data_4719 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4719 _Entry.Title ; Backbone 1H, 13C and 15N chemical shift assignments of the Ras-binding domain (RBD) of AF6 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2000-04-12 _Entry.Accession_date 2000-04-17 _Entry.Last_release_date 2001-03-15 _Entry.Original_release_date 2001-03-15 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Guido Steiner . . . 4719 2 Werner Kremer . . . 4719 3 Thomas Linnemann . . . 4719 4 Christian Herrmann . . . 4719 5 Matthias Geyer . . . 4719 6 Hans Kalbitzer . R. . 4719 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4719 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 483 4719 '15N chemical shifts' 124 4719 '1H chemical shifts' 754 4719 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 . . 2001-03-15 2000-04-12 original author . 4719 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4719 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 20513410 _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Sequence-specific Resonance Assignment of the Ras-binding Domain of AF6' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full 'Journal of Biomolecular NMR' _Citation.Journal_volume 18 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 73 _Citation.Page_last 74 _Citation.Year 2000 _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 Guido Steiner . . . 4719 1 2 Werner Kremer . . . 4719 1 3 Thomas Linnemann . . . 4719 1 4 Christian Herrmann . . . 4719 1 5 Matthias Geyer . . . 4719 1 6 Hans Kalbitzer . R. . 4719 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID AF6 4719 1 'NMR assignment' 4719 1 'Ras-binding domain' 4719 1 stop_ save_ save_ref1 _Citation.Sf_category citations _Citation.Sf_framecode ref1 _Citation.Entry_ID 4719 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 8703846 _Citation.Full_citation ; Genes Chromosomes Cancer 1996 Apr;15(4):206-16 Analysis of the t(6;11)(q27;q23) in leukemia shows a consistent breakpoint in Tanabe S, Zeleznik-Le NJ, Kobayashi H, Vignon C, Espinosa R 3rd, LeBeau MM, Thirman MJ, Rowley JD AF6 in three patients and in the ML-2 cell line. ; _Citation.Title 'Analysis of the t(6;11)(q27;q23) in leukemia shows a consistent breakpoint in AF6 in three patients and in the ML-2 cell line.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Genes Chromosomes Cancer' _Citation.Journal_name_full 'Genes, chromosomes & cancer' _Citation.Journal_volume 15 _Citation.Journal_issue 4 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1045-2257 _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 206 _Citation.Page_last 216 _Citation.Year 1996 _Citation.Details ; The t(6;11)(q27;23) is one of the most common translocations observed in patients with acute myeloid leukemia (AML). The translocation breakpoint involves the MLL gene, which is the human homolog of the Drosophila trithorax gene, at 11q23 and the AF6 gene at 6q27. Reverse transcriptase-polymerase chain reaction (RT-PCR) using an MLL sense primer and an AF6 antisense primer detected the MLL/AF6 fusion cDNA from three leukemia patients with the t(6;11) [two AML and one T-acute lymphoblastic leukemia (ALL)] and one cell line. The fusion point in the AF6 cDNA from these cases is identical, regardless of the leukemia phenotype. The ML-2 cell line, which was established from a patient with AML that developed after complete remission of T-cell lymphoma, has retained an 11q23-24 deletion from the lymphoma stage and has acquired the t(6;11) with development of AML. The ML-2 cells have no normal MLL gene on Southern blot analysis, which indicates that an intact MLL gene is not necessary for survival of leukemic cells. ; 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 S Tanabe S. . . 4719 2 2 'N J' Zeleznik-Le N. J. . 4719 2 3 H Kobayashi H. . . 4719 2 4 C Vignon C. . . 4719 2 5 R Espinosa R. . 3rd 4719 2 6 'M M' LeBeau M. M. . 4719 2 7 'M J' Thirman M. J. . 4719 2 8 'J D' Rowley J. D. . 4719 2 stop_ save_ save_ref2 _Citation.Sf_category citations _Citation.Sf_framecode ref2 _Citation.Entry_ID 4719 _Citation.ID 3 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 9349501 _Citation.Full_citation ; Oncogene 1997 Oct 2;15(14):1681-7 Chimeric MLL products with a Ras binding cytoplasmic protein AF6 involved in t(6;11) (q27;q23) leukemia localize in the nucleus. Joh T, Yamamoto K, Kagami Y, Kakuda H, Sato T, Yamamoto T, Takahashi T, Ueda R, Kaibuchi K, Seto M ; _Citation.Title 'Chimeric MLL products with a Ras binding cytoplasmic protein AF6 involved in t(6;11) (q27;q23) leukemia localize in the nucleus.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Oncogene _Citation.Journal_name_full Oncogene _Citation.Journal_volume 15 _Citation.Journal_issue 14 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0950-9232 _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 1681 _Citation.Page_last 1687 _Citation.Year 1997 _Citation.Details ; In infantile leukemias and therapy-related leukemias, the MLL gene is frequently found to be disrupted and fused to various translocation partner genes, such as AF4/FEL, LTG9/AF9 and LTG19/ENL as a result of 11q23 translocations. We previously showed that the N-terminal portion common to various chimeric MLL products, as well as to MLL-LTG9 and MLL-LTG19, localizes in the nuclei, and therefore suggested that it might play an important role in leukemogenesis. In the present study, MLL-AF6 chimeric products found in the t(6;11)(q27;q23) translocation were analysed since AF6, a Ras-binding protein, exhibits a different subcellular localization from that of LTG9/AF9 and LTG19/ENL. Immunofluorescence staining data and cell fractionation analyses demonstrated that MLL-AF6 chimeric products localize in the nuclei despite the fact that AF6 itself localizes in the cytoplasm, confirming the importance of the nuclear localization of chimeric MLL products. The region in the N-terminal portion of MLL responsible for this nuclear localization was examined and found to be a region containing AT-hook motifs. ; 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 T Joh T. . . 4719 3 2 K Yamamoto K. . . 4719 3 3 Y Kagami Y. . . 4719 3 4 H Kakuda H. . . 4719 3 5 T Sato T. . . 4719 3 6 T Yamamoto T. . . 4719 3 7 T Takahashi T. . . 4719 3 8 R Ueda R. . . 4719 3 9 K Kaibuchi K. . . 4719 3 10 M Seto M. . . 4719 3 stop_ save_ save_ref3 _Citation.Sf_category citations _Citation.Sf_framecode ref3 _Citation.Entry_ID 4719 _Citation.ID 4 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 10224125 _Citation.Full_citation ; J Biol Chem 1999 May 7;274(19):13556-62 Thermodynamic and kinetic characterization of the interaction between the Ras binding domain of AF6 and members of the Ras subfamily. Linnemann T, Geyer M, Jaitner BK, Block C, Kalbitzer HR, Wittinghofer A, Herrmann C ; _Citation.Title 'Thermodynamic and kinetic characterization of the interaction between the Ras binding domain of AF6 and members of the Ras subfamily.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full 'The Journal of biological chemistry' _Citation.Journal_volume 274 _Citation.Journal_issue 19 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0021-9258 _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 13556 _Citation.Page_last 13562 _Citation.Year 1999 _Citation.Details ; Cellular signaling downstream of Ras is highly diversified and may involve many different effector molecules. A potential candidate is AF6 which was originally identified as a fusion to ALL-1 in acute myeloid leukemia. In the present work the interaction between Ras and AF6 is characterized and compared with other effectors. The binding characteristics are quite similar to Raf and RalGEF, i.e. nucleotide dissociation as well as GTPase-activating protein activity are inhibited, whereas the intrinsic GTPase activity of Ras is unperturbed by AF6 binding. Particularly, the dynamics of interaction are similar to Raf and RalGEF with a lifetime of the Ras. AF6 complex in the millisecond range. As probed by 31P NMR spectroscopy one of two major conformational states of Ras is stabilized by the interaction with AF6. Looking at the affinities of AF6 to a number of Ras mutants in the effector region, a specificity profile emerges distinct from that of other effector molecules. This finding may be useful in defining the biological function of AF6 by selectively switching off other pathways downstream of Ras using the appropriate effector mutant. Notably, among the Ras-related proteins AF6 binds most tightly to Rap1A which could imply a role of Rap1A in AF6 regulation. ; 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 T Linnemann T. . . 4719 4 2 M Geyer M. . . 4719 4 3 'B K' Jaitner B. K. . 4719 4 4 C Block C. . . 4719 4 5 'H R' Kalbitzer H. R. . 4719 4 6 A Wittinghofer A. . . 4719 4 7 C Herrmann C. . . 4719 4 stop_ save_ save_ref4 _Citation.Sf_category citations _Citation.Sf_framecode ref4 _Citation.Entry_ID 4719 _Citation.ID 5 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 8557659 _Citation.Full_citation ; J Biol Chem 1996 Jan 12;271(2):607-10 Identification of AF-6 and canoe as putative targets for Ras. Kuriyama M, Harada N, Kuroda S, Yamamoto T, Nakafuku M, Iwamatsu A, Yamamoto D, Prasad R, Croce C, Canaani E, Kaibuchi K ; _Citation.Title 'Identification of AF-6 and canoe as putative targets for Ras.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full 'The Journal of biological chemistry' _Citation.Journal_volume 271 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0021-9258 _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 607 _Citation.Page_last 610 _Citation.Year 1996 _Citation.Details ; Ras (Ha-Ras, Ki-Ras, N-Ras) is implicated in the regulation of various cell functions such as gene expression and cell proliferation downstream from specific extracellular signals. Here, we partially purified a Ras-interacting protein with molecular mass of about 180 kDa (p180) from bovine brain membrane extract by glutathione S-transferase (GST)-Ha-Ras affinity column chromatography. This protein bound to the GTP gamma S (guanosine 5'-(3-O-thio)triphosphate, a nonhydrolyzable GTP analog).GST-Ha-Ras affinity column but not to those containing GDP.GST-Ha-Ras or GTP gamma S.GST-Ha-Ras with a mutation in the effector domain (Ha-RasA38). The amino acid sequences of the peptides derived from p180 were almost identical to those of human AF-6 that is identified as the fusion partner of the ALL-1 protein. The ALL-1/AF-6 chimeric protein is the critical product of the t (6:11) abnormality associated with some human leukemia. AF-6 has a GLGF/Dlg homology repeat (DHR) motif and shows a high degree of sequence similarity with Drosophila Canoe, which is assumed to function downstream from Notch in a common developmental pathway. The recombinant N-terminal domain of AF-6 and Canoe specifically interacted with GTP gamma S.GST-Ha-Ras. The known Ras target c-Raf-1 inhibited the interaction of AF-6 with GTP gamma S.GST-Ha-Ras. These results indicate that AF-6 and Canoe are putative targets for Ras. ; 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 M Kuriyama M. . . 