . . . . . . . . . rr_1iyu 1 . 1 . 687 . 1 1 46 SER O O 26.579 -15.339 30.254 . . . 1.0 . . . . . . . . . . . . A . 46 SER O . . . . . . . . . rr_1iyu 1 . 1 . 688 . 1 1 46 SER OG O 25.991 -13.326 32.383 . . . 1.0 . . . . . . . . . . . . A . 46 SER OG . . . . . . . . . rr_1iyu 1 . 1 . 689 . 1 1 47 PRO C C 27.222 -12.703 28.459 . . . 1.0 . . . . . . . . . . . . A . 47 PRO C . . . . . . . . . rr_1iyu 1 . 1 . 690 . 1 1 47 PRO CA C 26.111 -13.680 28.065 . . . 1.0 . . . . . . . . . . . . A . 47 PRO CA . . . . . . . . . rr_1iyu 1 . 1 . 691 . 1 1 47 PRO CB C 25.188 -13.064 27.011 . . . 1.0 . . . . . . . . . . . . A . 47 PRO CB . . . . . . . . . rr_1iyu 1 . 1 . 692 . 1 1 47 PRO CD C 23.939 -13.185 29.146 . . . 1.0 . . . . . . . . . . . . A . 47 PRO CD . . . . . . . . . rr_1iyu 1 . 1 . 693 . 1 1 47 PRO CG C 23.982 -12.472 27.781 . . . 1.0 . . . . . . . . . . . . A . 47 PRO CG . . . . . . . . . rr_1iyu 1 . 1 . 694 . 1 1 47 PRO HA H 26.526 -14.604 27.700 . . . 1.0 . . . . . . . . . . . . A . 47 PRO HA . . . . . . . . . rr_1iyu 1 . 1 . 695 . 1 1 47 PRO HB2 H 25.709 -12.283 26.473 . . . 1.0 . . . . . . . . . . . . A . 47 PRO HB2 . . . . . . . . . rr_1iyu 1 . 1 . 696 . 1 1 47 PRO HB3 H 24.845 -13.823 26.327 . . . 1.0 . . . . . . . . . . . . A . 47 PRO HB3 . . . . . . . . . rr_1iyu 1 . 1 . 697 . 1 1 47 PRO HD2 H 23.876 -12.462 29.947 . . . 1.0 . . . . . . . . . . . . A . 47 PRO HD2 . . . . . . . . . rr_1iyu 1 . 1 . 698 . 1 1 47 PRO HD3 H 23.108 -13.873 29.188 . . . 1.0 . . . . . . . . . . . . A . 47 PRO HD3 . . . . . . . . . rr_1iyu 1 . 1 . 699 . 1 1 47 PRO HG2 H 24.119 -11.408 27.919 . . . 1.0 . . . . . . . . . . . . A . 47 PRO HG2 . . . . . . . . . rr_1iyu 1 . 1 . 700 . 1 1 47 PRO HG3 H 23.068 -12.662 27.241 . . . 1.0 . . . . . . . . . . . . A . 47 PRO HG3 . . . . . . . . . rr_1iyu 1 . 1 . 701 . 1 1 47 PRO N N 25.216 -13.924 29.209 . . . 1.0 . . . . . . . . . . . . A . 47 PRO N . . . . . . . . . rr_1iyu 1 . 1 . 702 . 1 1 47 PRO O O 28.080 -12.369 27.667 . . . 1.0 . . . . . . . . . . . . A . 47 PRO O . . . . . . . . . rr_1iyu 1 . 1 . 703 . 1 1 48 LYS C C 28.330 -11.295 31.659 . . . 1.0 . . . . . . . . . . . . A . 48 LYS C . . . . . . . . . rr_1iyu 1 . 1 . 704 . 1 1 48 LYS CA C 28.262 -11.291 30.131 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CA . . . . . . . . . rr_1iyu 1 . 1 . 705 . 1 1 48 LYS CB C 27.920 -9.884 29.638 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CB . . . . . . . . . rr_1iyu 1 . 1 . 706 . 1 1 48 LYS CD C 29.168 -8.085 28.433 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CD . . . . . . . . . rr_1iyu 1 . 1 . 707 . 1 1 48 LYS CE C 30.645 -7.959 28.057 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CE . . . . . . . . . rr_1iyu 1 . 1 . 708 . 1 1 48 LYS CG C 28.756 -9.558 28.399 . . . 1.0 . . . . . . . . . . . . A . 48 LYS CG . . . . . . . . . rr_1iyu 1 . 1 . 709 . 1 1 48 LYS H H 26.509 -12.530 30.301 . . . 1.0 . . . . . . . . . . . . A . 48 LYS H . . . . . . . . . rr_1iyu 1 . 1 . 710 . 1 1 48 LYS HA H 29.218 -11.592 29.727 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HA . . . . . . . . . rr_1iyu 1 . 1 . 711 . 1 1 48 LYS HB2 H 26.869 -9.836 29.388 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HB2 . . . . . . . . . rr_1iyu 1 . 1 . 712 . 1 1 48 LYS HB3 H 28.138 -9.167 30.416 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HB3 . . . . . . . . . rr_1iyu 1 . 1 . 713 . 1 1 48 LYS HD2 H 28.567 -7.527 27.730 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HD2 . . . . . . . . . rr_1iyu 1 . 1 . 714 . 1 1 48 LYS HD3 H 29.017 -7.692 29.427 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HD3 . . . . . . . . . rr_1iyu 1 . 1 . 715 . 1 1 48 LYS HE2 H 31.245 -7.939 28.954 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HE2 . . . . . . . . . rr_1iyu 1 . 1 . 716 . 1 1 48 LYS HE3 H 30.935 -8.804 27.449 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HE3 . . . . . . . . . rr_1iyu 1 . 1 . 717 . 1 1 48 LYS HG2 H 29.639 -10.180 28.388 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HG2 . . . . . . . . . rr_1iyu 1 . 1 . 718 . 1 1 48 LYS HG3 H 28.172 -9.746 27.511 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HG3 . . . . . . . . . rr_1iyu 1 . 1 . 719 . 1 1 48 LYS HZ1 H 30.277 -6.717 26.427 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HZ1 . . . . . . . . . rr_1iyu 1 . 1 . 720 . 1 1 48 LYS HZ2 H 30.579 -5.886 27.874 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HZ2 . . . . . . . . . rr_1iyu 1 . 1 . 721 . 1 1 48 LYS HZ3 H 31.861 -6.615 27.032 . . . 1.0 . . . . . . . . . . . . A . 48 LYS HZ3 . . . . . . . . . rr_1iyu 1 . 1 . 722 . 1 1 48 LYS N N 27.210 -12.245 29.680 . . . 1.0 . . . . . . . . . . . . A . 48 LYS N . . . . . . . . . rr_1iyu 1 . 1 . 723 . 1 1 48 LYS NZ N 30.856 -6.699 27.290 . . . 1.0 . . . . . . . . . . . . A . 48 LYS NZ . . . . . . . . . rr_1iyu 1 . 1 . 724 . 1 1 48 LYS O O 27.320 -11.320 32.334 . . . 1.0 . . . . . . . . . . . . A . 48 LYS O . . . . . . . . . rr_1iyu 1 . 1 . 725 . 1 1 49 ALA C C 29.414 -9.856 34.229 . . . 1.0 . . . . . . . . . . . . A . 49 ALA C . . . . . . . . . rr_1iyu 1 . 1 . 726 . 1 1 49 ALA CA C 29.640 -11.272 33.696 . . . 1.0 . . . . . . . . . . . . A . 49 ALA CA . . . . . . . . . rr_1iyu 1 . 1 . 727 . 1 1 49 ALA CB C 31.041 -11.747 34.086 . . . 1.0 . . . . . . . . . . . . A . 49 ALA CB . . . . . . . . . rr_1iyu 1 . 1 . 728 . 1 1 49 ALA H H 30.315 -11.251 31.650 . . . 1.0 . . . . . . . . . . . . A . 49 ALA H . . . . . . . . . rr_1iyu 1 . 1 . 729 . 1 1 49 ALA HA H 28.903 -11.938 34.120 . . . 1.0 . . . . . . . . . . . . A . 49 ALA HA . . . . . . . . . rr_1iyu 1 . 1 . 730 . 1 1 49 ALA HB1 H 31.489 -12.269 33.253 . . . 1.0 . . . . . . . . . . . . A . 49 ALA HB1 . . . . . . . . . rr_1iyu 1 . 1 . 731 . 1 1 49 ALA HB2 H 31.650 -10.894 34.347 . . . 1.0 . . . . . . . . . . . . A . 49 ALA HB2 . . . . . . . . . rr_1iyu 1 . 1 . 732 . 1 1 49 ALA HB3 H 30.972 -12.413 34.934 . . . 1.0 . . . . . . . . . . . . A . 49 ALA HB3 . . . . . . . . . rr_1iyu 1 . 1 . 733 . 1 1 49 ALA N N 29.512 -11.270 32.211 . . . 1.0 . . . . . . . . . . . . A . 49 ALA N . . . . . . . . . rr_1iyu 1 . 1 . 734 . 1 1 49 ALA O O 30.332 -9.065 34.324 . . . 1.0 . . . . . . . . . . . . A . 49 ALA O . . . . . . . . . rr_1iyu 1 . 1 . 735 . 1 1 50 GLY C C 26.870 -8.250 36.215 . . . 1.0 . . . . . . . . . . . . A . 50 GLY C . . . . . . . . . rr_1iyu 1 . 1 . 736 . 1 1 50 GLY CA C 27.918 -8.164 35.104 . . . 1.0 . . . . . . . . . . . . A . 50 GLY CA . . . . . . . . . rr_1iyu 1 . 1 . 737 . 1 1 50 GLY H H 27.473 -10.182 34.494 . . . 1.0 . . . . . . . . . . . . A . 50 GLY H . . . . . . . . . rr_1iyu 1 . 1 . 738 . 1 1 50 GLY HA2 H 28.829 -7.735 35.498 . . . 1.0 . . . . . . . . . . . . A . 50 GLY HA2 . . . . . . . . . rr_1iyu 1 . 1 . 739 . 1 1 50 GLY HA3 H 27.542 -7.541 34.307 . . . 1.0 . . . . . . . . . . . . A . 50 GLY HA3 . . . . . . . . . rr_1iyu 1 . 1 . 740 . 1 1 50 GLY N N 28.200 -9.529 34.578 . . . 1.0 . . . . . . . . . . . . A . 50 GLY N . . . . . . . . . rr_1iyu 1 . 1 . 741 . 1 1 50 GLY O O 26.598 -9.309 36.744 . . . 1.0 . . . . . . . . . . . . A . 50 GLY O . . . . . . . . . rr_1iyu 1 . 1 . 742 . 1 1 51 VAL C C 23.903 -6.719 37.076 . . . 1.0 . . . . . . . . . . . . A . 51 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 743 . 1 1 51 VAL CA C 25.251 -7.162 37.650 . . . 1.0 . . . . . . . . . . . . A . 51 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 744 . 1 1 51 VAL CB C 25.666 -6.206 38.770 . . . 1.0 . . . . . . . . . . . . A . 51 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 745 . 1 1 51 VAL CG1 C 25.808 -4.791 38.208 . . . 1.0 . . . . . . . . . . . . A . 51 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 746 . 1 1 51 VAL CG2 C 24.599 -6.213 39.867 . . . 1.0 . . . . . . . . . . . . A . 51 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 747 . 1 1 51 VAL H H 26.514 -6.298 36.134 . . . 1.0 . . . . . . . . . . . . A . 51 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 748 . 1 1 51 VAL HA H 25.162 -8.163 38.046 . . . 1.0 . . . . . . . . . . . . A . 51 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 749 . 1 1 51 VAL HB H 26.612 -6.526 39.183 . . . 1.0 . . . . . . . . . . . . A . 51 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 750 . 1 1 51 VAL HG11 H 26.361 -4.825 37.281 . . . 1.0 . . . . . . . . . . . . A . 51 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 751 . 1 1 51 VAL HG12 H 24.828 -4.375 38.028 . . . 1.0 . . . . . . . . . . . . A . 51 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 752 . 1 1 51 VAL HG13 H 26.337 -4.173 38.919 . . . 1.0 . . . . . . . . . . . . A . 51 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 753 . 1 1 51 VAL HG21 H 23.619 -6.178 39.415 . . . 1.0 . . . . . . . . . . . . A . 51 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 754 . 1 1 51 VAL HG22 H 24.693 -7.114 40.455 . . . 1.0 . . . . . . . . . . . . A . 51 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 755 . 1 1 51 VAL HG23 H 24.732 -5.352 40.505 . . . 1.0 . . . . . . . . . . . . A . 51 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 756 . 1 1 51 VAL N N 26.280 -7.142 36.574 . . . 1.0 . . . . . . . . . . . . A . 51 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 757 . 1 1 51 VAL O O 23.774 -5.640 36.532 . . . 1.0 . . . . . . . . . . . . A . 51 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 758 . 1 1 52 VAL C C 21.249 -5.718 37.026 . . . 1.0 . . . . . . . . . . . . A . 52 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 759 . 1 1 52 VAL CA C 21.561 -7.169 36.653 . . . 1.0 . . . . . . . . . . . . A . 52 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 760 . 1 1 52 VAL CB C 20.495 -8.088 37.250 . . . 1.0 . . . . . . . . . . . . A . 52 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 761 . 1 1 52 VAL CG1 C 19.119 -7.695 36.709 . . . 1.0 . . . . . . . . . . . . A . 52 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 762 . 1 1 52 VAL CG2 C 20.798 -9.538 36.863 . . . 1.0 . . . . . . . . . . . . A . 52 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 763 . 1 1 52 VAL H H 23.023 -8.409 37.635 . . . 1.0 . . . . . . . . . . . . A . 52 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 764 . 1 1 52 VAL HA H 21.565 -7.272 35.578 . . . 1.0 . . . . . . . . . . . . A . 52 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 765 . 1 1 52 VAL HB H 20.499 -7.992 38.327 . . . 1.0 . . . . . . . . . . . . A . 52 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 766 . 1 1 52 VAL HG11 H 19.227 -7.283 35.717 . . . 1.0 . . . . . . . . . . . . A . 52 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 767 . 1 1 52 VAL HG12 H 18.485 -8.568 36.669 . . . 1.0 . . . . . . . . . . . . A . 52 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 768 . 1 1 52 VAL HG13 H 18.674 -6.956 37.359 . . . 1.0 . . . . . . . . . . . . A . 52 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 769 . 1 1 52 VAL HG21 H 21.837 -9.625 36.583 . . . 1.0 . . . . . . . . . . . . A . 52 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 770 . 1 1 52 VAL HG22 H 20.597 -10.185 37.704 . . . 1.0 . . . . . . . . . . . . A . 52 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 771 . 1 1 52 VAL HG23 H 20.175 -9.826 36.030 . . . 1.0 . . . . . . . . . . . . A . 52 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 772 . 1 1 52 VAL N N 22.898 -7.543 37.193 . . . 1.0 . . . . . . . . . . . . A . 52 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 773 . 1 1 52 VAL O O 21.498 -5.284 38.133 . . . 1.0 . . . . . . . . . . . . A . 52 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 774 . 1 1 53 LYS C C 18.863 -3.350 36.388 . . . 1.0 . . . . . . . . . . . . A . 53 LYS C . . . . . . . . . rr_1iyu 1 . 1 . 775 . 1 1 53 LYS CA C 20.381 -3.541 36.412 . . . 1.0 . . . . . . . . . . . . A . 53 LYS CA . . . . . . . . . rr_1iyu 1 . 1 . 776 . 1 1 53 LYS CB C 21.025 -2.635 35.361 . . . 1.0 . . . . . . . . . . . . A . 53 LYS CB . . . . . . . . . rr_1iyu 1 . 1 . 777 . 1 1 53 LYS CD C 21.658 -0.282 34.808 . . . 1.0 . . . . . . . . . . . . A . 53 LYS CD . . . . . . . . . rr_1iyu 1 . 1 . 778 . 1 1 53 LYS CE C 21.089 1.132 34.947 . . . 1.0 . . . . . . . . . . . . A . 53 LYS CE . . . . . . . . . rr_1iyu 1 . 1 . 779 . 1 1 53 LYS CG C 21.031 -1.191 35.867 . . . 1.0 . . . . . . . . . . . . A . 53 LYS CG . . . . . . . . . rr_1iyu 1 . 1 . 780 . 1 1 53 LYS H H 20.515 -5.332 35.222 . . . 1.0 . . . . . . . . . . . . A . 53 LYS H . . . . . . . . . rr_1iyu 1 . 1 . 781 . 1 1 53 LYS HA H 20.760 -3.285 37.390 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HA . . . . . . . . . rr_1iyu 1 . 1 . 782 . 1 1 53 LYS HB2 H 22.040 -2.958 35.181 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HB2 . . . . . . . . . rr_1iyu 1 . 1 . 783 . 1 1 53 LYS HB3 H 20.461 -2.690 34.443 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HB3 . . . . . . . . . rr_1iyu 1 . 1 . 784 . 1 1 53 LYS HD2 H 22.730 -0.255 34.947 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HD2 . . . . . . . . . rr_1iyu 1 . 1 . 785 . 1 1 53 LYS HD3 H 21.432 -0.664 33.825 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HD3 . . . . . . . . . rr_1iyu 1 . 1 . 786 . 1 1 53 LYS HE2 H 20.949 1.561 33.966 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HE2 . . . . . . . . . rr_1iyu 1 . 1 . 787 . 1 1 53 LYS HE3 H 20.140 1.089 35.460 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HE3 . . . . . . . . . rr_1iyu 1 . 1 . 788 . 1 1 53 LYS HG2 H 20.016 -0.874 36.060 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HG2 . . . . . . . . . rr_1iyu 1 . 1 . 789 . 1 1 53 LYS HG3 H 21.607 -1.130 36.778 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HG3 . . . . . . . . . rr_1iyu 1 . 1 . 790 . 1 1 53 LYS HZ1 H 22.319 1.472 36.592 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HZ1 . . . . . . . . . rr_1iyu 1 . 1 . 791 . 1 1 53 LYS HZ2 H 22.883 2.170 35.153 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HZ2 . . . . . . . . . rr_1iyu 1 . 1 . 792 . 1 1 53 LYS HZ3 H 21.576 2.872 35.981 . . . 1.0 . . . . . . . . . . . . A . 53 LYS HZ3 . . . . . . . . . rr_1iyu 1 . 1 . 793 . 1 1 53 LYS N N 20.707 -4.963 36.109 . . . 1.0 . . . . . . . . . . . . A . 53 LYS N . . . . . . . . . rr_1iyu 1 . 1 . 794 . 1 1 53 LYS NZ N 22.039 1.975 35.727 . . . 1.0 . . . . . . . . . . . . A . 53 LYS NZ . . . . . . . . . rr_1iyu 1 . 1 . 795 . 1 1 53 LYS O O 18.301 -2.663 37.218 . . . 1.0 . . . . . . . . . . . . A . 53 LYS O . . . . . . . . . rr_1iyu 1 . 1 . 796 . 1 1 54 SER C C 16.123 -4.982 34.588 . . . 1.0 . . . . . . . . . . . . A . 54 SER C . . . . . . . . . rr_1iyu 1 . 1 . 797 . 1 1 54 SER CA C 16.714 -3.805 35.367 . . . 1.0 . . . . . . . . . . . . A . 54 SER CA . . . . . . . . . rr_1iyu 1 . 1 . 798 . 1 1 54 SER CB C 16.368 -2.497 34.656 . . . 1.0 . . . . . . . . . . . . A . 54 SER CB . . . . . . . . . rr_1iyu 1 . 1 . 799 . 1 1 54 SER H H 18.666 -4.503 34.783 . . . 1.0 . . . . . . . . . . . . A . 54 SER H . . . . . . . . . rr_1iyu 1 . 1 . 800 . 1 1 54 SER HA H 16.302 -3.792 36.366 . . . 1.0 . . . . . . . . . . . . A . 54 SER HA . . . . . . . . . rr_1iyu 1 . 1 . 801 . 1 1 54 SER HB2 H 17.266 -1.925 34.493 . . . 1.0 . . . . . . . . . . . . A . 54 SER HB2 . . . . . . . . . rr_1iyu 1 . 1 . 802 . 1 1 54 SER HB3 H 15.907 -2.719 33.702 . . . 1.0 . . . . . . . . . . . . A . 54 SER HB3 . . . . . . . . . rr_1iyu 1 . 1 . 803 . 1 1 54 SER HG H 15.222 -0.957 34.976 . . . 1.0 . . . . . . . . . . . . A . 54 SER HG . . . . . . . . . rr_1iyu 1 . 1 . 804 . 1 1 54 SER N N 18.194 -3.953 35.443 . . . 1.0 . . . . . . . . . . . . A . 54 SER N . . . . . . . . . rr_1iyu 1 . 1 . 805 . 1 1 54 SER O O 16.712 -5.472 33.645 . . . 1.0 . . . . . . . . . . . . A . 54 SER O . . . . . . . . . rr_1iyu 1 . 1 . 806 . 1 1 54 SER OG O 15.474 -1.744 35.465 . . . 1.0 . . . . . . . . . . . . A . 54 SER OG . . . . . . . . . rr_1iyu 1 . 1 . 807 . 1 1 55 VAL C C 13.170 -6.074 33.405 . . . 1.0 . . . . . . . . . . . . A . 55 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 808 . 1 1 55 VAL CA C 14.336 -6.583 34.254 . . . 1.0 . . . . . . . . . . . . A . 55 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 809 . 1 1 55 VAL CB C 13.820 -7.603 35.270 . . . 1.0 . . . . . . . . . . . . A . 55 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 810 . 1 1 55 VAL CG1 C 13.290 -8.835 34.534 . . . 1.0 . . . . . . . . . . . . A . 55 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 811 . 1 1 55 VAL CG2 C 14.963 -8.018 36.200 . . . 1.0 . . . . . . . . . . . . A . 55 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 812 . 1 1 55 VAL H H 14.504 -5.029 35.737 . . . 1.0 . . . . . . . . . . . . A . 55 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 813 . 1 1 55 VAL HA H 15.069 -7.051 33.614 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 814 . 1 1 55 VAL HB H 13.023 -7.161 35.851 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 815 . 1 1 55 VAL HG11 H 13.974 -9.103 33.743 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 816 . 1 1 55 VAL HG12 H 13.202 -9.658 35.228 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 817 . 1 1 55 VAL HG13 H 12.321 -8.613 34.113 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 818 . 1 1 55 VAL HG21 H 15.820 -7.386 36.021 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 819 . 1 1 55 VAL HG22 H 14.647 -7.914 37.227 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 820 . 1 1 55 VAL HG23 H 15.228 -9.047 36.007 . . . 1.0 . . . . . . . . . . . . A . 55 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 821 . 1 1 55 VAL N N 14.963 -5.438 34.974 . . . 1.0 . . . . . . . . . . . . A . 55 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 822 . 1 1 55 VAL O O 12.156 -5.644 33.919 . . . 1.0 . . . . . . . . . . . . A . 55 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 823 . 1 1 56 SER C C 11.259 -6.799 30.909 . . . 1.0 . . . . . . . . . . . . A . 56 SER C . . . . . . . . . rr_1iyu 1 . 1 . 824 . 1 1 56 SER CA C 12.203 -5.637 31.227 . . . 1.0 . . . . . . . . . . . . A . 56 SER CA . . . . . . . . . rr_1iyu 1 . 1 . 825 . 1 1 56 SER CB C 12.792 -5.088 29.927 . . . 1.0 . . . . . . . . . . . . A . 56 SER CB . . . . . . . . . rr_1iyu 1 . 1 . 826 . 1 1 56 SER H H 14.130 -6.469 31.712 . . . 1.0 . . . . . . . . . . . . A . 56 SER H . . . . . . . . . rr_1iyu 1 . 1 . 827 . 1 1 56 SER HA H 11.654 -4.855 31.732 . . . 1.0 . . . . . . . . . . . . A . 56 SER HA . . . . . . . . . rr_1iyu 1 . 1 . 828 . 1 1 56 SER HB2 H 13.665 -5.659 29.656 . . . 1.0 . . . . . . . . . . . . A . 56 SER HB2 . . . . . . . . . rr_1iyu 1 . 1 . 829 . 1 1 56 SER HB3 H 12.055 -5.165 29.138 . . . 1.0 . . . . . . . . . . . . A . 56 SER HB3 . . . . . . . . . rr_1iyu 1 . 1 . 830 . 1 1 56 SER HG H 12.579 -3.186 29.581 . . . 1.0 . . . . . . . . . . . . A . 56 SER HG . . . . . . . . . rr_1iyu 1 . 1 . 831 . 1 1 56 SER N N 13.304 -6.119 32.107 . . . 1.0 . . . . . . . . . . . . A . 56 SER N . . . . . . . . . rr_1iyu 1 . 1 . 832 . 1 1 56 SER O O 10.476 -6.738 29.982 . . . 1.0 . . . . . . . . . . . . A . 56 SER O . . . . . . . . . rr_1iyu 1 . 1 . 833 . 1 1 56 SER OG O 13.162 -3.729 30.117 . . . 1.0 . . . . . . . . . . . . A . 56 SER OG . . . . . . . . . rr_1iyu 1 . 1 . 834 . 1 1 57 VAL C C 9.948 -9.598 32.742 . . . 1.0 . . . . . . . . . . . . A . 57 VAL C . . . . . . . . . rr_1iyu 1 . 1 . 835 . 1 1 57 VAL CA C 10.432 -9.020 31.411 . . . 1.0 . . . . . . . . . . . . A . 57 VAL CA . . . . . . . . . rr_1iyu 1 . 1 . 836 . 1 1 57 VAL CB C 11.203 -10.092 30.639 . . . 1.0 . . . . . . . . . . . . A . 57 VAL CB . . . . . . . . . rr_1iyu 1 . 1 . 837 . 1 1 57 VAL CG1 C 11.616 -9.541 29.273 . . . 1.0 . . . . . . . . . . . . A . 57 VAL CG1 . . . . . . . . . rr_1iyu 1 . 1 . 838 . 1 1 57 VAL CG2 C 12.453 -10.487 31.427 . . . 1.0 . . . . . . . . . . . . A . 57 VAL CG2 . . . . . . . . . rr_1iyu 1 . 1 . 839 . 1 1 57 VAL H H 11.965 -7.885 32.413 . . . 1.0 . . . . . . . . . . . . A . 57 VAL H . . . . . . . . . rr_1iyu 1 . 1 . 840 . 1 1 57 VAL HA H 9.582 -8.697 30.828 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HA . . . . . . . . . rr_1iyu 1 . 1 . 841 . 1 1 57 VAL HB H 10.572 -10.959 30.501 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HB . . . . . . . . . rr_1iyu 1 . 1 . 842 . 1 1 57 VAL HG11 H 12.099 -8.583 29.402 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG11 . . . . . . . . . rr_1iyu 1 . 1 . 843 . 1 1 57 VAL HG12 H 12.302 -10.228 28.800 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG12 . . . . . . . . . rr_1iyu 1 . 1 . 844 . 1 1 57 VAL HG13 H 10.740 -9.422 28.652 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG13 . . . . . . . . . rr_1iyu 1 . 1 . 845 . 1 1 57 VAL HG21 H 12.183 -10.685 32.454 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG21 . . . . . . . . . rr_1iyu 1 . 1 . 846 . 1 1 57 VAL HG22 H 12.887 -11.375 30.992 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG22 . . . . . . . . . rr_1iyu 1 . 1 . 847 . 1 1 57 VAL HG23 H 13.171 -9.681 31.392 . . . 1.0 . . . . . . . . . . . . A . 57 VAL HG23 . . . . . . . . . rr_1iyu 1 . 1 . 848 . 1 1 57 VAL N N 11.326 -7.856 31.670 . . . 1.0 . . . . . . . . . . . . A . 57 VAL N . . . . . . . . . rr_1iyu 1 . 1 . 849 . 1 1 57 VAL O O 10.295 -9.116 33.802 . . . 1.0 . . . . . . . . . . . . A . 57 VAL O . . . . . . . . . rr_1iyu 1 . 1 . 850 . 1 1 58 LYS C C 8.590 -12.758 33.807 . . . 1.0 . . . . . . . . . . . . A . 58 LYS C . . . . . . . . . rr_1iyu 1 . 1 . 851 . 1 1 58 LYS CA C 8.643 -11.236 33.958 . . . 1.0 . . . . . . . . . . . . A . 58 LYS CA . . . . . . . . . rr_1iyu 1 . 1 . 852 . 1 1 58 LYS CB C 7.239 -10.704 34.254 . . . 1.0 . . . . . . . . . . . . A . 58 LYS CB . . . . . . . . . rr_1iyu 1 . 1 . 853 . 1 1 58 LYS CD C 6.062 -9.289 35.945 . . . 1.0 . . . . . . . . . . . . A . 58 LYS CD . . . . . . . . . rr_1iyu 1 . 1 . 854 . 1 1 58 LYS CE C 5.459 -9.417 37.345 . . . 1.0 . . . . . . . . . . . . A . 58 LYS CE . . . . . . . . . rr_1iyu 1 . 1 . 855 . 1 1 58 LYS CG C 7.121 -10.375 35.744 . . . 1.0 . . . . . . . . . . . . A . 58 LYS CG . . . . . . . . . rr_1iyu 1 . 1 . 856 . 1 1 58 LYS H H 8.880 -11.002 31.830 . . . 1.0 . . . . . . . . . . . . A . 58 LYS H . . . . . . . . . rr_1iyu 1 . 1 . 857 . 1 1 58 LYS HA H 9.305 -10.978 34.772 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HA . . . . . . . . . rr_1iyu 1 . 1 . 858 . 1 1 58 LYS HB2 H 7.063 -9.811 33.673 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HB2 . . . . . . . . . rr_1iyu 1 . 1 . 859 . 1 1 58 LYS HB3 H 6.507 -11.453 33.994 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HB3 . . . . . . . . . rr_1iyu 1 . 1 . 860 . 1 1 58 LYS HD2 H 6.520 -8.316 35.837 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HD2 . . . . . . . . . rr_1iyu 1 . 1 . 861 . 1 1 58 LYS HD3 H 5.283 -9.405 35.207 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HD3 . . . . . . . . . rr_1iyu 1 . 1 . 862 . 1 1 58 LYS HE2 H 5.082 -10.419 37.484 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HE2 . . . . . . . . . rr_1iyu 1 . 1 . 863 . 1 1 58 LYS HE3 H 6.219 -9.212 38.085 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HE3 . . . . . . . . . rr_1iyu 1 . 1 . 864 . 1 1 58 LYS HG2 H 6.834 -11.264 36.287 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HG2 . . . . . . . . . rr_1iyu 1 . 1 . 865 . 1 1 58 LYS HG3 H 8.072 -10.020 36.111 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HG3 . . . . . . . . . rr_1iyu 1 . 1 . 866 . 1 1 58 LYS HZ1 H 3.896 -8.278 36.571 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HZ1 . . . . . . . . . rr_1iyu 1 . 1 . 867 . 1 1 58 LYS HZ2 H 3.636 -8.821 38.157 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HZ2 . . . . . . . . . rr_1iyu 1 . 1 . 868 . 1 1 58 LYS HZ3 H 4.716 -7.542 37.865 . . . 1.0 . . . . . . . . . . . . A . 58 LYS HZ3 . . . . . . . . . rr_1iyu 1 . 1 . 869 . 1 1 58 LYS N N 9.148 -10.628 32.695 . . . 1.0 . . . . . . . . . . . . A . 58 LYS N . . . . . . . . . rr_1iyu 1 . 1 . 870 . 1 1 58 LYS NZ N 4.343 -8.441 37.496 . . . 1.0 . . . . . . . . . . . . A . 58 LYS NZ . . . . . . . . . rr_1iyu 1 . 1 . 871 . 1 1 58 LYS O O 8.843 -13.295 32.746 . . . 1.0 . . . . . . . . . . . . A . 58 LYS O . . . . . . . . . rr_1iyu 1 . 1 . 872 . 1 1 59 LEU C C 6.820 -15.361 34.245 . . . 1.0 . . . . . . . . . . . . A . 59 LEU C . . . . . . . . . rr_1iyu 1 . 1 . 873 . 1 1 59 LEU CA C 8.194 -14.943 34.773 . . . 1.0 . . . . . . . . . . . . A . 59 LEU CA . . . . . . . . . rr_1iyu 1 . 1 . 874 . 1 1 59 LEU CB C 8.410 -15.545 36.163 . . . 1.0 . . . . . . . . . . . . A . 59 LEU CB . . . . . . . . . rr_1iyu 1 . 1 . 875 . 1 1 59 LEU CD1 C 6.503 -16.128 37.669 . . . 1.0 . . . . . . . . . . . . A . 59 LEU CD1 . . . . . . . . . rr_1iyu 1 . 1 . 876 . 1 1 59 LEU CD2 C 8.074 -14.290 38.296 . . . 1.0 . . . . . . . . . . . . A . 59 LEU CD2 . . . . . . . . . rr_1iyu 1 . 1 . 877 . 1 1 59 LEU CG C 7.366 -14.985 37.131 . . . 1.0 . . . . . . . . . . . . A . 59 LEU CG . . . . . . . . . rr_1iyu 1 . 1 . 878 . 1 1 59 LEU H H 8.062 -13.005 35.705 . . . 1.0 . . . . . . . . . . . . A . 59 LEU H . . . . . . . . . rr_1iyu 1 . 1 . 879 . 1 1 59 LEU HA H 8.961 -15.301 34.103 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HA . . . . . . . . . rr_1iyu 1 . 1 . 880 . 1 1 59 LEU HB2 H 8.313 -16.620 36.109 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 881 . 