data_7033 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7033 _Entry.Title ; GSPT1/eRF3a(PAM2-2)-PABC complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-03-27 _Entry.Accession_date 2006-03-27 _Entry.Last_release_date 2010-05-27 _Entry.Original_release_date 2010-05-27 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Masanori Osawa . . . 7033 2 Ichio Shimada . . . 7033 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7033 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 249 7033 '15N chemical shifts' 81 7033 '1H chemical shifts' 729 7033 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2010-05-27 2006-03-27 original author . 7033 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 3THK 'BMRB Entry Tracking System' 7033 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7033 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title '1H Assigned Chemical Shifts for eRF3a, and 1H, 13C, and 15N Assigned Chemical Shifts for PABC' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Masanori Osawa . . . 7033 1 2 Ichio Shimada . . . 7033 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7033 _Assembly.ID 1 _Assembly.Name 'GSPT1/eRF3a(PAM2-2) - PABC complex' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . 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 PAM2-2 1 $GSPT1_eRF3a . . no native no no . . . 7033 1 2 PABC 2 $polyA-binding_protein . . no native no no . . . 7033 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_GSPT1_eRF3a _Entity.Sf_category entity _Entity.Sf_framecode GSPT1_eRF3a _Entity.Entry_ID 7033 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PAM2-2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AKPFVPNVHAAEFVPSFLRG PA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 22 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2RQH . "Structure Of Gspt1ERF3A-Pabc" . . . . . 100.00 22 100.00 100.00 2.93e-05 . . . . 7033 1 2 no PDB 3KUJ . "Crystal Structure Of C-Terminal Domain Of Pabpc1 In Complex With Binding Region Of Erf3a" . . . . . 68.18 15 100.00 100.00 3.22e+00 . . . . 7033 1 3 no DBJ BAA91612 . "unnamed protein product [Homo sapiens]" . . . . . 95.45 628 100.00 100.00 9.63e-05 . . . . 7033 1 4 no DBJ BAA92160 . "eukaryotic polypeptide chain release factor 3 [Oryctolagus cuniculus]" . . . . . 100.00 588 100.00 100.00 7.42e-05 . . . . 7033 1 5 no DBJ BAE22025 . "unnamed protein product [Mus musculus]" . . . . . 100.00 226 100.00 100.00 3.02e-05 . . . . 7033 1 6 no DBJ BAJ20641 . "G1 to S phase transition 1 [synthetic construct]" . . . . . 86.36 634 100.00 100.00 3.34e-03 . . . . 7033 1 7 no EMBL CAB91089 . "polypeptide chain release factor 3b [Homo sapiens]" . . . . . 95.45 628 100.00 100.00 9.63e-05 . . . . 7033 1 8 no EMBL CAG31442 . "hypothetical protein RCJMB04_6h9 [Gallus gallus]" . . . . . 86.36 162 100.00 100.00 8.36e-04 . . . . 7033 1 9 no GB AAH09503 . "GSPT1 protein [Homo sapiens]" . . . . . 86.36 633 100.00 100.00 3.34e-03 . . . . 7033 1 10 no GB AAH31640 . "G1 to S phase transition 1 [Mus musculus]" . . . . . 100.00 587 100.00 100.00 3.06e-05 . . . . 7033 1 11 no GB AAH36077 . "G1 to S phase transition 2 [Homo sapiens]" . . . . . 95.45 628 100.00 100.00 5.84e-05 . . . . 7033 1 12 no GB AAH79092 . "G1 to S phase transition 1 [Rattus norvegicus]" . . . . . 100.00 636 100.00 100.00 3.21e-05 . . . . 7033 1 13 no GB AAI34652 . "GSPT1 protein [Bos taurus]" . . . . . 100.00 637 100.00 100.00 7.26e-05 . . . . 7033 1 14 no REF NP_001003978 . "eukaryotic peptide chain release factor GTP-binding subunit ERF3A [Rattus norvegicus]" . . . . . 100.00 636 100.00 100.00 3.21e-05 . . . . 7033 1 15 no REF NP_001091540 . "eukaryotic peptide chain release factor GTP-binding subunit ERF3A [Bos taurus]" . . . . . 100.00 636 100.00 100.00 4.36e-05 . . . . 7033 1 16 no REF NP_001123478 . "eukaryotic peptide chain release factor GTP-binding subunit ERF3A isoform 2 [Homo sapiens]" . . . . . 100.00 636 100.00 100.00 5.18e-05 . . . . 7033 1 17 no REF NP_001123480 . "eukaryotic peptide chain release factor GTP-binding subunit ERF3A isoform 2 [Mus musculus]" . . . . . 100.00 635 100.00 100.00 3.17e-05 . . . . 7033 1 18 no REF NP_001129149 . "eukaryotic peptide chain release factor GTP-binding subunit ERF3A [Gallus gallus]" . . . . . 86.36 618 100.00 100.00 3.75e-03 . . . . 7033 1 19 no SP Q8IYD1 . "RecName: Full=Eukaryotic peptide chain release factor GTP-binding subunit ERF3B; Short=Eukaryotic peptide chain release factor " . . . . . 95.45 628 100.00 100.00 9.63e-05 . . . . 7033 1 20 no SP Q8R050 . "RecName: Full=Eukaryotic peptide chain release factor GTP-binding subunit ERF3A; Short=Eukaryotic peptide chain release factor " . . . . . 100.00 636 100.00 100.00 3.18e-05 . . . . 7033 1 21 no TPG DAA15601 . "TPA: G1 to S phase transition 1 [Bos taurus]" . . . . . 100.00 605 100.00 100.00 7.10e-05 . . . . 7033 1 stop_ 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 73 ALA . 7033 1 2 74 LYS . 7033 1 3 75 PRO . 7033 1 4 76 PHE . 7033 1 5 77 VAL . 7033 1 6 78 PRO . 7033 1 7 79 ASN . 7033 1 8 80 VAL . 7033 1 9 81 HIS . 7033 1 10 82 ALA . 7033 1 11 83 ALA . 7033 1 12 84 GLU . 7033 1 13 85 PHE . 7033 1 14 86 VAL . 7033 1 15 87 PRO . 7033 1 16 88 SER . 7033 1 17 89 PHE . 7033 1 18 90 LEU . 7033 1 19 91 ARG . 7033 1 20 92 GLY . 7033 1 21 93 PRO . 7033 1 22 94 ALA . 7033 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 . ALA 1 1 7033 1 . LYS 2 2 7033 1 . PRO 3 3 7033 1 . PHE 4 4 7033 1 . VAL 5 5 7033 1 . PRO 6 6 7033 1 . ASN 7 7 7033 1 . VAL 8 8 7033 1 . HIS 9 9 7033 1 . ALA 10 10 7033 1 . ALA 11 11 7033 1 . GLU 12 12 7033 1 . PHE 13 13 7033 1 . VAL 14 14 7033 1 . PRO 15 15 7033 1 . SER 16 16 7033 1 . PHE 17 17 7033 1 . LEU 18 18 7033 1 . ARG 19 19 7033 1 . GLY 20 20 7033 1 . PRO 21 21 7033 1 . ALA 22 22 7033 1 stop_ save_ save_polyA-binding_protein _Entity.Sf_category entity _Entity.Sf_framecode polyA-binding_protein _Entity.Entry_ID 7033 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name 'PABC domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GQEPLTASMLASAPPQEQKQ MLGERLFPLIQAMHPTLAGK ITGMLLEIDNSELLHMLESP ESLRSKVDEAVAVLQAHQAK EAA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 83 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 10019 . polyA-binding_protein . . . . . 100.00 83 100.00 100.00 1.08e-49 . . . . 7033 2 2 no BMRB 4915 . PABC . . . . . 100.00 144 100.00 100.00 1.43e-49 . . . . 7033 2 3 no PDB 1G9L . "Solution Structure Of The Pabc Domain Of Human Poly(A) Binding Protein" . . . . . 100.00 144 100.00 100.00 1.43e-49 . . . . 7033 2 4 no PDB 1JGN . "Solution Structure Of The C-Terminal Pabc Domain Of Human Poly(A)-Binding Protein In Complex With The Peptide From Paip2" . . . . . 96.39 98 100.00 100.00 1.99e-47 . . . . 7033 2 5 no PDB 1JH4 . "Solution Structure Of The C-Terminal Pabc Domain Of Human Poly(A)-Binding Protein In Complex With The Peptide From Paip1" . . . . . 96.39 98 100.00 100.00 1.99e-47 . . . . 7033 2 6 no PDB 2RQG . "Structure Of Gspt1ERF3A-Pabc" . . . . . 100.00 83 100.00 100.00 1.08e-49 . . . . 7033 2 7 no PDB 2RQH . "Structure Of Gspt1ERF3A-Pabc" . . . . . 100.00 83 100.00 100.00 1.08e-49 . . . . 7033 2 8 no PDB 2X04 . "Crystal Structure Of The Pabc-Tnrc6c Complex" . . . . . 90.36 80 100.00 100.00 1.35e-43 . . . . 7033 2 9 no PDB 3KTP . "Structural Basis Of Gw182 Recognition By Poly(a)-binding Protein" . . . . . 96.39 88 100.00 100.00 2.93e-47 . . . . 7033 2 10 no PDB 3KTR . "Structural Basis Of Ataxin-2 Recognition By Poly(A)-Binding" . . . . . 96.39 88 100.00 100.00 2.93e-47 . . . . 7033 2 11 no PDB 3KUI . "Crystal Structure Of C-Terminal Domain Of Pabpc1 In Complex Binding Region Of Erf3a" . . . . . 96.39 88 100.00 100.00 2.93e-47 . . . . 7033 2 12 no PDB 3KUJ . "Crystal Structure Of C-Terminal Domain Of Pabpc1 In Complex With Binding Region Of Erf3a" . . . . . 96.39 88 100.00 100.00 2.93e-47 . . . . 7033 2 13 no PDB 3KUR . "Crystal Structure Of The Mlle Domain Of Poly(A)-Binding Protein" . . . . . 89.16 79 100.00 100.00 3.20e-43 . . . . 7033 2 14 no PDB 3KUS . "Crystal Structure Of The Mlle Domain Of Poly(A)-Binding Protein In Complex With The Binding Region Of Paip2" . . . . . 96.39 88 100.00 100.00 2.93e-47 . . . . 7033 2 15 no PDB 3KUT . "Crystal Structure Of The Mlle Domain Of Poly(a)-binding Protein In Complex With The Binding Region Of Paip2" . . . . . 96.39 88 100.00 100.00 2.93e-47 . . . . 7033 2 16 no PDB 3PKN . "Crystal Structure Of Mlle Domain Of Poly(A) Binding Protein In Complex With Pam2 Motif Of La-Related Protein 4 (Larp4)" . . . . . 96.39 88 100.00 100.00 2.93e-47 . . . . 7033 2 17 no PDB 3PTH . "The Pabc1 Mlle Domain Bound To The Variant Pam2 Motif Of Larp4b" . . . . . 95.18 82 100.00 100.00 7.50e-47 . . . . 7033 2 18 no DBJ BAC32110 . "unnamed protein product [Mus musculus]" . . . . . 100.00 636 98.80 100.00 1.21e-45 . . . . 7033 2 19 no DBJ BAC40951 . "unnamed protein product [Mus musculus]" . . . . . 100.00 636 98.80 100.00 1.11e-45 . . . . 7033 2 20 no DBJ BAC56450 . "similar to poly(A)-binding protein 1 [Bos taurus]" . . . . . 100.00 138 98.80 98.80 6.94e-49 . . . . 7033 2 21 no DBJ BAE21553 . "unnamed protein product [Mus musculus]" . . . . . 100.00 636 98.80 100.00 1.21e-45 . . . . 7033 2 22 no DBJ BAE30919 . "unnamed protein product [Mus musculus]" . . . . . 100.00 636 98.80 100.00 1.22e-45 . . . . 7033 2 23 no EMBL CAA40721 . "polyA binding protein [Xenopus laevis]" . . . . . 100.00 633 98.80 100.00 9.36e-46 . . . . 7033 2 24 no EMBL CAA46522 . "poly(A) binding protein [Mus musculus]" . . . . . 100.00 636 98.80 100.00 1.19e-45 . . . . 7033 2 25 no EMBL CAA68428 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 633 100.00 100.00 3.73e-46 . . . . 7033 2 26 no EMBL CAA88401 . "polyadenylate binding protein II [Homo sapiens]" . . . . . 100.00 522 100.00 100.00 7.91e-47 . . . . 7033 2 27 no EMBL CAB96752 . "polyadenylate-binding protein 1 [Bos taurus]" . . . . . 100.00 636 100.00 100.00 3.63e-46 . . . . 7033 2 28 no GB AAA60936 . "poly(A)-binding protein [Xenopus laevis]" . . . . . 100.00 633 97.59 98.80 1.02e-44 . . . . 7033 2 29 no GB AAD08718 . "poly(A)-binding protein [Homo sapiens]" . . . . . 100.00 636 100.00 100.00 3.63e-46 . . . . 7033 2 30 no GB AAH03870 . "Poly(A) binding protein, cytoplasmic 1 [Mus musculus]" . . . . . 100.00 636 98.80 100.00 1.21e-45 . . . . 7033 2 31 no GB AAH04587 . "Pabpc1 protein, partial [Mus musculus]" . . . . . 100.00 527 97.59 98.80 4.04e-45 . . . . 7033 2 32 no GB AAH11207 . "Poly(A) binding protein, cytoplasmic 1 [Mus musculus]" . . . . . 100.00 636 98.80 100.00 1.21e-45 . . . . 7033 2 33 no REF NP_001005051 . "poly(A) binding protein, cytoplasmic 1 [Xenopus (Silurana) tropicalis]" . . . . . 100.00 634 98.80 100.00 8.94e-46 . . . . 7033 2 34 no REF NP_001026768 . "polyadenylate-binding protein 1 [Gallus gallus]" . . . . . 100.00 637 98.80 100.00 8.53e-46 . . . . 7033 2 35 no REF NP_001080204 . "polyadenylate-binding protein 1-A [Xenopus laevis]" . . . . . 100.00 633 97.59 98.80 1.02e-44 . . . . 7033 2 36 no REF NP_001085069 . "polyadenylate-binding protein 1-B [Xenopus laevis]" . . . . . 100.00 633 98.80 100.00 9.55e-46 . . . . 7033 2 37 no REF NP_001126097 . "polyadenylate-binding protein 1 [Pongo abelii]" . . . . . 100.00 636 100.00 100.00 3.60e-46 . . . . 7033 2 38 no SP P11940 . "RecName: Full=Polyadenylate-binding protein 1; Short=PABP-1; Short=Poly(A)-binding protein 1 [Homo sapiens]" . . . . . 100.00 636 100.00 100.00 3.63e-46 . . . . 7033 2 39 no SP P20965 . "RecName: Full=Polyadenylate-binding protein 1-A; Short=PABP-1-A; Short=Poly(A)-binding protein 1-A; Short=xPABP1-A; AltName: Fu" . . . . . 100.00 633 98.80 100.00 9.83e-46 . . . . 7033 2 40 no SP P29341 . "RecName: Full=Polyadenylate-binding protein 1; Short=PABP-1; Short=Poly(A)-binding protein 1 [Mus musculus]" . . . . . 100.00 636 98.80 100.00 1.21e-45 . . . . 7033 2 41 no SP P61286 . "RecName: Full=Polyadenylate-binding protein 1; Short=PABP-1; Short=Poly(A)-binding protein 1 [Bos taurus]" . . . . . 100.00 636 100.00 100.00 3.63e-46 . . . . 7033 2 42 no SP Q5R8F7 . "RecName: Full=Polyadenylate-binding protein 1; Short=PABP-1; Short=Poly(A)-binding protein 1 [Pongo abelii]" . . . . . 