4719 5 2 N Harada N. . . 4719 5 3 S Kuroda S. . . 4719 5 4 T Yamamoto T. . . 4719 5 5 M Nakafuku M. . . 4719 5 6 A Iwamatsu A. . . 4719 5 7 D Yamamoto D. . . 4719 5 8 R Prasad R. . . 4719 5 9 C Croce C. . . 4719 5 10 E Canaani E. . . 4719 5 11 K Kaibuchi K. . . 4719 5 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_rnAF6 _Assembly.Sf_category assembly _Assembly.Sf_framecode rnAF6 _Assembly.Entry_ID 4719 _Assembly.ID 1 _Assembly.Name 'Ras binding domain of rat AF6' _Assembly.BMRB_code . _Assembly.Number_of_components . _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 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4719 1 stop_ 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 AF6 1 $AF6 . . . native . . . . . 4719 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'Ras binding domain of rat AF6' system 4719 1 rnAF6 abbreviation 4719 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_AF6 _Entity.Sf_category entity _Entity.Sf_framecode AF6 _Entity.Entry_ID 4719 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name rnAF6 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MSAGGRDEERRKLADIIHHW NANRLDLFEISQPTEDLEFH GVMRFYFQDKAAGNFATKCI RVSSTATTQDVIETLAEKFR PDMRMLSSPKYSLYEVHVSG ERRLDIDEKPLVVQLNWNKD DREGRFVLKNENDAIPAKKA Q ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 141 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 16481 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-24 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 DBJ BAA32483 . "AF-6 [Homo sapiens]" . . . . . 97.87 1743 99.28 99.28 4.03e-88 . . . . 4719 1 2 no DBJ BAA32484 . "AF-6 [Homo sapiens]" . . . . . 97.87 1816 99.28 99.28 3.37e-88 . . . . 4719 1 3 no DBJ BAA32485 . "AF-6 [Homo sapiens]" . . . . . 97.87 1611 99.28 99.28 4.17e-88 . . . . 4719 1 4 no DBJ BAD92657 . "Afadin variant [Homo sapiens]" . . . . . 91.49 1639 99.22 99.22 1.76e-81 . . . . 4719 1 5 no DBJ BAE38754 . "unnamed protein product [Mus musculus]" . . . . . 100.00 162 100.00 100.00 4.51e-100 . . . . 4719 1 6 no GB AAC50059 . "ALL-1 fusion partner from chromosome 6 [Homo sapiens]" . . . . . 97.87 1612 99.28 99.28 4.75e-88 . . . . 4719 1 7 no GB AAC53390 . "l-Afadin [Rattus norvegicus]" . . . . . 100.00 1829 100.00 100.00 1.42e-90 . . . . 4719 1 8 no GB AAC53391 . "s-Afadin [Rattus norvegicus]" . . . . . 100.00 1663 100.00 100.00 1.26e-90 . . . . 4719 1 9 no GB AAD54283 . "afadin [Mus musculus]" . . . . . 100.00 320 99.29 99.29 7.52e-98 . . . . 4719 1 10 no GB AAI56049 . "Myeloid/lymphoid or mixed-lineage leukemia (trithorax homolog, Drosophila); translocated to, 4, partial [synthetic construct]" . . . . . 97.87 1612 99.28 99.28 4.18e-88 . . . . 4719 1 11 no REF NP_001035089 . "afadin isoform 2 [Homo sapiens]" . . . . . 100.00 1651 99.29 99.29 4.21e-90 . . . . 4719 1 12 no REF NP_001193937 . "afadin isoform 1 [Homo sapiens]" . . . . . 97.87 1743 99.28 99.28 4.03e-88 . . . . 4719 1 13 no REF NP_001278893 . "afadin isoform 4 [Homo sapiens]" . . . . . 70.92 1781 98.00 98.00 1.32e-56 . . . . 4719 1 14 no REF NP_034936 . "afadin [Mus musculus]" . . . . . 100.00 1820 100.00 100.00 1.86e-90 . . . . 4719 1 15 no REF NP_037349 . "afadin [Rattus norvegicus]" . . . . . 100.00 1829 100.00 100.00 1.42e-90 . . . . 4719 1 16 no SP O35889 . "RecName: Full=Afadin; AltName: Full=Protein Af-6" . . . . . 100.00 1829 100.00 100.00 1.42e-90 . . . . 4719 1 17 no SP P55196 . "RecName: Full=Afadin; AltName: Full=ALL1-fused gene from chromosome 6 protein; Short=Protein AF-6" . . . . . 100.00 1824 99.29 99.29 6.29e-90 . . . . 4719 1 18 no SP Q9QZQ1 . "RecName: Full=Afadin; AltName: Full=Protein Af-6" . . . . . 100.00 1820 100.00 100.00 1.86e-90 . . . . 4719 1 19 no TPG DAA25947 . "TPA: MLLT4 [Bos taurus]" . . . . . 73.05 1952 98.06 100.00 1.09e-61 . . . . 4719 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID AF6 abbreviation 4719 1 rnAF6 common 4719 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 . MET . 4719 1 2 . SER . 4719 1 3 . ALA . 4719 1 4 . GLY . 4719 1 5 . GLY . 4719 1 6 . ARG . 4719 1 7 . ASP . 4719 1 8 . GLU . 4719 1 9 . GLU . 4719 1 10 . ARG . 4719 1 11 . ARG . 4719 1 12 . LYS . 4719 1 13 . LEU . 4719 1 14 . ALA . 4719 1 15 . ASP . 4719 1 16 . ILE . 4719 1 17 . ILE . 4719 1 18 . HIS . 4719 1 19 . HIS . 4719 1 20 . TRP . 4719 1 21 . ASN . 4719 1 22 . ALA . 4719 1 23 . ASN . 4719 1 24 . ARG . 4719 1 25 . LEU . 4719 1 26 . ASP . 4719 1 27 . LEU . 4719 1 28 . PHE . 4719 1 29 . GLU . 4719 1 30 . ILE . 4719 1 31 . SER . 4719 1 32 . GLN . 4719 1 33 . PRO . 4719 1 34 . THR . 4719 1 35 . GLU . 4719 1 36 . ASP . 4719 1 37 . LEU . 4719 1 38 . GLU . 4719 1 39 . PHE . 4719 1 40 . HIS . 4719 1 41 . GLY . 4719 1 42 . VAL . 4719 1 43 . MET . 4719 1 44 . ARG . 4719 1 45 . PHE . 4719 1 46 . TYR . 4719 1 47 . PHE . 4719 1 48 . GLN . 4719 1 49 . ASP . 4719 1 50 . LYS . 4719 1 51 . ALA . 4719 1 52 . ALA . 4719 1 53 . GLY . 4719 1 54 . ASN . 4719 1 55 . PHE . 4719 1 56 . ALA . 4719 1 57 . THR . 4719 1 58 . LYS . 4719 1 59 . CYS . 4719 1 60 . ILE . 4719 1 61 . ARG . 4719 1 62 . VAL . 4719 1 63 . SER . 4719 1 64 . SER . 4719 1 65 . THR . 4719 1 66 . ALA . 4719 1 67 . THR . 4719 1 68 . THR . 4719 1 69 . GLN . 4719 1 70 . ASP . 4719 1 71 . VAL . 4719 1 72 . ILE . 4719 1 73 . GLU . 4719 1 74 . THR . 4719 1 75 . LEU . 4719 1 76 . ALA . 4719 1 77 . GLU . 4719 1 78 . LYS . 4719 1 79 . PHE . 4719 1 80 . ARG . 4719 1 81 . PRO . 4719 1 82 . ASP . 4719 1 83 . MET . 4719 1 84 . ARG . 4719 1 85 . MET . 4719 1 86 . LEU . 4719 1 87 . SER . 4719 1 88 . SER . 4719 1 89 . PRO . 4719 1 90 . LYS . 4719 1 91 . TYR . 4719 1 92 . SER . 4719 1 93 . LEU . 4719 1 94 . TYR . 4719 1 95 . GLU . 4719 1 96 . VAL . 4719 1 97 . HIS . 4719 1 98 . VAL . 4719 1 99 . SER . 4719 1 100 . GLY . 4719 1 101 . GLU . 4719 1 102 . ARG . 4719 1 103 . ARG . 4719 1 104 . LEU . 4719 1 105 . ASP . 4719 1 106 . ILE . 4719 1 107 . ASP . 4719 1 108 . GLU . 4719 1 109 . LYS . 4719 1 110 . PRO . 4719 1 111 . LEU . 4719 1 112 . VAL . 4719 1 113 . VAL . 4719 1 114 . GLN . 4719 1 115 . LEU . 4719 1 116 . ASN . 4719 1 117 . TRP . 4719 1 118 . ASN . 4719 1 119 . LYS . 4719 1 120 . ASP . 4719 1 121 . ASP . 4719 1 122 . ARG . 4719 1 123 . GLU . 4719 1 124 . GLY . 4719 1 125 . ARG . 4719 1 126 . PHE . 4719 1 127 . VAL . 4719 1 128 . LEU . 4719 1 129 . LYS . 4719 1 130 . ASN . 4719 1 131 . GLU . 4719 1 132 . ASN . 4719 1 133 . ASP . 4719 1 134 . ALA . 4719 1 135 . ILE . 4719 1 136 . PRO . 4719 1 137 . ALA . 4719 1 138 . LYS . 4719 1 139 . LYS . 4719 1 140 . ALA . 4719 1 141 . GLN . 4719 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 4719 1 . SER 2 2 4719 1 . ALA 3 3 4719 1 . GLY 4 4 4719 1 . GLY 5 5 4719 1 . ARG 6 6 4719 1 . ASP 7 7 4719 1 . GLU 8 8 4719 1 . GLU 9 9 4719 1 . ARG 10 10 4719 1 . ARG 11 11 4719 1 . LYS 12 12 4719 1 . LEU 13 13 4719 1 . ALA 14 14 4719 1 . ASP 15 15 4719 1 . ILE 16 16 4719 1 . ILE 17 17 4719 1 . HIS 18 18 4719 1 . HIS 19 19 4719 1 . TRP 20 20 4719 1 . ASN 21 21 4719 1 . ALA 22 22 4719 1 . ASN 23 23 4719 1 . ARG 24 24 4719 1 . LEU 25 25 4719 1 . ASP 26 26 4719 1 . LEU 27 27 4719 1 . PHE 28 28 4719 1 . GLU 29 29 4719 1 . ILE 30 30 4719 1 . SER 31 31 4719 1 . GLN 32 32 4719 1 . PRO 33 33 4719 1 . THR 34 34 4719 1 . GLU 35 35 4719 1 . ASP 36 36 4719 1 . LEU 37 37 4719 1 . GLU 38 38 4719 1 . PHE 39 39 4719 1 . HIS 40 40 4719 1 . GLY 41 41 4719 1 . VAL 42 42 4719 1 . MET 43 43 4719 1 . ARG 44 44 4719 1 . PHE 45 45 4719 1 . TYR 46 46 4719 1 . PHE 47 47 4719 1 . GLN 48 48 4719 1 . ASP 49 49 4719 1 . LYS 50 50 4719 1 . ALA 51 51 4719 1 . ALA 52 52 4719 1 . GLY 53 53 4719 1 . ASN 54 54 4719 1 . PHE 55 55 4719 1 . ALA 56 56 4719 1 . THR 57 57 4719 1 . LYS 58 58 4719 1 . CYS 59 59 4719 1 . ILE 60 60 4719 1 . ARG 61 61 4719 1 . VAL 62 62 4719 1 . SER 63 63 4719 1 . SER 64 64 4719 1 . THR 65 65 4719 1 . ALA 66 66 4719 1 . THR 67 67 4719 1 . THR 68 68 4719 1 . GLN 69 69 4719 1 . ASP 70 70 4719 1 . VAL 71 71 4719 1 . ILE 72 72 4719 1 . GLU 73 73 4719 1 . THR 74 74 4719 1 . LEU 75 75 4719 1 . ALA 76 76 4719 1 . GLU 77 77 4719 1 . LYS 78 78 4719 1 . PHE 79 79 4719 1 . ARG 80 80 4719 1 . PRO 81 81 4719 1 . ASP 82 82 4719 1 . MET 83 83 4719 1 . ARG 84 84 4719 1 . MET 85 85 4719 1 . LEU 86 86 4719 1 . SER 87 87 4719 1 . SER 88 88 4719 1 . PRO 89 89 4719 1 . LYS 90 90 4719 1 . TYR 91 91 4719 1 . SER 92 92 4719 1 . LEU 93 93 4719 1 . TYR 94 94 4719 1 . GLU 95 95 4719 1 . VAL 96 96 4719 1 . HIS 97 97 4719 1 . VAL 98 98 4719 1 . SER 99 99 4719 1 . GLY 100 100 4719 1 . GLU 101 101 4719 1 . ARG 102 102 4719 1 . ARG 103 103 4719 1 . LEU 104 104 4719 1 . ASP 105 105 4719 1 . ILE 106 106 4719 1 . ASP 107 107 4719 1 . GLU 108 108 4719 1 . LYS 109 109 4719 1 . PRO 110 110 4719 1 . LEU 111 111 4719 1 . VAL 112 112 4719 1 . VAL 113 113 4719 1 . GLN 114 114 4719 1 . LEU 115 115 4719 1 . ASN 116 116 4719 1 . TRP 117 117 4719 1 . ASN 118 118 4719 1 . LYS 119 119 4719 1 . ASP 120 120 4719 1 . ASP 121 121 4719 1 . ARG 122 122 4719 1 . GLU 123 123 4719 1 . GLY 124 124 4719 1 . ARG 125 125 4719 1 . PHE 126 126 4719 1 . VAL 127 127 4719 1 . LEU 128 128 4719 1 . LYS 129 129 4719 1 . ASN 130 130 4719 1 . GLU 131 131 4719 1 . ASN 132 132 4719 1 . ASP 133 133 4719 1 . ALA 134 134 4719 1 . ILE 135 135 4719 1 . PRO 136 136 4719 1 . ALA 137 137 4719 1 . LYS 138 138 4719 1 . LYS 139 139 4719 1 . ALA 140 140 4719 1 . GLN 141 141 4719 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 4719 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $AF6 . 10116 . . 'Rattus norwegicus' rat . . Eukaryota Metazoa Rattus norwegicus . . . . . . . . . . . . . . . . . . . . . 4719 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 4719 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $AF6 . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . . . . . . . . 4719 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_unlabeled_protein _Sample.Sf_category sample _Sample.Sf_framecode unlabeled_protein _Sample.Entry_ID 4719 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 rnAF6 . . . 1 $AF6 . . 0.9 . . mM . . . . 4719 1 stop_ save_ save_15N_labeled_protein _Sample.Sf_category sample _Sample.Sf_framecode 15N_labeled_protein _Sample.Entry_ID 4719 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 rnAF6 [U-15N] . . 1 $AF6 . . 1.3 . . mM . . . . 4719 2 stop_ save_ save_13C_15N_labeled_protein _Sample.Sf_category sample _Sample.Sf_framecode 13C_15N_labeled_protein _Sample.Entry_ID 4719 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 rnAF6 '[U-13C; U-15N]' . . 1 $AF6 . . . 1.0 1.3 mM . . . . 4719 3 stop_ save_ ####################### # Sample conditions # ####################### save_standard_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode standard_conditions _Sample_condition_list.Entry_ID 4719 _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 pH 6.9 0.2 n/a 4719 1 temperature 303 5 K 4719 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 4719 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 4719 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 4719 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 4719 _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 NMR_spectrometer_1 Bruker DMX . 