1 1 59 LEU HB3 H 9.398 -15.290 36.516 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 882 . 1 1 59 LEU HD11 H 7.041 -17.060 37.575 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD11 . . . . . . . . . rr_1iyu 1 . 1 . 883 . 1 1 59 LEU HD12 H 6.274 -15.947 38.708 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD12 . . . . . . . . . rr_1iyu 1 . 1 . 884 . 1 1 59 LEU HD13 H 5.586 -16.184 37.102 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD13 . . . . . . . . . rr_1iyu 1 . 1 . 885 . 1 1 59 LEU HD21 H 8.974 -14.832 38.545 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD21 . . . . . . . . . rr_1iyu 1 . 1 . 886 . 1 1 59 LEU HD22 H 8.328 -13.280 38.012 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD22 . . . . . . . . . rr_1iyu 1 . 1 . 887 . 1 1 59 LEU HD23 H 7.418 -14.268 39.154 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD23 . . . . . . . . . rr_1iyu 1 . 1 . 888 . 1 1 59 LEU HG H 6.739 -14.275 36.612 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HG . . . . . . . . . rr_1iyu 1 . 1 . 889 . 1 1 59 LEU N N 8.263 -13.457 34.858 . . . 1.0 . . . . . . . . . . . . A . 59 LEU N . . . . . . . . . rr_1iyu 1 . 1 . 890 . 1 1 59 LEU O O 5.797 -14.929 34.738 . . . 1.0 . . . . . . . . . . . . A . 59 LEU O . . . . . . . . . rr_1iyu 1 . 1 . 891 . 1 1 60 GLY C C 5.066 -15.710 31.548 . . . 1.0 . . . . . . . . . . . . A . 60 GLY C . . . . . . . . . rr_1iyu 1 . 1 . 892 . 1 1 60 GLY CA C 5.480 -16.644 32.687 . . . 1.0 . . . . . . . . . . . . A . 60 GLY CA . . . . . . . . . rr_1iyu 1 . 1 . 893 . 1 1 60 GLY H H 7.624 -16.537 32.862 . . . 1.0 . . . . . . . . . . . . A . 60 GLY H . . . . . . . . . rr_1iyu 1 . 1 . 894 . 1 1 60 GLY HA2 H 5.573 -17.653 32.311 . . . 1.0 . . . . . . . . . . . . A . 60 GLY HA2 . . . . . . . . . rr_1iyu 1 . 1 . 895 . 1 1 60 GLY HA3 H 4.729 -16.615 33.461 . . . 1.0 . . . . . . . . . . . . A . 60 GLY HA3 . . . . . . . . . rr_1iyu 1 . 1 . 896 . 1 1 60 GLY N N 6.788 -16.199 33.245 . . . 1.0 . . . . . . . . . . . . A . 60 GLY N . . . . . . . . . rr_1iyu 1 . 1 . 897 . 1 1 60 GLY O O 4.144 -15.990 30.807 . . . 1.0 . . . . . . . . . . . . A . 60 GLY O . . . . . . . . . rr_1iyu 1 . 1 . 898 . 1 1 61 ASP C C 5.870 -14.210 28.970 . . . 1.0 . . . . . . . . . . . . A . 61 ASP C . . . . . . . . . rr_1iyu 1 . 1 . 899 . 1 1 61 ASP CA C 5.385 -13.653 30.310 . . . 1.0 . . . . . . . . . . . . A . 61 ASP CA . . . . . . . . . rr_1iyu 1 . 1 . 900 . 1 1 61 ASP CB C 6.053 -12.301 30.572 . . . 1.0 . . . . . . . . . . . . A . 61 ASP CB . . . . . . . . . rr_1iyu 1 . 1 . 901 . 1 1 61 ASP CG C 5.123 -11.426 31.414 . . . 1.0 . . . . . . . . . . . . A . 61 ASP CG . . . . . . . . . rr_1iyu 1 . 1 . 902 . 1 1 61 ASP H H 6.481 -14.396 32.009 . . . 1.0 . . . . . . . . . . . . A . 61 ASP H . . . . . . . . . rr_1iyu 1 . 1 . 903 . 1 1 61 ASP HA H 4.313 -13.524 30.280 . . . 1.0 . . . . . . . . . . . . A . 61 ASP HA . . . . . . . . . rr_1iyu 1 . 1 . 904 . 1 1 61 ASP HB2 H 6.981 -12.456 31.103 . . . 1.0 . . . . . . . . . . . . A . 61 ASP HB2 . . . . . . . . . rr_1iyu 1 . 1 . 905 . 1 1 61 ASP HB3 H 6.253 -11.810 29.632 . . . 1.0 . . . . . . . . . . . . A . 61 ASP HB3 . . . . . . . . . rr_1iyu 1 . 1 . 906 . 1 1 61 ASP N N 5.740 -14.603 31.401 . . . 1.0 . . . . . . . . . . . . A . 61 ASP N . . . . . . . . . rr_1iyu 1 . 1 . 907 . 1 1 61 ASP O O 6.774 -15.020 28.915 . . . 1.0 . . . . . . . . . . . . A . 61 ASP O . . . . . . . . . rr_1iyu 1 . 1 . 908 . 1 1 61 ASP OD1 O 4.874 -11.785 32.554 . . . 1.0 . . . . . . . . . . . . A . 61 ASP OD1 . . . . . . . . . rr_1iyu 1 . 1 . 909 . 1 1 61 ASP OD2 O 4.675 -10.412 30.906 . . . 1.0 . . . . . . . . . . . . A . 61 ASP OD2 . . . . . . . . . rr_1iyu 1 . 1 . 910 . 1 1 62 LYS C C 6.484 -13.195 25.821 . . . 1.0 . . . . . . . . . . . . A . 62 LYS C . . . . . . . . . rr_1iyu 1 . 1 . 911 . 1 1 62 LYS CA C 5.705 -14.288 26.555 . . . 1.0 . . . . . . . . . . . . A . 62 LYS CA . . . . . . . . . rr_1iyu 1 . 1 . 912 . 1 1 62 LYS CB C 4.471 -14.673 25.736 . . . 1.0 . . . . . . . . . . . . A . 62 LYS CB . . . . . . . . . rr_1iyu 1 . 1 . 913 . 1 1 62 LYS CD C 2.098 -15.325 26.171 . . . 1.0 . . . . . . . . . . . . A . 62 LYS CD . . . . . . . . . rr_1iyu 1 . 1 . 914 . 1 1 62 LYS CE C 1.810 -16.062 24.862 . . . 1.0 . . . . . . . . . . . . A . 62 LYS CE . . . . . . . . . rr_1iyu 1 . 1 . 915 . 1 1 62 LYS CG C 3.554 -15.560 26.579 . . . 1.0 . . . . . . . . . . . . A . 62 LYS CG . . . . . . . . . rr_1iyu 1 . 1 . 916 . 1 1 62 LYS H H 4.550 -13.128 27.955 . . . 1.0 . . . . . . . . . . . . A . 62 LYS H . . . . . . . . . rr_1iyu 1 . 1 . 917 . 1 1 62 LYS HA H 6.335 -15.155 26.684 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HA . . . . . . . . . rr_1iyu 1 . 1 . 918 . 1 1 62 LYS HB2 H 3.939 -13.778 25.445 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HB2 . . . . . . . . . rr_1iyu 1 . 1 . 919 . 1 1 62 LYS HB3 H 4.778 -15.212 24.853 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HB3 . . . . . . . . . rr_1iyu 1 . 1 . 920 . 1 1 62 LYS HD2 H 1.443 -15.696 26.946 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HD2 . . . . . . . . . rr_1iyu 1 . 1 . 921 . 1 1 62 LYS HD3 H 1.929 -14.268 26.031 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HD3 . . . . . . . . . rr_1iyu 1 . 1 . 922 . 1 1 62 LYS HE2 H 2.484 -15.711 24.095 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HE2 . . . . . . . . . rr_1iyu 1 . 1 . 923 . 1 1 62 LYS HE3 H 1.950 -17.123 25.007 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HE3 . . . . . . . . . rr_1iyu 1 . 1 . 924 . 1 1 62 LYS HG2 H 3.811 -16.598 26.419 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HG2 . . . . . . . . . rr_1iyu 1 . 1 . 925 . 1 1 62 LYS HG3 H 3.676 -15.315 27.623 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HG3 . . . . . . . . . rr_1iyu 1 . 1 . 926 . 1 1 62 LYS HZ1 H -0.128 -15.405 25.246 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HZ1 . . . . . . . . . rr_1iyu 1 . 1 . 927 . 1 1 62 LYS HZ2 H 0.396 -15.123 23.655 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HZ2 . . . . . . . . . rr_1iyu 1 . 1 . 928 . 1 1 62 LYS HZ3 H -0.039 -16.690 24.138 . . . 1.0 . . . . . . . . . . . . A . 62 LYS HZ3 . . . . . . . . . rr_1iyu 1 . 1 . 929 . 1 1 62 LYS N N 5.277 -13.782 27.889 . . . 1.0 . . . . . . . . . . . . A . 62 LYS N . . . . . . . . . rr_1iyu 1 . 1 . 930 . 1 1 62 LYS NZ N 0.403 -15.800 24.443 . . . 1.0 . . . . . . . . . . . . A . 62 LYS NZ . . . . . . . . . rr_1iyu 1 . 1 . 931 . 1 1 62 LYS O O 6.177 -12.024 25.924 . . . 1.0 . . . . . . . . . . . . A . 62 LYS O . . . . . . . . . rr_1iyu 1 . 1 . 932 . 1 1 63 LEU C C 8.658 -13.095 22.959 . . . 1.0 . . . . . . . . . . . . A . 63 LEU C . . . . . . . . . rr_1iyu 1 . 1 . 933 . 1 1 63 LEU CA C 8.289 -12.550 24.340 . . . 1.0 . . . . . . . . . . . . A . 63 LEU CA . . . . . . . . . rr_1iyu 1 . 1 . 934 . 1 1 63 LEU CB C 9.567 -12.236 25.122 . . . 1.0 . . . . . . . . . . . . A . 63 LEU CB . . . . . . . . . rr_1iyu 1 . 1 . 935 . 1 1 63 LEU CD1 C 10.082 -11.992 27.554 . . . 1.0 . . . . . . . . . . . . A . 63 LEU CD1 . . . . . . . . . rr_1iyu 1 . 1 . 936 . 1 1 63 LEU CD2 C 9.452 -9.988 26.203 . . . 1.0 . . . . . . . . . . . . A . 63 LEU CD2 . . . . . . . . . rr_1iyu 1 . 1 . 937 . 1 1 63 LEU CG C 9.209 -11.485 26.405 . . . 1.0 . . . . . . . . . . . . A . 63 LEU CG . . . . . . . . . rr_1iyu 1 . 1 . 938 . 1 1 63 LEU H H 7.723 -14.518 25.009 . . . 1.0 . . . . . . . . . . . . A . 63 LEU H . . . . . . . . . rr_1iyu 1 . 1 . 939 . 1 1 63 LEU HA H 7.706 -11.648 24.227 . . . 1.0 . . . . . . . . . . . . A . 63 LEU HA . . . . . . . . . rr_1iyu 1 . 1 . 940 . 1 1 63 LEU HB2 H 10.071 -13.159 25.372 . . . 1.0 . . . . . . . . . . . . A . 63 LEU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 941 . 1 1 63 LEU HB3 H 10.217 -11.622 24.517 . . . 1.0 . . . . . . . . . . . . A . 63 LEU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 942 . 1 1 63 LEU HD11 H 11.042 -12.301 27.167 . . . 1.0 . . . . . . . . . . . . A . 63 LEU HD11 . . . . . . . . . rr_1iyu 1 . 1 . 943 . 1 1 63 LEU HD12 H 10.223 -11.200 28.276 . . . 1.0 . . . . . . . . . . . . A . 63 LEU HD12 . . . . . . . . . rr_1iyu 1 . 1 . 944 . 1 1 63 LEU HD13 H 9.599 -12.832 28.031 . . . 1.0 . . . . . . . . . . . . A . 63 LEU HD13 . . . . . . . . . rr_1iyu 1 . 1 . 945 . 1 1 63 LEU HD21 H 9.712 -9.801 25.172 . . . 1.0 . . . . . . . . . . . . A . 63 LEU HD21 . . . . . . . . . rr_1iyu 1 . 1 . 946 . 1 1 63 LEU HD22 H 8.555 -9.441 26.453 . . . 1.0 . . . . . . . . . . . . A . 63 LEU HD22 . . . . . . . . . rr_1iyu 1 . 1 . 947 . 1 1 63 LEU HD23 H 10.260 -9.665 26.842 . . . 1.0 . . . . . . . . . . . . A . 63 LEU HD23 . . . . . . . . . rr_1iyu 1 . 1 . 948 . 1 1 63 LEU HG H 8.168 -11.655 26.643 . . . 1.0 . . . . . . . . . . . . A . 63 LEU HG . . . . . . . . . rr_1iyu 1 . 1 . 949 . 1 1 63 LEU N N 7.492 -13.568 25.080 . . . 1.0 . . . . . . . . . . . . A . 63 LEU N . . . . . . . . . rr_1iyu 1 . 1 . 950 . 1 1 63 LEU O O 8.956 -14.262 22.801 . . . 1.0 . . . . . . . . . . . . A . 63 LEU O . . . . . . . . . rr_1iyu 1 . 1 . 951 . 1 1 64 LYS C C 10.445 -12.372 20.281 . . . 1.0 . . . . . . . . . . . . A . 64 LYS C . . . . . . . . . rr_1iyu 1 . 1 . 952 . 1 1 64 LYS CA C 8.989 -12.730 20.587 . . . 1.0 . . . . . . . . . . . . A . 64 LYS CA . . . . . . . . . rr_1iyu 1 . 1 . 953 . 1 1 64 LYS CB C 8.072 -12.054 19.565 . . . 1.0 . . . . . . . . . . . . A . 64 LYS CB . . . . . . . . . rr_1iyu 1 . 1 . 954 . 1 1 64 LYS CD C 6.618 -12.437 17.569 . . . 1.0 . . . . . . . . . . . . A . 64 LYS CD . . . . . . . . . rr_1iyu 1 . 1 . 955 . 1 1 64 LYS CE C 6.987 -12.755 16.119 . . . 1.0 . . . . . . . . . . . . A . 64 LYS CE . . . . . . . . . rr_1iyu 1 . 1 . 956 . 1 1 64 LYS CG C 7.643 -13.075 18.510 . . . 1.0 . . . . . . . . . . . . A . 64 LYS CG . . . . . . . . . rr_1iyu 1 . 1 . 957 . 1 1 64 LYS H H 8.396 -11.321 22.105 . . . 1.0 . . . . . . . . . . . . A . 64 LYS H . . . . . . . . . rr_1iyu 1 . 1 . 958 . 1 1 64 LYS HA H 8.862 -13.801 20.531 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HA . . . . . . . . . rr_1iyu 1 . 1 . 959 . 1 1 64 LYS HB2 H 7.198 -11.665 20.068 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HB2 . . . . . . . . . rr_1iyu 1 . 1 . 960 . 1 1 64 LYS HB3 H 8.602 -11.245 19.086 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HB3 . . . . . . . . . rr_1iyu 1 . 1 . 961 . 1 1 64 LYS HD2 H 5.636 -12.832 17.787 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HD2 . . . . . . . . . rr_1iyu 1 . 1 . 962 . 1 1 64 LYS HD3 H 6.615 -11.367 17.712 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HD3 . . . . . . . . . rr_1iyu 1 . 1 . 963 . 1 1 64 LYS HE2 H 7.790 -12.106 15.802 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HE2 . . . . . . . . . rr_1iyu 1 . 1 . 964 . 1 1 64 LYS HE3 H 7.307 -13.784 16.047 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HE3 . . . . . . . . . rr_1iyu 1 . 1 . 965 . 1 1 64 LYS HG2 H 8.507 -13.390 17.942 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HG2 . . . . . . . . . rr_1iyu 1 . 1 . 966 . 1 1 64 LYS HG3 H 7.199 -13.930 18.995 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HG3 . . . . . . . . . rr_1iyu 1 . 1 . 967 . 1 1 64 LYS HZ1 H 5.231 -11.753 15.620 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HZ1 . . . . . . . . . rr_1iyu 1 . 1 . 968 . 1 1 64 LYS HZ2 H 6.114 -12.314 14.281 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HZ2 . . . . . . . . . rr_1iyu 1 . 1 . 969 . 1 1 64 LYS HZ3 H 5.223 -13.406 15.225 . . . 1.0 . . . . . . . . . . . . A . 64 LYS HZ3 . . . . . . . . . rr_1iyu 1 . 1 . 970 . 1 1 64 LYS N N 8.639 -12.259 21.957 . . . 1.0 . . . . . . . . . . . . A . 64 LYS N . . . . . . . . . rr_1iyu 1 . 1 . 971 . 1 1 64 LYS NZ N 5.799 -12.541 15.246 . . . 1.0 . . . . . . . . . . . . A . 64 LYS NZ . . . . . . . . . rr_1iyu 1 . 1 . 972 . 1 1 64 LYS O O 10.921 -11.313 20.637 . . . 1.0 . . . . . . . . . . . . A . 64 LYS O . . . . . . . . . rr_1iyu 1 . 1 . 973 . 1 1 65 GLU C C 12.724 -11.507 18.856 . . . 1.0 . . . . . . . . . . . . A . 65 GLU C . . . . . . . . . rr_1iyu 1 . 1 . 974 . 1 1 65 GLU CA C 12.580 -12.965 19.298 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CA . . . . . . . . . rr_1iyu 1 . 1 . 975 . 1 1 65 GLU CB C 13.037 -13.888 18.167 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CB . . . . . . . . . rr_1iyu 1 . 1 . 976 . 1 1 65 GLU CD C 12.304 -14.727 15.930 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CD . . . . . . . . . rr_1iyu 1 . 1 . 977 . 1 1 65 GLU CG C 12.291 -13.528 16.881 . . . 1.0 . . . . . . . . . . . . A . 65 GLU CG . . . . . . . . . rr_1iyu 1 . 1 . 978 . 1 1 65 GLU H H 10.753 -14.098 19.351 . . . 1.0 . . . . . . . . . . . . A . 65 GLU H . . . . . . . . . rr_1iyu 1 . 1 . 979 . 1 1 65 GLU HA H 13.189 -13.138 20.171 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HA . . . . . . . . . rr_1iyu 1 . 1 . 980 . 1 1 65 GLU HB2 H 14.100 -13.769 18.013 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 981 . 1 1 65 GLU HB3 H 12.824 -14.913 18.430 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 982 . 1 1 65 GLU HG2 H 11.269 -13.268 17.119 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HG2 . . . . . . . . . rr_1iyu 1 . 1 . 983 . 1 1 65 GLU HG3 H 12.775 -12.689 16.406 . . . 1.0 . . . . . . . . . . . . A . 65 GLU HG3 . . . . . . . . . rr_1iyu 1 . 1 . 984 . 1 1 65 GLU N N 11.156 -13.250 19.626 . . . 1.0 . . . . . . . . . . . . A . 65 GLU N . . . . . . . . . rr_1iyu 1 . 1 . 985 . 1 1 65 GLU O O 11.895 -10.981 18.141 . . . 1.0 . . . . . . . . . . . . A . 65 GLU O . . . . . . . . . rr_1iyu 1 . 1 . 986 . 1 1 65 GLU OE1 O 13.371 -15.279 15.720 . . . 1.0 . . . . . . . . . . . . A . 65 GLU OE1 . . . . . . . . . rr_1iyu 1 . 1 . 987 . 1 1 65 GLU OE2 O 11.247 -15.072 15.428 . . . 1.0 . . . . . . . . . . . . A . 65 GLU OE2 . . . . . . . . . rr_1iyu 1 . 1 . 988 . 1 1 66 GLY C C 13.511 -8.511 20.015 . . . 1.0 . . . . . . . . . . . . A . 66 GLY C . . . . . . . . . rr_1iyu 1 . 1 . 989 . 1 1 66 GLY CA C 13.967 -9.427 18.878 . . . 1.0 . . . . . . . . . . . . A . 66 GLY CA . . . . . . . . . rr_1iyu 1 . 1 . 990 . 1 1 66 GLY H H 14.428 -11.293 19.852 . . . 1.0 . . . . . . . . . . . . A . 66 GLY H . . . . . . . . . rr_1iyu 1 . 1 . 991 . 1 1 66 GLY HA2 H 15.013 -9.253 18.670 . . . 1.0 . . . . . . . . . . . . A . 66 GLY HA2 . . . . . . . . . rr_1iyu 1 . 1 . 992 . 1 1 66 GLY HA3 H 13.383 -9.216 17.995 . . . 1.0 . . . . . . . . . . . . A . 66 GLY HA3 . . . . . . . . . rr_1iyu 1 . 1 . 993 . 1 1 66 GLY N N 13.771 -10.850 19.275 . . . 1.0 . . . . . . . . . . . . A . 66 GLY N . . . . . . . . . rr_1iyu 1 . 1 . 994 . 1 1 66 GLY O O 13.829 -7.339 20.046 . . . 1.0 . . . . . . . . . . . . A . 66 GLY O . . . . . . . . . rr_1iyu 1 . 1 . 995 . 1 1 67 ASP C C 13.370 -8.145 23.171 . . . 1.0 . . . . . . . . . . . . A . 67 ASP C . . . . . . . . . rr_1iyu 1 . 1 . 996 . 1 1 67 ASP CA C 12.294 -8.193 22.085 . . . 1.0 . . . . . . . . . . . . A . 67 ASP CA . . . . . . . . . rr_1iyu 1 . 1 . 997 . 1 1 67 ASP CB C 11.011 -8.794 22.664 . . . 1.0 . . . . . . . . . . . . A . 67 ASP CB . . . . . . . . . rr_1iyu 1 . 1 . 998 . 1 1 67 ASP CG C 9.824 -8.419 21.776 . . . 1.0 . . . . . . . . . . . . A . 67 ASP CG . . . . . . . . . rr_1iyu 1 . 1 . 999 . 1 1 67 ASP H H 12.523 -9.983 20.908 . . . 1.0 . . . . . . . . . . . . A . 67 ASP H . . . . . . . . . rr_1iyu 1 . 1 . 1000 . 1 1 67 ASP HA H 12.094 -7.193 21.731 . . . 1.0 . . . . . . . . . . . . A . 67 ASP HA . . . . . . . . . rr_1iyu 1 . 1 . 1001 . 1 1 67 ASP HB2 H 11.105 -9.870 22.706 . . . 1.0 . . . . . . . . . . . . A . 67 ASP HB2 . . . . . . . . . rr_1iyu 1 . 1 . 1002 . 1 1 67 ASP HB3 H 10.850 -8.408 23.659 . . . 1.0 . . . . . . . . . . . . A . 67 ASP HB3 . . . . . . . . . rr_1iyu 1 . 1 . 1003 . 1 1 67 ASP N N 12.769 -9.035 20.951 . . . 1.0 . . . . . . . . . . . . A . 67 ASP N . . . . . . . . . rr_1iyu 1 . 1 . 1004 . 1 1 67 ASP O O 14.018 -9.132 23.461 . . . 1.0 . . . . . . . . . . . . A . 67 ASP O . . . . . . . . . rr_1iyu 1 . 1 . 1005 . 1 1 67 ASP OD1 O 9.937 -8.579 20.571 . . . 1.0 . . . . . . . . . . . . A . 67 ASP OD1 . . . . . . . . . rr_1iyu 1 . 1 . 1006 . 1 1 67 ASP OD2 O 8.823 -7.978 22.314 . . . 1.0 . . . . . . . . . . . . A . 67 ASP OD2 . . . . . . . . . rr_1iyu 1 . 1 . 1007 . 1 1 68 ALA C C 14.226 -7.809 26.010 . . . 1.0 . . . . . . . . . . . . A . 68 ALA C . . . . . . . . . rr_1iyu 1 . 1 . 1008 . 1 1 68 ALA CA C 14.602 -6.896 24.842 . . . 1.0 . . . . . . . . . . . . A . 68 ALA CA . . . . . . . . . rr_1iyu 1 . 1 . 1009 . 1 1 68 ALA CB C 14.680 -5.448 25.330 . . . 1.0 . . . . . . . . . . . . A . 68 ALA CB . . . . . . . . . rr_1iyu 1 . 1 . 1010 . 1 1 68 ALA H H 13.034 -6.221 23.527 . . . 1.0 . . . . . . . . . . . . A . 68 ALA H . . . . . . . . . rr_1iyu 1 . 1 . 1011 . 1 1 68 ALA HA H 15.561 -7.195 24.445 . . . 1.0 . . . . . . . . . . . . A . 68 ALA HA . . . . . . . . . rr_1iyu 1 . 1 . 1012 . 1 1 68 ALA HB1 H 13.681 -5.061 25.470 . . . 1.0 . . . . . . . . . . . . A . 68 ALA HB1 . . . . . . . . . rr_1iyu 1 . 1 . 1013 . 1 1 68 ALA HB2 H 15.214 -5.413 26.268 . . . 1.0 . . . . . . . . . . . . A . 68 ALA HB2 . . . . . . . . . rr_1iyu 1 . 1 . 1014 . 1 1 68 ALA HB3 H 15.199 -4.849 24.597 . . . 1.0 . . . . . . . . . . . . A . 68 ALA HB3 . . . . . . . . . rr_1iyu 1 . 1 . 1015 . 1 1 68 ALA N N 13.567 -7.005 23.775 . . . 1.0 . . . . . . . . . . . . A . 68 ALA N . . . . . . . . . rr_1iyu 1 . 1 . 1016 . 1 1 68 ALA O O 13.066 -8.067 26.261 . . . 1.0 . . . . . . . . . . . . A . 68 ALA O . . . . . . . . . rr_1iyu 1 . 1 . 1017 . 1 1 69 ILE C C 15.330 -8.519 29.181 . . . 1.0 . . . . . . . . . . . . A . 69 ILE C . . . . . . . . . rr_1iyu 1 . 1 . 1018 . 1 1 69 ILE CA C 14.896 -9.197 27.879 . . . 1.0 . . . . . . . . . . . . A . 69 ILE CA . . . . . . . . . rr_1iyu 1 . 1 . 1019 . 1 1 69 ILE CB C 15.655 -10.515 27.713 . . . 1.0 . . . . . . . . . . . . A . 69 ILE CB . . . . . . . . . rr_1iyu 1 . 1 . 1020 . 1 1 69 ILE CD1 C 13.821 -11.632 26.435 . . . 1.0 . . . . . . . . . . . . A . 69 ILE CD1 . . . . . . . . . rr_1iyu 1 . 1 . 1021 . 1 1 69 ILE CG1 C 15.273 -11.156 26.377 . . . 1.0 . . . . . . . . . . . . A . 69 ILE CG1 . . . . . . . . . rr_1iyu 1 . 1 . 1022 . 1 1 69 ILE CG2 C 15.288 -11.463 28.856 . . . 1.0 . . . . . . . . . . . . A . 69 ILE CG2 . . . . . . . . . rr_1iyu 1 . 1 . 1023 . 1 1 69 ILE H H 16.129 -8.081 26.509 . . . 1.0 . . . . . . . . . . . . A . 69 ILE H . . . . . . . . . rr_1iyu 1 . 1 . 1024 . 1 1 69 ILE HA H 13.835 -9.394 27.913 . . . 1.0 . . . . . . . . . . . . A . 69 ILE HA . . . . . . . . . rr_1iyu 1 . 1 . 1025 . 1 1 69 ILE HB H 16.718 -10.323 27.733 . . . 1.0 . . . . . . . . . . . . A . 69 ILE HB . . . . . . . . . rr_1iyu 1 . 1 . 1026 . 1 1 69 ILE HD11 H 13.391 -11.363 27.389 . . . 1.0 . . . . . . . . . . . . A . 69 ILE HD11 . . . . . . . . . rr_1iyu 1 . 1 . 1027 . 1 1 69 ILE HD12 H 13.257 -11.164 25.641 . . . 1.0 . . . . . . . . . . . . A . 69 ILE HD12 . . . . . . . . . rr_1iyu 1 . 1 . 1028 . 1 1 69 ILE HD13 H 13.788 -12.705 26.315 . . . 1.0 . . . . . . . . . . . . A . 69 ILE HD13 . . . . . . . . . rr_1iyu 1 . 1 . 1029 . 1 1 69 ILE HG12 H 15.384 -10.430 25.585 . . . 1.0 . . . . . . . . . . . . A . 69 ILE HG12 . . . . . . . . . rr_1iyu 1 . 1 . 1030 . 1 1 69 ILE HG13 H 15.919 -12.000 26.185 . . . 1.0 . . . . . . . . . . . . A . 69 ILE HG13 . . . . . . . . . rr_1iyu 1 . 1 . 1031 . 1 1 69 ILE HG21 H 15.455 -10.969 29.801 . . . 1.0 . . . . . . . . . . . . A . 69 ILE HG21 . . . . . . . . . rr_1iyu 1 . 1 . 1032 . 1 1 69 ILE HG22 H 14.247 -11.740 28.774 . . . 1.0 . . . . . . . . . . . . A . 69 ILE HG22 . . . . . . . . . rr_1iyu 1 . 1 . 1033 . 1 1 69 ILE HG23 H 15.902 -12.350 28.799 . . . 1.0 . . . . . . . . . . . . A . 69 ILE HG23 . . . . . . . . . rr_1iyu 1 . 1 . 1034 . 1 1 69 ILE N N 15.199 -8.301 26.728 . . . 1.0 . . . . . . . . . . . . A . 69 ILE N . . . . . . . . . rr_1iyu 1 . 1 . 1035 . 1 1 69 ILE O O 14.516 -8.176 30.014 . . . 1.0 . . . . . . . . . . . . A . 69 ILE O . . . . . . . . . rr_1iyu 1 . 1 . 1036 . 1 1 70 ILE C C 18.271 -6.753 30.280 . . . 1.0 . . . . . . . . . . . . A . 70 ILE C . . . . . . . . . rr_1iyu 1 . 1 . 1037 . 1 1 70 ILE CA C 17.092 -7.670 30.610 . . . 1.0 . . . . . . . . . . . . A . 70 ILE CA . . . . . . . . . rr_1iyu 1 . 1 . 1038 . 1 1 70 ILE CB C 17.542 -8.740 31.606 . . . 1.0 . . . . . . . . . . . . A . 70 ILE CB . . . . . . . . . rr_1iyu 1 . 1 . 1039 . 1 1 70 ILE CD1 C 19.642 -10.087 31.746 . . . 1.0 . . . . . . . . . . . . A . 70 ILE CD1 . . . . . . . . . rr_1iyu 1 . 1 . 1040 . 1 1 70 ILE CG1 C 18.417 -9.769 30.886 . . . 1.0 . . . . . . . . . . . . A . 70 ILE CG1 . . . . . . . . . rr_1iyu 1 . 1 . 1041 . 1 1 70 ILE CG2 C 16.314 -9.439 32.193 . . . 1.0 . . . . . . . . . . . . A . 70 ILE CG2 . . . . . . . . . rr_1iyu 1 . 1 . 1042 . 1 1 70 ILE H H 17.249 -8.609 28.677 . . . 1.0 . . . . . . . . . . . . A . 70 ILE H . . . . . . . . . rr_1iyu 1 . 1 . 1043 . 1 1 70 ILE HA H 16.293 -7.087 31.044 . . . 1.0 . . . . . . . . . . . . A . 70 ILE HA . . . . . . . . . rr_1iyu 1 . 1 . 1044 . 1 1 70 ILE HB H 18.107 -8.276 32.401 . . . 1.0 . . . . . . . . . . . . A . 70 ILE HB . . . . . . . . . rr_1iyu 1 . 1 . 1045 . 1 1 70 ILE HD11 H 19.356 -10.109 32.787 . . . 1.0 . . . . . . . . . . . . A . 70 ILE HD11 . . . . . . . . . rr_1iyu 1 . 1 . 1046 . 1 1 70 ILE HD12 H 20.041 -11.050 31.461 . . . 1.0 . . . . . . . . . . . . A . 70 ILE HD12 . . . . . . . . . rr_1iyu 1 . 1 . 1047 . 1 1 70 ILE HD13 H 20.395 -9.327 31.595 . . . 1.0 . . . . . . . . . . . . A . 70 ILE HD13 . . . . . . . . . rr_1iyu 1 . 1 . 1048 . 1 1 70 ILE HG12 H 17.848 -10.672 30.720 . . . 1.0 . . . . . . . . . . . . A . 70 ILE HG12 . . . . . . . . . rr_1iyu 1 . 1 . 1049 . 1 1 70 ILE HG13 H 18.740 -9.367 29.938 . . . 1.0 . . . . . . . . . . . . A . 70 ILE HG13 . . . . . . . . . rr_1iyu 1 . 1 . 1050 . 1 1 70 ILE HG21 H 15.583 -8.699 32.484 . . . 1.0 . . . . . . . . . . . . A . 70 ILE HG21 . . . . . . . . . rr_1iyu 1 . 1 . 1051 . 1 1 70 ILE HG22 H 15.886 -10.097 31.452 . . . 1.0 . . . . . . . . . . . . A . 70 ILE HG22 . . . . . . . . . rr_1iyu 1 . 1 . 1052 . 1 1 70 ILE HG23 H 16.608 -10.015 33.058 . . . 1.0 . . . . . . . . . . . . A . 70 ILE HG23 . . . . . . . . . rr_1iyu 1 . 1 . 1053 . 1 1 70 ILE N N 16.608 -8.325 29.362 . . . 1.0 . . . . . . . . . . . . A . 70 ILE N . . . . . . . . . rr_1iyu 1 . 1 . 1054 . 1 1 70 ILE O O 18.717 -6.679 29.152 . . . 1.0 . . . . . . . . . . . . A . 70 ILE O . . . . . . . . . rr_1iyu 1 . 1 . 1055 . 1 1 71 GLU C C 21.034 -5.410 32.024 . . . 1.0 . . . . . . . . . . . . A . 71 GLU C . . . . . . . . . rr_1iyu 1 . 1 . 1056 . 1 1 71 GLU CA C 19.932 -5.142 30.998 . . . 1.0 . . . . . . . . . . . . A . 71 GLU CA . . . . . . . . . rr_1iyu 1 . 1 . 1057 . 1 1 71 GLU CB C 19.468 -3.689 31.115 . . . 1.0 . . . . . . . . . . . . A . 71 GLU CB . . . . . . . . . rr_1iyu 1 . 1 . 1058 . 1 1 71 GLU CD C 19.120 -1.557 29.859 . . . 1.0 . . . . . . . . . . . . A . 71 GLU CD . . . . . . . . . rr_1iyu 1 . 1 . 1059 . 1 1 71 GLU CG C 19.441 -3.047 29.727 . . . 1.0 . . . . . . . . . . . . A . 71 GLU CG . . . . . . . . . rr_1iyu 1 . 1 . 1060 . 1 1 71 GLU H H 18.408 -6.127 32.159 . . . 1.0 . . . . . . . . . . . . A . 71 GLU H . . . . . . . . . rr_1iyu 1 . 1 . 1061 . 1 1 71 GLU HA H 20.315 -5.319 30.003 . . . 1.0 . . . . . . . . . . . . A . 71 GLU HA . . . . . . . . . rr_1iyu 1 . 1 . 1062 . 1 1 71 GLU HB2 H 18.476 -3.662 31.545 . . . 1.0 . . . . . . . . . . . . A . 71 GLU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 1063 . 1 1 71 GLU HB3 H 20.150 -3.143 31.749 . . . 1.0 . . . . . . . . . . . . A . 71 GLU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 1064 . 1 1 71 GLU HG2 H 20.406 -3.168 29.256 . . . 1.0 . . . . . . . . . . . . A . 71 GLU HG2 . . . . . . . . . rr_1iyu 1 . 1 . 1065 . 1 1 71 GLU HG3 H 18.684 -3.524 29.124 . . . 1.0 . . . . . . . . . . . . A . 71 GLU HG3 . . . . . . . . . rr_1iyu 1 . 1 . 1066 . 1 1 71 GLU N N 18.782 -6.053 31.256 . . . 1.0 . . . . . . . . . . . . A . 71 GLU N . . . . . . . . . rr_1iyu 1 . 1 . 1067 . 1 1 71 GLU O O 20.935 -5.022 33.171 . . . 1.0 . . . . . . . . . . . . A . 71 GLU O . . . . . . . . . rr_1iyu 1 . 1 . 1068 . 1 1 71 GLU OE1 O 17.949 -1.231 29.964 . . . 1.0 . . . . . . . . . . . . A . 71 GLU OE1 . . . . . . . . . rr_1iyu 1 . 1 . 1069 . 1 1 71 GLU OE2 O 20.050 -0.768 29.852 . . . 1.0 . . . . . . . . . . . . A . 71 GLU OE2 . . . . . . . . . rr_1iyu 1 . 1 . 1070 . 1 1 72 LEU C C 24.210 -5.219 32.537 . . . 1.0 . . . . . . . . . . . . A . 72 LEU C . . . . . . . . . rr_1iyu 1 . 1 . 1071 . 1 1 72 LEU CA C 23.193 -6.361 32.575 . . . 1.0 . . . . . . . . . . . . A . 72 LEU CA . . . . . . . . . rr_1iyu 1 . 1 . 1072 . 1 1 72 LEU CB C 23.879 -7.670 32.177 . . . 1.0 . . . . . . . . . . . . A . 72 LEU CB . . . . . . . . . rr_1iyu 1 . 1 . 1073 . 1 1 72 LEU CD1 C 25.429 -9.272 33.306 . . . 1.0 . . . . . . . . . . . . A . 72 LEU CD1 . . . . . . . . . rr_1iyu 1 . 1 . 1074 . 1 1 72 LEU CD2 C 26.349 -7.323 32.044 . . . 1.0 . . . . . . . . . . . . A . 72 LEU CD2 . . . . . . . . . rr_1iyu 1 . 1 . 1075 . 1 1 72 LEU CG C 25.201 -7.806 32.934 . . . 1.0 . . . . . . . . . . . . A . 72 LEU CG . . . . . . . . . rr_1iyu 1 . 1 . 1076 . 1 1 72 LEU H H 22.147 -6.374 30.692 . . . 1.0 . . . . . . . . . . . . A . 72 LEU H . . . . . . . . . rr_1iyu 1 . 1 . 1077 . 1 1 72 LEU HA H 22.792 -6.454 33.574 . . . 1.0 . . . . . . . . . . . . A . 