data_25038 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25038 _Entry.Title ; Structural Investigation of hnRNP L ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-06-24 _Entry.Accession_date 2014-06-24 _Entry.Last_release_date 2015-05-04 _Entry.Original_release_date 2015-05-04 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.77 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'NMR, 20 STRUCTURES' _Entry.Details 'First RNA Recognition Motif Domain of hnRNP L' _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 Markus Blatter . . . 25038 2 Frederic Allain . . . 25038 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 25038 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID Protein . 25038 RRM . 25038 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25038 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 318 25038 '15N chemical shifts' 103 25038 '1H chemical shifts' 677 25038 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 . . 2015-05-04 . original BMRB . 25038 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 25056 'Cyp33RRM90 MLLPHD3 H3K4me3' 25038 PDB 2MQL 'BMRB Entry Tracking System' 25038 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 25038 _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 ; Structural Investigation of hnRNP L ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'To be Published' _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 Markus Blatter . . . 25038 1 2 Frederic Allain . . . 25038 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25038 _Assembly.ID 1 _Assembly.Name 'hnRNP L' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _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 entity 1 $entity A . yes native no no . . . 25038 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 25038 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GENYDDPHKTPASPVVHIRG LIDGVVEADLVEALQEFGPI SYVVVMPKKRQALVEFEDVL GACNAVNYAADNQIYIAGHP AFVNYSTSQKISRPGDSDDS RSVNS ; _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 105 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 11386.674 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 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 2MQL . "Structural Investigation Of Hnrnp L" . . . . . 100.00 105 100.00 100.00 1.93e-69 . . . . 25038 1 2 no PDB 3R27 . "Crystal Structure Of The First Rrm Domain Of Heterogeneous Nuclear Ribonucleoprotein L (Hnrnp L)" . . . . . 86.67 100 100.00 100.00 1.44e-58 . . . . 25038 1 3 no DBJ BAB18649 . "heterogeneous nuclear ribonucleoprotein L [Homo sapiens]" . . . . . 100.00 589 100.00 100.00 8.66e-64 . . . . 25038 1 4 no DBJ BAC39565 . "unnamed protein product [Mus musculus]" . . . . . 100.00 329 100.00 100.00 3.67e-67 . . . . 25038 1 5 no DBJ BAE02304 . "unnamed protein product [Macaca fascicularis]" . . . . . 57.14 456 100.00 100.00 5.64e-31 . . . . 25038 1 6 no DBJ BAE26011 . "unnamed protein product [Mus musculus]" . . . . . 100.00 592 100.00 100.00 1.47e-63 . . . . 25038 1 7 no DBJ BAF84804 . "unnamed protein product [Homo sapiens]" . . . . . 57.14 456 100.00 100.00 5.70e-31 . . . . 25038 1 8 no EMBL CAA34261 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 558 100.00 100.00 6.29e-64 . . . . 25038 1 9 no GB AAH27206 . "Heterogeneous nuclear ribonucleoprotein L [Mus musculus]" . . . . . 100.00 555 100.00 100.00 6.55e-64 . . . . 25038 1 10 no GB AAH69184 . "HNRNPL protein, partial [Homo sapiens]" . . . . . 100.00 572 100.00 100.00 6.64e-64 . . . . 25038 1 11 no GB AAH99683 . "Hnrpl protein [Mus musculus]" . . . . . 100.00 586 100.00 100.00 8.66e-64 . . . . 25038 1 12 no GB AAI69048 . "Hnrnpl protein [Rattus norvegicus]" . . . . . 100.00 571 100.00 100.00 8.31e-64 . . . . 25038 1 13 no GB EAW56826 . "heterogeneous nuclear ribonucleoprotein L, isoform CRA_a [Homo sapiens]" . . . . . 100.00 557 99.05 99.05 5.93e-63 . . . . 25038 1 14 no PRF 1604358A . "nuclear RNP protein L" . . . . . 100.00 558 100.00 100.00 6.29e-64 . . . . 25038 1 15 no REF NP_001005335 . "heterogeneous nuclear ribonucleoprotein L isoform b [Homo sapiens]" . . . . . 57.14 456 100.00 100.00 5.70e-31 . . . . 25038 1 16 no REF NP_001128232 . "heterogeneous nuclear ribonucleoprotein L isoform a [Rattus norvegicus]" . . . . . 100.00 623 100.00 100.00 1.78e-63 . . . . 25038 1 17 no REF NP_001178959 . "heterogeneous nuclear ribonucleoprotein L [Bos taurus]" . . . . . 100.00 588 100.00 100.00 8.25e-64 . . . . 25038 1 18 no REF NP_001252929 . "heterogeneous nuclear ribonucleoprotein L [Macaca mulatta]" . . . . . 100.00 589 100.00 100.00 9.03e-64 . . . . 25038 1 19 no REF NP_001267082 . "heterogeneous nuclear ribonucleoprotein L [Pan troglodytes]" . . . . . 100.00 558 100.00 100.00 6.70e-64 . . . . 25038 1 20 no SP P14866 . "RecName: Full=Heterogeneous nuclear ribonucleoprotein L; Short=hnRNP L" . . . . . 100.00 589 100.00 100.00 9.03e-64 . . . . 25038 1 21 no SP Q8R081 . "RecName: Full=Heterogeneous nuclear ribonucleoprotein L; Short=hnRNP L" . . . . . 100.00 586 100.00 100.00 8.66e-64 . . . . 25038 1 22 no TPG DAA19831 . "TPA: heterogeneous nuclear ribonucleoprotein L [Bos taurus]" . . . . . 100.00 588 100.00 100.00 8.25e-64 . . . . 25038 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 84 GLY . 25038 1 2 85 GLU . 25038 1 3 86 ASN . 25038 1 4 87 TYR . 25038 1 5 88 ASP . 25038 1 6 89 ASP . 25038 1 7 90 PRO . 25038 1 8 91 HIS . 25038 1 9 92 LYS . 25038 1 10 93 THR . 25038 1 11 94 PRO . 25038 1 12 95 ALA . 25038 1 13 96 SER . 25038 1 14 97 PRO . 25038 1 15 98 VAL . 25038 1 16 99 VAL . 25038 1 17 100 HIS . 25038 1 18 101 ILE . 25038 1 19 102 ARG . 25038 1 20 103 GLY . 25038 1 21 104 LEU . 25038 1 22 105 ILE . 25038 1 23 106 ASP . 25038 1 24 107 GLY . 25038 1 25 108 VAL . 25038 1 26 109 VAL . 25038 1 27 110 GLU . 25038 1 28 111 ALA . 25038 1 29 112 ASP . 25038 1 30 113 LEU . 25038 1 31 114 VAL . 25038 1 32 115 GLU . 25038 1 33 116 ALA . 25038 1 34 117 LEU . 25038 1 35 118 GLN . 25038 1 36 119 GLU . 25038 1 37 120 PHE . 25038 1 38 121 GLY . 25038 1 39 122 PRO . 25038 1 40 123 ILE . 25038 1 41 124 SER . 25038 1 42 125 TYR . 25038 1 43 126 VAL . 25038 1 44 127 VAL . 25038 1 45 128 VAL . 25038 1 46 129 MET . 25038 1 47 130 PRO . 25038 1 48 131 LYS . 25038 1 49 132 LYS . 25038 1 50 133 ARG . 25038 1 51 134 GLN . 25038 1 52 135 ALA . 25038 1 53 136 LEU . 25038 1 54 137 VAL . 25038 1 55 138 GLU . 25038 1 56 139 PHE . 25038 1 57 140 GLU . 25038 1 58 141 ASP . 25038 1 59 142 VAL . 25038 1 60 143 LEU . 25038 1 61 144 GLY . 25038 1 62 145 ALA . 25038 1 63 146 CYS . 25038 1 64 147 ASN . 25038 1 65 148 ALA . 25038 1 66 149 VAL . 25038 1 67 150 ASN . 25038 1 68 151 TYR . 25038 1 69 152 ALA . 25038 1 70 153 ALA . 25038 1 71 154 ASP . 25038 1 72 155 ASN . 25038 1 73 156 GLN . 25038 1 74 157 ILE . 25038 1 75 158 TYR . 25038 1 76 159 ILE . 25038 1 77 160 ALA . 25038 1 78 161 GLY . 25038 1 79 162 HIS . 25038 1 80 163 PRO . 25038 1 81 164 ALA . 25038 1 82 165 PHE . 25038 1 83 166 VAL . 25038 1 84 167 ASN . 25038 1 85 168 TYR . 25038 1 86 169 SER . 25038 1 87 170 THR . 25038 1 88 171 SER . 25038 1 89 172 GLN . 25038 1 90 173 LYS . 25038 1 91 174 ILE . 25038 1 92 175 SER . 25038 1 93 176 ARG . 25038 1 94 177 PRO . 25038 1 95 178 GLY . 25038 1 96 179 ASP . 25038 1 97 180 SER . 25038 1 98 181 ASP . 25038 1 99 182 ASP . 25038 1 100 183 SER . 25038 1 101 184 ARG . 25038 1 102 185 SER . 25038 1 103 186 VAL . 25038 1 104 187 ASN . 25038 1 105 188 SER . 25038 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 . GLY 1 1 25038 1 . GLU 2 2 25038 1 . ASN 3 3 25038 1 . TYR 4 4 25038 1 . ASP 5 5 25038 1 . ASP 6 6 25038 1 . PRO 7 7 25038 1 . HIS 8 8 25038 1 . LYS 9 9 25038 1 . THR 10 10 25038 1 . PRO 11 11 25038 1 . ALA 12 12 25038 1 . SER 13 13 25038 1 . PRO 14 14 25038 1 . VAL 15 15 25038 1 . VAL 16 16 25038 1 . HIS 17 17 25038 1 . ILE 18 18 25038 1 . ARG 19 19 25038 1 . GLY 20 20 25038 1 . LEU 21 21 25038 1 . ILE 22 22 25038 1 . ASP 23 23 25038 1 . GLY 24 24 25038 1 . VAL 25 25 25038 1 . VAL 26 26 25038 1 . GLU 27 27 25038 1 . ALA 28 28 25038 1 . ASP 29 29 25038 1 . LEU 30 30 25038 1 . VAL 31 31 25038 1 . GLU 32 32 25038 1 . ALA 33 33 25038 1 . LEU 34 34 25038 1 . GLN 35 35 25038 1 . GLU 36 36 25038 1 . PHE 37 37 25038 1 . GLY 38 38 25038 1 . PRO 39 39 25038 1 . ILE 40 40 25038 1 . SER 41 41 25038 1 . TYR 42 42 25038 1 . VAL 43 43 25038 1 . VAL 44 44 25038 1 . VAL 45 45 25038 1 . MET 46 46 25038 1 . PRO 47 47 25038 1 . LYS 48 48 25038 1 . LYS 49 49 25038 1 . ARG 50 50 25038 1 . GLN 51 51 25038 1 . ALA 52 52 25038 1 . LEU 53 53 25038 1 . VAL 54 54 25038 1 . GLU 55 55 25038 1 . PHE 56 56 25038 1 . GLU 57 57 25038 1 . ASP 58 58 25038 1 . VAL 59 59 25038 1 . LEU 60 60 25038 1 . GLY 61 61 25038 1 . ALA 62 62 25038 1 . CYS 63 63 25038 1 . ASN 64 64 25038 1 . ALA 65 65 25038 1 . VAL 66 66 25038 1 . ASN 67 67 25038 1 . TYR 68 68 25038 1 . ALA 69 69 25038 1 . ALA 70 70 25038 1 . ASP 71 71 25038 1 . ASN 72 72 25038 1 . GLN 73 73 25038 1 . ILE 74 74 25038 1 . TYR 75 75 25038 1 . ILE 76 76 25038 1 . ALA 77 77 25038 1 . GLY 78 78 25038 1 . HIS 79 79 25038 1 . PRO 80 80 25038 1 . ALA 81 81 25038 1 . PHE 82 82 25038 1 . VAL 83 83 25038 1 . ASN 84 84 25038 1 . TYR 85 85 25038 1 . SER 86 86 25038 1 . THR 87 87 25038 1 . SER 88 88 25038 1 . GLN 89 89 25038 1 . LYS 90 90 25038 1 . ILE 91 91 25038 1 . SER 92 92 25038 1 . ARG 93 93 25038 1 . PRO 94 94 25038 1 . GLY 95 95 25038 1 . ASP 96 96 25038 1 . SER 97 97 25038 1 . ASP 98 98 25038 1 . ASP 99 99 25038 1 . SER 100 100 25038 1 . ARG 101 101 25038 1 . SER 102 102 25038 1 . VAL 103 103 25038 1 . ASN 104 104 25038 1 . SER 105 105 25038 1 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 25038 _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 . 10116 plasmid . 'Rattus norvegicus' Rat . . Eukaryota Metazoa Rattus norvegicus . . . . . . . . . . . . . 25038 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 25038 _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 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pTYB11 . . . 25038 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25038 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'pH 6.5' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% 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 entity '[U-100% 15N]' . . 1 $entity . . 1-2 . . mM . . . . 25038 1 2 'sodium chloride' 'natural abundance' . . . . . . 60 . . mM . . . . 25038 1 3 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 25038 1 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25038 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25038 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25038 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 25038 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% 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 entity '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 1-2 . . mM . . . . 25038 2 2 'sodium chloride' 'natural abundance' . . . . . . 60 . . mM . . . . 25038 2 3 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 25038 2 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25038 2 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25038 2 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25038 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 25038 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 entity '[U-100% 15N]' . . 1 $entity . . 1-2 . . mM . . . . 25038 3 2 'sodium chloride' 'natural abundance' . . . . . . 60 . . mM . . . . 25038 3 3 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 25038 3 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25038 3 5 D2O 'natural abundance' . . . . . . 100 . . % . . . . 