100.00 636 100.00 100.00 3.74e-46 . . . . 7033 2 43 no TPG DAA12894 . "TPA: polyadenylate-binding protein 1-like [Bos taurus]" . . . . . 100.00 269 98.80 98.80 1.18e-46 . . . . 7033 2 44 no TPG DAA22579 . "TPA: polyadenylate-binding protein 1 [Bos taurus]" . . . . . 100.00 636 100.00 100.00 3.63e-46 . . . . 7033 2 stop_ 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 1 541 GLY . 7033 2 2 542 GLN . 7033 2 3 543 GLU . 7033 2 4 544 PRO . 7033 2 5 545 LEU . 7033 2 6 546 THR . 7033 2 7 547 ALA . 7033 2 8 548 SER . 7033 2 9 549 MET . 7033 2 10 550 LEU . 7033 2 11 551 ALA . 7033 2 12 552 SER . 7033 2 13 553 ALA . 7033 2 14 554 PRO . 7033 2 15 555 PRO . 7033 2 16 556 GLN . 7033 2 17 557 GLU . 7033 2 18 558 GLN . 7033 2 19 559 LYS . 7033 2 20 560 GLN . 7033 2 21 561 MET . 7033 2 22 562 LEU . 7033 2 23 563 GLY . 7033 2 24 564 GLU . 7033 2 25 565 ARG . 7033 2 26 566 LEU . 7033 2 27 567 PHE . 7033 2 28 568 PRO . 7033 2 29 569 LEU . 7033 2 30 570 ILE . 7033 2 31 571 GLN . 7033 2 32 572 ALA . 7033 2 33 573 MET . 7033 2 34 574 HIS . 7033 2 35 575 PRO . 7033 2 36 576 THR . 7033 2 37 577 LEU . 7033 2 38 578 ALA . 7033 2 39 579 GLY . 7033 2 40 580 LYS . 7033 2 41 581 ILE . 7033 2 42 582 THR . 7033 2 43 583 GLY . 7033 2 44 584 MET . 7033 2 45 585 LEU . 7033 2 46 586 LEU . 7033 2 47 587 GLU . 7033 2 48 588 ILE . 7033 2 49 589 ASP . 7033 2 50 590 ASN . 7033 2 51 591 SER . 7033 2 52 592 GLU . 7033 2 53 593 LEU . 7033 2 54 594 LEU . 7033 2 55 595 HIS . 7033 2 56 596 MET . 7033 2 57 597 LEU . 7033 2 58 598 GLU . 7033 2 59 599 SER . 7033 2 60 600 PRO . 7033 2 61 601 GLU . 7033 2 62 602 SER . 7033 2 63 603 LEU . 7033 2 64 604 ARG . 7033 2 65 605 SER . 7033 2 66 606 LYS . 7033 2 67 607 VAL . 7033 2 68 608 ASP . 7033 2 69 609 GLU . 7033 2 70 610 ALA . 7033 2 71 611 VAL . 7033 2 72 612 ALA . 7033 2 73 613 VAL . 7033 2 74 614 LEU . 7033 2 75 615 GLN . 7033 2 76 616 ALA . 7033 2 77 617 HIS . 7033 2 78 618 GLN . 7033 2 79 619 ALA . 7033 2 80 620 LYS . 7033 2 81 621 GLU . 7033 2 82 622 ALA . 7033 2 83 623 ALA . 7033 2 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 . GLY 1 1 7033 2 . GLN 2 2 7033 2 . GLU 3 3 7033 2 . PRO 4 4 7033 2 . LEU 5 5 7033 2 . THR 6 6 7033 2 . ALA 7 7 7033 2 . SER 8 8 7033 2 . MET 9 9 7033 2 . LEU 10 10 7033 2 . ALA 11 11 7033 2 . SER 12 12 7033 2 . ALA 13 13 7033 2 . PRO 14 14 7033 2 . PRO 15 15 7033 2 . GLN 16 16 7033 2 . GLU 17 17 7033 2 . GLN 18 18 7033 2 . LYS 19 19 7033 2 . GLN 20 20 7033 2 . MET 21 21 7033 2 . LEU 22 22 7033 2 . GLY 23 23 7033 2 . GLU 24 24 7033 2 . ARG 25 25 7033 2 . LEU 26 26 7033 2 . PHE 27 27 7033 2 . PRO 28 28 7033 2 . LEU 29 29 7033 2 . ILE 30 30 7033 2 . GLN 31 31 7033 2 . ALA 32 32 7033 2 . MET 33 33 7033 2 . HIS 34 34 7033 2 . PRO 35 35 7033 2 . THR 36 36 7033 2 . LEU 37 37 7033 2 . ALA 38 38 7033 2 . GLY 39 39 7033 2 . LYS 40 40 7033 2 . ILE 41 41 7033 2 . THR 42 42 7033 2 . GLY 43 43 7033 2 . MET 44 44 7033 2 . LEU 45 45 7033 2 . LEU 46 46 7033 2 . GLU 47 47 7033 2 . ILE 48 48 7033 2 . ASP 49 49 7033 2 . ASN 50 50 7033 2 . SER 51 51 7033 2 . GLU 52 52 7033 2 . LEU 53 53 7033 2 . LEU 54 54 7033 2 . HIS 55 55 7033 2 . MET 56 56 7033 2 . LEU 57 57 7033 2 . GLU 58 58 7033 2 . SER 59 59 7033 2 . PRO 60 60 7033 2 . GLU 61 61 7033 2 . SER 62 62 7033 2 . LEU 63 63 7033 2 . ARG 64 64 7033 2 . SER 65 65 7033 2 . LYS 66 66 7033 2 . VAL 67 67 7033 2 . ASP 68 68 7033 2 . GLU 69 69 7033 2 . ALA 70 70 7033 2 . VAL 71 71 7033 2 . ALA 72 72 7033 2 . VAL 73 73 7033 2 . LEU 74 74 7033 2 . GLN 75 75 7033 2 . ALA 76 76 7033 2 . HIS 77 77 7033 2 . GLN 78 78 7033 2 . ALA 79 79 7033 2 . LYS 80 80 7033 2 . GLU 81 81 7033 2 . ALA 82 82 7033 2 . ALA 83 83 7033 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 7033 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $GSPT1_eRF3a . . . no . Mouse . . Eukaryota Metazoa Mus musculas . . . . . . . . . . . . . . . . . . . . . 7033 1 2 2 $polyA-binding_protein . . . no . Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 7033 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 7033 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $GSPT1_eRF3a . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7033 1 2 2 $polyA-binding_protein . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7033 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7033 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 PAM2-1 unlabeled . . 1 $GSPT1_eRF3a . . 1 . . mM . . . . 7033 1 2 'PABC domain' '[U-13C; U-15N]' . . 2 $polyA-binding_protein . . 1 . . mM . . . . 7033 1 3 NaCl . . . . . . . 150 . . mM . . . . 7033 1 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 7033 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.15 0.01 M 7033 1 pH 6.5 0.1 pH 7033 1 temperature 303 0.01 K 7033 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_500MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 500MHz_spectrometer _NMR_spectrometer.Entry_ID 7033 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 7033 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '15N-1H HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 2 '13C-1H HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 3 CBCA(CO)NH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 4 HNCACB no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 5 C(CO)NH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 6 H(CCO)NH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 7 HBHA(CBCACO)NH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 8 HCCH-TOCSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 9 '15N-edited TOCSY HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 10 '15N-edited NOESY HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 11 '13C,15N-filterd NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 12 '13C,15N-filterd TOCSY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $500MHz_spectrometer . . . . . . . . . . . . . . . . 7033 1 stop_ save_ save_15N-1H_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 15N-1H_HSQC _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '15N-1H HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_13C-1H_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 13C-1H_HSQC _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '13C-1H HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_CBCA(CO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode CBCA(CO)NH _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name CBCA(CO)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HNCACB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HNCACB _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HNCACB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_C(CO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode C(CO)NH _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name C(CO)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_H(CCO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode H(CCO)NH _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name H(CCO)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HBHA(CBCACO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HBHA(CBCACO)NH _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name HBHA(CBCACO)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HCCH-TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HCCH-TOCSY _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name HCCH-TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_15N-edited_TOCSY_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 15N-edited_TOCSY_HSQC _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name '15N-edited TOCSY HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_15N-edited_NOESY_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 15N-edited_NOESY_HSQC _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '15N-edited NOESY HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_13C_15N-filterd_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 13C_15N-filterd_NOESY _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name '13C,15N-filterd NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_13C_15N-filterd_TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 13C_15N-filterd_TOCSY _NMR_spec_expt.Entry_ID 7033 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name '13C,15N-filterd TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 7033 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 7033 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 7033 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 7033 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7033 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 isotropic 7033 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ALA HA H 1 4.049 0.020 . 1 . . . . 73 ALA HA . 7033 1 2 . 1 1 1 1 ALA HB1 H 1 1.463 0.020 . 1 . . . . 73 ALA HB . 7033 1 3 . 1 1 1 1 ALA HB2 H 1 1.463 0.020 . 1 . . . . 73 ALA HB . 7033 1 4 . 1 1 1 1 ALA HB3 H 1 1.463 0.020 . 1 . . . . 73 ALA HB . 7033 1 5 . 1 1 2 2 LYS H H 1 7.750 0.020 . 1 . . . . 74 LYS H . 7033 1 6 . 1 1 2 2 LYS HA H 1 4.197 0.020 . 1 . . . . 74 LYS HA . 7033 1 7 . 1 1 2 2 LYS HB2 H 1 1.779 0.020 . 2 . . . . 74 LYS HB2 . 7033 1 8 . 1 1 2 2 LYS HB3 H 1 1.830 0.020 . 2 . . . . 74 LYS HB3 . 7033 1 9 . 1 1 2 2 LYS HG2 H 1 1.420 0.020 . 2 . . . . 74 LYS HG2 . 7033 1 10 . 1 1 2 2 LYS HG3 H 1 1.479 0.020 . 2 . . . . 74 LYS HG3 . 7033 1 11 . 1 1 3 3 PRO HA H 1 4.401 0.020 . 1 . . . . 75 PRO HA . 7033 1 12 . 1 1 3 3 PRO HB2 H 1 1.789 0.020 . 2 . . . . 75 PRO HB2 . 7033 1 13 . 1 1 3 3 PRO HB3 H 1 2.284 0.020 . 2 . . . . 75 PRO HB3 . 7033 1 14 . 1 1 3 3 PRO HG2 H 1 1.989 0.020 . 1 . . . . 75 PRO HG2 . 7033 1 15 . 1 1 3 3 PRO HG3 H 1 1.989 0.020 . 1 . . . . 75 PRO HG3 . 7033 1 16 . 1 1 4 4 PHE H H 1 8.638 0.020 . 1 . . . . 76 PHE H . 7033 1 17 . 1 1 4 4 PHE HA H 1 4.799 0.020 . 1 . . . . 76 PHE HA . 7033 1 18 . 1 1 4 4 PHE HB2 H 1 2.969 0.020 . 2 . . . . 76 PHE HB2 . 7033 1 19 . 1 1 4 4 PHE HB3 H 1 3.171 0.020 . 2 . . . . 76 PHE HB3 . 7033 1 20 . 1 1 4 4 PHE HD1 H 1 7.295 0.020 . 1 . . . . 76 PHE HD1 . 7033 1 21 . 1 1 4 4 PHE HD2 H 1 7.295 0.020 . 1 . . . . 76 PHE HD2 . 7033 1 22 . 1 1 4 4 PHE HE1 H 1 6.927 0.020 . 1 . . . . 76 PHE HE1 . 7033 1 23 . 1 1 4 4 PHE HE2 H 1 6.927 0.020 . 1 . . . . 76 PHE HE2 . 7033 1 24 . 1 1 5 5 VAL H H 1 8.329 0.020 . 1 . . . . 77 VAL H . 7033 1 25 . 1 1 5 5 VAL HA H 1 4.122 0.020 . 1 . . . . 77 VAL HA . 7033 1 26 . 1 1 5 5 VAL HB H 1 1.874 0.020 . 1 . . . . 77 VAL HB . 7033 1 27 . 1 1 5 5 VAL HG11 H 1 0.784 0.020 . 2 . . . . 77 VAL HG1 . 7033 1 28 . 1 1 5 5 VAL HG12 H 1 0.784 0.020 . 2 . . . . 77 VAL HG1 . 7033 1 29 . 1 1 5 5 VAL HG13 H 1 0.784 0.020 . 2 . . . . 77 VAL HG1 . 7033 1 30 . 1 1 5 5 VAL HG21 H 1 0.736 0.020 . 2 . . . . 77 VAL HG2 . 7033 1 31 . 1 1 5 5 VAL HG22 H 1 0.736 0.020 . 2 . . . . 77 VAL HG2 . 7033 1 32 . 1 1 5 5 VAL HG23 H 1 0.736 0.020 . 2 . . . . 77 VAL HG2 . 7033 1 33 . 1 1 6 6 PRO HA H 1 3.841 0.020 . 1 . . . . 78 PRO HA . 7033 1 34 . 1 1 6 6 PRO HB2 H 1 1.943 0.020 . 2 . . . . 78 PRO HB2 . 7033 1 35 . 1 1 6 6 PRO HB3 H 1 1.778 0.020 . 2 . . . . 78 PRO HB3 . 7033 1 36 . 1 1 6 6 PRO HG2 H 1 1.519 0.020 . 1 . . . . 78 PRO HG2 . 7033 1 37 . 1 1 6 6 PRO HG3 H 1 1.519 0.020 . 1 . . . . 78 PRO HG3 . 7033 1 38 . 1 1 6 6 PRO HD2 H 1 3.182 0.020 . 2 . . . . 78 PRO HD2 . 7033 1 39 . 1 1 6 6 PRO HD3 H 1 3.325 0.020 . 2 . . . . 78 PRO HD3 . 7033 1 40 . 1 1 7 7 ASN H H 1 8.885 0.020 . 1 . . . . 79 ASN H . 7033 1 41 . 1 1 7 7 ASN HA H 1 4.723 0.020 . 1 . . . . 79 ASN HA . 7033 1 42 . 1 1 7 7 ASN HB2 H 1 2.851 0.020 . 2 . . . . 79 ASN HB2 . 7033 1 43 . 1 1 7 7 ASN HB3 H 1 3.194 0.020 . 2 . . . . 79 ASN HB3 . 7033 1 44 . 1 1 7 7 ASN HD21 H 1 8.570 0.020 . 2 . . . . 79 ASN HD21 . 7033 1 45 . 1 1 7 7 ASN HD22 H 1 6.950 0.020 . 2 . . . . 79 ASN HD22 . 7033 1 46 . 1 1 8 8 VAL H H 1 8.435 0.020 . 1 . . . . 80 VAL H . 7033 1 47 . 1 1 8 8 VAL HA H 1 3.697 0.020 . 1 . . . . 80 VAL HA . 7033 1 48 . 1 1 8 8 VAL HB H 1 1.650 0.020 . 1 . . . . 80 VAL HB . 7033 1 49 . 1 1 8 8 VAL HG11 H 1 0.436 0.020 . 2 . . . . 80 VAL HG1 . 7033 1 50 . 1 1 8 8 VAL HG12 H 1 0.436 0.020 . 2 . . . . 80 VAL HG1 . 7033 1 51 . 1 1 8 8 VAL HG13 H 1 0.436 0.020 . 