data_51730 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51730 _Entry.Title ; Resonance assignments of the microtubule-binding domain of the microtubule-associated protein 7 (MAP7) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-12-13 _Entry.Accession_date 2022-12-13 _Entry.Last_release_date 2022-12-13 _Entry.Original_release_date 2022-12-13 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details '1H, 13C and 15N backbone chemical Shift assignments of the MAP7 microtubule-binding domain' _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.ORCID _Entry_author.Entry_ID 1 Agnes Adler . . . . 51730 2 Lenette 'Frosig Kjaer' . . . . 51730 3 Marc Baldus . . . . 51730 4 Hugo 'van Ingen' . . . . 51730 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51730 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 348 51730 '15N chemical shifts' 104 51730 '1H chemical shifts' 367 51730 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 3 . . 2023-11-03 2022-12-13 update author 'update assignment' 51730 2 . . 2023-06-22 2022-12-13 update BMRB 'update entry citation' 51730 1 . . 2023-05-24 2022-12-13 original author 'original release' 51730 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51730 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37099260 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Resonance assignments of the microtubule-binding domain of the microtubule-associated protein 7 (MAP7) ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 17 _Citation.Journal_issue 1 _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 83 _Citation.Page_last 88 _Citation.Year 2023 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Agnes Adler A. . . . 51730 1 2 Lenette Kjaer L. F. . . 51730 1 3 'J Wouter' Beugelink J. W. . . 51730 1 4 Marc Baldus M. . . . 51730 1 5 Hugo 'van Ingen' H. . . . 51730 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'NMR resonance assignments, microtubule binding proteins, Microtubules, MAP7, MTBD' 51730 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51730 _Assembly.ID 1 _Assembly.Name 'MAP7 MTBD monomer' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _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 'MAP7 MTBD' 1 $entity_1 . . yes native no no . . . 51730 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51730 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; PVLRVDDRQRLARERREERE KQLAAREIVWLEREERARQH YEKHLEERKKRLEEQRQKEE RRRAAVEEKRRQRLEEDKER HEAVVRRTMERSQKPKQKHN RWSWGGSLHGSP ; _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 112 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _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 . 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 59 PRO . 51730 1 2 60 VAL . 51730 1 3 61 LEU . 51730 1 4 62 ARG . 51730 1 5 63 VAL . 51730 1 6 64 ASP . 51730 1 7 65 ASP . 51730 1 8 66 ARG . 51730 1 9 67 GLN . 51730 1 10 68 ARG . 51730 1 11 69 LEU . 51730 1 12 70 ALA . 51730 1 13 71 ARG . 51730 1 14 72 GLU . 51730 1 15 73 ARG . 51730 1 16 74 ARG . 51730 1 17 75 GLU . 51730 1 18 76 GLU . 51730 1 19 77 ARG . 51730 1 20 78 GLU . 51730 1 21 79 LYS . 51730 1 22 80 GLN . 51730 1 23 81 LEU . 51730 1 24 82 ALA . 51730 1 25 83 ALA . 51730 1 26 84 ARG . 51730 1 27 85 GLU . 51730 1 28 86 ILE . 51730 1 29 87 VAL . 51730 1 30 88 TRP . 51730 1 31 89 LEU . 51730 1 32 90 GLU . 51730 1 33 91 ARG . 51730 1 34 92 GLU . 51730 1 35 93 GLU . 51730 1 36 94 ARG . 51730 1 37 95 ALA . 51730 1 38 96 ARG . 51730 1 39 97 GLN . 51730 1 40 98 HIS . 51730 1 41 99 TYR . 51730 1 42 100 GLU . 51730 1 43 101 LYS . 51730 1 44 102 HIS . 51730 1 45 103 LEU . 51730 1 46 104 GLU . 51730 1 47 105 GLU . 51730 1 48 106 ARG . 51730 1 49 107 LYS . 51730 1 50 108 LYS . 51730 1 51 109 ARG . 51730 1 52 110 LEU . 51730 1 53 111 GLU . 51730 1 54 112 GLU . 51730 1 55 113 GLN . 51730 1 56 114 ARG . 51730 1 57 115 GLN . 51730 1 58 116 LYS . 51730 1 59 117 GLU . 51730 1 60 118 GLU . 51730 1 61 119 ARG . 51730 1 62 120 ARG . 51730 1 63 121 ARG . 51730 1 64 122 ALA . 51730 1 65 123 ALA . 51730 1 66 124 VAL . 51730 1 67 125 GLU . 51730 1 68 126 GLU . 51730 1 69 127 LYS . 51730 1 70 128 ARG . 51730 1 71 129 ARG . 51730 1 72 130 GLN . 51730 1 73 131 ARG . 51730 1 74 132 LEU . 51730 1 75 133 GLU . 51730 1 76 134 GLU . 51730 1 77 135 ASP . 51730 1 78 136 LYS . 51730 1 79 137 GLU . 51730 1 80 138 ARG . 51730 1 81 139 HIS . 51730 1 82 140 GLU . 51730 1 83 141 ALA . 51730 1 84 142 VAL . 51730 1 85 143 VAL . 51730 1 86 144 ARG . 51730 1 87 145 ARG . 51730 1 88 146 THR . 51730 1 89 147 MET . 51730 1 90 148 GLU . 51730 1 91 149 ARG . 51730 1 92 150 SER . 51730 1 93 151 GLN . 51730 1 94 152 LYS . 51730 1 95 153 PRO . 51730 1 96 154 LYS . 51730 1 97 155 GLN . 51730 1 98 156 LYS . 51730 1 99 157 HIS . 51730 1 100 158 ASN . 51730 1 101 159 ARG . 51730 1 102 160 TRP . 51730 1 103 161 SER . 51730 1 104 162 TRP . 51730 1 105 163 GLY . 51730 1 106 164 GLY . 51730 1 107 165 SER . 51730 1 108 166 LEU . 51730 1 109 167 HIS . 51730 1 110 168 GLY . 51730 1 111 169 SER . 51730 1 112 170 PRO . 51730 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 . PRO 1 1 51730 1 . VAL 2 2 51730 1 . LEU 3 3 51730 1 . ARG 4 4 51730 1 . VAL 5 5 51730 1 . ASP 6 6 51730 1 . ASP 7 7 51730 1 . ARG 8 8 51730 1 . GLN 9 9 51730 1 . ARG 10 10 51730 1 . LEU 11 11 51730 1 . ALA 12 12 51730 1 . ARG 13 13 51730 1 . GLU 14 14 51730 1 . ARG 15 15 51730 1 . ARG 16 16 51730 1 . GLU 17 17 51730 1 . GLU 18 18 51730 1 . ARG 19 19 51730 1 . GLU 20 20 51730 1 . LYS 21 21 51730 1 . GLN 22 22 51730 1 . LEU 23 23 51730 1 . ALA 24 24 51730 1 . ALA 25 25 51730 1 . ARG 26 26 51730 1 . GLU 27 27 51730 1 . ILE 28 28 51730 1 . VAL 29 29 51730 1 . TRP 30 30 51730 1 . LEU 31 31 51730 1 . GLU 32 32 51730 1 . ARG 33 33 51730 1 . GLU 34 34 51730 1 . GLU 35 35 51730 1 . ARG 36 36 51730 1 . ALA 37 37 51730 1 . ARG 38 38 51730 1 . GLN 39 39 51730 1 . HIS 40 40 51730 1 . TYR 41 41 51730 1 . GLU 42 42 51730 1 . LYS 43 43 51730 1 . HIS 44 44 51730 1 . LEU 45 45 51730 1 . GLU 46 46 51730 1 . GLU 47 47 51730 1 . ARG 48 48 51730 1 . LYS 49 49 51730 1 . LYS 50 50 51730 1 . ARG 51 51 51730 1 . LEU 52 52 51730 1 . GLU 53 53 51730 1 . GLU 54 54 51730 1 . GLN 55 55 51730 1 . ARG 56 56 51730 1 . GLN 57 57 51730 1 . LYS 58 58 51730 1 . GLU 59 59 51730 1 . GLU 60 60 51730 1 . ARG 61 61 51730 1 . ARG 62 62 51730 1 . ARG 63 63 51730 1 . ALA 64 64 51730 1 . ALA 65 65 51730 1 . VAL 66 66 51730 1 . GLU 67 67 51730 1 . GLU 68 68 51730 1 . LYS 69 69 51730 1 . ARG 70 70 51730 1 . ARG 71 71 51730 1 . GLN 72 72 51730 1 . ARG 73 73 51730 1 . LEU 74 74 51730 1 . GLU 75 75 51730 1 . GLU 76 76 51730 1 . ASP 77 77 51730 1 . LYS 78 78 51730 1 . GLU 79 79 51730 1 . ARG 80 80 51730 1 . HIS 81 81 51730 1 . GLU 82 82 51730 1 . ALA 83 83 51730 1 . VAL 84 84 51730 1 . VAL 85 85 51730 1 . ARG 86 86 51730 1 . ARG 87 87 51730 1 . THR 88 88 51730 1 . MET 89 89 51730 1 . GLU 90 90 51730 1 . ARG 91 91 51730 1 . SER 92 92 51730 1 . GLN 93 93 51730 1 . LYS 94 94 51730 1 . PRO 95 95 51730 1 . LYS 96 96 51730 1 . GLN 97 97 51730 1 . LYS 98 98 51730 1 . HIS 99 99 51730 1 . ASN 100 100 51730 1 . ARG 101 101 51730 1 . TRP 102 102 51730 1 . SER 103 103 51730 1 . TRP 104 104 51730 1 . GLY 105 105 51730 1 . GLY 106 106 51730 1 . SER 107 107 51730 1 . LEU 108 108 51730 1 . HIS 109 109 51730 1 . GLY 110 110 51730 1 . SER 111 111 51730 1 . PRO 112 112 51730 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51730 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 51730 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51730 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pLICHIS . . . 51730 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51730 _Sample.ID 1 _Sample.Name 'MAP7 MTBD' _Sample.Type solution _Sample.Sub_type . _Sample.Details '150 uM MAP7 MTBD in 40 mM NaPi; 150 mM NaCl; pH 6.5; 5% D2O; 1 mM DTT' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% D2O' _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 'MAP7 MTBD' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 150 . . uM . . . . 51730 1 2 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 51730 1 3 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 51730 1 4 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 51730 1 5 D2O 'natural abundance' . . . . . . 5 . . % . . . . 