500 . . . 4719 1 2 NMR_spectrometer_2 Bruker DRX . 600 . . . 4719 1 3 NMR_spectrometer_3 Bruker DRX . 800 . . . 4719 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 4719 _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 '1H-15N HSQC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4719 1 2 HNCA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4719 1 3 HNCO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4719 1 4 HN(CO)CA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4719 1 5 CBCA(CO)NH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4719 1 6 CBCANH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4719 1 7 15N-TOCSY-HSQC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4719 1 8 15N-NOESY-HSQC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4719 1 9 HCCH-TOCSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4719 1 10 13C-NOESY-HSQC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4719 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 4719 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '1H-15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 4719 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name HNCA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 4719 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HNCO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 4719 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HN(CO)CA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 4719 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name CBCA(CO)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 4719 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name CBCANH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 4719 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name 15N-TOCSY-HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 4719 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name 15N-NOESY-HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_9 _NMR_spec_expt.Entry_ID 4719 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name HCCH-TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_10 _NMR_spec_expt.Entry_ID 4719 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name 13C-NOESY-HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 4719 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 4719 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 4719 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 4719 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_H_HA_C_CA_CB_and_N_chemical_shifts_of_AF6 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode H_HA_C_CA_CB_and_N_chemical_shifts_of_AF6 _Assigned_chem_shift_list.Entry_ID 4719 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $standard_conditions _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 ; There are some values missing in the chemical shift table due to weak signals in our spectra which don't provide enough information for an unambiguous sequential assignment (e.g. in regions of high mobility or possibly chemical exchange processes). ; _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 . . 2 $15N_labeled_protein . 4719 1 . . 3 $13C_15N_labeled_protein . 4719 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 2 2 SER H H 1 8.36 0.02 . 1 . . . . . . . . 4719 1 2 . 1 1 2 2 SER HA H 1 4.46 0.02 . 1 . . . . . . . . 4719 1 3 . 1 1 2 2 SER HB2 H 1 3.87 0.02 . 1 . . . . . . . . 4719 1 4 . 1 1 2 2 SER HB3 H 1 3.84 0.02 . 1 . . . . . . . . 4719 1 5 . 1 1 2 2 SER CA C 13 58.02 0.04 . 1 . . . . . . . . 4719 1 6 . 1 1 2 2 SER CB C 13 63.84 0.04 . 1 . . . . . . . . 4719 1 7 . 1 1 2 2 SER N N 15 116.91 0.05 . 1 . . . . . . . . 4719 1 8 . 1 1 3 3 ALA H H 1 8.56 0.02 . 1 . . . . . . . . 4719 1 9 . 1 1 3 3 ALA HA H 1 4.34 0.02 . 1 . . . . . . . . 4719 1 10 . 1 1 3 3 ALA HB1 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 11 . 1 1 3 3 ALA HB2 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 12 . 1 1 3 3 ALA HB3 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 13 . 1 1 3 3 ALA C C 13 178.59 0.04 . 1 . . . . . . . . 4719 1 14 . 1 1 3 3 ALA CA C 13 52.82 0.04 . 1 . . . . . . . . 4719 1 15 . 1 1 3 3 ALA CB C 13 19.04 0.04 . 1 . . . . . . . . 4719 1 16 . 1 1 3 3 ALA N N 15 126.23 0.05 . 1 . . . . . . . . 4719 1 17 . 1 1 4 4 GLY H H 1 8.48 0.02 . 1 . . . . . . . . 4719 1 18 . 1 1 4 4 GLY C C 13 175.34 0.04 . 1 . . . . . . . . 4719 1 19 . 1 1 4 4 GLY CA C 13 45.44 0.04 . 1 . . . . . . . . 4719 1 20 . 1 1 4 4 GLY N N 15 108.93 0.05 . 1 . . . . . . . . 4719 1 21 . 1 1 5 5 GLY H H 1 8.41 0.02 . 1 . . . . . . . . 4719 1 22 . 1 1 5 5 GLY C C 13 175.42 0.04 . 1 . . . . . . . . 4719 1 23 . 1 1 5 5 GLY CA C 13 45.56 0.04 . 1 . . . . . . . . 4719 1 24 . 1 1 5 5 GLY N N 15 109.63 0.05 . 1 . . . . . . . . 4719 1 25 . 1 1 6 6 ARG H H 1 8.55 0.02 . 1 . . . . . . . . 4719 1 26 . 1 1 6 6 ARG C C 13 177.79 0.04 . 1 . . . . . . . . 4719 1 27 . 1 1 6 6 ARG CA C 13 57.63 0.04 . 1 . . . . . . . . 4719 1 28 . 1 1 6 6 ARG CB C 13 29.93 0.04 . 1 . . . . . . . . 4719 1 29 . 1 1 6 6 ARG N N 15 121.60 0.05 . 1 . . . . . . . . 4719 1 30 . 1 1 7 7 ASP H H 1 8.42 0.02 . 1 . . . . . . . . 4719 1 31 . 1 1 7 7 ASP HA H 1 4.42 0.02 . 1 . . . . . . . . 4719 1 32 . 1 1 7 7 ASP HB2 H 1 2.74 0.02 . 1 . . . . . . . . 4719 1 33 . 1 1 7 7 ASP HB3 H 1 2.68 0.02 . 1 . . . . . . . . 4719 1 34 . 1 1 7 7 ASP C C 13 178.60 0.04 . 1 . . . . . . . . 4719 1 35 . 1 1 7 7 ASP CA C 13 57.26 0.04 . 1 . . . . . . . . 4719 1 36 . 1 1 7 7 ASP CB C 13 40.69 0.04 . 1 . . . . . . . . 4719 1 37 . 1 1 7 7 ASP N N 15 119.22 0.05 . 1 . . . . . . . . 4719 1 38 . 1 1 8 8 GLU H H 1 8.17 0.02 . 1 . . . . . . . . 4719 1 39 . 1 1 8 8 GLU HA H 1 4.10 0.02 . 1 . . . . . . . . 4719 1 40 . 1 1 8 8 GLU HB2 H 1 2.04 0.02 . 1 . . . . . . . . 4719 1 41 . 1 1 8 8 GLU C C 13 179.00 0.04 . 1 . . . . . . . . 4719 1 42 . 1 1 8 8 GLU CA C 13 59.31 0.04 . 1 . . . . . . . . 4719 1 43 . 1 1 8 8 GLU CB C 13 29.33 0.04 . 1 . . . . . . . . 4719 1 44 . 1 1 8 8 GLU N N 15 120.18 0.05 . 1 . . . . . . . . 4719 1 45 . 1 1 9 9 GLU H H 1 8.13 0.02 . 1 . . . . . . . . 4719 1 46 . 1 1 9 9 GLU HA H 1 4.03 0.02 . 1 . . . . . . . . 4719 1 47 . 1 1 9 9 GLU C C 13 179.38 0.04 . 1 . . . . . . . . 4719 1 48 . 1 1 9 9 GLU CA C 13 59.31 0.04 . 1 . . . . . . . . 4719 1 49 . 1 1 9 9 GLU CB C 13 29.36 0.04 . 1 . . . . . . . . 4719 1 50 . 1 1 9 9 GLU N N 15 119.94 0.05 . 1 . . . . . . . . 4719 1 51 . 1 1 10 10 ARG H H 1 8.49 0.02 . 1 . . . . . . . . 4719 1 52 . 1 1 10 10 ARG HA H 1 3.72 0.02 . 1 . . . . . . . . 4719 1 53 . 1 1 10 10 ARG HB2 H 1 1.85 0.02 . 1 . . . . . . . . 4719 1 54 . 1 1 10 10 ARG HG2 H 1 1.48 0.02 . 1 . . . . . . . . 4719 1 55 . 1 1 10 10 ARG C C 13 177.72 0.04 . 1 . . . . . . . . 4719 1 56 . 1 1 10 10 ARG CA C 13 60.17 0.04 . 1 . . . . . . . . 4719 1 57 . 1 1 10 10 ARG CB C 13 29.83 0.04 . 1 . . . . . . . . 4719 1 58 . 1 1 10 10 ARG N N 15 120.89 0.05 . 1 . . . . . . . . 4719 1 59 . 1 1 11 11 ARG H H 1 8.02 0.02 . 1 . . . . . . . . 4719 1 60 . 1 1 11 11 ARG HA H 1 3.94 0.02 . 1 . . . . . . . . 4719 1 61 . 1 1 11 11 ARG HB2 H 1 1.79 0.02 . 1 . . . . . . . . 4719 1 62 . 1 1 11 11 ARG HG2 H 1 1.66 0.02 . 1 . . . . . . . . 4719 1 63 . 1 1 11 11 ARG HD2 H 1 3.23 0.02 . 1 . . . . . . . . 4719 1 64 . 1 1 11 11 ARG C C 13 179.03 0.04 . 1 . . . . . . . . 4719 1 65 . 1 1 11 11 ARG CA C 13 59.43 0.04 . 1 . . . . . . . . 4719 1 66 . 1 1 11 11 ARG CB C 13 29.96 0.04 . 1 . . . . . . . . 4719 1 67 . 1 1 11 11 ARG N N 15 118.54 0.05 . 1 . . . . . . . . 4719 1 68 . 1 1 12 12 LYS H H 1 7.98 0.02 . 1 . . . . . . . . 4719 1 69 . 1 1 12 12 LYS HA H 1 4.10 0.02 . 1 . . . . . . . . 4719 1 70 . 1 1 12 12 LYS HB2 H 1 1.87 0.02 . 1 . . . . . . . . 4719 1 71 . 1 1 12 12 LYS HG2 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 72 . 1 1 12 12 LYS HD2 H 1 1.66 0.02 . 1 . . . . . . . . 4719 1 73 . 1 1 12 12 LYS HE2 H 1 3.18 0.02 . 1 . . . . . . . . 4719 1 74 . 1 1 12 12 LYS C C 13 179.63 0.04 . 1 . . . . . . . . 4719 1 75 . 1 1 12 12 LYS CA C 13 59.47 0.04 . 1 . . . . . . . . 4719 1 76 . 1 1 12 12 LYS CB C 13 32.42 0.04 . 1 . . . . . . . . 4719 1 77 . 1 1 12 12 LYS CE C 13 42.81 0.04 . 1 . . . . . . . . 4719 1 78 . 1 1 12 12 LYS N N 15 119.24 0.05 . 1 . . . . . . . . 4719 1 79 . 1 1 13 13 LEU H H 1 7.95 0.02 . 1 . . . . . . . . 4719 1 80 . 1 1 13 13 LEU HA H 1 4.10 0.02 . 1 . . . . . . . . 4719 1 81 . 1 1 13 13 LEU HB2 H 1 1.70 0.02 . 1 . . . . . . . . 4719 1 82 . 1 1 13 13 LEU HB3 H 1 1.60 0.02 . 1 . . . . . . . . 4719 1 83 . 1 1 13 13 LEU HD11 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 84 . 1 1 13 13 LEU HD12 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 85 . 1 1 13 13 LEU HD13 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 86 . 1 1 13 13 LEU C C 13 178.19 0.04 . 1 . . . . . . . . 4719 1 87 . 1 1 13 13 LEU CA C 13 57.26 0.04 . 1 . . . . . . . . 4719 1 88 . 1 1 13 13 LEU CB C 13 42.18 0.04 . 1 . . . . . . . . 4719 1 89 . 1 1 13 13 LEU CD1 C 13 22.70 0.04 . 1 . . . . . . . . 4719 1 90 . 1 1 13 13 LEU N N 15 120.65 0.05 . 1 . . . . . . . . 4719 1 91 . 1 1 14 14 ALA H H 1 8.83 0.02 . 1 . . . . . . . . 4719 1 92 . 1 1 14 14 ALA HA H 1 3.76 0.02 . 1 . . . . . . . . 4719 1 93 . 1 1 14 14 ALA HB1 H 1 1.58 0.02 . 1 . . . . . . . . 4719 1 94 . 1 1 14 14 ALA HB2 H 1 1.58 0.02 . 1 . . . . . . . . 4719 1 95 . 1 1 14 14 ALA HB3 H 1 1.58 0.02 . 1 . . . . . . . . 4719 1 96 . 1 1 14 14 ALA C C 13 180.19 0.04 . 1 . . . . . . . . 4719 1 97 . 1 1 14 14 ALA CA C 13 55.40 0.04 . 1 . . . . . . . . 4719 1 98 . 1 1 14 14 ALA CB C 13 17.77 0.04 . 1 . . . . . . . . 4719 1 99 . 1 1 14 14 ALA N N 15 121.11 0.05 . 1 . . . . . . . . 4719 1 100 . 1 1 15 15 ASP H H 1 7.90 0.02 . 1 . . . . . . . . 4719 1 101 . 1 1 15 15 ASP HA H 1 4.60 0.02 . 1 . . . . . . . . 4719 1 102 . 1 1 15 15 ASP HB2 H 1 2.89 0.02 . 1 . . . . . . . . 4719 1 103 . 1 1 15 15 ASP HB3 H 1 2.79 0.02 . 1 . . . . . . . . 4719 1 104 . 1 1 15 15 ASP C C 13 179.12 0.04 . 1 . . . . . . . . 4719 1 105 . 1 1 15 15 ASP CA C 13 57.54 0.04 . 1 . . . . . . . . 4719 1 106 . 1 1 15 15 ASP CB C 13 40.73 0.04 . 1 . . . . . . . . 4719 1 107 . 1 1 15 15 ASP N N 15 118.54 0.05 . 1 . . . . . . . . 4719 1 108 . 1 1 16 16 ILE H H 1 7.90 0.02 . 1 . . . . . . . . 4719 1 109 . 1 1 16 16 ILE HA H 1 3.89 0.02 . 1 . . . . . . . . 4719 1 110 . 1 1 16 16 ILE HB H 1 2.13 0.02 . 1 . . . . . . . . 4719 1 111 . 1 1 16 16 ILE HG12 H 1 1.90 0.02 . 1 . . . . . . . . 4719 1 112 . 1 1 16 16 ILE HG13 H 1 1.26 0.02 . 1 . . . . . . . . 4719 1 113 . 1 1 16 16 ILE HG21 H 1 0.96 0.02 . 1 . . . . . . . . 4719 1 114 . 1 1 16 16 ILE HG22 H 1 0.96 0.02 . 1 . . . . . . . . 4719 1 115 . 1 1 16 16 ILE HG23 H 1 0.96 0.02 . 1 . . . . . . . . 4719 1 116 . 1 1 16 16 ILE HD11 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 117 . 1 1 16 16 ILE HD12 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 118 . 1 1 16 16 ILE HD13 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 119 . 1 1 16 16 ILE C C 13 179.88 0.04 . 1 . . . . . . . . 4719 1 120 . 1 1 16 16 ILE CA C 13 65.54 0.04 . 1 . . . . . . . . 4719 1 121 . 1 1 16 16 ILE CB C 13 38.16 0.04 . 