2 . . . . 80 VAL HG1 . 7033 1 52 . 1 1 8 8 VAL HG21 H 1 -0.037 0.020 . 2 . . . . 80 VAL HG2 . 7033 1 53 . 1 1 8 8 VAL HG22 H 1 -0.037 0.020 . 2 . . . . 80 VAL HG2 . 7033 1 54 . 1 1 8 8 VAL HG23 H 1 -0.037 0.020 . 2 . . . . 80 VAL HG2 . 7033 1 55 . 1 1 9 9 HIS H H 1 7.704 0.020 . 1 . . . . 81 HIS H . 7033 1 56 . 1 1 9 9 HIS HA H 1 4.596 0.020 . 1 . . . . 81 HIS HA . 7033 1 57 . 1 1 9 9 HIS HB2 H 1 2.972 0.020 . 2 . . . . 81 HIS HB2 . 7033 1 58 . 1 1 9 9 HIS HB3 H 1 3.293 0.020 . 2 . . . . 81 HIS HB3 . 7033 1 59 . 1 1 9 9 HIS HD2 H 1 7.023 0.020 . 1 . . . . 81 HIS HD2 . 7033 1 60 . 1 1 9 9 HIS HE1 H 1 7.858 0.020 . 1 . . . . 81 HIS HE1 . 7033 1 61 . 1 1 10 10 ALA H H 1 7.916 0.020 . 1 . . . . 82 ALA H . 7033 1 62 . 1 1 10 10 ALA HA H 1 4.009 0.020 . 1 . . . . 82 ALA HA . 7033 1 63 . 1 1 10 10 ALA HB1 H 1 1.284 0.020 . 1 . . . . 82 ALA HB . 7033 1 64 . 1 1 10 10 ALA HB2 H 1 1.284 0.020 . 1 . . . . 82 ALA HB . 7033 1 65 . 1 1 10 10 ALA HB3 H 1 1.284 0.020 . 1 . . . . 82 ALA HB . 7033 1 66 . 1 1 11 11 ALA H H 1 8.476 0.020 . 1 . . . . 83 ALA H . 7033 1 67 . 1 1 11 11 ALA HA H 1 4.101 0.020 . 1 . . . . 83 ALA HA . 7033 1 68 . 1 1 11 11 ALA HB1 H 1 1.324 0.020 . 1 . . . . 83 ALA HB . 7033 1 69 . 1 1 11 11 ALA HB2 H 1 1.324 0.020 . 1 . . . . 83 ALA HB . 7033 1 70 . 1 1 11 11 ALA HB3 H 1 1.324 0.020 . 1 . . . . 83 ALA HB . 7033 1 71 . 1 1 12 12 GLU H H 1 8.463 0.020 . 1 . . . . 84 GLU H . 7033 1 72 . 1 1 12 12 GLU HA H 1 3.895 0.020 . 1 . . . . 84 GLU HA . 7033 1 73 . 1 1 12 12 GLU HB2 H 1 1.728 0.020 . 2 . . . . 84 GLU HB2 . 7033 1 74 . 1 1 12 12 GLU HB3 H 1 1.785 0.020 . 2 . . . . 84 GLU HB3 . 7033 1 75 . 1 1 12 12 GLU HG2 H 1 2.007 0.020 . 2 . . . . 84 GLU HG2 . 7033 1 76 . 1 1 12 12 GLU HG3 H 1 2.065 0.020 . 2 . . . . 84 GLU HG3 . 7033 1 77 . 1 1 13 13 PHE H H 1 8.032 0.020 . 1 . . . . 85 PHE H . 7033 1 78 . 1 1 13 13 PHE HA H 1 4.393 0.020 . 1 . . . . 85 PHE HA . 7033 1 79 . 1 1 13 13 PHE HB2 H 1 2.839 0.020 . 2 . . . . 85 PHE HB2 . 7033 1 80 . 1 1 13 13 PHE HB3 H 1 2.896 0.020 . 2 . . . . 85 PHE HB3 . 7033 1 81 . 1 1 13 13 PHE HD1 H 1 6.974 0.020 . 1 . . . . 85 PHE HD1 . 7033 1 82 . 1 1 13 13 PHE HD2 H 1 6.974 0.020 . 1 . . . . 85 PHE HD2 . 7033 1 83 . 1 1 13 13 PHE HE1 H 1 6.945 0.020 . 1 . . . . 85 PHE HE1 . 7033 1 84 . 1 1 13 13 PHE HE2 H 1 6.945 0.020 . 1 . . . . 85 PHE HE2 . 7033 1 85 . 1 1 13 13 PHE HZ H 1 7.134 0.020 . 1 . . . . 85 PHE HZ . 7033 1 86 . 1 1 14 14 VAL H H 1 7.531 0.020 . 1 . . . . 86 VAL H . 7033 1 87 . 1 1 14 14 VAL HA H 1 3.961 0.020 . 1 . . . . 86 VAL HA . 7033 1 88 . 1 1 14 14 VAL HB H 1 1.525 0.020 . 1 . . . . 86 VAL HB . 7033 1 89 . 1 1 14 14 VAL HG11 H 1 0.632 0.020 . 2 . . . . 86 VAL HG1 . 7033 1 90 . 1 1 14 14 VAL HG12 H 1 0.632 0.020 . 2 . . . . 86 VAL HG1 . 7033 1 91 . 1 1 14 14 VAL HG13 H 1 0.632 0.020 . 2 . . . . 86 VAL HG1 . 7033 1 92 . 1 1 14 14 VAL HG21 H 1 0.598 0.020 . 2 . . . . 86 VAL HG2 . 7033 1 93 . 1 1 14 14 VAL HG22 H 1 0.598 0.020 . 2 . . . . 86 VAL HG2 . 7033 1 94 . 1 1 14 14 VAL HG23 H 1 0.598 0.020 . 2 . . . . 86 VAL HG2 . 7033 1 95 . 1 1 15 15 PRO HA H 1 4.093 0.020 . 1 . . . . 87 PRO HA . 7033 1 96 . 1 1 15 15 PRO HB2 H 1 1.977 0.020 . 2 . . . . 87 PRO HB2 . 7033 1 97 . 1 1 15 15 PRO HB3 H 1 2.322 0.020 . 2 . . . . 87 PRO HB3 . 7033 1 98 . 1 1 15 15 PRO HG3 H 1 2.041 0.020 . 2 . . . . 87 PRO HG3 . 7033 1 99 . 1 1 15 15 PRO HD2 H 1 3.305 0.020 . 2 . . . . 87 PRO HD2 . 7033 1 100 . 1 1 15 15 PRO HD3 H 1 3.389 0.020 . 2 . . . . 87 PRO HD3 . 7033 1 101 . 1 1 16 16 SER H H 1 7.834 0.020 . 1 . . . . 88 SER H . 7033 1 102 . 1 1 16 16 SER HA H 1 4.599 0.020 . 1 . . . . 88 SER HA . 7033 1 103 . 1 1 16 16 SER HB2 H 1 3.828 0.020 . 2 . . . . 88 SER HB2 . 7033 1 104 . 1 1 16 16 SER HB3 H 1 3.735 0.020 . 2 . . . . 88 SER HB3 . 7033 1 105 . 1 1 17 17 PHE H H 1 7.841 0.020 . 1 . . . . 89 PHE H . 7033 1 106 . 1 1 17 17 PHE HA H 1 4.545 0.020 . 1 . . . . 89 PHE HA . 7033 1 107 . 1 1 17 17 PHE HB2 H 1 3.014 0.020 . 2 . . . . 89 PHE HB2 . 7033 1 108 . 1 1 17 17 PHE HB3 H 1 3.223 0.020 . 2 . . . . 89 PHE HB3 . 7033 1 109 . 1 1 17 17 PHE HD1 H 1 7.220 0.020 . 1 . . . . 89 PHE HD1 . 7033 1 110 . 1 1 17 17 PHE HD2 H 1 7.220 0.020 . 1 . . . . 89 PHE HD2 . 7033 1 111 . 1 1 17 17 PHE HE1 H 1 7.351 0.020 . 1 . . . . 89 PHE HE1 . 7033 1 112 . 1 1 17 17 PHE HE2 H 1 7.351 0.020 . 1 . . . . 89 PHE HE2 . 7033 1 113 . 1 1 18 18 LEU H H 1 7.480 0.020 . 1 . . . . 90 LEU H . 7033 1 114 . 1 1 18 18 LEU HA H 1 4.294 0.020 . 1 . . . . 90 LEU HA . 7033 1 115 . 1 1 18 18 LEU HB2 H 1 1.219 0.020 . 2 . . . . 90 LEU HB2 . 7033 1 116 . 1 1 18 18 LEU HB3 H 1 1.423 0.020 . 2 . . . . 90 LEU HB3 . 7033 1 117 . 1 1 18 18 LEU HG H 1 0.973 0.020 . 1 . . . . 90 LEU HG . 7033 1 118 . 1 1 18 18 LEU HD11 H 1 0.781 0.020 . 2 . . . . 90 LEU HD1 . 7033 1 119 . 1 1 18 18 LEU HD12 H 1 0.781 0.020 . 2 . . . . 90 LEU HD1 . 7033 1 120 . 1 1 18 18 LEU HD13 H 1 0.781 0.020 . 2 . . . . 90 LEU HD1 . 7033 1 121 . 1 1 18 18 LEU HD21 H 1 0.742 0.020 . 2 . . . . 90 LEU HD2 . 7033 1 122 . 1 1 18 18 LEU HD22 H 1 0.742 0.020 . 2 . . . . 90 LEU HD2 . 7033 1 123 . 1 1 18 18 LEU HD23 H 1 0.742 0.020 . 2 . . . . 90 LEU HD2 . 7033 1 124 . 1 1 19 19 ARG H H 1 7.665 0.020 . 1 . . . . 91 ARG H . 7033 1 125 . 1 1 19 19 ARG HA H 1 4.159 0.020 . 1 . . . . 91 ARG HA . 7033 1 126 . 1 1 19 19 ARG HB2 H 1 1.698 0.020 . 2 . . . . 91 ARG HB2 . 7033 1 127 . 1 1 19 19 ARG HB3 H 1 1.802 0.020 . 2 . . . . 91 ARG HB3 . 7033 1 128 . 1 1 19 19 ARG HG2 H 1 1.482 0.020 . 2 . . . . 91 ARG HG2 . 7033 1 129 . 1 1 19 19 ARG HG3 H 1 1.564 0.020 . 2 . . . . 91 ARG HG3 . 7033 1 130 . 1 1 19 19 ARG HD2 H 1 3.075 0.020 . 1 . . . . 91 ARG HD2 . 7033 1 131 . 1 1 19 19 ARG HD3 H 1 3.075 0.020 . 1 . . . . 91 ARG HD3 . 7033 1 132 . 1 1 20 20 GLY H H 1 8.066 0.020 . 1 . . . . 92 GLY H . 7033 1 133 . 1 1 20 20 GLY HA2 H 1 3.957 0.020 . 2 . . . . 92 GLY HA2 . 7033 1 134 . 1 1 20 20 GLY HA3 H 1 4.117 0.020 . 2 . . . . 92 GLY HA3 . 7033 1 135 . 1 1 21 21 PRO HA H 1 3.577 0.020 . 1 . . . . 93 PRO HA . 7033 1 136 . 1 1 21 21 PRO HB2 H 1 1.972 0.020 . 2 . . . . 93 PRO HB2 . 7033 1 137 . 1 1 21 21 PRO HB3 H 1 2.219 0.020 . 2 . . . . 93 PRO HB3 . 7033 1 138 . 1 1 21 21 PRO HD2 H 1 3.183 0.020 . 2 . . . . 93 PRO HD2 . 7033 1 139 . 1 1 21 21 PRO HD3 H 1 3.326 0.020 . 2 . . . . 93 PRO HD3 . 7033 1 140 . 1 1 22 22 ALA H H 1 8.125 0.020 . 1 . . . . 94 ALA H . 7033 1 141 . 1 1 22 22 ALA HA H 1 4.111 0.020 . 1 . . . . 94 ALA HA . 7033 1 142 . 1 1 22 22 ALA HB1 H 1 1.319 0.020 . 1 . . . . 94 ALA HB . 7033 1 143 . 1 1 22 22 ALA HB2 H 1 1.319 0.020 . 1 . . . . 94 ALA HB . 7033 1 144 . 1 1 22 22 ALA HB3 H 1 1.319 0.020 . 1 . . . . 94 ALA HB . 7033 1 145 . 2 2 1 1 GLY H H 1 8.410 0.020 . 1 . . . . 541 GLY H . 7033 1 146 . 2 2 1 1 GLY HA2 H 1 3.926 0.020 . 1 . . . . 541 GLY HA2 . 7033 1 147 . 2 2 1 1 GLY HA3 H 1 3.926 0.020 . 1 . . . . 541 GLY HA3 . 7033 1 148 . 2 2 1 1 GLY CA C 13 43.004 0.400 . 1 . . . . 541 GLY CA . 7033 1 149 . 2 2 1 1 GLY N N 15 110.001 0.400 . 1 . . . . 541 GLY N . 7033 1 150 . 2 2 2 2 GLN H H 1 8.125 0.020 . 1 . . . . 542 GLN H . 7033 1 151 . 2 2 2 2 GLN HA H 1 4.339 0.020 . 1 . . . . 542 GLN HA . 7033 1 152 . 2 2 2 2 GLN HB2 H 1 1.897 0.020 . 2 . . . . 542 GLN HB2 . 7033 1 153 . 2 2 2 2 GLN HB3 H 1 2.061 0.020 . 2 . . . . 542 GLN HB3 . 7033 1 154 . 2 2 2 2 GLN HG2 H 1 2.283 0.020 . 1 . . . . 542 GLN HG2 . 7033 1 155 . 2 2 2 2 GLN HG3 H 1 2.283 0.020 . 1 . . . . 542 GLN HG3 . 7033 1 156 . 2 2 2 2 GLN CA C 13 52.920 0.400 . 1 . . . . 542 GLN CA . 7033 1 157 . 2 2 2 2 GLN CB C 13 27.439 0.400 . 1 . . . . 542 GLN CB . 7033 1 158 . 2 2 2 2 GLN CG C 13 31.409 0.400 . 1 . . . . 542 GLN CG . 7033 1 159 . 2 2 2 2 GLN N N 15 119.336 0.400 . 1 . . . . 542 GLN N . 7033 1 160 . 2 2 3 3 GLU H H 1 8.573 0.020 . 1 . . . . 543 GLU H . 7033 1 161 . 2 2 3 3 GLU HA H 1 4.519 0.020 . 1 . . . . 543 GLU HA . 7033 1 162 . 2 2 3 3 GLU HB2 H 1 1.879 0.020 . 2 . . . . 543 GLU HB2 . 7033 1 163 . 2 2 3 3 GLU HB3 H 1 2.020 0.020 . 2 . . . . 543 GLU HB3 . 7033 1 164 . 2 2 3 3 GLU HG2 H 1 2.265 0.020 . 1 . . . . 543 GLU HG2 . 7033 1 165 . 2 2 3 3 GLU HG3 H 1 2.265 0.020 . 1 . . . . 543 GLU HG3 . 7033 1 166 . 2 2 3 3 GLU CA C 13 52.097 0.400 . 1 . . . . 543 GLU CA . 7033 1 167 . 2 2 3 3 GLU CB C 13 26.822 0.400 . 1 . . . . 543 GLU CB . 7033 1 168 . 2 2 3 3 GLU N N 15 124.370 0.400 . 1 . . . . 543 GLU N . 7033 1 169 . 2 2 4 4 PRO HA H 1 4.338 0.020 . 1 . . . . 544 PRO HA . 7033 1 170 . 2 2 4 4 PRO HB2 H 1 1.757 0.020 . 2 . . . . 544 PRO HB2 . 7033 1 171 . 2 2 4 4 PRO HB3 H 1 2.268 0.020 . 2 . . . . 544 PRO HB3 . 7033 1 172 . 2 2 4 4 PRO HG2 H 1 1.988 0.020 . 2 . . . . 544 PRO HG2 . 7033 1 173 . 2 2 4 4 PRO HG3 H 1 2.000 0.020 . 2 . . . . 544 PRO HG3 . 7033 1 174 . 2 2 4 4 PRO HD2 H 1 3.663 0.020 . 2 . . . . 544 PRO HD2 . 7033 1 175 . 2 2 4 4 PRO HD3 H 1 3.820 0.020 . 2 . . . . 544 PRO HD3 . 7033 1 176 . 2 2 4 4 PRO CA C 13 60.623 0.400 . 1 . . . . 544 PRO CA . 7033 1 177 . 2 2 4 4 PRO CB C 13 29.590 0.400 . 1 . . . . 544 PRO CB . 7033 1 178 . 2 2 4 4 PRO CG C 13 24.988 0.400 . 1 . . . . 544 PRO CG . 7033 1 179 . 2 2 4 4 PRO CD C 13 48.171 0.400 . 1 . . . . 544 PRO CD . 7033 1 180 . 2 2 5 5 LEU H H 1 8.371 0.020 . 1 . . . . 545 LEU H . 7033 1 181 . 2 2 5 5 LEU HA H 1 4.541 0.020 . 1 . . . . 545 LEU HA . 7033 1 182 . 2 2 5 5 LEU HB2 H 1 1.328 0.020 . 2 . . . . 545 LEU HB2 . 7033 1 183 . 2 2 5 5 LEU HB3 H 1 1.491 0.020 . 2 . . . . 545 LEU HB3 . 7033 1 184 . 2 2 5 5 LEU HG H 1 1.484 0.020 . 1 . . . . 545 LEU HG . 7033 1 185 . 2 2 5 5 LEU HD11 H 1 0.864 0.020 . 2 . . . . 545 LEU HD1 . 7033 1 186 . 2 2 5 5 LEU HD12 H 1 0.864 0.020 . 2 . . . . 545 LEU HD1 . 7033 1 187 . 2 2 5 5 LEU HD13 H 1 0.864 0.020 . 2 . . . . 545 LEU HD1 . 7033 1 188 . 2 2 5 5 LEU HD21 H 1 0.759 0.020 . 2 . . . . 545 LEU HD2 . 7033 1 189 . 2 2 5 5 LEU HD22 H 1 0.759 0.020 . 2 . . . . 545 LEU HD2 . 7033 1 190 . 2 2 5 5 LEU HD23 H 1 0.759 0.020 . 2 . . . . 545 LEU HD2 . 7033 1 191 . 2 2 5 5 LEU CA C 13 52.180 0.400 . 1 . . . . 545 LEU CA . 7033 1 192 . 2 2 5 5 LEU CB C 13 40.591 0.400 . 1 . . . . 545 LEU CB . 7033 1 193 . 2 2 5 5 LEU CG C 13 24.427 0.400 . 1 . . . . 545 LEU CG . 7033 1 194 . 2 2 5 5 LEU CD1 C 13 22.472 0.400 . 1 . . . . 545 LEU CD1 . 7033 1 195 . 2 2 5 5 LEU CD2 C 13 23.253 0.400 . 1 . . . . 545 LEU CD2 . 7033 1 196 . 2 2 5 5 LEU N N 15 122.696 0.400 . 1 . . . . 545 LEU N . 7033 1 197 . 2 2 6 6 THR H H 1 7.280 0.020 . 1 . . . . 546 THR H . 7033 1 198 . 2 2 6 6 THR HA H 1 4.633 0.020 . 1 . . . . 546 THR HA . 7033 1 199 . 2 2 6 6 THR HB H 1 4.592 0.020 . 1 . . . . 546 THR HB . 7033 1 200 . 2 2 6 6 THR HG21 H 1 1.176 0.020 . 1 . . . . 546 THR HG2 . 7033 1 201 . 2 2 6 6 THR HG22 H 1 1.176 0.020 . 1 . . . . 546 THR HG2 . 7033 1 202 . 2 2 6 6 THR HG23 H 1 1.176 0.020 . 1 . . . . 546 THR HG2 . 7033 1 203 . 2 2 6 6 THR CA C 13 56.775 0.400 . 1 . . . . 546 THR CA . 7033 1 204 . 2 2 6 6 THR CB C 13 69.518 0.400 . 1 . . . . 546 THR CB . 7033 1 205 . 2 2 6 6 THR CG2 C 13 19.065 0.400 . 1 . . . . 546 THR CG2 . 7033 1 206 . 2 2 6 6 THR N N 15 113.368 0.400 . 1 . . . . 546 THR N . 7033 1 207 . 2 2 7 7 ALA H H 1 9.045 0.020 . 1 . . . . 547 ALA H . 7033 1 208 . 2 2 7 7 ALA HA H 1 3.931 0.020 . 1 . . . . 547 ALA HA . 7033 1 209 . 2 2 7 7 ALA HB1 H 1 1.417 0.020 . 1 . . . . 547 ALA HB . 7033 1 210 . 2 2 7 7 ALA HB2 H 1 1.417 0.020 . 1 . . . . 547 ALA HB . 7033 1 211 . 2 2 7 7 ALA HB3 H 1 1.417 0.020 . 1 . . . . 547 ALA HB . 7033 1 212 . 2 2 7 7 ALA CA C 13 52.881 0.400 . 1 . . . . 547 ALA CA . 7033 1 213 . 2 2 7 7 ALA CB C 13 15.331 0.400 . 1 . . . . 547 ALA CB . 7033 1 214 . 2 2 7 7 ALA N N 15 123.404 0.400 . 1 . . . . 547 ALA N . 7033 1 215 . 2 2 8 8 SER H H 1 8.338 0.020 . 1 . . . . 548 SER H . 7033 1 216 . 2 2 8 8 SER HA H 1 4.165 0.020 . 1 . . . . 548 SER HA . 7033 1 217 . 2 2 8 8 SER HB2 H 1 3.822 0.020 . 1 . . . . 548 SER HB2 . 7033 1 218 . 2 2 8 8 SER HB3 H 1 3.822 0.020 . 1 . . . . 548 SER HB3 . 7033 1 219 . 2 2 8 8 SER CA C 13 58.731 0.400 . 1 . . . . 548 SER CA . 7033 1 220 . 2 2 8 8 SER CB C 13 59.803 0.400 . 1 . . . . 548 SER CB . 7033 1 221 . 2 2 8 8 SER N N 15 113.026 0.400 . 1 . . . . 548 SER N . 7033 1 222 . 2 2 9 9 MET H H 1 7.578 0.020 . 1 . . . . 549 MET H . 7033 1 223 . 2 2 9 9 MET HA H 1 4.071 0.020 . 1 . . . . 549 MET HA . 