51730 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 51730 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'MAP7 MTBD assignment' _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' 212 . mM 51730 1 pH 6.5 . pH 51730 1 temperature 298 . K 51730 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51730 _Software.ID 1 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version 'POKY version 1' _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51730 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51730 _Software.ID 2 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 51730 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 51730 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker Avance III HD 600' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 51730 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 'Bruker Avance III HD 900' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51730 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N TROSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51730 1 2 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 51730 1 3 '3D HNCACO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 51730 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51730 1 5 '3D CCCONH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51730 1 6 '2D 1H-13C HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51730 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51730 1 8 '3D (H)CCH-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51730 1 9 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51730 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 51730 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name map7 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.713 internal indirect 0.251449530 . . . . . 51730 1 H 1 water protons . . . . ppm 4.713 internal direct 1.000000000 . . . . . 51730 1 N 15 water protons . . . . ppm 4.713 internal indirect 0.101329118 . . . . . 51730 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_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51730 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'MAP7 MTBD' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _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 '2D 1H-15N TROSY' . . . 51730 1 2 '3D HNCO' . . . 51730 1 3 '3D HNCACO' . . . 51730 1 4 '3D CBCA(CO)NH' . . . 51730 1 5 '3D CCCONH' . . . 51730 1 6 '2D 1H-13C HSQC' . . . 51730 1 7 '3D HBHA(CO)NH' . . . 51730 1 8 '3D (H)CCH-TOCSY' . . . 51730 1 9 '3D HNCA' . . . 51730 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 51730 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 PRO HA H 1 4.351 0.00 . . . . . . . 59 PRO HA . 51730 1 2 . 1 . 1 1 1 PRO HB2 H 1 2.187 0.00 . . . . . . . 59 PRO HB2 . 51730 1 3 . 1 . 1 1 1 PRO HB3 H 1 1.767 0.00 . . . . . . . 59 PRO HB3 . 51730 1 4 . 1 . 1 1 1 PRO C C 13 176.512 0.00 . . . . . . . 59 PRO C . 51730 1 5 . 1 . 1 1 1 PRO CA C 13 63.026 0.00 . . . . . . . 59 PRO CA . 51730 1 6 . 1 . 1 1 1 PRO CB C 13 32.000 0.00 . . . . . . . 59 PRO CB . 51730 1 7 . 1 . 1 2 2 VAL H H 1 8.083 0.01 . . . . . . . 60 VAL H . 51730 1 8 . 1 . 1 2 2 VAL HA H 1 3.959 0.00 . . . . . . . 60 VAL HA . 51730 1 9 . 1 . 1 2 2 VAL HB H 1 1.932 0.00 . . . . . . . 60 VAL HB . 51730 1 10 . 1 . 1 2 2 VAL HG11 H 1 0.825 0.00 . . . . . . . 60 VAL HG1 . 51730 1 11 . 1 . 1 2 2 VAL HG12 H 1 0.825 0.00 . . . . . . . 60 VAL HG1 . 51730 1 12 . 1 . 1 2 2 VAL HG13 H 1 0.825 0.00 . . . . . . . 60 VAL HG1 . 51730 1 13 . 1 . 1 2 2 VAL C C 13 175.986 0.00 . . . . . . . 60 VAL C . 51730 1 14 . 1 . 1 2 2 VAL CA C 13 62.290 0.00 . . . . . . . 60 VAL CA . 51730 1 15 . 1 . 1 2 2 VAL CB C 13 32.764 0.03 . . . . . . . 60 VAL CB . 51730 1 16 . 1 . 1 2 2 VAL CG1 C 13 21.141 0.00 . . . . . . . 60 VAL CG1 . 51730 1 17 . 1 . 1 2 2 VAL N N 15 120.936 0.08 . . . . . . . 60 VAL N . 51730 1 18 . 1 . 1 3 3 LEU H H 1 8.188 0.00 . . . . . . . 61 LEU H . 51730 1 19 . 1 . 1 3 3 LEU HA H 1 4.320 0.00 . . . . . . . 61 LEU HA . 51730 1 20 . 1 . 1 3 3 LEU HB2 H 1 1.984 0.00 . . . . . . . 61 LEU HB2 . 51730 1 21 . 1 . 1 3 3 LEU HB3 H 1 1.493 0.00 . . . . . . . 61 LEU HB3 . 51730 1 22 . 1 . 1 3 3 LEU HD21 H 1 0.861 0.00 . . . . . . . 61 LEU HD1 . 51730 1 23 . 1 . 1 3 3 LEU HD22 H 1 0.861 0.00 . . . . . . . 61 LEU HD1 . 51730 1 24 . 1 . 1 3 3 LEU HD23 H 1 0.861 0.00 . . . . . . . 61 LEU HD1 . 51730 1 25 . 1 . 1 3 3 LEU C C 13 176.820 0.00 . . . . . . . 61 LEU C . 51730 1 26 . 1 . 1 3 3 LEU CA C 13 54.877 0.02 . . . . . . . 61 LEU CA . 51730 1 27 . 1 . 1 3 3 LEU CB C 13 42.587 0.01 . . . . . . . 61 LEU CB . 51730 1 28 . 1 . 1 3 3 LEU CD1 C 13 23.507 0.01 . . . . . . . 61 LEU CD1 . 51730 1 29 . 1 . 1 3 3 LEU N N 15 126.680 0.05 . . . . . . . 61 LEU N . 51730 1 30 . 1 . 1 4 4 ARG H H 1 8.325 0.01 . . . . . . . 62 ARG H . 51730 1 31 . 1 . 1 4 4 ARG HA H 1 4.337 0.00 . . . . . . . 62 ARG HA . 51730 1 32 . 1 . 1 4 4 ARG HB2 H 1 1.788 0.00 . . . . . . . 62 ARG HB2 . 51730 1 33 . 1 . 1 4 4 ARG HB3 H 1 1.687 0.00 . . . . . . . 62 ARG HB3 . 51730 1 34 . 1 . 1 4 4 ARG HD2 H 1 3.134 0.00 . . . . . . . 62 ARG HD . 51730 1 35 . 1 . 1 4 4 ARG HD3 H 1 3.134 0.00 . . . . . . . 62 ARG HD . 51730 1 36 . 1 . 1 4 4 ARG C C 13 176.299 0.00 . . . . . . . 62 ARG C . 51730 1 37 . 1 . 1 4 4 ARG CA C 13 55.891 0.06 . . . . . . . 62 ARG CA . 51730 1 38 . 1 . 1 4 4 ARG CB C 13 31.008 0.02 . . . . . . . 62 ARG CB . 51730 1 39 . 1 . 1 4 4 ARG CD C 13 43.032 0.00 . . . . . . . 62 ARG CD . 51730 1 40 . 1 . 1 4 4 ARG N N 15 123.279 0.06 . . . . . . . 62 ARG N . 51730 1 41 . 1 . 1 5 5 VAL H H 1 8.191 0.01 . . . . . . . 63 VAL H . 51730 1 42 . 1 . 1 5 5 VAL HA H 1 3.969 0.00 . . . . . . . 63 VAL HA . 51730 1 43 . 1 . 1 5 5 VAL HB H 1 1.983 0.00 . . . . . . . 63 VAL HB . 51730 1 44 . 1 . 1 5 5 VAL HG11 H 1 0.861 0.00 . . . . . . . 63 VAL HG . 51730 1 45 . 1 . 1 5 5 VAL HG12 H 1 0.861 0.00 . . . . . . . 63 VAL HG . 51730 1 46 . 1 . 1 5 5 VAL HG13 H 1 0.861 0.00 . . . . . . . 63 VAL HG . 51730 1 47 . 1 . 1 5 5 VAL C C 13 175.819 0.00 . . . . . . . 63 VAL C . 51730 1 48 . 1 . 1 5 5 VAL CA C 13 62.716 0.01 . . . . . . . 63 VAL CA . 51730 1 49 . 1 . 1 5 5 VAL CB C 13 32.818 0.01 . . . . . . . 63 VAL CB . 51730 1 50 . 1 . 1 5 5 VAL CG1 C 13 20.635 0.00 . . . . . . . 63 VAL HG1 . 51730 1 51 . 1 . 1 5 5 VAL N N 15 122.010 0.05 . . . . . . . 63 VAL N . 51730 1 52 . 1 . 1 6 6 ASP H H 1 8.322 0.00 . . . . . . . 64 ASP H . 51730 1 53 . 1 . 1 6 6 ASP HA H 1 4.530 0.00 . . . . . . . 64 ASP HA . 51730 1 54 . 1 . 1 6 6 ASP HB2 H 1 2.630 0.00 . . . . . . . 64 ASP HB2 . 51730 1 55 . 1 . 1 6 6 ASP HB3 H 1 2.609 0.00 . . . . . . . 64 ASP HB3 . 51730 1 56 . 1 . 1 6 6 ASP C C 13 176.332 0.00 . . . . . . . 64 ASP C . 51730 1 57 . 1 . 1 6 6 ASP CA C 13 54.230 0.00 . . . . . . . 64 ASP CA . 51730 1 58 . 1 . 1 6 6 ASP CB C 13 41.242 0.00 . . . . . . . 64 ASP CB . 51730 1 59 . 1 . 1 6 6 ASP N N 15 123.350 0.04 . . . . . . . 64 ASP N . 51730 1 60 . 1 . 1 7 7 ASP H H 1 8.136 0.00 . . . . . . . 65 ASP H . 51730 1 61 . 1 . 1 7 7 ASP HA H 1 4.494 0.00 . . . . . . . 65 ASP HA . 51730 1 62 . 1 . 1 7 7 ASP HB2 H 1 2.619 0.00 . . . . . . . 65 ASP HB2 . 51730 1 63 . 1 . 1 7 7 ASP C C 13 177.138 0.00 . . . . . . . 65 ASP C . 51730 1 64 . 1 . 1 7 7 ASP CA C 13 55.324 0.00 . . . . . . . 65 ASP CA . 51730 1 65 . 1 . 1 7 7 ASP CB C 13 41.234 0.01 . . . . . . . 65 ASP CB . 51730 1 66 . 1 . 1 7 7 ASP N N 15 121.976 0.04 . . . . . . . 65 ASP N . 51730 1 67 . 1 . 1 8 8 ARG H H 1 8.206 0.00 . . . . . . . 66 ARG H . 51730 1 68 . 1 . 1 8 8 ARG HA H 1 4.007 0.00 . . . . . . . 66 ARG HA . 51730 1 69 . 1 . 1 8 8 ARG HB2 H 1 1.832 0.00 . . . . . . . 66 ARG HB2 . 51730 1 70 . 1 . 1 8 8 ARG HG2 H 1 1.525 0.00 . . . . . . . 66 ARG HG . 51730 1 71 . 1 . 1 8 8 ARG HG3 H 1 1.525 0.00 . . . . . . . 66 ARG HG . 51730 1 72 . 1 . 1 8 8 ARG HD2 H 1 3.134 0.00 . . . . . . . 66 ARG HD . 51730 1 73 . 1 . 1 8 8 ARG HD3 H 1 3.134 0.00 . . . . . . . 66 ARG HD . 51730 1 74 . 1 . 1 8 8 ARG C C 13 178.231 0.00 . . . . . . . 66 ARG C . 51730 1 75 . 1 . 1 8 8 ARG CA C 13 58.363 0.02 . . . . . . . 66 ARG CA . 51730 1 76 . 1 . 1 8 8 ARG CB C 13 30.077 0.02 . . . . . . . 66 ARG CB . 51730 1 77 . 1 . 1 8 8 ARG CD C 13 43.505 0.00 . . . . . . . 66 ARG CA . 51730 1 78 . 1 . 1 8 8 ARG CG C 13 27.210 0.00 . . . . . . . 66 ARG CG . 51730 1 79 . 1 . 1 8 8 ARG N N 15 120.452 0.03 . . . . . . . 66 ARG N . 51730 1 80 . 1 . 1 9 9 GLN H H 1 8.190 0.00 . . . . . . . 67 GLN H . 51730 1 81 . 1 . 1 9 9 GLN HA H 1 4.127 0.00 . . . . . . . 67 GLN HA . 51730 1 82 . 1 . 1 9 9 GLN HB2 H 1 2.040 0.00 . . . . . . . 67 GLN HB2 . 51730 1 83 . 1 . 1 9 9 GLN C C 13 177.441 0.03 . . . . . . . 67 GLN C . 51730 1 84 . 1 . 1 9 9 GLN CA C 13 57.556 0.04 . . . . . . . 67 GLN CA . 51730 1 85 . 1 . 1 9 9 GLN CB C 13 28.709 0.00 . . . . . . . 67 GLN CB . 51730 1 86 . 1 . 1 9 9 GLN N N 15 119.284 0.06 . . . . . . . 67 GLN N . 51730 1 87 . 1 . 1 10 10 ARG H H 1 7.962 0.00 . . . . . . . 68 ARG H . 51730 1 88 . 1 . 1 10 10 ARG HA H 1 4.034 0.00 . . . . . . . 68 ARG HA . 51730 1 89 . 1 . 1 10 10 ARG HB2 H 1 1.980 0.00 . . . . . . . 68 ARG HB2 . 51730 1 90 . 1 . 1 10 10 ARG HB3 H 1 1.778 0.00 . . . . . . . 68 ARG HB3 . 51730 1 91 . 1 . 1 10 10 ARG C C 13 177.649 0.04 . . . . . . . 68 ARG C . 51730 1 92 . 1 . 1 10 10 ARG CA C 13 58.260 0.08 . . . . . . . 68 ARG CA . 51730 1 93 . 1 . 1 10 10 ARG CB C 13 32.705 0.12 . . . . . . . 68 ARG CB . 51730 1 94 . 1 . 1 10 10 ARG N N 15 121.570 0.09 . . . . . . . 68 ARG N . 51730 1 95 . 1 . 1 11 11 LEU H H 1 8.017 0.01 . . . . . . . 69 LEU H . 51730 1 96 . 1 . 1 11 11 LEU HA H 1 4.087 0.00 . . . . . . . 69 LEU HA . 51730 1 97 . 1 . 1 11 11 LEU HB2 H 1 1.636 0.00 . . . . . . . 69 LEU HB2 . 51730 1 98 . 1 . 1 11 11 LEU HB3 H 1 1.494 0.00 . . . . . . . 69 LEU HB3 . 51730 1 99 . 1 . 1 11 11 LEU HD21 H 1 0.795 0.00 . . . . . . . 69 LEU HD1 . 51730 1 100 . 1 . 1 11 11 LEU HD22 H 1 0.795 0.00 . . . . . . . 69 LEU HD1 . 51730 1 101 . 1 . 