25038 3 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 25038 _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' 0.1 . M 25038 1 pH 6.5 . pH 25038 1 pressure 1 . atm 25038 1 temperature 310.15 . K 25038 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 25038 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 25038 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 25038 1 processing 25038 1 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 25038 _Software.ID 2 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 25038 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25038 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 25038 _Software.ID 3 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 25038 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25038 3 stop_ save_ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 25038 _Software.ID 4 _Software.Name AMBER _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 25038 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 25038 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25038 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25038 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 25038 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 900 . . . 25038 1 2 spectrometer_2 Bruker Avance . 700 . . . 25038 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 25038 _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 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25038 1 2 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25038 1 3 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25038 1 4 '2D 1H-1H NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25038 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 25038 _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 0.00 na indirect 0.251449530 . . . . . . . . . 25038 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 25038 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 25038 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25038 _Assigned_chem_shift_list.ID 1 _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 $chemical_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 '3D 1H-15N NOESY' . . . 25038 1 2 '3D 1H-13C NOESY aliphatic' . . . 25038 1 3 '3D 1H-13C NOESY aromatic' . . . 25038 1 4 '2D 1H-1H NOESY' . . . 25038 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 3 $SPARKY . . 25038 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 GLY HA2 H 1 3.879 0.000 . . . . . A 84 GLY HA2 . 25038 1 2 . 1 1 1 1 GLY HA3 H 1 3.879 0.000 . . . . . A 84 GLY HA3 . 25038 1 3 . 1 1 1 1 GLY CA C 13 43.565 0.000 . . . . . A 84 GLY CA . 25038 1 4 . 1 1 2 2 GLU HA H 1 4.330 0.000 . . . . . A 85 GLU HA . 25038 1 5 . 1 1 2 2 GLU HB2 H 1 2.237 0.000 . . . . . A 85 GLU HB2 . 25038 1 6 . 1 1 2 2 GLU HB3 H 1 2.237 0.000 . . . . . A 85 GLU HB3 . 25038 1 7 . 1 1 2 2 GLU HG2 H 1 1.952 0.000 . . . . . A 85 GLU HG2 . 25038 1 8 . 1 1 2 2 GLU HG3 H 1 1.851 0.000 . . . . . A 85 GLU HG3 . 25038 1 9 . 1 1 2 2 GLU CA C 13 56.443 0.000 . . . . . A 85 GLU CA . 25038 1 10 . 1 1 2 2 GLU CB C 13 36.172 0.000 . . . . . A 85 GLU CB . 25038 1 11 . 1 1 2 2 GLU CG C 13 30.629 0.012 . . . . . A 85 GLU CG . 25038 1 12 . 1 1 3 3 ASN H H 1 8.492 0.000 . . . . . A 86 ASN H . 25038 1 13 . 1 1 3 3 ASN HA H 1 4.698 0.000 . . . . . A 86 ASN HA . 25038 1 14 . 1 1 3 3 ASN HB2 H 1 2.788 0.000 . . . . . A 86 ASN HB2 . 25038 1 15 . 1 1 3 3 ASN HB3 H 1 2.714 0.000 . . . . . A 86 ASN HB3 . 25038 1 16 . 1 1 3 3 ASN HD21 H 1 7.574 0.000 . . . . . A 86 ASN HD21 . 25038 1 17 . 1 1 3 3 ASN HD22 H 1 6.905 0.000 . . . . . A 86 ASN HD22 . 25038 1 18 . 1 1 3 3 ASN CA C 13 53.187 0.000 . . . . . A 86 ASN CA . 25038 1 19 . 1 1 3 3 ASN CB C 13 39.214 0.001 . . . . . A 86 ASN CB . 25038 1 20 . 1 1 3 3 ASN N N 15 119.520 0.000 . . . . . A 86 ASN N . 25038 1 21 . 1 1 3 3 ASN ND2 N 15 113.049 0.001 . . . . . A 86 ASN ND2 . 25038 1 22 . 1 1 4 4 TYR H H 1 8.173 0.000 . . . . . A 87 TYR H . 25038 1 23 . 1 1 4 4 TYR HA H 1 4.577 0.000 . . . . . A 87 TYR HA . 25038 1 24 . 1 1 4 4 TYR HB2 H 1 3.097 0.000 . . . . . A 87 TYR HB2 . 25038 1 25 . 1 1 4 4 TYR HB3 H 1 2.928 0.000 . . . . . A 87 TYR HB3 . 25038 1 26 . 1 1 4 4 TYR HD1 H 1 7.094 0.000 . . . . . A 87 TYR HD1 . 25038 1 27 . 1 1 4 4 TYR HD2 H 1 7.094 0.000 . . . . . A 87 TYR HD2 . 25038 1 28 . 1 1 4 4 TYR HE1 H 1 6.813 0.000 . . . . . A 87 TYR HE1 . 25038 1 29 . 1 1 4 4 TYR HE2 H 1 6.813 0.000 . . . . . A 87 TYR HE2 . 25038 1 30 . 1 1 4 4 TYR CA C 13 57.914 0.000 . . . . . A 87 TYR CA . 25038 1 31 . 1 1 4 4 TYR CB C 13 38.717 0.023 . . . . . A 87 TYR CB . 25038 1 32 . 1 1 4 4 TYR CD1 C 13 133.266 0.000 . . . . . A 87 TYR CD1 . 25038 1 33 . 1 1 4 4 TYR CE1 C 13 118.343 0.000 . . . . . A 87 TYR CE1 . 25038 1 34 . 1 1 4 4 TYR N N 15 121.070 0.000 . . . . . A 87 TYR N . 25038 1 35 . 1 1 5 5 ASP H H 1 8.205 0.000 . . . . . A 88 ASP H . 25038 1 36 . 1 1 5 5 ASP HA H 1 4.590 0.000 . . . . . A 88 ASP HA . 25038 1 37 . 1 1 5 5 ASP HB2 H 1 2.601 0.000 . . . . . A 88 ASP HB2 . 25038 1 38 . 1 1 5 5 ASP HB3 H 1 2.601 0.000 . . . . . A 88 ASP HB3 . 25038 1 39 . 1 1 5 5 ASP CA C 13 54.121 0.000 . . . . . A 88 ASP CA . 25038 1 40 . 1 1 5 5 ASP CB C 13 41.463 0.000 . . . . . A 88 ASP CB . 25038 1 41 . 1 1 5 5 ASP N N 15 121.903 0.000 . . . . . A 88 ASP N . 25038 1 42 . 1 1 6 6 ASP H H 1 8.035 0.000 . . . . . A 89 ASP H . 25038 1 43 . 1 1 6 6 ASP HA H 1 4.835 0.000 . . . . . A 89 ASP HA . 25038 1 44 . 1 1 6 6 ASP HB2 H 1 2.779 0.000 . . . . . A 89 ASP HB2 . 25038 1 45 . 1 1 6 6 ASP HB3 H 1 2.605 0.000 . . . . . A 89 ASP HB3 . 25038 1 46 . 1 1 6 6 ASP CA C 13 52.104 0.000 . . . . . A 89 ASP CA . 25038 1 47 . 1 1 6 6 ASP CB C 13 41.814 0.009 . . . . . A 89 ASP CB . 25038 1 48 . 1 1 6 6 ASP N N 15 121.760 0.000 . . . . . A 89 ASP N . 25038 1 49 . 1 1 7 7 PRO HA H 1 4.448 0.000 . . . . . A 90 PRO HA . 25038 1 50 . 1 1 7 7 PRO HB2 H 1 2.261 0.000 . . . . . A 90 PRO HB2 . 25038 1 51 . 1 1 7 7 PRO HB3 H 1 1.777 0.000 . . . . . A 90 PRO HB3 . 25038 1 52 . 1 1 7 7 PRO HG2 H 1 2.004 0.000 . . . . . A 90 PRO HG2 . 25038 1 53 . 1 1 7 7 PRO HG3 H 1 1.768 0.000 . . . . . A 90 PRO HG3 . 25038 1 54 . 1 1 7 7 PRO HD2 H 1 3.852 0.000 . . . . . A 90 PRO HD2 . 25038 1 55 . 1 1 7 7 PRO HD3 H 1 3.852 0.000 . . . . . A 90 PRO HD3 . 25038 1 56 . 1 1 7 7 PRO CA C 13 63.833 0.000 . . . . . A 90 PRO CA . 25038 1 57 . 1 1 7 7 PRO CB C 13 32.184 0.004 . . . . . A 90 PRO CB . 25038 1 58 . 1 1 7 7 PRO CG C 13 27.003 0.020 . . . . . A 90 PRO CG . 25038 1 59 . 1 1 7 7 PRO CD C 13 50.913 0.000 . . . . . A 90 PRO CD . 25038 1 60 . 1 1 8 8 HIS H H 1 8.467 0.000 . . . . . A 91 HIS H . 25038 1 61 . 1 1 8 8 HIS HA H 1 4.682 0.000 . . . . . A 91 HIS HA . 25038 1 62 . 1 1 8 8 HIS HB2 H 1 3.317 0.000 . . . . . A 91 HIS HB2 . 25038 1 63 . 1 1 8 8 HIS HB3 H 1 3.201 0.000 . . . . . A 91 HIS HB3 . 25038 1 64 . 1 1 8 8 HIS HD2 H 1 7.210 0.000 . . . . . A 91 HIS HD2 . 25038 1 65 . 1 1 8 8 HIS HE1 H 1 8.225 0.000 . . . . . A 91 HIS HE1 . 25038 1 66 . 1 1 8 8 HIS CA C 13 56.221 0.000 . . . . . A 91 HIS CA . 25038 1 67 . 1 1 8 8 HIS CB C 13 29.264 0.002 . . . . . A 91 HIS CB . 25038 1 68 . 1 1 8 8 HIS CD2 C 13 120.264 0.000 . . . . . A 91 HIS CD2 . 25038 1 69 . 1 1 8 8 HIS CE1 C 13 137.411 0.000 . . . . . A 91 HIS CE1 . 25038 1 70 . 1 1 8 8 HIS N N 15 117.637 0.000 . . . . . A 91 HIS N . 25038 1 71 . 1 1 9 9 LYS H H 1 7.923 0.000 . . . . . A 92 LYS H . 25038 1 72 . 1 1 9 9 LYS HA H 1 4.418 0.000 . . . . . A 92 LYS HA . 25038 1 73 . 1 1 9 9 LYS HB2 H 1 1.925 0.000 . . . . . A 92 LYS HB2 . 25038 1 74 . 1 1 9 9 LYS HB3 H 1 1.806 0.000 . . . . . A 92 LYS HB3 . 25038 1 75 . 1 1 9 9 LYS HG2 H 1 1.461 0.000 . . . . . A 92 LYS HG2 . 25038 1 76 . 1 1 9 9 LYS HG3 H 1 1.410 0.000 . . . . . A 92 LYS HG3 . 25038 1 77 . 1 1 9 9 LYS HD2 H 1 1.735 0.000 . . . . . A 92 LYS HD2 . 25038 1 78 . 1 1 9 9 LYS HD3 H 1 1.735 0.000 . . . . . A 92 LYS HD3 . 25038 1 79 . 1 1 9 9 LYS HE2 H 1 3.048 0.000 . . . . . A 92 LYS HE2 . 25038 1 80 . 1 1 9 9 LYS HE3 H 1 3.048 0.000 . . . . . A 92 LYS HE3 . 25038 1 81 . 1 1 9 9 LYS CA C 13 56.110 0.000 . . . . . A 92 LYS CA . 25038 1 82 . 1 1 9 9 LYS CB C 13 33.133 0.001 . . . . . A 92 LYS CB . 25038 1 83 . 1 1 9 9 LYS CG C 13 24.843 0.006 . . . . . A 92 LYS CG . 25038 1 84 . 1 1 9 9 LYS CD C 13 29.077 0.000 . . . . . A 92 LYS CD . 25038 1 85 . 1 1 9 9 LYS CE C 13 42.258 0.000 . . . . . A 92 LYS CE . 25038 1 86 . 1 1 9 9 LYS N N 15 121.067 0.000 . . . . . A 92 LYS N . 25038 1 87 . 1 1 10 10 THR H H 1 8.105 0.000 . . . . . A 93 THR H . 25038 1 88 . 1 1 10 10 THR HA H 1 4.541 0.000 . . . . . A 93 THR HA . 25038 1 89 . 1 1 10 10 THR HB H 1 4.159 0.000 . . . . . A 93 THR HB . 25038 1 90 . 1 1 10 10 THR HG21 H 1 1.316 0.000 . . . . . A 93 THR HG21 . 25038 1 91 . 1 1 10 10 THR HG22 H 1 1.316 0.000 . . . . . A 93 THR HG22 . 25038 1 92 . 1 1 10 10 THR HG23 H 1 1.316 0.000 . . . . . A 93 THR HG23 . 25038 1 93 . 1 1 10 10 THR CA C 13 60.550 0.000 . . . . . A 93 THR CA . 25038 1 94 . 1 1 10 10 THR CB C 13 70.341 0.000 . . . . . A 93 THR CB . 25038 1 95 . 1 1 10 10 THR CG2 C 13 21.960 0.000 . . . . . A 93 THR CG2 . 25038 1 96 . 1 1 10 10 THR N N 15 119.990 0.000 . . . . . A 93 THR N . 25038 1 97 . 1 1 11 11 PRO HA H 1 4.284 0.000 . . . . . A 94 PRO HA . 25038 1 98 . 1 1 11 11 PRO HB2 H 1 2.260 0.000 . . . . . A 94 PRO HB2 . 25038 1 99 . 1 1 11 11 PRO HB3 H 1 2.260 0.000 . . . . . A 94 PRO HB3 . 25038 1 100 . 1 1 11 11 PRO HG2 H 1 1.971 0.000 . . . . . A 94 PRO HG2 . 25038 1 101 . 1 1 11 11 PRO HG3 H 1 1.814 0.000 . . . . . A 94 PRO HG3 . 25038 1 102 . 1 1 11 11 PRO HD2 H 1 3.911 0.000 . . . . . A 94 PRO HD2 . 25038 1 103 . 1 1 11 11 PRO HD3 H 1 3.699 0.000 . . . . . A 94 PRO HD3 . 25038 1 104 . 1 1 11 11 PRO CA C 13 62.477 0.000 . . . . . A 94 PRO CA . 25038 1 105 . 1 1 11 11 PRO CB C 13 32.245 0.000 . . . . . A 94 PRO CB . 25038 1 106 . 1 1 11 11 PRO CG C 13 27.434 0.033 . . . . . A 94 PRO CG . 25038 1 107 . 1 1 11 11 PRO CD C 13 51.165 0.003 . . . . . A 94 PRO CD . 25038 1 108 . 1 1 12 12 ALA H H 1 7.689 0.000 . . . . . A 95 ALA H . 25038 1 109 . 1 1 12 12 ALA HA H 1 1.942 0.000 . . . . . A 95 ALA HA . 25038 1 110 . 1 1 12 12 ALA HB1 H 1 0.829 0.000 . . . . . A 95 ALA HB1 . 25038 1 111 . 1 1 12 12 ALA HB2 H 1 0.829 0.000 . . . . . A 95 ALA HB2 . 25038 1 112 . 1 1 12 12 ALA HB3 H 1 0.829 0.000 . . . . . A 95 ALA HB3 . 25038 1 113 . 1 1 12 12 ALA CA C 13 52.176 0.000 . . . . . A 95 ALA CA . 25038 1 114 . 1 1 12 12 ALA CB C 13 19.077 0.000 . . . . . A 95 ALA CB . 25038 1 115 . 1 1 12 12 ALA N N 15 121.588 0.000 . . . . . A 95 ALA N . 25038 1 116 . 1 1 13 13 SER H H 1 6.513 0.000 . . . . . A 96 SER H . 25038 1 117 . 1 1 13 13 SER HA H 1 4.972 0.000 . . . . . A 96 SER HA . 25038 1 118 . 1 1 13 13 SER HB2 H 1 4.117 0.000 . . . . . A 96 SER HB2 . 25038 1 119 . 1 1 13 13 SER HB3 H 1 3.925 0.000 . . . . . A 96 SER HB3 . 25038 1 120 . 1 1 13 13 SER CA C 13 53.248 0.000 . . . . . A 96 SER CA . 25038 1 121 . 1 1 13 13 SER CB C 13 67.028 0.010 . . . . . A 96 SER CB . 25038 1 122 . 1 1 13 13 SER N N 15 115.382 0.000 . . . . . A 96 SER N . 25038 1 123 . 1 1 14 14 PRO HA H 1 4.618 0.000 . . . . . A 97 PRO HA . 25038 1 124 . 1 1 14 14 PRO HB2 H 1 2.327 0.000 . . . . . A 97 PRO HB2 . 25038 1 125 . 1 1 14 14 PRO HB3 H 1 2.327 0.000 . . . . . A 97 PRO HB3 . 25038 1 126 . 1 1 14 14 PRO HG2 H 1 2.081 0.000 . . . . . A 97 PRO HG2 . 25038 1 127 . 1 1 14 14 PRO HG3 H 1 2.020 0.000 . . . . . A 97 PRO HG3 . 25038 1 128 . 1 1 14 14 PRO HD2 H 1 3.842 0.000 . . . . . A 97 PRO HD2 . 25038 1 129 . 1 1 14 14 PRO HD3 H 1 3.664 0.000 . . . . . A 97 PRO HD3 . 25038 1 130 . 1 1 14 14 PRO CA C 13 64.555 0.000 . . . . . A 97 PRO CA . 25038 1 131 . 1 1 14 14 PRO CB C 13 32.140 0.000 . . . . . A 97 PRO CB . 25038 1 132 . 1 1 14 14 PRO CG C 13 27.491 0.019 . . . . . A 97 PRO CG . 25038 1 133 . 1 1 14 14 PRO CD C 13 50.659 0.023 . . . . . A 97 PRO CD . 25038 1 134 . 1 1 15 15 VAL H H 1 8.573 0.000 . . . . . A 98 VAL H . 25038 1 135 . 1 1 15 15 VAL HA H 1 5.052 0.000 . . . . . A 98 VAL HA . 25038 1 136 . 1 1 15 15 VAL HB H 1 2.168 0.000 . . . . . A 98 VAL HB . 25038 1 137 . 1 1 15 15 VAL HG11 H 1 0.812 0.000 . . . . . A 98 VAL HG11 . 