72 LEU HA . . . . . . . . . rr_1iyu 1 . 1 . 1078 . 1 1 72 LEU HB2 H 23.236 -8.503 32.423 . . . 1.0 . . . . . . . . . . . . A . 72 LEU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 1079 . 1 1 72 LEU HB3 H 24.074 -7.666 31.115 . . . 1.0 . . . . . . . . . . . . A . 72 LEU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 1080 . 1 1 72 LEU HD11 H 24.742 -9.895 32.753 . . . 1.0 . . . . . . . . . . . . A . 72 LEU HD11 . . . . . . . . . rr_1iyu 1 . 1 . 1081 . 1 1 72 LEU HD12 H 26.444 -9.551 33.064 . . . 1.0 . . . . . . . . . . . . A . 72 LEU HD12 . . . . . . . . . rr_1iyu 1 . 1 . 1082 . 1 1 72 LEU HD13 H 25.262 -9.404 34.365 . . . 1.0 . . . . . . . . . . . . A . 72 LEU HD13 . . . . . . . . . rr_1iyu 1 . 1 . 1083 . 1 1 72 LEU HD21 H 25.945 -6.868 31.151 . . . 1.0 . . . . . . . . . . . . A . 72 LEU HD21 . . . . . . . . . rr_1iyu 1 . 1 . 1084 . 1 1 72 LEU HD22 H 26.940 -6.597 32.582 . . . 1.0 . . . . . . . . . . . . A . 72 LEU HD22 . . . . . . . . . rr_1iyu 1 . 1 . 1085 . 1 1 72 LEU HD23 H 26.970 -8.163 31.771 . . . 1.0 . . . . . . . . . . . . A . 72 LEU HD23 . . . . . . . . . rr_1iyu 1 . 1 . 1086 . 1 1 72 LEU HG H 25.163 -7.208 33.833 . . . 1.0 . . . . . . . . . . . . A . 72 LEU HG . . . . . . . . . rr_1iyu 1 . 1 . 1087 . 1 1 72 LEU N N 22.086 -6.070 31.621 . . . 1.0 . . . . . . . . . . . . A . 72 LEU N . . . . . . . . . rr_1iyu 1 . 1 . 1088 . 1 1 72 LEU O O 24.471 -4.641 31.501 . . . 1.0 . . . . . . . . . . . . A . 72 LEU O . . . . . . . . . rr_1iyu 1 . 1 . 1089 . 1 1 73 GLU C C 27.173 -4.363 33.991 . . . 1.0 . . . . . . . . . . . . A . 73 GLU C . . . . . . . . . rr_1iyu 1 . 1 . 1090 . 1 1 73 GLU CA C 25.787 -3.787 33.689 . . . 1.0 . . . . . . . . . . . . A . 73 GLU CA . . . . . . . . . rr_1iyu 1 . 1 . 1091 . 1 1 73 GLU CB C 25.405 -2.781 34.777 . . . 1.0 . . . . . . . . . . . . A . 73 GLU CB . . . . . . . . . rr_1iyu 1 . 1 . 1092 . 1 1 73 GLU CD C 25.460 -0.343 35.318 . . . 1.0 . . . . . . . . . . . . A . 73 GLU CD . . . . . . . . . rr_1iyu 1 . 1 . 1093 . 1 1 73 GLU CG C 26.148 -1.465 34.539 . . . 1.0 . . . . . . . . . . . . A . 73 GLU CG . . . . . . . . . rr_1iyu 1 . 1 . 1094 . 1 1 73 GLU H H 24.563 -5.370 34.485 . . . 1.0 . . . . . . . . . . . . A . 73 GLU H . . . . . . . . . rr_1iyu 1 . 1 . 1095 . 1 1 73 GLU HA H 25.804 -3.290 32.730 . . . 1.0 . . . . . . . . . . . . A . 73 GLU HA . . . . . . . . . rr_1iyu 1 . 1 . 1096 . 1 1 73 GLU HB2 H 24.340 -2.605 34.746 . . . 1.0 . . . . . . . . . . . . A . 73 GLU HB2 . . . . . . . . . rr_1iyu 1 . 1 . 1097 . 1 1 73 GLU HB3 H 25.678 -3.176 35.744 . . . 1.0 . . . . . . . . . . . . A . 73 GLU HB3 . . . . . . . . . rr_1iyu 1 . 1 . 1098 . 1 1 73 GLU HG2 H 27.170 -1.563 34.875 . . . 1.0 . . . . . . . . . . . . A . 73 GLU HG2 . . . . . . . . . rr_1iyu 1 . 1 . 1099 . 1 1 73 GLU HG3 H 26.135 -1.229 33.486 . . . 1.0 . . . . . . . . . . . . A . 73 GLU HG3 . . . . . . . . . rr_1iyu 1 . 1 . 1100 . 1 1 73 GLU N N 24.787 -4.890 33.660 . . . 1.0 . . . . . . . . . . . . A . 73 GLU N . . . . . . . . . rr_1iyu 1 . 1 . 1101 . 1 1 73 GLU O O 27.531 -4.548 35.138 . . . 1.0 . . . . . . . . . . . . A . 73 GLU O . . . . . . . . . rr_1iyu 1 . 1 . 1102 . 1 1 73 GLU OE1 O 24.524 -0.639 36.044 . . . 1.0 . . . . . . . . . . . . A . 73 GLU OE1 . . . . . . . . . rr_1iyu 1 . 1 . 1103 . 1 1 73 GLU OE2 O 25.880 0.794 35.177 . . . 1.0 . . . . . . . . . . . . A . 73 GLU OE2 . . . . . . . . . rr_1iyu 1 . 1 . 1104 . 1 1 74 PRO C C 30.268 -4.094 33.439 . . . 1.0 . . . . . . . . . . . . A . 74 PRO C . . . . . . . . . rr_1iyu 1 . 1 . 1105 . 1 1 74 PRO CA C 29.270 -5.188 33.052 . . . 1.0 . . . . . . . . . . . . A . 74 PRO CA . . . . . . . . . rr_1iyu 1 . 1 . 1106 . 1 1 74 PRO CB C 29.552 -5.715 31.642 . . . 1.0 . . . . . . . . . . . . A . 74 PRO CB . . . . . . . . . rr_1iyu 1 . 1 . 1107 . 1 1 74 PRO CD C 27.458 -4.397 31.560 . . . 1.0 . . . . . . . . . . . . A . 74 PRO CD . . . . . . . . . rr_1iyu 1 . 1 . 1108 . 1 1 74 PRO CG C 28.607 -4.941 30.691 . . . 1.0 . . . . . . . . . . . . A . 74 PRO CG . . . . . . . . . rr_1iyu 1 . 1 . 1109 . 1 1 74 PRO HA H 29.295 -5.999 33.762 . . . 1.0 . . . . . . . . . . . . A . 74 PRO HA . . . . . . . . . rr_1iyu 1 . 1 . 1110 . 1 1 74 PRO HB2 H 30.584 -5.529 31.379 . . . 1.0 . . . . . . . . . . . . A . 74 PRO HB2 . . . . . . . . . rr_1iyu 1 . 1 . 1111 . 1 1 74 PRO HB3 H 29.337 -6.770 31.589 . . . 1.0 . . . . . . . . . . . . A . 74 PRO HB3 . . . . . . . . . rr_1iyu 1 . 1 . 1112 . 1 1 74 PRO HD2 H 27.315 -3.340 31.378 . . . 1.0 . . . . . . . . . . . . A . 74 PRO HD2 . . . . . . . . . rr_1iyu 1 . 1 . 1113 . 1 1 74 PRO HD3 H 26.547 -4.943 31.369 . . . 1.0 . . . . . . . . . . . . A . 74 PRO HD3 . . . . . . . . . rr_1iyu 1 . 1 . 1114 . 1 1 74 PRO HG2 H 29.142 -4.125 30.224 . . . 1.0 . . . . . . . . . . . . A . 74 PRO HG2 . . . . . . . . . rr_1iyu 1 . 1 . 1115 . 1 1 74 PRO HG3 H 28.212 -5.606 29.939 . . . 1.0 . . . . . . . . . . . . A . 74 PRO HG3 . . . . . . . . . rr_1iyu 1 . 1 . 1116 . 1 1 74 PRO N N 27.911 -4.630 32.946 . . . 1.0 . . . . . . . . . . . . A . 74 PRO N . . . . . . . . . rr_1iyu 1 . 1 . 1117 . 1 1 74 PRO O O 30.992 -3.579 32.609 . . . 1.0 . . . . . . . . . . . . A . 74 PRO O . . . . . . . . . rr_1iyu 1 . 1 . 1118 . 1 1 75 ALA C C 32.641 -2.942 34.520 . . . 1.0 . . . . . . . . . . . . A . 75 ALA C . . . . . . . . . rr_1iyu 1 . 1 . 1119 . 1 1 75 ALA CA C 31.264 -2.676 35.131 . . . 1.0 . . . . . . . . . . . . A . 75 ALA CA . . . . . . . . . rr_1iyu 1 . 1 . 1120 . 1 1 75 ALA CB C 31.372 -2.687 36.657 . . . 1.0 . . . . . . . . . . . . A . 75 ALA CB . . . . . . . . . rr_1iyu 1 . 1 . 1121 . 1 1 75 ALA H H 29.721 -4.163 35.346 . . . 1.0 . . . . . . . . . . . . A . 75 ALA H . . . . . . . . . rr_1iyu 1 . 1 . 1122 . 1 1 75 ALA HA H 30.905 -1.711 34.803 . . . 1.0 . . . . . . . . . . . . A . 75 ALA HA . . . . . . . . . rr_1iyu 1 . 1 . 1123 . 1 1 75 ALA HB1 H 31.178 -3.684 37.024 . . . 1.0 . . . . . . . . . . . . A . 75 ALA HB1 . . . . . . . . . rr_1iyu 1 . 1 . 1124 . 1 1 75 ALA HB2 H 32.366 -2.383 36.950 . . . 1.0 . . . . . . . . . . . . A . 75 ALA HB2 . . . . . . . . . rr_1iyu 1 . 1 . 1125 . 1 1 75 ALA HB3 H 30.649 -2.002 37.074 . . . 1.0 . . . . . . . . . . . . A . 75 ALA HB3 . . . . . . . . . rr_1iyu 1 . 1 . 1126 . 1 1 75 ALA N N 30.313 -3.735 34.693 . . . 1.0 . . . . . . . . . . . . A . 75 ALA N . . . . . . . . . rr_1iyu 1 . 1 . 1127 . 1 1 75 ALA O O 33.408 -3.740 35.020 . . . 1.0 . . . . . . . . . . . . A . 75 ALA O . . . . . . . . . rr_1iyu 1 . 1 . 1128 . 1 1 76 ALA C C 35.326 -1.588 33.461 . . . 1.0 . . . . . . . . . . . . A . 76 ALA C . . . . . . . . . rr_1iyu 1 . 1 . 1129 . 1 1 76 ALA CA C 34.287 -2.497 32.801 . . . 1.0 . . . . . . . . . . . . A . 76 ALA CA . . . . . . . . . rr_1iyu 1 . 1 . 1130 . 1 1 76 ALA CB C 34.193 -2.165 31.310 . . . 1.0 . . . . . . . . . . . . A . 76 ALA CB . . . . . . . . . rr_1iyu 1 . 1 . 1131 . 1 1 76 ALA H H 32.327 -1.641 33.054 . . . 1.0 . . . . . . . . . . . . A . 76 ALA H . . . . . . . . . rr_1iyu 1 . 1 . 1132 . 1 1 76 ALA HA H 34.582 -3.528 32.922 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HA . . . . . . . . . rr_1iyu 1 . 1 . 1133 . 1 1 76 ALA HB1 H 33.491 -1.357 31.165 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HB1 . . . . . . . . . rr_1iyu 1 . 1 . 1134 . 1 1 76 ALA HB2 H 35.165 -1.867 30.945 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HB2 . . . . . . . . . rr_1iyu 1 . 1 . 1135 . 1 1 76 ALA HB3 H 33.857 -3.036 30.768 . . . 1.0 . . . . . . . . . . . . A . 76 ALA HB3 . . . . . . . . . rr_1iyu 1 . 1 . 1136 . 1 1 76 ALA N N 32.960 -2.280 33.442 . . . 1.0 . . . . . . . . . . . . A . 76 ALA N . . . . . . . . . rr_1iyu 1 . 1 . 1137 . 1 1 76 ALA O O 35.955 -0.775 32.814 . . . 1.0 . . . . . . . . . . . . A . 76 ALA O . . . . . . . . . rr_1iyu 1 . 1 . 1138 . 1 1 77 GLY C C 35.835 0.437 35.899 . . . 1.0 . . . . . . . . . . . . A . 77 GLY C . . . . . . . . . rr_1iyu 1 . 1 . 1139 . 1 1 77 GLY CA C 36.506 -0.861 35.448 . . . 1.0 . . . . . . . . . . . . A . 77 GLY CA . . . . . . . . . rr_1iyu 1 . 1 . 1140 . 1 1 77 GLY H H 34.991 -2.380 35.251 . . . 1.0 . . . . . . . . . . . . A . 77 GLY H . . . . . . . . . rr_1iyu 1 . 1 . 1141 . 1 1 77 GLY HA2 H 36.892 -1.388 36.309 . . . 1.0 . . . . . . . . . . . . A . 77 GLY HA2 . . . . . . . . . rr_1iyu 1 . 1 . 1142 . 1 1 77 GLY HA3 H 37.317 -0.627 34.775 . . . 1.0 . . . . . . . . . . . . A . 77 GLY HA3 . . . . . . . . . rr_1iyu 1 . 1 . 1143 . 1 1 77 GLY N N 35.509 -1.718 34.747 . . . 1.0 . . . . . . . . . . . . A . 77 GLY N . . . . . . . . . rr_1iyu 1 . 1 . 1144 . 1 1 77 GLY O O 35.714 0.707 37.077 . . . 1.0 . . . . . . . . . . . . A . 77 GLY O . . . . . . . . . rr_1iyu 1 . 1 . 1145 . 1 1 78 ALA C C 35.575 3.243 36.404 . . . 1.0 . . . . . . . . . . . . A . 78 ALA C . . . . . . . . . rr_1iyu 1 . 1 . 1146 . 1 1 78 ALA CA C 34.734 2.524 35.347 . . . 1.0 . . . . . . . . . . . . A . 78 ALA CA . . . . . . . . . rr_1iyu 1 . 1 . 1147 . 1 1 78 ALA CB C 33.343 2.230 35.913 . . . 1.0 . . . . . . . . . . . . A . 78 ALA CB . . . . . . . . . rr_1iyu 1 . 1 . 1148 . 1 1 78 ALA H H 35.506 1.007 34.026 . . . 1.0 . . . . . . . . . . . . A . 78 ALA H . . . . . . . . . rr_1iyu 1 . 1 . 1149 . 1 1 78 ALA HA H 34.642 3.151 34.473 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HA . . . . . . . . . rr_1iyu 1 . 1 . 1150 . 1 1 78 ALA HB1 H 33.420 1.477 36.683 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HB1 . . . . . . . . . rr_1iyu 1 . 1 . 1151 . 1 1 78 ALA HB2 H 32.927 3.134 36.332 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HB2 . . . . . . . . . rr_1iyu 1 . 1 . 1152 . 1 1 78 ALA HB3 H 32.702 1.871 35.121 . . . 1.0 . . . . . . . . . . . . A . 78 ALA HB3 . . . . . . . . . rr_1iyu 1 . 1 . 1153 . 1 1 78 ALA N N 35.398 1.244 34.971 . . . 1.0 . . . . . . . . . . . . A . 78 ALA N . . . . . . . . . rr_1iyu 1 . 1 . 1154 . 1 1 78 ALA O O 36.480 3.990 36.088 . . . 1.0 . . . . . . . . . . . . A . 78 ALA O . . . . . . . . . rr_1iyu 1 . 1 . 1155 . 1 1 79 ARG C C 36.099 5.206 38.470 . . . 1.0 . . . . . . . . . . . . A . 79 ARG C . . . . . . . . . rr_1iyu 1 . 1 . 1156 . 1 1 79 ARG CA C 36.066 3.699 38.732 . . . 1.0 . . . . . . . . . . . . A . 79 ARG CA . . . . . . . . . rr_1iyu 1 . 1 . 1157 . 1 1 79 ARG CB C 37.495 3.152 38.740 . . . 1.0 . . . . . . . . . . . . A . 79 ARG CB . . . . . . . . . rr_1iyu 1 . 1 . 1158 . 1 1 79 ARG CD C 39.271 3.128 40.498 . . . 1.0 . . . . . . . . . . . . A . 79 ARG CD . . . . . . . . . rr_1iyu 1 . 1 . 1159 . 1 1 79 ARG CG C 38.370 4.022 39.645 . . . 1.0 . . . . . . . . . . . . A . 79 ARG CG . . . . . . . . . rr_1iyu 1 . 1 . 1160 . 1 1 79 ARG CZ C 37.361 2.338 41.761 . . . 1.0 . . . . . . . . . . . . A . 79 ARG CZ . . . . . . . . . rr_1iyu 1 . 1 . 1161 . 1 1 79 ARG H H 34.549 2.421 37.893 . . . 1.0 . . . . . . . . . . . . A . 79 ARG H . . . . . . . . . rr_1iyu 1 . 1 . 1162 . 1 1 79 ARG HA H 35.602 3.510 39.688 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HA . . . . . . . . . rr_1iyu 1 . 1 . 1163 . 1 1 79 ARG HB2 H 37.489 2.137 39.112 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HB2 . . . . . . . . . rr_1iyu 1 . 1 . 1164 . 1 1 79 ARG HB3 H 37.892 3.166 37.737 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HB3 . . . . . . . . . rr_1iyu 1 . 1 . 1165 . 1 1 79 ARG HD2 H 39.483 2.215 39.962 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HD2 . . . . . . . . . rr_1iyu 1 . 1 . 1166 . 1 1 79 ARG HD3 H 40.195 3.645 40.709 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HD3 . . . . . . . . . rr_1iyu 1 . 1 . 1167 . 1 1 79 ARG HE H 39.041 2.940 42.632 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HE . . . . . . . . . rr_1iyu 1 . 1 . 1168 . 1 1 79 ARG HG2 H 38.980 4.674 39.036 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HG2 . . . . . . . . . rr_1iyu 1 . 1 . 1169 . 1 1 79 ARG HG3 H 37.741 4.617 40.290 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HG3 . . . . . . . . . rr_1iyu 1 . 1 . 1170 . 1 1 79 ARG HH11 H 37.930 0.429 41.563 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HH11 . . . . . . . . . rr_1iyu 1 . 1 . 1171 . 1 1 79 ARG HH12 H 36.220 0.698 41.629 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HH12 . . . . . . . . . rr_1iyu 1 . 1 . 1172 . 1 1 79 ARG HH21 H 36.507 4.138 41.955 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HH21 . . . . . . . . . rr_1iyu 1 . 1 . 1173 . 1 1 79 ARG HH22 H 35.415 2.798 41.850 . . . 1.0 . . . . . . . . . . . . A . 79 ARG HH22 . . . . . . . . . rr_1iyu 1 . 1 . 1174 . 1 1 79 ARG N N 35.283 3.026 37.658 . . . 1.0 . . . . . . . . . . . . A . 79 ARG N . . . . . . . . . rr_1iyu 1 . 1 . 1175 . 1 1 79 ARG NE N 38.580 2.803 41.778 . . . 1.0 . . . . . . . . . . . . A . 79 ARG NE . . . . . . . . . rr_1iyu 1 . 1 . 1176 . 1 1 79 ARG NH1 N 37.154 1.055 41.642 . . . 1.0 . . . . . . . . . . . . A . 79 ARG NH1 . . . . . . . . . rr_1iyu 1 . 1 . 1177 . 1 1 79 ARG NH2 N 36.349 3.155 41.863 . . . 1.0 . . . . . . . . . . . . A . 79 ARG NH2 . . . . . . . . . rr_1iyu 1 . 1 . 1178 . 1 1 79 ARG O O 37.009 5.650 37.789 . . . 1.0 . . . . . . . . . . . . A . 79 ARG O . . . . . . . . . rr_1iyu 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_1iyu _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 1iyu.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 rr_1iyu 1 1 1iyu.mr . . XPLOR/CNS 2 distance NOE simple 474 rr_1iyu 1 1 1iyu.mr . . XPLOR/CNS 3 distance 'hydrogen bond' simple 22 rr_1iyu 1 1 1iyu.mr . . n/a 4 comment 'Not applicable' 'Not applicable' 0 rr_1iyu 1 1 1iyu.mr . . XPLOR/CNS 5 'dihedral angle' 'Not applicable' 'Not applicable' 66 rr_1iyu 1 1 1iyu.mr . . n/a 6 comment 'Not applicable' 'Not applicable' 0 rr_1iyu 1 1 1iyu.mr . . 'MR format' 7 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 rr_1iyu 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_1iyu _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_1iyu 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 2 2 GLU H H . . . 1 1 1 1 SER HA H . . . . . 2.7 0.0 2.7 . . . . . A . 2 GLU H . . A . 1 SER HA . . . 2 . HN . . . . . 1 . HA . . rr_1iyu 1 2 1 . . 1 1 2 2 GLU H H . . . 1 1 1 1 SER HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 2 GLU H . . A . 1 SER HB3 . . . 2 . HN . . . . . 1 . HB1 . . rr_1iyu 1 3 1 . . 1 1 2 2 GLU H H . . . 1 1 1 1 SER HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 2 GLU H . . A . 1 SER HB2 . . . 2 . HN . . . . . 1 . HB2 . . rr_1iyu 1 4 1 OR . 1 1 2 2 GLU H H . . . 1 1 1 1 SER HB3 H . . . . . 4.1 0.0 4.1 . . . . . A . 2 GLU H . . A . 1 SER HB3 . . . 2 . HN . . . . . 1 . HB* . . rr_1iyu 1 4 2 OR . 1 1 2 2 GLU H H . . . 1 1 1 1 SER HB2 H . . . . . 4.1 0.0 4.1 . . . . . A . 2 GLU H . . A . 1 SER HB2 . . . 2 . HN . . . . . 1 . HB* . . rr_1iyu 1 5 1 . . 1 1 2 2 GLU H H . . . 1 1 2 2 GLU HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 2 GLU H . . A . 2 GLU HB3 . . . 2 . HN . . . . . 2 . HB1 . . rr_1iyu 1 6 1 . . 1 1 2 2 GLU H H . . . 1 1 2 2 GLU HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 2 GLU H . . A . 2 GLU HB2 . . . 2 . HN . . . . . 2 . HB2 . . rr_1iyu 1 7 1 OR . 1 1 2 2 GLU H H . . . 1 1 2 2 GLU HB2 H . . . . . 4.1 0.0 4.1 . . . . . A . 2 GLU H . . A . 2 GLU HB2 . . . 2 . HN . . . . . 2 . HB* . . rr_1iyu 1 7 2 OR . 1 1 2 2 GLU H H . . . 1 1 2 2 GLU HB3 H . . . . . 4.1 0.0 4.1 . . . . . A . 2 GLU H . . A . 2 GLU HB3 . . . 2 . HN . . . . . 2 . HB* . . rr_1iyu 1 8 1 OR . 1 1 2 2 GLU H H . . . 1 1 2 2 GLU HG2 H . . . . . 3.3 0.0 4.3 . . . . . A . 2 GLU H . . A . 2 GLU HG2 . . . 2 . HN . . . . . 2 . HG* . . rr_1iyu 1 8 2 OR . 1 1 2 2 GLU H H . . . 1 1 2 2 GLU HG3 H . . . . . 3.3 0.0 4.3 . . . . . A . 2 GLU H . . A . 2 GLU HG3 . . . 2 . HN . . . . . 2 . HG* . . rr_1iyu 1 9 1 . . 1 1 2 2 GLU H H . . . 1 1 73 73 GLU HA H . . . . . 5.0 0.0 5.0 . . . . . A . 2 GLU H . . A . 73 GLU HA . . . 2 . HN . . . . . 73 . HA . . rr_1iyu 1 10 1 . . 1 1 3 3 ILE H H . . . 1 1 2 2 GLU HA H . . . . . 2.7 0.0 2.7 . . . . . A . 3 ILE H . . A . 2 GLU HA . . . 3 . HN . . . . . 2 . HA . . rr_1iyu 1 11 1 . . 1 1 3 3 ILE H H . . . 1 1 3 3 ILE HB H . . . . . 2.7 0.0 2.7 . . . . . A . 3 ILE H . . A . 3 ILE HB . . . 3 . HN . . . . . 3 . HB . . rr_1iyu 1 12 1 . . 1 1 4 4 ILE H H . . . 1 1 3 3 ILE HA H . . . . . 2.7 0.0 2.7 . . . . . A . 4 ILE H . . A . 3 ILE HA . . . 4 . HN . . . . . 3 . HA . . rr_1iyu 1 13 1 . . 1 1 4 4 ILE H H . . . 1 1 4 4 ILE HB H . . . . . 2.7 0.0 2.7 . . . . . A . 4 ILE H . . A . 4 ILE HB . . . 4 . HN . . . . . 4 . HB . . rr_1iyu 1 14 1 . . 1 1 4 4 ILE H H . . . 1 1 70 70 ILE H H . . . . . 3.3 0.0 3.3 . . . . . A . 4 ILE H . . A . 70 ILE H . . . 4 . HN . . . . . 70 . HN . . rr_1iyu 1 15 1 . . 1 1 4 4 ILE H H . . . 1 1 71 71 GLU HA H . . . . . 3.3 0.0 3.3 . . . . . A . 4 ILE H . . A . 71 GLU HA . . . 4 . HN . . . . . 71 . HA . . rr_1iyu 1 16 1 OR . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HG2 H . . . . . 3.3 0.0 3.9 . . . . . A . 5 ARG HA . . A . 5 ARG HG2 . . . 5 . HA . . . . . 5 . HG* . . rr_1iyu 1 16 2 OR . 1 1 5 5 ARG HA H . . . 1 1 5 5 ARG HG3 H . . . . . 3.3 0.0 3.9 . . . . . A . 5 ARG HA . . A . 5 ARG HG3 . . . 5 . HA . . . . . 5 . HG* . . rr_1iyu 1 17 1 . . 1 1 5 5 ARG HA H . . . 1 1 6 6 VAL HB H . . . . . 5.0 0.0 5.0 . . . . . A . 5 ARG HA . . A . 6 VAL HB . . . 5 . HA . . . . . 6 . HB . . rr_1iyu 1 18 1 . . 1 1 5 5 ARG HA H . . . 1 1 6 6 VAL MG2 H . . . . . 5.0 0.0 6.5 . . . . . A . 5 ARG HA . . A . 6 VAL MG2 . . . 5 . HA . . . . . 6 . HG2* . . rr_1iyu 1 19 1 . . 1 1 5 5 ARG HA H . . . 1 1 68 68 ALA HA H . . . . . 2.7 0.0 2.7 . . . . . A . 5 ARG HA . . A . 68 ALA HA . . . 5 . HA . . . . . 68 . HA . . rr_1iyu 1 20 1 . . 1 1 5 5 ARG HA H . . . 1 1 69 69 ILE MD H . . . . . 5.0 0.0 6.5 . . . . . A . 5 ARG HA . . A . 69 ILE MD . . . 5 . HA . . . . . 69 . HD1* . . rr_1iyu 1 21 1 . . 1 1 5 5 ARG H H . . . 1 1 4 4 ILE HA H . . . . . 2.7 0.0 2.7 . . . . . A . 5 ARG H . . A . 4 ILE HA . . . 5 . HN . . . . . 4 . HA . . rr_1iyu 1 22 1 OR . 1 1 5 5 ARG H H . . . 1 1 5 5 ARG HB2 H . . . . . 2.7 0.0 3.3 . . . . . A . 5 ARG H . . A . 5 ARG HB2 . . . 5 . HN . . . . . 5 . HB* . . rr_1iyu 1 22 2 OR . 1 1 5 5 ARG H H . . . 1 1 5 5 ARG HB3 H . . . . . 2.7 0.0 3.3 . . . . . A . 5 ARG H . . A . 5 ARG HB3 . . . 5 . HN . . . . . 5 . HB* . . rr_1iyu 1 23 1 OR . 1 1 5 5 ARG H H . . . 1 1 5 5 ARG HG2 H . . . . . 5.0 0.0 6.0 . . . . . A . 5 ARG H . . A . 5 ARG HG2 . . . 5 . HN . . . . . 5 . HG* . . rr_1iyu 1 23 2 OR . 1 1 5 5 ARG HG3 H . . . 1 1 5 5 ARG H H . . . . . 5.0 0.0 6.0 . . . . . A . 5 ARG HG3 . . A . 5 ARG H . . . 5 . HG* . . . . . 5 . HN . . rr_1iyu 1 24 1 . . 1 1 6 6 VAL HA H . . . 1 1 6 6 VAL MG1 H . . . . . 2.7 0.0 3.8 . . . . . A . 6 VAL HA . . A . 6 VAL MG1 . . . 6 . HA . . . . . 6 . HG1* . . rr_1iyu 1 25 1 . . 1 1 69 69 ILE MD H . . . 1 1 6 6 VAL HA H . . . . . 3.3 0.0 4.8 . . . . . A . 69 ILE MD . . A . 6 VAL HA . . . 69 . HD1* . . . . . 6 . HA . . rr_1iyu 1 26 1 . . 1 1 5 5 ARG HA H . . . 1 1 6 6 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 5 ARG HA . . A . 6 VAL H . . . 5 . HA . . . . . 6 . HN . . rr_1iyu 1 27 1 OR . 1 1 6 6 VAL H H . . . 1 1 5 5 ARG HB2 H . . . . . 5.0 0.0 6.0 . . . . . A . 6 VAL H . . A . 5 ARG HB2 . . . 6 . HN . . . . . 5 . HB* . . rr_1iyu 1 27 2 OR . 1 1 5 5 ARG HB3 H . . . 1 1 6 6 VAL H H . . . . . 5.0 0.0 6.0 . . . . . A . 5 ARG HB3 . . A . 6 VAL H . . . 5 . HB* . . . . . 6 . HN . . rr_1iyu 1 28 1 OR . 1 1 6 6 VAL H H . . . 1 1 5 5 ARG HG2 H . . . . . 3.3 0.0 4.3 . . . . . A . 6 VAL H . . A . 5 ARG HG2 . . . 6 . HN . . . . . 5 . HG* . . rr_1iyu 1 28 2 OR . 1 1 5 5 ARG HG3 H . . . 1 1 6 6 VAL H H . . . . . 3.3 0.0 4.3 . . . . . A . 5 ARG HG3 . . A . 6 VAL H . . . 5 . HG* . . . . . 6 . HN . . rr_1iyu 1 29 1 . . 1 1 6 6 VAL HB H . . . 1 1 6 6 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 6 VAL HB . . A . 6 VAL H . . . 6 . HB . . . . . 6 . HN . . rr_1iyu 1 30 1 . . 1 1 6 6 VAL MG1 H . . . 1 1 6 6 VAL H H . . . . . 5.0 0.0 6.5 . . . . . A . 6 VAL MG1 . . A . 6 VAL H . . . 6 . HG1* . . . . . 6 . HN . . rr_1iyu 1 31 1 . . 1 1 6 6 VAL MG2 H . . . 1 1 6 6 VAL H H . . . . . 2.7 0.0 4.2 . . . . . A . 6 VAL MG2 . . A . 6 VAL H . . . 6 . HG2* . . . . . 6 . HN . . rr_1iyu 1 32 1 . . 1 1 6 6 VAL H H . . . 1 1 67 67 ASP H H . . . . . 5.0 0.0 5.0 . . . . . A . 6 VAL H . . A . 67 ASP H . . . 6 . HN . . . . . 67 . HN . . rr_1iyu 1 33 1 . . 1 1 69 69 ILE MD H . . . 1 1 6 6 VAL H H . . . . . 5.0 0.0 6.5 . . . . . A . 69 ILE MD . . A . 6 VAL H . . . 69 . HD1* . . . . . 6 . HN . . rr_1iyu 1 34 1 OR . 1 1 6 6 VAL H H . . . 1 1 7 7 PRO HD3 H . . . . . 5.0 0.0 6.0 . . . . . A . 6 VAL H . . A . 7 PRO HD3 . . . 6 . HN . . . . . 7 . HD* . . rr_1iyu 1 34 2 OR . 1 1 6 6 VAL H H . . . 1 1 7 7 PRO HD2 H . . . . . 5.0 0.0 6.0 . . . . . A . 6 VAL H . . A . 7 PRO HD2 . . . 6 . HN . . . . . 7 . HD* . . rr_1iyu 1 35 1 . . 1 1 7 7 PRO HA H . . . 1 1 7 7 PRO HD3 H . . . . . 5.0 0.0 5.0 . . . . . A . 7 PRO HA . . A . 7 PRO HD3 . . . 7 . HA . . . . . 7 . HD1 . . rr_1iyu 1 36 1 . . 1 1 7 7 PRO HD2 H . . . 1 1 7 7 PRO HA H . . . . . 5.0 0.0 5.0 . . . . . A . 7 PRO HD2 . . A . 7 PRO HA . . . 7 . HD2 . . . . . 7 . HA . . rr_1iyu 1 37 1 OR . 1 1 7 7 PRO HA H . . . 1 1 7 7 PRO HD3 H . . . . . 4.1 0.0 4.1 . . . . . A . 7 PRO HA . . A . 7 PRO HD3 . . . 7 . HA . . . . . 7 . HD* . . rr_1iyu 1 37 2 OR . 1 1 7 7 PRO HD2 H . . . 1 1 7 7 PRO HA H . . . . . 4.1 0.0 4.1 . . . . . A . 7 PRO HD2 . . A . 7 PRO HA . . . 7 . HD* . . . . . 7 . HA . . rr_1iyu 1 38 1 OR . 1 1 6 6 VAL MG1 H . . . 1 1 7 7 PRO HD3 H . . . . . 3.3 0.0 5.8 . . . . . A . 6 VAL MG1 . . A . 7 PRO HD3 . . . 6 . HG1* . . . . . 7 . HD* . . rr_1iyu 1 38 2 OR . 1 1 6 6 VAL MG1 H . . . 1 1 7 7 PRO HD2 H . . . . . 3.3 0.0 5.8 . . . . . A . 6 VAL MG1 . . A . 7 PRO HD2 . . . 6 . HG1* . . . . . 7 . HD* . . rr_1iyu 1 39 1 OR . 1 1 69 69 ILE MD H . . . 1 1 7 7 PRO HD3 H . . . . . 5.0 0.0 7.5 . . . . . A . 69 ILE MD . . A . 7 PRO HD3 . . . 69 . HD1* . . . . . 7 . HD* . . rr_1iyu 1 39 2 OR . 1 1 69 69 ILE MD H . . . 1 1 7 7 PRO HD2 H . . . . . 5.0 0.0 7.5 . . . . . A . 69 ILE MD . . A . 7 PRO HD2 . . . 69 . HD1* . . . . . 7 . HD* . . rr_1iyu 1 40 1 . . 1 1 7 7 PRO HA H . . . 1 1 8 8 ASP H H . . . . . 2.7 0.0 2.7 . . . . . A . 7 PRO HA . . A . 8 ASP H . . . 7 . HA . . . . . 8 . HN . . rr_1iyu 1 41 1 . . 1 1 8 8 ASP H H . . . 1 1 7 7 PRO HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 8 ASP H . . A . 7 PRO HB3 . . . 8 . HN . . . . . 7 . HB1 . . rr_1iyu 1 42 1 . . 1 1 8 8 ASP H H . . . 1 1 7 7 PRO HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 8 ASP H . . A . 7 PRO HB2 . . . 8 . HN . . . . . 7 . HB2 . . rr_1iyu 1 43 1 OR . 1 1 8 8 ASP H H . . . 1 1 7 7 PRO HB3 H . . . . . 3.9 0.0 3.9 . . . . . A . 8 ASP H . . A . 7 PRO HB3 . . . 8 . HN . . . . . 7 . HB* . . rr_1iyu 1 43 2 OR . 1 1 8 8 ASP H H . . . 1 1 7 7 PRO HB2 H . . . . . 3.9 0.0 3.9 . . . . . A . 8 ASP H . . A . 7 PRO HB2 . . . 8 . HN . . . . . 7 . HB* . . rr_1iyu 1 44 1 OR . 1 1 8 8 ASP H H . . . 1 1 7 7 PRO HG2 H . . . . . 5.0 0.0 6.0 . . . . . A . 8 ASP H . . A . 7 PRO HG2 . . . 8 . HN . . . . . 7 . HG* . . rr_1iyu 1 44 2 OR . 1 1 8 8 ASP H H . . . 1 1 7 7 PRO HG3 H . . . . . 5.0 0.0 6.0 . . . . . A . 8 ASP H . . A . 7 PRO HG3 . . . 8 . HN . . . . . 7 . HG* . . rr_1iyu 1 45 1 . . 1 1 8 8 ASP H H . . . 1 1 8 8 ASP HB3 H . . . . . 2.7 0.0 2.7 . . . . . A . 8 ASP H . . A . 8 ASP HB3 . . . 8 . HN . . . . . 8 . HB1 . . rr_1iyu 1 46 1 . . 1 1 8 8 ASP H H . . . 1 1 8 8 ASP HB2 H . . . . . 2.7 0.0 2.7 . . . . . A . 8 ASP H . . A . 8 ASP HB2 . . . 8 . HN . . . . . 8 . HB2 . . rr_1iyu 1 47 1 . . 1 1 8 8 ASP H H . . . 1 1 9 9 ILE MG H . . . . . 5.0 0.0 6.5 . . . . . A . 8 ASP H . . A . 9 ILE MG . . . 8 . HN . . . . . 9 . HG2* . . rr_1iyu 1 48 1 OR . 1 1 9 9 ILE H H . . . 1 1 8 8 ASP HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 9 ILE H . . A . 8 ASP HB3 . . . 9 . HN . . . . . 8 . HB* . . rr_1iyu 1 48 2 OR . 1 1 9 9 ILE H H . . . 1 1 8 8 ASP HB2 H . . . . . 5.0 0.0 6.0 . . . . . A . 9 ILE H . . A . 8 ASP HB2 . . . 9 . HN . . . . . 8 . HB* . . rr_1iyu 1 49 1 . . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE HB H . . . . . 3.3 0.0 3.3 . . . . . A . 9 ILE H . . A . 9 ILE HB . . . 9 . HN . . . . . 9 . HB . . rr_1iyu 1 50 1 . . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE MD H . . . . . 5.0 0.0 6.5 . . . . . A . 9 ILE H . . A . 9 ILE MD . . . 9 . HN . . . . . 9 . HD1* . . rr_1iyu 1 51 1 . . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE HG13 H . . . . . 5.0 0.0 5.0 . . . . . A . 9 ILE H . . A . 9 ILE HG13 . . . 9 . HN . . . . . 9 . HG11 . . rr_1iyu 1 52 1 . . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE HG12 H . . . . . 5.0 0.0 5.0 . . . . . A . 9 ILE H . . A . 9 ILE HG12 . . . 9 . HN . . . . . 9 . HG12 . . rr_1iyu 1 53 1 OR . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE HG13 H . . . . . 3.9 0.0 3.9 . . . . . A . 9 ILE H . . A . 9 ILE HG13 . . . 9 . HN . . . . . 9 . HG1* . . rr_1iyu 1 53 2 OR . 1 1 9 9 ILE H H . . . 1 1 9 9 ILE HG12 H . . . . . 3.9 0.0 3.9 . . . . . A . 9 ILE H . . A . 9 ILE HG12 . . . 9 . HN . . . . . 9 . HG1* . . rr_1iyu 1 54 1 . . 1 1 9 9 ILE MG H . . . 1 1 9 9 ILE H H . . . . . 5.0 0.0 6.5 . . . . . A . 9 ILE MG . . A . 9 ILE H . . . 9 . HG2* . . . . . 9 . HN . . rr_1iyu 1 55 1 . . 1 1 10 10 GLY H H . . . 1 1 11 11 GLY H H . . . . . 3.3 0.0 3.3 . . . . . A . 10 GLY H . . A . 11 GLY H . . . 10 . HN . . . . . 