1 11 11 LEU HD23 H 1 0.795 0.00 . . . . . . . 69 LEU HD1 . 51730 1 102 . 1 . 1 11 11 LEU C C 13 178.292 0.00 . . . . . . . 69 LEU C . 51730 1 103 . 1 . 1 11 11 LEU CA C 13 56.555 0.01 . . . . . . . 69 LEU CA . 51730 1 104 . 1 . 1 11 11 LEU CB C 13 42.037 0.01 . . . . . . . 69 LEU CB . 51730 1 105 . 1 . 1 11 11 LEU CD1 C 13 23.359 0.00 . . . . . . . 69 LEU CD1 . 51730 1 106 . 1 . 1 11 11 LEU N N 15 120.554 0.05 . . . . . . . 69 LEU N . 51730 1 107 . 1 . 1 12 12 ALA H H 1 7.864 0.01 . . . . . . . 70 ALA H . 51730 1 108 . 1 . 1 12 12 ALA HA H 1 4.086 0.00 . . . . . . . 70 ALA HA . 51730 1 109 . 1 . 1 12 12 ALA HB1 H 1 1.372 0.00 . . . . . . . 70 ALA HB . 51730 1 110 . 1 . 1 12 12 ALA HB2 H 1 1.372 0.00 . . . . . . . 70 ALA HB . 51730 1 111 . 1 . 1 12 12 ALA HB3 H 1 1.372 0.00 . . . . . . . 70 ALA HB . 51730 1 112 . 1 . 1 12 12 ALA C C 13 179.403 0.00 . . . . . . . 70 ALA C . 51730 1 113 . 1 . 1 12 12 ALA CA C 13 54.043 0.00 . . . . . . . 70 ALA CA . 51730 1 114 . 1 . 1 12 12 ALA CB C 13 18.578 0.02 . . . . . . . 70 ALA CB . 51730 1 115 . 1 . 1 12 12 ALA N N 15 122.367 0.05 . . . . . . . 70 ALA N . 51730 1 116 . 1 . 1 13 13 ARG H H 1 7.956 0.00 . . . . . . . 71 ARG H . 51730 1 117 . 1 . 1 13 13 ARG HA H 1 4.055 0.00 . . . . . . . 71 ARG HA . 51730 1 118 . 1 . 1 13 13 ARG HB2 H 1 1.845 0.00 . . . . . . . 71 ARG HB2 . 51730 1 119 . 1 . 1 13 13 ARG HB3 H 1 1.838 0.00 . . . . . . . 71 ARG HB3 . 51730 1 120 . 1 . 1 13 13 ARG HD2 H 1 3.022 0.00 . . . . . . . 71 ARG HD . 51730 1 121 . 1 . 1 13 13 ARG HD3 H 1 3.022 0.00 . . . . . . . 71 ARG HD . 51730 1 122 . 1 . 1 13 13 ARG C C 13 177.522 0.00 . . . . . . . 71 ARG C . 51730 1 123 . 1 . 1 13 13 ARG CA C 13 58.096 0.00 . . . . . . . 71 ARG CA . 51730 1 124 . 1 . 1 13 13 ARG CB C 13 30.248 0.06 . . . . . . . 71 ARG CB . 51730 1 125 . 1 . 1 13 13 ARG CD C 13 43.486 0.00 . . . . . . . 71 ARG CD . 51730 1 126 . 1 . 1 13 13 ARG N N 15 119.587 0.04 . . . . . . . 71 ARG N . 51730 1 127 . 1 . 1 14 14 GLU H H 1 8.256 0.00 . . . . . . . 72 GLU H . 51730 1 128 . 1 . 1 14 14 GLU HA H 1 4.066 0.00 . . . . . . . 72 GLU HA . 51730 1 129 . 1 . 1 14 14 GLU HB2 H 1 1.995 0.00 . . . . . . . 72 GLU HB2 . 51730 1 130 . 1 . 1 14 14 GLU C C 13 178.101 0.00 . . . . . . . 72 GLU C . 51730 1 131 . 1 . 1 14 14 GLU CA C 13 58.227 0.00 . . . . . . . 72 GLU CA . 51730 1 132 . 1 . 1 14 14 GLU CB C 13 29.860 0.04 . . . . . . . 72 GLU CB . 51730 1 133 . 1 . 1 14 14 GLU N N 15 120.364 0.02 . . . . . . . 72 GLU N . 51730 1 134 . 1 . 1 15 15 ARG H H 1 8.122 0.00 . . . . . . . 73 ARG H . 51730 1 135 . 1 . 1 15 15 ARG C C 13 177.736 0.02 . . . . . . . 73 ARG C . 51730 1 136 . 1 . 1 15 15 ARG CA C 13 57.556 0.00 . . . . . . . 73 ARG CA . 51730 1 137 . 1 . 1 15 15 ARG CB C 13 30.404 0.05 . . . . . . . 73 ARG CB . 51730 1 138 . 1 . 1 15 15 ARG N N 15 120.311 0.04 . . . . . . . 73 ARG N . 51730 1 139 . 1 . 1 16 16 ARG H H 1 8.036 0.00 . . . . . . . 74 ARG H . 51730 1 140 . 1 . 1 16 16 ARG HA H 1 4.114 0.00 . . . . . . . 74 ARG HA . 51730 1 141 . 1 . 1 16 16 ARG HB2 H 1 1.761 0.00 . . . . . . . 74 ARG HB2 . 51730 1 142 . 1 . 1 16 16 ARG HB3 H 1 1.538 0.00 . . . . . . . 74 ARG HB3 . 51730 1 143 . 1 . 1 16 16 ARG HD2 H 1 3.103 0.00 . . . . . . . 74 ARG HD . 51730 1 144 . 1 . 1 16 16 ARG HD3 H 1 3.103 0.00 . . . . . . . 74 ARG HD . 51730 1 145 . 1 . 1 16 16 ARG C C 13 177.791 0.03 . . . . . . . 74 ARG C . 51730 1 146 . 1 . 1 16 16 ARG CA C 13 58.203 0.00 . . . . . . . 74 ARG CA . 51730 1 147 . 1 . 1 16 16 ARG CB C 13 30.315 0.00 . . . . . . . 74 ARG CB . 51730 1 148 . 1 . 1 16 16 ARG CD C 13 43.353 0.00 . . . . . . . 74 ARG CD . 51730 1 149 . 1 . 1 16 16 ARG N N 15 121.774 0.03 . . . . . . . 74 ARG N . 51730 1 150 . 1 . 1 17 17 GLU H H 1 8.048 0.01 . . . . . . . 75 GLU H . 51730 1 151 . 1 . 1 17 17 GLU HA H 1 4.077 0.00 . . . . . . . 75 GLU HA . 51730 1 152 . 1 . 1 17 17 GLU HB2 H 1 2.022 0.00 . . . . . . . 75 GLU HB2 . 51730 1 153 . 1 . 1 17 17 GLU HB3 H 1 1.834 0.00 . . . . . . . 75 GLU HB3 . 51730 1 154 . 1 . 1 17 17 GLU C C 13 177.964 0.04 . . . . . . . 75 GLU C . 51730 1 155 . 1 . 1 17 17 GLU CA C 13 58.365 0.00 . . . . . . . 75 GLU CA . 51730 1 156 . 1 . 1 17 17 GLU CB C 13 30.321 0.00 . . . . . . . 75 GLU CB . 51730 1 157 . 1 . 1 17 17 GLU N N 15 120.078 0.10 . . . . . . . 75 GLU N . 51730 1 158 . 1 . 1 18 18 GLU H H 1 7.932 0.01 . . . . . . . 76 GLU H . 51730 1 159 . 1 . 1 18 18 GLU HA H 1 4.096 0.00 . . . . . . . 76 GLU HA . 51730 1 160 . 1 . 1 18 18 GLU HB2 H 1 1.859 0.00 . . . . . . . 76 GLU HB2 . 51730 1 161 . 1 . 1 18 18 GLU HB3 H 1 1.816 0.00 . . . . . . . 76 GLU HB3 . 51730 1 162 . 1 . 1 18 18 GLU C C 13 177.968 0.05 . . . . . . . 76 GLU C . 51730 1 163 . 1 . 1 18 18 GLU CA C 13 58.402 0.00 . . . . . . . 76 GLU CA . 51730 1 164 . 1 . 1 18 18 GLU CB C 13 30.411 0.00 . . . . . . . 76 GLU CB . 51730 1 165 . 1 . 1 18 18 GLU N N 15 120.440 0.04 . . . . . . . 76 GLU N . 51730 1 166 . 1 . 1 19 19 ARG H H 1 8.217 0.00 . . . . . . . 77 ARG H . 51730 1 167 . 1 . 1 19 19 ARG C C 13 178.218 0.00 . . . . . . . 77 ARG C . 51730 1 168 . 1 . 1 19 19 ARG CA C 13 58.303 0.00 . . . . . . . 77 ARG CA . 51730 1 169 . 1 . 1 19 19 ARG CB C 13 29.672 0.01 . . . . . . . 77 ARG CB . 51730 1 170 . 1 . 1 19 19 ARG N N 15 119.597 0.04 . . . . . . . 77 ARG N . 51730 1 171 . 1 . 1 20 20 GLU H H 1 8.135 0.00 . . . . . . . 78 GLU H . 51730 1 172 . 1 . 1 20 20 GLU CA C 13 58.508 0.00 . . . . . . . 78 GLU CA . 51730 1 173 . 1 . 1 20 20 GLU CB C 13 29.681 0.00 . . . . . . . 78 GLU CB . 51730 1 174 . 1 . 1 20 20 GLU N N 15 120.929 0.02 . . . . . . . 78 GLU N . 51730 1 175 . 1 . 1 21 21 LYS HA H 1 4.107 0.00 . . . . . . . 79 LYS HA . 51730 1 176 . 1 . 1 21 21 LYS HB2 H 1 2.045 0.00 . . . . . . . 79 LYS HB2 . 51730 1 177 . 1 . 1 21 21 LYS HB3 H 1 1.832 0.00 . . . . . . . 79 LYS HB3 . 51730 1 178 . 1 . 1 21 21 LYS HG2 H 1 1.495 0.00 . . . . . . . 79 LYS HG . 51730 1 179 . 1 . 1 21 21 LYS HG3 H 1 1.495 0.00 . . . . . . . 79 LYS HG . 51730 1 180 . 1 . 1 21 21 LYS CA C 13 58.154 0.00 . . . . . . . 79 LYS CA . 51730 1 181 . 1 . 1 21 21 LYS CB C 13 32.671 0.00 . . . . . . . 79 LYS CB . 51730 1 182 . 1 . 1 21 21 LYS CG C 13 25.048 0.00 . . . . . . . 79 LYS CG . 51730 1 183 . 1 . 1 22 22 GLN H H 1 8.014 0.00 . . . . . . . 80 GLN H . 51730 1 184 . 1 . 1 22 22 GLN HA H 1 4.143 0.00 . . . . . . . 80 GLN HA . 51730 1 185 . 1 . 1 22 22 GLN HB2 H 1 2.046 0.00 . . . . . . . 80 GLN HB2 . 51730 1 186 . 1 . 1 22 22 GLN HB3 H 1 1.831 0.00 . . . . . . . 80 GLN HB3 . 51730 1 187 . 1 . 1 22 22 GLN C C 13 175.937 0.00 . . . . . . . 80 GLN C . 51730 1 188 . 1 . 1 22 22 GLN CA C 13 57.161 0.00 . . . . . . . 80 GLN CA . 51730 1 189 . 1 . 1 22 22 GLN CB C 13 28.791 0.03 . . . . . . . 80 GLN CB . 51730 1 190 . 1 . 1 22 22 GLN N N 15 119.905 0.07 . . . . . . . 80 GLN N . 51730 1 191 . 1 . 1 23 23 LEU H H 1 8.024 0.01 . . . . . . . 81 LEU H . 51730 1 192 . 1 . 1 23 23 LEU HA H 1 4.106 0.00 . . . . . . . 81 LEU HA . 51730 1 193 . 1 . 1 23 23 LEU HB2 H 1 1.657 0.00 . . . . . . . 81 LEU HB2 . 51730 1 194 . 1 . 1 23 23 LEU HB3 H 1 1.504 0.00 . . . . . . . 81 LEU HB3 . 51730 1 195 . 1 . 1 23 23 LEU HG H 1 1.601 0.00 . . . . . . . 81 LEU HG . 51730 1 196 . 1 . 1 23 23 LEU C C 13 178.154 0.03 . . . . . . . 81 LEU C . 51730 1 197 . 1 . 1 23 23 LEU CA C 13 56.397 0.00 . . . . . . . 81 LEU CA . 51730 1 198 . 1 . 1 23 23 LEU CB C 13 42.150 0.02 . . . . . . . 81 LEU CB . 51730 1 199 . 1 . 1 23 23 LEU CG C 13 27.250 0.00 . . . . . . . 81 LEU CG . 51730 1 200 . 1 . 1 23 23 LEU N N 15 121.748 0.04 . . . . . . . 81 LEU N . 51730 1 201 . 1 . 1 24 24 ALA H H 1 7.955 0.01 . . . . . . . 82 ALA H . 51730 1 202 . 1 . 1 24 24 ALA HA H 1 4.153 0.00 . . . . . . . 82 ALA HA . 51730 1 203 . 1 . 1 24 24 ALA HB1 H 1 1.367 0.00 . . . . . . . 82 ALA HB . 51730 1 204 . 1 . 1 24 24 ALA HB2 H 1 1.367 0.00 . . . . . . . 82 ALA HB . 51730 1 205 . 1 . 1 24 24 ALA HB3 H 1 1.367 0.00 . . . . . . . 82 ALA HB . 51730 1 206 . 1 . 1 24 24 ALA C C 13 178.360 0.00 . . . . . . . 82 ALA C . 51730 1 207 . 1 . 1 24 24 ALA CA C 13 53.280 0.00 . . . . . . . 82 ALA CA . 51730 1 208 . 1 . 1 24 24 ALA CB C 13 18.818 0.00 . . . . . . . 82 ALA CB . 51730 1 209 . 1 . 1 24 24 ALA N N 15 122.954 0.06 . . . . . . . 82 ALA N . 51730 1 210 . 1 . 1 25 25 ALA H H 1 7.849 0.01 . . . . . . . 83 ALA H . 51730 1 211 . 1 . 1 25 25 ALA HA H 1 4.147 0.00 . . . . . . . 83 ALA HA . 51730 1 212 . 1 . 1 25 25 ALA HB1 H 1 1.358 0.00 . . . . . . . 83 ALA HB . 51730 1 213 . 1 . 1 25 25 ALA HB2 H 1 1.358 0.00 . . . . . . . 83 ALA HB . 51730 1 214 . 1 . 1 25 25 ALA HB3 H 1 1.358 0.00 . . . . . . . 83 ALA HB . 51730 1 215 . 1 . 1 25 25 ALA C C 13 178.482 0.00 . . . . . . . 83 ALA C . 51730 1 216 . 1 . 1 25 25 ALA CA C 13 53.354 0.00 . . . . . . . 83 ALA CA . 51730 1 217 . 1 . 1 25 25 ALA CB C 13 18.826 0.02 . . . . . . . 83 ALA CB . 51730 1 218 . 1 . 1 25 25 ALA N N 15 121.611 0.06 . . . . . . . 83 ALA N . 51730 1 219 . 1 . 1 26 26 ARG H H 1 7.898 0.01 . . . . . . . 84 ARG H . 51730 1 220 . 1 . 1 26 26 ARG HA H 1 4.049 0.00 . . . . . . . 84 ARG HA . 51730 1 221 . 1 . 1 26 26 ARG HB2 H 1 1.977 0.00 . . . . . . . 84 ARG HB2 . 51730 1 222 . 1 . 1 26 26 ARG C C 13 176.824 0.00 . . . . . . . 