25038 1 138 . 1 1 15 15 VAL HG12 H 1 0.812 0.000 . . . . . A 98 VAL HG12 . 25038 1 139 . 1 1 15 15 VAL HG13 H 1 0.812 0.000 . . . . . A 98 VAL HG13 . 25038 1 140 . 1 1 15 15 VAL HG21 H 1 0.705 0.000 . . . . . A 98 VAL HG21 . 25038 1 141 . 1 1 15 15 VAL HG22 H 1 0.705 0.000 . . . . . A 98 VAL HG22 . 25038 1 142 . 1 1 15 15 VAL HG23 H 1 0.705 0.000 . . . . . A 98 VAL HG23 . 25038 1 143 . 1 1 15 15 VAL CA C 13 60.937 0.000 . . . . . A 98 VAL CA . 25038 1 144 . 1 1 15 15 VAL CB C 13 31.783 0.000 . . . . . A 98 VAL CB . 25038 1 145 . 1 1 15 15 VAL CG1 C 13 23.097 0.000 . . . . . A 98 VAL CG1 . 25038 1 146 . 1 1 15 15 VAL CG2 C 13 21.769 0.000 . . . . . A 98 VAL CG2 . 25038 1 147 . 1 1 15 15 VAL N N 15 119.140 0.000 . . . . . A 98 VAL N . 25038 1 148 . 1 1 16 16 VAL H H 1 9.500 0.000 . . . . . A 99 VAL H . 25038 1 149 . 1 1 16 16 VAL HA H 1 4.972 0.000 . . . . . A 99 VAL HA . 25038 1 150 . 1 1 16 16 VAL HB H 1 2.122 0.000 . . . . . A 99 VAL HB . 25038 1 151 . 1 1 16 16 VAL HG11 H 1 0.954 0.000 . . . . . A 99 VAL HG11 . 25038 1 152 . 1 1 16 16 VAL HG12 H 1 0.954 0.000 . . . . . A 99 VAL HG12 . 25038 1 153 . 1 1 16 16 VAL HG13 H 1 0.954 0.000 . . . . . A 99 VAL HG13 . 25038 1 154 . 1 1 16 16 VAL HG21 H 1 1.141 0.000 . . . . . A 99 VAL HG21 . 25038 1 155 . 1 1 16 16 VAL HG22 H 1 1.141 0.000 . . . . . A 99 VAL HG22 . 25038 1 156 . 1 1 16 16 VAL HG23 H 1 1.141 0.000 . . . . . A 99 VAL HG23 . 25038 1 157 . 1 1 16 16 VAL CA C 13 59.440 0.000 . . . . . A 99 VAL CA . 25038 1 158 . 1 1 16 16 VAL CB C 13 33.979 0.000 . . . . . A 99 VAL CB . 25038 1 159 . 1 1 16 16 VAL CG1 C 13 22.366 0.000 . . . . . A 99 VAL CG1 . 25038 1 160 . 1 1 16 16 VAL CG2 C 13 21.278 0.000 . . . . . A 99 VAL CG2 . 25038 1 161 . 1 1 16 16 VAL N N 15 120.615 0.000 . . . . . A 99 VAL N . 25038 1 162 . 1 1 17 17 HIS H H 1 9.477 0.000 . . . . . A 100 HIS H . 25038 1 163 . 1 1 17 17 HIS HA H 1 5.324 0.000 . . . . . A 100 HIS HA . 25038 1 164 . 1 1 17 17 HIS HB2 H 1 3.108 0.000 . . . . . A 100 HIS HB2 . 25038 1 165 . 1 1 17 17 HIS HB3 H 1 2.691 0.000 . . . . . A 100 HIS HB3 . 25038 1 166 . 1 1 17 17 HIS HD2 H 1 7.022 0.000 . . . . . A 100 HIS HD2 . 25038 1 167 . 1 1 17 17 HIS HE1 H 1 7.694 0.000 . . . . . A 100 HIS HE1 . 25038 1 168 . 1 1 17 17 HIS CA C 13 54.340 0.000 . . . . . A 100 HIS CA . 25038 1 169 . 1 1 17 17 HIS CB C 13 34.115 0.012 . . . . . A 100 HIS CB . 25038 1 170 . 1 1 17 17 HIS CD2 C 13 117.275 0.000 . . . . . A 100 HIS CD2 . 25038 1 171 . 1 1 17 17 HIS CE1 C 13 137.665 0.000 . . . . . A 100 HIS CE1 . 25038 1 172 . 1 1 17 17 HIS N N 15 125.469 0.000 . . . . . A 100 HIS N . 25038 1 173 . 1 1 18 18 ILE H H 1 9.384 0.000 . . . . . A 101 ILE H . 25038 1 174 . 1 1 18 18 ILE HA H 1 5.213 0.000 . . . . . A 101 ILE HA . 25038 1 175 . 1 1 18 18 ILE HB H 1 1.898 0.000 . . . . . A 101 ILE HB . 25038 1 176 . 1 1 18 18 ILE HG12 H 1 1.442 0.000 . . . . . A 101 ILE HG12 . 25038 1 177 . 1 1 18 18 ILE HG13 H 1 1.226 0.000 . . . . . A 101 ILE HG13 . 25038 1 178 . 1 1 18 18 ILE HG21 H 1 0.852 0.000 . . . . . A 101 ILE HG21 . 25038 1 179 . 1 1 18 18 ILE HG22 H 1 0.852 0.000 . . . . . A 101 ILE HG22 . 25038 1 180 . 1 1 18 18 ILE HG23 H 1 0.852 0.000 . . . . . A 101 ILE HG23 . 25038 1 181 . 1 1 18 18 ILE HD11 H 1 0.794 0.000 . . . . . A 101 ILE HD11 . 25038 1 182 . 1 1 18 18 ILE HD12 H 1 0.794 0.000 . . . . . A 101 ILE HD12 . 25038 1 183 . 1 1 18 18 ILE HD13 H 1 0.794 0.000 . . . . . A 101 ILE HD13 . 25038 1 184 . 1 1 18 18 ILE CA C 13 59.309 0.000 . . . . . A 101 ILE CA . 25038 1 185 . 1 1 18 18 ILE CB C 13 38.955 0.000 . . . . . A 101 ILE CB . 25038 1 186 . 1 1 18 18 ILE CG1 C 13 28.349 0.040 . . . . . A 101 ILE CG1 . 25038 1 187 . 1 1 18 18 ILE CG2 C 13 19.359 0.000 . . . . . A 101 ILE CG2 . 25038 1 188 . 1 1 18 18 ILE CD1 C 13 14.654 0.000 . . . . . A 101 ILE CD1 . 25038 1 189 . 1 1 18 18 ILE N N 15 128.404 0.000 . . . . . A 101 ILE N . 25038 1 190 . 1 1 19 19 ARG H H 1 8.972 0.000 . . . . . A 102 ARG H . 25038 1 191 . 1 1 19 19 ARG HA H 1 5.130 0.000 . . . . . A 102 ARG HA . 25038 1 192 . 1 1 19 19 ARG HB2 H 1 1.937 0.000 . . . . . A 102 ARG HB2 . 25038 1 193 . 1 1 19 19 ARG HB3 H 1 1.819 0.000 . . . . . A 102 ARG HB3 . 25038 1 194 . 1 1 19 19 ARG HG2 H 1 1.568 0.000 . . . . . A 102 ARG HG2 . 25038 1 195 . 1 1 19 19 ARG HG3 H 1 1.440 0.000 . . . . . A 102 ARG HG3 . 25038 1 196 . 1 1 19 19 ARG HD2 H 1 3.083 0.000 . . . . . A 102 ARG HD2 . 25038 1 197 . 1 1 19 19 ARG HD3 H 1 3.083 0.000 . . . . . A 102 ARG HD3 . 25038 1 198 . 1 1 19 19 ARG HE H 1 6.898 0.000 . . . . . A 102 ARG HE . 25038 1 199 . 1 1 19 19 ARG CA C 13 54.218 0.000 . . . . . A 102 ARG CA . 25038 1 200 . 1 1 19 19 ARG CB C 13 34.282 0.010 . . . . . A 102 ARG CB . 25038 1 201 . 1 1 19 19 ARG CG C 13 28.038 0.002 . . . . . A 102 ARG CG . 25038 1 202 . 1 1 19 19 ARG CD C 13 43.372 0.000 . . . . . A 102 ARG CD . 25038 1 203 . 1 1 19 19 ARG N N 15 123.920 0.000 . . . . . A 102 ARG N . 25038 1 204 . 1 1 19 19 ARG NE N 15 85.522 0.000 . . . . . A 102 ARG NE . 25038 1 205 . 1 1 20 20 GLY H H 1 9.082 0.000 . . . . . A 103 GLY H . 25038 1 206 . 1 1 20 20 GLY HA2 H 1 4.369 0.000 . . . . . A 103 GLY HA2 . 25038 1 207 . 1 1 20 20 GLY HA3 H 1 3.968 0.000 . . . . . A 103 GLY HA3 . 25038 1 208 . 1 1 20 20 GLY CA C 13 45.876 0.005 . . . . . A 103 GLY CA . 25038 1 209 . 1 1 20 20 GLY N N 15 108.133 0.000 . . . . . A 103 GLY N . 25038 1 210 . 1 1 21 21 LEU H H 1 7.352 0.000 . . . . . A 104 LEU H . 25038 1 211 . 1 1 21 21 LEU HA H 1 4.256 0.000 . . . . . A 104 LEU HA . 25038 1 212 . 1 1 21 21 LEU HB2 H 1 1.472 0.000 . . . . . A 104 LEU HB2 . 25038 1 213 . 1 1 21 21 LEU HB3 H 1 1.294 0.000 . . . . . A 104 LEU HB3 . 25038 1 214 . 1 1 21 21 LEU HG H 1 1.377 0.000 . . . . . A 104 LEU HG . 25038 1 215 . 1 1 21 21 LEU HD11 H 1 0.608 0.000 . . . . . A 104 LEU HD11 . 25038 1 216 . 1 1 21 21 LEU HD12 H 1 0.608 0.000 . . . . . A 104 LEU HD12 . 25038 1 217 . 1 1 21 21 LEU HD13 H 1 0.608 0.000 . . . . . A 104 LEU HD13 . 25038 1 218 . 1 1 21 21 LEU HD21 H 1 0.811 0.000 . . . . . A 104 LEU HD21 . 25038 1 219 . 1 1 21 21 LEU HD22 H 1 0.811 0.000 . . . . . A 104 LEU HD22 . 25038 1 220 . 1 1 21 21 LEU HD23 H 1 0.811 0.000 . . . . . A 104 LEU HD23 . 25038 1 221 . 1 1 21 21 LEU CA C 13 54.576 0.000 . . . . . A 104 LEU CA . 25038 1 222 . 1 1 21 21 LEU CB C 13 42.832 0.004 . . . . . A 104 LEU CB . 25038 1 223 . 1 1 21 21 LEU CG C 13 27.245 0.000 . . . . . A 104 LEU CG . 25038 1 224 . 1 1 21 21 LEU CD1 C 13 25.978 0.000 . . . . . A 104 LEU CD1 . 25038 1 225 . 1 1 21 21 LEU CD2 C 13 23.790 0.000 . . . . . A 104 LEU CD2 . 25038 1 226 . 1 1 21 21 LEU N N 15 116.963 0.000 . . . . . A 104 LEU N . 25038 1 227 . 1 1 22 22 ILE H H 1 7.619 0.000 . . . . . A 105 ILE H . 25038 1 228 . 1 1 22 22 ILE HA H 1 4.291 0.000 . . . . . A 105 ILE HA . 25038 1 229 . 1 1 22 22 ILE HB H 1 1.773 0.000 . . . . . A 105 ILE HB . 25038 1 230 . 1 1 22 22 ILE HG12 H 1 1.244 0.000 . . . . . A 105 ILE HG12 . 25038 1 231 . 1 1 22 22 ILE HG13 H 1 1.059 0.000 . . . . . A 105 ILE HG13 . 25038 1 232 . 1 1 22 22 ILE HG21 H 1 0.624 0.000 . . . . . A 105 ILE HG21 . 25038 1 233 . 1 1 22 22 ILE HG22 H 1 0.624 0.000 . . . . . A 105 ILE HG22 . 25038 1 234 . 1 1 22 22 ILE HG23 H 1 0.624 0.000 . . . . . A 105 ILE HG23 . 25038 1 235 . 1 1 22 22 ILE HD11 H 1 0.732 0.000 . . . . . A 105 ILE HD11 . 25038 1 236 . 1 1 22 22 ILE HD12 H 1 0.732 0.000 . . . . . A 105 ILE HD12 . 25038 1 237 . 1 1 22 22 ILE HD13 H 1 0.732 0.000 . . . . . A 105 ILE HD13 . 25038 1 238 . 1 1 22 22 ILE CA C 13 60.060 0.000 . . . . . A 105 ILE CA . 25038 1 239 . 1 1 22 22 ILE CB C 13 39.592 0.000 . . . . . A 105 ILE CB . 25038 1 240 . 1 1 22 22 ILE CG1 C 13 26.227 0.013 . . . . . A 105 ILE CG1 . 25038 1 241 . 1 1 22 22 ILE CG2 C 13 17.696 0.000 . . . . . A 105 ILE CG2 . 25038 1 242 . 1 1 22 22 ILE CD1 C 13 14.130 0.000 . . . . . A 105 ILE CD1 . 25038 1 243 . 1 1 22 22 ILE N N 15 115.391 0.000 . . . . . A 105 ILE N . 25038 1 244 . 1 1 23 23 ASP H H 1 7.998 0.000 . . . . . A 106 ASP H . 25038 1 245 . 1 1 23 23 ASP HA H 1 4.430 0.000 . . . . . A 106 ASP HA . 25038 1 246 . 1 1 23 23 ASP HB2 H 1 2.614 0.000 . . . . . A 106 ASP HB2 . 25038 1 247 . 1 1 23 23 ASP HB3 H 1 2.511 0.000 . . . . . A 106 ASP HB3 . 25038 1 248 . 1 1 23 23 ASP CA C 13 55.770 0.000 . . . . . A 106 ASP CA . 25038 1 249 . 1 1 23 23 ASP CB C 13 41.147 0.005 . . . . . A 106 ASP CB . 25038 1 250 . 1 1 23 23 ASP N N 15 119.972 0.000 . . . . . A 106 ASP N . 25038 1 251 . 1 1 24 24 GLY H H 1 8.524 0.000 . . . . . A 107 GLY H . 25038 1 252 . 1 1 24 24 GLY HA2 H 1 4.164 0.000 . . . . . A 107 GLY HA2 . 25038 1 253 . 1 1 24 24 GLY HA3 H 1 3.702 0.000 . . . . . A 107 GLY HA3 . 25038 1 254 . 1 1 24 24 GLY CA C 13 45.444 0.006 . . . . . A 107 GLY CA . 25038 1 255 . 1 1 24 24 GLY N N 15 109.601 0.000 . . . . . A 107 GLY N . 25038 1 256 . 1 1 25 25 VAL H H 1 7.024 0.000 . . . . . A 108 VAL H . 25038 1 257 . 1 1 25 25 VAL HA H 1 4.072 0.000 . . . . . A 108 VAL HA . 25038 1 258 . 1 1 25 25 VAL HB H 1 1.981 0.000 . . . . . A 108 VAL HB . 25038 1 259 . 1 1 25 25 VAL HG11 H 1 1.022 0.000 . . . . . A 108 VAL HG11 . 25038 1 260 . 1 1 25 25 VAL HG12 H 1 1.022 0.000 . . . . . A 108 VAL HG12 . 25038 1 261 . 1 1 25 25 VAL HG13 H 1 1.022 0.000 . . . . . A 108 VAL HG13 . 25038 1 262 . 1 1 25 25 VAL HG21 H 1 0.920 0.000 . . . . . A 108 VAL HG21 . 25038 1 263 . 1 1 25 25 VAL HG22 H 1 0.920 0.000 . . . . . A 108 VAL HG22 . 25038 1 264 . 1 1 25 25 VAL HG23 H 1 0.920 0.000 . . . . . A 108 VAL HG23 . 25038 1 265 . 1 1 25 25 VAL CA C 13 63.360 0.000 . . . . . A 108 VAL CA . 25038 1 266 . 1 1 25 25 VAL CB C 13 32.128 0.000 . . . . . A 108 VAL CB . 25038 1 267 . 1 1 25 25 VAL CG1 C 13 23.438 0.000 . . . . . A 108 VAL CG1 . 25038 1 268 . 1 1 25 25 VAL CG2 C 13 22.181 0.000 . . . . . A 108 VAL CG2 . 25038 1 269 . 1 1 25 25 VAL N N 15 120.038 0.000 . . . . . A 108 VAL N . 25038 1 270 . 1 1 26 26 VAL H H 1 8.880 0.000 . . . . . A 109 VAL H . 25038 1 271 . 1 1 26 26 VAL HA H 1 4.799 0.000 . . . . . A 109 VAL HA . 25038 1 272 . 1 1 26 26 VAL HB H 1 2.499 0.000 . . . . . A 109 VAL HB . 25038 1 273 . 1 1 26 26 VAL HG11 H 1 1.011 0.000 . . . . . A 109 VAL HG11 . 25038 1 274 . 1 1 26 26 VAL HG12 H 1 1.011 0.000 . . . . . A 109 VAL HG12 . 25038 1 275 . 1 1 26 26 VAL HG13 H 1 1.011 0.000 . . . . . A 109 VAL HG13 . 25038 1 276 . 1 1 26 26 VAL HG21 H 1 0.966 0.000 . . . . . A 109 VAL HG21 . 25038 1 277 . 1 1 26 26 VAL HG22 H 1 0.966 0.000 . . . . . A 109 VAL HG22 . 25038 1 278 . 1 1 26 26 VAL HG23 H 1 0.966 0.000 . . . . . A 109 VAL HG23 . 25038 1 279 . 1 1 26 26 VAL CA C 13 59.127 0.000 . . . . . A 109 VAL CA . 25038 1 280 . 1 1 26 26 VAL CB C 13 35.660 0.000 . . . . . A 109 VAL CB . 25038 1 281 . 1 1 26 26 VAL CG1 C 13 21.621 0.000 . . . . . A 109 VAL CG1 . 25038 1 282 . 1 1 26 26 VAL CG2 C 13 19.092 0.000 . . . . . A 109 VAL CG2 . 25038 1 283 . 1 1 26 26 VAL N N 15 119.135 0.000 . . . . . A 109 VAL N . 25038 1 284 . 1 1 27 27 GLU H H 1 9.603 0.000 . . . . . A 110 GLU H . 25038 1 285 . 1 1 27 27 GLU HA H 1 3.607 0.000 . . . . . A 110 GLU HA . 25038 1 286 . 1 1 27 27 GLU HB2 H 1 2.103 0.000 . . . . . A 110 GLU HB2 . 25038 1 287 . 1 1 27 27 GLU HB3 H 1 1.885 0.000 . . . . . A 110 GLU HB3 . 25038 1 288 . 1 1 27 27 GLU HG2 H 1 2.340 0.000 . . . . . A 110 GLU HG2 . 25038 1 289 . 1 1 27 27 GLU HG3 H 1 2.070 0.000 . . . . . A 110 GLU HG3 . 25038 1 290 . 1 1 27 27 GLU CA C 13 61.975 0.000 . . . . . A 110 GLU CA . 25038 1 291 . 1 1 27 27 GLU CB C 13 28.929 0.009 . . . . . A 110 GLU CB . 25038 1 292 . 1 1 27 27 GLU CG C 13 37.174 0.007 . . . . . A 110 GLU CG . 25038 1 293 . 1 1 27 27 GLU N N 15 122.627 0.000 . . . . . A 110 GLU N . 25038 1 294 . 1 1 28 28 ALA H H 1 8.604 0.000 . . . . . A 111 ALA H . 25038 1 295 . 1 1 28 28 ALA HA H 1 4.072 0.000 . . . . . A 111 ALA HA . 25038 1 296 . 1 1 28 28 ALA HB1 H 1 1.441 0.000 . . . . . A 111 ALA HB1 . 25038 1 297 . 1 1 28 28 ALA HB2 H 1 1.441 0.000 . . . . . A 111 ALA HB2 . 25038 1 298 . 