1 . . . . . . . . 4719 1 122 . 1 1 16 16 ILE CG1 C 13 29.24 0.04 . 1 . . . . . . . . 4719 1 123 . 1 1 16 16 ILE CG2 C 13 17.01 0.04 . 1 . . . . . . . . 4719 1 124 . 1 1 16 16 ILE CD1 C 13 13.23 0.04 . 1 . . . . . . . . 4719 1 125 . 1 1 16 16 ILE N N 15 122.29 0.05 . 1 . . . . . . . . 4719 1 126 . 1 1 17 17 ILE H H 1 8.48 0.02 . 1 . . . . . . . . 4719 1 127 . 1 1 17 17 ILE HA H 1 3.52 0.02 . 1 . . . . . . . . 4719 1 128 . 1 1 17 17 ILE HB H 1 1.60 0.02 . 1 . . . . . . . . 4719 1 129 . 1 1 17 17 ILE HG12 H 1 1.36 0.02 . 1 . . . . . . . . 4719 1 130 . 1 1 17 17 ILE HG13 H 1 0.39 0.02 . 1 . . . . . . . . 4719 1 131 . 1 1 17 17 ILE HG21 H 1 0.72 0.02 . 1 . . . . . . . . 4719 1 132 . 1 1 17 17 ILE HG22 H 1 0.72 0.02 . 1 . . . . . . . . 4719 1 133 . 1 1 17 17 ILE HG23 H 1 0.72 0.02 . 1 . . . . . . . . 4719 1 134 . 1 1 17 17 ILE HD11 H 1 0.05 0.02 . 1 . . . . . . . . 4719 1 135 . 1 1 17 17 ILE HD12 H 1 0.05 0.02 . 1 . . . . . . . . 4719 1 136 . 1 1 17 17 ILE HD13 H 1 0.05 0.02 . 1 . . . . . . . . 4719 1 137 . 1 1 17 17 ILE C C 13 177.57 0.04 . 1 . . . . . . . . 4719 1 138 . 1 1 17 17 ILE CA C 13 66.28 0.04 . 1 . . . . . . . . 4719 1 139 . 1 1 17 17 ILE CB C 13 38.77 0.04 . 1 . . . . . . . . 4719 1 140 . 1 1 17 17 ILE CG1 C 13 31.74 0.04 . 1 . . . . . . . . 4719 1 141 . 1 1 17 17 ILE CG2 C 13 17.65 0.04 . 1 . . . . . . . . 4719 1 142 . 1 1 17 17 ILE CD1 C 13 13.23 0.04 . 1 . . . . . . . . 4719 1 143 . 1 1 17 17 ILE N N 15 123.22 0.05 . 1 . . . . . . . . 4719 1 144 . 1 1 18 18 HIS H H 1 8.73 0.02 . 1 . . . . . . . . 4719 1 145 . 1 1 18 18 HIS HA H 1 4.45 0.02 . 1 . . . . . . . . 4719 1 146 . 1 1 18 18 HIS HB2 H 1 3.32 0.02 . 1 . . . . . . . . 4719 1 147 . 1 1 18 18 HIS HB3 H 1 3.30 0.02 . 1 . . . . . . . . 4719 1 148 . 1 1 18 18 HIS C C 13 179.17 0.04 . 1 . . . . . . . . 4719 1 149 . 1 1 18 18 HIS CA C 13 60.17 0.04 . 1 . . . . . . . . 4719 1 150 . 1 1 18 18 HIS CB C 13 30.35 0.04 . 1 . . . . . . . . 4719 1 151 . 1 1 18 18 HIS N N 15 119.71 0.05 . 1 . . . . . . . . 4719 1 152 . 1 1 19 19 HIS H H 1 8.19 0.02 . 1 . . . . . . . . 4719 1 153 . 1 1 19 19 HIS HA H 1 4.28 0.02 . 1 . . . . . . . . 4719 1 154 . 1 1 19 19 HIS HB2 H 1 3.26 0.02 . 1 . . . . . . . . 4719 1 155 . 1 1 19 19 HIS HB3 H 1 3.26 0.02 . 1 . . . . . . . . 4719 1 156 . 1 1 19 19 HIS C C 13 178.07 0.04 . 1 . . . . . . . . 4719 1 157 . 1 1 19 19 HIS CA C 13 60.04 0.04 . 1 . . . . . . . . 4719 1 158 . 1 1 19 19 HIS CB C 13 30.00 0.04 . 1 . . . . . . . . 4719 1 159 . 1 1 19 19 HIS N N 15 117.36 0.05 . 1 . . . . . . . . 4719 1 160 . 1 1 20 20 TRP H H 1 8.60 0.02 . 1 . . . . . . . . 4719 1 161 . 1 1 20 20 TRP HA H 1 3.92 0.02 . 1 . . . . . . . . 4719 1 162 . 1 1 20 20 TRP HB2 H 1 3.46 0.02 . 1 . . . . . . . . 4719 1 163 . 1 1 20 20 TRP HB3 H 1 3.31 0.02 . 1 . . . . . . . . 4719 1 164 . 1 1 20 20 TRP C C 13 179.28 0.04 . 1 . . . . . . . . 4719 1 165 . 1 1 20 20 TRP CA C 13 62.55 0.04 . 1 . . . . . . . . 4719 1 166 . 1 1 20 20 TRP CB C 13 30.34 0.04 . 1 . . . . . . . . 4719 1 167 . 1 1 20 20 TRP N N 15 123.69 0.05 . 1 . . . . . . . . 4719 1 168 . 1 1 21 21 ASN H H 1 9.16 0.02 . 1 . . . . . . . . 4719 1 169 . 1 1 21 21 ASN HA H 1 4.50 0.02 . 1 . . . . . . . . 4719 1 170 . 1 1 21 21 ASN C C 13 178.37 0.04 . 1 . . . . . . . . 4719 1 171 . 1 1 21 21 ASN CA C 13 55.69 0.04 . 1 . . . . . . . . 4719 1 172 . 1 1 21 21 ASN CB C 13 38.67 0.04 . 1 . . . . . . . . 4719 1 173 . 1 1 21 21 ASN N N 15 116.19 0.05 . 1 . . . . . . . . 4719 1 174 . 1 1 22 22 ALA H H 1 7.51 0.02 . 1 . . . . . . . . 4719 1 175 . 1 1 22 22 ALA HA H 1 4.20 0.02 . 1 . . . . . . . . 4719 1 176 . 1 1 22 22 ALA HB1 H 1 1.44 0.02 . 1 . . . . . . . . 4719 1 177 . 1 1 22 22 ALA HB2 H 1 1.44 0.02 . 1 . . . . . . . . 4719 1 178 . 1 1 22 22 ALA HB3 H 1 1.44 0.02 . 1 . . . . . . . . 4719 1 179 . 1 1 22 22 ALA C C 13 177.72 0.04 . 1 . . . . . . . . 4719 1 180 . 1 1 22 22 ALA CA C 13 53.41 0.04 . 1 . . . . . . . . 4719 1 181 . 1 1 22 22 ALA CB C 13 18.63 0.04 . 1 . . . . . . . . 4719 1 182 . 1 1 22 22 ALA N N 15 120.41 0.05 . 1 . . . . . . . . 4719 1 183 . 1 1 23 23 ASN H H 1 7.50 0.02 . 1 . . . . . . . . 4719 1 184 . 1 1 23 23 ASN HA H 1 4.88 0.02 . 1 . . . . . . . . 4719 1 185 . 1 1 23 23 ASN HB2 H 1 2.67 0.02 . 1 . . . . . . . . 4719 1 186 . 1 1 23 23 ASN HB3 H 1 2.29 0.02 . 1 . . . . . . . . 4719 1 187 . 1 1 23 23 ASN C C 13 174.65 0.04 . 1 . . . . . . . . 4719 1 188 . 1 1 23 23 ASN CA C 13 52.44 0.04 . 1 . . . . . . . . 4719 1 189 . 1 1 23 23 ASN CB C 13 40.62 0.04 . 1 . . . . . . . . 4719 1 190 . 1 1 23 23 ASN N N 15 116.66 0.05 . 1 . . . . . . . . 4719 1 191 . 1 1 24 24 ARG H H 1 7.21 0.02 . 1 . . . . . . . . 4719 1 192 . 1 1 24 24 ARG HA H 1 3.63 0.02 . 1 . . . . . . . . 4719 1 193 . 1 1 24 24 ARG HB2 H 1 2.17 0.02 . 1 . . . . . . . . 4719 1 194 . 1 1 24 24 ARG HG2 H 1 1.67 0.02 . 1 . . . . . . . . 4719 1 195 . 1 1 24 24 ARG HD2 H 1 3.15 0.02 . 1 . . . . . . . . 4719 1 196 . 1 1 24 24 ARG C C 13 174.63 0.04 . 1 . . . . . . . . 4719 1 197 . 1 1 24 24 ARG CA C 13 55.91 0.04 . 1 . . . . . . . . 4719 1 198 . 1 1 24 24 ARG CB C 13 30.13 0.04 . 1 . . . . . . . . 4719 1 199 . 1 1 24 24 ARG N N 15 118.30 0.05 . 1 . . . . . . . . 4719 1 200 . 1 1 25 25 LEU H H 1 8.31 0.02 . 1 . . . . . . . . 4719 1 201 . 1 1 25 25 LEU HA H 1 3.66 0.02 . 1 . . . . . . . . 4719 1 202 . 1 1 25 25 LEU HB2 H 1 1.71 0.02 . 1 . . . . . . . . 4719 1 203 . 1 1 25 25 LEU HB3 H 1 1.19 0.02 . 1 . . . . . . . . 4719 1 204 . 1 1 25 25 LEU HG H 1 1.50 0.02 . 1 . . . . . . . . 4719 1 205 . 1 1 25 25 LEU HD11 H 1 0.47 0.02 . 1 . . . . . . . . 4719 1 206 . 1 1 25 25 LEU HD12 H 1 0.47 0.02 . 1 . . . . . . . . 4719 1 207 . 1 1 25 25 LEU HD13 H 1 0.47 0.02 . 1 . . . . . . . . 4719 1 208 . 1 1 25 25 LEU HD21 H 1 0.12 0.02 . 1 . . . . . . . . 4719 1 209 . 1 1 25 25 LEU HD22 H 1 0.12 0.02 . 1 . . . . . . . . 4719 1 210 . 1 1 25 25 LEU HD23 H 1 0.12 0.02 . 1 . . . . . . . . 4719 1 211 . 1 1 25 25 LEU C C 13 177.22 0.04 . 1 . . . . . . . . 4719 1 212 . 1 1 25 25 LEU CA C 13 56.14 0.04 . 1 . . . . . . . . 4719 1 213 . 1 1 25 25 LEU CB C 13 41.89 0.04 . 1 . . . . . . . . 4719 1 214 . 1 1 25 25 LEU CG C 13 25.34 0.04 . 1 . . . . . . . . 4719 1 215 . 1 1 25 25 LEU CD1 C 13 21.07 0.04 . 1 . . . . . . . . 4719 1 216 . 1 1 25 25 LEU CD2 C 13 25.34 0.04 . 1 . . . . . . . . 4719 1 217 . 1 1 25 25 LEU N N 15 118.77 0.05 . 1 . . . . . . . . 4719 1 218 . 1 1 26 26 ASP H H 1 8.27 0.02 . 1 . . . . . . . . 4719 1 219 . 1 1 26 26 ASP HA H 1 4.70 0.02 . 1 . . . . . . . . 4719 1 220 . 1 1 26 26 ASP HB2 H 1 2.83 0.02 . 1 . . . . . . . . 4719 1 221 . 1 1 26 26 ASP HB3 H 1 2.58 0.02 . 1 . . . . . . . . 4719 1 222 . 1 1 26 26 ASP CA C 13 53.86 0.04 . 1 . . . . . . . . 4719 1 223 . 1 1 26 26 ASP N N 15 121.58 0.05 . 1 . . . . . . . . 4719 1 224 . 1 1 27 27 LEU HA H 1 3.08 0.02 . 1 . . . . . . . . 4719 1 225 . 1 1 27 27 LEU HB2 H 1 1.82 0.02 . 1 . . . . . . . . 4719 1 226 . 1 1 27 27 LEU HB3 H 1 1.04 0.02 . 1 . . . . . . . . 4719 1 227 . 1 1 27 27 LEU HG H 1 1.31 0.02 . 1 . . . . . . . . 4719 1 228 . 1 1 27 27 LEU HD11 H 1 0.54 0.02 . 1 . . . . . . . . 4719 1 229 . 1 1 27 27 LEU HD12 H 1 0.54 0.02 . 1 . . . . . . . . 4719 1 230 . 1 1 27 27 LEU HD13 H 1 0.54 0.02 . 1 . . . . . . . . 4719 1 231 . 1 1 27 27 LEU HD21 H 1 0.32 0.02 . 1 . . . . . . . . 4719 1 232 . 1 1 27 27 LEU HD22 H 1 0.32 0.02 . 1 . . . . . . . . 4719 1 233 . 1 1 27 27 LEU HD23 H 1 0.32 0.02 . 1 . . . . . . . . 4719 1 234 . 1 1 27 27 LEU CA C 13 56.17 0.04 . 1 . . . . . . . . 4719 1 235 . 1 1 27 27 LEU CB C 13 41.35 0.04 . 1 . . . . . . . . 4719 1 236 . 1 1 27 27 LEU CG C 13 25.87 0.04 . 1 . . . . . . . . 4719 1 237 . 1 1 27 27 LEU CD1 C 13 25.87 0.04 . 1 . . . . . . . . 4719 1 238 . 1 1 27 27 LEU CD2 C 13 22.67 0.04 . 1 . . . . . . . . 4719 1 239 . 1 1 30 30 ILE HA H 1 4.67 0.02 . 1 . . . . . . . . 4719 1 240 . 1 1 30 30 ILE HB H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 241 . 1 1 30 30 ILE HG12 H 1 1.83 0.02 . 1 . . . . . . . . 4719 1 242 . 1 1 30 30 ILE HG13 H 1 0.68 0.02 . 1 . . . . . . . . 4719 1 243 . 1 1 30 30 ILE HG21 H 1 1.08 0.02 . 1 . . . . . . . . 4719 1 244 . 1 1 30 30 ILE HG22 H 1 1.08 0.02 . 1 . . . . . . . . 4719 1 245 . 1 1 30 30 ILE HG23 H 1 1.08 0.02 . 1 . . . . . . . . 4719 1 246 . 1 1 30 30 ILE HD11 H 1 -0.30 0.02 . 1 . . . . . . . . 4719 1 247 . 1 1 30 30 ILE HD12 H 1 -0.30 0.02 . 1 . . . . . . . . 4719 1 248 . 1 1 30 30 ILE HD13 H 1 -0.30 0.02 . 1 . . . . . . . . 4719 1 249 . 1 1 30 30 ILE C C 13 176.67 0.04 . 1 . . . . . . . . 4719 1 250 . 1 1 30 30 ILE CA C 13 61.30 0.04 . 1 . . . . . . . . 4719 1 251 . 1 1 30 30 ILE CB C 13 39.59 0.04 . 1 . . . . . . . . 4719 1 252 . 1 1 30 30 ILE CG1 C 13 29.55 0.04 . 1 . . . . . . . . 4719 1 253 . 1 1 30 30 ILE CG2 C 13 18.94 0.04 . 1 . . . . . . . . 4719 1 254 . 1 1 30 30 ILE CD1 C 13 12.00 0.04 . 1 . . . . . . . . 4719 1 255 . 1 1 31 31 SER H H 1 9.18 0.02 . 1 . . . . . . . . 4719 1 256 . 1 1 31 31 SER HA H 1 4.25 0.02 . 1 . . . . . . . . 4719 1 257 . 1 1 31 31 SER HB2 H 1 4.11 0.02 . 1 . . . . . . . . 4719 1 258 . 1 1 31 31 SER HB3 H 1 3.53 0.02 . 1 . . . . . . . . 4719 1 259 . 1 1 31 31 SER C C 13 171.59 0.04 . 1 . . . . . . . . 4719 1 260 . 1 1 31 31 SER CA C 13 59.04 0.04 . 1 . . . . . . . . 4719 1 261 . 1 1 31 31 SER CB C 13 64.49 0.04 . 1 . . . . . . . . 4719 1 262 . 1 1 31 31 SER N N 15 124.86 0.05 . 1 . . . . . . . . 4719 1 263 . 1 1 32 32 GLN H H 1 7.94 0.02 . 1 . . . . . . . . 4719 1 264 . 1 1 32 32 GLN HA H 1 4.28 0.02 . 1 . . . . . . . . 4719 1 265 . 1 1 32 32 GLN HB2 H 1 2.09 0.02 . 1 . . . . . . . . 4719 1 266 . 1 1 32 32 GLN HB3 H 1 1.95 0.02 . 1 . . . . . . . . 4719 1 267 . 1 1 32 32 GLN HG2 H 1 2.54 0.02 . 1 . . . . . . . . 4719 1 268 . 1 1 32 32 GLN HG3 H 1 2.46 0.02 . 1 . . . . . . . . 4719 1 269 . 1 1 32 32 GLN CA C 13 53.68 0.04 . 1 . . . . . . . . 4719 1 270 . 1 1 32 32 GLN CB C 13 28.15 0.04 . 1 . . . . . . . . 4719 1 271 . 1 1 32 32 GLN CG C 13 33.66 0.04 . 1 . . . . . . . . 4719 1 272 . 1 1 32 32 GLN N N 15 114.08 0.05 . 1 . . . . . . . . 4719 1 273 . 1 1 33 33 PRO HA H 1 5.18 0.02 . 1 . . . . . . . . 4719 1 274 . 1 1 33 33 PRO HB2 H 1 1.97 0.02 . 1 . . . . . . . . 4719 1 275 . 1 1 33 33 PRO HB3 H 1 1.89 0.02 . 1 . . . . . . . . 4719 1 276 . 1 1 33 33 PRO HD2 H 1 3.62 0.02 . 1 . . . . . . . . 4719 1 277 . 1 1 33 33 PRO C C 13 178.57 0.04 . 1 . . . . . . . . 4719 1 278 . 1 1 33 33 PRO CA C 13 61.62 0.04 . 1 . . . . . . . . 4719 1 279 . 1 1 33 33 PRO CB C 13 31.86 0.04 . 1 . . . . . . . . 4719 1 280 . 1 1 34 34 THR H H 1 9.01 0.02 . 1 . . . . . . . . 4719 1 281 . 1 1 34 34 THR HA H 1 4.60 0.02 . 1 . . . . . . . . 4719 1 282 . 1 1 34 34 THR HB H 1 4.83 0.02 . 1 . . . . . . . . 4719 1 283 . 1 1 34 34 THR HG21 H 1 1.47 0.02 . 1 . . . . . . . . 4719 1 284 . 1 1 34 34 THR HG22 H 1 1.47 0.02 . 1 . . . . . . . . 4719 1 285 . 1 1 34 34 THR HG23 H 1 1.47 0.02 . 1 . . . . . . . . 4719 1 286 . 1 1 34 34 THR C C 13 177.01 0.04 . 1 . . . . . . . . 4719 1 287 . 1 1 34 34 THR CA C 13 60.82 0.04 . 1 . . . . . . . . 4719 1 288 . 1 1 34 34 THR CB C 13 71.07 0.04 . 1 . . . . . . . . 4719 1 289 . 1 1 34 34 THR CG2 C 13 22.38 0.04 . 1 . . . . . . . . 4719 1 290 . 1 1 34 34 THR N N 15 113.14 0.05 . 1 . . . . . . . . 