84 ARG C . 51730 1 223 . 1 . 1 26 26 ARG CA C 13 57.054 0.00 . . . . . . . 84 ARG CA . 51730 1 224 . 1 . 1 26 26 ARG CB C 13 30.628 0.00 . . . . . . . 84 ARG CB . 51730 1 225 . 1 . 1 26 26 ARG N N 15 118.549 0.04 . . . . . . . 84 ARG N . 51730 1 226 . 1 . 1 27 27 GLU H H 1 8.060 0.00 . . . . . . . 85 GLU H . 51730 1 227 . 1 . 1 27 27 GLU HA H 1 4.152 0.00 . . . . . . . 85 GLU HA . 51730 1 228 . 1 . 1 27 27 GLU HB2 H 1 1.973 0.00 . . . . . . . 85 GLU HB2 . 51730 1 229 . 1 . 1 27 27 GLU HG2 H 1 2.314 0.00 . . . . . . . 85 GLU HG . 51730 1 230 . 1 . 1 27 27 GLU HG3 H 1 2.314 0.00 . . . . . . . 85 GLU HG . 51730 1 231 . 1 . 1 27 27 GLU C C 13 177.003 0.00 . . . . . . . 85 GLU C . 51730 1 232 . 1 . 1 27 27 GLU CA C 13 57.378 0.00 . . . . . . . 85 GLU CA . 51730 1 233 . 1 . 1 27 27 GLU CB C 13 30.112 0.01 . . . . . . . 85 GLU CB . 51730 1 234 . 1 . 1 27 27 GLU CG C 13 36.499 0.00 . . . . . . . 85 GLU CG . 51730 1 235 . 1 . 1 27 27 GLU N N 15 120.529 0.05 . . . . . . . 85 GLU N . 51730 1 236 . 1 . 1 28 28 ILE H H 1 7.839 0.01 . . . . . . . 86 ILE H . 51730 1 237 . 1 . 1 28 28 ILE HA H 1 3.901 0.00 . . . . . . . 86 ILE HA . 51730 1 238 . 1 . 1 28 28 ILE HB H 1 1.765 0.00 . . . . . . . 86 ILE HB . 51730 1 239 . 1 . 1 28 28 ILE HD11 H 1 0.759 0.00 . . . . . . . 86 ILE HD1 . 51730 1 240 . 1 . 1 28 28 ILE HD12 H 1 0.759 0.00 . . . . . . . 86 ILE HD1 . 51730 1 241 . 1 . 1 28 28 ILE HD13 H 1 0.759 0.00 . . . . . . . 86 ILE HD1 . 51730 1 242 . 1 . 1 28 28 ILE HG12 H 1 1.097 0.00 . . . . . . . 86 ILE HG1 . 51730 1 243 . 1 . 1 28 28 ILE HG13 H 1 1.097 0.00 . . . . . . . 86 ILE HG1 . 51730 1 244 . 1 . 1 28 28 ILE HG21 H 1 0.671 0.00 . . . . . . . 86 ILE HG2 . 51730 1 245 . 1 . 1 28 28 ILE HG22 H 1 0.671 0.00 . . . . . . . 86 ILE HG2 . 51730 1 246 . 1 . 1 28 28 ILE HG23 H 1 0.671 0.00 . . . . . . . 86 ILE HG2 . 51730 1 247 . 1 . 1 28 28 ILE C C 13 176.718 0.00 . . . . . . . 86 ILE C . 51730 1 248 . 1 . 1 28 28 ILE CA C 13 62.337 0.00 . . . . . . . 86 ILE CA . 51730 1 249 . 1 . 1 28 28 ILE CB C 13 38.358 0.02 . . . . . . . 86 ILE CB . 51730 1 250 . 1 . 1 28 28 ILE CD1 C 13 12.782 0.00 . . . . . . . 86 ILE CD1 . 51730 1 251 . 1 . 1 28 28 ILE CG1 C 13 27.920 0.00 . . . . . . . 86 ILE CG1 . 51730 1 252 . 1 . 1 28 28 ILE CG2 C 13 17.249 0.00 . . . . . . . 86 ILE CG2 . 51730 1 253 . 1 . 1 28 28 ILE N N 15 121.091 0.09 . . . . . . . 86 ILE N . 51730 1 254 . 1 . 1 29 29 VAL H H 1 7.756 0.01 . . . . . . . 87 VAL H . 51730 1 255 . 1 . 1 29 29 VAL HA H 1 3.901 0.00 . . . . . . . 87 VAL HA . 51730 1 256 . 1 . 1 29 29 VAL HB H 1 1.951 0.00 . . . . . . . 87 VAL HB . 51730 1 257 . 1 . 1 29 29 VAL HG11 H 1 0.832 0.00 . . . . . . . 87 VAL HG1 . 51730 1 258 . 1 . 1 29 29 VAL HG12 H 1 0.832 0.00 . . . . . . . 87 VAL HG1 . 51730 1 259 . 1 . 1 29 29 VAL HG13 H 1 0.832 0.00 . . . . . . . 87 VAL HG1 . 51730 1 260 . 1 . 1 29 29 VAL C C 13 176.770 0.00 . . . . . . . 87 VAL C . 51730 1 261 . 1 . 1 29 29 VAL CA C 13 63.654 0.01 . . . . . . . 87 VAL CA . 51730 1 262 . 1 . 1 29 29 VAL CB C 13 32.322 0.01 . . . . . . . 87 VAL CB . 51730 1 263 . 1 . 1 29 29 VAL CG1 C 13 20.882 0.00 . . . . . . . 87 VAL CG1 . 51730 1 264 . 1 . 1 29 29 VAL N N 15 122.434 0.05 . . . . . . . 87 VAL N . 51730 1 265 . 1 . 1 30 30 TRP H H 1 7.996 0.01 . . . . . . . 88 TRP H . 51730 1 266 . 1 . 1 30 30 TRP HA H 1 4.456 0.00 . . . . . . . 88 TRP HA . 51730 1 267 . 1 . 1 30 30 TRP HB2 H 1 3.287 0.00 . . . . . . . 88 TRP HB2 . 51730 1 268 . 1 . 1 30 30 TRP HB3 H 1 3.180 0.00 . . . . . . . 88 TRP HB3 . 51730 1 269 . 1 . 1 30 30 TRP C C 13 176.917 0.00 . . . . . . . 88 TRP C . 51730 1 270 . 1 . 1 30 30 TRP CA C 13 58.451 0.02 . . . . . . . 88 TRP CA . 51730 1 271 . 1 . 1 30 30 TRP CB C 13 29.423 0.01 . . . . . . . 88 TRP CB . 51730 1 272 . 1 . 1 30 30 TRP N N 15 123.712 0.06 . . . . . . . 88 TRP N . 51730 1 273 . 1 . 1 31 31 LEU H H 1 8.002 0.01 . . . . . . . 89 LEU H . 51730 1 274 . 1 . 1 31 31 LEU HA H 1 4.066 0.00 . . . . . . . 89 LEU HA . 51730 1 275 . 1 . 1 31 31 LEU HB2 H 1 1.999 0.00 . . . . . . . 89 LEU HB2 . 51730 1 276 . 1 . 1 31 31 LEU HB3 H 1 1.476 0.00 . . . . . . . 89 LEU HB3 . 51730 1 277 . 1 . 1 31 31 LEU C C 13 178.149 0.03 . . . . . . . 89 LEU C . 51730 1 278 . 1 . 1 31 31 LEU CA C 13 56.380 0.00 . . . . . . . 89 LEU CA . 51730 1 279 . 1 . 1 31 31 LEU CB C 13 42.477 0.02 . . . . . . . 89 LEU CB . 51730 1 280 . 1 . 1 31 31 LEU N N 15 122.543 0.02 . . . . . . . 89 LEU N . 51730 1 281 . 1 . 1 32 32 GLU H H 1 8.119 0.00 . . . . . . . 90 GLU H . 51730 1 282 . 1 . 1 32 32 GLU HA H 1 4.030 0.00 . . . . . . . 90 GLU HA . 51730 1 283 . 1 . 1 32 32 GLU HB2 H 1 1.991 0.00 . . . . . . . 90 GLU HB2 . 51730 1 284 . 1 . 1 32 32 GLU HB3 H 1 1.847 0.00 . . . . . . . 90 GLU HB3 . 51730 1 285 . 1 . 1 32 32 GLU C C 13 177.766 0.02 . . . . . . . 90 GLU C . 51730 1 286 . 1 . 1 32 32 GLU CA C 13 58.040 0.00 . . . . . . . 90 GLU CA . 51730 1 287 . 1 . 1 32 32 GLU CB C 13 29.780 0.01 . . . . . . . 90 GLU CB . 51730 1 288 . 1 . 1 32 32 GLU N N 15 120.603 0.06 . . . . . . . 90 GLU N . 51730 1 289 . 1 . 1 33 33 ARG H H 1 8.014 0.01 . . . . . . . 91 ARG H . 51730 1 290 . 1 . 1 33 33 ARG HA H 1 4.022 0.00 . . . . . . . 91 ARG HA . 51730 1 291 . 1 . 1 33 33 ARG HB2 H 1 1.977 0.00 . . . . . . . 91 ARG HB2 . 51730 1 292 . 1 . 1 33 33 ARG HB3 H 1 1.798 0.00 . . . . . . . 91 ARG HB3 . 51730 1 293 . 1 . 1 33 33 ARG C C 13 177.930 0.00 . . . . . . . 91 ARG C . 51730 1 294 . 1 . 1 33 33 ARG CA C 13 58.148 0.00 . . . . . . . 91 ARG CA . 51730 1 295 . 1 . 1 33 33 ARG CB C 13 30.406 0.00 . . . . . . . 91 ARG CB . 51730 1 296 . 1 . 1 33 33 ARG N N 15 120.219 0.09 . . . . . . . 91 ARG N . 51730 1 297 . 1 . 1 34 34 GLU H H 1 8.178 0.00 . . . . . . . 92 GLU H . 51730 1 298 . 1 . 1 34 34 GLU HB2 H 1 1.946 0.00 . . . . . . . 92 GLU HB2 . 51730 1 299 . 1 . 1 34 34 GLU C C 13 177.895 0.00 . . . . . . . 92 GLU C . 51730 1 300 . 1 . 1 34 34 GLU CA C 13 58.061 0.00 . . . . . . . 92 GLU CA . 51730 1 301 . 1 . 1 34 34 GLU CB C 13 29.703 0.04 . . . . . . . 92 GLU CB . 51730 1 302 . 1 . 1 34 34 GLU N N 15 120.903 0.05 . . . . . . . 92 GLU N . 51730 1 303 . 1 . 1 35 35 GLU H H 1 8.164 0.01 . . . . . . . 93 GLU H . 51730 1 304 . 1 . 1 35 35 GLU HB3 H 1 1.830 0.00 . . . . . . . 93 GLU HB3 . 51730 1 305 . 1 . 1 35 35 GLU C C 13 178.026 0.00 . . . . . . . 93 GLU C . 51730 1 306 . 1 . 1 35 35 GLU CA C 13 58.285 0.00 . . . . . . . 93 GLU CA . 51730 1 307 . 1 . 1 35 35 GLU CB C 13 29.681 0.00 . . . . . . . 93 GLU CB . 51730 1 308 . 1 . 1 35 35 GLU N N 15 121.451 0.03 . . . . . . . 93 GLU N . 51730 1 309 . 1 . 1 36 36 ARG H H 1 8.080 0.00 . . . . . . . 94 ARG H . 51730 1 310 . 1 . 1 36 36 ARG HA H 1 4.263 0.00 . . . . . . . 94 ARG HA . 51730 1 311 . 1 . 1 36 36 ARG HB2 H 1 1.776 0.00 . . . . . . . 94 ARG HB2 . 51730 1 312 . 1 . 1 36 36 ARG HB3 H 1 1.480 0.00 . . . . . . . 94 ARG HB3 . 51730 1 313 . 1 . 1 36 36 ARG C C 13 177.800 0.00 . . . . . . . 94 ARG C . 51730 1 314 . 1 . 1 36 36 ARG CA C 13 56.729 0.00 . . . . . . . 94 ARG CA . 51730 1 315 . 1 . 1 36 36 ARG CB C 13 30.247 0.01 . . . . . . . 94 ARG CB . 51730 1 316 . 1 . 1 36 36 ARG N N 15 119.971 0.05 . . . . . . . 94 ARG N . 51730 1 317 . 1 . 1 37 37 ALA H H 1 7.885 0.01 . . . . . . . 95 ALA H . 51730 1 318 . 1 . 1 37 37 ALA HA H 1 4.090 0.00 . . . . . . . 95 ALA HA . 51730 1 319 . 1 . 1 37 37 ALA HB1 H 1 1.403 0.00 . . . . . . . 95 ALA HB . 51730 1 320 . 1 . 1 37 37 ALA HB2 H 1 1.403 0.00 . . . . . . . 95 ALA HB . 51730 1 321 . 1 . 1 37 37 ALA HB3 H 1 1.403 0.00 . . . . . . . 95 ALA HB . 51730 1 322 . 1 . 1 37 37 ALA C C 13 179.301 0.00 . . . . . . . 95 ALA C . 51730 1 323 . 1 . 1 37 37 ALA CA C 13 54.011 0.00 . . . . . . . 95 ALA CA . 51730 1 324 . 1 . 1 37 37 ALA CB C 13 18.852 0.05 . . . . . . . 95 ALA CB . 51730 1 325 . 1 . 1 37 37 ALA N N 15 122.509 0.05 . . . . . . . 95 ALA N . 51730 1 326 . 1 . 1 38 38 ARG H H 1 7.958 0.01 . . . . . . . 96 ARG H . 51730 1 327 . 1 . 1 38 38 ARG HA H 1 4.020 0.00 . . . . . . . 96 ARG HA . 51730 1 328 . 1 . 1 38 38 ARG HB2 H 1 2.001 0.00 . . . . . . . 96 ARG HB2 . 51730 1 329 . 1 . 1 38 38 ARG HB3 H 1 1.854 0.00 . . . . . . . 96 ARG HB3 . 51730 1 330 . 1 . 1 38 38 ARG C C 13 175.954 0.03 . . . . . . . 96 ARG C . 51730 1 331 . 1 . 1 38 38 ARG CA C 13 58.180 0.02 . . . . . . . 96 ARG CA . 51730 1 332 . 1 . 1 38 38 ARG CB C 13 30.240 0.00 . . . . . . . 96 ARG CB . 51730 1 333 . 1 . 1 38 38 ARG N N 15 119.596 0.07 . . . . . . . 96 ARG N . 51730 1 334 . 1 . 1 39 39 GLN H H 1 7.949 0.01 . . . . . . . 97 GLN H . 51730 1 335 . 1 . 1 39 39 GLN HA H 1 4.087 0.00 . . . . . . . 97 GLN HA . 51730 1 336 . 1 . 1 39 39 GLN C C 13 177.983 0.00 . . . . . . . 97 GLN C . 51730 1 337 . 1 . 1 39 39 GLN CA C 13 58.228 0.07 . . . . . . . 97 GLN CA . 51730 1 338 . 1 . 1 39 39 GLN CB C 13 29.805 0.00 . . . . . . . 97 GLN CB . 51730 1 339 . 1 . 1 39 39 GLN N N 15 120.695 0.07 . . . . . . . 97 GLN N . 51730 1 340 . 1 . 1 40 40 HIS H H 1 8.088 0.00 . . . . . . . 98 HIS H . 51730 1 341 . 1 . 1 40 40 HIS HA H 1 4.105 0.00 . . . . . . . 98 HIS HA . 51730 1 342 . 1 . 1 40 40 HIS HB2 H 1 3.120 0.00 . . . . . . . 98 HIS HB2 . 51730 1 343 . 1 . 1 40 40 HIS C C 13 175.976 0.02 . . . . . . . 