1 1 28 28 ALA HB3 H 1 1.441 0.000 . . . . . A 111 ALA HB3 . 25038 1 299 . 1 1 28 28 ALA CA C 13 55.422 0.000 . . . . . A 111 ALA CA . 25038 1 300 . 1 1 28 28 ALA CB C 13 18.647 0.000 . . . . . A 111 ALA CB . 25038 1 301 . 1 1 28 28 ALA N N 15 118.291 0.000 . . . . . A 111 ALA N . 25038 1 302 . 1 1 29 29 ASP H H 1 7.612 0.000 . . . . . A 112 ASP H . 25038 1 303 . 1 1 29 29 ASP HA H 1 4.476 0.000 . . . . . A 112 ASP HA . 25038 1 304 . 1 1 29 29 ASP HB2 H 1 3.045 0.000 . . . . . A 112 ASP HB2 . 25038 1 305 . 1 1 29 29 ASP HB3 H 1 2.603 0.000 . . . . . A 112 ASP HB3 . 25038 1 306 . 1 1 29 29 ASP CA C 13 57.490 0.000 . . . . . A 112 ASP CA . 25038 1 307 . 1 1 29 29 ASP CB C 13 42.002 0.010 . . . . . A 112 ASP CB . 25038 1 308 . 1 1 29 29 ASP N N 15 115.647 0.000 . . . . . A 112 ASP N . 25038 1 309 . 1 1 30 30 LEU H H 1 7.319 0.000 . . . . . A 113 LEU H . 25038 1 310 . 1 1 30 30 LEU HA H 1 3.996 0.000 . . . . . A 113 LEU HA . 25038 1 311 . 1 1 30 30 LEU HB2 H 1 2.143 0.000 . . . . . A 113 LEU HB2 . 25038 1 312 . 1 1 30 30 LEU HB3 H 1 1.269 0.000 . . . . . A 113 LEU HB3 . 25038 1 313 . 1 1 30 30 LEU HG H 1 1.490 0.000 . . . . . A 113 LEU HG . 25038 1 314 . 1 1 30 30 LEU HD11 H 1 0.708 0.000 . . . . . A 113 LEU HD11 . 25038 1 315 . 1 1 30 30 LEU HD12 H 1 0.708 0.000 . . . . . A 113 LEU HD12 . 25038 1 316 . 1 1 30 30 LEU HD13 H 1 0.708 0.000 . . . . . A 113 LEU HD13 . 25038 1 317 . 1 1 30 30 LEU HD21 H 1 0.753 0.000 . . . . . A 113 LEU HD21 . 25038 1 318 . 1 1 30 30 LEU HD22 H 1 0.753 0.000 . . . . . A 113 LEU HD22 . 25038 1 319 . 1 1 30 30 LEU HD23 H 1 0.753 0.000 . . . . . A 113 LEU HD23 . 25038 1 320 . 1 1 30 30 LEU CA C 13 57.822 0.000 . . . . . A 113 LEU CA . 25038 1 321 . 1 1 30 30 LEU CB C 13 41.117 0.014 . . . . . A 113 LEU CB . 25038 1 322 . 1 1 30 30 LEU CG C 13 28.339 0.000 . . . . . A 113 LEU CG . 25038 1 323 . 1 1 30 30 LEU CD1 C 13 26.939 0.000 . . . . . A 113 LEU CD1 . 25038 1 324 . 1 1 30 30 LEU CD2 C 13 25.805 0.000 . . . . . A 113 LEU CD2 . 25038 1 325 . 1 1 30 30 LEU N N 15 120.848 0.000 . . . . . A 113 LEU N . 25038 1 326 . 1 1 31 31 VAL H H 1 7.856 0.000 . . . . . A 114 VAL H . 25038 1 327 . 1 1 31 31 VAL HA H 1 3.368 0.000 . . . . . A 114 VAL HA . 25038 1 328 . 1 1 31 31 VAL HB H 1 2.015 0.000 . . . . . A 114 VAL HB . 25038 1 329 . 1 1 31 31 VAL HG11 H 1 0.941 0.000 . . . . . A 114 VAL HG11 . 25038 1 330 . 1 1 31 31 VAL HG12 H 1 0.941 0.000 . . . . . A 114 VAL HG12 . 25038 1 331 . 1 1 31 31 VAL HG13 H 1 0.941 0.000 . . . . . A 114 VAL HG13 . 25038 1 332 . 1 1 31 31 VAL HG21 H 1 0.907 0.000 . . . . . A 114 VAL HG21 . 25038 1 333 . 1 1 31 31 VAL HG22 H 1 0.907 0.000 . . . . . A 114 VAL HG22 . 25038 1 334 . 1 1 31 31 VAL HG23 H 1 0.907 0.000 . . . . . A 114 VAL HG23 . 25038 1 335 . 1 1 31 31 VAL CA C 13 66.945 0.000 . . . . . A 114 VAL CA . 25038 1 336 . 1 1 31 31 VAL CB C 13 31.915 0.000 . . . . . A 114 VAL CB . 25038 1 337 . 1 1 31 31 VAL CG1 C 13 22.726 0.000 . . . . . A 114 VAL CG1 . 25038 1 338 . 1 1 31 31 VAL CG2 C 13 21.338 0.000 . . . . . A 114 VAL CG2 . 25038 1 339 . 1 1 31 31 VAL N N 15 118.911 0.000 . . . . . A 114 VAL N . 25038 1 340 . 1 1 32 32 GLU H H 1 8.067 0.000 . . . . . A 115 GLU H . 25038 1 341 . 1 1 32 32 GLU HA H 1 3.976 0.000 . . . . . A 115 GLU HA . 25038 1 342 . 1 1 32 32 GLU HB2 H 1 2.208 0.000 . . . . . A 115 GLU HB2 . 25038 1 343 . 1 1 32 32 GLU HB3 H 1 2.077 0.000 . . . . . A 115 GLU HB3 . 25038 1 344 . 1 1 32 32 GLU HG2 H 1 2.402 0.000 . . . . . A 115 GLU HG2 . 25038 1 345 . 1 1 32 32 GLU HG3 H 1 2.337 0.000 . . . . . A 115 GLU HG3 . 25038 1 346 . 1 1 32 32 GLU CA C 13 59.362 0.000 . . . . . A 115 GLU CA . 25038 1 347 . 1 1 32 32 GLU CB C 13 29.691 0.005 . . . . . A 115 GLU CB . 25038 1 348 . 1 1 32 32 GLU CG C 13 36.184 0.002 . . . . . A 115 GLU CG . 25038 1 349 . 1 1 32 32 GLU N N 15 117.004 0.000 . . . . . A 115 GLU N . 25038 1 350 . 1 1 33 33 ALA H H 1 7.115 0.000 . . . . . A 116 ALA H . 25038 1 351 . 1 1 33 33 ALA HA H 1 4.478 0.000 . . . . . A 116 ALA HA . 25038 1 352 . 1 1 33 33 ALA HB1 H 1 1.677 0.000 . . . . . A 116 ALA HB1 . 25038 1 353 . 1 1 33 33 ALA HB2 H 1 1.677 0.000 . . . . . A 116 ALA HB2 . 25038 1 354 . 1 1 33 33 ALA HB3 H 1 1.677 0.000 . . . . . A 116 ALA HB3 . 25038 1 355 . 1 1 33 33 ALA CA C 13 54.046 0.000 . . . . . A 116 ALA CA . 25038 1 356 . 1 1 33 33 ALA CB C 13 21.467 0.000 . . . . . A 116 ALA CB . 25038 1 357 . 1 1 33 33 ALA N N 15 116.819 0.000 . . . . . A 116 ALA N . 25038 1 358 . 1 1 34 34 LEU H H 1 7.827 0.000 . . . . . A 117 LEU H . 25038 1 359 . 1 1 34 34 LEU HA H 1 5.046 0.000 . . . . . A 117 LEU HA . 25038 1 360 . 1 1 34 34 LEU HB2 H 1 2.051 0.000 . . . . . A 117 LEU HB2 . 25038 1 361 . 1 1 34 34 LEU HB3 H 1 1.905 0.000 . . . . . A 117 LEU HB3 . 25038 1 362 . 1 1 34 34 LEU HG H 1 1.938 0.000 . . . . . A 117 LEU HG . 25038 1 363 . 1 1 34 34 LEU HD11 H 1 0.924 0.000 . . . . . A 117 LEU HD11 . 25038 1 364 . 1 1 34 34 LEU HD12 H 1 0.924 0.000 . . . . . A 117 LEU HD12 . 25038 1 365 . 1 1 34 34 LEU HD13 H 1 0.924 0.000 . . . . . A 117 LEU HD13 . 25038 1 366 . 1 1 34 34 LEU HD21 H 1 1.115 0.000 . . . . . A 117 LEU HD21 . 25038 1 367 . 1 1 34 34 LEU HD22 H 1 1.115 0.000 . . . . . A 117 LEU HD22 . 25038 1 368 . 1 1 34 34 LEU HD23 H 1 1.115 0.000 . . . . . A 117 LEU HD23 . 25038 1 369 . 1 1 34 34 LEU CA C 13 55.269 0.000 . . . . . A 117 LEU CA . 25038 1 370 . 1 1 34 34 LEU CB C 13 43.448 0.006 . . . . . A 117 LEU CB . 25038 1 371 . 1 1 34 34 LEU CG C 13 27.956 0.000 . . . . . A 117 LEU CG . 25038 1 372 . 1 1 34 34 LEU CD1 C 13 27.052 0.000 . . . . . A 117 LEU CD1 . 25038 1 373 . 1 1 34 34 LEU CD2 C 13 23.470 0.000 . . . . . A 117 LEU CD2 . 25038 1 374 . 1 1 34 34 LEU N N 15 114.158 0.000 . . . . . A 117 LEU N . 25038 1 375 . 1 1 35 35 GLN H H 1 8.506 0.000 . . . . . A 118 GLN H . 25038 1 376 . 1 1 35 35 GLN HA H 1 4.682 0.000 . . . . . A 118 GLN HA . 25038 1 377 . 1 1 35 35 GLN HB2 H 1 2.279 0.000 . . . . . A 118 GLN HB2 . 25038 1 378 . 1 1 35 35 GLN HB3 H 1 2.218 0.000 . . . . . A 118 GLN HB3 . 25038 1 379 . 1 1 35 35 GLN HG2 H 1 2.624 0.000 . . . . . A 118 GLN HG2 . 25038 1 380 . 1 1 35 35 GLN HG3 H 1 2.268 0.000 . . . . . A 118 GLN HG3 . 25038 1 381 . 1 1 35 35 GLN HE21 H 1 7.424 0.000 . . . . . A 118 GLN HE21 . 25038 1 382 . 1 1 35 35 GLN HE22 H 1 6.718 0.000 . . . . . A 118 GLN HE22 . 25038 1 383 . 1 1 35 35 GLN CA C 13 57.942 0.000 . . . . . A 118 GLN CA . 25038 1 384 . 1 1 35 35 GLN CB C 13 26.773 0.000 . . . . . A 118 GLN CB . 25038 1 385 . 1 1 35 35 GLN CG C 13 32.647 0.006 . . . . . A 118 GLN CG . 25038 1 386 . 1 1 35 35 GLN N N 15 118.824 0.000 . . . . . A 118 GLN N . 25038 1 387 . 1 1 35 35 GLN NE2 N 15 110.535 0.000 . . . . . A 118 GLN NE2 . 25038 1 388 . 1 1 36 36 GLU H H 1 7.928 0.000 . . . . . A 119 GLU H . 25038 1 389 . 1 1 36 36 GLU HA H 1 3.995 0.000 . . . . . A 119 GLU HA . 25038 1 390 . 1 1 36 36 GLU HB2 H 1 1.584 0.000 . . . . . A 119 GLU HB2 . 25038 1 391 . 1 1 36 36 GLU HB3 H 1 1.533 0.000 . . . . . A 119 GLU HB3 . 25038 1 392 . 1 1 36 36 GLU HG2 H 1 1.308 0.000 . . . . . A 119 GLU HG2 . 25038 1 393 . 1 1 36 36 GLU HG3 H 1 1.308 0.000 . . . . . A 119 GLU HG3 . 25038 1 394 . 1 1 36 36 GLU CA C 13 57.622 0.000 . . . . . A 119 GLU CA . 25038 1 395 . 1 1 36 36 GLU CB C 13 29.050 0.022 . . . . . A 119 GLU CB . 25038 1 396 . 1 1 36 36 GLU CG C 13 35.380 0.000 . . . . . A 119 GLU CG . 25038 1 397 . 1 1 36 36 GLU N N 15 117.865 0.000 . . . . . A 119 GLU N . 25038 1 398 . 1 1 37 37 PHE H H 1 7.791 0.000 . . . . . A 120 PHE H . 25038 1 399 . 1 1 37 37 PHE HA H 1 4.529 0.000 . . . . . A 120 PHE HA . 25038 1 400 . 1 1 37 37 PHE HB2 H 1 3.569 0.000 . . . . . A 120 PHE HB2 . 25038 1 401 . 1 1 37 37 PHE HB3 H 1 3.145 0.000 . . . . . A 120 PHE HB3 . 25038 1 402 . 1 1 37 37 PHE HD1 H 1 7.118 0.000 . . . . . A 120 PHE HD1 . 25038 1 403 . 1 1 37 37 PHE HD2 H 1 7.118 0.000 . . . . . A 120 PHE HD2 . 25038 1 404 . 1 1 37 37 PHE HE1 H 1 6.997 0.000 . . . . . A 120 PHE HE1 . 25038 1 405 . 1 1 37 37 PHE HE2 H 1 6.997 0.000 . . . . . A 120 PHE HE2 . 25038 1 406 . 1 1 37 37 PHE HZ H 1 6.488 0.000 . . . . . A 120 PHE HZ . 25038 1 407 . 1 1 37 37 PHE CA C 13 59.579 0.000 . . . . . A 120 PHE CA . 25038 1 408 . 1 1 37 37 PHE CB C 13 38.359 0.004 . . . . . A 120 PHE CB . 25038 1 409 . 1 1 37 37 PHE CD2 C 13 128.546 0.000 . . . . . A 120 PHE CD2 . 25038 1 410 . 1 1 37 37 PHE CE2 C 13 131.356 0.000 . . . . . A 120 PHE CE2 . 25038 1 411 . 1 1 37 37 PHE CZ C 13 129.725 0.000 . . . . . A 120 PHE CZ . 25038 1 412 . 1 1 37 37 PHE N N 15 118.581 0.000 . . . . . A 120 PHE N . 25038 1 413 . 1 1 38 38 GLY H H 1 7.475 0.000 . . . . . A 121 GLY H . 25038 1 414 . 1 1 38 38 GLY HA2 H 1 4.390 0.000 . . . . . A 121 GLY HA2 . 25038 1 415 . 1 1 38 38 GLY HA3 H 1 4.148 0.000 . . . . . A 121 GLY HA3 . 25038 1 416 . 1 1 38 38 GLY CA C 13 44.976 0.002 . . . . . A 121 GLY CA . 25038 1 417 . 1 1 38 38 GLY N N 15 107.714 0.000 . . . . . A 121 GLY N . 25038 1 418 . 1 1 39 39 PRO HA H 1 4.595 0.000 . . . . . A 122 PRO HA . 25038 1 419 . 1 1 39 39 PRO HB2 H 1 2.342 0.000 . . . . . A 122 PRO HB2 . 25038 1 420 . 1 1 39 39 PRO HB3 H 1 1.967 0.000 . . . . . A 122 PRO HB3 . 25038 1 421 . 1 1 39 39 PRO HG2 H 1 2.181 0.000 . . . . . A 122 PRO HG2 . 25038 1 422 . 1 1 39 39 PRO HG3 H 1 2.110 0.000 . . . . . A 122 PRO HG3 . 25038 1 423 . 1 1 39 39 PRO HD2 H 1 3.843 0.000 . . . . . A 122 PRO HD2 . 25038 1 424 . 1 1 39 39 PRO HD3 H 1 3.721 0.000 . . . . . A 122 PRO HD3 . 25038 1 425 . 1 1 39 39 PRO CA C 13 63.244 0.000 . . . . . A 122 PRO CA . 25038 1 426 . 1 1 39 39 PRO CB C 13 32.142 0.019 . . . . . A 122 PRO CB . 25038 1 427 . 1 1 39 39 PRO CG C 13 28.273 0.012 . . . . . A 122 PRO CG . 25038 1 428 . 1 1 39 39 PRO CD C 13 49.822 0.002 . . . . . A 122 PRO CD . 25038 1 429 . 1 1 40 40 ILE H H 1 8.653 0.000 . . . . . A 123 ILE H . 25038 1 430 . 1 1 40 40 ILE HA H 1 3.971 0.000 . . . . . A 123 ILE HA . 25038 1 431 . 1 1 40 40 ILE HB H 1 1.581 0.000 . . . . . A 123 ILE HB . 25038 1 432 . 1 1 40 40 ILE HG12 H 1 1.738 0.000 . . . . . A 123 ILE HG12 . 25038 1 433 . 1 1 40 40 ILE HG13 H 1 0.110 0.000 . . . . . A 123 ILE HG13 . 25038 1 434 . 1 1 40 40 ILE HG21 H 1 0.518 0.000 . . . . . A 123 ILE HG21 . 25038 1 435 . 1 1 40 40 ILE HG22 H 1 0.518 0.000 . . . . . A 123 ILE HG22 . 25038 1 436 . 1 1 40 40 ILE HG23 H 1 0.518 0.000 . . . . . A 123 ILE HG23 . 25038 1 437 . 1 1 40 40 ILE HD11 H 1 0.548 0.000 . . . . . A 123 ILE HD11 . 25038 1 438 . 1 1 40 40 ILE HD12 H 1 0.548 0.000 . . . . . A 123 ILE HD12 . 25038 1 439 . 1 1 40 40 ILE HD13 H 1 0.548 0.000 . . . . . A 123 ILE HD13 . 25038 1 440 . 1 1 40 40 ILE CA C 13 61.760 0.000 . . . . . A 123 ILE CA . 25038 1 441 . 1 1 40 40 ILE CB C 13 40.972 0.000 . . . . . A 123 ILE CB . 25038 1 442 . 1 1 40 40 ILE CG1 C 13 28.755 0.007 . . . . . A 123 ILE CG1 . 25038 1 443 . 1 1 40 40 ILE CG2 C 13 18.082 0.000 . . . . . A 123 ILE CG2 . 25038 1 444 . 1 1 40 40 ILE CD1 C 13 14.700 0.000 . . . . . A 123 ILE CD1 . 25038 1 445 . 1 1 40 40 ILE N N 15 125.208 0.000 . . . . . A 123 ILE N . 25038 1 446 . 1 1 41 41 SER H H 1 9.281 0.000 . . . . . A 124 SER H . 25038 1 447 . 1 1 41 41 SER HA H 1 4.651 0.000 . . . . . A 124 SER HA . 25038 1 448 . 1 1 41 41 SER HB2 H 1 3.693 0.000 . . . . . A 124 SER HB2 . 25038 1 449 . 1 1 41 41 SER HB3 H 1 3.640 0.000 . . . . . A 124 SER HB3 . 25038 1 450 . 1 1 41 41 SER CA C 13 59.320 0.000 . . . . . A 124 SER CA . 25038 1 451 . 1 1 41 41 SER CB C 13 64.823 0.007 . . . . . A 124 SER CB . 25038 1 452 . 1 1 41 41 SER N N 15 122.827 0.000 . . . . . A 124 SER N . 25038 1 453 . 1 1 42 42 TYR H H 1 7.947 0.000 . . . . . A 125 TYR H . 25038 1 454 . 1 1 42 42 TYR HA H 1 4.610 0.000 . . . . . A 125 TYR HA . 25038 1 455 . 1 1 42 42 TYR HB2 H 1 3.020 0.000 . . . . . A 125 TYR HB2 . 25038 1 456 . 1 1 42 42 TYR HB3 H 1 2.546 0.000 . . . . . A 125 TYR HB3 . 25038 1 457 . 1 1 42 42 TYR HD1 H 1 6.998 0.000 . . . . . A 125 TYR HD1 . 25038 1 458 . 1 1 42 42 TYR HD2 H 1 6.998 0.000 . . . . . A 125 TYR HD2 . 