4719 1 291 . 1 1 35 35 GLU H H 1 9.39 0.02 . 1 . . . . . . . . 4719 1 292 . 1 1 35 35 GLU HA H 1 3.97 0.02 . 1 . . . . . . . . 4719 1 293 . 1 1 35 35 GLU HB2 H 1 2.19 0.02 . 1 . . . . . . . . 4719 1 294 . 1 1 35 35 GLU HB3 H 1 2.13 0.02 . 1 . . . . . . . . 4719 1 295 . 1 1 35 35 GLU HG2 H 1 2.50 0.02 . 1 . . . . . . . . 4719 1 296 . 1 1 35 35 GLU HG3 H 1 2.35 0.02 . 1 . . . . . . . . 4719 1 297 . 1 1 35 35 GLU C C 13 176.61 0.04 . 1 . . . . . . . . 4719 1 298 . 1 1 35 35 GLU CA C 13 59.57 0.04 . 1 . . . . . . . . 4719 1 299 . 1 1 35 35 GLU CB C 13 29.11 0.04 . 1 . . . . . . . . 4719 1 300 . 1 1 35 35 GLU CG C 13 35.87 0.04 . 1 . . . . . . . . 4719 1 301 . 1 1 35 35 GLU N N 15 120.18 0.05 . 1 . . . . . . . . 4719 1 302 . 1 1 36 36 ASP H H 1 7.72 0.02 . 1 . . . . . . . . 4719 1 303 . 1 1 36 36 ASP HA H 1 4.69 0.02 . 1 . . . . . . . . 4719 1 304 . 1 1 36 36 ASP HB2 H 1 2.77 0.02 . 1 . . . . . . . . 4719 1 305 . 1 1 36 36 ASP HB3 H 1 2.47 0.02 . 1 . . . . . . . . 4719 1 306 . 1 1 36 36 ASP C C 13 175.22 0.04 . 1 . . . . . . . . 4719 1 307 . 1 1 36 36 ASP CA C 13 53.52 0.04 . 1 . . . . . . . . 4719 1 308 . 1 1 36 36 ASP CB C 13 40.29 0.04 . 1 . . . . . . . . 4719 1 309 . 1 1 36 36 ASP N N 15 115.25 0.05 . 1 . . . . . . . . 4719 1 310 . 1 1 37 37 LEU H H 1 8.20 0.02 . 1 . . . . . . . . 4719 1 311 . 1 1 37 37 LEU HA H 1 3.64 0.02 . 1 . . . . . . . . 4719 1 312 . 1 1 37 37 LEU HB2 H 1 2.16 0.02 . 1 . . . . . . . . 4719 1 313 . 1 1 37 37 LEU HB3 H 1 1.68 0.02 . 1 . . . . . . . . 4719 1 314 . 1 1 37 37 LEU HG H 1 1.35 0.02 . 1 . . . . . . . . 4719 1 315 . 1 1 37 37 LEU HD11 H 1 0.93 0.02 . 1 . . . . . . . . 4719 1 316 . 1 1 37 37 LEU HD12 H 1 0.93 0.02 . 1 . . . . . . . . 4719 1 317 . 1 1 37 37 LEU HD13 H 1 0.93 0.02 . 1 . . . . . . . . 4719 1 318 . 1 1 37 37 LEU HD21 H 1 0.85 0.02 . 1 . . . . . . . . 4719 1 319 . 1 1 37 37 LEU HD22 H 1 0.85 0.02 . 1 . . . . . . . . 4719 1 320 . 1 1 37 37 LEU HD23 H 1 0.85 0.02 . 1 . . . . . . . . 4719 1 321 . 1 1 37 37 LEU C C 13 174.39 0.04 . 1 . . . . . . . . 4719 1 322 . 1 1 37 37 LEU CA C 13 56.55 0.04 . 1 . . . . . . . . 4719 1 323 . 1 1 37 37 LEU CB C 13 37.06 0.04 . 1 . . . . . . . . 4719 1 324 . 1 1 37 37 LEU CG C 13 27.66 0.04 . 1 . . . . . . . . 4719 1 325 . 1 1 37 37 LEU CD1 C 13 25.13 0.04 . 1 . . . . . . . . 4719 1 326 . 1 1 37 37 LEU CD2 C 13 23.01 0.04 . 1 . . . . . . . . 4719 1 327 . 1 1 37 37 LEU N N 15 113.85 0.05 . 1 . . . . . . . . 4719 1 328 . 1 1 38 38 GLU H H 1 7.44 0.02 . 1 . . . . . . . . 4719 1 329 . 1 1 38 38 GLU HA H 1 4.10 0.02 . 1 . . . . . . . . 4719 1 330 . 1 1 38 38 GLU HB2 H 1 2.02 0.02 . 1 . . . . . . . . 4719 1 331 . 1 1 38 38 GLU HB3 H 1 1.70 0.02 . 1 . . . . . . . . 4719 1 332 . 1 1 38 38 GLU HG2 H 1 2.13 0.02 . 1 . . . . . . . . 4719 1 333 . 1 1 38 38 GLU HG3 H 1 2.02 0.02 . 1 . . . . . . . . 4719 1 334 . 1 1 38 38 GLU C C 13 175.10 0.04 . 1 . . . . . . . . 4719 1 335 . 1 1 38 38 GLU CA C 13 56.17 0.04 . 1 . . . . . . . . 4719 1 336 . 1 1 38 38 GLU CB C 13 30.35 0.04 . 1 . . . . . . . . 4719 1 337 . 1 1 38 38 GLU CG C 13 36.18 0.04 . 1 . . . . . . . . 4719 1 338 . 1 1 38 38 GLU N N 15 119.00 0.05 . 1 . . . . . . . . 4719 1 339 . 1 1 39 39 PHE H H 1 7.96 0.02 . 1 . . . . . . . . 4719 1 340 . 1 1 39 39 PHE HA H 1 4.64 0.02 . 1 . . . . . . . . 4719 1 341 . 1 1 39 39 PHE HB2 H 1 3.16 0.02 . 1 . . . . . . . . 4719 1 342 . 1 1 39 39 PHE HB3 H 1 3.10 0.02 . 1 . . . . . . . . 4719 1 343 . 1 1 39 39 PHE HD1 H 1 6.88 0.02 . 1 . . . . . . . . 4719 1 344 . 1 1 39 39 PHE HE1 H 1 7.22 0.02 . 1 . . . . . . . . 4719 1 345 . 1 1 39 39 PHE C C 13 172.37 0.04 . 1 . . . . . . . . 4719 1 346 . 1 1 39 39 PHE CA C 13 55.48 0.04 . 1 . . . . . . . . 4719 1 347 . 1 1 39 39 PHE CB C 13 40.34 0.04 . 1 . . . . . . . . 4719 1 348 . 1 1 39 39 PHE N N 15 118.54 0.05 . 1 . . . . . . . . 4719 1 349 . 1 1 40 40 HIS H H 1 8.49 0.02 . 1 . . . . . . . . 4719 1 350 . 1 1 40 40 HIS HA H 1 5.47 0.02 . 1 . . . . . . . . 4719 1 351 . 1 1 40 40 HIS HB2 H 1 3.00 0.02 . 1 . . . . . . . . 4719 1 352 . 1 1 40 40 HIS HB3 H 1 2.72 0.02 . 1 . . . . . . . . 4719 1 353 . 1 1 40 40 HIS HD1 H 1 6.78 0.02 . 1 . . . . . . . . 4719 1 354 . 1 1 40 40 HIS C C 13 174.36 0.04 . 1 . . . . . . . . 4719 1 355 . 1 1 40 40 HIS CA C 13 55.20 0.04 . 1 . . . . . . . . 4719 1 356 . 1 1 40 40 HIS CB C 13 34.02 0.04 . 1 . . . . . . . . 4719 1 357 . 1 1 40 40 HIS N N 15 114.32 0.05 . 1 . . . . . . . . 4719 1 358 . 1 1 41 41 GLY H H 1 8.63 0.02 . 1 . . . . . . . . 4719 1 359 . 1 1 41 41 GLY HA2 H 1 4.49 0.02 . 1 . . . . . . . . 4719 1 360 . 1 1 41 41 GLY HA3 H 1 4.03 0.02 . 1 . . . . . . . . 4719 1 361 . 1 1 41 41 GLY C C 13 172.14 0.04 . 1 . . . . . . . . 4719 1 362 . 1 1 41 41 GLY CA C 13 45.62 0.04 . 1 . . . . . . . . 4719 1 363 . 1 1 41 41 GLY N N 15 105.90 0.05 . 1 . . . . . . . . 4719 1 364 . 1 1 42 42 VAL H H 1 9.02 0.02 . 1 . . . . . . . . 4719 1 365 . 1 1 42 42 VAL HA H 1 4.25 0.02 . 1 . . . . . . . . 4719 1 366 . 1 1 42 42 VAL HB H 1 1.45 0.02 . 1 . . . . . . . . 4719 1 367 . 1 1 42 42 VAL HG11 H 1 0.79 0.02 . 1 . . . . . . . . 4719 1 368 . 1 1 42 42 VAL HG12 H 1 0.79 0.02 . 1 . . . . . . . . 4719 1 369 . 1 1 42 42 VAL HG13 H 1 0.79 0.02 . 1 . . . . . . . . 4719 1 370 . 1 1 42 42 VAL HG21 H 1 0.10 0.02 . 1 . . . . . . . . 4719 1 371 . 1 1 42 42 VAL HG22 H 1 0.10 0.02 . 1 . . . . . . . . 4719 1 372 . 1 1 42 42 VAL HG23 H 1 0.10 0.02 . 1 . . . . . . . . 4719 1 373 . 1 1 42 42 VAL C C 13 175.66 0.04 . 1 . . . . . . . . 4719 1 374 . 1 1 42 42 VAL CA C 13 62.81 0.04 . 1 . . . . . . . . 4719 1 375 . 1 1 42 42 VAL CB C 13 30.79 0.04 . 1 . . . . . . . . 4719 1 376 . 1 1 42 42 VAL CG1 C 13 21.60 0.04 . 1 . . . . . . . . 4719 1 377 . 1 1 42 42 VAL CG2 C 13 20.54 0.04 . 1 . . . . . . . . 4719 1 378 . 1 1 42 42 VAL N N 15 123.93 0.05 . 1 . . . . . . . . 4719 1 379 . 1 1 43 43 MET H H 1 8.94 0.02 . 1 . . . . . . . . 4719 1 380 . 1 1 43 43 MET HA H 1 4.56 0.02 . 1 . . . . . . . . 4719 1 381 . 1 1 43 43 MET HB2 H 1 2.15 0.02 . 1 . . . . . . . . 4719 1 382 . 1 1 43 43 MET HB3 H 1 2.05 0.02 . 1 . . . . . . . . 4719 1 383 . 1 1 43 43 MET HG2 H 1 2.63 0.02 . 1 . . . . . . . . 4719 1 384 . 1 1 43 43 MET HG3 H 1 2.57 0.02 . 1 . . . . . . . . 4719 1 385 . 1 1 43 43 MET HE1 H 1 2.15 0.02 . 1 . . . . . . . . 4719 1 386 . 1 1 43 43 MET HE2 H 1 2.15 0.02 . 1 . . . . . . . . 4719 1 387 . 1 1 43 43 MET HE3 H 1 2.15 0.02 . 1 . . . . . . . . 4719 1 388 . 1 1 43 43 MET C C 13 172.78 0.04 . 1 . . . . . . . . 4719 1 389 . 1 1 43 43 MET CA C 13 55.35 0.04 . 1 . . . . . . . . 4719 1 390 . 1 1 43 43 MET CB C 13 31.81 0.04 . 1 . . . . . . . . 4719 1 391 . 1 1 43 43 MET CG C 13 32.08 0.04 . 1 . . . . . . . . 4719 1 392 . 1 1 43 43 MET N N 15 126.74 0.05 . 1 . . . . . . . . 4719 1 393 . 1 1 44 44 ARG H H 1 8.60 0.02 . 1 . . . . . . . . 4719 1 394 . 1 1 44 44 ARG HA H 1 4.79 0.02 . 1 . . . . . . . . 4719 1 395 . 1 1 44 44 ARG HB2 H 1 1.83 0.02 . 1 . . . . . . . . 4719 1 396 . 1 1 44 44 ARG HD2 H 1 3.14 0.02 . 1 . . . . . . . . 4719 1 397 . 1 1 44 44 ARG HD3 H 1 2.96 0.02 . 1 . . . . . . . . 4719 1 398 . 1 1 44 44 ARG HE H 1 7.31 0.02 . 1 . . . . . . . . 4719 1 399 . 1 1 44 44 ARG C C 13 174.27 0.04 . 1 . . . . . . . . 4719 1 400 . 1 1 44 44 ARG CA C 13 54.94 0.04 . 1 . . . . . . . . 4719 1 401 . 1 1 44 44 ARG CB C 13 32.34 0.04 . 1 . . . . . . . . 4719 1 402 . 1 1 44 44 ARG N N 15 122.52 0.05 . 1 . . . . . . . . 4719 1 403 . 1 1 45 45 PHE H H 1 8.90 0.02 . 1 . . . . . . . . 4719 1 404 . 1 1 45 45 PHE HA H 1 5.30 0.02 . 1 . . . . . . . . 4719 1 405 . 1 1 45 45 PHE HB2 H 1 2.91 0.02 . 1 . . . . . . . . 4719 1 406 . 1 1 45 45 PHE HB3 H 1 2.84 0.02 . 1 . . . . . . . . 4719 1 407 . 1 1 45 45 PHE HD1 H 1 7.13 0.02 . 1 . . . . . . . . 4719 1 408 . 1 1 45 45 PHE HE1 H 1 6.85 0.02 . 1 . . . . . . . . 4719 1 409 . 1 1 45 45 PHE C C 13 174.82 0.04 . 1 . . . . . . . . 4719 1 410 . 1 1 45 45 PHE CA C 13 57.23 0.04 . 1 . . . . . . . . 4719 1 411 . 1 1 45 45 PHE CB C 13 43.35 0.04 . 1 . . . . . . . . 4719 1 412 . 1 1 45 45 PHE N N 15 122.52 0.05 . 1 . . . . . . . . 4719 1 413 . 1 1 46 46 TYR H H 1 8.90 0.02 . 1 . . . . . . . . 4719 1 414 . 1 1 46 46 TYR HA H 1 5.33 0.02 . 1 . . . . . . . . 4719 1 415 . 1 1 46 46 TYR HB2 H 1 3.06 0.02 . 1 . . . . . . . . 4719 1 416 . 1 1 46 46 TYR HB3 H 1 2.91 0.02 . 1 . . . . . . . . 4719 1 417 . 1 1 46 46 TYR HD1 H 1 7.23 0.02 . 1 . . . . . . . . 4719 1 418 . 1 1 46 46 TYR HE1 H 1 6.85 0.02 . 1 . . . . . . . . 4719 1 419 . 1 1 46 46 TYR C C 13 175.02 0.04 . 1 . . . . . . . . 4719 1 420 . 1 1 46 46 TYR CA C 13 56.78 0.04 . 1 . . . . . . . . 4719 1 421 . 1 1 46 46 TYR CB C 13 40.70 0.04 . 1 . . . . . . . . 4719 1 422 . 1 1 46 46 TYR N N 15 120.88 0.05 . 1 . . . . . . . . 4719 1 423 . 1 1 47 47 PHE H H 1 9.11 0.02 . 1 . . . . . . . . 4719 1 424 . 1 1 47 47 PHE HA H 1 5.17 0.02 . 1 . . . . . . . . 4719 1 425 . 1 1 47 47 PHE HB2 H 1 3.21 0.02 . 1 . . . . . . . . 4719 1 426 . 1 1 47 47 PHE HB3 H 1 3.14 0.02 . 1 . . . . . . . . 4719 1 427 . 1 1 47 47 PHE HD1 H 1 7.23 0.02 . 1 . . . . . . . . 4719 1 428 . 1 1 47 47 PHE HE1 H 1 6.85 0.02 . 1 . . . . . . . . 4719 1 429 . 1 1 47 47 PHE HE2 H 1 7.06 0.02 . 1 . . . . . . . . 4719 1 430 . 1 1 47 47 PHE C C 13 174.42 0.04 . 1 . . . . . . . . 4719 1 431 . 1 1 47 47 PHE CA C 13 56.16 0.04 . 1 . . . . . . . . 4719 1 432 . 1 1 47 47 PHE CB C 13 40.91 0.04 . 1 . . . . . . . . 4719 1 433 . 1 1 47 47 PHE N N 15 121.58 0.05 . 1 . . . . . . . . 4719 1 434 . 1 1 48 48 GLN H H 1 8.60 0.02 . 1 . . . . . . . . 4719 1 435 . 1 1 48 48 GLN HA H 1 4.16 0.02 . 1 . . . . . . . . 4719 1 436 . 1 1 48 48 GLN HB2 H 1 1.89 0.02 . 1 . . . . . . . . 4719 1 437 . 1 1 48 48 GLN HB3 H 1 1.83 0.02 . 1 . . . . . . . . 4719 1 438 . 1 1 48 48 GLN HG2 H 1 2.14 0.02 . 1 . . . . . . . . 4719 1 439 . 1 1 48 48 GLN HG3 H 1 2.05 0.02 . 1 . . . . . . . . 4719 1 440 . 1 1 48 48 GLN C C 13 173.32 0.04 . 1 . . . . . . . . 4719 1 441 . 1 1 48 48 GLN CA C 13 55.37 0.04 . 1 . . . . . . . . 4719 1 442 . 1 1 48 48 GLN CB C 13 30.17 0.04 . 1 . . . . . . . . 4719 1 443 . 1 1 48 48 GLN CG C 13 36.02 0.04 . 1 . . . . . . . . 4719 1 444 . 1 1 48 48 GLN N N 15 127.68 0.05 . 1 . . . . . . . . 4719 1 445 . 1 1 49 49 ASP H H 1 8.16 0.02 . 1 . . . . . . . . 4719 1 446 . 1 1 49 49 ASP HA H 1 4.56 0.02 . 1 . . . . . . . . 4719 1 447 . 1 1 49 49 ASP HB2 H 1 2.81 0.02 . 1 . . . . . . . . 4719 1 448 . 1 1 49 49 ASP HB3 H 1 2.51 0.02 . 1 . . . . . . . . 4719 1 449 . 1 1 49 49 ASP C C 13 176.49 0.04 . 1 . . . . . . . . 4719 1 450 . 1 1 49 49 ASP CA C 13 53.07 0.04 . 1 . . . . . . . . 4719 1 451 . 1 1 49 49 ASP CB C 13 41.99 0.04 . 1 . . . . . . . . 4719 1 452 . 1 1 49 49 ASP N N 15 126.04 0.05 . 1 . . . . . . . . 4719 1 453 . 1 1 50 50 LYS H H 1 8.53 0.02 . 1 . . . . . . . . 4719 1 454 . 1 1 50 50 LYS HA H 1 4.05 0.02 . 1 . . . . . . . . 4719 1 455 . 1 1 50 50 LYS HB2 H 1 1.85 0.02 . 1 . . . . . . . . 4719 1 456 . 1 1 50 50 LYS HG2 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 457 . 1 1 50 50 LYS HD2 H 1 1.70 0.02 . 1 . . . . . . . . 4719 1 458 . 1 1 50 50 LYS C C 13 177.36 0.04 . 1 . . . . . . . . 4719 1 459 . 1 1 50 50 LYS CA C 13 58.05 0.04 . 1 . . . . . . . . 4719 1 460 . 1 1 50 50 LYS CB C 13 32.55 0.04 . 1 . . . . . . . . 