11 . HN . . rr_1iyu 1 56 1 . . 1 1 10 10 GLY H H . . . 1 1 9 9 ILE HA H . . . . . 5.0 0.0 5.0 . . . . . A . 10 GLY H . . A . 9 ILE HA . . . 10 . HN . . . . . 9 . HA . . rr_1iyu 1 57 1 OR . 1 1 10 10 GLY H H . . . 1 1 9 9 ILE HG13 H . . . . . 5.0 0.0 6.0 . . . . . A . 10 GLY H . . A . 9 ILE HG13 . . . 10 . HN . . . . . 9 . HG1* . . rr_1iyu 1 57 2 OR . 1 1 9 9 ILE HG12 H . . . 1 1 10 10 GLY H H . . . . . 5.0 0.0 6.0 . . . . . A . 9 ILE HG12 . . A . 10 GLY H . . . 9 . HG1* . . . . . 10 . HN . . rr_1iyu 1 58 1 . . 1 1 9 9 ILE H H . . . 1 1 10 10 GLY H H . . . . . 2.7 0.0 2.7 . . . . . A . 9 ILE H . . A . 10 GLY H . . . 9 . HN . . . . . 10 . HN . . rr_1iyu 1 59 1 . . 1 1 11 11 GLY H H . . . 1 1 10 10 GLY HA3 H . . . . . 5.0 0.0 5.0 . . . . . A . 11 GLY H . . A . 10 GLY HA3 . . . 11 . HN . . . . . 10 . HA1 . . rr_1iyu 1 60 1 . . 1 1 11 11 GLY H H . . . 1 1 10 10 GLY HA2 H . . . . . 5.0 0.0 5.0 . . . . . A . 11 GLY H . . A . 10 GLY HA2 . . . 11 . HN . . . . . 10 . HA2 . . rr_1iyu 1 61 1 . . 1 1 9 9 ILE MD H . . . 1 1 11 11 GLY H H . . . . . 5.0 0.0 6.5 . . . . . A . 9 ILE MD . . A . 11 GLY H . . . 9 . HD1* . . . . . 11 . HN . . rr_1iyu 1 62 1 . . 1 1 11 11 GLY H H . . . 1 1 9 9 ILE HG13 H . . . . . 5.0 0.0 5.0 . . . . . A . 11 GLY H . . A . 9 ILE HG13 . . . 11 . HN . . . . . 9 . HG11 . . rr_1iyu 1 63 1 . . 1 1 9 9 ILE HG12 H . . . 1 1 11 11 GLY H H . . . . . 5.0 0.0 5.0 . . . . . A . 9 ILE HG12 . . A . 11 GLY H . . . 9 . HG12 . . . . . 11 . HN . . rr_1iyu 1 64 1 OR . 1 1 11 11 GLY H H . . . 1 1 9 9 ILE HG13 H . . . . . 4.1 0.0 4.1 . . . . . A . 11 GLY H . . A . 9 ILE HG13 . . . 11 . HN . . . . . 9 . HG1* . . rr_1iyu 1 64 2 OR . 1 1 9 9 ILE HG12 H . . . 1 1 11 11 GLY H H . . . . . 4.1 0.0 4.1 . . . . . A . 9 ILE HG12 . . A . 11 GLY H . . . 9 . HG1* . . . . . 11 . HN . . rr_1iyu 1 65 1 . . 1 1 9 9 ILE MD H . . . 1 1 12 12 ASP HA H . . . . . 3.3 0.0 4.8 . . . . . A . 9 ILE MD . . A . 12 ASP HA . . . 9 . HD1* . . . . . 12 . HA . . rr_1iyu 1 66 1 . . 1 1 12 12 ASP H H . . . 1 1 11 11 GLY HA3 H . . . . . 3.3 0.0 3.3 . . . . . A . 12 ASP H . . A . 11 GLY HA3 . . . 12 . HN . . . . . 11 . HA1 . . rr_1iyu 1 67 1 . . 1 1 12 12 ASP H H . . . 1 1 11 11 GLY HA2 H . . . . . 3.3 0.0 3.3 . . . . . A . 12 ASP H . . A . 11 GLY HA2 . . . 12 . HN . . . . . 11 . HA2 . . rr_1iyu 1 68 1 OR . 1 1 12 12 ASP H H . . . 1 1 11 11 GLY HA3 H . . . . . 2.9 0.0 2.9 . . . . . A . 12 ASP H . . A . 11 GLY HA3 . . . 12 . HN . . . . . 11 . HA* . . rr_1iyu 1 68 2 OR . 1 1 12 12 ASP H H . . . 1 1 11 11 GLY HA2 H . . . . . 2.9 0.0 2.9 . . . . . A . 12 ASP H . . A . 11 GLY HA2 . . . 12 . HN . . . . . 11 . HA* . . rr_1iyu 1 69 1 OR . 1 1 12 12 ASP H H . . . 1 1 12 12 ASP HB2 H . . . . . 3.3 0.0 3.9 . . . . . A . 12 ASP H . . A . 12 ASP HB2 . . . 12 . HN . . . . . 12 . HB* . . rr_1iyu 1 69 2 OR . 1 1 12 12 ASP H H . . . 1 1 12 12 ASP HB3 H . . . . . 3.3 0.0 3.9 . . . . . A . 12 ASP H . . A . 12 ASP HB3 . . . 12 . HN . . . . . 12 . HB* . . rr_1iyu 1 70 1 OR . 1 1 35 35 LEU HB3 H . . . 1 1 13 13 GLY HA2 H . . . . . 3.3 0.0 4.3 . . . . . A . 35 LEU HB3 . . A . 13 GLY HA2 . . . 35 . HB1 . . . . . 13 . HA* . . rr_1iyu 1 70 2 OR . 1 1 13 13 GLY HA3 H . . . 1 1 35 35 LEU HB3 H . . . . . 3.3 0.0 4.3 . . . . . A . 13 GLY HA3 . . A . 35 LEU HB3 . . . 13 . HA* . . . . . 35 . HB1 . . rr_1iyu 1 71 1 OR . 1 1 9 9 ILE MD H . . . 1 1 13 13 GLY HA2 H . . . . . 3.3 0.0 5.8 . . . . . A . 9 ILE MD . . A . 13 GLY HA2 . . . 9 . HD1* . . . . . 13 . HA* . . rr_1iyu 1 71 2 OR . 1 1 9 9 ILE MD H . . . 1 1 13 13 GLY HA3 H . . . . . 3.3 0.0 5.8 . . . . . A . 9 ILE MD . . A . 13 GLY HA3 . . . 9 . HD1* . . . . . 13 . HA* . . rr_1iyu 1 72 1 OR . 1 1 9 9 ILE MG H . . . 1 1 13 13 GLY HA2 H . . . . . 3.3 0.0 5.8 . . . . . A . 9 ILE MG . . A . 13 GLY HA2 . . . 9 . HG2* . . . . . 13 . HA* . . rr_1iyu 1 72 2 OR . 1 1 9 9 ILE MG H . . . 1 1 13 13 GLY HA3 H . . . . . 3.3 0.0 5.8 . . . . . A . 9 ILE MG . . A . 13 GLY HA3 . . . 9 . HG2* . . . . . 13 . HA* . . rr_1iyu 1 73 1 . . 1 1 12 12 ASP HA H . . . 1 1 13 13 GLY H H . . . . . 2.7 0.0 2.7 . . . . . A . 12 ASP HA . . A . 13 GLY H . . . 12 . HA . . . . . 13 . HN . . rr_1iyu 1 74 1 OR . 1 1 13 13 GLY H H . . . 1 1 12 12 ASP HB2 H . . . . . 5.0 0.0 6.0 . . . . . A . 13 GLY H . . A . 12 ASP HB2 . . . 13 . HN . . . . . 12 . HB* . . rr_1iyu 1 74 2 OR . 1 1 12 12 ASP HB3 H . . . 1 1 13 13 GLY H H . . . . . 5.0 0.0 6.0 . . . . . A . 12 ASP HB3 . . A . 13 GLY H . . . 12 . HB* . . . . . 13 . HN . . rr_1iyu 1 75 1 . . 1 1 9 9 ILE MD H . . . 1 1 13 13 GLY H H . . . . . 5.0 0.0 6.5 . . . . . A . 9 ILE MD . . A . 13 GLY H . . . 9 . HD1* . . . . . 13 . HN . . rr_1iyu 1 76 1 OR . 1 1 14 14 GLU HA H . . . 1 1 14 14 GLU HG2 H . . . . . 2.7 0.0 3.3 . . . . . A . 14 GLU HA . . A . 14 GLU HG2 . . . 14 . HA . . . . . 14 . HG* . . rr_1iyu 1 76 2 OR . 1 1 14 14 GLU HA H . . . 1 1 14 14 GLU HG3 H . . . . . 2.7 0.0 3.3 . . . . . A . 14 GLU HA . . A . 14 GLU HG3 . . . 14 . HA . . . . . 14 . HG* . . rr_1iyu 1 77 1 . . 1 1 14 14 GLU HA H . . . 1 1 15 15 VAL MG2 H . . . . . 5.0 0.0 6.5 . . . . . A . 14 GLU HA . . A . 15 VAL MG2 . . . 14 . HA . . . . . 15 . HG2* . . rr_1iyu 1 78 1 . . 1 1 14 14 GLU HA H . . . 1 1 62 62 LYS HA H . . . . . 2.7 0.0 2.7 . . . . . A . 14 GLU HA . . A . 62 LYS HA . . . 14 . HA . . . . . 62 . HA . . rr_1iyu 1 79 1 OR . 1 1 14 14 GLU H H . . . 1 1 13 13 GLY HA2 H . . . . . 5.0 0.0 6.0 . . . . . A . 14 GLU H . . A . 13 GLY HA2 . . . 14 . HN . . . . . 13 . HA* . . rr_1iyu 1 79 2 OR . 1 1 13 13 GLY HA3 H . . . 1 1 14 14 GLU H H . . . . . 5.0 0.0 6.0 . . . . . A . 13 GLY HA3 . . A . 14 GLU H . . . 13 . HA* . . . . . 14 . HN . . rr_1iyu 1 80 1 OR . 1 1 14 14 GLU H H . . . 1 1 14 14 GLU HB2 H . . . . . 2.7 0.0 3.3 . . . . . A . 14 GLU H . . A . 14 GLU HB2 . . . 14 . HN . . . . . 14 . HB* . . rr_1iyu 1 80 2 OR . 1 1 14 14 GLU H H . . . 1 1 14 14 GLU HB3 H . . . . . 2.7 0.0 3.3 . . . . . A . 14 GLU H . . A . 14 GLU HB3 . . . 14 . HN . . . . . 14 . HB* . . rr_1iyu 1 81 1 OR . 1 1 14 14 GLU H H . . . 1 1 14 14 GLU HG2 H . . . . . 5.0 0.0 6.0 . . . . . A . 14 GLU H . . A . 14 GLU HG2 . . . 14 . HN . . . . . 14 . HG* . . rr_1iyu 1 81 2 OR . 1 1 14 14 GLU HG3 H . . . 1 1 14 14 GLU H H . . . . . 5.0 0.0 6.0 . . . . . A . 14 GLU HG3 . . A . 14 GLU H . . . 14 . HG* . . . . . 14 . HN . . rr_1iyu 1 82 1 . . 1 1 14 14 GLU H H . . . 1 1 35 35 LEU HA H . . . . . 5.0 0.0 5.0 . . . . . A . 14 GLU H . . A . 35 LEU HA . . . 14 . HN . . . . . 35 . HA . . rr_1iyu 1 83 1 . . 1 1 14 14 GLU H H . . . 1 1 37 37 SER HA H . . . . . 5.0 0.0 5.0 . . . . . A . 14 GLU H . . A . 37 SER HA . . . 14 . HN . . . . . 37 . HA . . rr_1iyu 1 84 1 . . 1 1 15 15 VAL HA H . . . 1 1 15 15 VAL MG1 H . . . . . 2.7 0.0 3.8 . . . . . A . 15 VAL HA . . A . 15 VAL MG1 . . . 15 . HA . . . . . 15 . HG1* . . rr_1iyu 1 85 1 . . 1 1 14 14 GLU HA H . . . 1 1 15 15 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 14 GLU HA . . A . 15 VAL H . . . 14 . HA . . . . . 15 . HN . . rr_1iyu 1 86 1 OR . 1 1 15 15 VAL H H . . . 1 1 14 14 GLU HB2 H . . . . . 3.3 0.0 4.3 . . . . . A . 15 VAL H . . A . 14 GLU HB2 . . . 15 . HN . . . . . 14 . HB* . . rr_1iyu 1 86 2 OR . 1 1 14 14 GLU HB3 H . . . 1 1 15 15 VAL H H . . . . . 3.3 0.0 4.3 . . . . . A . 14 GLU HB3 . . A . 15 VAL H . . . 14 . HB* . . . . . 15 . HN . . rr_1iyu 1 87 1 OR . 1 1 15 15 VAL H H . . . 1 1 14 14 GLU HG2 H . . . . . 5.0 0.0 6.0 . . . . . A . 15 VAL H . . A . 14 GLU HG2 . . . 15 . HN . . . . . 14 . HG* . . rr_1iyu 1 87 2 OR . 1 1 14 14 GLU HG3 H . . . 1 1 15 15 VAL H H . . . . . 5.0 0.0 6.0 . . . . . A . 14 GLU HG3 . . A . 15 VAL H . . . 14 . HG* . . . . . 15 . HN . . rr_1iyu 1 88 1 . . 1 1 15 15 VAL H H . . . 1 1 15 15 VAL HB H . . . . . 2.7 0.0 2.7 . . . . . A . 15 VAL H . . A . 15 VAL HB . . . 15 . HN . . . . . 15 . HB . . rr_1iyu 1 89 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 15 15 VAL H H . . . . . 5.0 0.0 6.5 . . . . . A . 15 VAL MG1 . . A . 15 VAL H . . . 15 . HG1* . . . . . 15 . HN . . rr_1iyu 1 90 1 . . 1 1 15 15 VAL MG2 H . . . 1 1 15 15 VAL H H . . . . . 2.7 0.0 4.2 . . . . . A . 15 VAL MG2 . . A . 15 VAL H . . . 15 . HG2* . . . . . 15 . HN . . rr_1iyu 1 91 1 . . 1 1 15 15 VAL H H . . . 1 1 61 61 ASP H H . . . . . 5.0 0.0 5.0 . . . . . A . 15 VAL H . . A . 61 ASP H . . . 15 . HN . . . . . 61 . HN . . rr_1iyu 1 92 1 . . 1 1 62 62 LYS HA H . . . 1 1 15 15 VAL H H . . . . . 5.0 0.0 5.0 . . . . . A . 62 LYS HA . . A . 15 VAL H . . . 62 . HA . . . . . 15 . HN . . rr_1iyu 1 93 1 . . 1 1 15 15 VAL HA H . . . 1 1 16 16 ILE H H . . . . . 2.7 0.0 2.7 . . . . . A . 15 VAL HA . . A . 16 ILE H . . . 15 . HA . . . . . 16 . HN . . rr_1iyu 1 94 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 16 16 ILE H H . . . . . 3.3 0.0 4.8 . . . . . A . 15 VAL MG1 . . A . 16 ILE H . . . 15 . HG1* . . . . . 16 . HN . . rr_1iyu 1 95 1 . . 1 1 16 16 ILE H H . . . 1 1 17 17 GLU H H . . . . . 2.7 0.0 2.7 . . . . . A . 16 ILE H . . A . 17 GLU H . . . 16 . HN . . . . . 17 . HN . . rr_1iyu 1 96 1 . . 1 1 35 35 LEU HA H . . . 1 1 16 16 ILE H H . . . . . 3.3 0.0 3.3 . . . . . A . 35 LEU HA . . A . 16 ILE H . . . 35 . HA . . . . . 16 . HN . . rr_1iyu 1 97 1 . . 1 1 15 15 VAL HA H . . . 1 1 17 17 GLU H H . . . . . 5.0 0.0 5.0 . . . . . A . 15 VAL HA . . A . 17 GLU H . . . 15 . HA . . . . . 17 . HN . . rr_1iyu 1 98 1 . . 1 1 17 17 GLU H H . . . 1 1 17 17 GLU HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 17 GLU H . . A . 17 GLU HB3 . . . 17 . HN . . . . . 17 . HB1 . . rr_1iyu 1 99 1 . . 1 1 17 17 GLU H H . . . 1 1 17 17 GLU HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 17 GLU H . . A . 17 GLU HB2 . . . 17 . HN . . . . . 17 . HB2 . . rr_1iyu 1 100 1 OR . 1 1 17 17 GLU H H . . . 1 1 17 17 GLU HB2 H . . . . . 4.1 0.0 4.1 . . . . . A . 17 GLU H . . A . 17 GLU HB2 . . . 17 . HN . . . . . 17 . HB* . . rr_1iyu 1 100 2 OR . 1 1 17 17 GLU H H . . . 1 1 17 17 GLU HB3 H . . . . . 4.1 0.0 4.1 . . . . . A . 17 GLU H . . A . 17 GLU HB3 . . . 17 . HN . . . . . 17 . HB* . . rr_1iyu 1 101 1 OR . 1 1 17 17 GLU H H . . . 1 1 34 34 VAL MG1 H . . . . . 5.0 0.0 8.4 . . . . . A . 17 GLU H . . A . 34 VAL MG1 . . . 17 . HN . . . . . 34 . HG* . . rr_1iyu 1 101 2 OR . 1 1 17 17 GLU H H . . . 1 1 34 34 VAL MG2 H . . . . . 5.0 0.0 8.4 . . . . . A . 17 GLU H . . A . 34 VAL MG2 . . . 17 . HN . . . . . 34 . HG* . . rr_1iyu 1 102 1 . . 1 1 18 18 LEU H H . . . 1 1 17 17 GLU HA H . . . . . 2.7 0.0 2.7 . . . . . A . 18 LEU H . . A . 17 GLU HA . . . 18 . HN . . . . . 17 . HA . . rr_1iyu 1 103 1 . . 1 1 18 18 LEU H H . . . 1 1 17 17 GLU HG3 H . . . . . 5.0 0.0 5.0 . . . . . A . 18 LEU H . . A . 17 GLU HG3 . . . 18 . HN . . . . . 17 . HG1 . . rr_1iyu 1 104 1 . . 1 1 18 18 LEU H H . . . 1 1 17 17 GLU HG2 H . . . . . 5.0 0.0 5.0 . . . . . A . 18 LEU H . . A . 17 GLU HG2 . . . 18 . HN . . . . . 17 . HG2 . . rr_1iyu 1 105 1 . . 1 1 18 18 LEU H H . . . 1 1 18 18 LEU HB3 H . . . . . 3.3 0.0 3.3 . . . . . A . 18 LEU H . . A . 18 LEU HB3 . . . 18 . HN . . . . . 18 . HB1 . . rr_1iyu 1 106 1 . . 1 1 18 18 LEU H H . . . 1 1 18 18 LEU HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 18 LEU H . . A . 18 LEU HB2 . . . 18 . HN . . . . . 18 . HB2 . . rr_1iyu 1 107 1 . . 1 1 18 18 LEU H H . . . 1 1 18 18 LEU MD1 H . . . . . 5.0 0.0 6.5 . . . . . A . 18 LEU H . . A . 18 LEU MD1 . . . 18 . HN . . . . . 18 . HD1* . . rr_1iyu 1 108 1 . . 1 1 18 18 LEU H H . . . 1 1 18 18 LEU MD2 H . . . . . 5.0 0.0 6.5 . . . . . A . 18 LEU H . . A . 18 LEU MD2 . . . 18 . HN . . . . . 18 . HD2* . . rr_1iyu 1 109 1 OR . 1 1 18 18 LEU H H . . . 1 1 18 18 LEU MD1 H . . . . . 5.2 0.0 5.2 . . . . . A . 18 LEU H . . A . 18 LEU MD1 . . . 18 . HN . . . . . 18 . HD* . . rr_1iyu 1 109 2 OR . 1 1 18 18 LEU H H . . . 1 1 18 18 LEU MD2 H . . . . . 5.2 0.0 5.2 . . . . . A . 18 LEU H . . A . 18 LEU MD2 . . . 18 . HN . . . . . 18 . HD* . . rr_1iyu 1 110 1 . . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 19 LEU H . . A . 19 LEU HB3 . . . 19 . HN . . . . . 19 . HB1 . . rr_1iyu 1 111 1 . . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 19 LEU H . . A . 19 LEU HB2 . . . 19 . HN . . . . . 19 . HB2 . . rr_1iyu 1 112 1 OR . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU HB3 H . . . . . 4.1 0.0 4.1 . . . . . A . 19 LEU H . . A . 19 LEU HB3 . . . 19 . HN . . . . . 19 . HB* . . rr_1iyu 1 112 2 OR . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU HB2 H . . . . . 4.1 0.0 4.1 . . . . . A . 19 LEU H . . A . 19 LEU HB2 . . . 19 . HN . . . . . 19 . HB* . . rr_1iyu 1 113 1 OR . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 19 LEU H . . A . 19 LEU MD1 . . . 19 . HN . . . . . 19 . HD* . . rr_1iyu 1 113 2 OR . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU MD2 H . . . . . 5.0 0.0 8.4 . . . . . A . 19 LEU H . . A . 19 LEU MD2 . . . 19 . HN . . . . . 19 . HD* . . rr_1iyu 1 114 1 . . 1 1 19 19 LEU H H . . . 1 1 19 19 LEU HG H . . . . . 2.7 0.0 2.7 . . . . . A . 19 LEU H . . A . 19 LEU HG . . . 19 . HN . . . . . 19 . HG . . rr_1iyu 1 115 1 . . 1 1 19 19 LEU H H . . . 1 1 20 20 VAL H H . . . . . 3.3 0.0 3.3 . . . . . A . 19 LEU H . . A . 20 VAL H . . . 19 . HN . . . . . 20 . HN . . rr_1iyu 1 116 1 . . 1 1 19 19 LEU H H . . . 1 1 33 33 VAL HA H . . . . . 3.3 0.0 3.3 . . . . . A . 19 LEU H . . A . 33 VAL HA . . . 19 . HN . . . . . 33 . HA . . rr_1iyu 1 117 1 . . 1 1 19 19 LEU H H . . . 1 1 33 33 VAL MG1 H . . . . . 5.0 0.0 6.5 . . . . . A . 19 LEU H . . A . 33 VAL MG1 . . . 19 . HN . . . . . 33 . HG1* . . rr_1iyu 1 118 1 OR . 1 1 20 20 VAL H H . . . 1 1 18 18 LEU HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 20 VAL H . . A . 18 LEU HB3 . . . 20 . HN . . . . . 18 . HB* . . rr_1iyu 1 118 2 OR . 1 1 20 20 VAL H H . . . 1 1 18 18 LEU HB2 H . . . . . 5.0 0.0 6.0 . . . . . A . 20 VAL H . . A . 18 LEU HB2 . . . 20 . HN . . . . . 18 . HB* . . rr_1iyu 1 119 1 . . 1 1 20 20 VAL H H . . . 1 1 19 19 LEU HA H . . . . . 3.3 0.0 3.3 . . . . . A . 20 VAL H . . A . 19 LEU HA . . . 20 . HN . . . . . 19 . HA . . rr_1iyu 1 120 1 OR . 1 1 20 20 VAL H H . . . 1 1 19 19 LEU HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 20 VAL H . . A . 19 LEU HB3 . . . 20 . HN . . . . . 19 . HB* . . rr_1iyu 1 120 2 OR . 1 1 19 19 LEU HB2 H . . . 1 1 20 20 VAL H H . . . . . 5.0 0.0 6.0 . . . . . A . 19 LEU HB2 . . A . 20 VAL H . . . 19 . HB* . . . . . 20 . HN . . rr_1iyu 1 121 1 . . 1 1 19 19 LEU HG H . . . 1 1 20 20 VAL H H . . . . . 5.0 0.0 5.0 . . . . . A . 19 LEU HG . . A . 20 VAL H . . . 19 . HG . . . . . 20 . HN . . rr_1iyu 1 122 1 . . 1 1 20 20 VAL H H . . . 1 1 20 20 VAL HB H . . . . . 5.0 0.0 5.0 . . . . . A . 20 VAL H . . A . 20 VAL HB . . . 20 . HN . . . . . 20 . HB . . rr_1iyu 1 123 1 . . 1 1 20 20 VAL H H . . . 1 1 20 20 VAL MG1 H . . . . . 3.3 0.0 4.8 . . . . . A . 20 VAL H . . A . 20 VAL MG1 . . . 20 . HN . . . . . 20 . HG1* . . rr_1iyu 1 124 1 . . 1 1 20 20 VAL H H . . . 1 1 20 20 VAL MG2 H . . . . . 2.7 0.0 4.2 . . . . . A . 20 VAL H . . A . 20 VAL MG2 . . . 20 . HN . . . . . 20 . HG2* . . rr_1iyu 1 125 1 . . 1 1 21 21 LYS H H . . . 1 1 20 20 VAL HA H . . . . . 2.7 0.0 2.7 . . . . . A . 21 LYS H . . A . 20 VAL HA . . . 21 . HN . . . . . 20 . HA . . rr_1iyu 1 126 1 . . 1 1 20 20 VAL HB H . . . 1 1 21 21 LYS H H . . . . . 2.7 0.0 2.7 . . . . . A . 20 VAL HB . . A . 21 LYS H . . . 20 . HB . . . . . 21 . HN . . rr_1iyu 1 127 1 OR . 1 1 21 21 LYS H H . . . 1 1 21 21 LYS HB2 H . . . . . 3.3 0.0 3.9 . . . . . A . 21 LYS H . . A . 21 LYS HB2 . . . 21 . HN . . . . . 21 . HB* . . rr_1iyu 1 127 2 OR . 1 1 21 21 LYS H H . . . 1 1 21 21 LYS HB3 H . . . . . 3.3 0.0 3.9 . . . . . A . 21 LYS H . . A . 21 LYS HB3 . . . 21 . HN . . . . . 21 . HB* . . rr_1iyu 1 128 1 . . 1 1 21 21 LYS H H . . . 1 1 24 24 ASP HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 21 LYS H . . A . 24 ASP HB3 . . . 21 . HN . . . . . 24 . HB1 . . rr_1iyu 1 129 1 . . 1 1 21 21 LYS H H . . . 1 1 24 24 ASP HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 21 LYS H . . A . 24 ASP HB2 . . . 21 . HN . . . . . 24 . HB2 . . rr_1iyu 1 130 1 . . 1 1 22 22 THR HA H . . . 1 1 22 22 THR MG H . . . . . 2.7 0.0 3.8 . . . . . A . 22 THR HA . . A . 22 THR MG . . . 22 . HA . . . . . 22 . HG2* . . rr_1iyu 1 131 1 . . 1 1 22 22 THR HA H . . . 1 1 52 52 VAL HB H . . . . . 3.3 0.0 3.3 . . . . . A . 22 THR HA . . A . 52 VAL HB . . . 22 . HA . . . . . 52 . HB . . rr_1iyu 1 132 1 OR . 1 1 22 22 THR H H . . . 1 1 21 21 LYS HB2 H . . . . . 5.0 0.0 6.0 . . . . . A . 22 THR H . . A . 21 LYS HB2 . . . 22 . HN . . . . . 21 . HB* . . rr_1iyu 1 132 2 OR . 1 1 21 21 LYS HB3 H . . . 1 1 22 22 THR H H . . . . . 5.0 0.0 6.0 . . . . . A . 21 LYS HB3 . . A . 22 THR H . . . 21 . HB* . . . . . 22 . HN . . rr_1iyu 1 133 1 . . 1 1 22 22 THR H H . . . 1 1 22 22 THR HB H . . . . . 3.3 0.0 3.3 . . . . . A . 22 THR H . . A . 22 THR HB . . . 22 . HN . . . . . 22 . HB . . rr_1iyu 1 134 1 . . 1 1 22 22 THR MG H . . . 1 1 22 22 THR H H . . . . . 3.3 0.0 4.8 . . . . . A . 22 THR MG . . A . 22 THR H . . . 22 . HG2* . . . . . 22 . HN . . rr_1iyu 1 135 1 OR . 1 1 22 22 THR MG H . . . 1 1 23 23 GLY HA3 H . . . . . 3.3 0.0 5.8 . . . . . A . 22 THR MG . . A . 23 GLY HA3 . . . 22 . HG2* . . . . . 23 . HA* . . rr_1iyu 1 135 2 OR . 1 1 22 22 THR MG H . . . 1 1 23 23 GLY HA2 H . . . . . 3.3 0.0 5.8 . . . . . A . 22 THR MG . . A . 23 GLY HA2 . . . 22 . HG2* . . . . . 23 . HA* . . rr_1iyu 1 136 1 OR . 1 1 23 23 GLY HA3 H . . . 1 1 51 51 VAL MG1 H . . . . . 3.3 0.0 5.8 . . . . . A . 23 GLY HA3 . . A . 51 VAL MG1 . . . 23 . HA* . . . . . 51 . HG1* . . rr_1iyu 1 136 2 OR . 1 1 23 23 GLY HA2 H . . . 1 1 51 51 VAL MG1 H . . . . . 3.3 0.0 5.8 . . . . . A . 23 GLY HA2 . . A . 51 VAL MG1 . . . 23 . HA* . . . . . 51 . HG1* . . rr_1iyu 1 137 1 . . 1 1 22 22 THR HA H . . . 1 1 23 23 GLY H H . . . . . 2.7 0.0 2.7 . . . . . A . 22 THR HA . . A . 23 GLY H . . . 22 . HA . . . . . 23 . HN . . rr_1iyu 1 138 1 . . 1 1 22 22 THR HB H . . . 1 1 23 23 GLY H H . . . . . 5.0 0.0 5.0 . . . . . A . 22 THR HB . . A . 23 GLY H . . . 22 . HB . . . . . 23 . HN . . rr_1iyu 1 139 1 . . 1 1 22 22 THR MG H . . . 1 1 23 23 GLY H H . . . . . 3.3 0.0 4.8 . . . . . A . 22 THR MG . . A . 23 GLY H . . . 22 . HG2* . . . . . 23 . HN . . rr_1iyu 1 140 1 . . 1 1 23 23 GLY H H . . . 1 1 24 24 ASP H H . . . . . 2.7 0.0 2.7 . . . . . A . 23 GLY H . . A . 24 ASP H . . . 23 . HN . . . . . 24 . HN . . rr_1iyu 1 141 1 . . 1 1 52 52 VAL HB H . . . 1 1 23 23 GLY H H . . . . . 2.7 0.0 2.7 . . . . . A . 52 VAL HB . . A . 23 GLY H . . . 52 . HB . . . . . 23 . HN . . rr_1iyu 1 142 1 . . 1 1 23 23 GLY H H . . . 1 1 52 52 VAL MG2 H . . . . . 5.0 0.0 6.5 . . . . . A . 23 GLY H . . A . 52 VAL MG2 . . . 23 . HN . . . . . 52 . HG2* . . rr_1iyu 1 143 1 . . 1 1 22 22 THR HA H . . . 1 1 24 24 ASP H H . . . . . 5.0 0.0 5.0 . . . . . A . 22 THR HA . . A . 24 ASP H . . . 22 . HA . . . . . 24 . HN . . rr_1iyu 1 144 1 . . 1 1 22 22 THR MG H . . . 1 1 24 24 ASP H H . . . . . 5.0 0.0 6.5 . . . . . A . 22 THR MG . . A . 24 ASP H . . . 22 . HG2* . . . . . 24 . HN . . rr_1iyu 1 145 1 . . 1 1 24 24 ASP H H . . . 1 1 23 23 GLY HA3 H . . . . . 5.0 0.0 5.0 . . . . . A . 24 ASP H . . A . 23 GLY HA3 . . . 24 . HN . . . . . 23 . HA1 . . rr_1iyu 1 146 1 . . 1 1 23 23 GLY HA2 H . . . 1 1 24 24 ASP H H . . . . . 5.0 0.0 5.0 . . . . . A . 23 GLY HA2 . . A . 24 ASP H . . . 23 . HA2 . . . . . 24 . HN . . rr_1iyu 1 147 1 . . 1 1 24 24 ASP HB3 H . . . 1 1 24 24 ASP H H . . . . . 5.0 0.0 5.0 . . . . . A . 24 ASP HB3 . . A . 24 ASP H . . . 24 . HB1 . . . . . 24 . HN . . rr_1iyu 1 148 1 . . 1 1 24 24 ASP HB2 H . . . 1 1 24 24 ASP H H . . . . . 2.7 0.0 2.7 . . . . . A . 24 ASP HB2 . . A . 24 ASP H . . . 24 . HB2 . . . . . 24 . HN . . rr_1iyu 1 149 1 OR . 1 1 24 24 ASP H H . . . 1 1 51 51 VAL MG1 H . . . . . 5.0 0.0 8.4 . . . . . A . 24 ASP H . . A . 51 VAL MG1 . . . 24 . HN . . . . . 51 . HG* . . rr_1iyu 1 149 2 OR . 1 1 24 24 ASP H H . . . 1 1 51 51 VAL MG2 H . . . . . 5.0 0.0 8.4 . . . . . A . 24 ASP H . . A . 51 VAL MG2 . . . 24 . HN . . . . . 51 . HG* . . rr_1iyu 1 150 1 . . 1 1 52 52 VAL HB H . . . 1 1 24 24 ASP H H . . . . . 2.7 0.0 2.7 . . . . . A . 52 VAL HB . . A . 24 ASP H . . . 52 . HB . . . . . 24 . HN . . rr_1iyu 1 151 1 . . 1 1 24 24 ASP H H . . . 1 1 52 52 VAL MG1 H . . . . . 5.0 0.0 6.5 . . . . . A . 24 ASP H . . A . 52 VAL MG1 . . . 24 . HN . . . . . 52 . HG1* . . rr_1iyu 1 152 1 . . 1 1 24 24 ASP HB3 H . . . 1 1 25 25 LEU H H . . . . . 3.3 0.0 3.3 . . . . . A . 24 ASP HB3 . . A . 25 LEU H . . . 24 . HB1 . . . . . 25 . HN . . rr_1iyu 1 153 1 . . 1 1 24 24 ASP HB2 H . . . 1 1 25 25 LEU H H . . . . . 5.0 0.0 5.0 . . . . . A . 24 ASP HB2 . . A . 25 LEU H . . . 24 . HB2 . . . . . 25 . HN . . rr_1iyu 1 154 1 . . 1 1 25 25 LEU H H . . . 1 1 25 25 LEU HB3 H . . . . . 3.3 0.0 3.3 . . . . . A . 25 LEU H . . A . 25 LEU HB3 . . . 25 . HN . . . . . 25 . HB1 . . rr_1iyu 1 155 1 . . 1 1 25 25 LEU H H . . . 1 1 25 25 LEU HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 25 LEU H . . A . 25 LEU HB2 . . . 25 . HN . . . . . 25 . HB2 . . rr_1iyu 1 156 1 OR . 1 1 25 25 LEU H H . . . 1 1 25 25 LEU HB3 H . . . . . 2.9 0.0 2.9 . . . . . A . 25 LEU H . . A . 25 LEU HB3 . . . 25 . HN . . . . . 25 . HB* . . rr_1iyu 1 156 2 OR . 1 1 25 25 LEU H H . . . 1 1 25 25 LEU HB2 H . . . . . 2.9 0.0 2.9 . . . . . A . 25 LEU H . . A . 25 LEU HB2 . . . 25 . HN . . . . . 25 . HB* . . rr_1iyu 1 157 1 OR . 1 1 25 25 LEU H H . . . 1 1 25 25 LEU MD1 H . . . . . 3.3 0.0 6.7 . . . . . A . 25 LEU H . . A . 25 LEU MD1 . . . 25 . HN . . . . . 25 . HD* . . rr_1iyu 1 157 2 OR . 1 1 25 25 LEU H H . . . 1 1 25 25 LEU MD2 H . . . . . 3.3 0.0 6.7 . . . . . A . 25 LEU H . . A . 25 LEU MD2 . . . 25 . HN . . . . . 25 . HD* . . rr_1iyu 1 158 1 . . 1 1 26 26 ILE HA H . . . 1 1 26 26 ILE MD H . . . . . 3.3 0.0 4.8 . . . . . A . 26 ILE HA . . A . 26 ILE MD . . . 26 . HA . . . . . 26 . HD1* . . rr_1iyu 1 159 1 . . 1 1 26 26 ILE H H . . . 1 1 25 25 LEU HA H . . . . . 3.3 0.0 3.3 . . . . . A . 26 ILE H . . A . 25 LEU HA . . . 26 . HN . . . . . 25 . HA . . rr_1iyu 1 160 1 . . 1 1 26 26 ILE H H . . . 1 1 26 26 ILE HB H . . . . . 2.7 0.0 2.7 . . . . . A . 26 ILE H . . A . 26 ILE HB . . . 26 . HN . . . . . 26 . HB . . rr_1iyu 1 161 1 . . 1 1 26 26 ILE H H . . . 1 1 50 50 GLY H H . . . . . 3.3 0.0 3.3 . . . . . A . 26 ILE H . . A . 50 GLY H . . . 26 . HN . . . . . 50 . HN . . rr_1iyu 1 162 1 . . 1 1 26 26 ILE HA H . . . 1 1 27 27 GLU H H . . . . . 2.7 0.0 2.7 . . . . . A . 26 ILE HA . . A . 27 GLU H . . . 26 . HA . . . . . 27 . HN . . rr_1iyu 1 163 1 . . 1 1 26 26 ILE HB H . . . 1 1 27 27 GLU H H . . . . . 2.7 0.0 2.7 . . . . . A . 26 ILE HB . . A . 27 GLU H . . . 26 . HB . . . . . 27 . HN . . rr_1iyu 1 164 1 . . 1 1 26 26 ILE MD H . . . 1 1 27 27 GLU H H . . . . . 5.0 0.0 6.5 . . . . . A . 26 ILE MD . . A . 27 GLU H . . . 26 . HD1* . . . . . 27 . HN . . rr_1iyu 1 165 1 . . 1 1 27 27 GLU H H . . . 1 1 27 27 GLU HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 27 GLU H . . A . 27 GLU HB3 . . . 27 . HN . . . . . 27 . HB1 . . rr_1iyu 1 166 1 . . 1 1 27 27 GLU H H . . . 1 1 27 27 GLU HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 27 GLU H . . A . 27 GLU HB2 . . . 27 . HN . . . . . 27 . HB2 . . rr_1iyu 1 167 1 OR . 1 1 27 27 GLU H H . . . 1 1 27 27 GLU HB2 H . . . . . 4.1 0.0 4.1 . . . . . A . 27 GLU H . . A . 27 GLU HB2 . . . 27 . HN . . . . . 27 . HB* . . rr_1iyu 1 167 2 OR . 1 1 27 27 GLU H H . . . 1 1 27 27 GLU HB3 H . . . . . 4.1 0.0 4.1 . . . . . A . 27 GLU H . . A . 27 GLU HB3 . . . 27 . HN . . . . . 27 . HB* . . rr_1iyu 1 168 1 . . 1 1 27 27 GLU H H . . . 1 1 27 27 GLU HG3 H . . . . . 5.0 0.0 5.0 . . . . . A . 27 GLU H . . A . 27 GLU HG3 . . . 27 . HN . . . . . 27 . HG1 . . rr_1iyu 1 169 1 . . 1 1 27 27 GLU H H . . . 1 1 27 27 GLU HG2 H . . . . . 5.0 0.0 5.0 . . . . . A . 27 GLU H . . A . 27 GLU HG2 . . . 27 . HN . . . . . 27 . HG2 . . rr_1iyu 1 170 1 . . 1 1 27 27 GLU H H . . . 1 1 30 30 GLN HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 27 GLU H . . A . 30 GLN HB3 . . . 27 . HN . . . . . 30 . HB1 . . rr_1iyu 1 171 1 . . 1 1 27 27 GLU H H . . . 1 1 30 30 GLN HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 27 GLU H . . A . 30 GLN HB2 . . . 27 . HN . . . . . 30 . HB2 . . rr_1iyu 1 172 1 OR . 1 1 27 27 GLU H H . . . 1 1 30 30 GLN HB2 H . . . . . 4.1 0.0 4.1 . . . . . A . 27 GLU H . . A . 30 GLN HB2 . . . 27 . HN . . . . . 30 . HB* . . rr_1iyu 1 172 2 OR . 1 1 27 27 GLU H H . . . 1 1 30 30 GLN HB3 H . . . . . 4.1 0.0 4.1 . . . . . A . 27 GLU H . . A . 30 GLN HB3 . . . 27 . HN . . . . . 30 . HB* . . rr_1iyu 1 173 1 . . 1 1 28 28 VAL HA H . . . 1 1 28 28 VAL HB H . . . . . 2.7 0.0 2.7 . . . . . A . 28 VAL HA . . A . 28 VAL HB . . . 28 . HA . . . . . 28 . HB . . rr_1iyu 1 174 1 OR . 1 1 28 28 VAL HA H . . . 1 1 28 28 VAL MG1 H . . . . . 2.7 0.0 4.3 . . . . . A . 28 VAL HA . . A . 28 VAL MG1 . . . 28 . HA . . . . . 28 . HG* . . rr_1iyu 1 174 2 OR . 1 1 28 28 VAL HA H . . . 1 1 28 28 VAL MG2 H . . . . . 2.7 0.0 4.3 . . . . . A . 28 VAL HA . . A . 28 VAL MG2 . . . 28 . HA . . . . . 28 . HG* . . rr_1iyu 1 175 1 OR . 1 1 28 28 VAL HA H . . . 1 1 29 29 GLU HB2 H . . . . . 5.0 0.0 6.0 . . . . . A . 28 VAL HA . . A . 29 GLU HB2 . . . 28 . HA . . . . . 29 . HB* . . rr_1iyu 1 175 2 OR . 1 1 28 28 VAL HA H . . . 