7033 1 224 . 2 2 9 9 MET HB2 H 1 2.119 0.020 . 1 . . . . 549 MET HB2 . 7033 1 225 . 2 2 9 9 MET HB3 H 1 2.119 0.020 . 1 . . . . 549 MET HB3 . 7033 1 226 . 2 2 9 9 MET HG2 H 1 2.512 0.020 . 2 . . . . 549 MET HG2 . 7033 1 227 . 2 2 9 9 MET HG3 H 1 2.545 0.020 . 2 . . . . 549 MET HG3 . 7033 1 228 . 2 2 9 9 MET HE1 H 1 2.093 0.020 . 1 . . . . 549 MET HE . 7033 1 229 . 2 2 9 9 MET HE2 H 1 2.093 0.020 . 1 . . . . 549 MET HE . 7033 1 230 . 2 2 9 9 MET HE3 H 1 2.093 0.020 . 1 . . . . 549 MET HE . 7033 1 231 . 2 2 9 9 MET CA C 13 56.349 0.400 . 1 . . . . 549 MET CA . 7033 1 232 . 2 2 9 9 MET CB C 13 31.538 0.400 . 1 . . . . 549 MET CB . 7033 1 233 . 2 2 9 9 MET CG C 13 29.224 0.400 . 1 . . . . 549 MET CG . 7033 1 234 . 2 2 9 9 MET CE C 13 14.596 0.400 . 1 . . . . 549 MET CE . 7033 1 235 . 2 2 9 9 MET N N 15 122.284 0.400 . 1 . . . . 549 MET N . 7033 1 236 . 2 2 10 10 LEU H H 1 7.695 0.020 . 1 . . . . 550 LEU H . 7033 1 237 . 2 2 10 10 LEU HA H 1 4.005 0.020 . 1 . . . . 550 LEU HA . 7033 1 238 . 2 2 10 10 LEU HB2 H 1 1.658 0.020 . 1 . . . . 550 LEU HB2 . 7033 1 239 . 2 2 10 10 LEU HB3 H 1 1.658 0.020 . 1 . . . . 550 LEU HB3 . 7033 1 240 . 2 2 10 10 LEU HG H 1 1.614 0.020 . 1 . . . . 550 LEU HG . 7033 1 241 . 2 2 10 10 LEU HD11 H 1 0.907 0.020 . 2 . . . . 550 LEU HD1 . 7033 1 242 . 2 2 10 10 LEU HD12 H 1 0.907 0.020 . 2 . . . . 550 LEU HD1 . 7033 1 243 . 2 2 10 10 LEU HD13 H 1 0.907 0.020 . 2 . . . . 550 LEU HD1 . 7033 1 244 . 2 2 10 10 LEU HD21 H 1 0.887 0.020 . 2 . . . . 550 LEU HD2 . 7033 1 245 . 2 2 10 10 LEU HD22 H 1 0.887 0.020 . 2 . . . . 550 LEU HD2 . 7033 1 246 . 2 2 10 10 LEU HD23 H 1 0.887 0.020 . 2 . . . . 550 LEU HD2 . 7033 1 247 . 2 2 10 10 LEU CA C 13 55.086 0.400 . 1 . . . . 550 LEU CA . 7033 1 248 . 2 2 10 10 LEU CB C 13 40.109 0.400 . 1 . . . . 550 LEU CB . 7033 1 249 . 2 2 10 10 LEU CD1 C 13 23.367 0.400 . 1 . . . . 550 LEU CD1 . 7033 1 250 . 2 2 10 10 LEU CD2 C 13 22.642 0.400 . 1 . . . . 550 LEU CD2 . 7033 1 251 . 2 2 10 10 LEU N N 15 118.618 0.400 . 1 . . . . 550 LEU N . 7033 1 252 . 2 2 11 11 ALA H H 1 7.707 0.020 . 1 . . . . 551 ALA H . 7033 1 253 . 2 2 11 11 ALA HA H 1 4.035 0.020 . 1 . . . . 551 ALA HA . 7033 1 254 . 2 2 11 11 ALA HB1 H 1 1.437 0.020 . 1 . . . . 551 ALA HB . 7033 1 255 . 2 2 11 11 ALA HB2 H 1 1.437 0.020 . 1 . . . . 551 ALA HB . 7033 1 256 . 2 2 11 11 ALA HB3 H 1 1.437 0.020 . 1 . . . . 551 ALA HB . 7033 1 257 . 2 2 11 11 ALA CA C 13 51.913 0.400 . 1 . . . . 551 ALA CA . 7033 1 258 . 2 2 11 11 ALA CB C 13 16.198 0.400 . 1 . . . . 551 ALA CB . 7033 1 259 . 2 2 11 11 ALA N N 15 116.904 0.400 . 1 . . . . 551 ALA N . 7033 1 260 . 2 2 12 12 SER H H 1 7.354 0.020 . 1 . . . . 552 SER H . 7033 1 261 . 2 2 12 12 SER HA H 1 4.375 0.020 . 1 . . . . 552 SER HA . 7033 1 262 . 2 2 12 12 SER HB2 H 1 3.931 0.020 . 2 . . . . 552 SER HB2 . 7033 1 263 . 2 2 12 12 SER HB3 H 1 3.960 0.020 . 2 . . . . 552 SER HB3 . 7033 1 264 . 2 2 12 12 SER CA C 13 56.445 0.400 . 1 . . . . 552 SER CA . 7033 1 265 . 2 2 12 12 SER CB C 13 61.675 0.400 . 1 . . . . 552 SER CB . 7033 1 266 . 2 2 12 12 SER N N 15 110.402 0.400 . 1 . . . . 552 SER N . 7033 1 267 . 2 2 13 13 ALA H H 1 7.601 0.020 . 1 . . . . 553 ALA H . 7033 1 268 . 2 2 13 13 ALA HA H 1 4.848 0.020 . 1 . . . . 553 ALA HA . 7033 1 269 . 2 2 13 13 ALA HB1 H 1 1.386 0.020 . 1 . . . . 553 ALA HB . 7033 1 270 . 2 2 13 13 ALA HB2 H 1 1.386 0.020 . 1 . . . . 553 ALA HB . 7033 1 271 . 2 2 13 13 ALA HB3 H 1 1.386 0.020 . 1 . . . . 553 ALA HB . 7033 1 272 . 2 2 13 13 ALA CA C 13 47.099 0.400 . 1 . . . . 553 ALA CA . 7033 1 273 . 2 2 13 13 ALA CB C 13 16.851 0.400 . 1 . . . . 553 ALA CB . 7033 1 274 . 2 2 13 13 ALA N N 15 126.744 0.400 . 1 . . . . 553 ALA N . 7033 1 275 . 2 2 14 14 PRO HA H 1 4.771 0.020 . 1 . . . . 554 PRO HA . 7033 1 276 . 2 2 14 14 PRO HB2 H 1 1.994 0.020 . 2 . . . . 554 PRO HB2 . 7033 1 277 . 2 2 14 14 PRO HB3 H 1 2.499 0.020 . 2 . . . . 554 PRO HB3 . 7033 1 278 . 2 2 14 14 PRO HG2 H 1 2.062 0.020 . 2 . . . . 554 PRO HG2 . 7033 1 279 . 2 2 14 14 PRO HG3 H 1 2.101 0.020 . 2 . . . . 554 PRO HG3 . 7033 1 280 . 2 2 14 14 PRO HD2 H 1 3.669 0.020 . 2 . . . . 554 PRO HD2 . 7033 1 281 . 2 2 14 14 PRO HD3 H 1 3.908 0.020 . 2 . . . . 554 PRO HD3 . 7033 1 282 . 2 2 14 14 PRO CA C 13 58.979 0.400 . 1 . . . . 554 PRO CA . 7033 1 283 . 2 2 15 15 PRO HA H 1 4.125 0.020 . 1 . . . . 555 PRO HA . 7033 1 284 . 2 2 15 15 PRO HB2 H 1 2.024 0.020 . 2 . . . . 555 PRO HB2 . 7033 1 285 . 2 2 15 15 PRO HB3 H 1 2.403 0.020 . 2 . . . . 555 PRO HB3 . 7033 1 286 . 2 2 15 15 PRO HG2 H 1 2.040 0.020 . 2 . . . . 555 PRO HG2 . 7033 1 287 . 2 2 15 15 PRO HG3 H 1 2.216 0.020 . 2 . . . . 555 PRO HG3 . 7033 1 288 . 2 2 15 15 PRO HD2 H 1 3.809 0.020 . 2 . . . . 555 PRO HD2 . 7033 1 289 . 2 2 15 15 PRO HD3 H 1 3.909 0.020 . 2 . . . . 555 PRO HD3 . 7033 1 290 . 2 2 15 15 PRO CA C 13 63.936 0.400 . 1 . . . . 555 PRO CA . 7033 1 291 . 2 2 15 15 PRO CB C 13 29.726 0.400 . 1 . . . . 555 PRO CB . 7033 1 292 . 2 2 15 15 PRO CG C 13 25.259 0.400 . 1 . . . . 555 PRO CG . 7033 1 293 . 2 2 15 15 PRO CD C 13 47.890 0.400 . 1 . . . . 555 PRO CD . 7033 1 294 . 2 2 16 16 GLN H H 1 9.186 0.020 . 1 . . . . 556 GLN H . 7033 1 295 . 2 2 16 16 GLN HA H 1 4.184 0.020 . 1 . . . . 556 GLN HA . 7033 1 296 . 2 2 16 16 GLN HB2 H 1 2.119 0.020 . 1 . . . . 556 GLN HB2 . 7033 1 297 . 2 2 16 16 GLN HB3 H 1 2.119 0.020 . 1 . . . . 556 GLN HB3 . 7033 1 298 . 2 2 16 16 GLN HG2 H 1 2.357 0.020 . 2 . . . . 556 GLN HG2 . 7033 1 299 . 2 2 16 16 GLN HG3 H 1 2.490 0.020 . 2 . . . . 556 GLN HG3 . 7033 1 300 . 2 2 16 16 GLN HE21 H 1 7.461 0.020 . 2 . . . . 556 GLN HE21 . 7033 1 301 . 2 2 16 16 GLN HE22 H 1 6.633 0.020 . 2 . . . . 556 GLN HE22 . 7033 1 302 . 2 2 16 16 GLN CA C 13 56.428 0.400 . 1 . . . . 556 GLN CA . 7033 1 303 . 2 2 16 16 GLN CB C 13 25.164 0.400 . 1 . . . . 556 GLN CB . 7033 1 304 . 2 2 16 16 GLN CG C 13 31.514 0.400 . 1 . . . . 556 GLN CG . 7033 1 305 . 2 2 16 16 GLN N N 15 116.360 0.400 . 1 . . . . 556 GLN N . 7033 1 306 . 2 2 16 16 GLN NE2 N 15 110.672 0.400 . 1 . . . . 556 GLN NE2 . 7033 1 307 . 2 2 17 17 GLU H H 1 7.554 0.020 . 1 . . . . 557 GLU H . 7033 1 308 . 2 2 17 17 GLU HA H 1 4.286 0.020 . 1 . . . . 557 GLU HA . 7033 1 309 . 2 2 17 17 GLU HB2 H 1 2.028 0.020 . 2 . . . . 557 GLU HB2 . 7033 1 310 . 2 2 17 17 GLU HB3 H 1 2.155 0.020 . 2 . . . . 557 GLU HB3 . 7033 1 311 . 2 2 17 17 GLU HG2 H 1 2.310 0.020 . 2 . . . . 557 GLU HG2 . 7033 1 312 . 2 2 17 17 GLU HG3 H 1 2.540 0.020 . 2 . . . . 557 GLU HG3 . 7033 1 313 . 2 2 17 17 GLU CA C 13 55.850 0.400 . 1 . . . . 557 GLU CA . 7033 1 314 . 2 2 17 17 GLU CB C 13 27.494 0.400 . 1 . . . . 557 GLU CB . 7033 1 315 . 2 2 17 17 GLU CG C 13 33.972 0.400 . 1 . . . . 557 GLU CG . 7033 1 316 . 2 2 17 17 GLU N N 15 120.277 0.400 . 1 . . . . 557 GLU N . 7033 1 317 . 2 2 18 18 GLN H H 1 7.989 0.020 . 1 . . . . 558 GLN H . 7033 1 318 . 2 2 18 18 GLN HA H 1 3.916 0.020 . 1 . . . . 558 GLN HA . 7033 1 319 . 2 2 18 18 GLN HB2 H 1 1.868 0.020 . 2 . . . . 558 GLN HB2 . 7033 1 320 . 2 2 18 18 GLN HB3 H 1 2.308 0.020 . 2 . . . . 558 GLN HB3 . 7033 1 321 . 2 2 18 18 GLN HG2 H 1 2.582 0.020 . 1 . . . . 558 GLN HG2 . 7033 1 322 . 2 2 18 18 GLN HG3 H 1 2.582 0.020 . 1 . . . . 558 GLN HG3 . 7033 1 323 . 2 2 18 18 GLN HE21 H 1 7.535 0.020 . 2 . . . . 558 GLN HE21 . 7033 1 324 . 2 2 18 18 GLN HE22 H 1 6.643 0.020 . 2 . . . . 558 GLN HE22 . 7033 1 325 . 2 2 18 18 GLN CA C 13 57.504 0.400 . 1 . . . . 558 GLN CA . 7033 1 326 . 2 2 18 18 GLN CB C 13 25.999 0.400 . 1 . . . . 558 GLN CB . 7033 1 327 . 2 2 18 18 GLN CG C 13 31.679 0.400 . 1 . . . . 558 GLN CG . 7033 1 328 . 2 2 18 18 GLN N N 15 119.133 0.400 . 1 . . . . 558 GLN N . 7033 1 329 . 2 2 18 18 GLN NE2 N 15 111.606 0.400 . 1 . . . . 558 GLN NE2 . 7033 1 330 . 2 2 19 19 LYS H H 1 7.474 0.020 . 1 . . . . 559 LYS H . 7033 1 331 . 2 2 19 19 LYS HA H 1 3.992 0.020 . 1 . . . . 559 LYS HA . 7033 1 332 . 2 2 19 19 LYS HB2 H 1 1.831 0.020 . 2 . . . . 559 LYS HB2 . 7033 1 333 . 2 2 19 19 LYS HB3 H 1 2.150 0.020 . 2 . . . . 559 LYS HB3 . 7033 1 334 . 2 2 19 19 LYS CA C 13 55.453 0.400 . 1 . . . . 559 LYS CA . 7033 1 335 . 2 2 19 19 LYS CB C 13 29.559 0.400 . 1 . . . . 559 LYS CB . 7033 1 336 . 2 2 19 19 LYS N N 15 113.428 0.400 . 1 . . . . 559 LYS N . 7033 1 337 . 2 2 20 20 GLN H H 1 7.581 0.020 . 1 . . . . 560 GLN H . 7033 1 338 . 2 2 20 20 GLN HA H 1 4.060 0.020 . 1 . . . . 560 GLN HA . 7033 1 339 . 2 2 20 20 GLN HB2 H 1 2.294 0.020 . 2 . . . . 560 GLN HB2 . 7033 1 340 . 2 2 20 20 GLN HB3 H 1 2.329 0.020 . 2 . . . . 560 GLN HB3 . 7033 1 341 . 2 2 20 20 GLN HG2 H 1 2.530 0.020 . 1 . . . . 560 GLN HG2 . 7033 1 342 . 2 2 20 20 GLN HG3 H 1 2.530 0.020 . 1 . . . . 560 GLN HG3 . 7033 1 343 . 2 2 20 20 GLN CA C 13 57.057 0.400 . 1 . . . . 560 GLN CA . 7033 1 344 . 2 2 20 20 GLN CB C 13 25.447 0.400 . 1 . . . . 560 GLN CB . 7033 1 345 . 2 2 20 20 GLN CG C 13 30.937 0.400 . 1 . . . . 560 GLN CG . 7033 1 346 . 2 2 20 20 GLN N N 15 118.870 0.400 . 1 . . . . 560 GLN N . 7033 1 347 . 2 2 21 21 MET H H 1 8.372 0.020 . 1 . . . . 561 MET H . 7033 1 348 . 2 2 21 21 MET HA H 1 4.000 0.020 . 1 . . . . 561 MET HA . 7033 1 349 . 2 2 21 21 MET HB2 H 1 2.005 0.020 . 2 . . . . 561 MET HB2 . 7033 1 350 . 2 2 21 21 MET HB3 H 1 2.202 0.020 . 2 . . . . 561 MET HB3 . 7033 1 351 . 2 2 21 21 MET HG2 H 1 2.576 0.020 . 2 . . . . 561 MET HG2 . 7033 1 352 . 2 2 21 21 MET HG3 H 1 2.769 0.020 . 2 . . . . 561 MET HG3 . 7033 1 353 . 2 2 21 21 MET HE1 H 1 1.993 0.020 . 1 . . . . 561 MET HE . 7033 1 354 . 2 2 21 21 MET HE2 H 1 1.993 0.020 . 1 . . . . 561 MET HE . 7033 1 355 . 2 2 21 21 MET HE3 H 1 1.993 0.020 . 1 . . . . 561 MET HE . 7033 1 356 . 2 2 21 21 MET CA C 13 56.960 0.400 . 1 . . . . 561 MET CA . 7033 1 357 . 2 2 21 21 MET CB C 13 31.497 0.400 . 1 . . . . 561 MET CB . 7033 1 358 . 2 2 21 21 MET CG C 13 29.646 0.400 . 1 . . . . 561 MET CG . 7033 1 359 . 2 2 21 21 MET CE C 13 14.408 0.400 . 1 . . . . 561 MET CE . 7033 1 360 . 2 2 21 21 MET N N 15 117.705 0.400 . 1 . . . . 561 MET N . 7033 1 361 . 2 2 22 22 LEU H H 1 7.760 0.020 . 1 . . . . 562 LEU H . 7033 1 362 . 2 2 22 22 LEU HA H 1 3.817 0.020 . 1 . . . . 562 LEU HA . 7033 1 363 . 2 2 22 22 LEU HB2 H 1 0.995 0.020 . 2 . . . . 562 LEU HB2 . 7033 1 364 . 2 2 22 22 LEU HB3 H 1 1.851 0.020 . 2 . . . . 562 LEU HB3 . 7033 1 365 . 2 2 22 22 LEU HG H 1 1.631 0.020 . 1 . . . . 562 LEU HG . 7033 1 366 . 2 2 22 22 LEU HD11 H 1 0.773 0.020 . 2 . . . . 562 LEU HD1 . 7033 1 367 . 2 2 22 22 LEU HD12 H 1 0.773 0.020 . 2 . . . . 562 LEU HD1 . 7033 1 368 . 2 2 22 22 LEU HD13 H 1 0.773 0.020 . 2 . . . . 562 LEU HD1 . 7033 1 369 . 2 2 22 22 LEU HD21 H 1 0.686 0.020 . 2 . . . . 562 LEU HD2 . 7033 1 370 . 2 2 22 22 LEU HD22 H 1 0.686 0.020 . 2 . . . . 562 LEU HD2 . 7033 1 371 . 2 2 22 22 LEU HD23 H 1 0.686 0.020 . 2 . . . . 562 LEU HD2 . 7033 1 372 . 2 2 22 22 LEU CA C 13 55.584 0.400 . 1 . . . . 562 LEU CA . 7033 1 373 . 2 2 22 22 LEU CB C 13 40.010 0.400 . 1 . . . . 562 LEU CB . 7033 1 374 . 2 2 22 22 LEU CD1 C 13 23.691 0.400 . 1 . . . . 562 LEU CD1 . 7033 1 375 . 2 2 22 22 LEU CD2 C 13 21.419 0.400 . 1 . . . . 562 LEU CD2 . 7033 1 376 . 2 2 22 22 LEU N N 15 118.885 0.400 . 1 . . . . 562 LEU N . 7033 1 377 . 2 2 23 23 GLY H H 1 8.903 0.020 . 1 . . . . 563 GLY H . 7033 1 378 . 2 2 23 23 GLY HA2 H 1 2.648 0.020 . 2 . . . . 563 GLY HA2 . 7033 1 379 . 2 2 23 23 GLY HA3 H 1 2.928 0.020 . 2 . . . . 563 GLY HA3 . 7033 1 380 . 2 2 23 23 GLY CA C 13 45.495 0.400 . 1 . . . . 563 GLY CA . 7033 1 381 . 2 2 23 23 GLY N N 15 109.080 0.400 . 1 . . . . 563 GLY N . 7033 1 382 . 2 2 24 24 GLU H H 1 8.382 0.020 . 1 . . . . 564 GLU H . 7033 1 383 . 2 2 24 24 GLU HA H 1 4.163 0.020 . 1 . . . . 564 GLU HA . 7033 1 384 . 2 2 24 24 GLU HB2 H 1 2.164 0.020 . 2 . . . . 564 GLU HB2 . 7033 1 385 . 2 2 24 24 GLU HB3 H 1 2.233 0.020 . 2 . . . . 564 GLU HB3 . 7033 1 386 . 2 2 24 24 GLU HG2 H 1 2.608 0.020 . 2 . . . . 564 GLU HG2 . 7033 1 387 . 2 2 24 24 GLU HG3 H 1 2.736 0.020 . 2 . . . . 564 GLU HG3 . 7033 1 388 . 2 2 24 24 GLU CA C 13 56.539 0.400 . 1 . . . . 564 GLU CA . 7033 1 389 . 2 2 24 24 GLU CB C 13 27.074 0.400 . 1 . . . . 564 GLU CB . 7033 1 390 . 2 2 24 24 GLU CG C 13 33.815 0.400 . 1 . . . . 564 GLU CG . 7033 1 391 . 2 2 24 24 GLU N N 15 118.701 0.400 . 1 . . . . 