4719 1 461 . 1 1 50 50 LYS N N 15 123.22 0.05 . 1 . . . . . . . . 4719 1 462 . 1 1 51 51 ALA H H 1 8.31 0.02 . 1 . . . . . . . . 4719 1 463 . 1 1 51 51 ALA HA H 1 4.19 0.02 . 1 . . . . . . . . 4719 1 464 . 1 1 51 51 ALA HB1 H 1 1.45 0.02 . 1 . . . . . . . . 4719 1 465 . 1 1 51 51 ALA HB2 H 1 1.45 0.02 . 1 . . . . . . . . 4719 1 466 . 1 1 51 51 ALA HB3 H 1 1.45 0.02 . 1 . . . . . . . . 4719 1 467 . 1 1 51 51 ALA C C 13 178.56 0.04 . 1 . . . . . . . . 4719 1 468 . 1 1 51 51 ALA CA C 13 53.63 0.04 . 1 . . . . . . . . 4719 1 469 . 1 1 51 51 ALA CB C 13 18.61 0.04 . 1 . . . . . . . . 4719 1 470 . 1 1 51 51 ALA N N 15 122.29 0.05 . 1 . . . . . . . . 4719 1 471 . 1 1 52 52 ALA H H 1 7.90 0.02 . 1 . . . . . . . . 4719 1 472 . 1 1 52 52 ALA HA H 1 4.26 0.02 . 1 . . . . . . . . 4719 1 473 . 1 1 52 52 ALA HB1 H 1 1.47 0.02 . 1 . . . . . . . . 4719 1 474 . 1 1 52 52 ALA HB2 H 1 1.47 0.02 . 1 . . . . . . . . 4719 1 475 . 1 1 52 52 ALA HB3 H 1 1.47 0.02 . 1 . . . . . . . . 4719 1 476 . 1 1 52 52 ALA C C 13 178.31 0.04 . 1 . . . . . . . . 4719 1 477 . 1 1 52 52 ALA CA C 13 52.19 0.04 . 1 . . . . . . . . 4719 1 478 . 1 1 52 52 ALA CB C 13 19.63 0.04 . 1 . . . . . . . . 4719 1 479 . 1 1 52 52 ALA N N 15 119.47 0.05 . 1 . . . . . . . . 4719 1 480 . 1 1 53 53 GLY H H 1 8.09 0.02 . 1 . . . . . . . . 4719 1 481 . 1 1 53 53 GLY HA2 H 1 3.84 0.02 . 1 . . . . . . . . 4719 1 482 . 1 1 53 53 GLY HA3 H 1 3.80 0.02 . 1 . . . . . . . . 4719 1 483 . 1 1 53 53 GLY C C 13 173.96 0.04 . 1 . . . . . . . . 4719 1 484 . 1 1 53 53 GLY CA C 13 45.46 0.04 . 1 . . . . . . . . 4719 1 485 . 1 1 53 53 GLY N N 15 106.92 0.05 . 1 . . . . . . . . 4719 1 486 . 1 1 54 54 ASN H H 1 7.89 0.02 . 1 . . . . . . . . 4719 1 487 . 1 1 54 54 ASN HA H 1 4.85 0.02 . 1 . . . . . . . . 4719 1 488 . 1 1 54 54 ASN HB2 H 1 2.84 0.02 . 1 . . . . . . . . 4719 1 489 . 1 1 54 54 ASN HB3 H 1 2.80 0.02 . 1 . . . . . . . . 4719 1 490 . 1 1 54 54 ASN C C 13 174.30 0.04 . 1 . . . . . . . . 4719 1 491 . 1 1 54 54 ASN CA C 13 52.19 0.04 . 1 . . . . . . . . 4719 1 492 . 1 1 54 54 ASN CB C 13 39.82 0.04 . 1 . . . . . . . . 4719 1 493 . 1 1 54 54 ASN N N 15 117.60 0.05 . 1 . . . . . . . . 4719 1 494 . 1 1 55 55 PHE H H 1 8.51 0.02 . 1 . . . . . . . . 4719 1 495 . 1 1 55 55 PHE HA H 1 5.22 0.02 . 1 . . . . . . . . 4719 1 496 . 1 1 55 55 PHE HB2 H 1 3.11 0.02 . 1 . . . . . . . . 4719 1 497 . 1 1 55 55 PHE HB3 H 1 3.11 0.02 . 1 . . . . . . . . 4719 1 498 . 1 1 55 55 PHE HD1 H 1 7.25 0.02 . 1 . . . . . . . . 4719 1 499 . 1 1 55 55 PHE C C 13 175.72 0.04 . 1 . . . . . . . . 4719 1 500 . 1 1 55 55 PHE CA C 13 57.30 0.04 . 1 . . . . . . . . 4719 1 501 . 1 1 55 55 PHE CB C 13 40.63 0.04 . 1 . . . . . . . . 4719 1 502 . 1 1 55 55 PHE N N 15 119.24 0.05 . 1 . . . . . . . . 4719 1 503 . 1 1 56 56 ALA H H 1 8.74 0.02 . 1 . . . . . . . . 4719 1 504 . 1 1 56 56 ALA HA H 1 4.83 0.02 . 1 . . . . . . . . 4719 1 505 . 1 1 56 56 ALA HB1 H 1 1.64 0.02 . 1 . . . . . . . . 4719 1 506 . 1 1 56 56 ALA HB2 H 1 1.64 0.02 . 1 . . . . . . . . 4719 1 507 . 1 1 56 56 ALA HB3 H 1 1.64 0.02 . 1 . . . . . . . . 4719 1 508 . 1 1 56 56 ALA C C 13 176.75 0.04 . 1 . . . . . . . . 4719 1 509 . 1 1 56 56 ALA CA C 13 51.38 0.04 . 1 . . . . . . . . 4719 1 510 . 1 1 56 56 ALA CB C 13 21.67 0.04 . 1 . . . . . . . . 4719 1 511 . 1 1 56 56 ALA N N 15 125.90 0.05 . 1 . . . . . . . . 4719 1 512 . 1 1 57 57 THR H H 1 8.48 0.02 . 1 . . . . . . . . 4719 1 513 . 1 1 57 57 THR HA H 1 5.67 0.02 . 1 . . . . . . . . 4719 1 514 . 1 1 57 57 THR HB H 1 3.77 0.02 . 1 . . . . . . . . 4719 1 515 . 1 1 57 57 THR HG21 H 1 0.84 0.02 . 1 . . . . . . . . 4719 1 516 . 1 1 57 57 THR HG22 H 1 0.84 0.02 . 1 . . . . . . . . 4719 1 517 . 1 1 57 57 THR HG23 H 1 0.84 0.02 . 1 . . . . . . . . 4719 1 518 . 1 1 57 57 THR C C 13 174.62 0.04 . 1 . . . . . . . . 4719 1 519 . 1 1 57 57 THR CA C 13 59.62 0.04 . 1 . . . . . . . . 4719 1 520 . 1 1 57 57 THR CB C 13 72.10 0.04 . 1 . . . . . . . . 4719 1 521 . 1 1 57 57 THR CG2 C 13 21.12 0.04 . 1 . . . . . . . . 4719 1 522 . 1 1 57 57 THR N N 15 110.57 0.05 . 1 . . . . . . . . 4719 1 523 . 1 1 58 58 LYS H H 1 8.70 0.02 . 1 . . . . . . . . 4719 1 524 . 1 1 58 58 LYS HA H 1 4.62 0.02 . 1 . . . . . . . . 4719 1 525 . 1 1 58 58 LYS HB2 H 1 1.43 0.02 . 1 . . . . . . . . 4719 1 526 . 1 1 58 58 LYS HB3 H 1 1.34 0.02 . 1 . . . . . . . . 4719 1 527 . 1 1 58 58 LYS HG2 H 1 0.97 0.02 . 1 . . . . . . . . 4719 1 528 . 1 1 58 58 LYS HG3 H 1 0.74 0.02 . 1 . . . . . . . . 4719 1 529 . 1 1 58 58 LYS HD2 H 1 1.65 0.02 . 1 . . . . . . . . 4719 1 530 . 1 1 58 58 LYS HD3 H 1 1.25 0.02 . 1 . . . . . . . . 4719 1 531 . 1 1 58 58 LYS HE2 H 1 2.61 0.02 . 1 . . . . . . . . 4719 1 532 . 1 1 58 58 LYS HZ1 H 1 7.05 0.02 . 1 . . . . . . . . 4719 1 533 . 1 1 58 58 LYS HZ2 H 1 7.05 0.02 . 1 . . . . . . . . 4719 1 534 . 1 1 58 58 LYS HZ3 H 1 7.05 0.02 . 1 . . . . . . . . 4719 1 535 . 1 1 58 58 LYS C C 13 174.94 0.04 . 1 . . . . . . . . 4719 1 536 . 1 1 58 58 LYS CA C 13 54.57 0.04 . 1 . . . . . . . . 4719 1 537 . 1 1 58 58 LYS CB C 13 36.83 0.04 . 1 . . . . . . . . 4719 1 538 . 1 1 58 58 LYS CG C 13 24.82 0.04 . 1 . . . . . . . . 4719 1 539 . 1 1 58 58 LYS CD C 13 27.66 0.04 . 1 . . . . . . . . 4719 1 540 . 1 1 58 58 LYS CE C 13 41.23 0.04 . 1 . . . . . . . . 4719 1 541 . 1 1 58 58 LYS N N 15 121.64 0.05 . 1 . . . . . . . . 4719 1 542 . 1 1 59 59 CYS H H 1 8.68 0.02 . 1 . . . . . . . . 4719 1 543 . 1 1 59 59 CYS HA H 1 5.66 0.02 . 1 . . . . . . . . 4719 1 544 . 1 1 59 59 CYS HB2 H 1 2.78 0.02 . 1 . . . . . . . . 4719 1 545 . 1 1 59 59 CYS HB3 H 1 2.26 0.02 . 1 . . . . . . . . 4719 1 546 . 1 1 59 59 CYS C C 13 174.94 0.04 . 1 . . . . . . . . 4719 1 547 . 1 1 59 59 CYS CA C 13 57.30 0.04 . 1 . . . . . . . . 4719 1 548 . 1 1 59 59 CYS CB C 13 28.74 0.04 . 1 . . . . . . . . 4719 1 549 . 1 1 59 59 CYS N N 15 120.88 0.05 . 1 . . . . . . . . 4719 1 550 . 1 1 60 60 ILE H H 1 8.55 0.02 . 1 . . . . . . . . 4719 1 551 . 1 1 60 60 ILE HA H 1 4.63 0.02 . 1 . . . . . . . . 4719 1 552 . 1 1 60 60 ILE HB H 1 1.86 0.02 . 1 . . . . . . . . 4719 1 553 . 1 1 60 60 ILE HG12 H 1 1.62 0.02 . 1 . . . . . . . . 4719 1 554 . 1 1 60 60 ILE HG13 H 1 1.05 0.02 . 1 . . . . . . . . 4719 1 555 . 1 1 60 60 ILE HG21 H 1 0.81 0.02 . 1 . . . . . . . . 4719 1 556 . 1 1 60 60 ILE HG22 H 1 0.81 0.02 . 1 . . . . . . . . 4719 1 557 . 1 1 60 60 ILE HG23 H 1 0.81 0.02 . 1 . . . . . . . . 4719 1 558 . 1 1 60 60 ILE HD11 H 1 0.60 0.02 . 1 . . . . . . . . 4719 1 559 . 1 1 60 60 ILE HD12 H 1 0.60 0.02 . 1 . . . . . . . . 4719 1 560 . 1 1 60 60 ILE HD13 H 1 0.60 0.02 . 1 . . . . . . . . 4719 1 561 . 1 1 60 60 ILE C C 13 173.78 0.04 . 1 . . . . . . . . 4719 1 562 . 1 1 60 60 ILE CA C 13 59.03 0.04 . 1 . . . . . . . . 4719 1 563 . 1 1 60 60 ILE CB C 13 42.33 0.04 . 1 . . . . . . . . 4719 1 564 . 1 1 60 60 ILE CG2 C 13 18.91 0.04 . 1 . . . . . . . . 4719 1 565 . 1 1 60 60 ILE CD1 C 13 13.54 0.04 . 1 . . . . . . . . 4719 1 566 . 1 1 60 60 ILE N N 15 116.66 0.05 . 1 . . . . . . . . 4719 1 567 . 1 1 61 61 ARG H H 1 8.68 0.02 . 1 . . . . . . . . 4719 1 568 . 1 1 61 61 ARG HA H 1 4.25 0.02 . 1 . . . . . . . . 4719 1 569 . 1 1 61 61 ARG HB2 H 1 2.26 0.02 . 1 . . . . . . . . 4719 1 570 . 1 1 61 61 ARG HB3 H 1 2.08 0.02 . 1 . . . . . . . . 4719 1 571 . 1 1 61 61 ARG HG2 H 1 1.88 0.02 . 1 . . . . . . . . 4719 1 572 . 1 1 61 61 ARG HG3 H 1 1.70 0.02 . 1 . . . . . . . . 4719 1 573 . 1 1 61 61 ARG HD2 H 1 3.21 0.02 . 1 . . . . . . . . 4719 1 574 . 1 1 61 61 ARG C C 13 175.05 0.04 . 1 . . . . . . . . 4719 1 575 . 1 1 61 61 ARG CA C 13 56.82 0.04 . 1 . . . . . . . . 4719 1 576 . 1 1 61 61 ARG CB C 13 30.23 0.04 . 1 . . . . . . . . 4719 1 577 . 1 1 61 61 ARG N N 15 124.16 0.05 . 1 . . . . . . . . 4719 1 578 . 1 1 62 62 VAL H H 1 8.90 0.02 . 1 . . . . . . . . 4719 1 579 . 1 1 62 62 VAL HA H 1 4.23 0.02 . 1 . . . . . . . . 4719 1 580 . 1 1 62 62 VAL HB H 1 1.92 0.02 . 1 . . . . . . . . 4719 1 581 . 1 1 62 62 VAL HG11 H 1 1.09 0.02 . 1 . . . . . . . . 4719 1 582 . 1 1 62 62 VAL HG12 H 1 1.09 0.02 . 1 . . . . . . . . 4719 1 583 . 1 1 62 62 VAL HG13 H 1 1.09 0.02 . 1 . . . . . . . . 4719 1 584 . 1 1 62 62 VAL HG21 H 1 1.02 0.02 . 1 . . . . . . . . 4719 1 585 . 1 1 62 62 VAL HG22 H 1 1.02 0.02 . 1 . . . . . . . . 4719 1 586 . 1 1 62 62 VAL HG23 H 1 1.02 0.02 . 1 . . . . . . . . 4719 1 587 . 1 1 62 62 VAL C C 13 174.34 0.04 . 1 . . . . . . . . 4719 1 588 . 1 1 62 62 VAL CA C 13 61.46 0.04 . 1 . . . . . . . . 4719 1 589 . 1 1 62 62 VAL CB C 13 34.99 0.04 . 1 . . . . . . . . 4719 1 590 . 1 1 62 62 VAL CG1 C 13 21.60 0.04 . 1 . . . . . . . . 4719 1 591 . 1 1 62 62 VAL CG2 C 13 22.67 0.04 . 1 . . . . . . . . 4719 1 592 . 1 1 62 62 VAL N N 15 130.02 0.05 . 1 . . . . . . . . 4719 1 593 . 1 1 63 63 SER H H 1 7.98 0.02 . 1 . . . . . . . . 4719 1 594 . 1 1 63 63 SER HA H 1 4.83 0.02 . 1 . . . . . . . . 4719 1 595 . 1 1 63 63 SER HB2 H 1 3.94 0.02 . 1 . . . . . . . . 4719 1 596 . 1 1 63 63 SER HB3 H 1 3.66 0.02 . 1 . . . . . . . . 4719 1 597 . 1 1 63 63 SER C C 13 176.72 0.04 . 1 . . . . . . . . 4719 1 598 . 1 1 63 63 SER CA C 13 56.49 0.04 . 1 . . . . . . . . 4719 1 599 . 1 1 63 63 SER CB C 13 63.88 0.04 . 1 . . . . . . . . 4719 1 600 . 1 1 63 63 SER N N 15 118.07 0.05 . 1 . . . . . . . . 4719 1 601 . 1 1 64 64 SER H H 1 8.99 0.02 . 1 . . . . . . . . 4719 1 602 . 1 1 64 64 SER HA H 1 3.40 0.02 . 1 . . . . . . . . 4719 1 603 . 1 1 64 64 SER HB2 H 1 3.01 0.02 . 1 . . . . . . . . 4719 1 604 . 1 1 64 64 SER HB3 H 1 1.56 0.02 . 1 . . . . . . . . 4719 1 605 . 1 1 64 64 SER C C 13 173.90 0.04 . 1 . . . . . . . . 4719 1 606 . 1 1 64 64 SER CA C 13 61.21 0.04 . 1 . . . . . . . . 4719 1 607 . 1 1 64 64 SER CB C 13 60.21 0.04 . 1 . . . . . . . . 4719 1 608 . 1 1 64 64 SER N N 15 121.83 0.05 . 1 . . . . . . . . 4719 1 609 . 1 1 65 65 THR H H 1 7.71 0.02 . 1 . . . . . . . . 4719 1 610 . 1 1 65 65 THR HA H 1 4.07 0.02 . 1 . . . . . . . . 4719 1 611 . 1 1 65 65 THR HB H 1 4.29 0.02 . 1 . . . . . . . . 4719 1 612 . 1 1 65 65 THR HG21 H 1 1.07 0.02 . 1 . . . . . . . . 4719 1 613 . 1 1 65 65 THR HG22 H 1 1.07 0.02 . 1 . . . . . . . . 4719 1 614 . 1 1 65 65 THR HG23 H 1 1.07 0.02 . 1 . . . . . . . . 4719 1 615 . 1 1 65 65 THR C C 13 175.00 0.04 . 1 . . . . . . . . 4719 1 616 . 1 1 65 65 THR CA C 13 61.46 0.04 . 1 . . . . . . . . 4719 1 617 . 1 1 65 65 THR CB C 13 69.11 0.04 . 1 . . . . . . . . 4719 1 618 . 1 1 65 65 THR CG2 C 13 21.75 0.04 . 1 . . . . . . . . 4719 1 619 . 1 1 65 65 THR N N 15 108.93 0.05 . 1 . . . . . . . . 4719 1 620 . 1 1 66 66 ALA H H 1 7.36 0.02 . 1 . . . . . . . . 4719 1 621 . 1 1 66 66 ALA HA H 1 4.49 0.02 . 1 . . . . . . . . 4719 1 622 . 1 1 66 66 ALA HB1 H 1 1.45 0.02 . 1 . . . . . . . . 4719 1 623 . 1 1 66 66 ALA HB2 H 1 1.45 0.02 . 1 . . . . . . . . 4719 1 624 . 1 1 66 66 ALA HB3 H 1 1.45 0.02 . 1 . . . . . . . . 4719 1 625 . 1 1 66 66 ALA C C 13 177.56 0.04 . 1 . . . . . . . . 4719 1 626 . 1 1 66 66 ALA CA C 13 52.08 0.04 . 1 . . . . . . . . 4719 1 627 . 1 1 66 66 ALA CB C 13 19.22 0.04 . 1 . . . . . . . . 4719 1 628 . 1 1 66 66 ALA N N 15 126.27 0.05 . 1 . . . . . . . . 4719 1 629 . 1 1 67 67 THR H H 1 8.94 0.02 . 1 . . . . . . . . 4719 1 630 . 1 1 67 67 THR HA H 1 5.13 0.02 . 1 . . . . . . . . 