1 1 29 29 GLU HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 28 VAL HA . . A . 29 GLU HB3 . . . 28 . HA . . . . . 29 . HB* . . rr_1iyu 1 176 1 OR . 1 1 28 28 VAL H H . . . 1 1 27 27 GLU HB2 H . . . . . 3.3 0.0 4.3 . . . . . A . 28 VAL H . . A . 27 GLU HB2 . . . 28 . HN . . . . . 27 . HB* . . rr_1iyu 1 176 2 OR . 1 1 27 27 GLU HB3 H . . . 1 1 28 28 VAL H H . . . . . 3.3 0.0 4.3 . . . . . A . 27 GLU HB3 . . A . 28 VAL H . . . 27 . HB* . . . . . 28 . HN . . rr_1iyu 1 177 1 OR . 1 1 28 28 VAL H H . . . 1 1 27 27 GLU HG2 H . . . . . 5.0 0.0 6.0 . . . . . A . 28 VAL H . . A . 27 GLU HG2 . . . 28 . HN . . . . . 27 . HG* . . rr_1iyu 1 177 2 OR . 1 1 28 28 VAL H H . . . 1 1 27 27 GLU HG3 H . . . . . 5.0 0.0 6.0 . . . . . A . 28 VAL H . . A . 27 GLU HG3 . . . 28 . HN . . . . . 27 . HG* . . rr_1iyu 1 178 1 . . 1 1 28 28 VAL HB H . . . 1 1 28 28 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 28 VAL HB . . A . 28 VAL H . . . 28 . HB . . . . . 28 . HN . . rr_1iyu 1 179 1 . . 1 1 28 28 VAL HA H . . . 1 1 29 29 GLU H H . . . . . 2.7 0.0 2.7 . . . . . A . 28 VAL HA . . A . 29 GLU H . . . 28 . HA . . . . . 29 . HN . . rr_1iyu 1 180 1 . . 1 1 28 28 VAL HB H . . . 1 1 29 29 GLU H H . . . . . 5.0 0.0 5.0 . . . . . A . 28 VAL HB . . A . 29 GLU H . . . 28 . HB . . . . . 29 . HN . . rr_1iyu 1 181 1 . . 1 1 29 29 GLU H H . . . 1 1 29 29 GLU HA H . . . . . 2.7 0.0 2.7 . . . . . A . 29 GLU H . . A . 29 GLU HA . . . 29 . HN . . . . . 29 . HA . . rr_1iyu 1 182 1 OR . 1 1 29 29 GLU H H . . . 1 1 29 29 GLU HB2 H . . . . . 5.0 0.0 5.6 . . . . . A . 29 GLU H . . A . 29 GLU HB2 . . . 29 . HN . . . . . 29 . HB* . . rr_1iyu 1 182 2 OR . 1 1 29 29 GLU HB3 H . . . 1 1 29 29 GLU H H . . . . . 5.0 0.0 5.6 . . . . . A . 29 GLU HB3 . . A . 29 GLU H . . . 29 . HB* . . . . . 29 . HN . . rr_1iyu 1 183 1 . . 1 1 29 29 GLU H H . . . 1 1 30 30 GLN H H . . . . . 3.3 0.0 3.3 . . . . . A . 29 GLU H . . A . 30 GLN H . . . 29 . HN . . . . . 30 . HN . . rr_1iyu 1 184 1 OR . 1 1 29 29 GLU H H . . . 1 1 46 46 SER HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 29 GLU H . . A . 46 SER HB3 . . . 29 . HN . . . . . 46 . HB* . . rr_1iyu 1 184 2 OR . 1 1 29 29 GLU H H . . . 1 1 46 46 SER HB2 H . . . . . 5.0 0.0 6.0 . . . . . A . 29 GLU H . . A . 46 SER HB2 . . . 29 . HN . . . . . 46 . HB* . . rr_1iyu 1 185 1 OR . 1 1 30 30 GLN HA H . . . 1 1 30 30 GLN HG2 H . . . . . 2.7 0.0 3.3 . . . . . A . 30 GLN HA . . A . 30 GLN HG2 . . . 30 . HA . . . . . 30 . HG* . . rr_1iyu 1 185 2 OR . 1 1 30 30 GLN HA H . . . 1 1 30 30 GLN HG3 H . . . . . 2.7 0.0 3.3 . . . . . A . 30 GLN HA . . A . 30 GLN HG3 . . . 30 . HA . . . . . 30 . HG* . . rr_1iyu 1 186 1 OR . 1 1 20 20 VAL MG1 H . . . 1 1 30 30 GLN HE22 H . . . . . 3.3 0.0 5.8 . . . . . A . 20 VAL MG1 . . A . 30 GLN HE22 . . . 20 . HG1* . . . . . 30 . HE2* . . rr_1iyu 1 186 2 OR . 1 1 20 20 VAL MG1 H . . . 1 1 30 30 GLN HE21 H . . . . . 3.3 0.0 5.8 . . . . . A . 20 VAL MG1 . . A . 30 GLN HE21 . . . 20 . HG1* . . . . . 30 . HE2* . . rr_1iyu 1 187 1 OR . 1 1 30 30 GLN HE22 H . . . 1 1 30 30 GLN HG2 H . . . . . 3.3 0.0 5.3 . . . . . A . 30 GLN HE22 . . A . 30 GLN HG2 . . . 30 . HE2* . . . . . 30 . HG* . . rr_1iyu 1 187 2 OR . 1 1 30 30 GLN HE21 H . . . 1 1 30 30 GLN HG2 H . . . . . 3.3 0.0 5.3 . . . . . A . 30 GLN HE21 . . A . 30 GLN HG2 . . . 30 . HE2* . . . . . 30 . HG* . . rr_1iyu 1 187 3 OR . 1 1 30 30 GLN HG3 H . . . 1 1 30 30 GLN HE22 H . . . . . 3.3 0.0 5.3 . . . . . A . 30 GLN HG3 . . A . 30 GLN HE22 . . . 30 . HG* . . . . . 30 . HE2* . . rr_1iyu 1 187 4 OR . 1 1 30 30 GLN HG3 H . . . 1 1 30 30 GLN HE21 H . . . . . 3.3 0.0 5.3 . . . . . A . 30 GLN HG3 . . A . 30 GLN HE21 . . . 30 . HG* . . . . . 30 . HE2* . . rr_1iyu 1 188 1 OR . 1 1 26 26 ILE HA H . . . 1 1 30 30 GLN HE22 H . . . . . 5.0 0.0 6.0 . . . . . A . 26 ILE HA . . A . 30 GLN HE22 . . . 26 . HA . . . . . 30 . HE2* . . rr_1iyu 1 188 2 OR . 1 1 26 26 ILE HA H . . . 1 1 30 30 GLN HE21 H . . . . . 5.0 0.0 6.0 . . . . . A . 26 ILE HA . . A . 30 GLN HE21 . . . 26 . HA . . . . . 30 . HE2* . . rr_1iyu 1 189 1 OR . 1 1 26 26 ILE MD H . . . 1 1 30 30 GLN HE22 H . . . . . 5.0 0.0 7.5 . . . . . A . 26 ILE MD . . A . 30 GLN HE22 . . . 26 . HD1* . . . . . 30 . HE2* . . rr_1iyu 1 189 2 OR . 1 1 26 26 ILE MD H . . . 1 1 30 30 GLN HE21 H . . . . . 5.0 0.0 7.5 . . . . . A . 26 ILE MD . . A . 30 GLN HE21 . . . 26 . HD1* . . . . . 30 . HE2* . . rr_1iyu 1 190 1 OR . 1 1 30 30 GLN HE22 H . . . 1 1 30 30 GLN HG2 H . . . . . 5.0 0.0 7.0 . . . . . A . 30 GLN HE22 . . A . 30 GLN HG2 . . . 30 . HE2* . . . . . 30 . HG* . . rr_1iyu 1 190 2 OR . 1 1 30 30 GLN HE21 H . . . 1 1 30 30 GLN HG2 H . . . . . 5.0 0.0 7.0 . . . . . A . 30 GLN HE21 . . A . 30 GLN HG2 . . . 30 . HE2* . . . . . 30 . HG* . . rr_1iyu 1 190 3 OR . 1 1 30 30 GLN HG3 H . . . 1 1 30 30 GLN HE22 H . . . . . 5.0 0.0 7.0 . . . . . A . 30 GLN HG3 . . A . 30 GLN HE22 . . . 30 . HG* . . . . . 30 . HE2* . . rr_1iyu 1 190 4 OR . 1 1 30 30 GLN HG3 H . . . 1 1 30 30 GLN HE21 H . . . . . 5.0 0.0 7.0 . . . . . A . 30 GLN HG3 . . A . 30 GLN HE21 . . . 30 . HG* . . . . . 30 . HE2* . . rr_1iyu 1 191 1 . . 1 1 28 28 VAL HA H . . . 1 1 30 30 GLN H H . . . . . 5.0 0.0 5.0 . . . . . A . 28 VAL HA . . A . 30 GLN H . . . 28 . HA . . . . . 30 . HN . . rr_1iyu 1 192 1 . . 1 1 29 29 GLU HA H . . . 1 1 30 30 GLN H H . . . . . 5.0 0.0 5.0 . . . . . A . 29 GLU HA . . A . 30 GLN H . . . 29 . HA . . . . . 30 . HN . . rr_1iyu 1 193 1 . . 1 1 30 30 GLN HB3 H . . . 1 1 30 30 GLN H H . . . . . 3.3 0.0 3.3 . . . . . A . 30 GLN HB3 . . A . 30 GLN H . . . 30 . HB1 . . . . . 30 . HN . . rr_1iyu 1 194 1 . . 1 1 30 30 GLN H H . . . 1 1 30 30 GLN HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 30 GLN H . . A . 30 GLN HB2 . . . 30 . HN . . . . . 30 . HB2 . . rr_1iyu 1 195 1 OR . 1 1 19 19 LEU MD1 H . . . 1 1 31 31 GLY HA3 H . . . . . 2.7 0.0 7.1 . . . . . A . 19 LEU MD1 . . A . 31 GLY HA3 . . . 19 . HD* . . . . . 31 . HA* . . rr_1iyu 1 195 2 OR . 1 1 19 19 LEU MD2 H . . . 1 1 31 31 GLY HA3 H . . . . . 2.7 0.0 7.1 . . . . . A . 19 LEU MD2 . . A . 31 GLY HA3 . . . 19 . HD* . . . . . 31 . HA* . . rr_1iyu 1 195 3 OR . 1 1 31 31 GLY HA2 H . . . 1 1 19 19 LEU MD1 H . . . . . 2.7 0.0 7.1 . . . . . A . 31 GLY HA2 . . A . 19 LEU MD1 . . . 31 . HA* . . . . . 19 . HD* . . rr_1iyu 1 195 4 OR . 1 1 19 19 LEU MD2 H . . . 1 1 31 31 GLY HA2 H . . . . . 2.7 0.0 7.1 . . . . . A . 19 LEU MD2 . . A . 31 GLY HA2 . . . 19 . HD* . . . . . 31 . HA* . . rr_1iyu 1 196 1 . . 1 1 30 30 GLN HA H . . . 1 1 31 31 GLY H H . . . . . 2.7 0.0 2.7 . . . . . A . 30 GLN HA . . A . 31 GLY H . . . 30 . HA . . . . . 31 . HN . . rr_1iyu 1 197 1 . . 1 1 30 30 GLN HB3 H . . . 1 1 31 31 GLY H H . . . . . 5.0 0.0 5.0 . . . . . A . 30 GLN HB3 . . A . 31 GLY H . . . 30 . HB1 . . . . . 31 . HN . . rr_1iyu 1 198 1 . . 1 1 31 31 GLY H H . . . 1 1 30 30 GLN HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 31 GLY H . . A . 30 GLN HB2 . . . 31 . HN . . . . . 30 . HB2 . . rr_1iyu 1 199 1 OR . 1 1 31 31 GLY H H . . . 1 1 30 30 GLN HB2 H . . . . . 4.1 0.0 4.1 . . . . . A . 31 GLY H . . A . 30 GLN HB2 . . . 31 . HN . . . . . 30 . HB* . . rr_1iyu 1 199 2 OR . 1 1 30 30 GLN HB3 H . . . 1 1 31 31 GLY H H . . . . . 4.1 0.0 4.1 . . . . . A . 30 GLN HB3 . . A . 31 GLY H . . . 30 . HB* . . . . . 31 . HN . . rr_1iyu 1 200 1 OR . 1 1 31 31 GLY H H . . . 1 1 30 30 GLN HG2 H . . . . . 3.3 0.0 4.3 . . . . . A . 31 GLY H . . A . 30 GLN HG2 . . . 31 . HN . . . . . 30 . HG* . . rr_1iyu 1 200 2 OR . 1 1 30 30 GLN HG3 H . . . 1 1 31 31 GLY H H . . . . . 3.3 0.0 4.3 . . . . . A . 30 GLN HG3 . . A . 31 GLY H . . . 30 . HG* . . . . . 31 . HN . . rr_1iyu 1 201 1 . . 1 1 30 30 GLN H H . . . 1 1 31 31 GLY H H . . . . . 5.0 0.0 5.0 . . . . . A . 30 GLN H . . A . 31 GLY H . . . 30 . HN . . . . . 31 . HN . . rr_1iyu 1 202 1 OR . 1 1 32 32 LEU H H . . . 1 1 19 19 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 32 LEU H . . A . 19 LEU MD1 . . . 32 . HN . . . . . 19 . HD* . . rr_1iyu 1 202 2 OR . 1 1 19 19 LEU MD2 H . . . 1 1 32 32 LEU H H . . . . . 5.0 0.0 8.4 . . . . . A . 19 LEU MD2 . . A . 32 LEU H . . . 19 . HD* . . . . . 32 . HN . . rr_1iyu 1 203 1 . . 1 1 32 32 LEU H H . . . 1 1 31 31 GLY HA3 H . . . . . 3.3 0.0 3.3 . . . . . A . 32 LEU H . . A . 31 GLY HA3 . . . 32 . HN . . . . . 31 . HA1 . . rr_1iyu 1 204 1 . . 1 1 31 31 GLY HA2 H . . . 1 1 32 32 LEU H H . . . . . 3.3 0.0 3.3 . . . . . A . 31 GLY HA2 . . A . 32 LEU H . . . 31 . HA2 . . . . . 32 . HN . . rr_1iyu 1 205 1 OR . 1 1 32 32 LEU H H . . . 1 1 31 31 GLY HA3 H . . . . . 2.9 0.0 2.9 . . . . . A . 32 LEU H . . A . 31 GLY HA3 . . . 32 . HN . . . . . 31 . HA* . . rr_1iyu 1 205 2 OR . 1 1 31 31 GLY HA2 H . . . 1 1 32 32 LEU H H . . . . . 2.9 0.0 2.9 . . . . . A . 31 GLY HA2 . . A . 32 LEU H . . . 31 . HA* . . . . . 32 . HN . . rr_1iyu 1 206 1 OR . 1 1 32 32 LEU H H . . . 1 1 32 32 LEU HB2 H . . . . . 3.3 0.0 3.9 . . . . . A . 32 LEU H . . A . 32 LEU HB2 . . . 32 . HN . . . . . 32 . HB* . . rr_1iyu 1 206 2 OR . 1 1 32 32 LEU H H . . . 1 1 32 32 LEU HB3 H . . . . . 3.3 0.0 3.9 . . . . . A . 32 LEU H . . A . 32 LEU HB3 . . . 32 . HN . . . . . 32 . HB* . . rr_1iyu 1 207 1 OR . 1 1 32 32 LEU H H . . . 1 1 32 32 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 32 LEU H . . A . 32 LEU MD1 . . . 32 . HN . . . . . 32 . HD* . . rr_1iyu 1 207 2 OR . 1 1 32 32 LEU H H . . . 1 1 32 32 LEU MD2 H . . . . . 5.0 0.0 8.4 . . . . . A . 32 LEU H . . A . 32 LEU MD2 . . . 32 . HN . . . . . 32 . HD* . . rr_1iyu 1 208 1 . . 1 1 32 32 LEU H H . . . 1 1 33 33 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 32 LEU H . . A . 33 VAL H . . . 32 . HN . . . . . 33 . HN . . rr_1iyu 1 209 1 . . 1 1 32 32 LEU H H . . . 1 1 45 45 PRO HA H . . . . . 3.3 0.0 3.3 . . . . . A . 32 LEU H . . A . 45 PRO HA . . . 32 . HN . . . . . 45 . HA . . rr_1iyu 1 210 1 OR . 1 1 33 33 VAL H H . . . 1 1 19 19 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 33 VAL H . . A . 19 LEU MD1 . . . 33 . HN . . . . . 19 . HD* . . rr_1iyu 1 210 2 OR . 1 1 19 19 LEU MD2 H . . . 1 1 33 33 VAL H H . . . . . 5.0 0.0 8.4 . . . . . A . 19 LEU MD2 . . A . 33 VAL H . . . 19 . HD* . . . . . 33 . HN . . rr_1iyu 1 211 1 OR . 1 1 33 33 VAL H H . . . 1 1 31 31 GLY HA3 H . . . . . 5.0 0.0 6.0 . . . . . A . 33 VAL H . . A . 31 GLY HA3 . . . 33 . HN . . . . . 31 . HA* . . rr_1iyu 1 211 2 OR . 1 1 31 31 GLY HA2 H . . . 1 1 33 33 VAL H H . . . . . 5.0 0.0 6.0 . . . . . A . 31 GLY HA2 . . A . 33 VAL H . . . 31 . HA* . . . . . 33 . HN . . rr_1iyu 1 212 1 OR . 1 1 33 33 VAL H H . . . 1 1 32 32 LEU HB2 H . . . . . 2.7 0.0 3.7 . . . . . A . 33 VAL H . . A . 32 LEU HB2 . . . 33 . HN . . . . . 32 . HB* . . rr_1iyu 1 212 2 OR . 1 1 32 32 LEU HB3 H . . . 1 1 33 33 VAL H H . . . . . 2.7 0.0 3.7 . . . . . A . 32 LEU HB3 . . A . 33 VAL H . . . 32 . HB* . . . . . 33 . HN . . rr_1iyu 1 213 1 . . 1 1 33 33 VAL H H . . . 1 1 32 32 LEU HG H . . . . . 5.0 0.0 5.0 . . . . . A . 33 VAL H . . A . 32 LEU HG . . . 33 . HN . . . . . 32 . HG . . rr_1iyu 1 214 1 . . 1 1 33 33 VAL H H . . . 1 1 33 33 VAL HB H . . . . . 5.0 0.0 5.0 . . . . . A . 33 VAL H . . A . 33 VAL HB . . . 33 . HN . . . . . 33 . HB . . rr_1iyu 1 215 1 . . 1 1 33 33 VAL MG1 H . . . 1 1 33 33 VAL H H . . . . . 5.0 0.0 6.5 . . . . . A . 33 VAL MG1 . . A . 33 VAL H . . . 33 . HG1* . . . . . 33 . HN . . rr_1iyu 1 216 1 . . 1 1 33 33 VAL H H . . . 1 1 33 33 VAL MG2 H . . . . . 3.3 0.0 4.8 . . . . . A . 33 VAL H . . A . 33 VAL MG2 . . . 33 . HN . . . . . 33 . HG2* . . rr_1iyu 1 217 1 . . 1 1 33 33 VAL H H . . . 1 1 44 44 VAL HB H . . . . . 3.3 0.0 3.3 . . . . . A . 33 VAL H . . A . 44 VAL HB . . . 33 . HN . . . . . 44 . HB . . rr_1iyu 1 218 1 . . 1 1 34 34 VAL HA H . . . 1 1 43 43 GLU HA H . . . . . 2.7 0.0 2.7 . . . . . A . 34 VAL HA . . A . 43 GLU HA . . . 34 . HA . . . . . 43 . HA . . rr_1iyu 1 219 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 34 34 VAL H H . . . . . 5.0 0.0 6.5 . . . . . A . 15 VAL MG1 . . A . 34 VAL H . . . 15 . HG1* . . . . . 34 . HN . . rr_1iyu 1 220 1 . . 1 1 17 17 GLU H H . . . 1 1 34 34 VAL H H . . . . . 3.3 0.0 3.3 . . . . . A . 17 GLU H . . A . 34 VAL H . . . 17 . HN . . . . . 34 . HN . . rr_1iyu 1 221 1 . . 1 1 33 33 VAL HA H . . . 1 1 34 34 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 33 VAL HA . . A . 34 VAL H . . . 33 . HA . . . . . 34 . HN . . rr_1iyu 1 222 1 . . 1 1 33 33 VAL HB H . . . 1 1 34 34 VAL H H . . . . . 3.3 0.0 3.3 . . . . . A . 33 VAL HB . . A . 34 VAL H . . . 33 . HB . . . . . 34 . HN . . rr_1iyu 1 223 1 . . 1 1 34 34 VAL H H . . . 1 1 34 34 VAL HB H . . . . . 2.7 0.0 2.7 . . . . . A . 34 VAL H . . A . 34 VAL HB . . . 34 . HN . . . . . 34 . HB . . rr_1iyu 1 224 1 OR . 1 1 34 34 VAL H H . . . 1 1 34 34 VAL MG1 H . . . . . 2.7 0.0 5.4 . . . . . A . 34 VAL H . . A . 34 VAL MG1 . . . 34 . HN . . . . . 34 . HG* . . rr_1iyu 1 224 2 OR . 1 1 34 34 VAL MG2 H . . . 1 1 34 34 VAL H H . . . . . 2.7 0.0 5.4 . . . . . A . 34 VAL MG2 . . A . 34 VAL H . . . 34 . HG* . . . . . 34 . HN . . rr_1iyu 1 225 1 . . 1 1 35 35 LEU HA H . . . 1 1 15 15 VAL HA H . . . . . 2.7 0.0 2.7 . . . . . A . 35 LEU HA . . A . 15 VAL HA . . . 35 . HA . . . . . 15 . HA . . rr_1iyu 1 226 1 . . 1 1 35 35 LEU HB3 H . . . 1 1 35 35 LEU HA H . . . . . 2.7 0.0 2.7 . . . . . A . 35 LEU HB3 . . A . 35 LEU HA . . . 35 . HB1 . . . . . 35 . HA . . rr_1iyu 1 227 1 OR . 1 1 35 35 LEU HA H . . . 1 1 35 35 LEU MD1 H . . . . . 2.7 0.0 5.4 . . . . . A . 35 LEU HA . . A . 35 LEU MD1 . . . 35 . HA . . . . . 35 . HD* . . rr_1iyu 1 227 2 OR . 1 1 35 35 LEU HA H . . . 1 1 35 35 LEU MD2 H . . . . . 2.7 0.0 5.4 . . . . . A . 35 LEU HA . . A . 35 LEU MD2 . . . 35 . HA . . . . . 35 . HD* . . rr_1iyu 1 228 1 . . 1 1 33 33 VAL MG2 H . . . 1 1 35 35 LEU H H . . . . . 3.3 0.0 4.8 . . . . . A . 33 VAL MG2 . . A . 35 LEU H . . . 33 . HG2* . . . . . 35 . HN . . rr_1iyu 1 229 1 . . 1 1 34 34 VAL HA H . . . 1 1 35 35 LEU H H . . . . . 3.3 0.0 3.3 . . . . . A . 34 VAL HA . . A . 35 LEU H . . . 34 . HA . . . . . 35 . HN . . rr_1iyu 1 230 1 OR . 1 1 35 35 LEU H H . . . 1 1 34 34 VAL MG1 H . . . . . 5.0 0.0 8.4 . . . . . A . 35 LEU H . . A . 34 VAL MG1 . . . 35 . HN . . . . . 34 . HG* . . rr_1iyu 1 230 2 OR . 1 1 34 34 VAL MG2 H . . . 1 1 35 35 LEU H H . . . . . 5.0 0.0 8.4 . . . . . A . 34 VAL MG2 . . A . 35 LEU H . . . 34 . HG* . . . . . 35 . HN . . rr_1iyu 1 231 1 . . 1 1 43 43 GLU HA H . . . 1 1 35 35 LEU H H . . . . . 5.0 0.0 5.0 . . . . . A . 43 GLU HA . . A . 35 LEU H . . . 43 . HA . . . . . 35 . HN . . rr_1iyu 1 232 1 OR . 1 1 36 36 GLU HA H . . . 1 1 36 36 GLU HG2 H . . . . . 2.7 0.0 3.3 . . . . . A . 36 GLU HA . . A . 36 GLU HG2 . . . 36 . HA . . . . . 36 . HG* . . rr_1iyu 1 232 2 OR . 1 1 36 36 GLU HA H . . . 1 1 36 36 GLU HG3 H . . . . . 2.7 0.0 3.3 . . . . . A . 36 GLU HA . . A . 36 GLU HG3 . . . 36 . HA . . . . . 36 . HG* . . rr_1iyu 1 233 1 . . 1 1 14 14 GLU H H . . . 1 1 36 36 GLU H H . . . . . 3.3 0.0 3.3 . . . . . A . 14 GLU H . . A . 36 GLU H . . . 14 . HN . . . . . 36 . HN . . rr_1iyu 1 234 1 . . 1 1 15 15 VAL HA H . . . 1 1 36 36 GLU H H . . . . . 5.0 0.0 5.0 . . . . . A . 15 VAL HA . . A . 36 GLU H . . . 15 . HA . . . . . 36 . HN . . rr_1iyu 1 235 1 . . 1 1 35 35 LEU HA H . . . 1 1 36 36 GLU H H . . . . . 2.7 0.0 2.7 . . . . . A . 35 LEU HA . . A . 36 GLU H . . . 35 . HA . . . . . 36 . HN . . rr_1iyu 1 236 1 . . 1 1 35 35 LEU HB3 H . . . 1 1 36 36 GLU H H . . . . . 3.3 0.0 3.3 . . . . . A . 35 LEU HB3 . . A . 36 GLU H . . . 35 . HB1 . . . . . 36 . HN . . rr_1iyu 1 237 1 . . 1 1 36 36 GLU H H . . . 1 1 35 35 LEU HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 36 GLU H . . A . 35 LEU HB2 . . . 36 . HN . . . . . 35 . HB2 . . rr_1iyu 1 238 1 . . 1 1 36 36 GLU H H . . . 1 1 36 36 GLU HB3 H . . . . . 3.3 0.0 3.3 . . . . . A . 36 GLU H . . A . 36 GLU HB3 . . . 36 . HN . . . . . 36 . HB1 . . rr_1iyu 1 239 1 . . 1 1 36 36 GLU H H . . . 1 1 36 36 GLU HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 36 GLU H . . A . 36 GLU HB2 . . . 36 . HN . . . . . 36 . HB2 . . rr_1iyu 1 240 1 OR . 1 1 36 36 GLU H H . . . 1 1 36 36 GLU HG2 H . . . . . 5.0 0.0 6.0 . . . . . A . 36 GLU H . . A . 36 GLU HG2 . . . 36 . HN . . . . . 36 . HG* . . rr_1iyu 1 240 2 OR . 1 1 36 36 GLU HG3 H . . . 1 1 36 36 GLU H H . . . . . 5.0 0.0 6.0 . . . . . A . 36 GLU HG3 . . A . 36 GLU H . . . 36 . HG* . . . . . 36 . HN . . rr_1iyu 1 241 1 . . 1 1 36 36 GLU HA H . . . 1 1 37 37 SER H H . . . . . 2.7 0.0 2.7 . . . . . A . 36 GLU HA . . A . 37 SER H . . . 36 . HA . . . . . 37 . HN . . rr_1iyu 1 242 1 . . 1 1 36 36 GLU HB3 H . . . 1 1 37 37 SER H H . . . . . 5.0 0.0 5.0 . . . . . A . 36 GLU HB3 . . A . 37 SER H . . . 36 . HB1 . . . . . 37 . HN . . rr_1iyu 1 243 1 . . 1 1 36 36 GLU HB2 H . . . 1 1 37 37 SER H H . . . . . 5.0 0.0 5.0 . . . . . A . 36 GLU HB2 . . A . 37 SER H . . . 36 . HB2 . . . . . 37 . HN . . rr_1iyu 1 244 1 OR . 1 1 37 37 SER H H . . . 1 1 36 36 GLU HG2 H . . . . . 3.3 0.0 4.3 . . . . . A . 37 SER H . . A . 36 GLU HG2 . . . 37 . HN . . . . . 36 . HG* . . rr_1iyu 1 244 2 OR . 1 1 36 36 GLU HG3 H . . . 1 1 37 37 SER H H . . . . . 3.3 0.0 4.3 . . . . . A . 36 GLU HG3 . . A . 37 SER H . . . 36 . HG* . . . . . 37 . HN . . rr_1iyu 1 245 1 OR . 1 1 37 37 SER H H . . . 1 1 37 37 SER HB2 H . . . . . 5.0 0.0 5.6 . . . . . A . 37 SER H . . A . 37 SER HB2 . . . 37 . HN . . . . . 37 . HB* . . rr_1iyu 1 245 2 OR . 1 1 37 37 SER H H . . . 1 1 37 37 SER HB3 H . . . . . 5.0 0.0 5.6 . . . . . A . 37 SER H . . A . 37 SER HB3 . . . 37 . HN . . . . . 37 . HB* . . rr_1iyu 1 246 1 . . 1 1 37 37 SER H H . . . 1 1 40 40 ALA H H . . . . . 3.3 0.0 3.3 . . . . . A . 37 SER H . . A . 40 ALA H . . . 37 . HN . . . . . 40 . HN . . rr_1iyu 1 247 1 . . 1 1 37 37 SER H H . . . 1 1 41 41 SER HA H . . . . . 3.3 0.0 3.3 . . . . . A . 37 SER H . . A . 41 SER HA . . . 37 . HN . . . . . 41 . HA . . rr_1iyu 1 248 1 . . 1 1 37 37 SER HA H . . . 1 1 38 38 ALA H H . . . . . 2.7 0.0 2.7 . . . . . A . 37 SER HA . . A . 38 ALA H . . . 37 . HA . . . . . 38 . HN . . rr_1iyu 1 249 1 OR . 1 1 38 38 ALA H H . . . 1 1 37 37 SER HB2 H . . . . . 2.7 0.0 3.7 . . . . . A . 38 ALA H . . A . 37 SER HB2 . . . 38 . HN . . . . . 37 . HB* . . rr_1iyu 1 249 2 OR . 1 1 37 37 SER HB3 H . . . 1 1 38 38 ALA H H . . . . . 2.7 0.0 3.7 . . . . . A . 37 SER HB3 . . A . 38 ALA H . . . 37 . HB* . . . . . 38 . HN . . rr_1iyu 1 250 1 . . 1 1 38 38 ALA H H . . . 1 1 38 38 ALA MB H . . . . . 2.7 0.0 3.8 . . . . . A . 38 ALA H . . A . 38 ALA MB . . . 38 . HN . . . . . 38 . HB* . . rr_1iyu 1 251 1 . . 1 1 38 38 ALA H H . . . 1 1 39 39 LYS H H . . . . . 3.3 0.0 3.3 . . . . . A . 38 ALA H . . A . 39 LYS H . . . 38 . HN . . . . . 39 . HN . . rr_1iyu 1 252 1 . . 1 1 40 40 ALA H H . . . 1 1 39 39 LYS H H . . . . . 3.3 0.0 3.3 . . . . . A . 40 ALA H . . A . 39 LYS H . . . 40 . HN . . . . . 39 . HN . . rr_1iyu 1 253 1 . . 1 1 40 40 ALA H H . . . 1 1 39 39 LYS HA H . . . . . 5.0 0.0 5.0 . . . . . A . 40 ALA H . . A . 39 LYS HA . . . 40 . HN . . . . . 39 . HA . . rr_1iyu 1 254 1 . . 1 1 40 40 ALA H H . . . 1 1 40 40 ALA MB H . . . . . 3.3 0.0 4.4 . . . . . A . 40 ALA H . . A . 40 ALA MB . . . 40 . HN . . . . . 40 . HB* . . rr_1iyu 1 255 1 OR . 1 1 41 41 SER HA H . . . 1 1 34 34 VAL MG1 H . . . . . 5.0 0.0 8.4 . . . . . A . 41 SER HA . . A . 34 VAL MG1 . . . 41 . HA . . . . . 34 . HG* . . rr_1iyu 1 255 2 OR . 1 1 34 34 VAL MG2 H . . . 1 1 41 41 SER HA H . . . . . 5.0 0.0 8.4 . . . . . A . 34 VAL MG2 . . A . 41 SER HA . . . 34 . HG* . . . . . 41 . HA . . rr_1iyu 1 256 1 . . 1 1 36 36 GLU HA H . . . 1 1 41 41 SER HA H . . . . . 2.7 0.0 2.7 . . . . . A . 36 GLU HA . . A . 41 SER HA . . . 36 . HA . . . . . 41 . HA . . rr_1iyu 1 257 1 OR . 1 1 41 41 SER HA H . . . 1 1 36 36 GLU HG2 H . . . . . 5.0 0.0 6.0 . . . . . A . 41 SER HA . . A . 36 GLU HG2 . . . 41 . HA . . . . . 36 . HG* . . rr_1iyu 1 257 2 OR . 1 1 36 36 GLU HG3 H . . . 1 1 41 41 SER HA H . . . . . 5.0 0.0 6.0 . . . . . A . 36 GLU HG3 . . A . 41 SER HA . . . 36 . HG* . . . . . 41 . HA . . rr_1iyu 1 258 1 OR . 1 1 34 34 VAL MG2 H . . . 1 1 41 41 SER HB2 H . . . . . 3.3 0.0 7.7 . . . . . A . 34 VAL MG2 . . A . 41 SER HB2 . . . 34 . HG* . . . . . 41 . HB* . . rr_1iyu 1 258 2 OR . 1 1 34 34 VAL MG1 H . . . 1 1 41 41 SER HB2 H . . . . . 3.3 0.0 7.7 . . . . . A . 34 VAL MG1 . . A . 41 SER HB2 . . . 34 . HG* . . . . . 41 . HB* . . rr_1iyu 1 258 3 OR . 1 1 41 41 SER HB3 H . . . 1 1 34 34 VAL MG1 H . . . . . 3.3 0.0 7.7 . . . . . A . 41 SER HB3 . . A . 34 VAL MG1 . . . 41 . HB* . . . . . 34 . HG* . . rr_1iyu 1 258 4 OR . 1 1 34 34 VAL MG2 H . . . 1 1 41 41 SER HB3 H . . . . . 3.3 0.0 7.7 . . . . . A . 34 VAL MG2 . . A . 41 SER HB3 . . . 34 . HG* . . . . . 41 . HB* . . rr_1iyu 1 259 1 . . 1 1 40 40 ALA MB H . . . 1 1 41 41 SER H H . . . . . 3.3 0.0 4.8 . . . . . A . 40 ALA MB . . A . 41 SER H . . . 40 . HB* . . . . . 41 . HN . . rr_1iyu 1 260 1 OR . 1 1 41 41 SER H H . . . 1 1 41 41 SER HB2 H . . . . . 3.3 0.0 3.9 . . . . . A . 41 SER H . . A . 41 SER HB2 . . . 41 . HN . . . . . 41 . HB* . . rr_1iyu 1 260 2 OR . 1 1 41 41 SER HB3 H . . . 1 1 41 41 SER H H . . . . . 3.3 0.0 3.9 . . . . . A . 41 SER HB3 . . A . 41 SER H . . . 41 . HB* . . . . . 41 . HN . . rr_1iyu 1 261 1 OR . 1 1 42 42 MET H H . . . 1 1 34 34 VAL MG1 H . . . . . 3.3 0.0 6.7 . . . . . A . 42 MET H . . A . 34 VAL MG1 . . . 42 . HN . . . . . 34 . HG* . . rr_1iyu 1 261 2 OR . 1 1 34 34 VAL MG2 H . . . 1 1 42 42 MET H H . . . . . 3.3 0.0 6.7 . . . . . A . 34 VAL MG2 . . A . 42 MET H . . . 34 . HG* . . . . . 42 . HN . . rr_1iyu 1 262 1 . . 1 1 36 36 GLU HA H . . . 1 1 42 42 MET H H . . . . . 5.0 0.0 5.0 . . . . . A . 36 GLU HA . . A . 42 MET H . . . 36 . HA . . . . . 42 . HN . . rr_1iyu 1 263 1 . . 1 1 40 40 ALA MB H . . . 1 1 42 42 MET H H . . . . . 5.0 0.0 6.5 . . . . . A . 40 ALA MB . . A . 42 MET H . . . 40 . HB* . . . . . 42 . HN . . rr_1iyu 1 264 1 . . 1 1 41 41 SER HA H . . . 1 1 42 42 MET H H . . . . . 2.7 0.0 2.7 . . . . . A . 41 SER HA . . A . 42 MET H . . . 41 . HA . . . . . 42 . HN . . rr_1iyu 1 265 1 OR . 1 1 42 42 MET H H . . . 1 1 41 41 SER HB2 H . . . . . 3.3 0.0 4.3 . . . . . A . 42 MET H . . A . 41 SER HB2 . . . 42 . HN . . . . . 41 . HB* . . rr_1iyu 1 265 2 OR . 1 1 41 41 SER HB3 H . . . 1 1 42 42 MET H H . . . . . 3.3 0.0 4.3 . . . . . A . 41 SER HB3 . . A . 42 MET H . . . 41 . HB* . . . . . 42 . HN . . rr_1iyu 1 266 1 OR . 1 1 42 42 MET H H . . . 1 1 42 42 MET HB2 H . . . . . 3.3 0.0 3.9 . . . . . A . 42 MET H . . A . 42 MET HB2 . . . 42 . HN . . . . . 42 . HB* . . rr_1iyu 1 266 2 OR . 1 1 42 42 MET H H . . . 1 1 42 42 MET HB3 H . . . . . 3.3 0.0 3.9 . . . . . A . 42 MET H . . A . 42 MET HB3 . . . 42 . HN . . . . . 42 . HB* . . rr_1iyu 1 267 1 OR . 1 1 42 42 MET H H . . . 1 1 42 42 MET HG2 H . . . . . 3.3 0.0 4.3 . . . . . A . 42 MET H . . A . 42 MET HG2 . . . 42 . HN . . . . . 42 . HG* . . rr_1iyu 1 267 2 OR . 1 1 42 42 MET H H . . . 1 1 42 42 MET HG3 H . . . . . 3.3 0.0 4.3 . . . . . A . 42 MET H . . A . 42 MET HG3 . . . 42 . HN . . . . . 42 . HG* . . rr_1iyu 1 268 1 . . 1 1 43 43 GLU H H . . . 1 1 42 42 MET HA H . . . . . 2.7 0.0 2.7 . . . . . A . 43 GLU H . . A . 42 MET HA . . . 43 . HN . . . . . 42 . HA . . rr_1iyu 1 269 1 OR . 1 1 43 43 GLU H H . . . 1 1 42 42 MET HB2 H . . . . . 5.0 0.0 6.0 . . . . . A . 43 GLU H . . A . 42 MET HB2 . . . 43 . HN . . . . . 42 . HB* . . rr_1iyu 1 269 2 OR . 1 1 42 42 MET HB3 H . . . 1 1 43 43 GLU H H . . . . . 5.0 0.0 6.0 . . . . . A . 42 MET HB3 . . A . 43 GLU H . . . 42 . HB* . . . . . 43 . HN . . rr_1iyu 1 270 1 OR . 1 1 43 43 GLU H H . . . 1 1 43 43 GLU HB2 H . . . . . 2.7 0.0 3.3 . . . . . A . 43 GLU H . . A . 43 GLU HB2 . . . 43 . HN . . . . . 43 . HB* . . rr_1iyu 1 270 2 OR . 1 1 43 43 GLU H H . . . 1 1 43 43 GLU HB3 H . . . . . 2.7 0.0 3.3 . . . . . A . 43 GLU H . . A . 43 GLU HB3 . . . 43 . HN . . . . . 43 . HB* . . rr_1iyu 1 271 1 OR . 1 1 44 44 VAL HA H . . . 1 1 44 44 VAL MG1 H . . . . . 2.7 0.0 4.3 . . . . . A . 44 VAL HA . . A . 44 VAL MG1 . . . 44 . HA . . . . . 44 . HG* . . rr_1iyu 1 271 2 OR . 1 1 44 44 VAL HA H . . . 1 1 44 44 VAL MG2 H . . . . . 2.7 0.0 4.3 . . . . . A . 44 VAL HA . . A . 44 VAL MG2 . . . 44 . HA . . . . . 44 . HG* . . rr_1iyu 1 272 1 . . 1 1 33 33 VAL H H . . . 1 1 44 44 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 33 VAL H . . A . 44 VAL H . . . 33 . HN . . . . . 44 . HN . . rr_1iyu 1 273 1 . . 1 1 43 43 GLU HA H . . . 1 1 44 44 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 43 GLU HA . . A . 44 VAL H . . . 43 . HA . . . . . 44 . HN . . rr_1iyu 1 274 1 . . 1 1 44 44 VAL HB H . . . 1 1 44 44 VAL H H . . . . . 3.3 0.0 3.3 . . . . . A . 44 VAL HB . . A . 44 VAL H . . . 44 . HB . . . . . 44 . HN . . rr_1iyu 1 275 1 OR . 1 1 44 44 VAL H H . . . 1 1 44 44 VAL MG1 H . . . . . 3.3 0.0 6.0 . . . . . A . 44 VAL H . . A . 44 VAL MG1 . . . 44 . HN . . . . . 44 . HG* . . rr_1iyu 1 275 2 OR . 1 1 44 44 VAL MG2 H . . . 1 1 44 44 VAL H H . . . . . 3.3 0.0 6.0 . . . . . A . 44 VAL MG2 . . A . 44 VAL H . . . 44 . HG* . . . . . 44 . HN . . rr_1iyu 1 276 1 . . 1 1 45 45 PRO HA H . . . 1 1 31 31 GLY HA3 H . . . . . 3.3 0.0 3.3 . . . . . A . 45 PRO HA . . A . 31 GLY HA3 . . . 45 . HA . . . . . 31 . HA1 . . rr_1iyu 1 277 1 . . 1 1 31 31 GLY HA2 H . . . 1 1 45 45 PRO HA H . . . . . 