564 GLU N . 7033 1 392 . 2 2 25 25 ARG H H 1 7.069 0.020 . 1 . . . . 565 ARG H . 7033 1 393 . 2 2 25 25 ARG HA H 1 4.339 0.020 . 1 . . . . 565 ARG HA . 7033 1 394 . 2 2 25 25 ARG HB2 H 1 1.840 0.020 . 2 . . . . 565 ARG HB2 . 7033 1 395 . 2 2 25 25 ARG HB3 H 1 2.012 0.020 . 2 . . . . 565 ARG HB3 . 7033 1 396 . 2 2 25 25 ARG HG2 H 1 1.767 0.020 . 2 . . . . 565 ARG HG2 . 7033 1 397 . 2 2 25 25 ARG HG3 H 1 1.852 0.020 . 2 . . . . 565 ARG HG3 . 7033 1 398 . 2 2 25 25 ARG HD2 H 1 3.134 0.020 . 2 . . . . 565 ARG HD2 . 7033 1 399 . 2 2 25 25 ARG HD3 H 1 3.210 0.020 . 2 . . . . 565 ARG HD3 . 7033 1 400 . 2 2 25 25 ARG CA C 13 54.052 0.400 . 1 . . . . 565 ARG CA . 7033 1 401 . 2 2 25 25 ARG CB C 13 28.335 0.400 . 1 . . . . 565 ARG CB . 7033 1 402 . 2 2 25 25 ARG CG C 13 24.998 0.400 . 1 . . . . 565 ARG CG . 7033 1 403 . 2 2 25 25 ARG CD C 13 40.073 0.400 . 1 . . . . 565 ARG CD . 7033 1 404 . 2 2 25 25 ARG N N 15 115.063 0.400 . 1 . . . . 565 ARG N . 7033 1 405 . 2 2 26 26 LEU H H 1 8.337 0.020 . 1 . . . . 566 LEU H . 7033 1 406 . 2 2 26 26 LEU HA H 1 3.953 0.020 . 1 . . . . 566 LEU HA . 7033 1 407 . 2 2 26 26 LEU HB2 H 1 1.319 0.020 . 2 . . . . 566 LEU HB2 . 7033 1 408 . 2 2 26 26 LEU HB3 H 1 1.666 0.020 . 2 . . . . 566 LEU HB3 . 7033 1 409 . 2 2 26 26 LEU HG H 1 1.645 0.020 . 1 . . . . 566 LEU HG . 7033 1 410 . 2 2 26 26 LEU HD11 H 1 0.689 0.020 . 2 . . . . 566 LEU HD1 . 7033 1 411 . 2 2 26 26 LEU HD12 H 1 0.689 0.020 . 2 . . . . 566 LEU HD1 . 7033 1 412 . 2 2 26 26 LEU HD13 H 1 0.689 0.020 . 2 . . . . 566 LEU HD1 . 7033 1 413 . 2 2 26 26 LEU HD21 H 1 0.727 0.020 . 2 . . . . 566 LEU HD2 . 7033 1 414 . 2 2 26 26 LEU HD22 H 1 0.727 0.020 . 2 . . . . 566 LEU HD2 . 7033 1 415 . 2 2 26 26 LEU HD23 H 1 0.727 0.020 . 2 . . . . 566 LEU HD2 . 7033 1 416 . 2 2 26 26 LEU CA C 13 54.921 0.400 . 1 . . . . 566 LEU CA . 7033 1 417 . 2 2 26 26 LEU CB C 13 41.797 0.400 . 1 . . . . 566 LEU CB . 7033 1 418 . 2 2 26 26 LEU CD1 C 13 23.930 0.400 . 1 . . . . 566 LEU CD1 . 7033 1 419 . 2 2 26 26 LEU CD2 C 13 21.917 0.400 . 1 . . . . 566 LEU CD2 . 7033 1 420 . 2 2 26 26 LEU N N 15 119.554 0.400 . 1 . . . . 566 LEU N . 7033 1 421 . 2 2 27 27 PHE H H 1 8.612 0.020 . 1 . . . . 567 PHE H . 7033 1 422 . 2 2 27 27 PHE HA H 1 4.286 0.020 . 1 . . . . 567 PHE HA . 7033 1 423 . 2 2 27 27 PHE HB2 H 1 3.194 0.020 . 1 . . . . 567 PHE HB2 . 7033 1 424 . 2 2 27 27 PHE HB3 H 1 3.194 0.020 . 1 . . . . 567 PHE HB3 . 7033 1 425 . 2 2 27 27 PHE HD1 H 1 6.989 0.020 . 1 . . . . 567 PHE HD1 . 7033 1 426 . 2 2 27 27 PHE HD2 H 1 6.989 0.020 . 1 . . . . 567 PHE HD2 . 7033 1 427 . 2 2 27 27 PHE HE1 H 1 7.248 0.020 . 1 . . . . 567 PHE HE1 . 7033 1 428 . 2 2 27 27 PHE HE2 H 1 7.248 0.020 . 1 . . . . 567 PHE HE2 . 7033 1 429 . 2 2 27 27 PHE HZ H 1 7.127 0.020 . 1 . . . . 567 PHE HZ . 7033 1 430 . 2 2 27 27 PHE CA C 13 61.260 0.400 . 1 . . . . 567 PHE CA . 7033 1 431 . 2 2 27 27 PHE CB C 13 34.419 0.400 . 1 . . . . 567 PHE CB . 7033 1 432 . 2 2 27 27 PHE N N 15 117.541 0.400 . 1 . . . . 567 PHE N . 7033 1 433 . 2 2 28 28 PRO HA H 1 4.305 0.020 . 1 . . . . 568 PRO HA . 7033 1 434 . 2 2 28 28 PRO HB2 H 1 1.879 0.020 . 2 . . . . 568 PRO HB2 . 7033 1 435 . 2 2 28 28 PRO HB3 H 1 2.434 0.020 . 2 . . . . 568 PRO HB3 . 7033 1 436 . 2 2 28 28 PRO HG2 H 1 2.169 0.020 . 1 . . . . 568 PRO HG2 . 7033 1 437 . 2 2 28 28 PRO HG3 H 1 2.169 0.020 . 1 . . . . 568 PRO HG3 . 7033 1 438 . 2 2 28 28 PRO HD2 H 1 3.889 0.020 . 1 . . . . 568 PRO HD2 . 7033 1 439 . 2 2 28 28 PRO HD3 H 1 3.889 0.020 . 1 . . . . 568 PRO HD3 . 7033 1 440 . 2 2 28 28 PRO CA C 13 63.299 0.400 . 1 . . . . 568 PRO CA . 7033 1 441 . 2 2 28 28 PRO CB C 13 28.491 0.400 . 1 . . . . 568 PRO CB . 7033 1 442 . 2 2 28 28 PRO CG C 13 26.155 0.400 . 1 . . . . 568 PRO CG . 7033 1 443 . 2 2 28 28 PRO CD C 13 47.998 0.400 . 1 . . . . 568 PRO CD . 7033 1 444 . 2 2 29 29 LEU H H 1 6.806 0.020 . 1 . . . . 569 LEU H . 7033 1 445 . 2 2 29 29 LEU HA H 1 4.061 0.020 . 1 . . . . 569 LEU HA . 7033 1 446 . 2 2 29 29 LEU HB2 H 1 1.337 0.020 . 2 . . . . 569 LEU HB2 . 7033 1 447 . 2 2 29 29 LEU HB3 H 1 2.008 0.020 . 2 . . . . 569 LEU HB3 . 7033 1 448 . 2 2 29 29 LEU HG H 1 1.859 0.020 . 1 . . . . 569 LEU HG . 7033 1 449 . 2 2 29 29 LEU HD11 H 1 0.922 0.020 . 2 . . . . 569 LEU HD1 . 7033 1 450 . 2 2 29 29 LEU HD12 H 1 0.922 0.020 . 2 . . . . 569 LEU HD1 . 7033 1 451 . 2 2 29 29 LEU HD13 H 1 0.922 0.020 . 2 . . . . 569 LEU HD1 . 7033 1 452 . 2 2 29 29 LEU HD21 H 1 0.849 0.020 . 2 . . . . 569 LEU HD2 . 7033 1 453 . 2 2 29 29 LEU HD22 H 1 0.849 0.020 . 2 . . . . 569 LEU HD2 . 7033 1 454 . 2 2 29 29 LEU HD23 H 1 0.849 0.020 . 2 . . . . 569 LEU HD2 . 7033 1 455 . 2 2 29 29 LEU CA C 13 54.587 0.400 . 1 . . . . 569 LEU CA . 7033 1 456 . 2 2 29 29 LEU CB C 13 39.058 0.400 . 1 . . . . 569 LEU CB . 7033 1 457 . 2 2 29 29 LEU CD1 C 13 23.591 0.400 . 1 . . . . 569 LEU CD1 . 7033 1 458 . 2 2 29 29 LEU CD2 C 13 19.468 0.400 . 1 . . . . 569 LEU CD2 . 7033 1 459 . 2 2 29 29 LEU N N 15 116.505 0.400 . 1 . . . . 569 LEU N . 7033 1 460 . 2 2 30 30 ILE H H 1 7.822 0.020 . 1 . . . . 570 ILE H . 7033 1 461 . 2 2 30 30 ILE HA H 1 3.666 0.020 . 1 . . . . 570 ILE HA . 7033 1 462 . 2 2 30 30 ILE HB H 1 1.667 0.020 . 1 . . . . 570 ILE HB . 7033 1 463 . 2 2 30 30 ILE HG12 H 1 0.891 0.020 . 2 . . . . 570 ILE HG12 . 7033 1 464 . 2 2 30 30 ILE HG13 H 1 1.715 0.020 . 2 . . . . 570 ILE HG13 . 7033 1 465 . 2 2 30 30 ILE HG21 H 1 0.872 0.020 . 1 . . . . 570 ILE HG2 . 7033 1 466 . 2 2 30 30 ILE HG22 H 1 0.872 0.020 . 1 . . . . 570 ILE HG2 . 7033 1 467 . 2 2 30 30 ILE HG23 H 1 0.872 0.020 . 1 . . . . 570 ILE HG2 . 7033 1 468 . 2 2 30 30 ILE HD11 H 1 0.763 0.020 . 1 . . . . 570 ILE HD1 . 7033 1 469 . 2 2 30 30 ILE HD12 H 1 0.763 0.020 . 1 . . . . 570 ILE HD1 . 7033 1 470 . 2 2 30 30 ILE HD13 H 1 0.763 0.020 . 1 . . . . 570 ILE HD1 . 7033 1 471 . 2 2 30 30 ILE CA C 13 61.701 0.400 . 1 . . . . 570 ILE CA . 7033 1 472 . 2 2 30 30 ILE CB C 13 34.895 0.400 . 1 . . . . 570 ILE CB . 7033 1 473 . 2 2 30 30 ILE CG2 C 13 16.001 0.400 . 1 . . . . 570 ILE CG2 . 7033 1 474 . 2 2 30 30 ILE CD1 C 13 11.952 0.400 . 1 . . . . 570 ILE CD1 . 7033 1 475 . 2 2 30 30 ILE N N 15 119.786 0.400 . 1 . . . . 570 ILE N . 7033 1 476 . 2 2 31 31 GLN H H 1 8.978 0.020 . 1 . . . . 571 GLN H . 7033 1 477 . 2 2 31 31 GLN HA H 1 3.495 0.020 . 1 . . . . 571 GLN HA . 7033 1 478 . 2 2 31 31 GLN HB2 H 1 1.229 0.020 . 2 . . . . 571 GLN HB2 . 7033 1 479 . 2 2 31 31 GLN HB3 H 1 1.824 0.020 . 2 . . . . 571 GLN HB3 . 7033 1 480 . 2 2 31 31 GLN HG2 H 1 2.106 0.020 . 1 . . . . 571 GLN HG2 . 7033 1 481 . 2 2 31 31 GLN HG3 H 1 2.106 0.020 . 1 . . . . 571 GLN HG3 . 7033 1 482 . 2 2 31 31 GLN CA C 13 56.214 0.400 . 1 . . . . 571 GLN CA . 7033 1 483 . 2 2 31 31 GLN CB C 13 26.029 0.400 . 1 . . . . 571 GLN CB . 7033 1 484 . 2 2 31 31 GLN CG C 13 31.524 0.400 . 1 . . . . 571 GLN CG . 7033 1 485 . 2 2 31 31 GLN N N 15 123.064 0.400 . 1 . . . . 571 GLN N . 7033 1 486 . 2 2 32 32 ALA H H 1 6.748 0.020 . 1 . . . . 572 ALA H . 7033 1 487 . 2 2 32 32 ALA HA H 1 4.043 0.020 . 1 . . . . 572 ALA HA . 7033 1 488 . 2 2 32 32 ALA HB1 H 1 1.390 0.020 . 1 . . . . 572 ALA HB . 7033 1 489 . 2 2 32 32 ALA HB2 H 1 1.390 0.020 . 1 . . . . 572 ALA HB . 7033 1 490 . 2 2 32 32 ALA HB3 H 1 1.390 0.020 . 1 . . . . 572 ALA HB . 7033 1 491 . 2 2 32 32 ALA CA C 13 51.493 0.400 . 1 . . . . 572 ALA CA . 7033 1 492 . 2 2 32 32 ALA CB C 13 15.989 0.400 . 1 . . . . 572 ALA CB . 7033 1 493 . 2 2 32 32 ALA N N 15 115.817 0.400 . 1 . . . . 572 ALA N . 7033 1 494 . 2 2 33 33 MET H H 1 7.162 0.020 . 1 . . . . 573 MET H . 7033 1 495 . 2 2 33 33 MET HA H 1 4.134 0.020 . 1 . . . . 573 MET HA . 7033 1 496 . 2 2 33 33 MET HB2 H 1 1.805 0.020 . 2 . . . . 573 MET HB2 . 7033 1 497 . 2 2 33 33 MET HB3 H 1 2.074 0.020 . 2 . . . . 573 MET HB3 . 7033 1 498 . 2 2 33 33 MET HG2 H 1 2.462 0.020 . 2 . . . . 573 MET HG2 . 7033 1 499 . 2 2 33 33 MET HG3 H 1 2.710 0.020 . 2 . . . . 573 MET HG3 . 7033 1 500 . 2 2 33 33 MET HE1 H 1 2.001 0.020 . 1 . . . . 573 MET HE . 7033 1 501 . 2 2 33 33 MET HE2 H 1 2.001 0.020 . 1 . . . . 573 MET HE . 7033 1 502 . 2 2 33 33 MET HE3 H 1 2.001 0.020 . 1 . . . . 573 MET HE . 7033 1 503 . 2 2 33 33 MET CA C 13 55.044 0.400 . 1 . . . . 573 MET CA . 7033 1 504 . 2 2 33 33 MET CB C 13 33.001 0.400 . 1 . . . . 573 MET CB . 7033 1 505 . 2 2 33 33 MET CE C 13 15.217 0.400 . 1 . . . . 573 MET CE . 7033 1 506 . 2 2 33 33 MET N N 15 114.757 0.400 . 1 . . . . 573 MET N . 7033 1 507 . 2 2 34 34 HIS H H 1 8.045 0.020 . 1 . . . . 574 HIS H . 7033 1 508 . 2 2 34 34 HIS HA H 1 4.845 0.020 . 1 . . . . 574 HIS HA . 7033 1 509 . 2 2 34 34 HIS HB2 H 1 2.453 0.020 . 2 . . . . 574 HIS HB2 . 7033 1 510 . 2 2 34 34 HIS HB3 H 1 2.850 0.020 . 2 . . . . 574 HIS HB3 . 7033 1 511 . 2 2 34 34 HIS HD2 H 1 8.181 0.020 . 1 . . . . 574 HIS HD2 . 7033 1 512 . 2 2 34 34 HIS CA C 13 51.478 0.400 . 1 . . . . 574 HIS CA . 7033 1 513 . 2 2 34 34 HIS CB C 13 30.230 0.400 . 1 . . . . 574 HIS CB . 7033 1 514 . 2 2 34 34 HIS N N 15 115.882 0.400 . 1 . . . . 574 HIS N . 7033 1 515 . 2 2 35 35 PRO HA H 1 4.382 0.020 . 1 . . . . 575 PRO HA . 7033 1 516 . 2 2 35 35 PRO HB2 H 1 2.033 0.020 . 2 . . . . 575 PRO HB2 . 7033 1 517 . 2 2 35 35 PRO HB3 H 1 2.457 0.020 . 2 . . . . 575 PRO HB3 . 7033 1 518 . 2 2 35 35 PRO HG2 H 1 2.083 0.020 . 1 . . . . 575 PRO HG2 . 7033 1 519 . 2 2 35 35 PRO HG3 H 1 2.083 0.020 . 1 . . . . 575 PRO HG3 . 7033 1 520 . 2 2 35 35 PRO HD2 H 1 3.317 0.020 . 2 . . . . 575 PRO HD2 . 7033 1 521 . 2 2 35 35 PRO HD3 H 1 3.719 0.020 . 2 . . . . 575 PRO HD3 . 7033 1 522 . 2 2 35 35 PRO CA C 13 63.546 0.400 . 1 . . . . 575 PRO CA . 7033 1 523 . 2 2 35 35 PRO CB C 13 29.561 0.400 . 1 . . . . 575 PRO CB . 7033 1 524 . 2 2 35 35 PRO CG C 13 24.871 0.400 . 1 . . . . 575 PRO CG . 7033 1 525 . 2 2 35 35 PRO CD C 13 47.447 0.400 . 1 . . . . 575 PRO CD . 7033 1 526 . 2 2 36 36 THR H H 1 8.237 0.020 . 1 . . . . 576 THR H . 7033 1 527 . 2 2 36 36 THR HA H 1 4.441 0.020 . 1 . . . . 576 THR HA . 7033 1 528 . 2 2 36 36 THR HB H 1 4.377 0.020 . 1 . . . . 576 THR HB . 7033 1 529 . 2 2 36 36 THR HG21 H 1 1.288 0.020 . 1 . . . . 576 THR HG2 . 7033 1 530 . 2 2 36 36 THR HG22 H 1 1.288 0.020 . 1 . . . . 576 THR HG2 . 7033 1 531 . 2 2 36 36 THR HG23 H 1 1.288 0.020 . 1 . . . . 576 THR HG2 . 7033 1 532 . 2 2 36 36 THR CA C 13 61.267 0.400 . 1 . . . . 576 THR CA . 7033 1 533 . 2 2 36 36 THR CB C 13 66.612 0.400 . 1 . . . . 576 THR CB . 7033 1 534 . 2 2 36 36 THR CG2 C 13 19.709 0.400 . 1 . . . . 576 THR CG2 . 7033 1 535 . 2 2 36 36 THR N N 15 107.912 0.400 . 1 . . . . 576 THR N . 7033 1 536 . 2 2 37 37 LEU H H 1 7.432 0.020 . 1 . . . . 577 LEU H . 7033 1 537 . 2 2 37 37 LEU HA H 1 4.810 0.020 . 1 . . . . 577 LEU HA . 7033 1 538 . 2 2 37 37 LEU HB2 H 1 1.351 0.020 . 2 . . . . 577 LEU HB2 . 7033 1 539 . 2 2 37 37 LEU HB3 H 1 1.613 0.020 . 2 . . . . 577 LEU HB3 . 7033 1 540 . 2 2 37 37 LEU HG H 1 1.611 0.020 . 1 . . . . 577 LEU HG . 7033 1 541 . 2 2 37 37 LEU HD11 H 1 0.741 0.020 . 2 . . . . 577 LEU HD1 . 7033 1 542 . 2 2 37 37 LEU HD12 H 1 0.741 0.020 . 2 . . . . 577 LEU HD1 . 7033 1 543 . 2 2 37 37 LEU HD13 H 1 0.741 0.020 . 2 . . . . 577 LEU HD1 . 7033 1 544 . 2 2 37 37 LEU HD21 H 1 0.840 0.020 . 2 . . . . 577 LEU HD2 . 7033 1 545 . 2 2 37 37 LEU HD22 H 1 0.840 0.020 . 2 . . . . 577 LEU HD2 . 7033 1 546 . 2 2 37 37 LEU HD23 H 1 0.840 0.020 . 2 . . . . 577 LEU HD2 . 7033 1 547 . 2 2 37 37 LEU CA C 13 51.629 0.400 . 1 . . . . 577 LEU CA . 7033 1 548 . 2 2 37 37 LEU CB C 13 41.412 0.400 . 1 . . . . 577 LEU CB . 7033 1 549 . 2 2 37 37 LEU CD1 C 13 22.782 0.400 . 1 . . . . 577 LEU CD1 . 7033 1 550 . 2 2 37 37 LEU CD2 C 13 20.163 0.400 . 1 . . . . 577 LEU CD2 . 7033 1 551 . 2 2 37 37 LEU N N 15 119.825 0.400 . 1 . . . . 577 LEU N . 7033 1 552 . 2 2 38 38 ALA H H 1 7.314 0.020 . 1 . . . . 578 ALA H . 7033 1 553 . 2 2 38 38 ALA HA H 1 3.770 0.020 . 1 . . . . 578 ALA HA . 7033 1 554 . 2 2 38 38 ALA HB1 H 1 1.056 0.020 . 1 . . . . 578 ALA HB . 7033 1 555 . 2 2 38 38 ALA HB2 H 1 1.056 0.020 . 1 . . . . 578 ALA HB . 7033 1 556 . 2 2 38 38 ALA HB3 H 1 1.056 0.020 . 1 . . . . 578 ALA HB . 7033 1 557 . 2 2 38 38 ALA CA C 13 53.983 0.400 . 1 . . . . 578 ALA CA . 7033 1 558 . 2 2 38 38 ALA CB C 13 15.745 0.400 . 1 . . . . 578 ALA CB . 