98 HIS C . 51730 1 344 . 1 . 1 40 40 HIS CA C 13 57.695 0.00 . . . . . . . 98 HIS CA . 51730 1 345 . 1 . 1 40 40 HIS CB C 13 29.885 0.01 . . . . . . . 98 HIS CB . 51730 1 346 . 1 . 1 40 40 HIS N N 15 119.874 0.10 . . . . . . . 98 HIS N . 51730 1 347 . 1 . 1 41 41 TYR H H 1 8.058 0.01 . . . . . . . 99 TYR H . 51730 1 348 . 1 . 1 41 41 TYR HA H 1 4.501 0.00 . . . . . . . 99 TYR HA . 51730 1 349 . 1 . 1 41 41 TYR HB2 H 1 3.096 0.00 . . . . . . . 99 TYR HB2 . 51730 1 350 . 1 . 1 41 41 TYR HB3 H 1 2.321 0.00 . . . . . . . 99 TYR HB3 . 51730 1 351 . 1 . 1 41 41 TYR C C 13 176.845 0.00 . . . . . . . 99 TYR C . 51730 1 352 . 1 . 1 41 41 TYR CA C 13 59.864 0.00 . . . . . . . 99 TYR CA . 51730 1 353 . 1 . 1 41 41 TYR CB C 13 38.653 0.02 . . . . . . . 99 TYR CB . 51730 1 354 . 1 . 1 41 41 TYR N N 15 121.194 0.04 . . . . . . . 99 TYR N . 51730 1 355 . 1 . 1 42 42 GLU H H 1 8.388 0.00 . . . . . . . 100 GLU H . 51730 1 356 . 1 . 1 42 42 GLU HA H 1 4.072 0.00 . . . . . . . 100 GLU HA . 51730 1 357 . 1 . 1 42 42 GLU C C 13 178.050 0.00 . . . . . . . 100 GLU C . 51730 1 358 . 1 . 1 42 42 GLU CA C 13 58.276 0.00 . . . . . . . 100 GLU CA . 51730 1 359 . 1 . 1 42 42 GLU CB C 13 29.790 0.02 . . . . . . . 100 GLU CB . 51730 1 360 . 1 . 1 42 42 GLU N N 15 120.494 0.09 . . . . . . . 100 GLU N . 51730 1 361 . 1 . 1 43 43 LYS H H 1 8.097 0.01 . . . . . . . 101 LYS H . 51730 1 362 . 1 . 1 43 43 LYS HA H 1 4.089 0.00 . . . . . . . 101 LYS HA . 51730 1 363 . 1 . 1 43 43 LYS HB2 H 1 1.837 0.00 . . . . . . . 101 LYS HB2 . 51730 1 364 . 1 . 1 43 43 LYS HB3 H 1 1.779 0.00 . . . . . . . 101 LYS HB3 . 51730 1 365 . 1 . 1 43 43 LYS C C 13 177.912 0.00 . . . . . . . 101 LYS C . 51730 1 366 . 1 . 1 43 43 LYS CA C 13 58.371 0.00 . . . . . . . 101 LYS CA . 51730 1 367 . 1 . 1 43 43 LYS CB C 13 30.997 0.07 . . . . . . . 101 LYS CB . 51730 1 368 . 1 . 1 43 43 LYS N N 15 120.625 0.04 . . . . . . . 101 LYS N . 51730 1 369 . 1 . 1 44 44 HIS H H 1 8.076 0.00 . . . . . . . 102 HIS H . 51730 1 370 . 1 . 1 44 44 HIS C C 13 177.320 0.00 . . . . . . . 102 HIS C . 51730 1 371 . 1 . 1 44 44 HIS CA C 13 57.702 0.00 . . . . . . . 102 HIS CA . 51730 1 372 . 1 . 1 44 44 HIS CB C 13 29.172 0.00 . . . . . . . 102 HIS CB . 51730 1 373 . 1 . 1 44 44 HIS N N 15 119.755 0.09 . . . . . . . 102 HIS N . 51730 1 374 . 1 . 1 45 45 LEU H H 1 7.900 0.00 . . . . . . . 103 LEU H . 51730 1 375 . 1 . 1 45 45 LEU CA C 13 57.331 0.00 . . . . . . . 103 LEU CA . 51730 1 376 . 1 . 1 45 45 LEU CB C 13 41.841 0.01 . . . . . . . 103 LEU CB . 51730 1 377 . 1 . 1 45 45 LEU N N 15 121.627 0.02 . . . . . . . 103 LEU N . 51730 1 378 . 1 . 1 46 46 GLU H H 1 8.098 0.00 . . . . . . . 104 GLU H . 51730 1 379 . 1 . 1 46 46 GLU HA H 1 4.078 0.00 . . . . . . . 104 GLU HA . 51730 1 380 . 1 . 1 46 46 GLU HB2 H 1 1.862 0.00 . . . . . . . 104 GLU HB2 . 51730 1 381 . 1 . 1 46 46 GLU HB3 H 1 1.834 0.00 . . . . . . . 104 GLU HB3 . 51730 1 382 . 1 . 1 46 46 GLU C C 13 177.562 0.00 . . . . . . . 104 GLU C . 51730 1 383 . 1 . 1 46 46 GLU CA C 13 58.811 0.00 . . . . . . . 104 GLU CA . 51730 1 384 . 1 . 1 46 46 GLU CB C 13 29.569 0.00 . . . . . . . 104 GLU CB . 51730 1 385 . 1 . 1 46 46 GLU N N 15 120.428 0.02 . . . . . . . 104 GLU N . 51730 1 386 . 1 . 1 47 47 GLU H H 1 8.414 0.00 . . . . . . . 105 GLU H . 51730 1 387 . 1 . 1 47 47 GLU HA H 1 4.077 0.00 . . . . . . . 105 GLU HA . 51730 1 388 . 1 . 1 47 47 GLU HB2 H 1 2.046 0.00 . . . . . . . 105 GLU HB2 . 51730 1 389 . 1 . 1 47 47 GLU HB3 H 1 2.013 0.00 . . . . . . . 105 GLU HB3 . 51730 1 390 . 1 . 1 47 47 GLU C C 13 177.998 0.06 . . . . . . . 105 GLU C . 51730 1 391 . 1 . 1 47 47 GLU CA C 13 58.323 0.00 . . . . . . . 105 GLU CA . 51730 1 392 . 1 . 1 47 47 GLU CB C 13 29.767 0.00 . . . . . . . 105 GLU CB . 51730 1 393 . 1 . 1 47 47 GLU N N 15 120.284 0.02 . . . . . . . 105 GLU N . 51730 1 394 . 1 . 1 48 48 ARG H H 1 7.949 0.00 . . . . . . . 106 ARG H . 51730 1 395 . 1 . 1 48 48 ARG HA H 1 3.922 0.00 . . . . . . . 106 ARG HA . 51730 1 396 . 1 . 1 48 48 ARG C C 13 178.144 0.01 . . . . . . . 106 ARG C . 51730 1 397 . 1 . 1 48 48 ARG CA C 13 58.993 0.00 . . . . . . . 106 ARG CA . 51730 1 398 . 1 . 1 48 48 ARG CB C 13 30.160 0.00 . . . . . . . 106 ARG CB . 51730 1 399 . 1 . 1 48 48 ARG N N 15 120.309 0.04 . . . . . . . 106 ARG N . 51730 1 400 . 1 . 1 49 49 LYS H H 1 7.927 0.00 . . . . . . . 107 LYS H . 51730 1 401 . 1 . 1 49 49 LYS HB2 H 1 1.836 0.00 . . . . . . . 107 LYS HB2 . 51730 1 402 . 1 . 1 49 49 LYS C C 13 178.781 0.00 . . . . . . . 107 LYS C . 51730 1 403 . 1 . 1 49 49 LYS CA C 13 59.237 0.08 . . . . . . . 107 LYS CA . 51730 1 404 . 1 . 1 49 49 LYS CB C 13 32.514 0.03 . . . . . . . 107 LYS CB . 51730 1 405 . 1 . 1 49 49 LYS N N 15 119.793 0.04 . . . . . . . 107 LYS N . 51730 1 406 . 1 . 1 50 50 LYS H H 1 7.892 0.00 . . . . . . . 108 LYS H . 51730 1 407 . 1 . 1 50 50 LYS C C 13 178.720 0.00 . . . . . . . 108 LYS C . 51730 1 408 . 1 . 1 50 50 LYS CA C 13 58.858 0.06 . . . . . . . 108 LYS CA . 51730 1 409 . 1 . 1 50 50 LYS CB C 13 32.483 0.00 . . . . . . . 108 LYS CB . 51730 1 410 . 1 . 1 50 50 LYS N N 15 120.156 0.05 . . . . . . . 108 LYS N . 51730 1 411 . 1 . 1 51 51 ARG H H 1 7.969 0.01 . . . . . . . 109 ARG H . 51730 1 412 . 1 . 1 51 51 ARG C C 13 179.457 0.10 . . . . . . . 109 ARG C . 51730 1 413 . 1 . 1 51 51 ARG CA C 13 57.659 0.00 . . . . . . . 109 ARG CA . 51730 1 414 . 1 . 1 51 51 ARG CB C 13 30.223 0.00 . . . . . . . 109 ARG CB . 51730 1 415 . 1 . 1 51 51 ARG N N 15 119.739 0.07 . . . . . . . 109 ARG N . 51730 1 416 . 1 . 1 52 52 LEU H H 1 8.034 0.01 . . . . . . . 110 LEU H . 51730 1 417 . 1 . 1 52 52 LEU C C 13 178.602 0.00 . . . . . . . 110 LEU C . 51730 1 418 . 1 . 1 52 52 LEU CA C 13 58.769 0.00 . . . . . . . 110 LEU CA . 51730 1 419 . 1 . 1 52 52 LEU CB C 13 41.740 0.00 . . . . . . . 110 LEU CB . 51730 1 420 . 1 . 1 52 52 LEU N N 15 120.845 0.04 . . . . . . . 110 LEU N . 51730 1 421 . 1 . 1 53 53 GLU H H 1 8.068 0.00 . . . . . . . 111 GLU H . 51730 1 422 . 1 . 1 53 53 GLU HB2 H 1 1.994 0.00 . . . . . . . 111 GLU HB2 . 51730 1 423 . 1 . 1 53 53 GLU HB3 H 1 1.851 0.00 . . . . . . . 111 GLU HB3 . 51730 1 424 . 1 . 1 53 53 GLU C C 13 178.940 0.00 . . . . . . . 111 GLU C . 51730 1 425 . 1 . 1 53 53 GLU CA C 13 57.885 0.02 . . . . . . . 111 GLU CA . 51730 1 426 . 1 . 1 53 53 GLU CB C 13 29.470 0.00 . . . . . . . 111 GLU CB . 51730 1 427 . 1 . 1 53 53 GLU N N 15 120.881 0.00 . . . . . . . 111 GLU N . 51730 1 428 . 1 . 1 54 54 GLU H H 1 8.224 0.01 . . . . . . . 112 GLU H . 51730 1 429 . 1 . 1 54 54 GLU HA H 1 4.039 0.00 . . . . . . . 112 GLU HA . 51730 1 430 . 1 . 1 54 54 GLU HB3 H 1 1.843 0.00 . . . . . . . 112 GLU HB3 . 51730 1 431 . 1 . 1 54 54 GLU C C 13 179.158 0.04 . . . . . . . 112 GLU C . 51730 1 432 . 1 . 1 54 54 GLU CA C 13 59.033 0.00 . . . . . . . 112 GLU CA . 51730 1 433 . 1 . 1 54 54 GLU CB C 13 29.457 0.02 . . . . . . . 112 GLU CB . 51730 1 434 . 1 . 1 54 54 GLU N N 15 120.787 0.08 . . . . . . . 112 GLU N . 51730 1 435 . 1 . 1 55 55 GLN H H 1 8.017 0.01 . . . . . . . 113 GLN H . 51730 1 436 . 1 . 1 55 55 GLN HA H 1 4.136 0.00 . . . . . . . 113 GLN HA . 51730 1 437 . 1 . 1 55 55 GLN HB2 H 1 1.977 0.00 . . . . . . . 113 GLN HB2 . 51730 1 438 . 1 . 1 55 55 GLN HB3 H 1 1.789 0.00 . . . . . . . 113 GLN HB3 . 51730 1 439 . 1 . 1 55 55 GLN C C 13 178.219 0.00 . . . . . . . 113 GLN C . 51730 1 440 . 1 . 1 55 55 GLN CA C 13 58.559 0.02 . . . . . . . 113 GLN CA . 51730 1 441 . 1 . 1 55 55 GLN CB C 13 28.486 0.00 . . . . . . . 113 GLN CB . 51730 1 442 . 1 . 1 55 55 GLN N N 15 119.552 0.04 . . . . . . . 113 GLN N . 51730 1 443 . 1 . 1 56 56 ARG H H 1 8.108 0.00 . . . . . . . 114 ARG H . 51730 1 444 . 1 . 1 56 56 ARG C C 13 178.943 0.00 . . . . . . . 114 ARG C . 51730 1 445 . 1 . 1 56 56 ARG CA C 13 59.075 0.05 . . . . . . . 114 ARG CA . 51730 1 446 . 1 . 1 56 56 ARG CB C 13 30.010 0.03 . . . . . . . 114 ARG CB . 51730 1 447 . 1 . 1 56 56 ARG N N 15 120.976 0.06 . . . . . . . 114 ARG N . 51730 1 448 . 1 . 1 57 57 GLN H H 1 8.169 0.00 . . . . . . . 115 GLN H . 51730 1 449 . 1 . 1 57 57 GLN C C 13 178.434 0.00 . . . . . . . 115 GLN C . 51730 1 450 . 1 . 1 57 57 GLN CA C 13 58.766 0.00 . . . . . . . 115 GLN CA . 51730 1 451 . 1 . 1 57 57 GLN CB C 13 28.627 0.00 . . . . . . . 115 GLN CB . 51730 1 452 . 1 . 1 57 57 GLN N N 15 118.919 0.03 . . . . . . . 115 GLN N . 51730 1 453 . 1 . 1 58 58 LYS H H 1 7.977 0.00 . . . . . . . 116 LYS H . 51730 1 454 . 1 . 1 58 58 LYS C C 13 179.099 0.00 . . . . . . . 116 LYS C . 51730 1 455 . 1 . 1 58 58 LYS CA C 13 58.060 0.00 . . . . . . . 116 LYS CA . 51730 1 456 . 1 . 1 58 58 LYS CB C 13 32.570 0.00 . . . . . . . 116 LYS CB . 51730 1 457 . 1 . 1 58 58 LYS N N 15 120.453 0.03 . . . . . . . 116 LYS N . 51730 1 458 . 1 . 1 60 60 GLU HA H 1 4.041 0.00 . . . . . . . 118 GLU HA . 51730 1 459 . 1 . 1 60 60 GLU CA C 13 58.793 0.00 . . . . . . . 118 GLU CA . 51730 1 460 . 1 . 1 60 60 GLU CB C 13 28.820 0.00 . . . . . . . 118 GLU CB . 51730 1 461 . 1 . 1 61 61 ARG H H 1 8.016 0.00 . . . . . . . 119 ARG H . 51730 1 462 . 1 . 1 61 61 ARG HA H 1 4.443 0.00 . . . . . . . 119 ARG HA . 51730 1 463 . 1 . 1 61 61 ARG HB2 H 1 1.850 0.00 . . . . . . . 