3.3 0.0 3.3 . . . . . A . 31 GLY HA2 . . A . 45 PRO HA . . . 31 . HA2 . . . . . 45 . HA . . rr_1iyu 1 278 1 OR . 1 1 45 45 PRO HA H . . . 1 1 31 31 GLY HA3 H . . . . . 2.9 0.0 2.9 . . . . . A . 45 PRO HA . . A . 31 GLY HA3 . . . 45 . HA . . . . . 31 . HA* . . rr_1iyu 1 278 2 OR . 1 1 31 31 GLY HA2 H . . . 1 1 45 45 PRO HA H . . . . . 2.9 0.0 2.9 . . . . . A . 31 GLY HA2 . . A . 45 PRO HA . . . 31 . HA* . . . . . 45 . HA . . rr_1iyu 1 279 1 OR . 1 1 45 45 PRO HA H . . . 1 1 45 45 PRO HD2 H . . . . . 5.0 0.0 6.0 . . . . . A . 45 PRO HA . . A . 45 PRO HD2 . . . 45 . HA . . . . . 45 . HD* . . rr_1iyu 1 279 2 OR . 1 1 45 45 PRO HA H . . . 1 1 45 45 PRO HD3 H . . . . . 5.0 0.0 6.0 . . . . . A . 45 PRO HA . . A . 45 PRO HD3 . . . 45 . HA . . . . . 45 . HD* . . rr_1iyu 1 280 1 . . 1 1 26 26 ILE MD H . . . 1 1 46 46 SER HA H . . . . . 3.3 0.0 4.8 . . . . . A . 26 ILE MD . . A . 46 SER HA . . . 26 . HD1* . . . . . 46 . HA . . rr_1iyu 1 281 1 OR . 1 1 19 19 LEU MD1 H . . . 1 1 46 46 SER HB3 H . . . . . 5.0 0.0 9.4 . . . . . A . 19 LEU MD1 . . A . 46 SER HB3 . . . 19 . HD* . . . . . 46 . HB* . . rr_1iyu 1 281 2 OR . 1 1 19 19 LEU MD2 H . . . 1 1 46 46 SER HB3 H . . . . . 5.0 0.0 9.4 . . . . . A . 19 LEU MD2 . . A . 46 SER HB3 . . . 19 . HD* . . . . . 46 . HB* . . rr_1iyu 1 281 3 OR . 1 1 46 46 SER HB2 H . . . 1 1 19 19 LEU MD1 H . . . . . 5.0 0.0 9.4 . . . . . A . 46 SER HB2 . . A . 19 LEU MD1 . . . 46 . HB* . . . . . 19 . HD* . . rr_1iyu 1 281 4 OR . 1 1 19 19 LEU MD2 H . . . 1 1 46 46 SER HB2 H . . . . . 5.0 0.0 9.4 . . . . . A . 19 LEU MD2 . . A . 46 SER HB2 . . . 19 . HD* . . . . . 46 . HB* . . rr_1iyu 1 282 1 OR . 1 1 26 26 ILE MD H . . . 1 1 46 46 SER HB3 H . . . . . 3.3 0.0 5.8 . . . . . A . 26 ILE MD . . A . 46 SER HB3 . . . 26 . HD1* . . . . . 46 . HB* . . rr_1iyu 1 282 2 OR . 1 1 26 26 ILE MD H . . . 1 1 46 46 SER HB2 H . . . . . 3.3 0.0 5.8 . . . . . A . 26 ILE MD . . A . 46 SER HB2 . . . 26 . HD1* . . . . . 46 . HB* . . rr_1iyu 1 283 1 . . 1 1 26 26 ILE MD H . . . 1 1 46 46 SER HG H . . . . . 3.3 0.0 4.8 . . . . . A . 26 ILE MD . . A . 46 SER HG . . . 26 . HD1* . . . . . 46 . HG . . rr_1iyu 1 284 1 . . 1 1 28 28 VAL HA H . . . 1 1 46 46 SER HG H . . . . . 5.0 0.0 5.0 . . . . . A . 28 VAL HA . . A . 46 SER HG . . . 28 . HA . . . . . 46 . HG . . rr_1iyu 1 285 1 OR . 1 1 46 46 SER HG H . . . 1 1 72 72 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 46 SER HG . . A . 72 LEU MD1 . . . 46 . HG . . . . . 72 . HD* . . rr_1iyu 1 285 2 OR . 1 1 46 46 SER HG H . . . 1 1 72 72 LEU MD2 H . . . . . 5.0 0.0 8.4 . . . . . A . 46 SER HG . . A . 72 LEU MD2 . . . 46 . HG . . . . . 72 . HD* . . rr_1iyu 1 286 1 . . 1 1 30 30 GLN H H . . . 1 1 46 46 SER H H . . . . . 5.0 0.0 5.0 . . . . . A . 30 GLN H . . A . 46 SER H . . . 30 . HN . . . . . 46 . HN . . rr_1iyu 1 287 1 . . 1 1 45 45 PRO HA H . . . 1 1 46 46 SER H H . . . . . 2.7 0.0 2.7 . . . . . A . 45 PRO HA . . A . 46 SER H . . . 45 . HA . . . . . 46 . HN . . rr_1iyu 1 288 1 OR . 1 1 46 46 SER H H . . . 1 1 45 45 PRO HB2 H . . . . . 5.0 0.0 6.0 . . . . . A . 46 SER H . . A . 45 PRO HB2 . . . 46 . HN . . . . . 45 . HB* . . rr_1iyu 1 288 2 OR . 1 1 46 46 SER H H . . . 1 1 45 45 PRO HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 46 SER H . . A . 45 PRO HB3 . . . 46 . HN . . . . . 45 . HB* . . rr_1iyu 1 289 1 OR . 1 1 46 46 SER H H . . . 1 1 45 45 PRO HG2 H . . . . . 3.3 0.0 4.3 . . . . . A . 46 SER H . . A . 45 PRO HG2 . . . 46 . HN . . . . . 45 . HG* . . rr_1iyu 1 289 2 OR . 1 1 46 46 SER H H . . . 1 1 45 45 PRO HG3 H . . . . . 3.3 0.0 4.3 . . . . . A . 46 SER H . . A . 45 PRO HG3 . . . 46 . HN . . . . . 45 . HG* . . rr_1iyu 1 290 1 . . 1 1 46 46 SER H H . . . 1 1 46 46 SER HB3 H . . . . . 3.3 0.0 3.3 . . . . . A . 46 SER H . . A . 46 SER HB3 . . . 46 . HN . . . . . 46 . HB1 . . rr_1iyu 1 291 1 . . 1 1 46 46 SER HB2 H . . . 1 1 46 46 SER H H . . . . . 3.3 0.0 3.3 . . . . . A . 46 SER HB2 . . A . 46 SER H . . . 46 . HB2 . . . . . 46 . HN . . rr_1iyu 1 292 1 OR . 1 1 46 46 SER H H . . . 1 1 46 46 SER HB3 H . . . . . 2.9 0.0 2.9 . . . . . A . 46 SER H . . A . 46 SER HB3 . . . 46 . HN . . . . . 46 . HB* . . rr_1iyu 1 292 2 OR . 1 1 46 46 SER HB2 H . . . 1 1 46 46 SER H H . . . . . 2.9 0.0 2.9 . . . . . A . 46 SER HB2 . . A . 46 SER H . . . 46 . HB* . . . . . 46 . HN . . rr_1iyu 1 293 1 . . 1 1 46 46 SER HG H . . . 1 1 46 46 SER H H . . . . . 5.0 0.0 5.0 . . . . . A . 46 SER HG . . A . 46 SER H . . . 46 . HG . . . . . 46 . HN . . rr_1iyu 1 294 1 . . 1 1 28 28 VAL HA H . . . 1 1 48 48 LYS H H . . . . . 5.0 0.0 5.0 . . . . . A . 28 VAL HA . . A . 48 LYS H . . . 28 . HA . . . . . 48 . HN . . rr_1iyu 1 295 1 . . 1 1 48 48 LYS H H . . . 1 1 46 46 SER HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 48 LYS H . . A . 46 SER HB3 . . . 48 . HN . . . . . 46 . HB1 . . rr_1iyu 1 296 1 . . 1 1 46 46 SER HB2 H . . . 1 1 48 48 LYS H H . . . . . 5.0 0.0 5.0 . . . . . A . 46 SER HB2 . . A . 48 LYS H . . . 46 . HB2 . . . . . 48 . HN . . rr_1iyu 1 297 1 . . 1 1 46 46 SER HG H . . . 1 1 48 48 LYS H H . . . . . 2.7 0.0 2.7 . . . . . A . 46 SER HG . . A . 48 LYS H . . . 46 . HG . . . . . 48 . HN . . rr_1iyu 1 298 1 . . 1 1 48 48 LYS H H . . . 1 1 47 47 PRO HA H . . . . . 3.3 0.0 3.3 . . . . . A . 48 LYS H . . A . 47 PRO HA . . . 48 . HN . . . . . 47 . HA . . rr_1iyu 1 299 1 OR . 1 1 48 48 LYS H H . . . 1 1 48 48 LYS HB2 H . . . . . 3.3 0.0 3.9 . . . . . A . 48 LYS H . . A . 48 LYS HB2 . . . 48 . HN . . . . . 48 . HB* . . rr_1iyu 1 299 2 OR . 1 1 48 48 LYS H H . . . 1 1 48 48 LYS HB3 H . . . . . 3.3 0.0 3.9 . . . . . A . 48 LYS H . . A . 48 LYS HB3 . . . 48 . HN . . . . . 48 . HB* . . rr_1iyu 1 300 1 OR . 1 1 48 48 LYS H H . . . 1 1 72 72 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 48 LYS H . . A . 72 LEU MD1 . . . 48 . HN . . . . . 72 . HD* . . rr_1iyu 1 300 2 OR . 1 1 72 72 LEU MD2 H . . . 1 1 48 48 LYS H H . . . . . 5.0 0.0 8.4 . . . . . A . 72 LEU MD2 . . A . 48 LYS H . . . 72 . HD* . . . . . 48 . HN . . rr_1iyu 1 301 1 . . 1 1 28 28 VAL HA H . . . 1 1 49 49 ALA H H . . . . . 5.0 0.0 5.0 . . . . . A . 28 VAL HA . . A . 49 ALA H . . . 28 . HA . . . . . 49 . HN . . rr_1iyu 1 302 1 . . 1 1 49 49 ALA H H . . . 1 1 49 49 ALA MB H . . . . . 2.7 0.0 3.8 . . . . . A . 49 ALA H . . A . 49 ALA MB . . . 49 . HN . . . . . 49 . HB* . . rr_1iyu 1 303 1 OR . 1 1 49 49 ALA H H . . . 1 1 72 72 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 49 ALA H . . A . 72 LEU MD1 . . . 49 . HN . . . . . 72 . HD* . . rr_1iyu 1 303 2 OR . 1 1 72 72 LEU MD2 H . . . 1 1 49 49 ALA H H . . . . . 5.0 0.0 8.4 . . . . . A . 72 LEU MD2 . . A . 49 ALA H . . . 72 . HD* . . . . . 49 . HN . . rr_1iyu 1 304 1 . . 1 1 26 26 ILE HB H . . . 1 1 50 50 GLY H H . . . . . 5.0 0.0 5.0 . . . . . A . 26 ILE HB . . A . 50 GLY H . . . 26 . HB . . . . . 50 . HN . . rr_1iyu 1 305 1 . . 1 1 26 26 ILE MD H . . . 1 1 50 50 GLY H H . . . . . 5.0 0.0 6.5 . . . . . A . 26 ILE MD . . A . 50 GLY H . . . 26 . HD1* . . . . . 50 . HN . . rr_1iyu 1 306 1 . . 1 1 50 50 GLY H H . . . 1 1 49 49 ALA MB H . . . . . 5.0 0.0 6.5 . . . . . A . 50 GLY H . . A . 49 ALA MB . . . 50 . HN . . . . . 49 . HB* . . rr_1iyu 1 307 1 . . 1 1 50 50 GLY H H . . . 1 1 72 72 LEU HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 50 GLY H . . A . 72 LEU HB2 . . . 50 . HN . . . . . 72 . HB2 . . rr_1iyu 1 308 1 OR . 1 1 50 50 GLY H H . . . 1 1 72 72 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 50 GLY H . . A . 72 LEU MD1 . . . 50 . HN . . . . . 72 . HD* . . rr_1iyu 1 308 2 OR . 1 1 50 50 GLY H H . . . 1 1 72 72 LEU MD2 H . . . . . 5.0 0.0 8.4 . . . . . A . 50 GLY H . . A . 72 LEU MD2 . . . 50 . HN . . . . . 72 . HD* . . rr_1iyu 1 309 1 OR . 1 1 72 72 LEU MD2 H . . . 1 1 50 50 GLY HA3 H . . . . . 5.0 0.0 8.4 . . . . . A . 72 LEU MD2 . . A . 50 GLY HA3 . . . 72 . HD* . . . . . 50 . HA1 . . rr_1iyu 1 309 2 OR . 1 1 50 50 GLY HA3 H . . . 1 1 72 72 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 50 GLY HA3 . . A . 72 LEU MD1 . . . 50 . HA1 . . . . . 72 . HD* . . rr_1iyu 1 310 1 OR . 1 1 72 72 LEU MD2 H . . . 1 1 50 50 GLY HA2 H . . . . . 5.0 0.0 8.4 . . . . . A . 72 LEU MD2 . . A . 50 GLY HA2 . . . 72 . HD* . . . . . 50 . HA2 . . rr_1iyu 1 310 2 OR . 1 1 50 50 GLY HA2 H . . . 1 1 72 72 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 50 GLY HA2 . . A . 72 LEU MD1 . . . 50 . HA2 . . . . . 72 . HD* . . rr_1iyu 1 311 1 OR . 1 1 50 50 GLY HA3 H . . . 1 1 72 72 LEU MD1 H . . . . . 5.2 0.0 5.2 . . . . . A . 50 GLY HA3 . . A . 72 LEU MD1 . . . 50 . HA* . . . . . 72 . HD* . . rr_1iyu 1 311 2 OR . 1 1 50 50 GLY HA2 H . . . 1 1 72 72 LEU MD1 H . . . . . 5.2 0.0 5.2 . . . . . A . 50 GLY HA2 . . A . 72 LEU MD1 . . . 50 . HA* . . . . . 72 . HD* . . rr_1iyu 1 311 3 OR . 1 1 72 72 LEU MD2 H . . . 1 1 50 50 GLY HA3 H . . . . . 5.2 0.0 5.2 . . . . . A . 72 LEU MD2 . . A . 50 GLY HA3 . . . 72 . HD* . . . . . 50 . HA* . . rr_1iyu 1 311 4 OR . 1 1 72 72 LEU MD2 H . . . 1 1 50 50 GLY HA2 H . . . . . 5.2 0.0 5.2 . . . . . A . 72 LEU MD2 . . A . 50 GLY HA2 . . . 72 . HD* . . . . . 50 . HA* . . rr_1iyu 1 312 1 . . 1 1 51 51 VAL MG2 H . . . 1 1 51 51 VAL HA H . . . . . 3.3 0.0 4.4 . . . . . A . 51 VAL MG2 . . A . 51 VAL HA . . . 51 . HG2* . . . . . 51 . HA . . rr_1iyu 1 313 1 OR . 1 1 51 51 VAL HA H . . . 1 1 72 72 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 51 VAL HA . . A . 72 LEU MD1 . . . 51 . HA . . . . . 72 . HD* . . rr_1iyu 1 313 2 OR . 1 1 72 72 LEU MD2 H . . . 1 1 51 51 VAL HA H . . . . . 5.0 0.0 8.4 . . . . . A . 72 LEU MD2 . . A . 51 VAL HA . . . 72 . HD* . . . . . 51 . HA . . rr_1iyu 1 314 1 OR . 1 1 51 51 VAL H H . . . 1 1 72 72 LEU MD1 H . . . . . 3.3 0.0 6.7 . . . . . A . 51 VAL H . . A . 72 LEU MD1 . . . 51 . HN . . . . . 72 . HD* . . rr_1iyu 1 314 2 OR . 1 1 72 72 LEU MD2 H . . . 1 1 51 51 VAL H H . . . . . 3.3 0.0 6.7 . . . . . A . 72 LEU MD2 . . A . 51 VAL H . . . 72 . HD* . . . . . 51 . HN . . rr_1iyu 1 315 1 . . 1 1 22 22 THR HA H . . . 1 1 52 52 VAL H H . . . . . 5.0 0.0 5.0 . . . . . A . 22 THR HA . . A . 52 VAL H . . . 22 . HA . . . . . 52 . HN . . rr_1iyu 1 316 1 . . 1 1 24 24 ASP H H . . . 1 1 52 52 VAL H H . . . . . 5.0 0.0 5.0 . . . . . A . 24 ASP H . . A . 52 VAL H . . . 24 . HN . . . . . 52 . HN . . rr_1iyu 1 317 1 . . 1 1 51 51 VAL HA H . . . 1 1 52 52 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 51 VAL HA . . A . 52 VAL H . . . 51 . HA . . . . . 52 . HN . . rr_1iyu 1 318 1 . . 1 1 52 52 VAL HB H . . . 1 1 52 52 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 52 VAL HB . . A . 52 VAL H . . . 52 . HB . . . . . 52 . HN . . rr_1iyu 1 319 1 . . 1 1 52 52 VAL MG1 H . . . 1 1 52 52 VAL H H . . . . . 3.3 0.0 4.8 . . . . . A . 52 VAL MG1 . . A . 52 VAL H . . . 52 . HG1* . . . . . 52 . HN . . rr_1iyu 1 320 1 . . 1 1 52 52 VAL MG2 H . . . 1 1 52 52 VAL H H . . . . . 2.7 0.0 4.2 . . . . . A . 52 VAL MG2 . . A . 52 VAL H . . . 52 . HG2* . . . . . 52 . HN . . rr_1iyu 1 321 1 OR . 1 1 52 52 VAL H H . . . 1 1 72 72 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 52 VAL H . . A . 72 LEU MD1 . . . 52 . HN . . . . . 72 . HD* . . rr_1iyu 1 321 2 OR . 1 1 72 72 LEU MD2 H . . . 1 1 52 52 VAL H H . . . . . 5.0 0.0 8.4 . . . . . A . 72 LEU MD2 . . A . 52 VAL H . . . 72 . HD* . . . . . 52 . HN . . rr_1iyu 1 322 1 . . 1 1 53 53 LYS H H . . . 1 1 52 52 VAL HA H . . . . . 2.7 0.0 2.7 . . . . . A . 53 LYS H . . A . 52 VAL HA . . . 53 . HN . . . . . 52 . HA . . rr_1iyu 1 323 1 . . 1 1 52 52 VAL MG1 H . . . 1 1 53 53 LYS H H . . . . . 5.0 0.0 6.5 . . . . . A . 52 VAL MG1 . . A . 53 LYS H . . . 52 . HG1* . . . . . 53 . HN . . rr_1iyu 1 324 1 . . 1 1 53 53 LYS H H . . . 1 1 53 53 LYS HB3 H . . . . . 3.3 0.0 3.3 . . . . . A . 53 LYS H . . A . 53 LYS HB3 . . . 53 . HN . . . . . 53 . HB1 . . rr_1iyu 1 325 1 . . 1 1 53 53 LYS H H . . . 1 1 53 53 LYS HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 53 LYS H . . A . 53 LYS HB2 . . . 53 . HN . . . . . 53 . HB2 . . rr_1iyu 1 326 1 . . 1 1 53 53 LYS H H . . . 1 1 54 54 SER H H . . . . . 2.7 0.0 2.7 . . . . . A . 53 LYS H . . A . 54 SER H . . . 53 . HN . . . . . 54 . HN . . rr_1iyu 1 327 1 . . 1 1 53 53 LYS H H . . . 1 1 72 72 LEU HA H . . . . . 3.3 0.0 3.3 . . . . . A . 53 LYS H . . A . 72 LEU HA . . . 53 . HN . . . . . 72 . HA . . rr_1iyu 1 328 1 OR . 1 1 53 53 LYS H H . . . 1 1 72 72 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 53 LYS H . . A . 72 LEU MD1 . . . 53 . HN . . . . . 72 . HD* . . rr_1iyu 1 328 2 OR . 1 1 72 72 LEU MD2 H . . . 1 1 53 53 LYS H H . . . . . 5.0 0.0 8.4 . . . . . A . 72 LEU MD2 . . A . 53 LYS H . . . 72 . HD* . . . . . 53 . HN . . rr_1iyu 1 329 1 . . 1 1 54 54 SER H H . . . 1 1 53 53 LYS HA H . . . . . 5.0 0.0 5.0 . . . . . A . 54 SER H . . A . 53 LYS HA . . . 54 . HN . . . . . 53 . HA . . rr_1iyu 1 330 1 . . 1 1 54 54 SER H H . . . 1 1 53 53 LYS HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 54 SER H . . A . 53 LYS HB3 . . . 54 . HN . . . . . 53 . HB1 . . rr_1iyu 1 331 1 . . 1 1 54 54 SER H H . . . 1 1 53 53 LYS HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 54 SER H . . A . 53 LYS HB2 . . . 54 . HN . . . . . 53 . HB2 . . rr_1iyu 1 332 1 OR . 1 1 54 54 SER H H . . . 1 1 53 53 LYS HB3 H . . . . . 4.1 0.0 4.1 . . . . . A . 54 SER H . . A . 53 LYS HB3 . . . 54 . HN . . . . . 53 . HB* . . rr_1iyu 1 332 2 OR . 1 1 54 54 SER H H . . . 1 1 53 53 LYS HB2 H . . . . . 4.1 0.0 4.1 . . . . . A . 54 SER H . . A . 53 LYS HB2 . . . 54 . HN . . . . . 53 . HB* . . rr_1iyu 1 333 1 OR . 1 1 54 54 SER H H . . . 1 1 54 54 SER HB2 H . . . . . 5.0 0.0 5.6 . . . . . A . 54 SER H . . A . 54 SER HB2 . . . 54 . HN . . . . . 54 . HB* . . rr_1iyu 1 333 2 OR . 1 1 54 54 SER H H . . . 1 1 54 54 SER HB3 H . . . . . 5.0 0.0 5.6 . . . . . A . 54 SER H . . A . 54 SER HB3 . . . 54 . HN . . . . . 54 . HB* . . rr_1iyu 1 334 1 . . 1 1 54 54 SER H H . . . 1 1 70 70 ILE HB H . . . . . 5.0 0.0 5.0 . . . . . A . 54 SER H . . A . 70 ILE HB . . . 54 . HN . . . . . 70 . HB . . rr_1iyu 1 335 1 OR . 1 1 54 54 SER H H . . . 1 1 71 71 GLU HB2 H . . . . . 3.3 0.0 4.3 . . . . . A . 54 SER H . . A . 71 GLU HB2 . . . 54 . HN . . . . . 71 . HB* . . rr_1iyu 1 335 2 OR . 1 1 54 54 SER H H . . . 1 1 71 71 GLU HB3 H . . . . . 3.3 0.0 4.3 . . . . . A . 54 SER H . . A . 71 GLU HB3 . . . 54 . HN . . . . . 71 . HB* . . rr_1iyu 1 336 1 . . 1 1 55 55 VAL H H . . . 1 1 54 54 SER HA H . . . . . 2.7 0.0 2.7 . . . . . A . 55 VAL H . . A . 54 SER HA . . . 55 . HN . . . . . 54 . HA . . rr_1iyu 1 337 1 . . 1 1 55 55 VAL H H . . . 1 1 55 55 VAL HB H . . . . . 2.7 0.0 2.7 . . . . . A . 55 VAL H . . A . 55 VAL HB . . . 55 . HN . . . . . 55 . HB . . rr_1iyu 1 338 1 . . 1 1 55 55 VAL H H . . . 1 1 55 55 VAL MG1 H . . . . . 5.0 0.0 6.5 . . . . . A . 55 VAL H . . A . 55 VAL MG1 . . . 55 . HN . . . . . 55 . HG1* . . rr_1iyu 1 339 1 . . 1 1 55 55 VAL H H . . . 1 1 55 55 VAL MG2 H . . . . . 3.3 0.0 4.8 . . . . . A . 55 VAL H . . A . 55 VAL MG2 . . . 55 . HN . . . . . 55 . HG2* . . rr_1iyu 1 340 1 . . 1 1 55 55 VAL HB H . . . 1 1 56 56 SER H H . . . . . 5.0 0.0 5.0 . . . . . A . 55 VAL HB . . A . 56 SER H . . . 55 . HB . . . . . 56 . HN . . rr_1iyu 1 341 1 . . 1 1 55 55 VAL MG1 H . . . 1 1 56 56 SER H H . . . . . 3.3 0.0 4.8 . . . . . A . 55 VAL MG1 . . A . 56 SER H . . . 55 . HG1* . . . . . 56 . HN . . rr_1iyu 1 342 1 . . 1 1 56 56 SER H H . . . 1 1 56 56 SER HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 56 SER H . . A . 56 SER HB3 . . . 56 . HN . . . . . 56 . HB1 . . rr_1iyu 1 343 1 . . 1 1 56 56 SER H H . . . 1 1 56 56 SER HB2 H . . . . . 5.0 0.0 5.0 . . . . . A . 56 SER H . . A . 56 SER HB2 . . . 56 . HN . . . . . 56 . HB2 . . rr_1iyu 1 344 1 OR . 1 1 56 56 SER H H . . . 1 1 56 56 SER HB3 H . . . . . 4.1 0.0 4.1 . . . . . A . 56 SER H . . A . 56 SER HB3 . . . 56 . HN . . . . . 56 . HB* . . rr_1iyu 1 344 2 OR . 1 1 56 56 SER H H . . . 1 1 56 56 SER HB2 H . . . . . 4.1 0.0 4.1 . . . . . A . 56 SER H . . A . 56 SER HB2 . . . 56 . HN . . . . . 56 . HB* . . rr_1iyu 1 345 1 . . 1 1 56 56 SER H H . . . 1 1 57 57 VAL MG2 H . . . . . 5.0 0.0 6.5 . . . . . A . 56 SER H . . A . 57 VAL MG2 . . . 56 . HN . . . . . 57 . HG2* . . rr_1iyu 1 346 1 . . 1 1 56 56 SER H H . . . 1 1 57 57 VAL H H . . . . . 2.7 0.0 2.7 . . . . . A . 56 SER H . . A . 57 VAL H . . . 56 . HN . . . . . 57 . HN . . rr_1iyu 1 347 1 . . 1 1 56 56 SER H H . . . 1 1 70 70 ILE HA H . . . . . 2.7 0.0 2.7 . . . . . A . 56 SER H . . A . 70 ILE HA . . . 56 . HN . . . . . 70 . HA . . rr_1iyu 1 348 1 . . 1 1 57 57 VAL HA H . . . 1 1 57 57 VAL HB H . . . . . 2.7 0.0 2.7 . . . . . A . 57 VAL HA . . A . 57 VAL HB . . . 57 . HA . . . . . 57 . HB . . rr_1iyu 1 349 1 . . 1 1 57 57 VAL HA H . . . 1 1 57 57 VAL MG1 H . . . . . 2.7 0.0 4.2 . . . . . A . 57 VAL HA . . A . 57 VAL MG1 . . . 57 . HA . . . . . 57 . HG1* . . rr_1iyu 1 350 1 . . 1 1 57 57 VAL MG2 H . . . 1 1 57 57 VAL HA H . . . . . 3.3 0.0 4.8 . . . . . A . 57 VAL MG2 . . A . 57 VAL HA . . . 57 . HG2* . . . . . 57 . HA . . rr_1iyu 1 351 1 . . 1 1 55 55 VAL HB H . . . 1 1 57 57 VAL H H . . . . . 5.0 0.0 5.0 . . . . . A . 55 VAL HB . . A . 57 VAL H . . . 55 . HB . . . . . 57 . HN . . rr_1iyu 1 352 1 . . 1 1 55 55 VAL MG1 H . . . 1 1 57 57 VAL H H . . . . . 3.3 0.0 4.8 . . . . . A . 55 VAL MG1 . . A . 57 VAL H . . . 55 . HG1* . . . . . 57 . HN . . rr_1iyu 1 353 1 . . 1 1 57 57 VAL H H . . . 1 1 56 56 SER HA H . . . . . 3.3 0.0 3.3 . . . . . A . 57 VAL H . . A . 56 SER HA . . . 57 . HN . . . . . 56 . HA . . rr_1iyu 1 354 1 OR . 1 1 57 57 VAL H H . . . 1 1 56 56 SER HB3 H . . . . . 3.3 0.0 4.3 . . . . . A . 57 VAL H . . A . 56 SER HB3 . . . 57 . HN . . . . . 56 . HB* . . rr_1iyu 1 354 2 OR . 1 1 56 56 SER HB2 H . . . 1 1 57 57 VAL H H . . . . . 3.3 0.0 4.3 . . . . . A . 56 SER HB2 . . A . 57 VAL H . . . 56 . HB* . . . . . 57 . HN . . rr_1iyu 1 355 1 . . 1 1 57 57 VAL H H . . . 1 1 57 57 VAL HB H . . . . . 5.0 0.0 5.0 . . . . . A . 57 VAL H . . A . 57 VAL HB . . . 57 . HN . . . . . 57 . HB . . rr_1iyu 1 356 1 . . 1 1 57 57 VAL H H . . . 1 1 57 57 VAL MG1 H . . . . . 3.3 0.0 4.8 . . . . . A . 57 VAL H . . A . 57 VAL MG1 . . . 57 . HN . . . . . 57 . HG1* . . rr_1iyu 1 357 1 . . 1 1 57 57 VAL MG2 H . . . 1 1 57 57 VAL H H . . . . . 2.7 0.0 4.2 . . . . . A . 57 VAL MG2 . . A . 57 VAL H . . . 57 . HG2* . . . . . 57 . HN . . rr_1iyu 1 358 1 . . 1 1 57 57 VAL HA H . . . 1 1 58 58 LYS H H . . . . . 2.7 0.0 2.7 . . . . . A . 57 VAL HA . . A . 58 LYS H . . . 57 . HA . . . . . 58 . HN . . rr_1iyu 1 359 1 . . 1 1 57 57 VAL HB H . . . 1 1 58 58 LYS H H . . . . . 2.7 0.0 2.7 . . . . . A . 57 VAL HB . . A . 58 LYS H . . . 57 . HB . . . . . 58 . HN . . rr_1iyu 1 360 1 . . 1 1 57 57 VAL MG1 H . . . 1 1 58 58 LYS H H . . . . . 5.0 0.0 6.0 . . . . . A . 57 VAL MG1 . . A . 58 LYS H . . . 57 . HG1* . . . . . 58 . HN . . rr_1iyu 1 361 1 . . 1 1 57 57 VAL MG2 H . . . 1 1 58 58 LYS H H . . . . . 5.0 0.0 6.0 . . . . . A . 57 VAL MG2 . . A . 58 LYS H . . . 57 . HG2* . . . . . 58 . HN . . rr_1iyu 1 362 1 . . 1 1 58 58 LYS H H . . . 1 1 58 58 LYS HB3 H . . . . . 3.3 0.0 3.3 . . . . . A . 58 LYS H . . A . 58 LYS HB3 . . . 58 . HN . . . . . 58 . HB1 . . rr_1iyu 1 363 1 . . 1 1 58 58 LYS H H . . . 1 1 58 58 LYS HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 58 LYS H . . A . 58 LYS HB2 . . . 58 . HN . . . . . 58 . HB2 . . rr_1iyu 1 364 1 . . 1 1 58 58 LYS H H . . . 1 1 61 61 ASP HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 58 LYS H . . A . 61 ASP HB3 . . . 58 . HN . . . . . 61 . HB1 . . rr_1iyu 1 365 1 . . 1 1 58 58 LYS H H . . . 1 1 61 61 ASP HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 58 LYS H . . A . 61 ASP HB2 . . . 58 . HN . . . . . 61 . HB2 . . rr_1iyu 1 366 1 OR . 1 1 59 59 LEU H H . . . 1 1 18 18 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 59 LEU H . . A . 18 LEU MD1 . . . 59 . HN . . . . . 18 . HD* . . rr_1iyu 1 366 2 OR . 1 1 18 18 LEU MD2 H . . . 1 1 59 59 LEU H H . . . . . 5.0 0.0 8.4 . . . . . A . 18 LEU MD2 . . A . 59 LEU H . . . 18 . HD* . . . . . 59 . HN . . rr_1iyu 1 367 1 . . 1 1 59 59 LEU H H . . . 1 1 58 58 LYS HA H . . . . . 3.3 0.0 3.3 . . . . . A . 59 LEU H . . A . 58 LYS HA . . . 59 . HN . . . . . 58 . HA . . rr_1iyu 1 368 1 OR . 1 1 59 59 LEU H H . . . 1 1 58 58 LYS HB3 H . . . . . 3.3 0.0 4.3 . . . . . A . 59 LEU H . . A . 58 LYS HB3 . . . 59 . HN . . . . . 58 . HB* . . rr_1iyu 1 368 2 OR . 1 1 59 59 LEU H H . . . 1 1 58 58 LYS HB2 H . . . . . 3.3 0.0 4.3 . . . . . A . 59 LEU H . . A . 58 LYS HB2 . . . 59 . HN . . . . . 58 . HB* . . rr_1iyu 1 369 1 OR . 1 1 59 59 LEU H H . . . 1 1 59 59 LEU HB2 H . . . . . 2.7 0.0 3.3 . . . . . A . 59 LEU H . . A . 59 LEU HB2 . . . 59 . HN . . . . . 59 . HB* . . rr_1iyu 1 369 2 OR . 1 1 59 59 LEU H H . . . 1 1 59 59 LEU HB3 H . . . . . 2.7 0.0 3.3 . . . . . A . 59 LEU H . . A . 59 LEU HB3 . . . 59 . HN . . . . . 59 . HB* . . rr_1iyu 1 370 1 . . 1 1 59 59 LEU H H . . . 1 1 59 59 LEU MD1 H . . . . . 5.0 0.0 6.5 . . . . . A . 59 LEU H . . A . 59 LEU MD1 . . . 59 . HN . . . . . 59 . HD1* . . rr_1iyu 1 371 1 . . 1 1 59 59 LEU H H . . . 1 1 59 59 LEU MD2 H . . . . . 5.0 0.0 6.5 . . . . . A . 59 LEU H . . A . 59 LEU MD2 . . . 59 . HN . . . . . 59 . HD2* . . rr_1iyu 1 372 1 . . 1 1 59 59 LEU H H . . . 1 1 59 59 LEU HG H . . . . . 3.3 0.0 3.3 . . . . . A . 59 LEU H . . A . 59 LEU HG . . . 59 . HN . . . . . 59 . HG . . rr_1iyu 1 373 1 . . 1 1 15 15 VAL HB H . . . 1 1 60 60 GLY H H . . . . . 3.3 0.0 3.3 . . . . . A . 15 VAL HB . . A . 60 GLY H . . . 15 . HB . . . . . 60 . HN . . rr_1iyu 1 374 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 60 60 GLY H H . . . . . 3.3 0.0 4.8 . . . . . A . 15 VAL MG1 . . A . 60 GLY H . . . 15 . HG1* . . . . . 60 . HN . . rr_1iyu 1 375 1 . . 1 1 15 15 VAL MG2 H . . . 1 1 60 60 GLY H H . . . . . 5.0 0.0 6.5 . . . . . A . 15 VAL MG2 . . A . 60 GLY H . . . 15 . HG2* . . . . . 60 . HN . . rr_1iyu 1 376 1 . . 1 1 60 60 GLY H H . . . 1 1 59 59 LEU HA H . . . . . 2.7 0.0 2.7 . . . . . A . 60 GLY H . . A . 59 LEU HA . . . 60 . HN . . . . . 59 . HA . . rr_1iyu 1 377 1 OR . 1 1 60 60 GLY H H . . . 1 1 59 59 LEU HB2 H . . . . . 3.3 0.0 4.3 . . . . . A . 60 GLY H . . A . 59 LEU HB2 . . . 60 . HN . . . . . 59 . HB* . . rr_1iyu 1 377 2 OR . 1 1 59 59 LEU HB3 H . . . 1 1 60 60 GLY H H . . . . . 3.3 0.0 4.3 . . . . . A . 59 LEU HB3 . . A . 60 GLY H . . . 59 . HB* . . . . . 60 . HN . . rr_1iyu 1 378 1 OR . 1 1 60 60 GLY H H . . . 1 1 59 59 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 60 GLY H . . A . 59 LEU MD1 . . . 60 . HN . . . . . 59 . HD* . . rr_1iyu 1 378 2 OR . 1 1 60 60 GLY H H . . . 1 1 59 59 LEU MD2 H . . . . . 5.0 0.0 8.4 . . . . . A . 60 GLY H . . A . 59 LEU MD2 . . . 60 . HN . . . . . 59 . HD* . . rr_1iyu 1 379 1 . . 1 1 61 61 ASP H H . . . 1 1 60 60 GLY H H . . . . . 2.7 0.0 2.7 . . . . . A . 61 ASP H . . A . 60 GLY H . . . 61 . HN . . . . . 60 . HN . . rr_1iyu 1 380 1 . . 1 1 15 15 VAL HB H . . . 1 1 61 61 ASP H H . . . . . 3.3 0.0 3.3 . . . . . A . 15 VAL HB . . A . 61 ASP H . . . 15 . HB . . . . . 61 . HN . . rr_1iyu 1 381 1 . . 1 1 15 15 VAL MG1 H . . . 1 1 61 61 ASP H H . . . . . 5.0 0.0 6.5 . . . . . A . 15 VAL MG1 . . A . 61 ASP H . . . 15 . HG1* . . . . . 61 . HN . . rr_1iyu 1 382 1 . . 1 1 15 15 VAL MG2 H . . . 1 1 61 61 ASP H H . . . . . 3.3 0.0 4.8 . . . . . A . 15 VAL MG2 . . A . 61 ASP H . . . 15 . HG2* . . . . . 61 . HN . . rr_1iyu 1 383 1 . . 1 1 61 61 ASP H H . . . 1 1 59 59 LEU HA H . . . . . 5.0 0.0 5.0 . . . . . A . 61 ASP H . . A . 59 LEU HA . . . 61 . HN . . . . . 59 . HA . . rr_1iyu 1 384 1 . . 1 1 61 61 ASP H H . . . 1 1 59 59 LEU HG H . . . . . 5.0 0.0 5.0 . . . . . A . 61 ASP H . . A . 59 LEU HG . . . 61 . HN . . . . . 59 . HG . . rr_1iyu 1 385 1 OR . 1 1 61 61 ASP H H . . . 1 1 60 60 GLY HA2 H . . . . . 5.0 0.0 6.0 . . . . . A . 61 ASP H . . A . 60 GLY HA2 . . . 61 . HN . . . . . 60 . HA* . . rr_1iyu 1 385 2 OR . 1 1 61 61 ASP H H . . . 1 1 60 60 GLY HA3 H . . . . . 5.0 0.0 6.0 . . . . . A . 61 ASP H . . A . 60 GLY HA3 . . . 61 . HN . . . . . 60 . HA* . . rr_1iyu 1 386 1 . . 1 1 61 61 ASP H H . . . 1 1 61 61 ASP HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 61 ASP H . . A . 61 ASP HB3 . . . 61 . HN . . . . . 61 . HB1 . . rr_1iyu 1 387 1 . . 1 1 61 61 ASP H H . . . 1 1 61 61 ASP HB2 H . . . . . 2.7 0.0 2.7 . . . . . A . 61 ASP H . . A . 61 ASP HB2 . . . 61 . HN . . . . . 61 . HB2 . . rr_1iyu 1 388 1 . . 1 1 62 62 LYS H H . . . 1 1 61 61 ASP HA H . . . . . 2.7 0.0 2.7 . . . . . A . 62 LYS H . . A . 61 ASP HA . . . 62 . HN . . . . . 61 . HA . . rr_1iyu 1 389 1 . . 1 1 61 61 ASP HB3 H . . . 1 1 62 62 LYS H H . . . . . 3.3 0.0 3.3 . . . . . A . 61 ASP HB3 . . A . 62 LYS H . . . 61 . HB1 . . . . . 62 . HN . . rr_1iyu 1 390 1 . . 1 1 61 61 ASP HB2 H . . . 1 1 62 62 LYS H H . . . . . 5.0 0.0 5.0 . . . . . A . 61 ASP HB2 . . A . 62 LYS H . . . 61 . HB2 . . . . . 62 . HN . . rr_1iyu 1 391 1 OR . 1 1 62 62 LYS H H . . . 1 1 62 62 LYS HB2 H . . . . . 3.3 0.0 3.9 . . . . . A . 62 LYS H . . A . 62 LYS HB2 . . . 62 . HN . . . . . 62 . HB* . . rr_1iyu 1 391 2 OR . 1 1 62 62 LYS H H . . . 1 1 62 62 LYS HB3 H . . . . . 3.3 0.0 3.9 . . . . . A . 62 LYS H . . A . 62 LYS HB3 . . . 62 . HN . . . . . 62 . HB* . . rr_1iyu 1 392 1 . . 1 1 13 13 GLY H H . . . 1 1 63 63 LEU H H . . . . . 