25038 1 459 . 1 1 42 42 TYR HE1 H 1 6.757 0.000 . . . . . A 125 TYR HE1 . 25038 1 460 . 1 1 42 42 TYR HE2 H 1 6.757 0.000 . . . . . A 125 TYR HE2 . 25038 1 461 . 1 1 42 42 TYR CA C 13 59.112 0.000 . . . . . A 125 TYR CA . 25038 1 462 . 1 1 42 42 TYR CB C 13 42.865 0.002 . . . . . A 125 TYR CB . 25038 1 463 . 1 1 42 42 TYR CD1 C 13 133.019 0.000 . . . . . A 125 TYR CD1 . 25038 1 464 . 1 1 42 42 TYR CE1 C 13 118.237 0.000 . . . . . A 125 TYR CE1 . 25038 1 465 . 1 1 42 42 TYR N N 15 121.148 0.000 . . . . . A 125 TYR N . 25038 1 466 . 1 1 43 43 VAL H H 1 7.443 0.000 . . . . . A 126 VAL H . 25038 1 467 . 1 1 43 43 VAL HA H 1 4.749 0.000 . . . . . A 126 VAL HA . 25038 1 468 . 1 1 43 43 VAL HB H 1 1.773 0.000 . . . . . A 126 VAL HB . 25038 1 469 . 1 1 43 43 VAL HG11 H 1 0.812 0.000 . . . . . A 126 VAL HG11 . 25038 1 470 . 1 1 43 43 VAL HG12 H 1 0.812 0.000 . . . . . A 126 VAL HG12 . 25038 1 471 . 1 1 43 43 VAL HG13 H 1 0.812 0.000 . . . . . A 126 VAL HG13 . 25038 1 472 . 1 1 43 43 VAL HG21 H 1 0.768 0.000 . . . . . A 126 VAL HG21 . 25038 1 473 . 1 1 43 43 VAL HG22 H 1 0.768 0.000 . . . . . A 126 VAL HG22 . 25038 1 474 . 1 1 43 43 VAL HG23 H 1 0.768 0.000 . . . . . A 126 VAL HG23 . 25038 1 475 . 1 1 43 43 VAL CA C 13 60.531 0.000 . . . . . A 126 VAL CA . 25038 1 476 . 1 1 43 43 VAL CB C 13 35.693 0.000 . . . . . A 126 VAL CB . 25038 1 477 . 1 1 43 43 VAL CG1 C 13 22.108 0.000 . . . . . A 126 VAL CG1 . 25038 1 478 . 1 1 43 43 VAL CG2 C 13 22.002 0.000 . . . . . A 126 VAL CG2 . 25038 1 479 . 1 1 43 43 VAL N N 15 123.893 0.000 . . . . . A 126 VAL N . 25038 1 480 . 1 1 44 44 VAL H H 1 8.917 0.000 . . . . . A 127 VAL H . 25038 1 481 . 1 1 44 44 VAL HA H 1 4.454 0.000 . . . . . A 127 VAL HA . 25038 1 482 . 1 1 44 44 VAL HB H 1 2.013 0.000 . . . . . A 127 VAL HB . 25038 1 483 . 1 1 44 44 VAL HG11 H 1 1.095 0.000 . . . . . A 127 VAL HG11 . 25038 1 484 . 1 1 44 44 VAL HG12 H 1 1.095 0.000 . . . . . A 127 VAL HG12 . 25038 1 485 . 1 1 44 44 VAL HG13 H 1 1.095 0.000 . . . . . A 127 VAL HG13 . 25038 1 486 . 1 1 44 44 VAL HG21 H 1 1.039 0.000 . . . . . A 127 VAL HG21 . 25038 1 487 . 1 1 44 44 VAL HG22 H 1 1.039 0.000 . . . . . A 127 VAL HG22 . 25038 1 488 . 1 1 44 44 VAL HG23 H 1 1.039 0.000 . . . . . A 127 VAL HG23 . 25038 1 489 . 1 1 44 44 VAL CA C 13 61.115 0.000 . . . . . A 127 VAL CA . 25038 1 490 . 1 1 44 44 VAL CB C 13 35.840 0.000 . . . . . A 127 VAL CB . 25038 1 491 . 1 1 44 44 VAL CG1 C 13 22.157 0.000 . . . . . A 127 VAL CG1 . 25038 1 492 . 1 1 44 44 VAL CG2 C 13 21.254 0.000 . . . . . A 127 VAL CG2 . 25038 1 493 . 1 1 44 44 VAL N N 15 123.239 0.000 . . . . . A 127 VAL N . 25038 1 494 . 1 1 45 45 VAL H H 1 8.841 0.000 . . . . . A 128 VAL H . 25038 1 495 . 1 1 45 45 VAL HA H 1 4.261 0.000 . . . . . A 128 VAL HA . 25038 1 496 . 1 1 45 45 VAL HB H 1 2.022 0.000 . . . . . A 128 VAL HB . 25038 1 497 . 1 1 45 45 VAL HG11 H 1 0.835 0.000 . . . . . A 128 VAL HG11 . 25038 1 498 . 1 1 45 45 VAL HG12 H 1 0.835 0.000 . . . . . A 128 VAL HG12 . 25038 1 499 . 1 1 45 45 VAL HG13 H 1 0.835 0.000 . . . . . A 128 VAL HG13 . 25038 1 500 . 1 1 45 45 VAL HG21 H 1 0.763 0.000 . . . . . A 128 VAL HG21 . 25038 1 501 . 1 1 45 45 VAL HG22 H 1 0.763 0.000 . . . . . A 128 VAL HG22 . 25038 1 502 . 1 1 45 45 VAL HG23 H 1 0.763 0.000 . . . . . A 128 VAL HG23 . 25038 1 503 . 1 1 45 45 VAL CA C 13 61.668 0.000 . . . . . A 128 VAL CA . 25038 1 504 . 1 1 45 45 VAL CB C 13 33.172 0.000 . . . . . A 128 VAL CB . 25038 1 505 . 1 1 45 45 VAL CG1 C 13 21.683 0.000 . . . . . A 128 VAL CG1 . 25038 1 506 . 1 1 45 45 VAL CG2 C 13 21.743 0.000 . . . . . A 128 VAL CG2 . 25038 1 507 . 1 1 45 45 VAL N N 15 125.271 0.000 . . . . . A 128 VAL N . 25038 1 508 . 1 1 46 46 MET H H 1 8.705 0.000 . . . . . A 129 MET H . 25038 1 509 . 1 1 46 46 MET HB2 H 1 2.688 0.000 . . . . . A 129 MET HB2 . 25038 1 510 . 1 1 46 46 MET HB3 H 1 2.339 0.000 . . . . . A 129 MET HB3 . 25038 1 511 . 1 1 46 46 MET HE1 H 1 2.076 0.000 . . . . . A 129 MET HE1 . 25038 1 512 . 1 1 46 46 MET HE2 H 1 2.076 0.000 . . . . . A 129 MET HE2 . 25038 1 513 . 1 1 46 46 MET HE3 H 1 2.076 0.000 . . . . . A 129 MET HE3 . 25038 1 514 . 1 1 46 46 MET CB C 13 32.578 0.010 . . . . . A 129 MET CB . 25038 1 515 . 1 1 46 46 MET CE C 13 18.062 0.000 . . . . . A 129 MET CE . 25038 1 516 . 1 1 46 46 MET N N 15 125.802 0.000 . . . . . A 129 MET N . 25038 1 517 . 1 1 47 47 PRO HA H 1 4.316 0.000 . . . . . A 130 PRO HA . 25038 1 518 . 1 1 47 47 PRO HB2 H 1 2.545 0.000 . . . . . A 130 PRO HB2 . 25038 1 519 . 1 1 47 47 PRO HB3 H 1 2.085 0.000 . . . . . A 130 PRO HB3 . 25038 1 520 . 1 1 47 47 PRO HD2 H 1 3.965 0.000 . . . . . A 130 PRO HD2 . 25038 1 521 . 1 1 47 47 PRO HD3 H 1 3.796 0.000 . . . . . A 130 PRO HD3 . 25038 1 522 . 1 1 47 47 PRO CA C 13 65.571 0.000 . . . . . A 130 PRO CA . 25038 1 523 . 1 1 47 47 PRO CB C 13 32.551 0.027 . . . . . A 130 PRO CB . 25038 1 524 . 1 1 47 47 PRO CD C 13 51.328 0.008 . . . . . A 130 PRO CD . 25038 1 525 . 1 1 48 48 LYS HA H 1 4.202 0.000 . . . . . A 131 LYS HA . 25038 1 526 . 1 1 48 48 LYS CA C 13 58.686 0.000 . . . . . A 131 LYS CA . 25038 1 527 . 1 1 49 49 LYS H H 1 7.347 0.000 . . . . . A 132 LYS H . 25038 1 528 . 1 1 49 49 LYS HA H 1 4.503 0.000 . . . . . A 132 LYS HA . 25038 1 529 . 1 1 49 49 LYS HG2 H 1 1.584 0.000 . . . . . A 132 LYS HG2 . 25038 1 530 . 1 1 49 49 LYS HG3 H 1 1.501 0.000 . . . . . A 132 LYS HG3 . 25038 1 531 . 1 1 49 49 LYS CA C 13 54.749 0.000 . . . . . A 132 LYS CA . 25038 1 532 . 1 1 49 49 LYS CG C 13 25.684 0.006 . . . . . A 132 LYS CG . 25038 1 533 . 1 1 49 49 LYS N N 15 114.460 0.000 . . . . . A 132 LYS N . 25038 1 534 . 1 1 50 50 ARG H H 1 8.089 0.000 . . . . . A 133 ARG H . 25038 1 535 . 1 1 50 50 ARG HA H 1 3.941 0.000 . . . . . A 133 ARG HA . 25038 1 536 . 1 1 50 50 ARG HB2 H 1 1.591 0.000 . . . . . A 133 ARG HB2 . 25038 1 537 . 1 1 50 50 ARG HB3 H 1 1.522 0.000 . . . . . A 133 ARG HB3 . 25038 1 538 . 1 1 50 50 ARG HG2 H 1 2.361 0.000 . . . . . A 133 ARG HG2 . 25038 1 539 . 1 1 50 50 ARG HG3 H 1 2.107 0.000 . . . . . A 133 ARG HG3 . 25038 1 540 . 1 1 50 50 ARG HD2 H 1 3.299 0.000 . . . . . A 133 ARG HD2 . 25038 1 541 . 1 1 50 50 ARG HD3 H 1 3.201 0.000 . . . . . A 133 ARG HD3 . 25038 1 542 . 1 1 50 50 ARG HE H 1 7.419 0.000 . . . . . A 133 ARG HE . 25038 1 543 . 1 1 50 50 ARG CA C 13 57.509 0.000 . . . . . A 133 ARG CA . 25038 1 544 . 1 1 50 50 ARG CB C 13 27.806 0.003 . . . . . A 133 ARG CB . 25038 1 545 . 1 1 50 50 ARG CG C 13 26.484 0.013 . . . . . A 133 ARG CG . 25038 1 546 . 1 1 50 50 ARG CD C 13 43.549 0.004 . . . . . A 133 ARG CD . 25038 1 547 . 1 1 50 50 ARG N N 15 116.946 0.000 . . . . . A 133 ARG N . 25038 1 548 . 1 1 50 50 ARG NE N 15 86.396 0.000 . . . . . A 133 ARG NE . 25038 1 549 . 1 1 51 51 GLN H H 1 7.355 0.000 . . . . . A 134 GLN H . 25038 1 550 . 1 1 51 51 GLN HA H 1 5.410 0.000 . . . . . A 134 GLN HA . 25038 1 551 . 1 1 51 51 GLN HB2 H 1 2.435 0.000 . . . . . A 134 GLN HB2 . 25038 1 552 . 1 1 51 51 GLN HB3 H 1 1.828 0.000 . . . . . A 134 GLN HB3 . 25038 1 553 . 1 1 51 51 GLN HG2 H 1 2.827 0.000 . . . . . A 134 GLN HG2 . 25038 1 554 . 1 1 51 51 GLN HG3 H 1 2.613 0.000 . . . . . A 134 GLN HG3 . 25038 1 555 . 1 1 51 51 GLN HE21 H 1 7.593 0.000 . . . . . A 134 GLN HE21 . 25038 1 556 . 1 1 51 51 GLN HE22 H 1 6.903 0.000 . . . . . A 134 GLN HE22 . 25038 1 557 . 1 1 51 51 GLN CA C 13 53.558 0.000 . . . . . A 134 GLN CA . 25038 1 558 . 1 1 51 51 GLN CB C 13 35.763 0.057 . . . . . A 134 GLN CB . 25038 1 559 . 1 1 51 51 GLN CG C 13 34.145 0.006 . . . . . A 134 GLN CG . 25038 1 560 . 1 1 51 51 GLN N N 15 113.755 0.000 . . . . . A 134 GLN N . 25038 1 561 . 1 1 51 51 GLN NE2 N 15 112.907 0.000 . . . . . A 134 GLN NE2 . 25038 1 562 . 1 1 52 52 ALA H H 1 8.985 0.000 . . . . . A 135 ALA H . 25038 1 563 . 1 1 52 52 ALA HA H 1 5.095 0.000 . . . . . A 135 ALA HA . 25038 1 564 . 1 1 52 52 ALA HB1 H 1 1.301 0.000 . . . . . A 135 ALA HB1 . 25038 1 565 . 1 1 52 52 ALA HB2 H 1 1.301 0.000 . . . . . A 135 ALA HB2 . 25038 1 566 . 1 1 52 52 ALA HB3 H 1 1.301 0.000 . . . . . A 135 ALA HB3 . 25038 1 567 . 1 1 52 52 ALA CA C 13 51.360 0.000 . . . . . A 135 ALA CA . 25038 1 568 . 1 1 52 52 ALA CB C 13 24.882 0.000 . . . . . A 135 ALA CB . 25038 1 569 . 1 1 52 52 ALA N N 15 119.434 0.000 . . . . . A 135 ALA N . 25038 1 570 . 1 1 53 53 LEU H H 1 9.024 0.000 . . . . . A 136 LEU H . 25038 1 571 . 1 1 53 53 LEU HA H 1 5.473 0.000 . . . . . A 136 LEU HA . 25038 1 572 . 1 1 53 53 LEU HB2 H 1 1.621 0.000 . . . . . A 136 LEU HB2 . 25038 1 573 . 1 1 53 53 LEU HB3 H 1 1.203 0.000 . . . . . A 136 LEU HB3 . 25038 1 574 . 1 1 53 53 LEU HD11 H 1 0.857 0.000 . . . . . A 136 LEU HD11 . 25038 1 575 . 1 1 53 53 LEU HD12 H 1 0.857 0.000 . . . . . A 136 LEU HD12 . 25038 1 576 . 1 1 53 53 LEU HD13 H 1 0.857 0.000 . . . . . A 136 LEU HD13 . 25038 1 577 . 1 1 53 53 LEU HD21 H 1 1.095 0.000 . . . . . A 136 LEU HD21 . 25038 1 578 . 1 1 53 53 LEU HD22 H 1 1.095 0.000 . . . . . A 136 LEU HD22 . 25038 1 579 . 1 1 53 53 LEU HD23 H 1 1.095 0.000 . . . . . A 136 LEU HD23 . 25038 1 580 . 1 1 53 53 LEU CA C 13 53.880 0.000 . . . . . A 136 LEU CA . 25038 1 581 . 1 1 53 53 LEU CB C 13 46.228 0.010 . . . . . A 136 LEU CB . 25038 1 582 . 1 1 53 53 LEU CD1 C 13 26.341 0.000 . . . . . A 136 LEU CD1 . 25038 1 583 . 1 1 53 53 LEU CD2 C 13 22.157 0.000 . . . . . A 136 LEU CD2 . 25038 1 584 . 1 1 53 53 LEU N N 15 119.835 0.000 . . . . . A 136 LEU N . 25038 1 585 . 1 1 54 54 VAL H H 1 8.870 0.000 . . . . . A 137 VAL H . 25038 1 586 . 1 1 54 54 VAL HA H 1 4.418 0.000 . . . . . A 137 VAL HA . 25038 1 587 . 1 1 54 54 VAL HB H 1 1.800 0.000 . . . . . A 137 VAL HB . 25038 1 588 . 1 1 54 54 VAL HG11 H 1 0.768 0.000 . . . . . A 137 VAL HG11 . 25038 1 589 . 1 1 54 54 VAL HG12 H 1 0.768 0.000 . . . . . A 137 VAL HG12 . 25038 1 590 . 1 1 54 54 VAL HG13 H 1 0.768 0.000 . . . . . A 137 VAL HG13 . 25038 1 591 . 1 1 54 54 VAL HG21 H 1 0.348 0.000 . . . . . A 137 VAL HG21 . 25038 1 592 . 1 1 54 54 VAL HG22 H 1 0.348 0.000 . . . . . A 137 VAL HG22 . 25038 1 593 . 1 1 54 54 VAL HG23 H 1 0.348 0.000 . . . . . A 137 VAL HG23 . 25038 1 594 . 1 1 54 54 VAL CA C 13 61.158 0.000 . . . . . A 137 VAL CA . 25038 1 595 . 1 1 54 54 VAL CB C 13 34.897 0.000 . . . . . A 137 VAL CB . 25038 1 596 . 1 1 54 54 VAL CG1 C 13 21.908 0.000 . . . . . A 137 VAL CG1 . 25038 1 597 . 1 1 54 54 VAL CG2 C 13 21.102 0.000 . . . . . A 137 VAL CG2 . 25038 1 598 . 1 1 54 54 VAL N N 15 121.279 0.000 . . . . . A 137 VAL N . 25038 1 599 . 1 1 55 55 GLU H H 1 9.263 0.000 . . . . . A 138 GLU H . 25038 1 600 . 1 1 55 55 GLU HA H 1 5.008 0.000 . . . . . A 138 GLU HA . 25038 1 601 . 1 1 55 55 GLU HB2 H 1 2.167 0.000 . . . . . A 138 GLU HB2 . 25038 1 602 . 1 1 55 55 GLU HB3 H 1 2.006 0.000 . . . . . A 138 GLU HB3 . 25038 1 603 . 1 1 55 55 GLU HG2 H 1 2.186 0.000 . . . . . A 138 GLU HG2 . 25038 1 604 . 1 1 55 55 GLU HG3 H 1 2.046 0.000 . . . . . A 138 GLU HG3 . 25038 1 605 . 1 1 55 55 GLU CA C 13 54.460 0.000 . . . . . A 138 GLU CA . 25038 1 606 . 1 1 55 55 GLU CB C 13 32.984 0.000 . . . . . A 138 GLU CB . 25038 1 607 . 1 1 55 55 GLU CG C 13 36.765 0.000 . . . . . A 138 GLU CG . 25038 1 608 . 1 1 55 55 GLU N N 15 129.089 0.000 . . . . . A 138 GLU N . 25038 1 609 . 1 1 56 56 PHE H H 1 9.440 0.000 . . . . . A 139 PHE H . 25038 1 610 . 1 1 56 56 PHE HA H 1 4.613 0.000 . . . . . A 139 PHE HA . 25038 1 611 . 1 1 56 56 PHE HB2 H 1 3.933 0.000 . . . . . A 139 PHE HB2 . 25038 1 612 . 1 1 56 56 PHE HB3 H 1 3.206 0.000 . . . . . A 139 PHE HB3 . 25038 1 613 . 1 1 56 56 PHE HD1 H 1 7.336 0.000 . . . . . A 139 PHE HD1 . 25038 1 614 . 1 1 56 56 PHE HD2 H 1 7.336 0.000 . . . . . A 139 PHE HD2 . 25038 1 615 . 1 1 56 56 PHE HE1 H 1 7.246 0.000 . . . . . A 139 PHE HE1 . 25038 1 616 . 1 1 56 56 PHE HE2 H 1 7.246 0.000 . . . . . A 139 PHE HE2 . 25038 1 617 . 1 1 56 56 PHE HZ H 1 7.390 0.000 . . . . . A 139 PHE HZ . 25038 1 618 . 1 1 56 56 PHE CA C 13 60.037 0.000 . . . . . A 139 PHE CA . 25038 1 619 . 