119 ARG HB2 . 51730 1 464 . 1 . 1 61 61 ARG C C 13 178.761 0.00 . . . . . . . 119 ARG C . 51730 1 465 . 1 . 1 61 61 ARG CA C 13 58.790 0.00 . . . . . . . 119 ARG CA . 51730 1 466 . 1 . 1 61 61 ARG CB C 13 30.218 0.02 . . . . . . . 119 ARG CB . 51730 1 467 . 1 . 1 61 61 ARG N N 15 119.862 0.03 . . . . . . . 119 ARG N . 51730 1 468 . 1 . 1 62 62 ARG H H 1 7.936 0.01 . . . . . . . 120 ARG H . 51730 1 469 . 1 . 1 62 62 ARG HB2 H 1 1.853 0.00 . . . . . . . 120 ARG HB2 . 51730 1 470 . 1 . 1 62 62 ARG HB3 H 1 1.779 0.00 . . . . . . . 120 ARG HB3 . 51730 1 471 . 1 . 1 62 62 ARG C C 13 178.331 0.00 . . . . . . . 120 ARG C . 51730 1 472 . 1 . 1 62 62 ARG CA C 13 58.803 0.02 . . . . . . . 120 ARG CA . 51730 1 473 . 1 . 1 62 62 ARG CB C 13 30.237 0.01 . . . . . . . 120 ARG CB . 51730 1 474 . 1 . 1 62 62 ARG N N 15 121.357 0.07 . . . . . . . 120 ARG N . 51730 1 475 . 1 . 1 63 63 ARG H H 1 8.128 0.01 . . . . . . . 121 ARG H . 51730 1 476 . 1 . 1 63 63 ARG HA H 1 3.969 0.00 . . . . . . . 121 ARG HA . 51730 1 477 . 1 . 1 63 63 ARG C C 13 178.348 0.00 . . . . . . . 121 ARG C . 51730 1 478 . 1 . 1 63 63 ARG CA C 13 58.814 0.01 . . . . . . . 121 ARG CA . 51730 1 479 . 1 . 1 63 63 ARG CB C 13 30.279 0.01 . . . . . . . 121 ARG CB . 51730 1 480 . 1 . 1 63 63 ARG N N 15 119.689 0.09 . . . . . . . 121 ARG N . 51730 1 481 . 1 . 1 64 64 ALA H H 1 8.003 0.00 . . . . . . . 122 ALA H . 51730 1 482 . 1 . 1 64 64 ALA C C 13 179.461 0.00 . . . . . . . 122 ALA C . 51730 1 483 . 1 . 1 64 64 ALA CA C 13 54.319 0.00 . . . . . . . 122 ALA CA . 51730 1 484 . 1 . 1 64 64 ALA CB C 13 18.457 0.00 . . . . . . . 122 ALA CB . 51730 1 485 . 1 . 1 64 64 ALA N N 15 122.120 0.06 . . . . . . . 122 ALA N . 51730 1 486 . 1 . 1 65 65 ALA H H 1 7.837 0.00 . . . . . . . 123 ALA H . 51730 1 487 . 1 . 1 65 65 ALA C C 13 180.001 0.00 . . . . . . . 123 ALA C . 51730 1 488 . 1 . 1 65 65 ALA CA C 13 54.348 0.02 . . . . . . . 123 ALA CA . 51730 1 489 . 1 . 1 65 65 ALA CB C 13 18.431 0.02 . . . . . . . 123 ALA CB . 51730 1 490 . 1 . 1 65 65 ALA N N 15 121.732 0.05 . . . . . . . 123 ALA N . 51730 1 491 . 1 . 1 66 66 VAL H H 1 7.847 0.00 . . . . . . . 124 VAL H . 51730 1 492 . 1 . 1 66 66 VAL HB H 1 1.827 0.00 . . . . . . . 124 VAL HB . 51730 1 493 . 1 . 1 66 66 VAL HG21 H 1 1.009 0.00 . . . . . . . 124 VAL HG2 . 51730 1 494 . 1 . 1 66 66 VAL HG22 H 1 1.009 0.00 . . . . . . . 124 VAL HG2 . 51730 1 495 . 1 . 1 66 66 VAL HG23 H 1 1.009 0.00 . . . . . . . 124 VAL HG2 . 51730 1 496 . 1 . 1 66 66 VAL C C 13 178.256 0.02 . . . . . . . 124 VAL C . 51730 1 497 . 1 . 1 66 66 VAL CA C 13 65.326 0.01 . . . . . . . 124 VAL CA . 51730 1 498 . 1 . 1 66 66 VAL CB C 13 32.194 0.03 . . . . . . . 124 VAL CB . 51730 1 499 . 1 . 1 66 66 VAL CG2 C 13 22.126 0.00 . . . . . . . 124 VAL CG2 . 51730 1 500 . 1 . 1 66 66 VAL N N 15 119.328 0.02 . . . . . . . 124 VAL N . 51730 1 501 . 1 . 1 67 67 GLU H H 1 8.008 0.00 . . . . . . . 125 GLU H . 51730 1 502 . 1 . 1 67 67 GLU HG2 H 1 2.241 0.00 . . . . . . . 125 GLU HG1 . 51730 1 503 . 1 . 1 67 67 GLU C C 13 178.253 0.00 . . . . . . . 125 GLU C . 51730 1 504 . 1 . 1 67 67 GLU CA C 13 58.323 0.00 . . . . . . . 125 GLU CA . 51730 1 505 . 1 . 1 67 67 GLU CB C 13 29.543 0.00 . . . . . . . 125 GLU CB . 51730 1 506 . 1 . 1 67 67 GLU CG C 13 36.128 0.00 . . . . . . . 125 GLU CG1 . 51730 1 507 . 1 . 1 67 67 GLU N N 15 121.465 0.02 . . . . . . . 125 GLU N . 51730 1 508 . 1 . 1 68 68 GLU H H 1 7.992 0.00 . . . . . . . 126 GLU H . 51730 1 509 . 1 . 1 68 68 GLU CA C 13 58.242 0.03 . . . . . . . 126 GLU CA . 51730 1 510 . 1 . 1 68 68 GLU CB C 13 29.650 0.00 . . . . . . . 126 GLU CB . 51730 1 511 . 1 . 1 68 68 GLU N N 15 120.906 0.02 . . . . . . . 126 GLU N . 51730 1 512 . 1 . 1 69 69 LYS H H 1 7.833 0.00 . . . . . . . 127 LYS H . 51730 1 513 . 1 . 1 69 69 LYS C C 13 178.340 0.00 . . . . . . . 127 LYS C . 51730 1 514 . 1 . 1 69 69 LYS CA C 13 58.313 0.04 . . . . . . . 127 LYS CA . 51730 1 515 . 1 . 1 69 69 LYS CB C 13 32.232 0.00 . . . . . . . 127 LYS CB . 51730 1 516 . 1 . 1 69 69 LYS N N 15 119.906 0.04 . . . . . . . 127 LYS N . 51730 1 517 . 1 . 1 70 70 ARG H H 1 7.832 0.01 . . . . . . . 128 ARG H . 51730 1 518 . 1 . 1 70 70 ARG HA H 1 4.075 0.00 . . . . . . . 128 ARG HA . 51730 1 519 . 1 . 1 70 70 ARG HB2 H 1 1.974 0.00 . . . . . . . 128 ARG HB2 . 51730 1 520 . 1 . 1 70 70 ARG HB3 H 1 1.796 0.00 . . . . . . . 128 ARG HB3 . 51730 1 521 . 1 . 1 70 70 ARG C C 13 178.322 0.04 . . . . . . . 128 ARG C . 51730 1 522 . 1 . 1 70 70 ARG CA C 13 58.275 0.00 . . . . . . . 128 ARG CA . 51730 1 523 . 1 . 1 70 70 ARG CB C 13 29.650 0.00 . . . . . . . 128 ARG CB . 51730 1 524 . 1 . 1 70 70 ARG N N 15 119.887 0.04 . . . . . . . 128 ARG N . 51730 1 525 . 1 . 1 71 71 ARG H H 1 7.994 0.01 . . . . . . . 129 ARG H . 51730 1 526 . 1 . 1 71 71 ARG HA H 1 4.080 0.00 . . . . . . . 129 ARG HA . 51730 1 527 . 1 . 1 71 71 ARG C C 13 177.569 0.05 . . . . . . . 129 ARG C . 51730 1 528 . 1 . 1 71 71 ARG CA C 13 57.381 0.00 . . . . . . . 129 ARG CA . 51730 1 529 . 1 . 1 71 71 ARG CB C 13 30.371 0.09 . . . . . . . 129 ARG CB . 51730 1 530 . 1 . 1 71 71 ARG N N 15 120.549 0.03 . . . . . . . 129 ARG N . 51730 1 531 . 1 . 1 72 72 GLN H H 1 8.095 0.01 . . . . . . . 130 GLN H . 51730 1 532 . 1 . 1 72 72 GLN HA H 1 4.205 0.00 . . . . . . . 130 GLN HA . 51730 1 533 . 1 . 1 72 72 GLN HB2 H 1 1.421 0.00 . . . . . . . 130 GLN HB2 . 51730 1 534 . 1 . 1 72 72 GLN HB3 H 1 1.373 0.00 . . . . . . . 130 GLN HB3 . 51730 1 535 . 1 . 1 72 72 GLN C C 13 177.379 0.00 . . . . . . . 130 GLN C . 51730 1 536 . 1 . 1 72 72 GLN CA C 13 57.602 0.04 . . . . . . . 130 GLN CA . 51730 1 537 . 1 . 1 72 72 GLN CB C 13 28.776 0.01 . . . . . . . 130 GLN CB . 51730 1 538 . 1 . 1 72 72 GLN N N 15 119.115 0.05 . . . . . . . 130 GLN N . 51730 1 539 . 1 . 1 73 73 ARG H H 1 8.130 0.00 . . . . . . . 131 ARG H . 51730 1 540 . 1 . 1 73 73 ARG C C 13 176.026 0.04 . . . . . . . 131 ARG C . 51730 1 541 . 1 . 1 73 73 ARG CA C 13 57.625 0.01 . . . . . . . 131 ARG CA . 51730 1 542 . 1 . 1 73 73 ARG CB C 13 30.045 0.00 . . . . . . . 131 ARG CB . 51730 1 543 . 1 . 1 73 73 ARG N N 15 119.087 0.07 . . . . . . . 131 ARG N . 51730 1 544 . 1 . 1 74 74 LEU H H 1 7.964 0.01 . . . . . . . 132 LEU H . 51730 1 545 . 1 . 1 74 74 LEU HA H 1 4.068 0.00 . . . . . . . 132 LEU HA . 51730 1 546 . 1 . 1 74 74 LEU HD11 H 1 0.775 0.00 . . . . . . . 132 LEU HD1 . 51730 1 547 . 1 . 1 74 74 LEU HD12 H 1 0.775 0.00 . . . . . . . 132 LEU HD1 . 51730 1 548 . 1 . 1 74 74 LEU HD13 H 1 0.775 0.00 . . . . . . . 132 LEU HD1 . 51730 1 549 . 1 . 1 74 74 LEU C C 13 178.792 0.00 . . . . . . . 132 LEU C . 51730 1 550 . 1 . 1 74 74 LEU CA C 13 56.731 0.01 . . . . . . . 132 LEU CA . 51730 1 551 . 1 . 1 74 74 LEU CB C 13 42.142 0.02 . . . . . . . 132 LEU CB . 51730 1 552 . 1 . 1 74 74 LEU CD1 C 13 24.582 0.00 . . . . . . . 132 LEU CD1 . 51730 1 553 . 1 . 1 74 74 LEU N N 15 121.258 0.05 . . . . . . . 132 LEU N . 51730 1 554 . 1 . 1 75 75 GLU H H 1 8.094 0.01 . . . . . . . 133 GLU H . 51730 1 555 . 1 . 1 75 75 GLU C C 13 177.778 0.00 . . . . . . . 133 GLU C . 51730 1 556 . 1 . 1 75 75 GLU CA C 13 57.864 0.04 . . . . . . . 133 GLU CA . 51730 1 557 . 1 . 1 75 75 GLU CB C 13 29.826 0.00 . . . . . . . 133 GLU CB . 51730 1 558 . 1 . 1 75 75 GLU N N 15 120.004 0.06 . . . . . . . 133 GLU N . 51730 1 559 . 1 . 1 76 76 GLU H H 1 8.126 0.00 . . . . . . . 134 GLU H . 51730 1 560 . 1 . 1 76 76 GLU HA H 1 4.097 0.00 . . . . . . . 134 GLU HA . 51730 1 561 . 1 . 1 76 76 GLU HB2 H 1 2.060 0.00 . . . . . . . 134 GLU HB2 . 51730 1 562 . 1 . 1 76 76 GLU HB3 H 1 2.007 0.00 . . . . . . . 134 GLU HB3 . 51730 1 563 . 1 . 1 76 76 GLU C C 13 177.553 0.00 . . . . . . . 134 GLU C . 51730 1 564 . 1 . 1 76 76 GLU CA C 13 57.910 0.01 . . . . . . . 134 GLU CA . 51730 1 565 . 1 . 1 76 76 GLU CB C 13 30.049 0.00 . . . . . . . 134 GLU CB . 51730 1 566 . 1 . 1 76 76 GLU N N 15 120.761 0.02 . . . . . . . 134 GLU N . 51730 1 567 . 1 . 1 77 77 ASP H H 1 8.194 0.00 . . . . . . . 135 ASP H . 51730 1 568 . 1 . 1 77 77 ASP C C 13 177.459 0.01 . . . . . . . 135 ASP C . 51730 1 569 . 1 . 1 77 77 ASP CA C 13 55.589 0.00 . . . . . . . 135 ASP CA . 51730 1 570 . 1 . 1 77 77 ASP CB C 13 40.974 0.01 . . . . . . . 135 ASP CB . 51730 1 571 . 1 . 1 77 77 ASP N N 15 120.590 0.04 . . . . . . . 135 ASP N . 51730 1 572 . 1 . 1 78 78 LYS H H 1 7.963 0.00 . . . . . . . 136 LYS H . 51730 1 573 . 1 . 1 78 78 LYS C C 13 178.770 0.00 . . . . . . . 136 LYS C . 51730 1 574 . 1 . 1 78 78 LYS CA C 13 58.274 0.01 . . . . . . . 136 LYS CA . 51730 1 575 . 1 . 1 78 78 LYS CB C 13 32.624 0.04 . . . . . . . 136 LYS CB . 51730 1 576 . 1 . 1 78 78 LYS N N 15 121.479 0.06 . . . . . . . 136 LYS N . 51730 1 577 . 1 . 1 79 79 GLU H H 1 8.016 0.00 . . . . . . . 137 GLU H . 51730 1 578 . 1 . 1 79 79 GLU C C 13 176.715 0.00 . . . . . . . 137 GLU C . 51730 1 579 . 1 . 1 79 79 GLU CA C 13 59.521 0.00 . . . . . . . 137 GLU CA . 51730 1 580 . 1 . 1 79 79 GLU CB C 13 29.314 0.00 . . . . . . . 137 GLU CB . 51730 1 581 . 1 . 1 79 79 GLU N N 15 120.543 0.02 . . . . . . . 137 GLU N . 51730 1 582 . 1 . 1 80 80 ARG H H 1 8.321 0.00 . . . . . . . 138 ARG H . 51730 1 583 . 1 . 