4719 1 631 . 1 1 67 67 THR HB H 1 4.99 0.02 . 1 . . . . . . . . 4719 1 632 . 1 1 67 67 THR HG21 H 1 1.33 0.02 . 1 . . . . . . . . 4719 1 633 . 1 1 67 67 THR HG22 H 1 1.33 0.02 . 1 . . . . . . . . 4719 1 634 . 1 1 67 67 THR HG23 H 1 1.33 0.02 . 1 . . . . . . . . 4719 1 635 . 1 1 67 67 THR C C 13 176.70 0.04 . 1 . . . . . . . . 4719 1 636 . 1 1 67 67 THR CA C 13 60.12 0.04 . 1 . . . . . . . . 4719 1 637 . 1 1 67 67 THR CB C 13 72.44 0.04 . 1 . . . . . . . . 4719 1 638 . 1 1 67 67 THR CG2 C 13 21.48 0.04 . 1 . . . . . . . . 4719 1 639 . 1 1 67 67 THR N N 15 112.68 0.05 . 1 . . . . . . . . 4719 1 640 . 1 1 68 68 THR H H 1 8.82 0.02 . 1 . . . . . . . . 4719 1 641 . 1 1 68 68 THR HA H 1 3.44 0.02 . 1 . . . . . . . . 4719 1 642 . 1 1 68 68 THR HB H 1 4.35 0.02 . 1 . . . . . . . . 4719 1 643 . 1 1 68 68 THR HG21 H 1 1.21 0.02 . 1 . . . . . . . . 4719 1 644 . 1 1 68 68 THR HG22 H 1 1.21 0.02 . 1 . . . . . . . . 4719 1 645 . 1 1 68 68 THR HG23 H 1 1.21 0.02 . 1 . . . . . . . . 4719 1 646 . 1 1 68 68 THR CA C 13 66.87 0.04 . 1 . . . . . . . . 4719 1 647 . 1 1 68 68 THR CB C 13 68.98 0.04 . 1 . . . . . . . . 4719 1 648 . 1 1 68 68 THR CG2 C 13 22.67 0.04 . 1 . . . . . . . . 4719 1 649 . 1 1 68 68 THR N N 15 118.77 0.05 . 1 . . . . . . . . 4719 1 650 . 1 1 69 69 GLN C C 13 177.43 0.04 . 1 . . . . . . . . 4719 1 651 . 1 1 69 69 GLN CA C 13 59.18 0.04 . 1 . . . . . . . . 4719 1 652 . 1 1 69 69 GLN CB C 13 28.66 0.04 . 1 . . . . . . . . 4719 1 653 . 1 1 70 70 ASP H H 1 7.49 0.02 . 1 . . . . . . . . 4719 1 654 . 1 1 70 70 ASP HA H 1 4.28 0.02 . 1 . . . . . . . . 4719 1 655 . 1 1 70 70 ASP HB2 H 1 3.06 0.02 . 1 . . . . . . . . 4719 1 656 . 1 1 70 70 ASP HB3 H 1 2.77 0.02 . 1 . . . . . . . . 4719 1 657 . 1 1 70 70 ASP C C 13 179.32 0.04 . 1 . . . . . . . . 4719 1 658 . 1 1 70 70 ASP CA C 13 57.48 0.04 . 1 . . . . . . . . 4719 1 659 . 1 1 70 70 ASP CB C 13 40.77 0.04 . 1 . . . . . . . . 4719 1 660 . 1 1 70 70 ASP N N 15 119.47 0.05 . 1 . . . . . . . . 4719 1 661 . 1 1 71 71 VAL H H 1 8.31 0.02 . 1 . . . . . . . . 4719 1 662 . 1 1 71 71 VAL HA H 1 3.36 0.02 . 1 . . . . . . . . 4719 1 663 . 1 1 71 71 VAL HB H 1 1.92 0.02 . 1 . . . . . . . . 4719 1 664 . 1 1 71 71 VAL HG11 H 1 0.87 0.02 . 1 . . . . . . . . 4719 1 665 . 1 1 71 71 VAL HG12 H 1 0.87 0.02 . 1 . . . . . . . . 4719 1 666 . 1 1 71 71 VAL HG13 H 1 0.87 0.02 . 1 . . . . . . . . 4719 1 667 . 1 1 71 71 VAL HG21 H 1 0.39 0.02 . 1 . . . . . . . . 4719 1 668 . 1 1 71 71 VAL HG22 H 1 0.39 0.02 . 1 . . . . . . . . 4719 1 669 . 1 1 71 71 VAL HG23 H 1 0.39 0.02 . 1 . . . . . . . . 4719 1 670 . 1 1 71 71 VAL C C 13 177.57 0.04 . 1 . . . . . . . . 4719 1 671 . 1 1 71 71 VAL CA C 13 66.71 0.04 . 1 . . . . . . . . 4719 1 672 . 1 1 71 71 VAL CB C 13 31.52 0.04 . 1 . . . . . . . . 4719 1 673 . 1 1 71 71 VAL CG1 C 13 23.65 0.04 . 1 . . . . . . . . 4719 1 674 . 1 1 71 71 VAL CG2 C 13 22.36 0.04 . 1 . . . . . . . . 4719 1 675 . 1 1 71 71 VAL N N 15 120.41 0.05 . 1 . . . . . . . . 4719 1 676 . 1 1 72 72 ILE H H 1 8.70 0.02 . 1 . . . . . . . . 4719 1 677 . 1 1 72 72 ILE HA H 1 3.24 0.02 . 1 . . . . . . . . 4719 1 678 . 1 1 72 72 ILE HB H 1 1.91 0.02 . 1 . . . . . . . . 4719 1 679 . 1 1 72 72 ILE HG12 H 1 0.66 0.02 . 1 . . . . . . . . 4719 1 680 . 1 1 72 72 ILE HG21 H 1 0.86 0.02 . 1 . . . . . . . . 4719 1 681 . 1 1 72 72 ILE HG22 H 1 0.86 0.02 . 1 . . . . . . . . 4719 1 682 . 1 1 72 72 ILE HG23 H 1 0.86 0.02 . 1 . . . . . . . . 4719 1 683 . 1 1 72 72 ILE HD11 H 1 0.87 0.02 . 1 . . . . . . . . 4719 1 684 . 1 1 72 72 ILE HD12 H 1 0.87 0.02 . 1 . . . . . . . . 4719 1 685 . 1 1 72 72 ILE HD13 H 1 0.87 0.02 . 1 . . . . . . . . 4719 1 686 . 1 1 72 72 ILE C C 13 177.25 0.04 . 1 . . . . . . . . 4719 1 687 . 1 1 72 72 ILE CA C 13 67.05 0.04 . 1 . . . . . . . . 4719 1 688 . 1 1 72 72 ILE CB C 13 37.86 0.04 . 1 . . . . . . . . 4719 1 689 . 1 1 72 72 ILE CG1 C 13 29.61 0.04 . 1 . . . . . . . . 4719 1 690 . 1 1 72 72 ILE CG2 C 13 17.68 0.04 . 1 . . . . . . . . 4719 1 691 . 1 1 72 72 ILE CD1 C 13 13.60 0.04 . 1 . . . . . . . . 4719 1 692 . 1 1 72 72 ILE N N 15 120.41 0.05 . 1 . . . . . . . . 4719 1 693 . 1 1 73 73 GLU H H 1 7.90 0.02 . 1 . . . . . . . . 4719 1 694 . 1 1 73 73 GLU HA H 1 3.98 0.02 . 1 . . . . . . . . 4719 1 695 . 1 1 73 73 GLU HB2 H 1 2.10 0.02 . 1 . . . . . . . . 4719 1 696 . 1 1 73 73 GLU HG2 H 1 2.35 0.02 . 1 . . . . . . . . 4719 1 697 . 1 1 73 73 GLU C C 13 179.93 0.04 . 1 . . . . . . . . 4719 1 698 . 1 1 73 73 GLU CA C 13 59.63 0.04 . 1 . . . . . . . . 4719 1 699 . 1 1 73 73 GLU CB C 13 29.01 0.04 . 1 . . . . . . . . 4719 1 700 . 1 1 73 73 GLU N N 15 117.36 0.05 . 1 . . . . . . . . 4719 1 701 . 1 1 74 74 THR H H 1 7.75 0.02 . 1 . . . . . . . . 4719 1 702 . 1 1 74 74 THR HA H 1 3.94 0.02 . 1 . . . . . . . . 4719 1 703 . 1 1 74 74 THR HB H 1 4.11 0.02 . 1 . . . . . . . . 4719 1 704 . 1 1 74 74 THR HG21 H 1 1.15 0.02 . 1 . . . . . . . . 4719 1 705 . 1 1 74 74 THR HG22 H 1 1.15 0.02 . 1 . . . . . . . . 4719 1 706 . 1 1 74 74 THR HG23 H 1 1.15 0.02 . 1 . . . . . . . . 4719 1 707 . 1 1 74 74 THR C C 13 176.81 0.04 . 1 . . . . . . . . 4719 1 708 . 1 1 74 74 THR CA C 13 66.32 0.04 . 1 . . . . . . . . 4719 1 709 . 1 1 74 74 THR CB C 13 68.36 0.04 . 1 . . . . . . . . 4719 1 710 . 1 1 74 74 THR CG2 C 13 22.07 0.04 . 1 . . . . . . . . 4719 1 711 . 1 1 74 74 THR N N 15 115.96 0.05 . 1 . . . . . . . . 4719 1 712 . 1 1 75 75 LEU H H 1 8.51 0.02 . 1 . . . . . . . . 4719 1 713 . 1 1 75 75 LEU HA H 1 4.35 0.02 . 1 . . . . . . . . 4719 1 714 . 1 1 75 75 LEU C C 13 178.27 0.04 . 1 . . . . . . . . 4719 1 715 . 1 1 75 75 LEU CA C 13 57.26 0.04 . 1 . . . . . . . . 4719 1 716 . 1 1 75 75 LEU CB C 13 42.20 0.04 . 1 . . . . . . . . 4719 1 717 . 1 1 75 75 LEU N N 15 121.35 0.05 . 1 . . . . . . . . 4719 1 718 . 1 1 76 76 ALA H H 1 8.82 0.02 . 1 . . . . . . . . 4719 1 719 . 1 1 76 76 ALA HA H 1 3.71 0.02 . 1 . . . . . . . . 4719 1 720 . 1 1 76 76 ALA HB1 H 1 1.36 0.02 . 1 . . . . . . . . 4719 1 721 . 1 1 76 76 ALA HB2 H 1 1.36 0.02 . 1 . . . . . . . . 4719 1 722 . 1 1 76 76 ALA HB3 H 1 1.36 0.02 . 1 . . . . . . . . 4719 1 723 . 1 1 76 76 ALA C C 13 179.64 0.04 . 1 . . . . . . . . 4719 1 724 . 1 1 76 76 ALA CA C 13 55.04 0.04 . 1 . . . . . . . . 4719 1 725 . 1 1 76 76 ALA CB C 13 17.93 0.04 . 1 . . . . . . . . 4719 1 726 . 1 1 76 76 ALA N N 15 121.35 0.05 . 1 . . . . . . . . 4719 1 727 . 1 1 77 77 GLU H H 1 7.15 0.02 . 1 . . . . . . . . 4719 1 728 . 1 1 77 77 GLU HA H 1 4.07 0.02 . 1 . . . . . . . . 4719 1 729 . 1 1 77 77 GLU HB2 H 1 2.13 0.02 . 1 . . . . . . . . 4719 1 730 . 1 1 77 77 GLU C C 13 178.36 0.04 . 1 . . . . . . . . 4719 1 731 . 1 1 77 77 GLU CA C 13 58.06 0.04 . 1 . . . . . . . . 4719 1 732 . 1 1 77 77 GLU CB C 13 29.55 0.04 . 1 . . . . . . . . 4719 1 733 . 1 1 77 77 GLU N N 15 115.06 0.05 . 1 . . . . . . . . 4719 1 734 . 1 1 78 78 LYS H H 1 7.73 0.02 . 1 . . . . . . . . 4719 1 735 . 1 1 78 78 LYS HA H 1 4.04 0.02 . 1 . . . . . . . . 4719 1 736 . 1 1 78 78 LYS HB2 H 1 1.53 0.02 . 1 . . . . . . . . 4719 1 737 . 1 1 78 78 LYS HB3 H 1 1.37 0.02 . 1 . . . . . . . . 4719 1 738 . 1 1 78 78 LYS HG2 H 1 1.49 0.02 . 1 . . . . . . . . 4719 1 739 . 1 1 78 78 LYS C C 13 178.27 0.04 . 1 . . . . . . . . 4719 1 740 . 1 1 78 78 LYS CA C 13 56.92 0.04 . 1 . . . . . . . . 4719 1 741 . 1 1 78 78 LYS CB C 13 32.07 0.04 . 1 . . . . . . . . 4719 1 742 . 1 1 78 78 LYS N N 15 116.90 0.05 . 1 . . . . . . . . 4719 1 743 . 1 1 79 79 PHE H H 1 8.19 0.02 . 1 . . . . . . . . 4719 1 744 . 1 1 79 79 PHE HA H 1 4.67 0.02 . 1 . . . . . . . . 4719 1 745 . 1 1 79 79 PHE HB2 H 1 2.92 0.02 . 1 . . . . . . . . 4719 1 746 . 1 1 79 79 PHE HB3 H 1 2.44 0.02 . 1 . . . . . . . . 4719 1 747 . 1 1 79 79 PHE HD1 H 1 7.11 0.02 . 1 . . . . . . . . 4719 1 748 . 1 1 79 79 PHE HE1 H 1 7.03 0.02 . 1 . . . . . . . . 4719 1 749 . 1 1 79 79 PHE C C 13 175.85 0.04 . 1 . . . . . . . . 4719 1 750 . 1 1 79 79 PHE CA C 13 58.47 0.04 . 1 . . . . . . . . 4719 1 751 . 1 1 79 79 PHE CB C 13 39.07 0.04 . 1 . . . . . . . . 4719 1 752 . 1 1 79 79 PHE N N 15 115.72 0.05 . 1 . . . . . . . . 4719 1 753 . 1 1 80 80 ARG H H 1 7.55 0.02 . 1 . . . . . . . . 4719 1 754 . 1 1 80 80 ARG HA H 1 4.43 0.02 . 1 . . . . . . . . 4719 1 755 . 1 1 80 80 ARG CA C 13 56.77 0.04 . 1 . . . . . . . . 4719 1 756 . 1 1 80 80 ARG CB C 13 29.13 0.04 . 1 . . . . . . . . 4719 1 757 . 1 1 80 80 ARG N N 15 120.41 0.05 . 1 . . . . . . . . 4719 1 758 . 1 1 81 81 PRO HA H 1 4.43 0.02 . 1 . . . . . . . . 4719 1 759 . 1 1 81 81 PRO HB2 H 1 2.28 0.02 . 1 . . . . . . . . 4719 1 760 . 1 1 81 81 PRO HB3 H 1 1.93 0.02 . 1 . . . . . . . . 4719 1 761 . 1 1 81 81 PRO HD2 H 1 3.63 0.02 . 1 . . . . . . . . 4719 1 762 . 1 1 81 81 PRO C C 13 177.22 0.04 . 1 . . . . . . . . 4719 1 763 . 1 1 81 81 PRO CA C 13 64.41 0.04 . 1 . . . . . . . . 4719 1 764 . 1 1 81 81 PRO CB C 13 31.53 0.04 . 1 . . . . . . . . 4719 1 765 . 1 1 81 81 PRO CD C 13 50.07 0.04 . 1 . . . . . . . . 4719 1 766 . 1 1 82 82 ASP H H 1 8.20 0.02 . 1 . . . . . . . . 4719 1 767 . 1 1 82 82 ASP HA H 1 4.60 0.02 . 1 . . . . . . . . 4719 1 768 . 1 1 82 82 ASP HB2 H 1 2.83 0.02 . 1 . . . . . . . . 4719 1 769 . 1 1 82 82 ASP HB3 H 1 2.74 0.02 . 1 . . . . . . . . 4719 1 770 . 1 1 82 82 ASP C C 13 176.55 0.04 . 1 . . . . . . . . 4719 1 771 . 1 1 82 82 ASP CA C 13 54.55 0.04 . 1 . . . . . . . . 4719 1 772 . 1 1 82 82 ASP CB C 13 41.27 0.04 . 1 . . . . . . . . 4719 1 773 . 1 1 82 82 ASP N N 15 116.66 0.05 . 1 . . . . . . . . 4719 1 774 . 1 1 83 83 MET H H 1 7.95 0.02 . 1 . . . . . . . . 4719 1 775 . 1 1 83 83 MET HA H 1 4.50 0.02 . 1 . . . . . . . . 4719 1 776 . 1 1 83 83 MET HB2 H 1 2.05 0.02 . 1 . . . . . . . . 4719 1 777 . 1 1 83 83 MET HG2 H 1 2.49 0.02 . 1 . . . . . . . . 4719 1 778 . 1 1 83 83 MET C C 13 176.46 0.04 . 1 . . . . . . . . 4719 1 779 . 1 1 83 83 MET CA C 13 55.52 0.04 . 1 . . . . . . . . 4719 1 780 . 1 1 83 83 MET CB C 13 32.85 0.04 . 1 . . . . . . . . 4719 1 781 . 1 1 83 83 MET N N 15 119.24 0.05 . 1 . . . . . . . . 4719 1 782 . 1 1 84 84 ARG H H 1 8.33 0.02 . 1 . . . . . . . . 4719 1 783 . 1 1 84 84 ARG HA H 1 4.28 0.02 . 1 . . . . . . . . 4719 1 784 . 1 1 84 84 ARG C C 13 176.58 0.04 . 1 . . . . . . . . 4719 1 785 . 1 1 84 84 ARG CA C 13 56.81 0.04 . 1 . . . . . . . . 4719 1 786 . 1 1 84 84 ARG CB C 13 30.12 0.04 . 1 . . . . . . . . 4719 1 787 . 1 1 84 84 ARG N N 15 120.65 0.05 . 1 . . . . . . . . 4719 1 788 . 1 1 85 85 MET H H 1 8.31 0.02 . 1 . . . . . . . . 4719 1 789 . 1 1 85 85 MET HA H 1 4.47 0.02 . 1 . . . . . . . . 4719 1 790 . 1 1 85 85 MET HB2 H 1 2.16 0.02 . 1 . . . . . . . . 4719 1 791 . 1 1 85 85 MET HB3 H 1 2.05 0.02 . 1 . . . . . . . . 4719 1 792 . 1 1 85 85 MET HG2 H 1 2.63 0.02 . 1 . . . . . . . . 4719 1 793 . 1 1 85 85 MET HG3 H 1 2.57 0.02 . 1 . . . . . . . . 4719 1 794 . 1 1 85 85 MET C C 13 176.17 0.04 . 1 . . . . . . . . 4719 1 795 . 1 1 85 85 MET CA C 13 55.50 0.04 . 1 . . . . . . . . 4719 1 796 . 1 1 85 85 MET CB C 13 32.45 0.04 . 1 . . . . . . . . 4719 1 797 . 1 1 85 85 MET N N 15 119.24 0.05 . 1 . . . . . . . . 4719 1 798 . 1 1 86 86 LEU H H 1 8.21 0.02 . 1 . . . . . . . . 4719 1 799 . 1 1 86 86 LEU HA H 1 4.33 0.02 . 1 . . . . . . . . 4719 1 800 . 1 1 86 86 LEU HB2 H 1 1.72 0.02 . 1 . . . . . . . . 