7033 1 559 . 2 2 38 38 ALA N N 15 121.621 0.400 . 1 . . . . 578 ALA N . 7033 1 560 . 2 2 39 39 GLY H H 1 9.423 0.020 . 1 . . . . 579 GLY H . 7033 1 561 . 2 2 39 39 GLY HA2 H 1 4.362 0.020 . 1 . . . . 579 GLY HA2 . 7033 1 562 . 2 2 39 39 GLY HA3 H 1 4.362 0.020 . 1 . . . . 579 GLY HA3 . 7033 1 563 . 2 2 39 39 GLY CA C 13 46.115 0.400 . 1 . . . . 579 GLY CA . 7033 1 564 . 2 2 39 39 GLY N N 15 110.672 0.400 . 1 . . . . 579 GLY N . 7033 1 565 . 2 2 40 40 LYS H H 1 8.436 0.020 . 1 . . . . 580 LYS H . 7033 1 566 . 2 2 40 40 LYS HA H 1 4.119 0.020 . 1 . . . . 580 LYS HA . 7033 1 567 . 2 2 40 40 LYS HB2 H 1 1.941 0.020 . 2 . . . . 580 LYS HB2 . 7033 1 568 . 2 2 40 40 LYS HB3 H 1 2.192 0.020 . 2 . . . . 580 LYS HB3 . 7033 1 569 . 2 2 40 40 LYS HG2 H 1 1.775 0.020 . 1 . . . . 580 LYS HG2 . 7033 1 570 . 2 2 40 40 LYS HG3 H 1 1.775 0.020 . 1 . . . . 580 LYS HG3 . 7033 1 571 . 2 2 40 40 LYS HE2 H 1 2.867 0.020 . 1 . . . . 580 LYS HE2 . 7033 1 572 . 2 2 40 40 LYS HE3 H 1 2.867 0.020 . 1 . . . . 580 LYS HE3 . 7033 1 573 . 2 2 40 40 LYS CA C 13 56.114 0.400 . 1 . . . . 580 LYS CA . 7033 1 574 . 2 2 40 40 LYS CB C 13 29.561 0.400 . 1 . . . . 580 LYS CB . 7033 1 575 . 2 2 40 40 LYS CG C 13 25.554 0.400 . 1 . . . . 580 LYS CG . 7033 1 576 . 2 2 40 40 LYS CD C 13 30.720 0.400 . 1 . . . . 580 LYS CD . 7033 1 577 . 2 2 40 40 LYS CE C 13 40.305 0.400 . 1 . . . . 580 LYS CE . 7033 1 578 . 2 2 40 40 LYS N N 15 127.054 0.400 . 1 . . . . 580 LYS N . 7033 1 579 . 2 2 41 41 ILE H H 1 8.787 0.020 . 1 . . . . 581 ILE H . 7033 1 580 . 2 2 41 41 ILE HA H 1 3.684 0.020 . 1 . . . . 581 ILE HA . 7033 1 581 . 2 2 41 41 ILE HB H 1 1.675 0.020 . 1 . . . . 581 ILE HB . 7033 1 582 . 2 2 41 41 ILE HG12 H 1 0.883 0.020 . 2 . . . . 581 ILE HG12 . 7033 1 583 . 2 2 41 41 ILE HG13 H 1 1.565 0.020 . 2 . . . . 581 ILE HG13 . 7033 1 584 . 2 2 41 41 ILE HG21 H 1 0.925 0.020 . 1 . . . . 581 ILE HG2 . 7033 1 585 . 2 2 41 41 ILE HG22 H 1 0.925 0.020 . 1 . . . . 581 ILE HG2 . 7033 1 586 . 2 2 41 41 ILE HG23 H 1 0.925 0.020 . 1 . . . . 581 ILE HG2 . 7033 1 587 . 2 2 41 41 ILE HD11 H 1 0.543 0.020 . 1 . . . . 581 ILE HD1 . 7033 1 588 . 2 2 41 41 ILE HD12 H 1 0.543 0.020 . 1 . . . . 581 ILE HD1 . 7033 1 589 . 2 2 41 41 ILE HD13 H 1 0.543 0.020 . 1 . . . . 581 ILE HD1 . 7033 1 590 . 2 2 41 41 ILE CA C 13 62.288 0.400 . 1 . . . . 581 ILE CA . 7033 1 591 . 2 2 41 41 ILE CB C 13 35.675 0.400 . 1 . . . . 581 ILE CB . 7033 1 592 . 2 2 41 41 ILE CG1 C 13 26.043 0.400 . 1 . . . . 581 ILE CG1 . 7033 1 593 . 2 2 41 41 ILE CG2 C 13 16.644 0.400 . 1 . . . . 581 ILE CG2 . 7033 1 594 . 2 2 41 41 ILE CD1 C 13 12.323 0.400 . 1 . . . . 581 ILE CD1 . 7033 1 595 . 2 2 41 41 ILE N N 15 117.797 0.400 . 1 . . . . 581 ILE N . 7033 1 596 . 2 2 42 42 THR H H 1 8.514 0.020 . 1 . . . . 582 THR H . 7033 1 597 . 2 2 42 42 THR HA H 1 3.545 0.020 . 1 . . . . 582 THR HA . 7033 1 598 . 2 2 42 42 THR HB H 1 4.450 0.020 . 1 . . . . 582 THR HB . 7033 1 599 . 2 2 42 42 THR HG21 H 1 0.903 0.020 . 1 . . . . 582 THR HG2 . 7033 1 600 . 2 2 42 42 THR HG22 H 1 0.903 0.020 . 1 . . . . 582 THR HG2 . 7033 1 601 . 2 2 42 42 THR HG23 H 1 0.903 0.020 . 1 . . . . 582 THR HG2 . 7033 1 602 . 2 2 42 42 THR CA C 13 66.645 0.400 . 1 . . . . 582 THR CA . 7033 1 603 . 2 2 42 42 THR CB C 13 65.602 0.400 . 1 . . . . 582 THR CB . 7033 1 604 . 2 2 42 42 THR CG2 C 13 19.470 0.400 . 1 . . . . 582 THR CG2 . 7033 1 605 . 2 2 42 42 THR N N 15 115.389 0.400 . 1 . . . . 582 THR N . 7033 1 606 . 2 2 43 43 GLY H H 1 7.859 0.020 . 1 . . . . 583 GLY H . 7033 1 607 . 2 2 43 43 GLY HA2 H 1 3.783 0.020 . 2 . . . . 583 GLY HA2 . 7033 1 608 . 2 2 43 43 GLY HA3 H 1 4.514 0.020 . 2 . . . . 583 GLY HA3 . 7033 1 609 . 2 2 43 43 GLY CA C 13 45.084 0.400 . 1 . . . . 583 GLY CA . 7033 1 610 . 2 2 43 43 GLY N N 15 106.214 0.400 . 1 . . . . 583 GLY N . 7033 1 611 . 2 2 44 44 MET H H 1 8.074 0.020 . 1 . . . . 584 MET H . 7033 1 612 . 2 2 44 44 MET HA H 1 3.990 0.020 . 1 . . . . 584 MET HA . 7033 1 613 . 2 2 44 44 MET HB2 H 1 2.271 0.020 . 1 . . . . 584 MET HB2 . 7033 1 614 . 2 2 44 44 MET HB3 H 1 2.271 0.020 . 1 . . . . 584 MET HB3 . 7033 1 615 . 2 2 44 44 MET HG2 H 1 2.755 0.020 . 2 . . . . 584 MET HG2 . 7033 1 616 . 2 2 44 44 MET HG3 H 1 2.845 0.020 . 2 . . . . 584 MET HG3 . 7033 1 617 . 2 2 44 44 MET HE1 H 1 1.784 0.020 . 1 . . . . 584 MET HE . 7033 1 618 . 2 2 44 44 MET HE2 H 1 1.784 0.020 . 1 . . . . 584 MET HE . 7033 1 619 . 2 2 44 44 MET HE3 H 1 1.784 0.020 . 1 . . . . 584 MET HE . 7033 1 620 . 2 2 44 44 MET CA C 13 56.905 0.400 . 1 . . . . 584 MET CA . 7033 1 621 . 2 2 44 44 MET CB C 13 32.158 0.400 . 1 . . . . 584 MET CB . 7033 1 622 . 2 2 44 44 MET CE C 13 15.107 0.400 . 1 . . . . 584 MET CE . 7033 1 623 . 2 2 44 44 MET N N 15 118.946 0.400 . 1 . . . . 584 MET N . 7033 1 624 . 2 2 45 45 LEU H H 1 8.355 0.020 . 1 . . . . 585 LEU H . 7033 1 625 . 2 2 45 45 LEU HA H 1 3.953 0.020 . 1 . . . . 585 LEU HA . 7033 1 626 . 2 2 45 45 LEU HB2 H 1 1.267 0.020 . 2 . . . . 585 LEU HB2 . 7033 1 627 . 2 2 45 45 LEU HB3 H 1 1.737 0.020 . 2 . . . . 585 LEU HB3 . 7033 1 628 . 2 2 45 45 LEU HG H 1 1.772 0.020 . 1 . . . . 585 LEU HG . 7033 1 629 . 2 2 45 45 LEU HD11 H 1 0.724 0.020 . 2 . . . . 585 LEU HD1 . 7033 1 630 . 2 2 45 45 LEU HD12 H 1 0.724 0.020 . 2 . . . . 585 LEU HD1 . 7033 1 631 . 2 2 45 45 LEU HD13 H 1 0.724 0.020 . 2 . . . . 585 LEU HD1 . 7033 1 632 . 2 2 45 45 LEU HD21 H 1 0.607 0.020 . 2 . . . . 585 LEU HD2 . 7033 1 633 . 2 2 45 45 LEU HD22 H 1 0.607 0.020 . 2 . . . . 585 LEU HD2 . 7033 1 634 . 2 2 45 45 LEU HD23 H 1 0.607 0.020 . 2 . . . . 585 LEU HD2 . 7033 1 635 . 2 2 45 45 LEU CA C 13 55.003 0.400 . 1 . . . . 585 LEU CA . 7033 1 636 . 2 2 45 45 LEU CB C 13 38.165 0.400 . 1 . . . . 585 LEU CB . 7033 1 637 . 2 2 45 45 LEU CG C 13 25.608 0.400 . 1 . . . . 585 LEU CG . 7033 1 638 . 2 2 45 45 LEU CD1 C 13 23.193 0.400 . 1 . . . . 585 LEU CD1 . 7033 1 639 . 2 2 45 45 LEU CD2 C 13 21.892 0.400 . 1 . . . . 585 LEU CD2 . 7033 1 640 . 2 2 45 45 LEU N N 15 119.806 0.400 . 1 . . . . 585 LEU N . 7033 1 641 . 2 2 46 46 LEU H H 1 7.845 0.020 . 1 . . . . 586 LEU H . 7033 1 642 . 2 2 46 46 LEU HA H 1 4.064 0.020 . 1 . . . . 586 LEU HA . 7033 1 643 . 2 2 46 46 LEU HB2 H 1 1.553 0.020 . 2 . . . . 586 LEU HB2 . 7033 1 644 . 2 2 46 46 LEU HB3 H 1 1.911 0.020 . 2 . . . . 586 LEU HB3 . 7033 1 645 . 2 2 46 46 LEU HG H 1 1.870 0.020 . 1 . . . . 586 LEU HG . 7033 1 646 . 2 2 46 46 LEU HD11 H 1 0.673 0.020 . 2 . . . . 586 LEU HD1 . 7033 1 647 . 2 2 46 46 LEU HD12 H 1 0.673 0.020 . 2 . . . . 586 LEU HD1 . 7033 1 648 . 2 2 46 46 LEU HD13 H 1 0.673 0.020 . 2 . . . . 586 LEU HD1 . 7033 1 649 . 2 2 46 46 LEU HD21 H 1 0.655 0.020 . 2 . . . . 586 LEU HD2 . 7033 1 650 . 2 2 46 46 LEU HD22 H 1 0.655 0.020 . 2 . . . . 586 LEU HD2 . 7033 1 651 . 2 2 46 46 LEU HD23 H 1 0.655 0.020 . 2 . . . . 586 LEU HD2 . 7033 1 652 . 2 2 46 46 LEU CA C 13 54.110 0.400 . 1 . . . . 586 LEU CA . 7033 1 653 . 2 2 46 46 LEU CB C 13 39.289 0.400 . 1 . . . . 586 LEU CB . 7033 1 654 . 2 2 46 46 LEU CD1 C 13 26.526 0.400 . 1 . . . . 586 LEU CD1 . 7033 1 655 . 2 2 46 46 LEU CD2 C 13 20.812 0.400 . 1 . . . . 586 LEU CD2 . 7033 1 656 . 2 2 46 46 LEU N N 15 115.985 0.400 . 1 . . . . 586 LEU N . 7033 1 657 . 2 2 47 47 GLU H H 1 7.006 0.020 . 1 . . . . 587 GLU H . 7033 1 658 . 2 2 47 47 GLU HA H 1 4.205 0.020 . 1 . . . . 587 GLU HA . 7033 1 659 . 2 2 47 47 GLU HB2 H 1 2.048 0.020 . 2 . . . . 587 GLU HB2 . 7033 1 660 . 2 2 47 47 GLU HB3 H 1 2.277 0.020 . 2 . . . . 587 GLU HB3 . 7033 1 661 . 2 2 47 47 GLU HG2 H 1 2.634 0.020 . 1 . . . . 587 GLU HG2 . 7033 1 662 . 2 2 47 47 GLU HG3 H 1 2.634 0.020 . 1 . . . . 587 GLU HG3 . 7033 1 663 . 2 2 47 47 GLU CA C 13 55.724 0.400 . 1 . . . . 587 GLU CA . 7033 1 664 . 2 2 47 47 GLU CB C 13 27.779 0.400 . 1 . . . . 587 GLU CB . 7033 1 665 . 2 2 47 47 GLU CG C 13 34.914 0.400 . 1 . . . . 587 GLU CG . 7033 1 666 . 2 2 47 47 GLU N N 15 116.012 0.400 . 1 . . . . 587 GLU N . 7033 1 667 . 2 2 48 48 ILE H H 1 7.833 0.020 . 1 . . . . 588 ILE H . 7033 1 668 . 2 2 48 48 ILE HA H 1 3.701 0.020 . 1 . . . . 588 ILE HA . 7033 1 669 . 2 2 48 48 ILE HB H 1 1.810 0.020 . 1 . . . . 588 ILE HB . 7033 1 670 . 2 2 48 48 ILE HG21 H 1 0.990 0.020 . 1 . . . . 588 ILE HG2 . 7033 1 671 . 2 2 48 48 ILE HG22 H 1 0.990 0.020 . 1 . . . . 588 ILE HG2 . 7033 1 672 . 2 2 48 48 ILE HG23 H 1 0.990 0.020 . 1 . . . . 588 ILE HG2 . 7033 1 673 . 2 2 48 48 ILE HD11 H 1 0.182 0.020 . 1 . . . . 588 ILE HD1 . 7033 1 674 . 2 2 48 48 ILE HD12 H 1 0.182 0.020 . 1 . . . . 588 ILE HD1 . 7033 1 675 . 2 2 48 48 ILE HD13 H 1 0.182 0.020 . 1 . . . . 588 ILE HD1 . 7033 1 676 . 2 2 48 48 ILE CA C 13 59.910 0.400 . 1 . . . . 588 ILE CA . 7033 1 677 . 2 2 48 48 ILE CB C 13 35.083 0.400 . 1 . . . . 588 ILE CB . 7033 1 678 . 2 2 48 48 ILE CG2 C 13 14.757 0.400 . 1 . . . . 588 ILE CG2 . 7033 1 679 . 2 2 48 48 ILE CD1 C 13 11.439 0.400 . 1 . . . . 588 ILE CD1 . 7033 1 680 . 2 2 48 48 ILE N N 15 123.491 0.400 . 1 . . . . 588 ILE N . 7033 1 681 . 2 2 49 49 ASP H H 1 7.756 0.020 . 1 . . . . 589 ASP H . 7033 1 682 . 2 2 49 49 ASP HA H 1 4.252 0.020 . 1 . . . . 589 ASP HA . 7033 1 683 . 2 2 49 49 ASP HB2 H 1 2.642 0.020 . 2 . . . . 589 ASP HB2 . 7033 1 684 . 2 2 49 49 ASP HB3 H 1 2.680 0.020 . 2 . . . . 589 ASP HB3 . 7033 1 685 . 2 2 49 49 ASP CA C 13 52.944 0.400 . 1 . . . . 589 ASP CA . 7033 1 686 . 2 2 49 49 ASP CB C 13 40.551 0.400 . 1 . . . . 589 ASP CB . 7033 1 687 . 2 2 49 49 ASP N N 15 120.796 0.400 . 1 . . . . 589 ASP N . 7033 1 688 . 2 2 50 50 ASN H H 1 8.633 0.020 . 1 . . . . 590 ASN H . 7033 1 689 . 2 2 50 50 ASN HA H 1 4.214 0.020 . 1 . . . . 590 ASN HA . 7033 1 690 . 2 2 50 50 ASN HB2 H 1 2.495 0.020 . 2 . . . . 590 ASN HB2 . 7033 1 691 . 2 2 50 50 ASN HB3 H 1 2.864 0.020 . 2 . . . . 590 ASN HB3 . 7033 1 692 . 2 2 50 50 ASN HD21 H 1 7.242 0.020 . 2 . . . . 590 ASN HD21 . 7033 1 693 . 2 2 50 50 ASN HD22 H 1 6.451 0.020 . 2 . . . . 590 ASN HD22 . 7033 1 694 . 2 2 50 50 ASN CA C 13 53.774 0.400 . 1 . . . . 590 ASN CA . 7033 1 695 . 2 2 50 50 ASN CB C 13 34.780 0.400 . 1 . . . . 590 ASN CB . 7033 1 696 . 2 2 50 50 ASN N N 15 122.561 0.400 . 1 . . . . 590 ASN N . 7033 1 697 . 2 2 50 50 ASN ND2 N 15 108.102 0.400 . 1 . . . . 590 ASN ND2 . 7033 1 698 . 2 2 51 51 SER H H 1 8.536 0.020 . 1 . . . . 591 SER H . 7033 1 699 . 2 2 51 51 SER HA H 1 4.170 0.020 . 1 . . . . 591 SER HA . 7033 1 700 . 2 2 51 51 SER HB2 H 1 3.879 0.020 . 1 . . . . 591 SER HB2 . 7033 1 701 . 2 2 51 51 SER HB3 H 1 3.879 0.020 . 1 . . . . 591 SER HB3 . 7033 1 702 . 2 2 51 51 SER CA C 13 59.597 0.400 . 1 . . . . 591 SER CA . 7033 1 703 . 2 2 51 51 SER CB C 13 59.803 0.400 . 1 . . . . 591 SER CB . 7033 1 704 . 2 2 51 51 SER N N 15 114.101 0.400 . 1 . . . . 591 SER N . 7033 1 705 . 2 2 52 52 GLU H H 1 7.270 0.020 . 1 . . . . 592 GLU H . 7033 1 706 . 2 2 52 52 GLU HA H 1 4.256 0.020 . 1 . . . . 592 GLU HA . 7033 1 707 . 2 2 52 52 GLU HB2 H 1 2.020 0.020 . 1 . . . . 592 GLU HB2 . 7033 1 708 . 2 2 52 52 GLU HB3 H 1 2.020 0.020 . 1 . . . . 592 GLU HB3 . 7033 1 709 . 2 2 52 52 GLU HG2 H 1 2.237 0.020 . 1 . . . . 592 GLU HG2 . 7033 1 710 . 2 2 52 52 GLU HG3 H 1 2.237 0.020 . 1 . . . . 592 GLU HG3 . 7033 1 711 . 2 2 52 52 GLU CA C 13 56.003 0.400 . 1 . . . . 592 GLU CA . 7033 1 712 . 2 2 52 52 GLU CB C 13 26.852 0.400 . 1 . . . . 592 GLU CB . 7033 1 713 . 2 2 52 52 GLU CG C 13 33.813 0.400 . 1 . . . . 592 GLU CG . 7033 1 714 . 2 2 52 52 GLU N N 15 123.717 0.400 . 1 . . . . 592 GLU N . 7033 1 715 . 2 2 53 53 LEU H H 1 7.909 0.020 . 1 . . . . 593 LEU H . 7033 1 716 . 2 2 53 53 LEU HA H 1 4.183 0.020 . 1 . . . . 593 LEU HA . 7033 1 717 . 2 2 53 53 LEU HB2 H 1 1.071 0.020 . 2 . . . . 593 LEU HB2 . 7033 1 718 . 2 2 53 53 LEU HB3 H 1 2.054 0.020 . 2 . . . . 593 LEU HB3 . 7033 1 719 . 2 2 53 53 LEU HG H 1 1.500 0.020 . 1 . . . . 593 LEU HG . 7033 1 720 . 2 2 53 53 LEU HD11 H 1 0.917 0.020 . 2 . . . . 593 LEU HD1 . 7033 1 721 . 2 2 53 53 LEU HD12 H 1 0.917 0.020 . 2 . . . . 593 LEU HD1 . 7033 1 722 . 2 2 53 53 LEU HD13 H 1 0.917 0.020 . 2 . . . . 593 LEU HD1 . 7033 1 723 . 2 2 53 53 LEU HD21 H 1 0.769 0.020 . 2 . . . . 593 LEU HD2 . 7033 1 724 . 2 2 53 53 LEU HD22 H 1 0.769 0.020 . 2 . . . . 593 LEU HD2 . 7033 1 725 . 2 2 53 53 LEU HD23 H 1 0.769 0.020 . 2 . . . . 593 LEU HD2 . 