1 80 80 ARG C C 13 175.747 0.00 . . . . . . . 138 ARG C . 51730 1 584 . 1 . 1 80 80 ARG CA C 13 57.142 0.08 . . . . . . . 138 ARG CA . 51730 1 585 . 1 . 1 80 80 ARG CB C 13 30.346 0.01 . . . . . . . 138 ARG CB . 51730 1 586 . 1 . 1 80 80 ARG N N 15 122.255 0.04 . . . . . . . 138 ARG N . 51730 1 587 . 1 . 1 81 81 HIS H H 1 8.206 0.01 . . . . . . . 139 HIS H . 51730 1 588 . 1 . 1 81 81 HIS HA H 1 4.452 0.00 . . . . . . . 139 HIS HA . 51730 1 589 . 1 . 1 81 81 HIS HB2 H 1 3.158 0.00 . . . . . . . 139 HIS HB2 . 51730 1 590 . 1 . 1 81 81 HIS HB3 H 1 3.113 0.00 . . . . . . . 139 HIS HB3 . 51730 1 591 . 1 . 1 81 81 HIS C C 13 175.727 0.00 . . . . . . . 139 HIS C . 51730 1 592 . 1 . 1 81 81 HIS CA C 13 57.159 0.02 . . . . . . . 139 HIS CA . 51730 1 593 . 1 . 1 81 81 HIS CB C 13 30.048 0.02 . . . . . . . 139 HIS CB . 51730 1 594 . 1 . 1 81 81 HIS N N 15 119.416 0.08 . . . . . . . 139 HIS N . 51730 1 595 . 1 . 1 82 82 GLU H H 1 8.315 0.01 . . . . . . . 140 GLU H . 51730 1 596 . 1 . 1 82 82 GLU HA H 1 4.046 0.00 . . . . . . . 140 GLU HA . 51730 1 597 . 1 . 1 82 82 GLU C C 13 176.883 0.00 . . . . . . . 140 GLU C . 51730 1 598 . 1 . 1 82 82 GLU CA C 13 57.451 0.02 . . . . . . . 140 GLU CA . 51730 1 599 . 1 . 1 82 82 GLU CB C 13 29.959 0.02 . . . . . . . 140 GLU CB . 51730 1 600 . 1 . 1 82 82 GLU N N 15 120.620 0.06 . . . . . . . 140 GLU N . 51730 1 601 . 1 . 1 83 83 ALA H H 1 8.066 0.01 . . . . . . . 141 ALA H . 51730 1 602 . 1 . 1 83 83 ALA HA H 1 4.144 0.00 . . . . . . . 141 ALA HA . 51730 1 603 . 1 . 1 83 83 ALA HB1 H 1 1.363 0.00 . . . . . . . 141 ALA HB . 51730 1 604 . 1 . 1 83 83 ALA HB2 H 1 1.363 0.00 . . . . . . . 141 ALA HB . 51730 1 605 . 1 . 1 83 83 ALA HB3 H 1 1.363 0.00 . . . . . . . 141 ALA HB . 51730 1 606 . 1 . 1 83 83 ALA C C 13 178.519 0.00 . . . . . . . 141 ALA C . 51730 1 607 . 1 . 1 83 83 ALA CA C 13 53.471 0.02 . . . . . . . 141 ALA CA . 51730 1 608 . 1 . 1 83 83 ALA CB C 13 18.894 0.00 . . . . . . . 141 ALA CB . 51730 1 609 . 1 . 1 83 83 ALA N N 15 123.607 0.05 . . . . . . . 141 ALA N . 51730 1 610 . 1 . 1 84 84 VAL H H 1 7.797 0.01 . . . . . . . 142 VAL H . 51730 1 611 . 1 . 1 84 84 VAL HA H 1 3.823 0.00 . . . . . . . 142 VAL HA . 51730 1 612 . 1 . 1 84 84 VAL HB H 1 2.040 0.00 . . . . . . . 142 VAL HB . 51730 1 613 . 1 . 1 84 84 VAL HG11 H 1 0.866 0.00 . . . . . . . 142 VAL HG1 . 51730 1 614 . 1 . 1 84 84 VAL HG12 H 1 0.866 0.00 . . . . . . . 142 VAL HG1 . 51730 1 615 . 1 . 1 84 84 VAL HG13 H 1 0.866 0.00 . . . . . . . 142 VAL HG1 . 51730 1 616 . 1 . 1 84 84 VAL HG21 H 1 0.910 0.00 . . . . . . . 142 VAL HG2 . 51730 1 617 . 1 . 1 84 84 VAL HG22 H 1 0.910 0.00 . . . . . . . 142 VAL HG2 . 51730 1 618 . 1 . 1 84 84 VAL HG23 H 1 0.910 0.00 . . . . . . . 142 VAL HG2 . 51730 1 619 . 1 . 1 84 84 VAL C C 13 177.156 0.00 . . . . . . . 142 VAL C . 51730 1 620 . 1 . 1 84 84 VAL CA C 13 63.709 0.04 . . . . . . . 142 VAL CA . 51730 1 621 . 1 . 1 84 84 VAL CB C 13 32.451 0.00 . . . . . . . 142 VAL CB . 51730 1 622 . 1 . 1 84 84 VAL CG1 C 13 20.787 0.00 . . . . . . . 142 VAL CG1 . 51730 1 623 . 1 . 1 84 84 VAL CG2 C 13 21.284 0.00 . . . . . . . 142 VAL CG2 . 51730 1 624 . 1 . 1 84 84 VAL N N 15 119.304 0.05 . . . . . . . 142 VAL N . 51730 1 625 . 1 . 1 85 85 VAL H H 1 7.948 0.00 . . . . . . . 143 VAL H . 51730 1 626 . 1 . 1 85 85 VAL HA H 1 3.812 0.00 . . . . . . . 143 VAL HA . 51730 1 627 . 1 . 1 85 85 VAL HB H 1 1.943 0.00 . . . . . . . 143 VAL HB . 51730 1 628 . 1 . 1 85 85 VAL C C 13 176.840 0.00 . . . . . . . 143 VAL C . 51730 1 629 . 1 . 1 85 85 VAL CA C 13 63.673 0.00 . . . . . . . 143 VAL CA . 51730 1 630 . 1 . 1 85 85 VAL CB C 13 32.338 0.01 . . . . . . . 143 VAL CB . 51730 1 631 . 1 . 1 85 85 VAL N N 15 123.260 0.05 . . . . . . . 143 VAL N . 51730 1 632 . 1 . 1 86 86 ARG H H 1 8.173 0.00 . . . . . . . 144 ARG H . 51730 1 633 . 1 . 1 86 86 ARG C C 13 176.846 0.00 . . . . . . . 144 ARG C . 51730 1 634 . 1 . 1 86 86 ARG CA C 13 57.030 0.03 . . . . . . . 144 ARG CA . 51730 1 635 . 1 . 1 86 86 ARG CB C 13 30.669 0.04 . . . . . . . 144 ARG CB . 51730 1 636 . 1 . 1 86 86 ARG N N 15 123.435 0.03 . . . . . . . 144 ARG N . 51730 1 637 . 1 . 1 87 87 ARG H H 1 8.130 0.00 . . . . . . . 145 ARG H . 51730 1 638 . 1 . 1 87 87 ARG HA H 1 4.236 0.00 . . . . . . . 145 ARG HA . 51730 1 639 . 1 . 1 87 87 ARG HB2 H 1 1.803 0.00 . . . . . . . 145 ARG HB2 . 51730 1 640 . 1 . 1 87 87 ARG HB3 H 1 1.757 0.00 . . . . . . . 145 ARG HB3 . 51730 1 641 . 1 . 1 87 87 ARG C C 13 177.037 0.00 . . . . . . . 145 ARG C . 51730 1 642 . 1 . 1 87 87 ARG CA C 13 56.991 0.03 . . . . . . . 145 ARG CA . 51730 1 643 . 1 . 1 87 87 ARG CB C 13 30.703 0.06 . . . . . . . 145 ARG CB . 51730 1 644 . 1 . 1 87 87 ARG N N 15 121.334 0.01 . . . . . . . 145 ARG N . 51730 1 645 . 1 . 1 88 88 THR H H 1 8.029 0.00 . . . . . . . 146 THR H . 51730 1 646 . 1 . 1 88 88 THR HB H 1 4.164 0.00 . . . . . . . 146 THR HB . 51730 1 647 . 1 . 1 88 88 THR C C 13 174.955 0.00 . . . . . . . 146 THR C . 51730 1 648 . 1 . 1 88 88 THR CA C 13 62.899 0.01 . . . . . . . 146 THR CA . 51730 1 649 . 1 . 1 88 88 THR CB C 13 69.573 0.04 . . . . . . . 146 THR CB . 51730 1 650 . 1 . 1 88 88 THR N N 15 115.048 0.07 . . . . . . . 146 THR N . 51730 1 651 . 1 . 1 89 89 MET H H 1 8.182 0.01 . . . . . . . 147 MET H . 51730 1 652 . 1 . 1 89 89 MET HB2 H 1 1.986 0.00 . . . . . . . 147 MET HB2 . 51730 1 653 . 1 . 1 89 89 MET HE1 H 1 1.997 0.00 . . . . . . . 147 MET HE . 51730 1 654 . 1 . 1 89 89 MET HE2 H 1 1.997 0.00 . . . . . . . 147 MET HE . 51730 1 655 . 1 . 1 89 89 MET HE3 H 1 1.997 0.00 . . . . . . . 147 MET HE . 51730 1 656 . 1 . 1 89 89 MET C C 13 176.568 0.00 . . . . . . . 147 MET C . 51730 1 657 . 1 . 1 89 89 MET CA C 13 56.010 0.07 . . . . . . . 147 MET CA . 51730 1 658 . 1 . 1 89 89 MET CB C 13 32.834 0.02 . . . . . . . 147 MET CB . 51730 1 659 . 1 . 1 89 89 MET CE C 13 16.904 0.00 . . . . . . . 147 MET CE . 51730 1 660 . 1 . 1 89 89 MET N N 15 122.067 0.03 . . . . . . . 147 MET N . 51730 1 661 . 1 . 1 90 90 GLU H H 1 8.218 0.00 . . . . . . . 148 GLU H . 51730 1 662 . 1 . 1 90 90 GLU HG2 H 1 2.198 0.00 . . . . . . . 148 GLU HG . 51730 1 663 . 1 . 1 90 90 GLU HG3 H 1 2.198 0.00 . . . . . . . 148 GLU HG . 51730 1 664 . 1 . 1 90 90 GLU C C 13 176.843 0.00 . . . . . . . 148 GLU C . 51730 1 665 . 1 . 1 90 90 GLU CA C 13 57.102 0.01 . . . . . . . 148 GLU CA . 51730 1 666 . 1 . 1 90 90 GLU CB C 13 30.259 0.04 . . . . . . . 148 GLU CB . 51730 1 667 . 1 . 1 90 90 GLU CG C 13 36.199 0.00 . . . . . . . 148 GLU CG1 . 51730 1 668 . 1 . 1 90 90 GLU N N 15 121.900 0.02 . . . . . . . 148 GLU N . 51730 1 669 . 1 . 1 91 91 ARG H H 1 8.200 0.00 . . . . . . . 149 ARG H . 51730 1 670 . 1 . 1 91 91 ARG HA H 1 4.237 0.00 . . . . . . . 149 ARG HA . 51730 1 671 . 1 . 1 91 91 ARG HB2 H 1 1.822 0.00 . . . . . . . 149 ARG HB2 . 51730 1 672 . 1 . 1 91 91 ARG HB3 H 1 1.730 0.00 . . . . . . . 149 ARG HB3 . 51730 1 673 . 1 . 1 91 91 ARG C C 13 176.515 0.00 . . . . . . . 149 ARG C . 51730 1 674 . 1 . 1 91 91 ARG CA C 13 56.484 0.01 . . . . . . . 149 ARG CA . 51730 1 675 . 1 . 1 91 91 ARG CB C 13 30.692 0.02 . . . . . . . 149 ARG CB . 51730 1 676 . 1 . 1 91 91 ARG N N 15 121.399 0.02 . . . . . . . 149 ARG N . 51730 1 677 . 1 . 1 92 92 SER H H 1 8.127 0.00 . . . . . . . 150 SER H . 51730 1 678 . 1 . 1 92 92 SER HB3 H 1 3.807 0.00 . . . . . . . 150 SER HB3 . 51730 1 679 . 1 . 1 92 92 SER C C 13 174.469 0.00 . . . . . . . 150 SER C . 51730 1 680 . 1 . 1 92 92 SER CA C 13 58.570 0.04 . . . . . . . 150 SER CA . 51730 1 681 . 1 . 1 92 92 SER CB C 13 63.818 0.03 . . . . . . . 150 SER CB . 51730 1 682 . 1 . 1 92 92 SER N N 15 116.212 0.05 . . . . . . . 150 SER N . 51730 1 683 . 1 . 1 93 93 GLN H H 1 8.200 0.00 . . . . . . . 151 GLN H . 51730 1 684 . 1 . 1 93 93 GLN HA H 1 3.744 0.00 . . . . . . . 151 GLN HA . 51730 1 685 . 1 . 1 93 93 GLN HB2 H 1 2.031 0.00 . . . . . . . 151 GLN HB2 . 51730 1 686 . 1 . 1 93 93 GLN HB3 H 1 1.886 0.00 . . . . . . . 151 GLN HB3 . 51730 1 687 . 1 . 1 93 93 GLN C C 13 175.649 0.00 . . . . . . . 151 GLN C . 51730 1 688 . 1 . 1 93 93 GLN CA C 13 55.650 0.00 . . . . . . . 151 GLN CA . 51730 1 689 . 1 . 1 93 93 GLN CB C 13 29.660 0.01 . . . . . . . 151 GLN CB . 51730 1 690 . 1 . 1 93 93 GLN N N 15 121.901 0.02 . . . . . . . 151 GLN N . 51730 1 691 . 1 . 1 94 94 LYS H H 1 8.168 0.00 . . . . . . . 152 LYS H . 51730 1 692 . 1 . 1 94 94 LYS C C 13 176.835 0.00 . . . . . . . 152 LYS C . 51730 1 693 . 1 . 1 94 94 LYS CA C 13 54.443 0.00 . . . . . . . 152 LYS CA . 51730 1 694 . 1 . 1 94 94 LYS CB C 13 32.436 0.00 . . . . . . . 152 LYS CB . 51730 1 695 . 1 . 1 94 94 LYS N N 15 123.618 0.05 . . . . . . . 152 LYS N . 51730 1 696 . 1 . 1 95 95 PRO HA H 1 4.320 0.00 . . . . . . . 153 PRO HA . 51730 1 697 . 1 . 1 95 95 PRO HB2 H 1 2.207 0.00 . . . . . . . 153 PRO HB2 . 51730 1 698 . 1 . 1 95 95 PRO HB3 H 1 1.786 0.00 . . . . . . . 153 PRO HB3 . 51730 1 699 . 1 . 1 95 95 PRO HG2 H 1 1.937 0.00 . . . . . . . 153 PRO HG . 51730 1 700 . 1 . 1 95 95 PRO HG3 H 1 1.937 0.00 . . . . . . . 153 PRO HG . 51730 1 701 . 1 . 1 95 95 PRO HD2 H 1 3.570 0.00 . . . . . . . 153 PRO HD . 51730 1 702 . 1 . 1 95 95 PRO HD3 H 1 3.570 0.00 . . . . . . . 