5.0 0.0 5.0 . . . . . A . 13 GLY H . . A . 63 LEU H . . . 13 . HN . . . . . 63 . HN . . rr_1iyu 1 393 1 . . 1 1 14 14 GLU HA H . . . 1 1 63 63 LEU H H . . . . . 3.3 0.0 3.3 . . . . . A . 14 GLU HA . . A . 63 LEU H . . . 14 . HA . . . . . 63 . HN . . rr_1iyu 1 394 1 . . 1 1 62 62 LYS HA H . . . 1 1 63 63 LEU H H . . . . . 2.7 0.0 2.7 . . . . . A . 62 LYS HA . . A . 63 LEU H . . . 62 . HA . . . . . 63 . HN . . rr_1iyu 1 395 1 OR . 1 1 63 63 LEU H H . . . 1 1 63 63 LEU HB2 H . . . . . 2.7 0.0 3.3 . . . . . A . 63 LEU H . . A . 63 LEU HB2 . . . 63 . HN . . . . . 63 . HB* . . rr_1iyu 1 395 2 OR . 1 1 63 63 LEU H H . . . 1 1 63 63 LEU HB3 H . . . . . 2.7 0.0 3.3 . . . . . A . 63 LEU H . . A . 63 LEU HB3 . . . 63 . HN . . . . . 63 . HB* . . rr_1iyu 1 396 1 . . 1 1 12 12 ASP HA H . . . 1 1 64 64 LYS HA H . . . . . 3.3 0.0 3.3 . . . . . A . 12 ASP HA . . A . 64 LYS HA . . . 12 . HA . . . . . 64 . HA . . rr_1iyu 1 397 1 . . 1 1 64 64 LYS H H . . . 1 1 63 63 LEU HA H . . . . . 2.7 0.0 2.7 . . . . . A . 64 LYS H . . A . 63 LEU HA . . . 64 . HN . . . . . 63 . HA . . rr_1iyu 1 398 1 . . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HB3 H . . . . . 3.3 0.0 3.3 . . . . . A . 64 LYS H . . A . 64 LYS HB3 . . . 64 . HN . . . . . 64 . HB1 . . rr_1iyu 1 399 1 . . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 64 LYS H . . A . 64 LYS HB2 . . . 64 . HN . . . . . 64 . HB2 . . rr_1iyu 1 400 1 OR . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HB3 H . . . . . 2.9 0.0 2.9 . . . . . A . 64 LYS H . . A . 64 LYS HB3 . . . 64 . HN . . . . . 64 . HB* . . rr_1iyu 1 400 2 OR . 1 1 64 64 LYS H H . . . 1 1 64 64 LYS HB2 H . . . . . 2.9 0.0 2.9 . . . . . A . 64 LYS H . . A . 64 LYS HB2 . . . 64 . HN . . . . . 64 . HB* . . rr_1iyu 1 401 1 . . 1 1 64 64 LYS H H . . . 1 1 67 67 ASP HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 64 LYS H . . A . 67 ASP HB3 . . . 64 . HN . . . . . 67 . HB1 . . rr_1iyu 1 402 1 . . 1 1 64 64 LYS H H . . . 1 1 67 67 ASP HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 64 LYS H . . A . 67 ASP HB2 . . . 64 . HN . . . . . 67 . HB2 . . rr_1iyu 1 403 1 . . 1 1 6 6 VAL HB H . . . 1 1 65 65 GLU HA H . . . . . 3.3 0.0 3.3 . . . . . A . 6 VAL HB . . A . 65 GLU HA . . . 6 . HB . . . . . 65 . HA . . rr_1iyu 1 404 1 . . 1 1 6 6 VAL MG1 H . . . 1 1 65 65 GLU HA H . . . . . 3.3 0.0 4.8 . . . . . A . 6 VAL MG1 . . A . 65 GLU HA . . . 6 . HG1* . . . . . 65 . HA . . rr_1iyu 1 405 1 . . 1 1 12 12 ASP HA H . . . 1 1 65 65 GLU H H . . . . . 5.0 0.0 5.0 . . . . . A . 12 ASP HA . . A . 65 GLU H . . . 12 . HA . . . . . 65 . HN . . rr_1iyu 1 406 1 . . 1 1 6 6 VAL HB H . . . 1 1 65 65 GLU H H . . . . . 5.0 0.0 5.0 . . . . . A . 6 VAL HB . . A . 65 GLU H . . . 6 . HB . . . . . 65 . HN . . rr_1iyu 1 407 1 OR . 1 1 65 65 GLU H H . . . 1 1 64 64 LYS HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 65 GLU H . . A . 64 LYS HB3 . . . 65 . HN . . . . . 64 . HB* . . rr_1iyu 1 407 2 OR . 1 1 64 64 LYS HB2 H . . . 1 1 65 65 GLU H H . . . . . 5.0 0.0 6.0 . . . . . A . 64 LYS HB2 . . A . 65 GLU H . . . 64 . HB* . . . . . 65 . HN . . rr_1iyu 1 408 1 . . 1 1 65 65 GLU HA H . . . 1 1 65 65 GLU H H . . . . . 2.7 0.0 2.7 . . . . . A . 65 GLU HA . . A . 65 GLU H . . . 65 . HA . . . . . 65 . HN . . rr_1iyu 1 409 1 OR . 1 1 65 65 GLU H H . . . 1 1 65 65 GLU HB2 H . . . . . 2.7 0.0 3.3 . . . . . A . 65 GLU H . . A . 65 GLU HB2 . . . 65 . HN . . . . . 65 . HB* . . rr_1iyu 1 409 2 OR . 1 1 65 65 GLU H H . . . 1 1 65 65 GLU HB3 H . . . . . 2.7 0.0 3.3 . . . . . A . 65 GLU H . . A . 65 GLU HB3 . . . 65 . HN . . . . . 65 . HB* . . rr_1iyu 1 410 1 OR . 1 1 65 65 GLU H H . . . 1 1 65 65 GLU HG2 H . . . . . 2.7 0.0 3.7 . . . . . A . 65 GLU H . . A . 65 GLU HG2 . . . 65 . HN . . . . . 65 . HG* . . rr_1iyu 1 410 2 OR . 1 1 65 65 GLU H H . . . 1 1 65 65 GLU HG3 H . . . . . 2.7 0.0 3.7 . . . . . A . 65 GLU H . . A . 65 GLU HG3 . . . 65 . HN . . . . . 65 . HG* . . rr_1iyu 1 411 1 OR . 1 1 65 65 GLU H H . . . 1 1 9 9 ILE HG13 H . . . . . 5.0 0.0 6.0 . . . . . A . 65 GLU H . . A . 9 ILE HG13 . . . 65 . HN . . . . . 9 . HG1* . . rr_1iyu 1 411 2 OR . 1 1 9 9 ILE HG12 H . . . 1 1 65 65 GLU H H . . . . . 5.0 0.0 6.0 . . . . . A . 9 ILE HG12 . . A . 65 GLU H . . . 9 . HG1* . . . . . 65 . HN . . rr_1iyu 1 412 1 OR . 1 1 66 66 GLY H H . . . 1 1 5 5 ARG HG2 H . . . . . 5.0 0.0 6.0 . . . . . A . 66 GLY H . . A . 5 ARG HG2 . . . 66 . HN . . . . . 5 . HG* . . rr_1iyu 1 412 2 OR . 1 1 5 5 ARG HG3 H . . . 1 1 66 66 GLY H H . . . . . 5.0 0.0 6.0 . . . . . A . 5 ARG HG3 . . A . 66 GLY H . . . 5 . HG* . . . . . 66 . HN . . rr_1iyu 1 413 1 . . 1 1 6 6 VAL HB H . . . 1 1 66 66 GLY H H . . . . . 2.7 0.0 2.7 . . . . . A . 6 VAL HB . . A . 66 GLY H . . . 6 . HB . . . . . 66 . HN . . rr_1iyu 1 414 1 . . 1 1 6 6 VAL MG1 H . . . 1 1 66 66 GLY H H . . . . . 5.0 0.0 6.5 . . . . . A . 6 VAL MG1 . . A . 66 GLY H . . . 6 . HG1* . . . . . 66 . HN . . rr_1iyu 1 415 1 . . 1 1 6 6 VAL H H . . . 1 1 66 66 GLY H H . . . . . 5.0 0.0 5.0 . . . . . A . 6 VAL H . . A . 66 GLY H . . . 6 . HN . . . . . 66 . HN . . rr_1iyu 1 416 1 . . 1 1 65 65 GLU HA H . . . 1 1 66 66 GLY H H . . . . . 2.7 0.0 2.7 . . . . . A . 65 GLU HA . . A . 66 GLY H . . . 65 . HA . . . . . 66 . HN . . rr_1iyu 1 417 1 OR . 1 1 66 66 GLY H H . . . 1 1 65 65 GLU HG2 H . . . . . 3.3 0.0 4.3 . . . . . A . 66 GLY H . . A . 65 GLU HG2 . . . 66 . HN . . . . . 65 . HG* . . rr_1iyu 1 417 2 OR . 1 1 65 65 GLU HG3 H . . . 1 1 66 66 GLY H H . . . . . 3.3 0.0 4.3 . . . . . A . 65 GLU HG3 . . A . 66 GLY H . . . 65 . HG* . . . . . 66 . HN . . rr_1iyu 1 418 1 . . 1 1 67 67 ASP H H . . . 1 1 66 66 GLY H H . . . . . 3.3 0.0 3.3 . . . . . A . 67 ASP H . . A . 66 GLY H . . . 67 . HN . . . . . 66 . HN . . rr_1iyu 1 419 1 . . 1 1 6 6 VAL HB H . . . 1 1 67 67 ASP H H . . . . . 3.3 0.0 3.3 . . . . . A . 6 VAL HB . . A . 67 ASP H . . . 6 . HB . . . . . 67 . HN . . rr_1iyu 1 420 1 . . 1 1 6 6 VAL MG2 H . . . 1 1 67 67 ASP H H . . . . . 5.0 0.0 6.5 . . . . . A . 6 VAL MG2 . . A . 67 ASP H . . . 6 . HG2* . . . . . 67 . HN . . rr_1iyu 1 421 1 . . 1 1 67 67 ASP H H . . . 1 1 65 65 GLU HA H . . . . . 5.0 0.0 5.0 . . . . . A . 67 ASP H . . A . 65 GLU HA . . . 67 . HN . . . . . 65 . HA . . rr_1iyu 1 422 1 OR . 1 1 67 67 ASP H H . . . 1 1 66 66 GLY HA2 H . . . . . 5.0 0.0 6.0 . . . . . A . 67 ASP H . . A . 66 GLY HA2 . . . 67 . HN . . . . . 66 . HA* . . rr_1iyu 1 422 2 OR . 1 1 67 67 ASP H H . . . 1 1 66 66 GLY HA3 H . . . . . 5.0 0.0 6.0 . . . . . A . 67 ASP H . . A . 66 GLY HA3 . . . 67 . HN . . . . . 66 . HA* . . rr_1iyu 1 423 1 . . 1 1 67 67 ASP H H . . . 1 1 67 67 ASP HB3 H . . . . . 5.0 0.0 5.0 . . . . . A . 67 ASP H . . A . 67 ASP HB3 . . . 67 . HN . . . . . 67 . HB1 . . rr_1iyu 1 424 1 . . 1 1 67 67 ASP H H . . . 1 1 67 67 ASP HB2 H . . . . . 2.7 0.0 2.7 . . . . . A . 67 ASP H . . A . 67 ASP HB2 . . . 67 . HN . . . . . 67 . HB2 . . rr_1iyu 1 425 1 OR . 1 1 68 68 ALA H H . . . 1 1 5 5 ARG HB2 H . . . . . 3.3 0.0 4.3 . . . . . A . 68 ALA H . . A . 5 ARG HB2 . . . 68 . HN . . . . . 5 . HB* . . rr_1iyu 1 425 2 OR . 1 1 5 5 ARG HB3 H . . . 1 1 68 68 ALA H H . . . . . 3.3 0.0 4.3 . . . . . A . 5 ARG HB3 . . A . 68 ALA H . . . 5 . HB* . . . . . 68 . HN . . rr_1iyu 1 426 1 . . 1 1 67 67 ASP HB3 H . . . 1 1 68 68 ALA H H . . . . . 3.3 0.0 3.3 . . . . . A . 67 ASP HB3 . . A . 68 ALA H . . . 67 . HB1 . . . . . 68 . HN . . rr_1iyu 1 427 1 . . 1 1 67 67 ASP HB2 H . . . 1 1 68 68 ALA H H . . . . . 5.0 0.0 5.0 . . . . . A . 67 ASP HB2 . . A . 68 ALA H . . . 67 . HB2 . . . . . 68 . HN . . rr_1iyu 1 428 1 . . 1 1 68 68 ALA HA H . . . 1 1 68 68 ALA H H . . . . . 3.3 0.0 3.3 . . . . . A . 68 ALA HA . . A . 68 ALA H . . . 68 . HA . . . . . 68 . HN . . rr_1iyu 1 429 1 . . 1 1 68 68 ALA H H . . . 1 1 68 68 ALA MB H . . . . . 2.7 0.0 3.8 . . . . . A . 68 ALA H . . A . 68 ALA MB . . . 68 . HN . . . . . 68 . HB* . . rr_1iyu 1 430 1 . . 1 1 69 69 ILE MD H . . . 1 1 68 68 ALA H H . . . . . 5.0 0.0 6.5 . . . . . A . 69 ILE MD . . A . 68 ALA H . . . 69 . HD1* . . . . . 68 . HN . . rr_1iyu 1 431 1 . . 1 1 5 5 ARG HA H . . . 1 1 69 69 ILE H H . . . . . 3.3 0.0 3.3 . . . . . A . 5 ARG HA . . A . 69 ILE H . . . 5 . HA . . . . . 69 . HN . . rr_1iyu 1 432 1 . . 1 1 68 68 ALA HA H . . . 1 1 69 69 ILE H H . . . . . 2.7 0.0 2.7 . . . . . A . 68 ALA HA . . A . 69 ILE H . . . 68 . HA . . . . . 69 . HN . . rr_1iyu 1 433 1 . . 1 1 69 69 ILE H H . . . 1 1 69 69 ILE HB H . . . . . 3.3 0.0 3.3 . . . . . A . 69 ILE H . . A . 69 ILE HB . . . 69 . HN . . . . . 69 . HB . . rr_1iyu 1 434 1 . . 1 1 70 70 ILE H H . . . 1 1 69 69 ILE H H . . . . . 3.3 0.0 3.3 . . . . . A . 70 ILE H . . A . 69 ILE H . . . 70 . HN . . . . . 69 . HN . . rr_1iyu 1 435 1 . . 1 1 70 70 ILE HA H . . . 1 1 55 55 VAL HA H . . . . . 3.3 0.0 3.3 . . . . . A . 70 ILE HA . . A . 55 VAL HA . . . 70 . HA . . . . . 55 . HA . . rr_1iyu 1 436 1 OR . 1 1 70 70 ILE HA H . . . 1 1 56 56 SER HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 70 ILE HA . . A . 56 SER HB3 . . . 70 . HA . . . . . 56 . HB* . . rr_1iyu 1 436 2 OR . 1 1 56 56 SER HB2 H . . . 1 1 70 70 ILE HA H . . . . . 5.0 0.0 6.0 . . . . . A . 56 SER HB2 . . A . 70 ILE HA . . . 56 . HB* . . . . . 70 . HA . . rr_1iyu 1 437 1 . . 1 1 70 70 ILE HB H . . . 1 1 70 70 ILE HA H . . . . . 2.7 0.0 2.7 . . . . . A . 70 ILE HB . . A . 70 ILE HA . . . 70 . HB . . . . . 70 . HA . . rr_1iyu 1 438 1 . . 1 1 4 4 ILE HB H . . . 1 1 70 70 ILE H H . . . . . 3.3 0.0 3.3 . . . . . A . 4 ILE HB . . A . 70 ILE H . . . 4 . HB . . . . . 70 . HN . . rr_1iyu 1 439 1 . . 1 1 70 70 ILE H H . . . 1 1 5 5 ARG HA H . . . . . 5.0 0.0 5.0 . . . . . A . 70 ILE H . . A . 5 ARG HA . . . 70 . HN . . . . . 5 . HA . . rr_1iyu 1 440 1 . . 1 1 70 70 ILE H H . . . 1 1 68 68 ALA HA H . . . . . 5.0 0.0 5.0 . . . . . A . 70 ILE H . . A . 68 ALA HA . . . 70 . HN . . . . . 68 . HA . . rr_1iyu 1 441 1 . . 1 1 70 70 ILE H H . . . 1 1 69 69 ILE HA H . . . . . 5.0 0.0 5.0 . . . . . A . 70 ILE H . . A . 69 ILE HA . . . 70 . HN . . . . . 69 . HA . . rr_1iyu 1 442 1 . . 1 1 70 70 ILE H H . . . 1 1 69 69 ILE HB H . . . . . 2.7 0.0 2.7 . . . . . A . 70 ILE H . . A . 69 ILE HB . . . 70 . HN . . . . . 69 . HB . . rr_1iyu 1 443 1 . . 1 1 70 70 ILE H H . . . 1 1 69 69 ILE MD H . . . . . 5.0 0.0 6.5 . . . . . A . 70 ILE H . . A . 69 ILE MD . . . 70 . HN . . . . . 69 . HD1* . . rr_1iyu 1 444 1 . . 1 1 70 70 ILE H H . . . 1 1 70 70 ILE HB H . . . . . 5.0 0.0 5.0 . . . . . A . 70 ILE H . . A . 70 ILE HB . . . 70 . HN . . . . . 70 . HB . . rr_1iyu 1 445 1 . . 1 1 3 3 ILE HA H . . . 1 1 71 71 GLU HA H . . . . . 2.7 0.0 2.7 . . . . . A . 3 ILE HA . . A . 71 GLU HA . . . 3 . HA . . . . . 71 . HA . . rr_1iyu 1 446 1 . . 1 1 54 54 SER H H . . . 1 1 71 71 GLU H H . . . . . 3.3 0.0 3.3 . . . . . A . 54 SER H . . A . 71 GLU H . . . 54 . HN . . . . . 71 . HN . . rr_1iyu 1 447 1 . . 1 1 70 70 ILE HA H . . . 1 1 71 71 GLU H H . . . . . 2.7 0.0 2.7 . . . . . A . 70 ILE HA . . A . 71 GLU H . . . 70 . HA . . . . . 71 . HN . . rr_1iyu 1 448 1 . . 1 1 70 70 ILE HB H . . . 1 1 71 71 GLU H H . . . . . 2.7 0.0 2.7 . . . . . A . 70 ILE HB . . A . 71 GLU H . . . 70 . HB . . . . . 71 . HN . . rr_1iyu 1 449 1 OR . 1 1 71 71 GLU H H . . . 1 1 71 71 GLU HB2 H . . . . . 3.3 0.0 3.9 . . . . . A . 71 GLU H . . A . 71 GLU HB2 . . . 71 . HN . . . . . 71 . HB* . . rr_1iyu 1 449 2 OR . 1 1 71 71 GLU HB3 H . . . 1 1 71 71 GLU H H . . . . . 3.3 0.0 3.9 . . . . . A . 71 GLU HB3 . . A . 71 GLU H . . . 71 . HB* . . . . . 71 . HN . . rr_1iyu 1 450 1 . . 1 1 52 52 VAL HA H . . . 1 1 72 72 LEU HA H . . . . . 3.3 0.0 3.3 . . . . . A . 52 VAL HA . . A . 72 LEU HA . . . 52 . HA . . . . . 72 . HA . . rr_1iyu 1 451 1 . . 1 1 72 72 LEU HB2 H . . . 1 1 72 72 LEU HA H . . . . . 2.7 0.0 2.7 . . . . . A . 72 LEU HB2 . . A . 72 LEU HA . . . 72 . HB2 . . . . . 72 . HA . . rr_1iyu 1 452 1 OR . 1 1 72 72 LEU HA H . . . 1 1 72 72 LEU MD1 H . . . . . 3.3 0.0 6.0 . . . . . A . 72 LEU HA . . A . 72 LEU MD1 . . . 72 . HA . . . . . 72 . HD* . . rr_1iyu 1 452 2 OR . 1 1 72 72 LEU MD2 H . . . 1 1 72 72 LEU HA H . . . . . 3.3 0.0 6.0 . . . . . A . 72 LEU MD2 . . A . 72 LEU HA . . . 72 . HD* . . . . . 72 . HA . . rr_1iyu 1 453 1 OR . 1 1 72 72 LEU H H . . . 1 1 1 1 SER HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 72 LEU H . . A . 1 SER HB3 . . . 72 . HN . . . . . 1 . HB* . . rr_1iyu 1 453 2 OR . 1 1 1 1 SER HB2 H . . . 1 1 72 72 LEU H H . . . . . 5.0 0.0 6.0 . . . . . A . 1 SER HB2 . . A . 72 LEU H . . . 1 . HB* . . . . . 72 . HN . . rr_1iyu 1 454 1 . . 1 1 2 2 GLU H H . . . 1 1 72 72 LEU H H . . . . . 5.0 0.0 5.0 . . . . . A . 2 GLU H . . A . 72 LEU H . . . 2 . HN . . . . . 72 . HN . . rr_1iyu 1 455 1 . . 1 1 3 3 ILE HA H . . . 1 1 72 72 LEU H H . . . . . 5.0 0.0 5.0 . . . . . A . 3 ILE HA . . A . 72 LEU H . . . 3 . HA . . . . . 72 . HN . . rr_1iyu 1 456 1 . . 1 1 71 71 GLU HA H . . . 1 1 72 72 LEU H H . . . . . 2.7 0.0 2.7 . . . . . A . 71 GLU HA . . A . 72 LEU H . . . 71 . HA . . . . . 72 . HN . . rr_1iyu 1 457 1 OR . 1 1 72 72 LEU H H . . . 1 1 71 71 GLU HB2 H . . . . . 5.0 0.0 6.0 . . . . . A . 72 LEU H . . A . 71 GLU HB2 . . . 72 . HN . . . . . 71 . HB* . . rr_1iyu 1 457 2 OR . 1 1 71 71 GLU HB3 H . . . 1 1 72 72 LEU H H . . . . . 5.0 0.0 6.0 . . . . . A . 71 GLU HB3 . . A . 72 LEU H . . . 71 . HB* . . . . . 72 . HN . . rr_1iyu 1 458 1 . . 1 1 72 72 LEU H H . . . 1 1 72 72 LEU HB3 H . . . . . 3.3 0.0 3.3 . . . . . A . 72 LEU H . . A . 72 LEU HB3 . . . 72 . HN . . . . . 72 . HB1 . . rr_1iyu 1 459 1 . . 1 1 72 72 LEU HB2 H . . . 1 1 72 72 LEU H H . . . . . 3.3 0.0 3.3 . . . . . A . 72 LEU HB2 . . A . 72 LEU H . . . 72 . HB2 . . . . . 72 . HN . . rr_1iyu 1 460 1 OR . 1 1 72 72 LEU H H . . . 1 1 72 72 LEU MD1 H . . . . . 5.0 0.0 8.4 . . . . . A . 72 LEU H . . A . 72 LEU MD1 . . . 72 . HN . . . . . 72 . HD* . . rr_1iyu 1 460 2 OR . 1 1 72 72 LEU MD2 H . . . 1 1 72 72 LEU H H . . . . . 5.0 0.0 8.4 . . . . . A . 72 LEU MD2 . . A . 72 LEU H . . . 72 . HD* . . . . . 72 . HN . . rr_1iyu 1 461 1 . . 1 1 1 1 SER HA H . . . 1 1 73 73 GLU HA H . . . . . 3.3 0.0 3.3 . . . . . A . 1 SER HA . . A . 73 GLU HA . . . 1 . HA . . . . . 73 . HA . . rr_1iyu 1 462 1 . . 1 1 73 73 GLU HA H . . . 1 1 1 1 SER HB3 H . . . . . 2.7 0.0 2.7 . . . . . A . 73 GLU HA . . A . 1 SER HB3 . . . 73 . HA . . . . . 1 . HB1 . . rr_1iyu 1 463 1 . . 1 1 1 1 SER HB2 H . . . 1 1 73 73 GLU HA H . . . . . 2.7 0.0 2.7 . . . . . A . 1 SER HB2 . . A . 73 GLU HA . . . 1 . HB2 . . . . . 73 . HA . . rr_1iyu 1 464 1 OR . 1 1 73 73 GLU HA H . . . 1 1 73 73 GLU HG2 H . . . . . 5.0 0.0 5.6 . . . . . A . 73 GLU HA . . A . 73 GLU HG2 . . . 73 . HA . . . . . 73 . HG* . . rr_1iyu 1 464 2 OR . 1 1 73 73 GLU HA H . . . 1 1 73 73 GLU HG3 H . . . . . 5.0 0.0 5.6 . . . . . A . 73 GLU HA . . A . 73 GLU HG3 . . . 73 . HA . . . . . 73 . HG* . . rr_1iyu 1 465 1 OR . 1 1 73 73 GLU H H . . . 1 1 1 1 SER HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 73 GLU H . . A . 1 SER HB3 . . . 73 . HN . . . . . 1 . HB* . . rr_1iyu 1 465 2 OR . 1 1 1 1 SER HB2 H . . . 1 1 73 73 GLU H H . . . . . 5.0 0.0 6.0 . . . . . A . 1 SER HB2 . . A . 73 GLU H . . . 1 . HB* . . . . . 73 . HN . . rr_1iyu 1 466 1 . . 1 1 51 51 VAL H H . . . 1 1 73 73 GLU H H . . . . . 3.3 0.0 3.3 . . . . . A . 51 VAL H . . A . 73 GLU H . . . 51 . HN . . . . . 73 . HN . . rr_1iyu 1 467 1 . . 1 1 52 52 VAL HA H . . . 1 1 73 73 GLU H H . . . . . 5.0 0.0 5.0 . . . . . A . 52 VAL HA . . A . 73 GLU H . . . 52 . HA . . . . . 73 . HN . . rr_1iyu 1 468 1 OR . 1 1 73 73 GLU H H . . . 1 1 53 53 LYS HB3 H . . . . . 5.0 0.0 6.0 . . . . . A . 73 GLU H . . A . 53 LYS HB3 . . . 73 . HN . . . . . 53 . HB* . . rr_1iyu 1 468 2 OR . 1 1 53 53 LYS HB2 H . . . 1 1 73 73 GLU H H . . . . . 5.0 0.0 6.0 . . . . . A . 53 LYS HB2 . . A . 73 GLU H . . . 53 . HB* . . . . . 73 . HN . . rr_1iyu 1 469 1 . . 1 1 72 72 LEU HA H . . . 1 1 73 73 GLU H H . . . . . 2.7 0.0 2.7 . . . . . A . 72 LEU HA . . A . 73 GLU H . . . 72 . HA . . . . . 73 . HN . . rr_1iyu 1 470 1 . . 1 1 72 72 LEU HB3 H . . . 1 1 73 73 GLU H H . . . . . 5.0 0.0 5.0 . . . . . A . 72 LEU HB3 . . A . 73 GLU H . . . 72 . HB1 . . . . . 73 . HN . . rr_1iyu 1 471 1 . . 1 1 72 72 LEU HB2 H . . . 1 1 73 73 GLU H H . . . . . 5.0 0.0 5.0 . . . . . A . 72 LEU HB2 . . A . 73 GLU H . . . 72 . HB2 . . . . . 73 . HN . . rr_1iyu 1 472 1 OR . 1 1 73 73 GLU H H . . . 1 1 72 72 LEU MD1 H . . . . . 3.3 0.0 6.7 . . . . . A . 73 GLU H . . A . 72 LEU MD1 . . . 73 . HN . . . . . 72 . HD* . . rr_1iyu 1 472 2 OR . 1 1 72 72 LEU MD2 H . . . 1 1 73 73 GLU H H . . . . . 3.3 0.0 6.7 . . . . . A . 72 LEU MD2 . . A . 73 GLU H . . . 72 . HD* . . . . . 73 . HN . . rr_1iyu 1 473 1 . . 1 1 73 73 GLU H H . . . 1 1 73 73 GLU HB3 H . . . . . 3.3 0.0 3.3 . . . . . A . 73 GLU H . . A . 73 GLU HB3 . . . 73 . HN . . . . . 73 . HB1 . . rr_1iyu 1 474 1 . . 1 1 73 73 GLU H H . . . 1 1 73 73 GLU HB2 H . . . . . 3.3 0.0 3.3 . . . . . A . 73 GLU H . . A . 73 GLU HB2 . . . 73 . HN . . . . . 73 . HB2 . . rr_1iyu 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 E2 1 1 1 4 rr_1iyu 1 2 ! 5 63 5 65 rr_1iyu 1 3 ! 8 63 8 65 rr_1iyu 1 4 I3 11 1 11 18 rr_1iyu 1 5 I4 14 1 14 18 rr_1iyu 1 6 R5 19 1 19 18 rr_1iyu 1 7 V6 28 1 28 18 rr_1iyu 1 8 P7 40 1 40 18 rr_1iyu 1 9 ! 43 63 43 65 rr_1iyu 1 10 D8 46 1 46 18 rr_1iyu 1 11 ! 50 63 50 65 rr_1iyu 1 12 I9 55 1 55 18 rr_1iyu 1 13 ! 61 64 61 66 rr_1iyu 1 14 G10 63 1 63 19 rr_1iyu 1 15 G11 68 1 68 19 rr_1iyu 1 16 ; ! D12 ; 74 65 75 19 rr_1iyu 1 17 ! 79 65 79 67 rr_1iyu 1 18 G13 81 1 81 19 rr_1iyu 1 19 E14 88 1 88 19 rr_1iyu 1 20 V15 97 1 97 19 rr_1iyu 1 21 I16 107 1 107 19 rr_1iyu 1 22 E17 112 1 112 19 rr_1iyu 1 23 ! 116 65 116 67 rr_1iyu 1 24 L18 118 1 118 19 rr_1iyu 1 25 ; ! L19 ; 126 65 127 19 rr_1iyu 1 26 ! 130 65 130 67 rr_1iyu 1 27 V20 136 1 136 19 rr_1iyu 1 28 K21 144 1 144 19 rr_1iyu 1 29 T22 150 1 150 19 rr_1iyu 1 30 G23 156 1 156 19 rr_1iyu 1 31 D24 165 1 165 19 rr_1iyu 1 32 L25 175 1 175 19 rr_1iyu 1 33 ! 180 65 180 67 rr_1iyu 1 34 I26 182 1 182 19 rr_1iyu 1 35 E27 187 1 187 19 rr_1iyu 1 36 ! 193 65 193 67 rr_1iyu 1 37 ; ! V28 ; 198 65 199 19 rr_1iyu 1 38 E29 206 1 206 19 rr_1iyu 1 39 Q30 213 1 213 19 rr_1iyu 1 40 G31 224 1 224 19 rr_1iyu 1 41 ! 229 65 229 67 rr_1iyu 1 42 L32 232 1 232 19 rr_1iyu 1 43 ! 236 65 236 67 rr_1iyu 1 44 V33 241 1 241 19 rr_1iyu 1 45 V34 250 1 250 19 rr_1iyu 1 46 L35 258 1 258 19 rr_1iyu 1 47 E36 266 1 266 19 rr_1iyu 1 48 S37 276 1 276 19 rr_1iyu 1 49 A38 284 1 284 19 rr_1iyu 1 50 K39 289 1 289 19 rr_1iyu 1 51 A40 291 1 291 19 rr_1iyu 1 52 S41 294 1 294 19 rr_1iyu 1 53 M42 301 1 301 19 rr_1iyu 1 54 E43 309 1 309 19 rr_1iyu 1 55 V44 313 1 313 19 rr_1iyu 1 56 P45 319 1 319 19 rr_1iyu 1 57 ! 322 65 322 67 rr_1iyu 1 58 S46 324 1 324 19 rr_1iyu 1 59 ! 337 65 337 67 rr_1iyu 1 60 K48 339 1 339 19 rr_1iyu 1 61 A49 347 1 347 19 rr_1iyu 1 62 G50 351 1 351 19 rr_1iyu 1 63 V51 360 1 360 19 rr_1iyu 1 64 V52 364 1 364 19 rr_1iyu 1 65 K53 372 1 372 19 rr_1iyu 1 66 S54 380 1 380 19 rr_1iyu 1 67 ! 384 65 384 67 rr_1iyu 1 68 V55 388 1 388 19 rr_1iyu 1 69 S56 393 1 393 19 rr_1iyu 1 70 ! 398 65 398 67 rr_1iyu 1 71 V57 402 1 402 19 rr_1iyu 1 72 K58 413 1 413 19 rr_1iyu 1 73 L59 422 1 422 19 rr_1iyu 1 74 G60 430 1 430 19 rr_1iyu 1 75 D61 438 1 438 19 rr_1iyu 1 76 K62 447 1 447 19 rr_1iyu 1 77 L63 452 1 452 19 rr_1iyu 1 78 K64 457 1 457 19 rr_1iyu 1 79 ! 462 65 462 67 rr_1iyu 1 80 E65 465 1 465 19 rr_1iyu 1 81 G66 475 1 475 19 rr_1iyu 1 82 D67 483 1 483 19 rr_1iyu 1 83 A68 490 1 490 19 rr_1iyu 1 84 I69 497 1 497 19 rr_1iyu 1 85 I70 502 1 502 19 rr_1iyu 1 86 E71 513 1 513 19 rr_1iyu 1 87 L72 519 1 519 19 rr_1iyu 1 88 E73 531 1 531 19 rr_1iyu 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_3 _Gen_dist_constraint_list.Entry_ID rr_1iyu _Gen_dist_constraint_list.ID 2 _Gen_dist_constraint_list.Constraint_type 'hydrogen bond' _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 3 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_1iyu 2 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 4 4 ILE N N . . . 1 1 70 70 ILE O O . . . . . 2.9 0.0 3.3 . . . . . A . 4 ILE N . . A . 70 ILE O . . . 4 . N . . . . . 70 . O . . rr_1iyu 2 2 1 . . 1 1 4 4 ILE H H . . . 1 1 70 70 ILE O O . . . . . 1.9 0.0 2.3 . . . . . A . 4 ILE H . . A . 70 ILE O . . . 4 . HN . . . . . 70 . O . . rr_1iyu 2 3 1 . . 1 1 63 63 LEU N N . . . 1 1 13 13 GLY O O . . . . . 2.9 0.0 3.3 . . . . . A . 63 LEU N . . A . 13 GLY O . . . 63 . N . . . . . 13 . O . . rr_1iyu 2 4 1 . . 1 1 63 63 LEU H H . . . 1 1 13 13 GLY O O . . . . . 1.9 0.0 2.3 . . . . . A . 63 LEU H . . A . 13 GLY O . . . 63 . HN . . . . . 13 . O . . rr_1iyu 2 5 1 . . 1 1 16 16 ILE N N . . . 1 1 34 34 VAL O O . . . . . 2.9 0.0 3.3 . . . . . A . 16 ILE N . . A . 34 VAL O . . . 16 . N . . . . . 34 . O . . rr_1iyu 2 6 1 . . 1 1 16 16 ILE H H . . . 1 1 34 34 VAL O O . . . . . 1.9 0.0 2.3 . . . . . A . 16 ILE H . . A . 34 VAL O . . . 16 . HN . . . . . 34 . O . . rr_1iyu 2 7 1 . . 1 1 46 46 SER N N . . . 1 1 30 30 GLN O O . . . . . 2.9 0.0 3.3 . . . . . A . 46 SER N . . A . 30 GLN O . . . 46 . N . . . . . 30 . O . . rr_1iyu 2 8 1 . . 1 1 46 46 SER H H . . . 1 1 30 30 GLN O O . . . . . 1.9 0.0 2.3 . . . . . A . 46 SER H . . A . 30 GLN O . . . 46 . HN . . . . . 30 . O . . rr_1iyu 2 9 1 . . 1 1 53 53 LYS N N . . . 1 1 71 71 GLU O O . . . . . 2.9 0.0 3.3 . . . . . A . 53 LYS N . . A . 71 GLU O . . . 53 . N . . . . . 71 . O . . rr_1iyu 2 10 1 . . 1 1 53 53 LYS H H . . . 1 1 71 71 GLU O O . . . . . 1.9 0.0 2.3 . . . . . A . 53 LYS H . . A . 71 GLU O . . . 53 . HN . . . . . 71 . O . . rr_1iyu 2 11 1 . . 1 1 6 6 VAL N N . . . 1 1 67 67 ASP O O . . . . . 2.9 0.0 3.3 . . . . . A . 6 VAL N . . A . 67 ASP O . . . 6 . N . . . . . 67 . O . . rr_1iyu 2 12 1 . . 1 1 6 6 VAL H H . . . 1 1 67 67 ASP O O . . . . . 1.9 0.0 2.3 . . . . . A . 6 VAL H . . A . 67 ASP O . . . 6 . HN . . . . . 67 . O . . rr_1iyu 2 13 1 . . 1 1 36 36 GLU N N . . . 1 1 14 14 GLU O O . . . . . 2.9 0.0 3.3 . . . . . A . 36 GLU N . . A . 14 GLU O . . . 36 . N . . . . . 14 . O . . rr_1iyu 2 14 1 . . 1 1 36 36 GLU H H . . . 1 1 14 14 GLU O O . . . . . 1.9 0.0 2.3 . . . . . A . 36 GLU H . . A . 14 GLU O . . . 36 . HN . . . . . 14 . O . . rr_1iyu 2 15 1 . . 1 1 15 15 VAL N N . . . 1 1 61 61 ASP O O . . . . . 2.9 0.0 3.3 . . . . . A . 15 VAL N . . A . 61 ASP O . . . 15 . N . . . . . 61 . O . . rr_1iyu 2 16 1 . . 1 1 15 15 VAL H H . . . 1 1 61 61 ASP O O . . . . . 1.9 0.0 2.3 . . . . . A . 15 VAL H . . A . 61 ASP O . . . 15 . HN . . . . . 61 . O . . rr_1iyu 2 17 1 . . 1 1 44 44 VAL N N . . . 1 1 33 33 VAL O O . . . . . 2.9 0.0 3.3 . . . . . A . 44 VAL N . . A . 33 VAL O . . . 44 . N . . . . . 33 . O . . rr_1iyu 2 18 1 . . 1 1 44 44 VAL H H . . . 1 1 33 33 VAL O O . . . . . 1.9 0.0 2.3 . . . . . A . 44 VAL H . . A . 33 VAL O . . . 44 . HN . . . . . 33 . O . . rr_1iyu 2 19 1 . . 1 1 73 73 GLU N N . . . 1 1 51 51 VAL O O . . . . . 2.9 0.0 3.3 . . . . . A . 73 GLU N . . A . 51 VAL O . . . 73 . N . . . . . 51 . O . . rr_1iyu 2 20 1 . . 1 1 73 73 GLU H H . . . 1 1 51 51 VAL O O . . . . . 1.9 0.0 2.3 . . . . . A . 73 GLU H . . A . 51 VAL O . . . 73 . HN . . . . . 51 . O . . rr_1iyu 2 21 1 . . 1 1 33 33 VAL N N . . . 1 1 44 44 VAL O O . . . . . 2.9 0.0 3.3 . . . . . A . 33 VAL N . . A . 44 VAL O . . . 33 . N . . . . . 44 . O . . rr_1iyu 2 22 1 . . 1 1 33 33 VAL H H . . . 1 1 44 44 VAL O O . . . . . 1.9 0.0 2.3 . . . . . A . 33 VAL H . . A . 44 VAL O . . . 33 . HN . . . . . 