7033 1 726 . 2 2 53 53 LEU CA C 13 55.627 0.400 . 1 . . . . 593 LEU CA . 7033 1 727 . 2 2 53 53 LEU CB C 13 40.744 0.400 . 1 . . . . 593 LEU CB . 7033 1 728 . 2 2 53 53 LEU CD1 C 13 24.438 0.400 . 1 . . . . 593 LEU CD1 . 7033 1 729 . 2 2 53 53 LEU CD2 C 13 19.972 0.400 . 1 . . . . 593 LEU CD2 . 7033 1 730 . 2 2 53 53 LEU N N 15 121.352 0.400 . 1 . . . . 593 LEU N . 7033 1 731 . 2 2 54 54 LEU H H 1 8.163 0.020 . 1 . . . . 594 LEU H . 7033 1 732 . 2 2 54 54 LEU HA H 1 3.864 0.020 . 1 . . . . 594 LEU HA . 7033 1 733 . 2 2 54 54 LEU HB2 H 1 1.526 0.020 . 2 . . . . 594 LEU HB2 . 7033 1 734 . 2 2 54 54 LEU HB3 H 1 1.719 0.020 . 2 . . . . 594 LEU HB3 . 7033 1 735 . 2 2 54 54 LEU HG H 1 1.753 0.020 . 1 . . . . 594 LEU HG . 7033 1 736 . 2 2 54 54 LEU HD11 H 1 0.769 0.020 . 2 . . . . 594 LEU HD1 . 7033 1 737 . 2 2 54 54 LEU HD12 H 1 0.769 0.020 . 2 . . . . 594 LEU HD1 . 7033 1 738 . 2 2 54 54 LEU HD13 H 1 0.769 0.020 . 2 . . . . 594 LEU HD1 . 7033 1 739 . 2 2 54 54 LEU HD21 H 1 0.714 0.020 . 2 . . . . 594 LEU HD2 . 7033 1 740 . 2 2 54 54 LEU HD22 H 1 0.714 0.020 . 2 . . . . 594 LEU HD2 . 7033 1 741 . 2 2 54 54 LEU HD23 H 1 0.714 0.020 . 2 . . . . 594 LEU HD2 . 7033 1 742 . 2 2 54 54 LEU CA C 13 55.588 0.400 . 1 . . . . 594 LEU CA . 7033 1 743 . 2 2 54 54 LEU CB C 13 39.217 0.400 . 1 . . . . 594 LEU CB . 7033 1 744 . 2 2 54 54 LEU CD1 C 13 22.547 0.400 . 1 . . . . 594 LEU CD1 . 7033 1 745 . 2 2 54 54 LEU CD2 C 13 21.640 0.400 . 1 . . . . 594 LEU CD2 . 7033 1 746 . 2 2 54 54 LEU N N 15 117.569 0.400 . 1 . . . . 594 LEU N . 7033 1 747 . 2 2 55 55 HIS H H 1 7.285 0.020 . 1 . . . . 595 HIS H . 7033 1 748 . 2 2 55 55 HIS HA H 1 4.436 0.020 . 1 . . . . 595 HIS HA . 7033 1 749 . 2 2 55 55 HIS HB2 H 1 3.235 0.020 . 2 . . . . 595 HIS HB2 . 7033 1 750 . 2 2 55 55 HIS HB3 H 1 3.426 0.020 . 2 . . . . 595 HIS HB3 . 7033 1 751 . 2 2 55 55 HIS HD1 H 1 7.021 0.020 . 1 . . . . 595 HIS HD1 . 7033 1 752 . 2 2 55 55 HIS CA C 13 56.392 0.400 . 1 . . . . 595 HIS CA . 7033 1 753 . 2 2 55 55 HIS CB C 13 26.232 0.400 . 1 . . . . 595 HIS CB . 7033 1 754 . 2 2 55 55 HIS N N 15 117.282 0.400 . 1 . . . . 595 HIS N . 7033 1 755 . 2 2 56 56 MET H H 1 8.255 0.020 . 1 . . . . 596 MET H . 7033 1 756 . 2 2 56 56 MET HA H 1 3.739 0.020 . 1 . . . . 596 MET HA . 7033 1 757 . 2 2 56 56 MET HB2 H 1 1.861 0.020 . 2 . . . . 596 MET HB2 . 7033 1 758 . 2 2 56 56 MET HB3 H 1 2.304 0.020 . 2 . . . . 596 MET HB3 . 7033 1 759 . 2 2 56 56 MET HG2 H 1 2.647 0.020 . 1 . . . . 596 MET HG2 . 7033 1 760 . 2 2 56 56 MET HG3 H 1 2.647 0.020 . 1 . . . . 596 MET HG3 . 7033 1 761 . 2 2 56 56 MET HE1 H 1 1.837 0.020 . 1 . . . . 596 MET HE . 7033 1 762 . 2 2 56 56 MET HE2 H 1 1.837 0.020 . 1 . . . . 596 MET HE . 7033 1 763 . 2 2 56 56 MET HE3 H 1 1.837 0.020 . 1 . . . . 596 MET HE . 7033 1 764 . 2 2 56 56 MET CA C 13 56.929 0.400 . 1 . . . . 596 MET CA . 7033 1 765 . 2 2 56 56 MET CB C 13 31.083 0.400 . 1 . . . . 596 MET CB . 7033 1 766 . 2 2 56 56 MET CE C 13 15.206 0.400 . 1 . . . . 596 MET CE . 7033 1 767 . 2 2 56 56 MET N N 15 119.505 0.400 . 1 . . . . 596 MET N . 7033 1 768 . 2 2 57 57 LEU H H 1 7.512 0.020 . 1 . . . . 597 LEU H . 7033 1 769 . 2 2 57 57 LEU HA H 1 3.864 0.020 . 1 . . . . 597 LEU HA . 7033 1 770 . 2 2 57 57 LEU HB2 H 1 1.470 0.020 . 2 . . . . 597 LEU HB2 . 7033 1 771 . 2 2 57 57 LEU HB3 H 1 1.948 0.020 . 2 . . . . 597 LEU HB3 . 7033 1 772 . 2 2 57 57 LEU HG H 1 1.766 0.020 . 1 . . . . 597 LEU HG . 7033 1 773 . 2 2 57 57 LEU HD11 H 1 0.865 0.020 . 2 . . . . 597 LEU HD1 . 7033 1 774 . 2 2 57 57 LEU HD12 H 1 0.865 0.020 . 2 . . . . 597 LEU HD1 . 7033 1 775 . 2 2 57 57 LEU HD13 H 1 0.865 0.020 . 2 . . . . 597 LEU HD1 . 7033 1 776 . 2 2 57 57 LEU HD21 H 1 0.719 0.020 . 2 . . . . 597 LEU HD2 . 7033 1 777 . 2 2 57 57 LEU HD22 H 1 0.719 0.020 . 2 . . . . 597 LEU HD2 . 7033 1 778 . 2 2 57 57 LEU HD23 H 1 0.719 0.020 . 2 . . . . 597 LEU HD2 . 7033 1 779 . 2 2 57 57 LEU CA C 13 54.467 0.400 . 1 . . . . 597 LEU CA . 7033 1 780 . 2 2 57 57 LEU CB C 13 39.220 0.400 . 1 . . . . 597 LEU CB . 7033 1 781 . 2 2 57 57 LEU CG C 13 24.625 0.400 . 1 . . . . 597 LEU CG . 7033 1 782 . 2 2 57 57 LEU CD1 C 13 23.646 0.400 . 1 . . . . 597 LEU CD1 . 7033 1 783 . 2 2 57 57 LEU CD2 C 13 21.266 0.400 . 1 . . . . 597 LEU CD2 . 7033 1 784 . 2 2 57 57 LEU N N 15 115.834 0.400 . 1 . . . . 597 LEU N . 7033 1 785 . 2 2 58 58 GLU H H 1 7.201 0.020 . 1 . . . . 598 GLU H . 7033 1 786 . 2 2 58 58 GLU HA H 1 4.423 0.020 . 1 . . . . 598 GLU HA . 7033 1 787 . 2 2 58 58 GLU HB2 H 1 2.121 0.020 . 2 . . . . 598 GLU HB2 . 7033 1 788 . 2 2 58 58 GLU HB3 H 1 2.031 0.020 . 2 . . . . 598 GLU HB3 . 7033 1 789 . 2 2 58 58 GLU HG2 H 1 2.294 0.020 . 1 . . . . 598 GLU HG2 . 7033 1 790 . 2 2 58 58 GLU HG3 H 1 2.294 0.020 . 1 . . . . 598 GLU HG3 . 7033 1 791 . 2 2 58 58 GLU CA C 13 53.530 0.400 . 1 . . . . 598 GLU CA . 7033 1 792 . 2 2 58 58 GLU CB C 13 28.393 0.400 . 1 . . . . 598 GLU CB . 7033 1 793 . 2 2 58 58 GLU CG C 13 33.602 0.400 . 1 . . . . 598 GLU CG . 7033 1 794 . 2 2 58 58 GLU N N 15 115.966 0.400 . 1 . . . . 598 GLU N . 7033 1 795 . 2 2 59 59 SER H H 1 7.264 0.020 . 1 . . . . 599 SER H . 7033 1 796 . 2 2 59 59 SER HA H 1 4.991 0.020 . 1 . . . . 599 SER HA . 7033 1 797 . 2 2 59 59 SER HB2 H 1 3.367 0.020 . 2 . . . . 599 SER HB2 . 7033 1 798 . 2 2 59 59 SER HB3 H 1 3.485 0.020 . 2 . . . . 599 SER HB3 . 7033 1 799 . 2 2 59 59 SER CA C 13 51.224 0.400 . 1 . . . . 599 SER CA . 7033 1 800 . 2 2 59 59 SER CB C 13 60.285 0.400 . 1 . . . . 599 SER CB . 7033 1 801 . 2 2 59 59 SER N N 15 113.934 0.400 . 1 . . . . 599 SER N . 7033 1 802 . 2 2 60 60 PRO HA H 1 4.309 0.020 . 1 . . . . 600 PRO HA . 7033 1 803 . 2 2 60 60 PRO HB2 H 1 1.929 0.020 . 2 . . . . 600 PRO HB2 . 7033 1 804 . 2 2 60 60 PRO HB3 H 1 2.394 0.020 . 2 . . . . 600 PRO HB3 . 7033 1 805 . 2 2 60 60 PRO HG2 H 1 1.975 0.020 . 2 . . . . 600 PRO HG2 . 7033 1 806 . 2 2 60 60 PRO HG3 H 1 2.094 0.020 . 2 . . . . 600 PRO HG3 . 7033 1 807 . 2 2 60 60 PRO HD2 H 1 3.666 0.020 . 2 . . . . 600 PRO HD2 . 7033 1 808 . 2 2 60 60 PRO HD3 H 1 3.894 0.020 . 2 . . . . 600 PRO HD3 . 7033 1 809 . 2 2 60 60 PRO CA C 13 62.864 0.400 . 1 . . . . 600 PRO CA . 7033 1 810 . 2 2 60 60 PRO CB C 13 29.738 0.400 . 1 . . . . 600 PRO CB . 7033 1 811 . 2 2 60 60 PRO CD C 13 48.064 0.400 . 1 . . . . 600 PRO CD . 7033 1 812 . 2 2 61 61 GLU H H 1 8.981 0.020 . 1 . . . . 601 GLU H . 7033 1 813 . 2 2 61 61 GLU HA H 1 4.067 0.020 . 1 . . . . 601 GLU HA . 7033 1 814 . 2 2 61 61 GLU HB2 H 1 1.976 0.020 . 1 . . . . 601 GLU HB2 . 7033 1 815 . 2 2 61 61 GLU HB3 H 1 1.976 0.020 . 1 . . . . 601 GLU HB3 . 7033 1 816 . 2 2 61 61 GLU HG2 H 1 2.306 0.020 . 1 . . . . 601 GLU HG2 . 7033 1 817 . 2 2 61 61 GLU HG3 H 1 2.306 0.020 . 1 . . . . 601 GLU HG3 . 7033 1 818 . 2 2 61 61 GLU CA C 13 57.450 0.400 . 1 . . . . 601 GLU CA . 7033 1 819 . 2 2 61 61 GLU CB C 13 26.410 0.400 . 1 . . . . 601 GLU CB . 7033 1 820 . 2 2 61 61 GLU CG C 13 34.016 0.400 . 1 . . . . 601 GLU CG . 7033 1 821 . 2 2 61 61 GLU N N 15 117.588 0.400 . 1 . . . . 601 GLU N . 7033 1 822 . 2 2 62 62 SER H H 1 7.758 0.020 . 1 . . . . 602 SER H . 7033 1 823 . 2 2 62 62 SER HA H 1 4.326 0.020 . 1 . . . . 602 SER HA . 7033 1 824 . 2 2 62 62 SER HB2 H 1 3.926 0.020 . 1 . . . . 602 SER HB2 . 7033 1 825 . 2 2 62 62 SER HB3 H 1 3.926 0.020 . 1 . . . . 602 SER HB3 . 7033 1 826 . 2 2 62 62 SER CA C 13 58.994 0.400 . 1 . . . . 602 SER CA . 7033 1 827 . 2 2 62 62 SER CB C 13 60.558 0.400 . 1 . . . . 602 SER CB . 7033 1 828 . 2 2 62 62 SER N N 15 117.065 0.400 . 1 . . . . 602 SER N . 7033 1 829 . 2 2 63 63 LEU H H 1 7.853 0.020 . 1 . . . . 603 LEU H . 7033 1 830 . 2 2 63 63 LEU HA H 1 4.066 0.020 . 1 . . . . 603 LEU HA . 7033 1 831 . 2 2 63 63 LEU HB2 H 1 1.707 0.020 . 2 . . . . 603 LEU HB2 . 7033 1 832 . 2 2 63 63 LEU HB3 H 1 1.889 0.020 . 2 . . . . 603 LEU HB3 . 7033 1 833 . 2 2 63 63 LEU HG H 1 1.322 0.020 . 1 . . . . 603 LEU HG . 7033 1 834 . 2 2 63 63 LEU HD11 H 1 0.695 0.020 . 2 . . . . 603 LEU HD1 . 7033 1 835 . 2 2 63 63 LEU HD12 H 1 0.695 0.020 . 2 . . . . 603 LEU HD1 . 7033 1 836 . 2 2 63 63 LEU HD13 H 1 0.695 0.020 . 2 . . . . 603 LEU HD1 . 7033 1 837 . 2 2 63 63 LEU HD21 H 1 0.784 0.020 . 2 . . . . 603 LEU HD2 . 7033 1 838 . 2 2 63 63 LEU HD22 H 1 0.784 0.020 . 2 . . . . 603 LEU HD2 . 7033 1 839 . 2 2 63 63 LEU HD23 H 1 0.784 0.020 . 2 . . . . 603 LEU HD2 . 7033 1 840 . 2 2 63 63 LEU CA C 13 56.122 0.400 . 1 . . . . 603 LEU CA . 7033 1 841 . 2 2 63 63 LEU CB C 13 38.257 0.400 . 1 . . . . 603 LEU CB . 7033 1 842 . 2 2 63 63 LEU CG C 13 23.583 0.400 . 1 . . . . 603 LEU CG . 7033 1 843 . 2 2 63 63 LEU CD1 C 13 21.966 0.400 . 1 . . . . 603 LEU CD1 . 7033 1 844 . 2 2 63 63 LEU CD2 C 13 24.364 0.400 . 1 . . . . 603 LEU CD2 . 7033 1 845 . 2 2 63 63 LEU N N 15 121.598 0.400 . 1 . . . . 603 LEU N . 7033 1 846 . 2 2 64 64 ARG H H 1 8.342 0.020 . 1 . . . . 604 ARG H . 7033 1 847 . 2 2 64 64 ARG HA H 1 3.721 0.020 . 1 . . . . 604 ARG HA . 7033 1 848 . 2 2 64 64 ARG HB2 H 1 1.929 0.020 . 1 . . . . 604 ARG HB2 . 7033 1 849 . 2 2 64 64 ARG HB3 H 1 1.929 0.020 . 1 . . . . 604 ARG HB3 . 7033 1 850 . 2 2 64 64 ARG HG2 H 1 1.699 0.020 . 1 . . . . 604 ARG HG2 . 7033 1 851 . 2 2 64 64 ARG HG3 H 1 1.699 0.020 . 1 . . . . 604 ARG HG3 . 7033 1 852 . 2 2 64 64 ARG HD2 H 1 3.244 0.020 . 1 . . . . 604 ARG HD2 . 7033 1 853 . 2 2 64 64 ARG HD3 H 1 3.244 0.020 . 1 . . . . 604 ARG HD3 . 7033 1 854 . 2 2 64 64 ARG CA C 13 57.174 0.400 . 1 . . . . 604 ARG CA . 7033 1 855 . 2 2 64 64 ARG CB C 13 27.146 0.400 . 1 . . . . 604 ARG CB . 7033 1 856 . 2 2 64 64 ARG CG C 13 24.299 0.400 . 1 . . . . 604 ARG CG . 7033 1 857 . 2 2 64 64 ARG CD C 13 40.512 0.400 . 1 . . . . 604 ARG CD . 7033 1 858 . 2 2 64 64 ARG N N 15 117.584 0.400 . 1 . . . . 604 ARG N . 7033 1 859 . 2 2 65 65 SER H H 1 7.678 0.020 . 1 . . . . 605 SER H . 7033 1 860 . 2 2 65 65 SER HA H 1 4.288 0.020 . 1 . . . . 605 SER HA . 7033 1 861 . 2 2 65 65 SER HB2 H 1 4.022 0.020 . 1 . . . . 605 SER HB2 . 7033 1 862 . 2 2 65 65 SER HB3 H 1 4.022 0.020 . 1 . . . . 605 SER HB3 . 7033 1 863 . 2 2 65 65 SER CA C 13 59.242 0.400 . 1 . . . . 605 SER CA . 7033 1 864 . 2 2 65 65 SER CB C 13 60.457 0.400 . 1 . . . . 605 SER CB . 7033 1 865 . 2 2 65 65 SER N N 15 111.637 0.400 . 1 . . . . 605 SER N . 7033 1 866 . 2 2 66 66 LYS H H 1 7.307 0.020 . 1 . . . . 606 LYS H . 7033 1 867 . 2 2 66 66 LYS HA H 1 4.291 0.020 . 1 . . . . 606 LYS HA . 7033 1 868 . 2 2 66 66 LYS HB2 H 1 1.537 0.020 . 2 . . . . 606 LYS HB2 . 7033 1 869 . 2 2 66 66 LYS HB3 H 1 2.119 0.020 . 2 . . . . 606 LYS HB3 . 7033 1 870 . 2 2 66 66 LYS HG2 H 1 1.364 0.020 . 2 . . . . 606 LYS HG2 . 7033 1 871 . 2 2 66 66 LYS HG3 H 1 1.484 0.020 . 2 . . . . 606 LYS HG3 . 7033 1 872 . 2 2 66 66 LYS HD2 H 1 1.661 0.020 . 1 . . . . 606 LYS HD2 . 7033 1 873 . 2 2 66 66 LYS HD3 H 1 1.661 0.020 . 1 . . . . 606 LYS HD3 . 7033 1 874 . 2 2 66 66 LYS HE2 H 1 2.798 0.020 . 2 . . . . 606 LYS HE2 . 7033 1 875 . 2 2 66 66 LYS HE3 H 1 2.864 0.020 . 2 . . . . 606 LYS HE3 . 7033 1 876 . 2 2 66 66 LYS CA C 13 55.682 0.400 . 1 . . . . 606 LYS CA . 7033 1 877 . 2 2 66 66 LYS CB C 13 30.059 0.400 . 1 . . . . 606 LYS CB . 7033 1 878 . 2 2 66 66 LYS CG C 13 22.359 0.400 . 1 . . . . 606 LYS CG . 7033 1 879 . 2 2 66 66 LYS CD C 13 25.827 0.400 . 1 . . . . 606 LYS CD . 7033 1 880 . 2 2 66 66 LYS CE C 13 39.929 0.400 . 1 . . . . 606 LYS CE . 7033 1 881 . 2 2 66 66 LYS N N 15 120.370 0.400 . 1 . . . . 606 LYS N . 7033 1 882 . 2 2 67 67 VAL H H 1 8.530 0.020 . 1 . . . . 607 VAL H . 7033 1 883 . 2 2 67 67 VAL HA H 1 3.429 0.020 . 1 . . . . 607 VAL HA . 7033 1 884 . 2 2 67 67 VAL HB H 1 2.274 0.020 . 1 . . . . 607 VAL HB . 7033 1 885 . 2 2 67 67 VAL HG11 H 1 1.112 0.020 . 2 . . . . 607 VAL HG1 . 7033 1 886 . 2 2 67 67 VAL HG12 H 1 1.112 0.020 . 2 . . . . 607 VAL HG1 . 7033 1 887 . 2 2 67 67 VAL HG13 H 1 1.112 0.020 . 2 . . . . 607 VAL HG1 . 7033 1 888 . 2 2 67 67 VAL HG21 H 1 0.980 0.020 . 2 . . . . 607 VAL HG2 . 7033 1 889 . 2 2 67 67 VAL HG22 H 1 0.980 0.020 . 2 . . . . 607 VAL HG2 . 7033 1 890 . 2 2 67 67 VAL HG23 H 1 0.980 0.020 . 2 . . . . 607 VAL HG2 . 7033 1 891 . 2 2 67 67 VAL CA C 13 64.961 0.400 . 1 . . . . 607 VAL CA . 7033 1 892 . 2 2 67 67 VAL CB C 13 29.229 0.400 . 1 . . . . 607 VAL CB . 7033 1 893 . 