153 PRO HD . 51730 1 703 . 1 . 1 95 95 PRO C C 13 176.887 0.00 . . . . . . . 153 PRO C . 51730 1 704 . 1 . 1 95 95 PRO CA C 13 63.136 0.00 . . . . . . . 153 PRO CA . 51730 1 705 . 1 . 1 95 95 PRO CB C 13 32.180 0.00 . . . . . . . 153 PRO CB . 51730 1 706 . 1 . 1 95 95 PRO CD C 13 50.406 0.00 . . . . . . . 153 PRO CD . 51730 1 707 . 1 . 1 95 95 PRO CG C 13 27.315 0.00 . . . . . . . 153 PRO CG . 51730 1 708 . 1 . 1 96 96 LYS H H 1 8.328 0.00 . . . . . . . 154 LYS H . 51730 1 709 . 1 . 1 96 96 LYS HA H 1 4.149 0.00 . . . . . . . 154 LYS HA . 51730 1 710 . 1 . 1 96 96 LYS HB2 H 1 1.681 0.00 . . . . . . . 154 LYS HB . 51730 1 711 . 1 . 1 96 96 LYS HB3 H 1 1.681 0.00 . . . . . . . 154 LYS HB . 51730 1 712 . 1 . 1 96 96 LYS HG2 H 1 1.354 0.00 . . . . . . . 154 LYS HG . 51730 1 713 . 1 . 1 96 96 LYS HG3 H 1 1.354 0.00 . . . . . . . 154 LYS HG . 51730 1 714 . 1 . 1 96 96 LYS C C 13 176.644 0.00 . . . . . . . 154 LYS C . 51730 1 715 . 1 . 1 96 96 LYS CA C 13 56.490 0.02 . . . . . . . 154 LYS CA . 51730 1 716 . 1 . 1 96 96 LYS CB C 13 32.983 0.02 . . . . . . . 154 LYS CB . 51730 1 717 . 1 . 1 96 96 LYS CG C 13 24.873 0.00 . . . . . . . 154 LYS CG . 51730 1 718 . 1 . 1 96 96 LYS N N 15 121.644 0.05 . . . . . . . 154 LYS N . 51730 1 719 . 1 . 1 97 97 GLN H H 1 8.227 0.01 . . . . . . . 155 GLN H . 51730 1 720 . 1 . 1 97 97 GLN HA H 1 4.205 0.00 . . . . . . . 155 GLN HA . 51730 1 721 . 1 . 1 97 97 GLN HB2 H 1 1.911 0.00 . . . . . . . 155 GLN HB2 . 51730 1 722 . 1 . 1 97 97 GLN HB3 H 1 1.835 0.00 . . . . . . . 155 GLN HB3 . 51730 1 723 . 1 . 1 97 97 GLN C C 13 175.787 0.00 . . . . . . . 155 GLN C . 51730 1 724 . 1 . 1 97 97 GLN CA C 13 55.651 0.03 . . . . . . . 155 GLN CA . 51730 1 725 . 1 . 1 97 97 GLN CB C 13 29.784 0.02 . . . . . . . 155 GLN CB . 51730 1 726 . 1 . 1 97 97 GLN N N 15 121.460 0.05 . . . . . . . 155 GLN N . 51730 1 727 . 1 . 1 98 98 LYS H H 1 8.276 0.00 . . . . . . . 156 LYS H . 51730 1 728 . 1 . 1 98 98 LYS C C 13 176.238 0.00 . . . . . . . 156 LYS C . 51730 1 729 . 1 . 1 98 98 LYS CA C 13 56.531 0.00 . . . . . . . 156 LYS CA . 51730 1 730 . 1 . 1 98 98 LYS CB C 13 33.131 0.00 . . . . . . . 156 LYS CB . 51730 1 731 . 1 . 1 98 98 LYS N N 15 122.871 0.05 . . . . . . . 156 LYS N . 51730 1 732 . 1 . 1 100 100 ASN HA H 1 4.518 0.00 . . . . . . . 158 ASN HA . 51730 1 733 . 1 . 1 100 100 ASN HB3 H 1 2.572 0.00 . . . . . . . 158 ASN HB3 . 51730 1 734 . 1 . 1 100 100 ASN C C 13 175.098 0.00 . . . . . . . 158 ASN C . 51730 1 735 . 1 . 1 100 100 ASN CA C 13 53.152 0.00 . . . . . . . 158 ASN CA . 51730 1 736 . 1 . 1 100 100 ASN CB C 13 38.921 0.00 . . . . . . . 158 ASN CB . 51730 1 737 . 1 . 1 101 101 ARG H H 1 8.224 0.00 . . . . . . . 159 ARG H . 51730 1 738 . 1 . 1 101 101 ARG HA H 1 4.029 0.00 . . . . . . . 159 ARG HA . 51730 1 739 . 1 . 1 101 101 ARG HB2 H 1 1.847 0.00 . . . . . . . 159 ARG HB2 . 51730 1 740 . 1 . 1 101 101 ARG HB3 H 1 1.492 0.00 . . . . . . . 159 ARG HB3 . 51730 1 741 . 1 . 1 101 101 ARG HG2 H 1 1.196 0.00 . . . . . . . 159 ARG HG . 51730 1 742 . 1 . 1 101 101 ARG HG3 H 1 1.196 0.00 . . . . . . . 159 ARG HG . 51730 1 743 . 1 . 1 101 101 ARG HD2 H 1 2.887 0.00 . . . . . . . 159 ARG HD . 51730 1 744 . 1 . 1 101 101 ARG HD3 H 1 2.887 0.00 . . . . . . . 159 ARG HD . 51730 1 745 . 1 . 1 101 101 ARG C C 13 175.933 0.00 . . . . . . . 159 ARG C . 51730 1 746 . 1 . 1 101 101 ARG CA C 13 56.611 0.01 . . . . . . . 159 ARG CA . 51730 1 747 . 1 . 1 101 101 ARG CB C 13 30.431 0.01 . . . . . . . 159 ARG CB . 51730 1 748 . 1 . 1 101 101 ARG CD C 13 43.128 0.00 . . . . . . . 159 ARG CD . 51730 1 749 . 1 . 1 101 101 ARG CG C 13 26.645 0.00 . . . . . . . 159 ARG CG . 51730 1 750 . 1 . 1 101 101 ARG N N 15 121.240 0.05 . . . . . . . 159 ARG N . 51730 1 751 . 1 . 1 102 102 TRP H H 1 7.947 0.01 . . . . . . . 160 TRP H . 51730 1 752 . 1 . 1 102 102 TRP HA H 1 4.556 0.00 . . . . . . . 160 TRP HA . 51730 1 753 . 1 . 1 102 102 TRP HB3 H 1 3.056 0.00 . . . . . . . 160 TRP HB3 . 51730 1 754 . 1 . 1 102 102 TRP C C 13 176.221 0.00 . . . . . . . 160 TRP C . 51730 1 755 . 1 . 1 102 102 TRP CA C 13 57.197 0.00 . . . . . . . 160 TRP CA . 51730 1 756 . 1 . 1 102 102 TRP CB C 13 29.528 0.02 . . . . . . . 160 TRP CB . 51730 1 757 . 1 . 1 102 102 TRP N N 15 121.063 0.05 . . . . . . . 160 TRP N . 51730 1 758 . 1 . 1 103 103 SER H H 1 7.801 0.00 . . . . . . . 161 SER H . 51730 1 759 . 1 . 1 103 103 SER HA H 1 3.586 0.00 . . . . . . . 161 SER HA . 51730 1 760 . 1 . 1 103 103 SER C C 13 173.976 0.00 . . . . . . . 161 SER C . 51730 1 761 . 1 . 1 103 103 SER CA C 13 58.209 0.01 . . . . . . . 161 SER CA . 51730 1 762 . 1 . 1 103 103 SER CB C 13 63.834 0.01 . . . . . . . 161 SER CB . 51730 1 763 . 1 . 1 103 103 SER N N 15 116.891 0.05 . . . . . . . 161 SER N . 51730 1 764 . 1 . 1 104 104 TRP H H 1 7.881 0.00 . . . . . . . 162 TRP H . 51730 1 765 . 1 . 1 104 104 TRP HA H 1 4.518 0.00 . . . . . . . 162 TRP HA . 51730 1 766 . 1 . 1 104 104 TRP HB2 H 1 3.172 0.00 . . . . . . . 162 TRP HB2 . 51730 1 767 . 1 . 1 104 104 TRP HB3 H 1 3.125 0.00 . . . . . . . 162 TRP HB3 . 51730 1 768 . 1 . 1 104 104 TRP C C 13 176.725 0.00 . . . . . . . 162 TRP C . 51730 1 769 . 1 . 1 104 104 TRP CA C 13 57.505 0.01 . . . . . . . 162 TRP CA . 51730 1 770 . 1 . 1 104 104 TRP CB C 13 29.546 0.01 . . . . . . . 162 TRP CB . 51730 1 771 . 1 . 1 104 104 TRP N N 15 122.629 0.04 . . . . . . . 162 TRP N . 51730 1 772 . 1 . 1 105 105 GLY H H 1 8.164 0.01 . . . . . . . 163 GLY H . 51730 1 773 . 1 . 1 105 105 GLY HA2 H 1 3.767 0.00 . . . . . . . 163 GLY HA . 51730 1 774 . 1 . 1 105 105 GLY HA3 H 1 3.767 0.00 . . . . . . . 163 GLY HA . 51730 1 775 . 1 . 1 105 105 GLY C C 13 174.592 0.02 . . . . . . . 163 GLY C . 51730 1 776 . 1 . 1 105 105 GLY CA C 13 45.580 0.01 . . . . . . . 163 GLY CA . 51730 1 777 . 1 . 1 105 105 GLY N N 15 110.814 0.05 . . . . . . . 163 GLY N . 51730 1 778 . 1 . 1 106 106 GLY H H 1 7.648 0.01 . . . . . . . 164 GLY H . 51730 1 779 . 1 . 1 106 106 GLY HA2 H 1 3.756 0.00 . . . . . . . 164 GLY HA . 51730 1 780 . 1 . 1 106 106 GLY HA3 H 1 3.756 0.00 . . . . . . . 164 GLY HA . 51730 1 781 . 1 . 1 106 106 GLY C C 13 174.101 0.00 . . . . . . . 164 GLY C . 51730 1 782 . 1 . 1 106 106 GLY CA C 13 45.236 0.01 . . . . . . . 164 GLY CA . 51730 1 783 . 1 . 1 106 106 GLY N N 15 108.254 0.03 . . . . . . . 164 GLY N . 51730 1 784 . 1 . 1 107 107 SER H H 1 8.026 0.00 . . . . . . . 165 SER H . 51730 1 785 . 1 . 1 107 107 SER HA H 1 4.294 0.00 . . . . . . . 165 SER HA . 51730 1 786 . 1 . 1 107 107 SER HB2 H 1 4.126 0.00 . . . . . . . 165 SER HB2 . 51730 1 787 . 1 . 1 107 107 SER C C 13 174.560 0.02 . . . . . . . 165 SER C . 51730 1 788 . 1 . 1 107 107 SER CA C 13 58.350 0.01 . . . . . . . 165 SER CA . 51730 1 789 . 1 . 1 107 107 SER CB C 13 63.892 0.01 . . . . . . . 165 SER CB . 51730 1 790 . 1 . 1 107 107 SER N N 15 115.315 0.04 . . . . . . . 165 SER N . 51730 1 791 . 1 . 1 108 108 LEU H H 1 8.152 0.00 . . . . . . . 166 LEU H . 51730 1 792 . 1 . 1 108 108 LEU C C 13 177.149 0.00 . . . . . . . 166 LEU C . 51730 1 793 . 1 . 1 108 108 LEU CA C 13 55.492 0.04 . . . . . . . 166 LEU CA . 51730 1 794 . 1 . 1 108 108 LEU CB C 13 42.211 0.03 . . . . . . . 166 LEU CB . 51730 1 795 . 1 . 1 108 108 LEU N N 15 123.617 0.05 . . . . . . . 166 LEU N . 51730 1 796 . 1 . 1 109 109 HIS H H 1 8.172 0.00 . . . . . . . 167 HIS H . 51730 1 797 . 1 . 1 109 109 HIS HA H 1 4.525 0.00 . . . . . . . 167 HIS HA . 51730 1 798 . 1 . 1 109 109 HIS HB2 H 1 3.082 0.00 . . . . . . . 167 HIS HB2 . 51730 1 799 . 1 . 1 109 109 HIS HB3 H 1 2.948 0.00 . . . . . . . 167 HIS HB3 . 51730 1 800 . 1 . 1 109 109 HIS C C 13 175.220 0.00 . . . . . . . 167 HIS C . 51730 1 801 . 1 . 1 109 109 HIS CA C 13 55.647 0.02 . . . . . . . 167 HIS CA . 51730 1 802 . 1 . 1 109 109 HIS CB C 13 29.888 0.02 . . . . . . . 167 HIS CB . 51730 1 803 . 1 . 1 109 109 HIS N N 15 118.931 0.02 . . . . . . . 167 HIS N . 51730 1 804 . 1 . 1 110 110 GLY H H 1 8.126 0.00 . . . . . . . 168 GLY H . 51730 1 805 . 1 . 1 110 110 GLY HA2 H 1 3.825 0.00 . . . . . . . 168 GLY HA . 51730 1 806 . 1 . 1 110 110 GLY HA3 H 1 3.825 0.00 . . . . . . . 168 GLY HA . 51730 1 807 . 1 . 1 110 110 GLY C C 13 173.519 0.00 . . . . . . . 168 GLY C . 51730 1 808 . 1 . 1 110 110 GLY CA C 13 45.169 0.01 . . . . . . . 168 GLY CA . 51730 1 809 . 1 . 1 110 110 GLY N N 15 109.951 0.06 . . . . . . . 168 GLY N . 51730 1 810 . 1 . 1 111 111 SER H H 1 8.026 0.00 . . . . . . . 169 SER H . 51730 1 811 . 1 . 1 111 111 SER HB3 H 1 3.707 0.00 . . . . . . . 169 SER HB3 . 51730 1 812 . 1 . 1 111 111 SER C C 13 179.775 0.00 . . . . . . . 169 SER C . 51730 1 813 . 1 . 1 111 111 SER CA C 13 56.422 0.00 . . . . . . . 169 SER CA . 51730 1 814 . 1 . 1 111 111 SER CB C 13 63.527 0.00 . . . . . . . 169 SER CB . 51730 1 815 . 1 . 1 111 111 SER N N 15 117.203 0.04 . . . . . . . 169 SER N . 51730 1 816 . 1 . 1 112 112 PRO HA H 1 4.145 0.00 . . . . . . . 170 PRO HA . 51730 1 817 . 1 . 1 112 112 PRO HD2 H 1 3.731 0.00 . . . . . . . 170 PRO HD . 51730 1 818 . 1 . 1 112 112 PRO HD3 H 1 3.731 0.00 . . . . . . . 170 PRO HD . 51730 1 819 . 1 . 1 112 112 PRO CA C 13 64.897 0.00 . . . . . . . 170 PRO CA . 51730 1 stop_ save_