1 1 56 56 PHE CB C 13 39.579 0.036 . . . . . A 139 PHE CB . 25038 1 620 . 1 1 56 56 PHE CD1 C 13 131.938 0.000 . . . . . A 139 PHE CD1 . 25038 1 621 . 1 1 56 56 PHE CE1 C 13 131.094 0.000 . . . . . A 139 PHE CE1 . 25038 1 622 . 1 1 56 56 PHE CZ C 13 131.232 0.000 . . . . . A 139 PHE CZ . 25038 1 623 . 1 1 56 56 PHE N N 15 129.049 0.000 . . . . . A 139 PHE N . 25038 1 624 . 1 1 57 57 GLU H H 1 8.695 0.000 . . . . . A 140 GLU H . 25038 1 625 . 1 1 57 57 GLU HA H 1 4.042 0.000 . . . . . A 140 GLU HA . 25038 1 626 . 1 1 57 57 GLU HB2 H 1 2.127 0.000 . . . . . A 140 GLU HB2 . 25038 1 627 . 1 1 57 57 GLU HB3 H 1 1.947 0.000 . . . . . A 140 GLU HB3 . 25038 1 628 . 1 1 57 57 GLU HG2 H 1 2.267 0.000 . . . . . A 140 GLU HG2 . 25038 1 629 . 1 1 57 57 GLU HG3 H 1 2.228 0.000 . . . . . A 140 GLU HG3 . 25038 1 630 . 1 1 57 57 GLU CA C 13 59.264 0.000 . . . . . A 140 GLU CA . 25038 1 631 . 1 1 57 57 GLU CB C 13 30.871 0.006 . . . . . A 140 GLU CB . 25038 1 632 . 1 1 57 57 GLU CG C 13 37.157 0.008 . . . . . A 140 GLU CG . 25038 1 633 . 1 1 57 57 GLU N N 15 119.820 0.000 . . . . . A 140 GLU N . 25038 1 634 . 1 1 58 58 ASP H H 1 8.577 0.000 . . . . . A 141 ASP H . 25038 1 635 . 1 1 58 58 ASP HA H 1 4.955 0.000 . . . . . A 141 ASP HA . 25038 1 636 . 1 1 58 58 ASP HB2 H 1 2.879 0.000 . . . . . A 141 ASP HB2 . 25038 1 637 . 1 1 58 58 ASP HB3 H 1 2.804 0.000 . . . . . A 141 ASP HB3 . 25038 1 638 . 1 1 58 58 ASP CA C 13 52.439 0.000 . . . . . A 141 ASP CA . 25038 1 639 . 1 1 58 58 ASP CB C 13 45.696 0.004 . . . . . A 141 ASP CB . 25038 1 640 . 1 1 58 58 ASP N N 15 115.192 0.000 . . . . . A 141 ASP N . 25038 1 641 . 1 1 59 59 VAL H H 1 8.570 0.000 . . . . . A 142 VAL H . 25038 1 642 . 1 1 59 59 VAL HA H 1 3.805 0.000 . . . . . A 142 VAL HA . 25038 1 643 . 1 1 59 59 VAL HB H 1 2.123 0.000 . . . . . A 142 VAL HB . 25038 1 644 . 1 1 59 59 VAL HG11 H 1 0.925 0.000 . . . . . A 142 VAL HG11 . 25038 1 645 . 1 1 59 59 VAL HG12 H 1 0.925 0.000 . . . . . A 142 VAL HG12 . 25038 1 646 . 1 1 59 59 VAL HG13 H 1 0.925 0.000 . . . . . A 142 VAL HG13 . 25038 1 647 . 1 1 59 59 VAL HG21 H 1 0.976 0.000 . . . . . A 142 VAL HG21 . 25038 1 648 . 1 1 59 59 VAL HG22 H 1 0.976 0.000 . . . . . A 142 VAL HG22 . 25038 1 649 . 1 1 59 59 VAL HG23 H 1 0.976 0.000 . . . . . A 142 VAL HG23 . 25038 1 650 . 1 1 59 59 VAL CA C 13 64.988 0.000 . . . . . A 142 VAL CA . 25038 1 651 . 1 1 59 59 VAL CB C 13 32.146 0.000 . . . . . A 142 VAL CB . 25038 1 652 . 1 1 59 59 VAL CG1 C 13 21.999 0.000 . . . . . A 142 VAL CG1 . 25038 1 653 . 1 1 59 59 VAL CG2 C 13 20.244 0.000 . . . . . A 142 VAL CG2 . 25038 1 654 . 1 1 59 59 VAL N N 15 122.159 0.000 . . . . . A 142 VAL N . 25038 1 655 . 1 1 60 60 LEU H H 1 8.495 0.000 . . . . . A 143 LEU H . 25038 1 656 . 1 1 60 60 LEU HA H 1 4.016 0.000 . . . . . A 143 LEU HA . 25038 1 657 . 1 1 60 60 LEU HB2 H 1 1.776 0.000 . . . . . A 143 LEU HB2 . 25038 1 658 . 1 1 60 60 LEU HB3 H 1 1.672 0.000 . . . . . A 143 LEU HB3 . 25038 1 659 . 1 1 60 60 LEU HG H 1 1.772 0.000 . . . . . A 143 LEU HG . 25038 1 660 . 1 1 60 60 LEU HD11 H 1 1.011 0.000 . . . . . A 143 LEU HD11 . 25038 1 661 . 1 1 60 60 LEU HD12 H 1 1.011 0.000 . . . . . A 143 LEU HD12 . 25038 1 662 . 1 1 60 60 LEU HD13 H 1 1.011 0.000 . . . . . A 143 LEU HD13 . 25038 1 663 . 1 1 60 60 LEU HD21 H 1 0.968 0.000 . . . . . A 143 LEU HD21 . 25038 1 664 . 1 1 60 60 LEU HD22 H 1 0.968 0.000 . . . . . A 143 LEU HD22 . 25038 1 665 . 1 1 60 60 LEU HD23 H 1 0.968 0.000 . . . . . A 143 LEU HD23 . 25038 1 666 . 1 1 60 60 LEU CA C 13 58.403 0.000 . . . . . A 143 LEU CA . 25038 1 667 . 1 1 60 60 LEU CB C 13 41.287 0.007 . . . . . A 143 LEU CB . 25038 1 668 . 1 1 60 60 LEU CG C 13 27.255 0.000 . . . . . A 143 LEU CG . 25038 1 669 . 1 1 60 60 LEU CD1 C 13 24.457 0.000 . . . . . A 143 LEU CD1 . 25038 1 670 . 1 1 60 60 LEU CD2 C 13 24.121 0.000 . . . . . A 143 LEU CD2 . 25038 1 671 . 1 1 60 60 LEU N N 15 121.632 0.000 . . . . . A 143 LEU N . 25038 1 672 . 1 1 61 61 GLY H H 1 7.701 0.000 . . . . . A 144 GLY H . 25038 1 673 . 1 1 61 61 GLY HA2 H 1 3.756 0.000 . . . . . A 144 GLY HA2 . 25038 1 674 . 1 1 61 61 GLY HA3 H 1 3.497 0.000 . . . . . A 144 GLY HA3 . 25038 1 675 . 1 1 61 61 GLY CA C 13 47.195 0.004 . . . . . A 144 GLY CA . 25038 1 676 . 1 1 61 61 GLY N N 15 105.889 0.000 . . . . . A 144 GLY N . 25038 1 677 . 1 1 62 62 ALA H H 1 6.226 0.000 . . . . . A 145 ALA H . 25038 1 678 . 1 1 62 62 ALA HA H 1 3.330 0.000 . . . . . A 145 ALA HA . 25038 1 679 . 1 1 62 62 ALA HB1 H 1 1.823 0.000 . . . . . A 145 ALA HB1 . 25038 1 680 . 1 1 62 62 ALA HB2 H 1 1.823 0.000 . . . . . A 145 ALA HB2 . 25038 1 681 . 1 1 62 62 ALA HB3 H 1 1.823 0.000 . . . . . A 145 ALA HB3 . 25038 1 682 . 1 1 62 62 ALA CA C 13 54.949 0.000 . . . . . A 145 ALA CA . 25038 1 683 . 1 1 62 62 ALA CB C 13 20.889 0.000 . . . . . A 145 ALA CB . 25038 1 684 . 1 1 62 62 ALA N N 15 122.148 0.000 . . . . . A 145 ALA N . 25038 1 685 . 1 1 63 63 CYS H H 1 8.716 0.000 . . . . . A 146 CYS H . 25038 1 686 . 1 1 63 63 CYS HA H 1 4.660 0.000 . . . . . A 146 CYS HA . 25038 1 687 . 1 1 63 63 CYS HB2 H 1 3.002 0.000 . . . . . A 146 CYS HB2 . 25038 1 688 . 1 1 63 63 CYS HB3 H 1 2.943 0.000 . . . . . A 146 CYS HB3 . 25038 1 689 . 1 1 63 63 CYS CA C 13 61.174 0.000 . . . . . A 146 CYS CA . 25038 1 690 . 1 1 63 63 CYS CB C 13 26.955 0.002 . . . . . A 146 CYS CB . 25038 1 691 . 1 1 63 63 CYS N N 15 116.215 0.000 . . . . . A 146 CYS N . 25038 1 692 . 1 1 64 64 ASN H H 1 8.351 0.000 . . . . . A 147 ASN H . 25038 1 693 . 1 1 64 64 ASN HA H 1 4.466 0.000 . . . . . A 147 ASN HA . 25038 1 694 . 1 1 64 64 ASN HB2 H 1 3.377 0.000 . . . . . A 147 ASN HB2 . 25038 1 695 . 1 1 64 64 ASN HB3 H 1 3.031 0.000 . . . . . A 147 ASN HB3 . 25038 1 696 . 1 1 64 64 ASN HD21 H 1 7.869 0.000 . . . . . A 147 ASN HD21 . 25038 1 697 . 1 1 64 64 ASN HD22 H 1 6.793 0.000 . . . . . A 147 ASN HD22 . 25038 1 698 . 1 1 64 64 ASN CA C 13 55.710 0.000 . . . . . A 147 ASN CA . 25038 1 699 . 1 1 64 64 ASN CB C 13 37.575 0.021 . . . . . A 147 ASN CB . 25038 1 700 . 1 1 64 64 ASN N N 15 118.561 0.000 . . . . . A 147 ASN N . 25038 1 701 . 1 1 64 64 ASN ND2 N 15 109.985 0.002 . . . . . A 147 ASN ND2 . 25038 1 702 . 1 1 65 65 ALA H H 1 7.462 0.000 . . . . . A 148 ALA H . 25038 1 703 . 1 1 65 65 ALA HA H 1 2.352 0.000 . . . . . A 148 ALA HA . 25038 1 704 . 1 1 65 65 ALA HB1 H 1 1.006 0.000 . . . . . A 148 ALA HB1 . 25038 1 705 . 1 1 65 65 ALA HB2 H 1 1.006 0.000 . . . . . A 148 ALA HB2 . 25038 1 706 . 1 1 65 65 ALA HB3 H 1 1.006 0.000 . . . . . A 148 ALA HB3 . 25038 1 707 . 1 1 65 65 ALA CA C 13 54.906 0.000 . . . . . A 148 ALA CA . 25038 1 708 . 1 1 65 65 ALA CB C 13 18.140 0.000 . . . . . A 148 ALA CB . 25038 1 709 . 1 1 65 65 ALA N N 15 123.316 0.000 . . . . . A 148 ALA N . 25038 1 710 . 1 1 66 66 VAL H H 1 8.345 0.000 . . . . . A 149 VAL H . 25038 1 711 . 1 1 66 66 VAL HA H 1 3.157 0.000 . . . . . A 149 VAL HA . 25038 1 712 . 1 1 66 66 VAL HB H 1 1.753 0.000 . . . . . A 149 VAL HB . 25038 1 713 . 1 1 66 66 VAL HG11 H 1 0.155 0.000 . . . . . A 149 VAL HG11 . 25038 1 714 . 1 1 66 66 VAL HG12 H 1 0.155 0.000 . . . . . A 149 VAL HG12 . 25038 1 715 . 1 1 66 66 VAL HG13 H 1 0.155 0.000 . . . . . A 149 VAL HG13 . 25038 1 716 . 1 1 66 66 VAL HG21 H 1 0.609 0.000 . . . . . A 149 VAL HG21 . 25038 1 717 . 1 1 66 66 VAL HG22 H 1 0.609 0.000 . . . . . A 149 VAL HG22 . 25038 1 718 . 1 1 66 66 VAL HG23 H 1 0.609 0.000 . . . . . A 149 VAL HG23 . 25038 1 719 . 1 1 66 66 VAL CA C 13 67.158 0.000 . . . . . A 149 VAL CA . 25038 1 720 . 1 1 66 66 VAL CB C 13 31.433 0.000 . . . . . A 149 VAL CB . 25038 1 721 . 1 1 66 66 VAL CG1 C 13 23.592 0.000 . . . . . A 149 VAL CG1 . 25038 1 722 . 1 1 66 66 VAL CG2 C 13 20.997 0.000 . . . . . A 149 VAL CG2 . 25038 1 723 . 1 1 66 66 VAL N N 15 117.650 0.000 . . . . . A 149 VAL N . 25038 1 724 . 1 1 67 67 ASN H H 1 8.855 0.000 . . . . . A 150 ASN H . 25038 1 725 . 1 1 67 67 ASN HA H 1 4.518 0.000 . . . . . A 150 ASN HA . 25038 1 726 . 1 1 67 67 ASN HB2 H 1 2.744 0.000 . . . . . A 150 ASN HB2 . 25038 1 727 . 1 1 67 67 ASN HB3 H 1 2.645 0.000 . . . . . A 150 ASN HB3 . 25038 1 728 . 1 1 67 67 ASN CA C 13 56.019 0.000 . . . . . A 150 ASN CA . 25038 1 729 . 1 1 67 67 ASN CB C 13 41.264 0.027 . . . . . A 150 ASN CB . 25038 1 730 . 1 1 67 67 ASN N N 15 117.987 0.000 . . . . . A 150 ASN N . 25038 1 731 . 1 1 68 68 TYR H H 1 8.000 0.000 . . . . . A 151 TYR H . 25038 1 732 . 1 1 68 68 TYR HA H 1 4.195 0.000 . . . . . A 151 TYR HA . 25038 1 733 . 1 1 68 68 TYR HB2 H 1 3.263 0.000 . . . . . A 151 TYR HB2 . 25038 1 734 . 1 1 68 68 TYR HB3 H 1 2.928 0.000 . . . . . A 151 TYR HB3 . 25038 1 735 . 1 1 68 68 TYR HD1 H 1 7.074 0.000 . . . . . A 151 TYR HD1 . 25038 1 736 . 1 1 68 68 TYR HD2 H 1 7.074 0.000 . . . . . A 151 TYR HD2 . 25038 1 737 . 1 1 68 68 TYR HE1 H 1 6.807 0.000 . . . . . A 151 TYR HE1 . 25038 1 738 . 1 1 68 68 TYR HE2 H 1 6.807 0.000 . . . . . A 151 TYR HE2 . 25038 1 739 . 1 1 68 68 TYR CA C 13 62.179 0.000 . . . . . A 151 TYR CA . 25038 1 740 . 1 1 68 68 TYR CB C 13 39.295 0.053 . . . . . A 151 TYR CB . 25038 1 741 . 1 1 68 68 TYR CD2 C 13 133.974 0.000 . . . . . A 151 TYR CD2 . 25038 1 742 . 1 1 68 68 TYR CE2 C 13 118.648 0.000 . . . . . A 151 TYR CE2 . 25038 1 743 . 1 1 68 68 TYR N N 15 122.624 0.000 . . . . . A 151 TYR N . 25038 1 744 . 1 1 69 69 ALA H H 1 8.070 0.000 . . . . . A 152 ALA H . 25038 1 745 . 1 1 69 69 ALA HA H 1 4.540 0.000 . . . . . A 152 ALA HA . 25038 1 746 . 1 1 69 69 ALA HB1 H 1 1.559 0.000 . . . . . A 152 ALA HB1 . 25038 1 747 . 1 1 69 69 ALA HB2 H 1 1.559 0.000 . . . . . A 152 ALA HB2 . 25038 1 748 . 1 1 69 69 ALA HB3 H 1 1.559 0.000 . . . . . A 152 ALA HB3 . 25038 1 749 . 1 1 69 69 ALA CA C 13 52.702 0.000 . . . . . A 152 ALA CA . 25038 1 750 . 1 1 69 69 ALA CB C 13 18.676 0.000 . . . . . A 152 ALA CB . 25038 1 751 . 1 1 69 69 ALA N N 15 120.330 0.000 . . . . . A 152 ALA N . 25038 1 752 . 1 1 70 70 ALA H H 1 7.500 0.000 . . . . . A 153 ALA H . 25038 1 753 . 1 1 70 70 ALA HA H 1 4.138 0.000 . . . . . A 153 ALA HA . 25038 1 754 . 1 1 70 70 ALA HB1 H 1 1.484 0.000 . . . . . A 153 ALA HB1 . 25038 1 755 . 1 1 70 70 ALA HB2 H 1 1.484 0.000 . . . . . A 153 ALA HB2 . 25038 1 756 . 1 1 70 70 ALA HB3 H 1 1.484 0.000 . . . . . A 153 ALA HB3 . 25038 1 757 . 1 1 70 70 ALA CA C 13 55.003 0.000 . . . . . A 153 ALA CA . 25038 1 758 . 1 1 70 70 ALA CB C 13 18.465 0.000 . . . . . A 153 ALA CB . 25038 1 759 . 1 1 70 70 ALA N N 15 120.188 0.000 . . . . . A 153 ALA N . 25038 1 760 . 1 1 71 71 ASP H H 1 7.129 0.000 . . . . . A 154 ASP H . 25038 1 761 . 1 1 71 71 ASP HA H 1 4.919 0.000 . . . . . A 154 ASP HA . 25038 1 762 . 1 1 71 71 ASP CA C 13 54.040 0.000 . . . . . A 154 ASP CA . 25038 1 763 . 1 1 71 71 ASP N N 15 113.070 0.000 . . . . . A 154 ASP N . 25038 1 764 . 1 1 72 72 ASN H H 1 7.713 0.000 . . . . . A 155 ASN H . 25038 1 765 . 1 1 72 72 ASN HA H 1 4.778 0.000 . . . . . A 155 ASN HA . 25038 1 766 . 1 1 72 72 ASN HB2 H 1 2.141 0.000 . . . . . A 155 ASN HB2 . 25038 1 767 . 1 1 72 72 ASN HB3 H 1 1.679 0.000 . . . . . A 155 ASN HB3 . 25038 1 768 . 1 1 72 72 ASN CA C 13 52.150 0.000 . . . . . A 155 ASN CA . 25038 1 769 . 1 1 72 72 ASN CB C 13 42.477 0.002 . . . . . A 155 ASN CB . 25038 1 770 . 1 1 72 72 ASN N N 15 117.983 0.000 . . . . . A 155 ASN N . 25038 1 771 . 1 1 73 73 GLN H H 1 8.176 0.000 . . . . . A 156 GLN H . 25038 1 772 . 1 1 73 73 GLN HA H 1 4.409 0.000 . . . . . A 156 GLN HA . 25038 1 773 . 1 1 73 73 GLN HB2 H 1 1.952 0.000 . . . . . A 156 GLN HB2 . 25038 1 774 . 1 1 73 73 GLN HB3 H 1 1.708 0.000 . . . . . A 156 GLN HB3 . 25038 1 775 . 1 1 73 73 GLN HG2 H 1 2.061 0.000 . . . . . A 156 GLN HG2 . 25038 1 776 . 1 1 73 73 GLN HG3 H 1 1.860 0.000 . . . . . A 156 GLN HG3 . 25038 1 777 . 1 1 73 73 GLN HE21 H 1 7.548 0.000 . . . . . A 156 GLN HE21 . 25038 1 778 . 1 1 73 73 GLN HE22 H 1 6.360 0.000 . . . . . A 156 GLN HE22 . 25038 1 779 . 1 1 73 73 GLN CA C 13 55.410 0.000 . . . . . A 156 GLN CA . 25038 1 780 . 