2 2 67 67 VAL CG1 C 13 19.716 0.400 . 1 . . . . 607 VAL CG1 . 7033 1 894 . 2 2 67 67 VAL CG2 C 13 22.203 0.400 . 1 . . . . 607 VAL CG2 . 7033 1 895 . 2 2 67 67 VAL N N 15 120.957 0.400 . 1 . . . . 607 VAL N . 7033 1 896 . 2 2 68 68 ASP H H 1 8.681 0.020 . 1 . . . . 608 ASP H . 7033 1 897 . 2 2 68 68 ASP HA H 1 4.340 0.020 . 1 . . . . 608 ASP HA . 7033 1 898 . 2 2 68 68 ASP HB2 H 1 2.621 0.020 . 2 . . . . 608 ASP HB2 . 7033 1 899 . 2 2 68 68 ASP HB3 H 1 2.858 0.020 . 2 . . . . 608 ASP HB3 . 7033 1 900 . 2 2 68 68 ASP CA C 13 55.221 0.400 . 1 . . . . 608 ASP CA . 7033 1 901 . 2 2 68 68 ASP CB C 13 37.197 0.400 . 1 . . . . 608 ASP CB . 7033 1 902 . 2 2 68 68 ASP N N 15 119.314 0.400 . 1 . . . . 608 ASP N . 7033 1 903 . 2 2 69 69 GLU H H 1 7.647 0.020 . 1 . . . . 609 GLU H . 7033 1 904 . 2 2 69 69 GLU HA H 1 4.092 0.020 . 1 . . . . 609 GLU HA . 7033 1 905 . 2 2 69 69 GLU HB2 H 1 2.102 0.020 . 2 . . . . 609 GLU HB2 . 7033 1 906 . 2 2 69 69 GLU HB3 H 1 2.353 0.020 . 2 . . . . 609 GLU HB3 . 7033 1 907 . 2 2 69 69 GLU HG2 H 1 2.546 0.020 . 1 . . . . 609 GLU HG2 . 7033 1 908 . 2 2 69 69 GLU HG3 H 1 2.546 0.020 . 1 . . . . 609 GLU HG3 . 7033 1 909 . 2 2 69 69 GLU CA C 13 57.211 0.400 . 1 . . . . 609 GLU CA . 7033 1 910 . 2 2 69 69 GLU CB C 13 27.613 0.400 . 1 . . . . 609 GLU CB . 7033 1 911 . 2 2 69 69 GLU CG C 13 33.978 0.400 . 1 . . . . 609 GLU CG . 7033 1 912 . 2 2 69 69 GLU N N 15 120.498 0.400 . 1 . . . . 609 GLU N . 7033 1 913 . 2 2 70 70 ALA H H 1 8.157 0.020 . 1 . . . . 610 ALA H . 7033 1 914 . 2 2 70 70 ALA HA H 1 3.850 0.020 . 1 . . . . 610 ALA HA . 7033 1 915 . 2 2 70 70 ALA HB1 H 1 1.616 0.020 . 1 . . . . 610 ALA HB . 7033 1 916 . 2 2 70 70 ALA HB2 H 1 1.616 0.020 . 1 . . . . 610 ALA HB . 7033 1 917 . 2 2 70 70 ALA HB3 H 1 1.616 0.020 . 1 . . . . 610 ALA HB . 7033 1 918 . 2 2 70 70 ALA CA C 13 53.226 0.400 . 1 . . . . 610 ALA CA . 7033 1 919 . 2 2 70 70 ALA CB C 13 15.829 0.400 . 1 . . . . 610 ALA CB . 7033 1 920 . 2 2 70 70 ALA N N 15 121.960 0.400 . 1 . . . . 610 ALA N . 7033 1 921 . 2 2 71 71 VAL H H 1 8.842 0.020 . 1 . . . . 611 VAL H . 7033 1 922 . 2 2 71 71 VAL HA H 1 3.279 0.020 . 1 . . . . 611 VAL HA . 7033 1 923 . 2 2 71 71 VAL HB H 1 1.953 0.020 . 1 . . . . 611 VAL HB . 7033 1 924 . 2 2 71 71 VAL HG11 H 1 0.679 0.020 . 2 . . . . 611 VAL HG1 . 7033 1 925 . 2 2 71 71 VAL HG12 H 1 0.679 0.020 . 2 . . . . 611 VAL HG1 . 7033 1 926 . 2 2 71 71 VAL HG13 H 1 0.679 0.020 . 2 . . . . 611 VAL HG1 . 7033 1 927 . 2 2 71 71 VAL HG21 H 1 0.497 0.020 . 2 . . . . 611 VAL HG2 . 7033 1 928 . 2 2 71 71 VAL HG22 H 1 0.497 0.020 . 2 . . . . 611 VAL HG2 . 7033 1 929 . 2 2 71 71 VAL HG23 H 1 0.497 0.020 . 2 . . . . 611 VAL HG2 . 7033 1 930 . 2 2 71 71 VAL CA C 13 64.518 0.400 . 1 . . . . 611 VAL CA . 7033 1 931 . 2 2 71 71 VAL CB C 13 29.069 0.400 . 1 . . . . 611 VAL CB . 7033 1 932 . 2 2 71 71 VAL CG1 C 13 18.485 0.400 . 1 . . . . 611 VAL CG1 . 7033 1 933 . 2 2 71 71 VAL CG2 C 13 21.379 0.400 . 1 . . . . 611 VAL CG2 . 7033 1 934 . 2 2 71 71 VAL N N 15 117.918 0.400 . 1 . . . . 611 VAL N . 7033 1 935 . 2 2 72 72 ALA H H 1 7.753 0.020 . 1 . . . . 612 ALA H . 7033 1 936 . 2 2 72 72 ALA HA H 1 4.105 0.020 . 1 . . . . 612 ALA HA . 7033 1 937 . 2 2 72 72 ALA HB1 H 1 1.483 0.020 . 1 . . . . 612 ALA HB . 7033 1 938 . 2 2 72 72 ALA HB2 H 1 1.483 0.020 . 1 . . . . 612 ALA HB . 7033 1 939 . 2 2 72 72 ALA HB3 H 1 1.483 0.020 . 1 . . . . 612 ALA HB . 7033 1 940 . 2 2 72 72 ALA CA C 13 52.834 0.400 . 1 . . . . 612 ALA CA . 7033 1 941 . 2 2 72 72 ALA CB C 13 15.400 0.400 . 1 . . . . 612 ALA CB . 7033 1 942 . 2 2 72 72 ALA N N 15 121.380 0.400 . 1 . . . . 612 ALA N . 7033 1 943 . 2 2 73 73 VAL H H 1 7.524 0.020 . 1 . . . . 613 VAL H . 7033 1 944 . 2 2 73 73 VAL HA H 1 3.804 0.020 . 1 . . . . 613 VAL HA . 7033 1 945 . 2 2 73 73 VAL HB H 1 1.975 0.020 . 1 . . . . 613 VAL HB . 7033 1 946 . 2 2 73 73 VAL HG11 H 1 0.835 0.020 . 2 . . . . 613 VAL HG1 . 7033 1 947 . 2 2 73 73 VAL HG12 H 1 0.835 0.020 . 2 . . . . 613 VAL HG1 . 7033 1 948 . 2 2 73 73 VAL HG13 H 1 0.835 0.020 . 2 . . . . 613 VAL HG1 . 7033 1 949 . 2 2 73 73 VAL HG21 H 1 1.014 0.020 . 2 . . . . 613 VAL HG2 . 7033 1 950 . 2 2 73 73 VAL HG22 H 1 1.014 0.020 . 2 . . . . 613 VAL HG2 . 7033 1 951 . 2 2 73 73 VAL HG23 H 1 1.014 0.020 . 2 . . . . 613 VAL HG2 . 7033 1 952 . 2 2 73 73 VAL CA C 13 63.485 0.400 . 1 . . . . 613 VAL CA . 7033 1 953 . 2 2 73 73 VAL CB C 13 29.266 0.400 . 1 . . . . 613 VAL CB . 7033 1 954 . 2 2 73 73 VAL CG1 C 13 18.846 0.400 . 1 . . . . 613 VAL CG1 . 7033 1 955 . 2 2 73 73 VAL CG2 C 13 20.386 0.400 . 1 . . . . 613 VAL CG2 . 7033 1 956 . 2 2 73 73 VAL N N 15 117.888 0.400 . 1 . . . . 613 VAL N . 7033 1 957 . 2 2 74 74 LEU H H 1 8.198 0.020 . 1 . . . . 614 LEU H . 7033 1 958 . 2 2 74 74 LEU HA H 1 4.001 0.020 . 1 . . . . 614 LEU HA . 7033 1 959 . 2 2 74 74 LEU HB2 H 1 1.620 0.020 . 2 . . . . 614 LEU HB2 . 7033 1 960 . 2 2 74 74 LEU HB3 H 1 1.679 0.020 . 2 . . . . 614 LEU HB3 . 7033 1 961 . 2 2 74 74 LEU HG H 1 1.484 0.020 . 1 . . . . 614 LEU HG . 7033 1 962 . 2 2 74 74 LEU HD11 H 1 0.862 0.020 . 2 . . . . 614 LEU HD1 . 7033 1 963 . 2 2 74 74 LEU HD12 H 1 0.862 0.020 . 2 . . . . 614 LEU HD1 . 7033 1 964 . 2 2 74 74 LEU HD13 H 1 0.862 0.020 . 2 . . . . 614 LEU HD1 . 7033 1 965 . 2 2 74 74 LEU HD21 H 1 0.850 0.020 . 2 . . . . 614 LEU HD2 . 7033 1 966 . 2 2 74 74 LEU HD22 H 1 0.850 0.020 . 2 . . . . 614 LEU HD2 . 7033 1 967 . 2 2 74 74 LEU HD23 H 1 0.850 0.020 . 2 . . . . 614 LEU HD2 . 7033 1 968 . 2 2 74 74 LEU CA C 13 55.722 0.400 . 1 . . . . 614 LEU CA . 7033 1 969 . 2 2 74 74 LEU CB C 13 39.770 0.400 . 1 . . . . 614 LEU CB . 7033 1 970 . 2 2 74 74 LEU CG C 13 24.457 0.400 . 1 . . . . 614 LEU CG . 7033 1 971 . 2 2 74 74 LEU CD1 C 13 22.261 0.400 . 1 . . . . 614 LEU CD1 . 7033 1 972 . 2 2 74 74 LEU CD2 C 13 22.113 0.400 . 1 . . . . 614 LEU CD2 . 7033 1 973 . 2 2 74 74 LEU N N 15 122.279 0.400 . 1 . . . . 614 LEU N . 7033 1 974 . 2 2 75 75 GLN H H 1 8.702 0.020 . 1 . . . . 615 GLN H . 7033 1 975 . 2 2 75 75 GLN HA H 1 4.058 0.020 . 1 . . . . 615 GLN HA . 7033 1 976 . 2 2 75 75 GLN HB2 H 1 2.076 0.020 . 1 . . . . 615 GLN HB2 . 7033 1 977 . 2 2 75 75 GLN HB3 H 1 2.076 0.020 . 1 . . . . 615 GLN HB3 . 7033 1 978 . 2 2 75 75 GLN HG2 H 1 2.303 0.020 . 2 . . . . 615 GLN HG2 . 7033 1 979 . 2 2 75 75 GLN HG3 H 1 2.504 0.020 . 2 . . . . 615 GLN HG3 . 7033 1 980 . 2 2 75 75 GLN HE21 H 1 7.210 0.020 . 2 . . . . 615 GLN HE21 . 7033 1 981 . 2 2 75 75 GLN HE22 H 1 6.731 0.020 . 2 . . . . 615 GLN HE22 . 7033 1 982 . 2 2 75 75 GLN CA C 13 56.182 0.400 . 1 . . . . 615 GLN CA . 7033 1 983 . 2 2 75 75 GLN CB C 13 25.677 0.400 . 1 . . . . 615 GLN CB . 7033 1 984 . 2 2 75 75 GLN CG C 13 32.237 0.400 . 1 . . . . 615 GLN CG . 7033 1 985 . 2 2 75 75 GLN N N 15 117.674 0.400 . 1 . . . . 615 GLN N . 7033 1 986 . 2 2 75 75 GLN NE2 N 15 110.552 0.400 . 1 . . . . 615 GLN NE2 . 7033 1 987 . 2 2 76 76 ALA H H 1 7.662 0.020 . 1 . . . . 616 ALA H . 7033 1 988 . 2 2 76 76 ALA HA H 1 4.187 0.020 . 1 . . . . 616 ALA HA . 7033 1 989 . 2 2 76 76 ALA HB1 H 1 1.466 0.020 . 1 . . . . 616 ALA HB . 7033 1 990 . 2 2 76 76 ALA HB2 H 1 1.466 0.020 . 1 . . . . 616 ALA HB . 7033 1 991 . 2 2 76 76 ALA HB3 H 1 1.466 0.020 . 1 . . . . 616 ALA HB . 7033 1 992 . 2 2 76 76 ALA CA C 13 51.995 0.400 . 1 . . . . 616 ALA CA . 7033 1 993 . 2 2 76 76 ALA CB C 13 15.771 0.400 . 1 . . . . 616 ALA CB . 7033 1 994 . 2 2 76 76 ALA N N 15 121.678 0.400 . 1 . . . . 616 ALA N . 7033 1 995 . 2 2 77 77 HIS H H 1 7.872 0.020 . 1 . . . . 617 HIS H . 7033 1 996 . 2 2 77 77 HIS HA H 1 4.371 0.020 . 1 . . . . 617 HIS HA . 7033 1 997 . 2 2 77 77 HIS HB2 H 1 3.081 0.020 . 2 . . . . 617 HIS HB2 . 7033 1 998 . 2 2 77 77 HIS HB3 H 1 3.266 0.020 . 2 . . . . 617 HIS HB3 . 7033 1 999 . 2 2 77 77 HIS HE1 H 1 7.171 0.020 . 1 . . . . 617 HIS HE1 . 7033 1 1000 . 2 2 77 77 HIS CA C 13 56.337 0.400 . 1 . . . . 617 HIS CA . 7033 1 1001 . 2 2 77 77 HIS CB C 13 28.543 0.400 . 1 . . . . 617 HIS CB . 7033 1 1002 . 2 2 77 77 HIS N N 15 118.191 0.400 . 1 . . . . 617 HIS N . 7033 1 1003 . 2 2 78 78 GLN H H 1 8.076 0.020 . 1 . . . . 618 GLN H . 7033 1 1004 . 2 2 78 78 GLN HA H 1 4.047 0.020 . 1 . . . . 618 GLN HA . 7033 1 1005 . 2 2 78 78 GLN HB2 H 1 2.058 0.020 . 1 . . . . 618 GLN HB2 . 7033 1 1006 . 2 2 78 78 GLN HB3 H 1 2.058 0.020 . 1 . . . . 618 GLN HB3 . 7033 1 1007 . 2 2 78 78 GLN HG2 H 1 2.499 0.020 . 1 . . . . 618 GLN HG2 . 7033 1 1008 . 2 2 78 78 GLN HG3 H 1 2.499 0.020 . 1 . . . . 618 GLN HG3 . 7033 1 1009 . 2 2 78 78 GLN CA C 13 54.793 0.400 . 1 . . . . 618 GLN CA . 7033 1 1010 . 2 2 78 78 GLN CB C 13 26.314 0.400 . 1 . . . . 618 GLN CB . 7033 1 1011 . 2 2 78 78 GLN CG C 13 31.714 0.400 . 1 . . . . 618 GLN CG . 7033 1 1012 . 2 2 78 78 GLN N N 15 118.799 0.400 . 1 . . . . 618 GLN N . 7033 1 1013 . 2 2 79 79 ALA H H 1 7.834 0.020 . 1 . . . . 619 ALA H . 7033 1 1014 . 2 2 79 79 ALA HA H 1 4.205 0.020 . 1 . . . . 619 ALA HA . 7033 1 1015 . 2 2 79 79 ALA HB1 H 1 1.415 0.020 . 1 . . . . 619 ALA HB . 7033 1 1016 . 2 2 79 79 ALA HB2 H 1 1.415 0.020 . 1 . . . . 619 ALA HB . 7033 1 1017 . 2 2 79 79 ALA HB3 H 1 1.415 0.020 . 1 . . . . 619 ALA HB . 7033 1 1018 . 2 2 79 79 ALA CA C 13 50.713 0.400 . 1 . . . . 619 ALA CA . 7033 1 1019 . 2 2 79 79 ALA CB C 13 16.278 0.400 . 1 . . . . 619 ALA CB . 7033 1 1020 . 2 2 79 79 ALA N N 15 122.208 0.400 . 1 . . . . 619 ALA N . 7033 1 1021 . 2 2 80 80 LYS H H 1 7.749 0.020 . 1 . . . . 620 LYS H . 7033 1 1022 . 2 2 80 80 LYS HA H 1 4.194 0.020 . 1 . . . . 620 LYS HA . 7033 1 1023 . 2 2 80 80 LYS HB2 H 1 1.781 0.020 . 2 . . . . 620 LYS HB2 . 7033 1 1024 . 2 2 80 80 LYS HB3 H 1 1.834 0.020 . 2 . . . . 620 LYS HB3 . 7033 1 1025 . 2 2 80 80 LYS HG2 H 1 1.440 0.020 . 2 . . . . 620 LYS HG2 . 7033 1 1026 . 2 2 80 80 LYS HG3 H 1 1.475 0.020 . 2 . . . . 620 LYS HG3 . 7033 1 1027 . 2 2 80 80 LYS HD2 H 1 1.658 0.020 . 1 . . . . 620 LYS HD2 . 7033 1 1028 . 2 2 80 80 LYS HD3 H 1 1.658 0.020 . 1 . . . . 620 LYS HD3 . 7033 1 1029 . 2 2 80 80 LYS HE2 H 1 2.966 0.020 . 1 . . . . 620 LYS HE2 . 7033 1 1030 . 2 2 80 80 LYS HE3 H 1 2.966 0.020 . 1 . . . . 620 LYS HE3 . 7033 1 1031 . 2 2 80 80 LYS CA C 13 54.364 0.400 . 1 . . . . 620 LYS CA . 7033 1 1032 . 2 2 80 80 LYS CB C 13 30.232 0.400 . 1 . . . . 620 LYS CB . 7033 1 1033 . 2 2 80 80 LYS N N 15 119.067 0.400 . 1 . . . . 620 LYS N . 7033 1 1034 . 2 2 81 81 GLU H H 1 8.058 0.020 . 1 . . . . 621 GLU H . 7033 1 1035 . 2 2 81 81 GLU HA H 1 4.180 0.020 . 1 . . . . 621 GLU HA . 7033 1 1036 . 2 2 81 81 GLU HB2 H 1 1.855 0.020 . 2 . . . . 621 GLU HB2 . 7033 1 1037 . 2 2 81 81 GLU HB3 H 1 2.012 0.020 . 2 . . . . 621 GLU HB3 . 7033 1 1038 . 2 2 81 81 GLU HG2 H 1 2.153 0.020 . 1 . . . . 621 GLU HG2 . 7033 1 1039 . 2 2 81 81 GLU HG3 H 1 2.153 0.020 . 1 . . . . 621 GLU HG3 . 7033 1 1040 . 2 2 81 81 GLU CA C 13 54.273 0.400 . 1 . . . . 621 GLU CA . 7033 1 1041 . 2 2 81 81 GLU CB C 13 27.722 0.400 . 1 . . . . 621 GLU CB . 7033 1 1042 . 2 2 81 81 GLU CG C 13 34.040 0.400 . 1 . . . . 621 GLU CG . 7033 1 1043 . 2 2 81 81 GLU N N 15 120.650 0.400 . 1 . . . . 621 GLU N . 7033 1 1044 . 2 2 82 82 ALA H H 1 7.981 0.020 . 1 . . . . 622 ALA H . 7033 1 1045 . 2 2 82 82 ALA HA H 1 4.289 0.020 . 1 . . . . 622 ALA HA . 7033 1 1046 . 2 2 82 82 ALA HB1 H 1 1.361 0.020 . 1 . . . . 622 ALA HB . 7033 1 1047 . 2 2 82 82 ALA HB2 H 1 1.361 0.020 . 1 . . . . 622 ALA HB . 7033 1 1048 . 2 2 82 82 ALA HB3 H 1 1.361 0.020 . 1 . . . . 622 ALA HB . 7033 1 1049 . 2 2 82 82 ALA CA C 13 49.927 0.400 . 1 . . . . 622 ALA CA . 7033 1 1050 . 2 2 82 82 ALA CB C 13 16.895 0.400 . 1 . . . . 622 ALA CB . 7033 1 1051 . 2 2 82 82 ALA N N 15 124.635 0.400 . 1 . . . . 622 ALA N . 7033 1 1052 . 2 2 83 83 ALA H H 1 7.742 0.020 . 1 . . . . 623 ALA H . 7033 1 1053 . 2 2 83 83 ALA HA H 1 4.081 0.020 . 1 . . . . 623 ALA HA . 7033 1 1054 . 2 2 83 83 ALA HB1 H 1 1.316 0.020 . 1 . . . . 623 ALA HB . 7033 1 1055 . 2 2 83 83 ALA HB2 H 1 1.316 0.020 . 1 . . . . 623 ALA HB . 7033 1 1056 . 2 2 83 83 ALA HB3 H 1 1.316 0.020 . 1 . . . . 623 ALA HB . 7033 1 1057 . 2 2 83 83 ALA CA C 13 51.466 0.400 . 1 . . . . 623 ALA CA . 7033 1 1058 . 2 2 83 83 ALA CB C 13 17.672 0.400 . 1 . . . . 623 ALA CB . 7033 1 1059 . 2 2 83 83 ALA N N 15 129.100 0.400 . 1 . . . . 623 ALA N . 7033 1 stop_ save_