44 . O . . rr_1iyu 2 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 ; !H-BOND CONSTRAINTS !H-bond between 4 HN and 70 CO ; 1 1 4 40 rr_1iyu 2 2 '!H-bond between 63 HN and 13 CO' 8 1 8 41 rr_1iyu 2 3 '!H-bond between 16 HN and 34 CO' 12 1 12 41 rr_1iyu 2 4 '!H-bond between 46 HN and 30 CO' 16 1 16 41 rr_1iyu 2 5 '!H-bond between 53 HN and 71 CO' 20 1 20 41 rr_1iyu 2 6 '!H-bond between 6 HN and 67 CO' 24 1 24 40 rr_1iyu 2 7 '!H-bond between 36 HN and 14 CO' 28 1 28 41 rr_1iyu 2 8 '!H-bond between 15 HN and 61 CO' 32 1 32 41 rr_1iyu 2 9 '!H-bond between 44 HN and 33 CO' 36 1 36 41 rr_1iyu 2 10 '!H-bond between 73 HN and 51 CO' 40 1 40 41 rr_1iyu 2 11 '!H-bond between 33 HN and 44 CO' 44 1 44 41 rr_1iyu 2 stop_ save_ save_CNS/XPLOR_dihedral_5 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_5 _Torsion_angle_constraint_list.Entry_ID rr_1iyu _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Details 'Generated by Wattos' _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 5 loop_ _Torsion_angle_constraint_software.Software_ID _Torsion_angle_constraint_software.Software_label _Torsion_angle_constraint_software.Method_ID _Torsion_angle_constraint_software.Method_label _Torsion_angle_constraint_software.Entry_ID _Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID . . . . rr_1iyu 1 stop_ loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Atom_type_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Atom_type_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Atom_type_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Atom_type_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.PDB_record_ID_1 _Torsion_angle_constraint.PDB_model_num_1 _Torsion_angle_constraint.PDB_strand_ID_1 _Torsion_angle_constraint.PDB_ins_code_1 _Torsion_angle_constraint.PDB_residue_no_1 _Torsion_angle_constraint.PDB_residue_name_1 _Torsion_angle_constraint.PDB_atom_name_1 _Torsion_angle_constraint.PDB_record_ID_2 _Torsion_angle_constraint.PDB_model_num_2 _Torsion_angle_constraint.PDB_strand_ID_2 _Torsion_angle_constraint.PDB_ins_code_2 _Torsion_angle_constraint.PDB_residue_no_2 _Torsion_angle_constraint.PDB_residue_name_2 _Torsion_angle_constraint.PDB_atom_name_2 _Torsion_angle_constraint.PDB_record_ID_3 _Torsion_angle_constraint.PDB_model_num_3 _Torsion_angle_constraint.PDB_strand_ID_3 _Torsion_angle_constraint.PDB_ins_code_3 _Torsion_angle_constraint.PDB_residue_no_3 _Torsion_angle_constraint.PDB_residue_name_3 _Torsion_angle_constraint.PDB_atom_name_3 _Torsion_angle_constraint.PDB_record_ID_4 _Torsion_angle_constraint.PDB_model_num_4 _Torsion_angle_constraint.PDB_strand_ID_4 _Torsion_angle_constraint.PDB_ins_code_4 _Torsion_angle_constraint.PDB_residue_no_4 _Torsion_angle_constraint.PDB_residue_name_4 _Torsion_angle_constraint.PDB_atom_name_4 _Torsion_angle_constraint.Auth_entity_assembly_ID_1 _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_chain_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_alt_ID_1 _Torsion_angle_constraint.Auth_atom_name_1 _Torsion_angle_constraint.Auth_entity_assembly_ID_2 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_chain_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_alt_ID_2 _Torsion_angle_constraint.Auth_atom_name_2 _Torsion_angle_constraint.Auth_entity_assembly_ID_3 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_chain_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_alt_ID_3 _Torsion_angle_constraint.Auth_atom_name_3 _Torsion_angle_constraint.Auth_entity_assembly_ID_4 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_chain_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Auth_alt_ID_4 _Torsion_angle_constraint.Auth_atom_name_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . 1 1 2 2 GLU C C . . 1 1 3 3 ILE N N . . 1 1 3 3 ILE CA C . . 1 1 3 3 ILE C C . -160.0 -80.0 . . . A . 2 GLU C . . A . 3 ILE N . . A . 3 ILE CA . . A . 3 ILE C . . . 2 . C . . . . . 3 . N . . . . . 3 . CA . . . . . 3 . C . . rr_1iyu 1 2 . . 1 1 3 3 ILE C C . . 1 1 4 4 ILE N N . . 1 1 4 4 ILE CA C . . 1 1 4 4 ILE C C . -150.0 -90.0 . . . A . 3 ILE C . . A . 4 ILE N . . A . 4 ILE CA . . A . 4 ILE C . . . 3 . C . . . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . rr_1iyu 1 3 . . 1 1 4 4 ILE C C . . 1 1 5 5 ARG N N . . 1 1 5 5 ARG CA C . . 1 1 5 5 ARG C C . -150.0 -90.0 . . . A . 4 ILE C . . A . 5 ARG N . . A . 5 ARG CA . . A . 5 ARG C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . rr_1iyu 1 4 . . 1 1 5 5 ARG C C . . 1 1 6 6 VAL N N . . 1 1 6 6 VAL CA C . . 1 1 6 6 VAL C C . -85.0 -25.0 . . . A . 5 ARG C . . A . 6 VAL N . . A . 6 VAL CA . . A . 6 VAL C . . . 5 . C . . . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . rr_1iyu 1 5 . . 1 1 7 7 PRO C C . . 1 1 8 8 ASP N N . . 1 1 8 8 ASP CA C . . 1 1 8 8 ASP C C . -85.0 -25.0 . . . A . 7 PRO C . . A . 8 ASP N . . A . 8 ASP CA . . A . 8 ASP C . . . 7 . C . . . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . rr_1iyu 1 6 . . 1 1 8 8 ASP C C . . 1 1 9 9 ILE N N . . 1 1 9 9 ILE CA C . . 1 1 9 9 ILE C C . -150.0 -90.0 . . . A . 8 ASP C . . A . 9 ILE N . . A . 9 ILE CA . . A . 9 ILE C . . . 8 . C . . . . . 9 . N . . . . . 9 . CA . . . . . 9 . C . . rr_1iyu 1 7 . . 1 1 13 13 GLY C C . . 1 1 14 14 GLU N N . . 1 1 14 14 GLU CA C . . 1 1 14 14 GLU C C . -160.0 -80.0 . . . A . 13 GLY C . . A . 14 GLU N . . A . 14 GLU CA . . A . 14 GLU C . . . 13 . C . . . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . rr_1iyu 1 8 . . 1 1 14 14 GLU C C . . 1 1 15 15 VAL N N . . 1 1 15 15 VAL CA C . . 1 1 15 15 VAL C C . -85.0 -25.0 . . . A . 14 GLU C . . A . 15 VAL N . . A . 15 VAL CA . . A . 15 VAL C . . . 14 . C . . . . . 15 . N . . . . . 15 . CA . . . . . 15 . C . . rr_1iyu 1 9 . . 1 1 15 15 VAL C C . . 1 1 16 16 ILE N N . . 1 1 16 16 ILE CA C . . 1 1 16 16 ILE C C . -150.0 -90.0 . . . A . 15 VAL C . . A . 16 ILE N . . A . 16 ILE CA . . A . 16 ILE C . . . 15 . C . . . . . 16 . N . . . . . 16 . CA . . . . . 16 . C . . rr_1iyu 1 10 . . 1 1 17 17 GLU C C . . 1 1 18 18 LEU N N . . 1 1 18 18 LEU CA C . . 1 1 18 18 LEU C C . -160.0 -80.0 . . . A . 17 GLU C . . A . 18 LEU N . . A . 18 LEU CA . . A . 18 LEU C . . . 17 . C . . . . . 18 . N . . . . . 18 . CA . . . . . 18 . C . . rr_1iyu 1 11 . . 1 1 18 18 LEU C C . . 1 1 19 19 LEU N N . . 1 1 19 19 LEU CA C . . 1 1 19 19 LEU C C . -160.0 -80.0 . . . A . 18 LEU C . . A . 19 LEU N . . A . 19 LEU CA . . A . 19 LEU C . . . 18 . C . . . . . 19 . N . . . . . 19 . CA . . . . . 19 . C . . rr_1iyu 1 12 . . 1 1 19 19 LEU C C . . 1 1 20 20 VAL N N . . 1 1 20 20 VAL CA C . . 1 1 20 20 VAL C C . -150.0 -90.0 . . . A . 19 LEU C . . A . 20 VAL N . . A . 20 VAL CA . . A . 20 VAL C . . . 19 . C . . . . . 20 . N . . . . . 20 . CA . . . . . 20 . C . . rr_1iyu 1 13 . . 1 1 20 20 VAL C C . . 1 1 21 21 LYS N N . . 1 1 21 21 LYS CA C . . 1 1 21 21 LYS C C . -150.0 -90.0 . . . A . 20 VAL C . . A . 21 LYS N . . A . 21 LYS CA . . A . 21 LYS C . . . 20 . C . . . . . 21 . N . . . . . 21 . CA . . . . . 21 . C . . rr_1iyu 1 14 . . 1 1 21 21 LYS C C . . 1 1 22 22 THR N N . . 1 1 22 22 THR CA C . . 1 1 22 22 THR C C . -85.0 -25.0 . . . A . 21 LYS C . . A . 22 THR N . . A . 22 THR CA . . A . 22 THR C . . . 21 . C . . . . . 22 . N . . . . . 22 . CA . . . . . 22 . C . . rr_1iyu 1 15 . . 1 1 23 23 GLY C C . . 1 1 24 24 ASP N N . . 1 1 24 24 ASP CA C . . 1 1 24 24 ASP C C . -85.0 -25.0 . . . A . 23 GLY C . . A . 24 ASP N . . A . 24 ASP CA . . A . 24 ASP C . . . 23 . C . . . . . 24 . N . . . . . 24 . CA . . . . . 24 . C . . rr_1iyu 1 16 . . 1 1 24 24 ASP C C . . 1 1 25 25 LEU N N . . 1 1 25 25 LEU CA C . . 1 1 25 25 LEU C C . -160.0 -80.0 . . . A . 24 ASP C . . A . 25 LEU N . . A . 25 LEU CA . . A . 25 LEU C . . . 24 . C . . . . . 25 . N . . . . . 25 . CA . . . . . 25 . C . . rr_1iyu 1 17 . . 1 1 25 25 LEU C C . . 1 1 26 26 ILE N N . . 1 1 26 26 ILE CA C . . 1 1 26 26 ILE C C . -150.0 -90.0 . . . A . 25 LEU C . . A . 26 ILE N . . A . 26 ILE CA . . A . 26 ILE C . . . 25 . C . . . . . 26 . N . . . . . 26 . CA . . . . . 26 . C . . rr_1iyu 1 18 . . 1 1 26 26 ILE C C . . 1 1 27 27 GLU N N . . 1 1 27 27 GLU CA C . . 1 1 27 27 GLU C C . -150.0 -90.0 . . . A . 26 ILE C . . A . 27 GLU N . . A . 27 GLU CA . . A . 27 GLU C . . . 26 . C . . . . . 27 . N . . . . . 27 . CA . . . . . 27 . C . . rr_1iyu 1 19 . . 1 1 27 27 GLU C C . . 1 1 28 28 VAL N N . . 1 1 28 28 VAL CA C . . 1 1 28 28 VAL C C . -85.0 -25.0 . . . A . 27 GLU C . . A . 28 VAL N . . A . 28 VAL CA . . A . 28 VAL C . . . 27 . C . . . . . 28 . N . . . . . 28 . CA . . . . . 28 . C . . rr_1iyu 1 20 . . 1 1 29 29 GLU C C . . 1 1 30 30 GLN N N . . 1 1 30 30 GLN CA C . . 1 1 30 30 GLN C C . -85.0 -25.0 . . . A . 29 GLU C . . A . 30 GLN N . . A . 30 GLN CA . . A . 30 GLN C . . . 29 . C . . . . . 30 . N . . . . . 30 . CA . . . . . 30 . C . . rr_1iyu 1 21 . . 1 1 31 31 GLY C C . . 1 1 32 32 LEU N N . . 1 1 32 32 LEU CA C . . 1 1 32 32 LEU C C . -160.0 -80.0 . . . A . 31 GLY C . . A . 32 LEU N . . A . 32 LEU CA . . A . 32 LEU C . . . 31 . C . . . . . 32 . N . . . . . 32 . CA . . . . . 32 . C . . rr_1iyu 1 22 . . 1 1 33 33 VAL C C . . 1 1 34 34 VAL N N . . 1 1 34 34 VAL CA C . . 1 1 34 34 VAL C C . -150.0 -90.0 . . . A . 33 VAL C . . A . 34 VAL N . . A . 34 VAL CA . . A . 34 VAL C . . . 33 . C . . . . . 34 . N . . . . . 34 . CA . . . . . 34 . C . . rr_1iyu 1 23 . . 1 1 34 34 VAL C C . . 1 1 35 35 LEU N N . . 1 1 35 35 LEU CA C . . 1 1 35 35 LEU C C . -150.0 -90.0 . . . A . 34 VAL C . . A . 35 LEU N . . A . 35 LEU CA . . A . 35 LEU C . . . 34 . C . . . . . 35 . N . . . . . 35 . CA . . . . . 35 . C . . rr_1iyu 1 24 . . 1 1 35 35 LEU C C . . 1 1 36 36 GLU N N . . 1 1 36 36 GLU CA C . . 1 1 36 36 GLU C C . -150.0 -90.0 . . . A . 35 LEU C . . A . 36 GLU N . . A . 36 GLU CA . . A . 36 GLU C . . . 35 . C . . . . . 36 . N . . . . . 36 . CA . . . . . 36 . C . . rr_1iyu 1 25 . . 1 1 36 36 GLU C C . . 1 1 37 37 SER N N . . 1 1 37 37 SER CA C . . 1 1 37 37 SER C C . -160.0 -80.0 . . . A . 36 GLU C . . A . 37 SER N . . A . 37 SER CA . . A . 37 SER C . . . 36 . C . . . . . 37 . N . . . . . 37 . CA . . . . . 37 . C . . rr_1iyu 1 26 . . 1 1 37 37 SER C C . . 1 1 38 38 ALA N N . . 1 1 38 38 ALA CA C . . 1 1 38 38 ALA C C . -85.0 -25.0 . . . A . 37 SER C . . A . 38 ALA N . . A . 38 ALA CA . . A . 38 ALA C . . . 37 . C . . . . . 38 . N . . . . . 38 . CA . . . . . 38 . C . . rr_1iyu 1 27 . . 1 1 38 38 ALA C C . . 1 1 39 39 LYS N N . . 1 1 39 39 LYS CA C . . 1 1 39 39 LYS C C . -160.0 -80.0 . . . A . 38 ALA C . . A . 39 LYS N . . A . 39 LYS CA . . A . 39 LYS C . . . 38 . C . . . . . 39 . N . . . . . 39 . CA . . . . . 39 . C . . rr_1iyu 1 28 . . 1 1 40 40 ALA C C . . 1 1 41 41 SER N N . . 1 1 41 41 SER CA C . . 1 1 41 41 SER C C . -160.0 -80.0 . . . A . 40 ALA C . . A . 41 SER N . . A . 41 SER CA . . A . 41 SER C . . . 40 . C . . . . . 41 . N . . . . . 41 . CA . . . . . 41 . C . . rr_1iyu 1 29 . . 1 1 41 41 SER C C . . 1 1 42 42 MET N N . . 1 1 42 42 MET CA C . . 1 1 42 42 MET C C . -160.0 -80.0 . . . A . 41 SER C . . A . 42 MET N . . A . 42 MET CA . . A . 42 MET C . . . 41 . C . . . . . 42 . N . . . . . 42 . CA . . . . . 42 . C . . rr_1iyu 1 30 . . 1 1 42 42 MET C C . . 1 1 43 43 GLU N N . . 1 1 43 43 GLU CA C . . 1 1 43 43 GLU C C . -160.0 -80.0 . . . A . 42 MET C . . A . 43 GLU N . . A . 43 GLU CA . . A . 43 GLU C . . . 42 . C . . . . . 43 . N . . . . . 43 . CA . . . . . 43 . C . . rr_1iyu 1 31 . . 1 1 43 43 GLU C C . . 1 1 44 44 VAL N N . . 1 1 44 44 VAL CA C . . 1 1 44 44 VAL C C . -160.0 -80.0 . . . A . 43 GLU C . . A . 44 VAL N . . A . 44 VAL CA . . A . 44 VAL C . . . 43 . C . . . . . 44 . N . . . . . 44 . CA . . . . . 44 . C . . rr_1iyu 1 32 . . 1 1 45 45 PRO C C . . 1 1 46 46 SER N N . . 1 1 46 46 SER CA C . . 1 1 46 46 SER C C . -85.0 -25.0 . . . A . 45 PRO C . . A . 46 SER N . . A . 46 SER CA . . A . 46 SER C . . . 45 . C . . . . . 46 . N . . . . . 46 . CA . . . . . 46 . C . . rr_1iyu 1 33 . . 1 1 47 47 PRO C C . . 1 1 48 48 LYS N N . . 1 1 48 48 LYS CA C . . 1 1 48 48 LYS C C . -160.0 -80.0 . . . A . 47 PRO C . . A . 48 LYS N . . A . 48 LYS CA . . A . 48 LYS C . . . 47 . C . . . . . 48 . N . . . . . 48 . CA . . . . . 48 . C . . rr_1iyu 1 34 . . 1 1 48 48 LYS C C . . 1 1 49 49 ALA N N . . 1 1 49 49 ALA CA C . . 1 1 49 49 ALA C C . -85.0 -25.0 . . . A . 48 LYS C . . A . 49 ALA N . . A . 49 ALA CA . . A . 49 ALA C . . . 48 . C . . . . . 49 . N . . . . . 49 . CA . . . . . 49 . C . . rr_1iyu 1 35 . . 1 1 50 50 GLY C C . . 1 1 51 51 VAL N N . . 1 1 51 51 VAL CA C . . 1 1 51 51 VAL C C . -150.0 -90.0 . . . A . 50 GLY C . . A . 51 VAL N . . A . 51 VAL CA . . A . 51 VAL C . . . 50 . C . . . . . 51 . N . . . . . 51 . CA . . . . . 51 . C . . rr_1iyu 1 36 . . 1 1 51 51 VAL C C . . 1 1 52 52 VAL N N . . 1 1 52 52 VAL CA C . . 1 1 52 52 VAL C C . -85.0 -25.0 . . . A . 51 VAL C . . A . 52 VAL N . . A . 52 VAL CA . . A . 52 VAL C . . . 51 . C . . . . . 52 . N . . . . . 52 . CA . . . . . 52 . C . . rr_1iyu 1 37 . . 1 1 52 52 VAL C C . . 1 1 53 53 LYS N N . . 1 1 53 53 LYS CA C . . 1 1 53 53 LYS C C . -160.0 -80.0 . . . A . 52 VAL C . . A . 53 LYS N . . A . 53 LYS CA . . A . 53 LYS C . . . 52 . C . . . . . 53 . N . . . . . 53 . CA . . . . . 53 . C . . rr_1iyu 1 38 . . 1 1 54 54 SER C C . . 1 1 55 55 VAL N N . . 1 1 55 55 VAL CA C . . 1 1 55 55 VAL C C . -160.0 -80.0 . . . A . 54 SER C . . A . 55 VAL N . . A . 55 VAL CA . . A . 55 VAL C . . . 54 . C . . . . . 55 . N . . . . . 55 . CA . . . . . 55 . C . . rr_1iyu 1 39 . . 1 1 56 56 SER C C . . 1 1 57 57 VAL N N . . 1 1 57 57 VAL CA C . . 1 1 57 57 VAL C C . -150.0 -90.0 . . . A . 56 SER C . . A . 57 VAL N . . A . 57 VAL CA . . A . 57 VAL C . . . 56 . C . . . . . 57 . N . . . . . 57 . CA . . . . . 57 . C . . rr_1iyu 1 40 . . 1 1 57 57 VAL C C . . 1 1 58 58 LYS N N . . 1 1 58 58 LYS CA C . . 1 1 58 58 LYS C C . -150.0 -90.0 . . . A . 57 VAL C . . A . 58 LYS N . . A . 58 LYS CA . . A . 58 LYS C . . . 57 . C . . . . . 58 . N . . . . . 58 . CA . . . . . 58 . C . . rr_1iyu 1 41 . . 1 1 58 58 LYS C C . . 1 1 59 59 LEU N N . . 1 1 59 59 LEU CA C . . 1 1 59 59 LEU C C . -85.0 -25.0 . . . A . 58 LYS C . . A . 59 LEU N . . A . 59 LEU CA . . A . 59 LEU C . . . 58 . C . . . . . 59 . N . . . . . 59 . CA . . . . . 59 . C . . rr_1iyu 1 42 . . 1 1 60 60 GLY C C . . 1 1 61 61 ASP N N . . 1 1 61 61 ASP CA C . . 1 1 61 61 ASP C C . -85.0 -25.0 . . . A . 60 GLY C . . A . 61 ASP N . . A . 61 ASP CA . . A . 61 ASP C . . . 60 . C . . . . . 61 . N . . . . . 61 . CA . . . . . 61 . C . . rr_1iyu 1 43 . . 1 1 61 61 ASP C C . . 1 1 62 62 LYS N N . . 1 1 62 62 LYS CA C . . 1 1 62 62 LYS C C . -160.0 -80.0 . . . A . 61 ASP C . . A . 62 LYS N . . A . 62 LYS CA . . A . 62 LYS C . . . 61 . C . . . . . 62 . N . . . . . 62 . CA . . . . . 62 . C . . rr_1iyu 1 44 . . 1 1 62 62 LYS C C . . 1 1 63 63 LEU N N . . 1 1 63 63 LEU CA C . . 1 1 63 63 LEU C C . -150.0 -90.0 . . . A . 62 LYS C . . A . 63 LEU N . . A . 63 LEU CA . . A . 63 LEU C . . . 62 . C . . . . . 63 . N . . . . . 63 . CA . . . . . 63 . C . . rr_1iyu 1 45 . . 1 1 63 63 LEU C C . . 1 1 64 64 LYS N N . . 1 1 64 64 LYS CA C . . 1 1 64 64 LYS C C . -160.0 -80.0 . . . A . 63 LEU C . . A . 64 LYS N . . A . 64 LYS CA . . A . 64 LYS C . . . 63 . C . . . . . 64 . N . . . . . 64 . CA . . . . . 64 . C . . rr_1iyu 1 46 . . 1 1 64 64 LYS C C . . 1 1 65 65 GLU N N . . 1 1 65 65 GLU CA C . . 1 1 65 65 GLU C C . -85.0 -25.0 . . . A . 64 LYS C . . A . 65 GLU N . . A . 65 GLU CA . . A . 65 GLU C . . . 64 . C . . . . . 65 . N . . . . . 65 . CA . . . . . 65 . C . . rr_1iyu 1 47 . . 1 1 66 66 GLY C C . . 1 1 67 67 ASP N N . . 1 1 67 67 ASP CA C . . 1 1 67 67 ASP C C . -85.0 -25.0 . . . A . 66 GLY C . . A . 67 ASP N . . A . 67 ASP CA . . A . 67 ASP C . . . 66 . C . . . . . 67 . N . . . . . 67 . CA . . . . . 67 . C . . rr_1iyu 1 48 . . 1 1 67 67 ASP C C . . 1 1 68 68 ALA N N . . 1 1 68 68 ALA CA C . . 1 1 68 68 ALA C C . -85.0 -25.0 . . . A . 67 ASP C . . A . 68 ALA N . . A . 68 ALA CA . . A . 68 ALA C . . . 67 . C . . . . . 68 . N . . . . . 68 . CA . . . . . 68 . C . . rr_1iyu 1 49 . . 1 1 68 68 ALA C C . . 1 1 69 69 ILE N N . . 1 1 69 69 ILE CA C . . 1 1 69 69 ILE C C . -150.0 -90.0 . . . A . 68 ALA C . . A . 69 ILE N . . A . 69 ILE CA . . A . 69 ILE C . . . 68 . C . . . . . 69 . N . . . . . 69 . CA . . . . . 69 . C . . rr_1iyu 1 50 . . 1 1 69 69 ILE C C . . 1 1 70 70 ILE N N . . 1 1 70 70 ILE CA C . . 1 1 70 70 ILE C C . -160.0 -80.0 . . . A . 69 ILE C . . A . 70 ILE N . . A . 70 ILE CA . . A . 70 ILE C . . . 69 . C . . . . . 70 . N . . . . . 70 . CA . . . . . 70 . C . . rr_1iyu 1 51 . . 1 1 70 70 ILE C C . . 1 1 71 71 GLU N N . . 1 1 71 71 GLU CA C . . 1 1 71 71 GLU C C . -150.0 -90.0 . . . A . 70 ILE C . . A . 71 GLU N . . A . 71 GLU CA . . A . 71 GLU C . . . 70 . C . . . . . 71 . N . . . . . 71 . CA . . . . . 71 . C . . rr_1iyu 1 52 . . 1 1 71 71 GLU C C . . 1 1 72 72 LEU N N . . 1 1 72 72 LEU CA C . . 1 1 72 72 LEU C C . -150.0 -90.0 . . . A . 71 GLU C . . A . 72 LEU N . . A . 72 LEU CA . . A . 72 LEU C . . . 71 . C . . . . . 72 . N . . . . . 72 . CA . . . . . 72 . C . . rr_1iyu 1 53 . . 1 1 72 72 LEU C C . . 1 1 73 73 GLU N N . . 1 1 73 73 GLU CA C . . 1 1 73 73 GLU C C . -150.0 -90.0 . . . A . 72 LEU C . . A . 73 GLU N . . A . 73 GLU CA . . A . 73 GLU C . . . 72 . C . . . . . 73 . N . . . . . 73 . CA . . . . . 73 . C . . rr_1iyu 1 54 . . 1 1 24 24 ASP N N . . 1 1 24 24 ASP CA C . . 1 1 24 24 ASP CB C . . 1 1 24 24 ASP CG C . -90.0 -30.0 . . . A . 24 ASP N . . A . 24 ASP CA . . A . 24 ASP CB . . A . 24 ASP CG . . . 24 . N . . . . . 24 . CA . . . . . 24 . CB . . . . . 24 . CG . . rr_1iyu 1 55 . . 1 1 35 35 LEU N N . . 1 1 35 35 LEU CA C . . 1 1 35 35 LEU CB C . . 1 1 35 35 LEU CG C . -90.0 -30.0 . . . A . 35 LEU N . . A . 35 LEU CA . . A . 35 LEU CB . . A . 35 LEU CG . . . 35 . N . . . . . 35 . CA . . . . . 35 . CB . . . . . 35 . CG . . rr_1iyu 1 56 . . 1 1 61 61 ASP N N . . 1 1 61 61 ASP CA C . . 1 1 61 61 ASP CB C . . 1 1 61 61 ASP CG C . -90.0 -30.0 . . . A . 61 ASP N . . A . 61 ASP CA . . A . 61 ASP CB . . A . 61 ASP CG . . . 61 . N . . . . . 61 . CA . . . . . 61 . CB . . . . . 61 . CG . . rr_1iyu 1 57 . . 1 1 67 67 ASP N N . . 1 1 67 67 ASP CA C . . 1 1 67 67 ASP CB C . . 1 1 67 67 ASP CG C . -90.0 -30.0 . . . A . 67 ASP N . . A . 67 ASP CA . . A . 67 ASP CB . . A . 67 ASP CG . . . 67 . N . . . . . 67 . CA . . . . . 67 . CB . . . . . 67 . CG . . rr_1iyu 1 58 . . 1 1 72 72 LEU N N . . 1 1 72 72 LEU CA C . . 1 1 72 72 LEU CB C . . 1 1 72 72 LEU CG C . 150.0 210.0 . . . A . 72 LEU N . . A . 72 LEU CA . . A . 72 LEU CB . . A . 72 LEU CG . . . 72 . N . . . . . 72 . CA . . . . . 72 . CB . . . . . 72 . CG . . rr_1iyu 1 59 . . 1 1 6 6 VAL N N . . 1 1 6 6 VAL CA C . . 1 1 6 6 VAL CB C . . 1 1 6 6 VAL CG1 C . 150.0 210.0 . . . A . 6 VAL N . . A . 6 VAL CA . . A . 6 VAL CB . . A . 6 VAL CG1 . . . 6 . N . . . . . 6 . CA . . . . . 6 . CB . . . . . 6 . CG1 . . rr_1iyu 1 60 . . 1 1 15 15 VAL N N . . 1 1 15 15 VAL CA C . . 1 1 15 15 VAL CB C . . 1 1 15 15 VAL CG1 C . 150.0 210.0 . . . A . 15 VAL N . . A . 15 VAL CA . . A . 15 VAL CB . . A . 15 VAL CG1 . . . 15 . N . . . . . 15 . CA . . . . . 15 . CB . . . . . 15 . CG1 . . rr_1iyu 1 61 . . 1 1 20 20 VAL N N . . 1 1 20 20 VAL CA C . . 1 1 20 20 VAL CB C . . 1 1 20 20 VAL CG1 C . -90.0 -30.0 . . . A . 20 VAL N . . A . 20 VAL CA . . A . 20 VAL CB . . A . 20 VAL CG1 . . . 20 . N . . . . . 20 . CA . . . . . 20 . CB . . . . . 20 . CG1 . . rr_1iyu 1 62 . . 1 1 33 33 VAL N N . . 1 1 33 33 VAL CA C . . 1 1 33 33 VAL CB C . . 1 1 33 33 VAL CG1 C . -90.0 -30.0 . . . A . 33 VAL N . . A . 33 VAL CA . . A . 33 VAL CB . . A . 33 VAL CG1 . . . 33 . N . . . . . 33 . CA . . . . . 33 . CB . . . . . 33 . CG1 . . rr_1iyu 1 63 . . 1 1 51 51 VAL N N . . 1 1 51 51 VAL CA C . . 1 1 51 51 VAL CB C . . 1 1 51 51 VAL CG1 C . 30.0 90.0 . . . A . 51 VAL N . . A . 51 VAL CA . . A . 51 VAL CB . . A . 51 VAL CG1 . . . 51 . N . . . . . 51 . CA . . . . . 51 . CB . . . . . 51 . CG1 . . rr_1iyu 1 64 . . 1 1 52 52 VAL N N . . 1 1 52 52 VAL CA C . . 1 1 52 52 VAL CB C . . 1 1 52 52 VAL CG1 C . 150.0 210.0 . . . A . 52 VAL N . . A . 52 VAL CA . . A . 52 VAL CB . . A . 52 VAL CG1 . . . 52 . N . . . . . 52 . CA . . . . . 52 . CB . . . . . 52 . CG1 . . rr_1iyu 1 65 . . 1 1 55 55 VAL N N . . 1 1 55 55 VAL CA C . . 1 1 55 55 VAL CB C . . 1 1 55 55 VAL CG1 C . 150.0 210.0 . . . A . 55 VAL N . . A . 55 VAL CA . . A . 55 VAL CB . . A . 55 VAL CG1 . . . 55 . N . . . . . 55 . CA . . . . . 55 . CB . . . . . 55 . CG1 . . rr_1iyu 1 66 . . 1 1 57 57 VAL N N . . 1 1 57 57 VAL CA C . . 1 1 57 57 VAL CB C . . 1 1 57 57 VAL CG1 C . -90.0 -30.0 . . . A . 57 VAL N . . A . 57 VAL CA . . A . 57 VAL CB . . A . 57 VAL CG1 . . . 57 . N . . . . . 57 . CA . . . . . 57 . CB . . . . . 57 . CG1 . . rr_1iyu 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 ; ! Phi constraints AND Chi constraints ! Phi restraints: minimum deviation = 30 degrees ! 3J values from HMQC-J experiment, after fitting and/or spectral simulations ! for 3J values > 9 Hz, phi = -120 +- 30 ! for 3J values > 8 Hz, phi = -120 +- 40 ! for 3J values < 6 Hz, phi = -55 +- 30 ! ILE3 ; 1 1 9 11 rr_1iyu 1 2 '! ILE4' 12 1 12 12 rr_1iyu 1 3 '! ARG5' 15 1 15 11 rr_1iyu 1 4 '! VAL6' 18 1 18 12 rr_1iyu 1 5 '! ASP8' 21 1 21 11 rr_1iyu 1 6 '! ILE9' 24 1 24 12 rr_1iyu 1 7 '! GLU14' 27 1 27 12 rr_1iyu 1 8 '! VAL15' 30 1 30 12 rr_1iyu 1 9 '! ILE16' 33 1 33 12 rr_1iyu 1 10 '! LEU18' 36 1 36 13 rr_1iyu 1 11 '! LEU19' 39 1 39 12 rr_1iyu 1 12 '! VAL20' 42 1 42 12 rr_1iyu 1 13 '! LYS21' 45 1 45 13 rr_1iyu 1 14 '! THR22' 48 1 48 12 rr_1iyu 1 15 '! ASP24' 51 1 51 12 rr_1iyu 1 16 '! LEU25' 54 1 54 12 rr_1iyu 1 17 '! ILE26' 57 1 57 12 rr_1iyu 1 18 '! GLU27' 60 1 60 12 rr_1iyu 1 19 '! VAL28' 63 1 63 12 rr_1iyu 1 20 '! GLN30' 66 1 66 12 rr_1iyu 1 21 '! LEU32' 69 1 69 12 rr_1iyu 1 22 '! VAL34' 72 1 72 13 rr_1iyu 1 23 '! LEU35' 75 1 75 12 rr_1iyu 1 24 '! GLU36' 78 1 78 12 rr_1iyu 1 25 '! SER37' 81 1 81 13 rr_1iyu 1 26 '! ALA38, from COSY, in HMQC-J too weak' 84 1 84 43 rr_1iyu 1 27 '! LYS39' 87 1 87 13 rr_1iyu 1 28 '! SER41' 90 1 90 13 rr_1iyu 1 29 '! MET42' 93 1 93 12 rr_1iyu 1 30 '! GLU43' 96 1 96 13 rr_1iyu 1 31 '! VAL44' 99 1 99 12 rr_1iyu 1 32 '! SER46' 102 1 102 13 rr_1iyu 1 33 '! LYS48' 105 1 105 13 rr_1iyu 1 34 '! ALA49' 108 1 108 12 rr_1iyu 1 35 '! VAL51' 111 1 111 13 rr_1iyu 1 36 '! VAL52' 114 1 114 12 rr_1iyu 1 37 '! LYS53' 117 1 117 12 rr_1iyu 1 38 '! VAL55' 120 1 120 12 rr_1iyu 1 39 '! VAL57' 123 1 123 12 rr_1iyu 1 40 '! LYS58' 126 1 126 13 rr_1iyu 1 41 '! LEU59' 129 1 129 12 rr_1iyu 1 42 '! ASP61' 132 1 132 12 rr_1iyu 1 43 '! LYS62' 135 1 135 13 rr_1iyu 1 44 '! LEU63' 138 1 138 12 rr_1iyu 1 45 '! LYS64' 141 1 141 12 rr_1iyu 1 46 '! GLU65' 144 1 144 13 rr_1iyu 1 47 '! ASP67' 147 1 147 13 rr_1iyu 1 48 '! ALA68' 150 1 150 12 rr_1iyu 1 49 '! ILE69' 153 1 153 12 rr_1iyu 1 50 '! ILE70' 156 1 156 12 rr_1iyu 1 51 '! GLU71' 159 1 159 12 rr_1iyu 1 52 '! LEU72' 162 1 162 13 rr_1iyu 1 53 '! GLU73' 165 1 165 12 rr_1iyu 1 54 ; ! Chi constraints: minimum deviation = 30 degrees ! beta-methylene protons ! D24, t2g3 ; 170 1 174 16 rr_1iyu 1 55 '! L35, t2g3' 177 1 177 17 rr_1iyu 1 56 '! D61, t2g3' 180 1 180 16 rr_1iyu 1 57 '! D67, t2g3' 183 1 183 16 rr_1iyu 1 58 '! L72, g2t3' 186 1 186 16 rr_1iyu 1 59 ; ! Valines ! V6, g+ ; 191 1 193 13 rr_1iyu 1 60 '! V15, g+' 196 1 196 13 rr_1iyu 1 61 '! V20, g-' 199 1 199 14 rr_1iyu 1 62 '! V33, g-' 202 1 202 14 rr_1iyu 1 63 '! V51, t' 205 1 205 13 rr_1iyu 1 64 '! V52, g+' 208 1 208 14 rr_1iyu 1 65 '! V55, g+' 211 1 211 14 rr_1iyu 1 66 '! V57, g-' 214 1 214 14 rr_1iyu 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_1iyu _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 ACYLTRANSFERASE 25-SEP-96 1IYU *TITLE LIPOYL DOMAIN OF PYRUVATE DEHYDROGENASE COMPLEX, NMR, *TITLE 2 MINIMIZED AVERAGE STRUCTURE *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: DIHYDROLIPOAMIDE ACETYLTRANSFERASE COMPONENT OF *COMPND 3 PYRUVATE DEHYDROGENASE COMPLEX; *COMPND 4 CHAIN: NULL; *COMPND 5 FRAGMENT: LIPOYL DOMAIN, RESIDUES 1 - 79; *COMPND 6 SYNONYM: E2P; *COMPND 7 EC: 2.3.1.12 *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: AZOTOBACTER VINELANDII *KEYWDS GLYCOLYSIS, TRANSFERASE, ACYLTRANSFERASE, LIPOYL *EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE *AUTHOR A.BERG,J.VERVOORT,A.DE KOK *REVDAT 1 12-MAR-97 1IYU 0 This file contains the experimental data (NOE distance constraints, hydrogen bond distance constraints, and dihedral angle constraints) for the determination of the three-dimensional solution structure of the N-terminal lipoyl domain of the dihydrolipoamide acetyltransferase component of the pyruvate dehydrogenase complex from Azotobacter vinelandii. The method used to determine the solution structures of the lipoyl domain is the ab initio dynamical simulated annealing calculation strategy of Nilges et al. (1991)In: Computational aspects of the study of biological macromolecules by nuclear magnetic resonance spectroscopy (Hoch, J.C., et al. eds.) pp 451-455, Plenum Press, New York. X-PLOR version 3.1 was used for the structure calculation. NOEs are grouped into strong, medium and weak categories, corresponding to upper-bound interproton distance constraints of 2.7, 3.3, and 5.0 A, respectively. An additional 0.5 A is added to the upper limits for distances involving methyl groups. In all cases, the lower-bound distance constraint is set to 0.0 A. NOEs which partially overlapped in the spectra were conservatively assigned an upper bound constraint of 5.0 A if their intensity grouping was ambiguous. The standard pseudoatom corrections (Wuthrich et al., 1983) are applied to methyl groups, degenerate diastereotopic hydrogen atoms, and diastereotopic hydrogen groups for which only one NOE was observed. For stereospecifically unassigned diastereotopic substituents for which NOEs to both hydrogens were observed, the DIANA treatment of diastereotopic hydrogens is used. In cases where both NOEs had an equal upper distance limit, no pseudoatom correction is applied. In cases where both NOEs have different upper distance limits, the upper distance limit of both NOEs is set equal to the higher limit of the two, and an extra 'DIANA' pseudoatom distance constraint is calculated and added to the constraint list, indicated by '!!' in the constraint list. !!NOE distance constraints ; save_ save_MR_file_comment_6 _Org_constr_file_comment.Sf_framecode MR_file_comment_6 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID rr_1iyu _Org_constr_file_comment.ID 3 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 6 _Org_constr_file_comment.Details 'Generated by Wattos' _Org_constr_file_comment.Comment end save_ save_MR_file_comment_4 _Org_constr_file_comment.Sf_framecode MR_file_comment_4 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID rr_1iyu _Org_constr_file_comment.ID 2 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 4 _Org_constr_file_comment.Details 'Generated by Wattos' _Org_constr_file_comment.Comment 'restraints dihedral reset' save_