1 1 73 73 GLN CB C 13 30.636 0.005 . . . . . A 156 GLN CB . 25038 1 781 . 1 1 73 73 GLN CG C 13 34.251 0.004 . . . . . A 156 GLN CG . 25038 1 782 . 1 1 73 73 GLN N N 15 117.303 0.000 . . . . . A 156 GLN N . 25038 1 783 . 1 1 73 73 GLN NE2 N 15 114.958 0.001 . . . . . A 156 GLN NE2 . 25038 1 784 . 1 1 74 74 ILE H H 1 8.918 0.000 . . . . . A 157 ILE H . 25038 1 785 . 1 1 74 74 ILE HA H 1 4.413 0.000 . . . . . A 157 ILE HA . 25038 1 786 . 1 1 74 74 ILE HB H 1 1.771 0.000 . . . . . A 157 ILE HB . 25038 1 787 . 1 1 74 74 ILE HG12 H 1 1.797 0.000 . . . . . A 157 ILE HG12 . 25038 1 788 . 1 1 74 74 ILE HG13 H 1 1.368 0.000 . . . . . A 157 ILE HG13 . 25038 1 789 . 1 1 74 74 ILE HG21 H 1 0.872 0.000 . . . . . A 157 ILE HG21 . 25038 1 790 . 1 1 74 74 ILE HG22 H 1 0.872 0.000 . . . . . A 157 ILE HG22 . 25038 1 791 . 1 1 74 74 ILE HG23 H 1 0.872 0.000 . . . . . A 157 ILE HG23 . 25038 1 792 . 1 1 74 74 ILE HD11 H 1 0.685 0.000 . . . . . A 157 ILE HD11 . 25038 1 793 . 1 1 74 74 ILE HD12 H 1 0.685 0.000 . . . . . A 157 ILE HD12 . 25038 1 794 . 1 1 74 74 ILE HD13 H 1 0.685 0.000 . . . . . A 157 ILE HD13 . 25038 1 795 . 1 1 74 74 ILE CA C 13 61.461 0.000 . . . . . A 157 ILE CA . 25038 1 796 . 1 1 74 74 ILE CB C 13 39.105 0.000 . . . . . A 157 ILE CB . 25038 1 797 . 1 1 74 74 ILE CG1 C 13 28.918 0.014 . . . . . A 157 ILE CG1 . 25038 1 798 . 1 1 74 74 ILE CG2 C 13 16.633 0.000 . . . . . A 157 ILE CG2 . 25038 1 799 . 1 1 74 74 ILE CD1 C 13 13.432 0.000 . . . . . A 157 ILE CD1 . 25038 1 800 . 1 1 74 74 ILE N N 15 125.455 0.000 . . . . . A 157 ILE N . 25038 1 801 . 1 1 75 75 TYR H H 1 8.733 0.000 . . . . . A 158 TYR H . 25038 1 802 . 1 1 75 75 TYR HA H 1 4.683 0.000 . . . . . A 158 TYR HA . 25038 1 803 . 1 1 75 75 TYR HB2 H 1 2.891 0.000 . . . . . A 158 TYR HB2 . 25038 1 804 . 1 1 75 75 TYR HB3 H 1 2.366 0.000 . . . . . A 158 TYR HB3 . 25038 1 805 . 1 1 75 75 TYR HD1 H 1 6.737 0.000 . . . . . A 158 TYR HD1 . 25038 1 806 . 1 1 75 75 TYR HD2 H 1 6.737 0.000 . . . . . A 158 TYR HD2 . 25038 1 807 . 1 1 75 75 TYR HE1 H 1 6.738 0.000 . . . . . A 158 TYR HE1 . 25038 1 808 . 1 1 75 75 TYR HE2 H 1 6.738 0.000 . . . . . A 158 TYR HE2 . 25038 1 809 . 1 1 75 75 TYR CA C 13 57.241 0.000 . . . . . A 158 TYR CA . 25038 1 810 . 1 1 75 75 TYR CB C 13 40.645 0.188 . . . . . A 158 TYR CB . 25038 1 811 . 1 1 75 75 TYR CD2 C 13 132.519 0.000 . . . . . A 158 TYR CD2 . 25038 1 812 . 1 1 75 75 TYR CE2 C 13 118.172 0.000 . . . . . A 158 TYR CE2 . 25038 1 813 . 1 1 75 75 TYR N N 15 126.365 0.000 . . . . . A 158 TYR N . 25038 1 814 . 1 1 76 76 ILE H H 1 8.852 0.000 . . . . . A 159 ILE H . 25038 1 815 . 1 1 76 76 ILE HA H 1 4.255 0.000 . . . . . A 159 ILE HA . 25038 1 816 . 1 1 76 76 ILE HB H 1 1.789 0.000 . . . . . A 159 ILE HB . 25038 1 817 . 1 1 76 76 ILE HG12 H 1 1.334 0.000 . . . . . A 159 ILE HG12 . 25038 1 818 . 1 1 76 76 ILE HG13 H 1 1.009 0.000 . . . . . A 159 ILE HG13 . 25038 1 819 . 1 1 76 76 ILE HG21 H 1 0.738 0.000 . . . . . A 159 ILE HG21 . 25038 1 820 . 1 1 76 76 ILE HG22 H 1 0.738 0.000 . . . . . A 159 ILE HG22 . 25038 1 821 . 1 1 76 76 ILE HG23 H 1 0.738 0.000 . . . . . A 159 ILE HG23 . 25038 1 822 . 1 1 76 76 ILE HD11 H 1 0.688 0.000 . . . . . A 159 ILE HD11 . 25038 1 823 . 1 1 76 76 ILE HD12 H 1 0.688 0.000 . . . . . A 159 ILE HD12 . 25038 1 824 . 1 1 76 76 ILE HD13 H 1 0.688 0.000 . . . . . A 159 ILE HD13 . 25038 1 825 . 1 1 76 76 ILE CA C 13 60.130 0.000 . . . . . A 159 ILE CA . 25038 1 826 . 1 1 76 76 ILE CB C 13 38.977 0.000 . . . . . A 159 ILE CB . 25038 1 827 . 1 1 76 76 ILE CG1 C 13 27.261 0.011 . . . . . A 159 ILE CG1 . 25038 1 828 . 1 1 76 76 ILE CG2 C 13 18.031 0.000 . . . . . A 159 ILE CG2 . 25038 1 829 . 1 1 76 76 ILE CD1 C 13 13.339 0.000 . . . . . A 159 ILE CD1 . 25038 1 830 . 1 1 76 76 ILE N N 15 121.220 0.000 . . . . . A 159 ILE N . 25038 1 831 . 1 1 77 77 ALA H H 1 9.677 0.000 . . . . . A 160 ALA H . 25038 1 832 . 1 1 77 77 ALA HA H 1 4.108 0.000 . . . . . A 160 ALA HA . 25038 1 833 . 1 1 77 77 ALA HB1 H 1 1.426 0.000 . . . . . A 160 ALA HB1 . 25038 1 834 . 1 1 77 77 ALA HB2 H 1 1.426 0.000 . . . . . A 160 ALA HB2 . 25038 1 835 . 1 1 77 77 ALA HB3 H 1 1.426 0.000 . . . . . A 160 ALA HB3 . 25038 1 836 . 1 1 77 77 ALA CA C 13 53.085 0.000 . . . . . A 160 ALA CA . 25038 1 837 . 1 1 77 77 ALA CB C 13 17.504 0.000 . . . . . A 160 ALA CB . 25038 1 838 . 1 1 77 77 ALA N N 15 131.890 0.000 . . . . . A 160 ALA N . 25038 1 839 . 1 1 78 78 GLY H H 1 8.674 0.000 . . . . . A 161 GLY H . 25038 1 840 . 1 1 78 78 GLY HA2 H 1 4.193 0.000 . . . . . A 161 GLY HA2 . 25038 1 841 . 1 1 78 78 GLY HA3 H 1 3.607 0.000 . . . . . A 161 GLY HA3 . 25038 1 842 . 1 1 78 78 GLY CA C 13 45.469 0.003 . . . . . A 161 GLY CA . 25038 1 843 . 1 1 78 78 GLY N N 15 101.533 0.000 . . . . . A 161 GLY N . 25038 1 844 . 1 1 79 79 HIS H H 1 7.966 0.000 . . . . . A 162 HIS H . 25038 1 845 . 1 1 79 79 HIS HA H 1 5.189 0.000 . . . . . A 162 HIS HA . 25038 1 846 . 1 1 79 79 HIS HB2 H 1 3.333 0.000 . . . . . A 162 HIS HB2 . 25038 1 847 . 1 1 79 79 HIS HB3 H 1 2.979 0.000 . . . . . A 162 HIS HB3 . 25038 1 848 . 1 1 79 79 HIS HD2 H 1 7.376 0.000 . . . . . A 162 HIS HD2 . 25038 1 849 . 1 1 79 79 HIS HE1 H 1 8.145 0.000 . . . . . A 162 HIS HE1 . 25038 1 850 . 1 1 79 79 HIS CA C 13 53.969 0.000 . . . . . A 162 HIS CA . 25038 1 851 . 1 1 79 79 HIS CB C 13 32.597 0.003 . . . . . A 162 HIS CB . 25038 1 852 . 1 1 79 79 HIS CD2 C 13 122.063 0.000 . . . . . A 162 HIS CD2 . 25038 1 853 . 1 1 79 79 HIS CE1 C 13 138.038 0.000 . . . . . A 162 HIS CE1 . 25038 1 854 . 1 1 79 79 HIS N N 15 120.337 0.000 . . . . . A 162 HIS N . 25038 1 855 . 1 1 80 80 PRO HA H 1 4.268 0.000 . . . . . A 163 PRO HA . 25038 1 856 . 1 1 80 80 PRO HB2 H 1 1.666 0.000 . . . . . A 163 PRO HB2 . 25038 1 857 . 1 1 80 80 PRO HB3 H 1 1.666 0.000 . . . . . A 163 PRO HB3 . 25038 1 858 . 1 1 80 80 PRO HG2 H 1 2.082 0.000 . . . . . A 163 PRO HG2 . 25038 1 859 . 1 1 80 80 PRO HG3 H 1 1.817 0.000 . . . . . A 163 PRO HG3 . 25038 1 860 . 1 1 80 80 PRO HD2 H 1 3.759 0.000 . . . . . A 163 PRO HD2 . 25038 1 861 . 1 1 80 80 PRO HD3 H 1 3.544 0.000 . . . . . A 163 PRO HD3 . 25038 1 862 . 1 1 80 80 PRO CA C 13 63.310 0.000 . . . . . A 163 PRO CA . 25038 1 863 . 1 1 80 80 PRO CB C 13 32.169 0.000 . . . . . A 163 PRO CB . 25038 1 864 . 1 1 80 80 PRO CG C 13 27.416 0.009 . . . . . A 163 PRO CG . 25038 1 865 . 1 1 80 80 PRO CD C 13 50.843 0.025 . . . . . A 163 PRO CD . 25038 1 866 . 1 1 81 81 ALA H H 1 8.036 0.000 . . . . . A 164 ALA H . 25038 1 867 . 1 1 81 81 ALA HA H 1 4.592 0.000 . . . . . A 164 ALA HA . 25038 1 868 . 1 1 81 81 ALA HB1 H 1 1.195 0.000 . . . . . A 164 ALA HB1 . 25038 1 869 . 1 1 81 81 ALA HB2 H 1 1.195 0.000 . . . . . A 164 ALA HB2 . 25038 1 870 . 1 1 81 81 ALA HB3 H 1 1.195 0.000 . . . . . A 164 ALA HB3 . 25038 1 871 . 1 1 81 81 ALA CA C 13 50.294 0.000 . . . . . A 164 ALA CA . 25038 1 872 . 1 1 81 81 ALA CB C 13 22.720 0.000 . . . . . A 164 ALA CB . 25038 1 873 . 1 1 81 81 ALA N N 15 124.745 0.000 . . . . . A 164 ALA N . 25038 1 874 . 1 1 82 82 PHE H H 1 8.223 0.000 . . . . . A 165 PHE H . 25038 1 875 . 1 1 82 82 PHE HA H 1 4.960 0.000 . . . . . A 165 PHE HA . 25038 1 876 . 1 1 82 82 PHE HB2 H 1 3.168 0.000 . . . . . A 165 PHE HB2 . 25038 1 877 . 1 1 82 82 PHE HB3 H 1 2.681 0.000 . . . . . A 165 PHE HB3 . 25038 1 878 . 1 1 82 82 PHE HD1 H 1 7.178 0.000 . . . . . A 165 PHE HD1 . 25038 1 879 . 1 1 82 82 PHE HD2 H 1 7.178 0.000 . . . . . A 165 PHE HD2 . 25038 1 880 . 1 1 82 82 PHE HE1 H 1 7.366 0.000 . . . . . A 165 PHE HE1 . 25038 1 881 . 1 1 82 82 PHE HE2 H 1 7.366 0.000 . . . . . A 165 PHE HE2 . 25038 1 882 . 1 1 82 82 PHE HZ H 1 7.282 0.000 . . . . . A 165 PHE HZ . 25038 1 883 . 1 1 82 82 PHE CA C 13 57.221 0.000 . . . . . A 165 PHE CA . 25038 1 884 . 1 1 82 82 PHE CB C 13 40.963 0.001 . . . . . A 165 PHE CB . 25038 1 885 . 1 1 82 82 PHE CD1 C 13 131.896 0.000 . . . . . A 165 PHE CD1 . 25038 1 886 . 1 1 82 82 PHE CE1 C 13 131.459 0.000 . . . . . A 165 PHE CE1 . 25038 1 887 . 1 1 82 82 PHE CZ C 13 129.835 0.000 . . . . . A 165 PHE CZ . 25038 1 888 . 1 1 82 82 PHE N N 15 118.002 0.000 . . . . . A 165 PHE N . 25038 1 889 . 1 1 83 83 VAL H H 1 8.614 0.000 . . . . . A 166 VAL H . 25038 1 890 . 1 1 83 83 VAL HA H 1 4.895 0.000 . . . . . A 166 VAL HA . 25038 1 891 . 1 1 83 83 VAL HB H 1 1.779 0.000 . . . . . A 166 VAL HB . 25038 1 892 . 1 1 83 83 VAL HG11 H 1 0.797 0.000 . . . . . A 166 VAL HG11 . 25038 1 893 . 1 1 83 83 VAL HG12 H 1 0.797 0.000 . . . . . A 166 VAL HG12 . 25038 1 894 . 1 1 83 83 VAL HG13 H 1 0.797 0.000 . . . . . A 166 VAL HG13 . 25038 1 895 . 1 1 83 83 VAL HG21 H 1 0.681 0.000 . . . . . A 166 VAL HG21 . 25038 1 896 . 1 1 83 83 VAL HG22 H 1 0.681 0.000 . . . . . A 166 VAL HG22 . 25038 1 897 . 1 1 83 83 VAL HG23 H 1 0.681 0.000 . . . . . A 166 VAL HG23 . 25038 1 898 . 1 1 83 83 VAL CA C 13 60.829 0.000 . . . . . A 166 VAL CA . 25038 1 899 . 1 1 83 83 VAL CB C 13 34.855 0.000 . . . . . A 166 VAL CB . 25038 1 900 . 1 1 83 83 VAL CG1 C 13 21.001 0.000 . . . . . A 166 VAL CG1 . 25038 1 901 . 1 1 83 83 VAL CG2 C 13 20.972 0.000 . . . . . A 166 VAL CG2 . 25038 1 902 . 1 1 83 83 VAL N N 15 121.502 0.000 . . . . . A 166 VAL N . 25038 1 903 . 1 1 84 84 ASN H H 1 8.360 0.000 . . . . . A 167 ASN H . 25038 1 904 . 1 1 84 84 ASN HA H 1 4.777 0.000 . . . . . A 167 ASN HA . 25038 1 905 . 1 1 84 84 ASN HB2 H 1 2.934 0.000 . . . . . A 167 ASN HB2 . 25038 1 906 . 1 1 84 84 ASN HB3 H 1 2.750 0.000 . . . . . A 167 ASN HB3 . 25038 1 907 . 1 1 84 84 ASN HD21 H 1 7.628 0.000 . . . . . A 167 ASN HD21 . 25038 1 908 . 1 1 84 84 ASN HD22 H 1 6.983 0.000 . . . . . A 167 ASN HD22 . 25038 1 909 . 1 1 84 84 ASN CA C 13 51.961 0.000 . . . . . A 167 ASN CA . 25038 1 910 . 1 1 84 84 ASN CB C 13 42.575 0.013 . . . . . A 167 ASN CB . 25038 1 911 . 1 1 84 84 ASN N N 15 121.446 0.000 . . . . . A 167 ASN N . 25038 1 912 . 1 1 84 84 ASN ND2 N 15 112.100 0.000 . . . . . A 167 ASN ND2 . 25038 1 913 . 1 1 85 85 TYR H H 1 8.506 0.000 . . . . . A 168 TYR H . 25038 1 914 . 1 1 85 85 TYR HA H 1 4.743 0.000 . . . . . A 168 TYR HA . 25038 1 915 . 1 1 85 85 TYR HB2 H 1 3.297 0.000 . . . . . A 168 TYR HB2 . 25038 1 916 . 1 1 85 85 TYR HB3 H 1 2.610 0.000 . . . . . A 168 TYR HB3 . 25038 1 917 . 1 1 85 85 TYR HD1 H 1 7.299 0.000 . . . . . A 168 TYR HD1 . 25038 1 918 . 1 1 85 85 TYR HD2 H 1 7.299 0.000 . . . . . A 168 TYR HD2 . 25038 1 919 . 1 1 85 85 TYR HE1 H 1 6.744 0.000 . . . . . A 168 TYR HE1 . 25038 1 920 . 1 1 85 85 TYR HE2 H 1 6.744 0.000 . . . . . A 168 TYR HE2 . 25038 1 921 . 1 1 85 85 TYR CA C 13 60.088 0.000 . . . . . A 168 TYR CA . 25038 1 922 . 1 1 85 85 TYR CB C 13 39.235 0.015 . . . . . A 168 TYR CB . 25038 1 923 . 1 1 85 85 TYR CD2 C 13 133.422 0.000 . . . . . A 168 TYR CD2 . 25038 1 924 . 1 1 85 85 TYR CE2 C 13 118.939 0.000 . . . . . A 168 TYR CE2 . 25038 1 925 . 1 1 85 85 TYR N N 15 120.459 0.000 . . . . . A 168 TYR N . 25038 1 926 . 1 1 86 86 SER H H 1 8.918 0.000 . . . . . A 169 SER H . 25038 1 927 . 1 1 86 86 SER HA H 1 4.791 0.000 . . . . . A 169 SER HA . 25038 1 928 . 1 1 86 86 SER HB2 H 1 3.789 0.000 . . . . . A 169 SER HB2 . 25038 1 929 . 1 1 86 86 SER HB3 H 1 3.667 0.000 . . . . . A 169 SER HB3 . 25038 1 930 . 1 1 86 86 SER CA C 13 56.439 0.000 . . . . . A 169 SER CA . 25038 1 931 . 1 1 86 86 SER CB C 13 64.082 0.012 . . . . . A 169 SER CB . 25038 1 932 . 1 1 86 86 SER N N 15 115.466 0.000 . . . . . A 169 SER N . 25038 1 933 . 1 1 87 87 THR HA H 1 4.173 0.000 . . . . . A 170 THR HA . 25038 1 934 . 1 1 87 87 THR HB H 1 4.364 0.000 . . . . . A 170 THR HB . 25038 1 935 . 1 1 87 87 THR HG21 H 1 1.393 0.000 . . . . . A 170 THR HG21 . 25038 1 936 . 1 1 87 87 THR HG22 H 1 1.393 0.000 . . . . . A 170 THR HG22 . 25038 1 937 . 1 1 87 87 THR HG23 H 1 1.393 0.000 . . . . . A 170 THR HG23 . 25038 1 938 . 1 1 87 87 THR CA C 13 63.884 0.000 . . . . . A 170 THR CA . 25038 1 939 . 1 1 87 87 THR CB C 13 69.038 0.000 . . . . . A 170 THR CB . 25038 1 940 . 1 1 87 87 THR CG2 C 13 22.206 0.000 . . . . . A 170 THR CG2 . 25038 1 941 . 1 1 88 88 SER H H 1 8.663 0.000 . . . . . A 171 SER H . 25038 1 942 . 1 1 88 88 SER HA H 1 4.522 0.000 . . . . . A 171 SER HA . 25038 1 943 . 1 1 88 88 SER HB2 H 1 3.836 0.000 . . . . . A 171 SER HB2 . 25038 1 944 . 1 1 88 88 SER HB3 H 1 3.771 0.000 . . . . . A 171 SER HB3 . 25038 1 945 . 1 1 88 88 SER CA C 13 58.398 0.000 . . . . . A 171 SER CA . 25038 1 946 . 1 1 88 88 SER CB C 13 64.162 0.001 . . . . . A 171 SER CB . 25038 1 947 . 1 1 88 88 SER N N 15 119.092 0.000 . . . . . A 171 SER N . 25038 1 948 . 1 1 89 89 GLN H H 1 8.687 0.000 . . . . . A 172 GLN H . 25038 1 949 . 1 1 89 89 GLN HA H 1 4.447 0.000 . . . . . A 172 GLN HA . 25038 1 950 . 1 1 89 89 GLN HB2 H 1 1.845 0.000 . . . . . A 172 GLN HB2 . 25038 1 951 . 1 1 89 89 GLN HB3 H 1 1.845 0.000 . . . . . A 172 GLN HB3 . 25038 1 952 . 1 1 89 89 GLN HG2 H 1 2.482 0.000 . . . . . A 172 GLN HG2 . 25038 1 953 . 1 1 89 89 GLN HG3 H 1 2.422 0.000 . . . . . A 172 GLN HG3 . 25038 1 954 . 1 1 89 89 GLN HE21 H 1 7.379 0.000 . . . . . A 172 GLN HE21 . 25038 1 955 . 1 1 89 89 GLN HE22 H 1 7.049 0.000 . . . . . A 172 GLN HE22 . 25038 1 956 . 1 1 89 89 GLN CA C 13 55.788 0.000 . . . . . A 172 GLN CA . 25038 1 957 . 1 1 89 89 GLN CB C 13 29.287 0.000 . . . . . A 172 GLN CB . 25038 1 958 . 1 1 89 89 GLN CG C 13 33.987 0.004 . . . . . A 172 GLN CG . 25038 1 959 . 1 1 89 89 GLN N N 15 121.211 0.000 . . . . . A 172 GLN N . 25038 1 960 . 1 1 89 89 GLN NE2 N 15 113.043 0.000 . . . . . A 172 GLN NE2 . 25038 1 961 . 1 1 90 90 LYS H H 1 7.513 0.000 . . . . . A 173 LYS H . 25038 1 962 . 1 1 90 90 LYS HA H 1 4.131 0.000 . . . . . A 173 LYS HA . 25038 1 963 . 1 1 90 90 LYS HB2 H 1 1.698 0.000 . . . . . A 173 LYS HB2 . 25038 1 964 . 1 1 90 90 LYS HB3 H 1 1.632 0.000 . . . . . A 173 LYS HB3 . 25038 1 965 . 1 1 90 90 LYS HG2 H 1 1.379 0.000 . . . . . A 173 LYS HG2 . 25038 1 966 . 1 1 90 90 LYS HG3 H 1 1.307 0.000 . . . . . A 173 LYS HG3 . 25038 1 967 . 1 1 90 90 LYS HD2 H 1 1.660 0.000 . . . . . A 173 LYS HD2 . 25038 1 968 . 1 1 90 90 LYS HD3 H 1 1.660 0.000 . . . . . A 173 LYS HD3 . 25038 1 969 . 1 1 90 90 LYS HE2 H 1 2.971 0.000 . . . . . A 173 LYS HE2 . 25038 1 970 . 1 1 90 90 LYS HE3 H 1 2.971 0.000 . . . . . A 173 LYS HE3 . 25038 1 971 . 1 1 90 90 LYS CA C 13 55.751 0.000 . . . . . A 173 LYS CA . 25038 1 972 . 1 1 90 90 LYS CB C 13 35.581 0.002 . . . . . A 173 LYS CB . 25038 1 973 . 1 1 90 90 LYS CG C 13 24.270 0.001 . . . . . A 173 LYS CG . 25038 1 974 . 1 1 90 90 LYS CD C 13 29.090 0.000 . . . . . A 173 LYS CD . 25038 1 975 . 1 1 90 90 LYS CE C 13 42.150 0.000 . . . . . A 173 LYS CE . 25038 1 976 . 1 1 90 90 LYS N N 15 116.453 0.000 . . . . . A 173 LYS N . 25038 1 977 . 1 1 91 91 ILE H H 1 8.701 0.000 . . . . . A 174 ILE H . 25038 1 978 . 1 1 91 91 ILE HA H 1 3.834 0.000 . . . . . A 174 ILE HA . 25038 1 979 . 1 1 91 91 ILE HB H 1 1.674 0.000 . . . . . A 174 ILE HB . 25038 1 980 . 1 1 91 91 ILE HG21 H 1 0.875 0.000 . . . . . A 174 ILE HG21 . 25038 1 981 . 1 1 91 91 ILE HG22 H 1 0.875 0.000 . . . . . A 174 ILE HG22 . 25038 1 982 . 1 1 91 91 ILE HG23 H 1 0.875 0.000 . . . . . A 174 ILE HG23 . 25038 1 983 . 1 1 91 91 ILE HD11 H 1 0.980 0.000 . . . . . A 174 ILE HD11 . 25038 1 984 . 1 1 91 91 ILE HD12 H 1 0.980 0.000 . . . . . A 174 ILE HD12 . 25038 1 985 . 1 1 91 91 ILE HD13 H 1 0.980 0.000 . . . . . A 174 ILE HD13 . 25038 1 986 . 1 1 91 91 ILE CA C 13 63.040 0.000 . . . . . A 174 ILE CA . 25038 1 987 . 1 1 91 91 ILE CB C 13 38.760 0.000 . . . . . A 174 ILE CB . 25038 1 988 . 1 1 91 91 ILE CG2 C 13 16.030 0.000 . . . . . A 174 ILE CG2 . 25038 1 989 . 1 1 91 91 ILE CD1 C 13 13.830 0.000 . . . . . A 174 ILE CD1 . 25038 1 990 . 1 1 91 91 ILE N N 15 124.969 0.000 . . . . . A 174 ILE N . 25038 1 991 . 1 1 92 92 SER H H 1 8.692 0.000 . . . . . A 175 SER H . 25038 1 992 . 1 1 92 92 SER N N 15 124.113 0.000 . . . . . A 175 SER N . 25038 1 993 . 1 1 93 93 ARG H H 1 8.379 0.000 . . . . . A 176 ARG H . 25038 1 994 . 1 1 93 93 ARG HA H 1 4.702 0.000 . . . . . A 176 ARG HA . 25038 1 995 . 1 1 93 93 ARG HB2 H 1 1.675 0.000 . . . . . A 176 ARG HB2 . 25038 1 996 . 1 1 93 93 ARG HB3 H 1 1.675 0.000 . . . . . A 176 ARG HB3 . 25038 1 997 . 1 1 93 93 ARG HG2 H 1 1.384 0.000 . . . . . A 176 ARG HG2 . 25038 1 998 . 1 1 93 93 ARG HG3 H 1 1.342 0.000 . . . . . A 176 ARG HG3 . 25038 1 999 . 1 1 93 93 ARG CA C 13 53.538 0.000 . . . . . A 176 ARG CA . 25038 1 1000 . 1 1 93 93 ARG CB C 13 30.088 0.000 . . . . . A 176 ARG CB . 25038 1 1001 . 1 1 93 93 ARG CG C 13 26.540 0.001 . . . . . A 176 ARG CG . 25038 1 1002 . 1 1 93 93 ARG N N 15 125.524 0.000 . . . . . A 176 ARG N . 25038 1 1003 . 1 1 94 94 PRO HA H 1 4.343 0.000 . . . . . A 177 PRO HA . 25038 1 1004 . 1 1 94 94 PRO HB2 H 1 2.327 0.000 . . . . . A 177 PRO HB2 . 25038 1 1005 . 1 1 94 94 PRO HB3 H 1 1.981 0.000 . . . . . A 177 PRO HB3 . 25038 1 1006 . 1 1 94 94 PRO HG2 H 1 2.160 0.000 . . . . . A 177 PRO HG2 . 25038 1 1007 . 1 1 94 94 PRO HG3 H 1 2.160 0.000 . . . . . A 177 PRO HG3 . 25038 1 1008 . 1 1 94 94 PRO HD2 H 1 4.225 0.000 . . . . . A 177 PRO HD2 . 25038 1 1009 . 1 1 94 94 PRO HD3 H 1 3.700 0.000 . . . . . A 177 PRO HD3 . 25038 1 1010 . 1 1 94 94 PRO CA C 13 63.660 0.000 . . . . . A 177 PRO CA . 25038 1 1011 . 1 1 94 94 PRO CB C 13 32.134 0.006 . . . . . A 177 PRO CB . 25038 1 1012 . 1 1 94 94 PRO CG C 13 27.706 0.000 . . . . . A 177 PRO CG . 25038 1 1013 . 1 1 94 94 PRO CD C 13 50.852 0.001 . . . . . A 177 PRO CD . 25038 1 1014 . 1 1 95 95 GLY H H 1 8.520 0.000 . . . . . A 178 GLY H . 25038 1 1015 . 1 1 95 95 GLY HA2 H 1 3.999 0.000 . . . . . A 178 GLY HA2 . 25038 1 1016 . 1 1 95 95 GLY HA3 H 1 3.999 0.000 . . . . . A 178 GLY HA3 . 25038 1 1017 . 1 1 95 95 GLY CA C 13 45.400 0.000 . . . . . A 178 GLY CA . 25038 1 1018 . 1 1 95 95 GLY N N 15 109.773 0.000 . . . . . A 178 GLY N . 25038 1 1019 . 1 1 96 96 ASP H H 1 8.113 0.000 . . . . . A 179 ASP H . 25038 1 1020 . 1 1 96 96 ASP HA H 1 4.664 0.000 . . . . . A 179 ASP HA . 25038 1 1021 . 1 1 96 96 ASP HB2 H 1 2.760 0.000 . . . . . A 179 ASP HB2 . 25038 1 1022 . 1 1 96 96 ASP HB3 H 1 2.706 0.000 . . . . . A 179 ASP HB3 . 25038 1 1023 . 1 1 96 96 ASP CA C 13 54.630 0.000 . . . . . A 179 ASP CA . 25038 1 1024 . 1 1 96 96 ASP CB C 13 41.275 0.011 . . . . . A 179 ASP CB . 25038 1 1025 . 1 1 96 96 ASP N N 15 120.705 0.000 . . . . . A 179 ASP N . 25038 1 1026 . 1 1 97 97 SER H H 1 8.278 0.000 . . . . . A 180 SER H . 25038 1 1027 . 1 1 97 97 SER HA H 1 4.510 0.000 . . . . . A 180 SER HA . 25038 1 1028 . 1 1 97 97 SER HB2 H 1 3.896 0.000 . . . . . A 180 SER HB2 . 25038 1 1029 . 1 1 97 97 SER HB3 H 1 3.896 0.000 . . . . . A 180 SER HB3 . 25038 1 1030 . 1 1 97 97 SER CA C 13 58.400 0.000 . . . . . A 180 SER CA . 25038 1 1031 . 1 1 97 97 SER CB C 13 64.095 0.000 . . . . . A 180 SER CB . 25038 1 1032 . 1 1 97 97 SER N N 15 115.491 0.000 . . . . . A 180 SER N . 25038 1 1033 . 1 1 98 98 ASP H H 1 8.371 0.000 . . . . . A 181 ASP H . 25038 1 1034 . 1 1 98 98 ASP HA H 1 4.690 0.000 . . . . . A 181 ASP HA . 25038 1 1035 . 1 1 98 98 ASP HB2 H 1 2.779 0.000 . . . . . A 181 ASP HB2 . 25038 1 1036 . 1 1 98 98 ASP HB3 H 1 2.721 0.000 . . . . . A 181 ASP HB3 . 25038 1 1037 . 1 1 98 98 ASP CA C 13 54.614 0.000 . . . . . A 181 ASP CA . 25038 1 1038 . 1 1 98 98 ASP CB C 13 41.303 0.000 . . . . . A 181 ASP CB . 25038 1 1039 . 1 1 98 98 ASP N N 15 122.472 0.000 . . . . . A 181 ASP N . 25038 1 1040 . 1 1 99 99 ASP H H 1 8.323 0.000 . . . . . A 182 ASP H . 25038 1 1041 . 1 1 99 99 ASP HA H 1 4.661 0.000 . . . . . A 182 ASP HA . 25038 1 1042 . 1 1 99 99 ASP HB2 H 1 2.760 0.000 . . . . . A 182 ASP HB2 . 25038 1 1043 . 1 1 99 99 ASP HB3 H 1 2.706 0.000 . . . . . A 182 ASP HB3 . 25038 1 1044 . 1 1 99 99 ASP CA C 13 54.668 0.000 . . . . . A 182 ASP CA . 25038 1 1045 . 1 1 99 99 ASP CB C 13 41.275 0.011 . . . . . A 182 ASP CB . 25038 1 1046 . 1 1 99 99 ASP N N 15 121.277 0.000 . . . . . A 182 ASP N . 25038 1 1047 . 1 1 100 100 SER H H 1 8.321 0.000 . . . . . A 183 SER H . 25038 1 1048 . 1 1 100 100 SER HA H 1 4.426 0.000 . . . . . A 183 SER HA . 25038 1 1049 . 1 1 100 100 SER HB2 H 1 3.945 0.000 . . . . . A 183 SER HB2 . 25038 1 1050 . 1 1 100 100 SER HB3 H 1 3.945 0.000 . . . . . A 183 SER HB3 . 25038 1 1051 . 1 1 100 100 SER CA C 13 59.256 0.000 . . . . . A 183 SER CA . 25038 1 1052 . 1 1 100 100 SER CB C 13 63.865 0.000 . . . . . A 183 SER CB . 25038 1 1053 . 1 1 100 100 SER N N 15 116.407 0.000 . . . . . A 183 SER N . 25038 1 1054 . 1 1 101 101 ARG H H 1 8.161 0.000 . . . . . A 184 ARG H . 25038 1 1055 . 1 1 101 101 ARG HA H 1 4.420 0.000 . . . . . A 184 ARG HA . 25038 1 1056 . 1 1 101 101 ARG HB2 H 1 1.952 0.000 . . . . . A 184 ARG HB2 . 25038 1 1057 . 1 1 101 101 ARG HB3 H 1 1.851 0.000 . . . . . A 184 ARG HB3 . 25038 1 1058 . 1 1 101 101 ARG HG2 H 1 1.702 0.000 . . . . . A 184 ARG HG2 . 25038 1 1059 . 1 1 101 101 ARG HG3 H 1 1.681 0.000 . . . . . A 184 ARG HG3 . 25038 1 1060 . 1 1 101 101 ARG HD2 H 1 3.253 0.000 . . . . . A 184 ARG HD2 . 25038 1 1061 . 1 1 101 101 ARG HD3 H 1 3.253 0.000 . . . . . A 184 ARG HD3 . 25038 1 1062 . 1 1 101 101 ARG CA C 13 56.430 0.000 . . . . . A 184 ARG CA . 25038 1 1063 . 1 1 101 101 ARG CB C 13 30.629 0.012 . . . . . A 184 ARG CB . 25038 1 1064 . 1 1 101 101 ARG CG C 13 27.201 0.004 . . . . . A 184 ARG CG . 25038 1 1065 . 1 1 101 101 ARG CD C 13 43.451 0.000 . . . . . A 184 ARG CD . 25038 1 1066 . 1 1 101 101 ARG N N 15 122.019 0.000 . . . . . A 184 ARG N . 25038 1 1067 . 1 1 102 102 SER H H 1 8.243 0.000 . . . . . A 185 SER H . 25038 1 1068 . 1 1 102 102 SER HA H 1 4.527 0.000 . . . . . A 185 SER HA . 25038 1 1069 . 1 1 102 102 SER HB2 H 1 3.920 0.000 . . . . . A 185 SER HB2 . 25038 1 1070 . 1 1 102 102 SER HB3 H 1 3.920 0.000 . . . . . A 185 SER HB3 . 25038 1 1071 . 1 1 102 102 SER CA C 13 58.450 0.000 . . . . . A 185 SER CA . 25038 1 1072 . 1 1 102 102 SER CB C 13 63.868 0.000 . . . . . A 185 SER CB . 25038 1 1073 . 1 1 102 102 SER N N 15 116.571 0.000 . . . . . A 185 SER N . 25038 1 1074 . 1 1 103 103 VAL H H 1 8.082 0.000 . . . . . A 186 VAL H . 25038 1 1075 . 1 1 103 103 VAL HA H 1 4.230 0.000 . . . . . A 186 VAL HA . 25038 1 1076 . 1 1 103 103 VAL HB H 1 2.170 0.000 . . . . . A 186 VAL HB . 25038 1 1077 . 1 1 103 103 VAL HG11 H 1 0.987 0.000 . . . . . A 186 VAL HG11 . 25038 1 1078 . 1 1 103 103 VAL HG12 H 1 0.987 0.000 . . . . . A 186 VAL HG12 . 25038 1 1079 . 1 1 103 103 VAL HG13 H 1 0.987 0.000 . . . . . A 186 VAL HG13 . 25038 1 1080 . 1 1 103 103 VAL HG21 H 1 0.976 0.000 . . . . . A 186 VAL HG21 . 25038 1 1081 . 1 1 103 103 VAL HG22 H 1 0.976 0.000 . . . . . A 186 VAL HG22 . 25038 1 1082 . 1 1 103 103 VAL HG23 H 1 0.976 0.000 . . . . . A 186 VAL HG23 . 25038 1 1083 . 1 1 103 103 VAL CA C 13 62.440 0.000 . . . . . A 186 VAL CA . 25038 1 1084 . 1 1 103 103 VAL CB C 13 32.801 0.000 . . . . . A 186 VAL CB . 25038 1 1085 . 1 1 103 103 VAL CG1 C 13 21.216 0.000 . . . . . A 186 VAL CG1 . 25038 1 1086 . 1 1 103 103 VAL CG2 C 13 20.244 0.000 . . . . . A 186 VAL CG2 . 25038 1 1087 . 1 1 103 103 VAL N N 15 120.922 0.000 . . . . . A 186 VAL N . 25038 1 1088 . 1 1 104 104 ASN H H 1 8.431 0.000 . . . . . A 187 ASN H . 25038 1 1089 . 1 1 104 104 ASN HA H 1 4.864 0.000 . . . . . A 187 ASN HA . 25038 1 1090 . 1 1 104 104 ASN HB2 H 1 2.910 0.000 . . . . . A 187 ASN HB2 . 25038 1 1091 . 1 1 104 104 ASN HB3 H 1 2.766 0.000 . . . . . A 187 ASN HB3 . 25038 1 1092 . 1 1 104 104 ASN CA C 13 53.390 0.000 . . . . . A 187 ASN CA . 25038 1 1093 . 1 1 104 104 ASN CB C 13 39.361 0.005 . . . . . A 187 ASN CB . 25038 1 1094 . 1 1 104 104 ASN N N 15 122.174 0.000 . . . . . A 187 ASN N . 25038 1 1095 . 1 1 105 105 SER H H 1 7.880 0.000 . . . . . A 188 SER H . 25038 1 1096 . 1 1 105 105 SER HA H 1 4.305 0.000 . . . . . A 188 SER HA . 25038 1 1097 . 1 1 105 105 SER CA C 13 60.120 0.000 . . . . . A 188 SER CA . 25038 1 1098 . 1 1 105 105 SER N N 15 121.742 0.000 . . . . . A 188 SER N . 25038 1 stop_ save_