4719 1 801 . 1 1 86 86 LEU HB3 H 1 1.63 0.02 . 1 . . . . . . . . 4719 1 802 . 1 1 86 86 LEU HG H 1 1.63 0.02 . 1 . . . . . . . . 4719 1 803 . 1 1 86 86 LEU HD11 H 1 0.96 0.02 . 1 . . . . . . . . 4719 1 804 . 1 1 86 86 LEU HD12 H 1 0.96 0.02 . 1 . . . . . . . . 4719 1 805 . 1 1 86 86 LEU HD13 H 1 0.96 0.02 . 1 . . . . . . . . 4719 1 806 . 1 1 86 86 LEU HD21 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 807 . 1 1 86 86 LEU HD22 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 808 . 1 1 86 86 LEU HD23 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 809 . 1 1 86 86 LEU C C 13 177.19 0.04 . 1 . . . . . . . . 4719 1 810 . 1 1 86 86 LEU CA C 13 55.39 0.04 . 1 . . . . . . . . 4719 1 811 . 1 1 86 86 LEU CB C 13 42.27 0.04 . 1 . . . . . . . . 4719 1 812 . 1 1 86 86 LEU CG C 13 26.41 0.04 . 1 . . . . . . . . 4719 1 813 . 1 1 86 86 LEU CD1 C 13 24.27 0.04 . 1 . . . . . . . . 4719 1 814 . 1 1 86 86 LEU CD2 C 13 23.20 0.04 . 1 . . . . . . . . 4719 1 815 . 1 1 86 86 LEU N N 15 122.29 0.05 . 1 . . . . . . . . 4719 1 816 . 1 1 87 87 SER H H 1 8.02 0.02 . 1 . . . . . . . . 4719 1 817 . 1 1 87 87 SER HA H 1 4.45 0.02 . 1 . . . . . . . . 4719 1 818 . 1 1 87 87 SER HB2 H 1 3.83 0.02 . 1 . . . . . . . . 4719 1 819 . 1 1 87 87 SER HB3 H 1 3.83 0.02 . 1 . . . . . . . . 4719 1 820 . 1 1 87 87 SER C C 13 176.34 0.04 . 1 . . . . . . . . 4719 1 821 . 1 1 87 87 SER CA C 13 57.79 0.04 . 1 . . . . . . . . 4719 1 822 . 1 1 87 87 SER CB C 13 63.77 0.04 . 1 . . . . . . . . 4719 1 823 . 1 1 87 87 SER N N 15 114.55 0.05 . 1 . . . . . . . . 4719 1 824 . 1 1 88 88 SER H H 1 8.43 0.02 . 1 . . . . . . . . 4719 1 825 . 1 1 88 88 SER HA H 1 4.50 0.02 . 1 . . . . . . . . 4719 1 826 . 1 1 88 88 SER HB2 H 1 3.86 0.02 . 1 . . . . . . . . 4719 1 827 . 1 1 88 88 SER HB3 H 1 3.86 0.02 . 1 . . . . . . . . 4719 1 828 . 1 1 88 88 SER CA C 13 56.57 0.04 . 1 . . . . . . . . 4719 1 829 . 1 1 88 88 SER CB C 13 63.40 0.04 . 1 . . . . . . . . 4719 1 830 . 1 1 88 88 SER N N 15 117.53 0.05 . 1 . . . . . . . . 4719 1 831 . 1 1 89 89 PRO HA H 1 4.31 0.02 . 1 . . . . . . . . 4719 1 832 . 1 1 89 89 PRO HD2 H 1 3.66 0.02 . 1 . . . . . . . . 4719 1 833 . 1 1 89 89 PRO HD3 H 1 3.57 0.02 . 1 . . . . . . . . 4719 1 834 . 1 1 89 89 PRO C C 13 176.03 0.04 . 1 . . . . . . . . 4719 1 835 . 1 1 89 89 PRO CA C 13 62.84 0.04 . 1 . . . . . . . . 4719 1 836 . 1 1 89 89 PRO CB C 13 31.97 0.04 . 1 . . . . . . . . 4719 1 837 . 1 1 89 89 PRO CD C 13 49.05 0.04 . 1 . . . . . . . . 4719 1 838 . 1 1 90 90 LYS H H 1 7.80 0.02 . 1 . . . . . . . . 4719 1 839 . 1 1 90 90 LYS HA H 1 4.38 0.02 . 1 . . . . . . . . 4719 1 840 . 1 1 90 90 LYS HB2 H 1 1.83 0.02 . 1 . . . . . . . . 4719 1 841 . 1 1 90 90 LYS HB3 H 1 1.70 0.02 . 1 . . . . . . . . 4719 1 842 . 1 1 90 90 LYS HG2 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 843 . 1 1 90 90 LYS HE2 H 1 3.01 0.02 . 1 . . . . . . . . 4719 1 844 . 1 1 90 90 LYS C C 13 175.24 0.04 . 1 . . . . . . . . 4719 1 845 . 1 1 90 90 LYS CA C 13 55.05 0.04 . 1 . . . . . . . . 4719 1 846 . 1 1 90 90 LYS CB C 13 33.38 0.04 . 1 . . . . . . . . 4719 1 847 . 1 1 90 90 LYS CG C 13 24.40 0.04 . 1 . . . . . . . . 4719 1 848 . 1 1 90 90 LYS CD C 13 30.02 0.04 . 1 . . . . . . . . 4719 1 849 . 1 1 90 90 LYS CE C 13 41.10 0.04 . 1 . . . . . . . . 4719 1 850 . 1 1 90 90 LYS N N 15 122.05 0.05 . 1 . . . . . . . . 4719 1 851 . 1 1 91 91 TYR H H 1 8.43 0.02 . 1 . . . . . . . . 4719 1 852 . 1 1 91 91 TYR HA H 1 5.53 0.02 . 1 . . . . . . . . 4719 1 853 . 1 1 91 91 TYR HB2 H 1 2.98 0.02 . 1 . . . . . . . . 4719 1 854 . 1 1 91 91 TYR HB3 H 1 2.75 0.02 . 1 . . . . . . . . 4719 1 855 . 1 1 91 91 TYR HD1 H 1 6.97 0.02 . 1 . . . . . . . . 4719 1 856 . 1 1 91 91 TYR HE1 H 1 6.69 0.02 . 1 . . . . . . . . 4719 1 857 . 1 1 91 91 TYR C C 13 176.44 0.04 . 1 . . . . . . . . 4719 1 858 . 1 1 91 91 TYR CA C 13 57.05 0.04 . 1 . . . . . . . . 4719 1 859 . 1 1 91 91 TYR CB C 13 41.93 0.04 . 1 . . . . . . . . 4719 1 860 . 1 1 91 91 TYR N N 15 122.67 0.05 . 1 . . . . . . . . 4719 1 861 . 1 1 92 92 SER H H 1 9.06 0.02 . 1 . . . . . . . . 4719 1 862 . 1 1 92 92 SER HA H 1 4.68 0.02 . 1 . . . . . . . . 4719 1 863 . 1 1 92 92 SER HB2 H 1 3.82 0.02 . 1 . . . . . . . . 4719 1 864 . 1 1 92 92 SER HB3 H 1 3.80 0.02 . 1 . . . . . . . . 4719 1 865 . 1 1 92 92 SER C C 13 171.20 0.04 . 1 . . . . . . . . 4719 1 866 . 1 1 92 92 SER CA C 13 57.60 0.04 . 1 . . . . . . . . 4719 1 867 . 1 1 92 92 SER CB C 13 67.11 0.04 . 1 . . . . . . . . 4719 1 868 . 1 1 92 92 SER N N 15 115.50 0.05 . 1 . . . . . . . . 4719 1 869 . 1 1 93 93 LEU H H 1 9.47 0.02 . 1 . . . . . . . . 4719 1 870 . 1 1 93 93 LEU HA H 1 5.41 0.02 . 1 . . . . . . . . 4719 1 871 . 1 1 93 93 LEU HB2 H 1 2.03 0.02 . 1 . . . . . . . . 4719 1 872 . 1 1 93 93 LEU HB3 H 1 1.20 0.02 . 1 . . . . . . . . 4719 1 873 . 1 1 93 93 LEU HG H 1 1.86 0.02 . 1 . . . . . . . . 4719 1 874 . 1 1 93 93 LEU HD11 H 1 1.18 0.02 . 1 . . . . . . . . 4719 1 875 . 1 1 93 93 LEU HD12 H 1 1.18 0.02 . 1 . . . . . . . . 4719 1 876 . 1 1 93 93 LEU HD13 H 1 1.18 0.02 . 1 . . . . . . . . 4719 1 877 . 1 1 93 93 LEU HD21 H 1 1.04 0.02 . 1 . . . . . . . . 4719 1 878 . 1 1 93 93 LEU HD22 H 1 1.04 0.02 . 1 . . . . . . . . 4719 1 879 . 1 1 93 93 LEU HD23 H 1 1.04 0.02 . 1 . . . . . . . . 4719 1 880 . 1 1 93 93 LEU C C 13 174.09 0.04 . 1 . . . . . . . . 4719 1 881 . 1 1 93 93 LEU CA C 13 53.51 0.04 . 1 . . . . . . . . 4719 1 882 . 1 1 93 93 LEU CB C 13 45.94 0.04 . 1 . . . . . . . . 4719 1 883 . 1 1 93 93 LEU CG C 13 27.34 0.04 . 1 . . . . . . . . 4719 1 884 . 1 1 93 93 LEU CD1 C 13 23.74 0.04 . 1 . . . . . . . . 4719 1 885 . 1 1 93 93 LEU CD2 C 13 25.87 0.04 . 1 . . . . . . . . 4719 1 886 . 1 1 93 93 LEU N N 15 125.80 0.05 . 1 . . . . . . . . 4719 1 887 . 1 1 94 94 TYR H H 1 9.64 0.02 . 1 . . . . . . . . 4719 1 888 . 1 1 94 94 TYR HA H 1 5.42 0.02 . 1 . . . . . . . . 4719 1 889 . 1 1 94 94 TYR HB2 H 1 2.92 0.02 . 1 . . . . . . . . 4719 1 890 . 1 1 94 94 TYR HB3 H 1 2.60 0.02 . 1 . . . . . . . . 4719 1 891 . 1 1 94 94 TYR HD1 H 1 6.96 0.02 . 1 . . . . . . . . 4719 1 892 . 1 1 94 94 TYR HE1 H 1 6.84 0.02 . 1 . . . . . . . . 4719 1 893 . 1 1 94 94 TYR C C 13 176.22 0.04 . 1 . . . . . . . . 4719 1 894 . 1 1 94 94 TYR CA C 13 56.30 0.04 . 1 . . . . . . . . 4719 1 895 . 1 1 94 94 TYR CB C 13 41.46 0.04 . 1 . . . . . . . . 4719 1 896 . 1 1 94 94 TYR N N 15 124.40 0.05 . 1 . . . . . . . . 4719 1 897 . 1 1 95 95 GLU H H 1 9.12 0.02 . 1 . . . . . . . . 4719 1 898 . 1 1 95 95 GLU HA H 1 4.99 0.02 . 1 . . . . . . . . 4719 1 899 . 1 1 95 95 GLU HB2 H 1 2.03 0.02 . 1 . . . . . . . . 4719 1 900 . 1 1 95 95 GLU HB3 H 1 2.03 0.02 . 1 . . . . . . . . 4719 1 901 . 1 1 95 95 GLU HG2 H 1 2.61 0.02 . 1 . . . . . . . . 4719 1 902 . 1 1 95 95 GLU HG3 H 1 2.44 0.02 . 1 . . . . . . . . 4719 1 903 . 1 1 95 95 GLU C C 13 175.34 0.04 . 1 . . . . . . . . 4719 1 904 . 1 1 95 95 GLU CA C 13 54.00 0.04 . 1 . . . . . . . . 4719 1 905 . 1 1 95 95 GLU CB C 13 31.78 0.04 . 1 . . . . . . . . 4719 1 906 . 1 1 95 95 GLU CG C 13 35.48 0.04 . 1 . . . . . . . . 4719 1 907 . 1 1 95 95 GLU N N 15 119.24 0.05 . 1 . . . . . . . . 4719 1 908 . 1 1 96 96 VAL H H 1 9.20 0.02 . 1 . . . . . . . . 4719 1 909 . 1 1 96 96 VAL HA H 1 4.32 0.02 . 1 . . . . . . . . 4719 1 910 . 1 1 96 96 VAL HB H 1 1.64 0.02 . 1 . . . . . . . . 4719 1 911 . 1 1 96 96 VAL HG11 H 1 0.84 0.02 . 1 . . . . . . . . 4719 1 912 . 1 1 96 96 VAL HG12 H 1 0.84 0.02 . 1 . . . . . . . . 4719 1 913 . 1 1 96 96 VAL HG13 H 1 0.84 0.02 . 1 . . . . . . . . 4719 1 914 . 1 1 96 96 VAL HG21 H 1 0.79 0.02 . 1 . . . . . . . . 4719 1 915 . 1 1 96 96 VAL HG22 H 1 0.79 0.02 . 1 . . . . . . . . 4719 1 916 . 1 1 96 96 VAL HG23 H 1 0.79 0.02 . 1 . . . . . . . . 4719 1 917 . 1 1 96 96 VAL C C 13 174.30 0.04 . 1 . . . . . . . . 4719 1 918 . 1 1 96 96 VAL CA C 13 62.73 0.04 . 1 . . . . . . . . 4719 1 919 . 1 1 96 96 VAL CB C 13 33.78 0.04 . 1 . . . . . . . . 4719 1 920 . 1 1 96 96 VAL CG1 C 13 21.07 0.04 . 1 . . . . . . . . 4719 1 921 . 1 1 96 96 VAL CG2 C 13 20.01 0.04 . 1 . . . . . . . . 4719 1 922 . 1 1 96 96 VAL N N 15 125.57 0.05 . 1 . . . . . . . . 4719 1 923 . 1 1 97 97 HIS H H 1 8.59 0.02 . 1 . . . . . . . . 4719 1 924 . 1 1 97 97 HIS HA H 1 4.76 0.02 . 1 . . . . . . . . 4719 1 925 . 1 1 97 97 HIS HB2 H 1 2.86 0.02 . 1 . . . . . . . . 4719 1 926 . 1 1 97 97 HIS HB3 H 1 3.49 0.02 . 1 . . . . . . . . 4719 1 927 . 1 1 97 97 HIS CA C 13 53.67 0.04 . 1 . . . . . . . . 4719 1 928 . 1 1 97 97 HIS CB C 13 33.05 0.04 . 1 . . . . . . . . 4719 1 929 . 1 1 97 97 HIS N N 15 124.86 0.05 . 1 . . . . . . . . 4719 1 930 . 1 1 98 98 VAL HA H 1 3.79 0.02 . 1 . . . . . . . . 4719 1 931 . 1 1 98 98 VAL HB H 1 2.09 0.02 . 1 . . . . . . . . 4719 1 932 . 1 1 98 98 VAL HG11 H 1 1.03 0.02 . 1 . . . . . . . . 4719 1 933 . 1 1 98 98 VAL HG12 H 1 1.03 0.02 . 1 . . . . . . . . 4719 1 934 . 1 1 98 98 VAL HG13 H 1 1.03 0.02 . 1 . . . . . . . . 4719 1 935 . 1 1 98 98 VAL HG21 H 1 0.97 0.02 . 1 . . . . . . . . 4719 1 936 . 1 1 98 98 VAL HG22 H 1 0.97 0.02 . 1 . . . . . . . . 4719 1 937 . 1 1 98 98 VAL HG23 H 1 0.97 0.02 . 1 . . . . . . . . 4719 1 938 . 1 1 98 98 VAL C C 13 177.36 0.04 . 1 . . . . . . . . 4719 1 939 . 1 1 98 98 VAL CA C 13 65.84 0.04 . 1 . . . . . . . . 4719 1 940 . 1 1 98 98 VAL CB C 13 30.81 0.04 . 1 . . . . . . . . 4719 1 941 . 1 1 98 98 VAL CG1 C 13 21.07 0.04 . 1 . . . . . . . . 4719 1 942 . 1 1 98 98 VAL CG2 C 13 20.01 0.04 . 1 . . . . . . . . 4719 1 943 . 1 1 99 99 SER H H 1 7.67 0.02 . 1 . . . . . . . . 4719 1 944 . 1 1 99 99 SER HA H 1 4.40 0.02 . 1 . . . . . . . . 4719 1 945 . 1 1 99 99 SER HB2 H 1 3.98 0.02 . 1 . . . . . . . . 4719 1 946 . 1 1 99 99 SER HB3 H 1 3.79 0.02 . 1 . . . . . . . . 4719 1 947 . 1 1 99 99 SER C C 13 174.44 0.04 . 1 . . . . . . . . 4719 1 948 . 1 1 99 99 SER CA C 13 58.02 0.04 . 1 . . . . . . . . 4719 1 949 . 1 1 99 99 SER CB C 13 63.50 0.04 . 1 . . . . . . . . 4719 1 950 . 1 1 99 99 SER N N 15 109.86 0.05 . 1 . . . . . . . . 4719 1 951 . 1 1 100 100 GLY H H 1 7.41 0.02 . 1 . . . . . . . . 4719 1 952 . 1 1 100 100 GLY HA2 H 1 4.46 0.02 . 1 . . . . . . . . 4719 1 953 . 1 1 100 100 GLY HA3 H 1 3.89 0.02 . 1 . . . . . . . . 4719 1 954 . 1 1 100 100 GLY C C 13 171.17 0.04 . 1 . . . . . . . . 4719 1 955 . 1 1 100 100 GLY CA C 13 44.97 0.04 . 1 . . . . . . . . 4719 1 956 . 1 1 100 100 GLY N N 15 109.63 0.05 . 1 . . . . . . . . 4719 1 957 . 1 1 101 101 GLU H H 1 8.47 0.02 . 1 . . . . . . . . 4719 1 958 . 1 1 101 101 GLU HA H 1 5.67 0.02 . 1 . . . . . . . . 4719 1 959 . 1 1 101 101 GLU HB2 H 1 2.32 0.02 . 1 . . . . . . . . 4719 1 960 . 1 1 101 101 GLU HB3 H 1 2.17 0.02 . 1 . . . . . . . . 4719 1 961 . 1 1 101 101 GLU HG2 H 1 2.08 0.02 . 1 . . . . . . . . 4719 1 962 . 1 1 101 101 GLU HG3 H 1 2.08 0.02 . 1 . . . . . . . . 4719 1 963 . 1 1 101 101 GLU C C 13 175.63 0.04 . 1 . . . . . . . . 4719 1 964 . 1 1 101 101 GLU CA C 13 53.74 0.04 . 1 . . . . . . . . 4719 1 965 . 1 1 101 101 GLU CB C 13 34.25 0.04 . 1 . . . . . . . . 4719 1 966 . 1 1 101 101 GLU CG C 13 34.25 0.04 . 1 . . . . . . . . 4719 1 967 . 1 1 101 101 GLU N N 15 116.66 0.05 . 1 . . . . . . . . 4719 1 968 . 1 1 102 102 ARG H H 1 9.02 0.02 . 1 . . . . . . . . 4719 1 969 . 1 1 102 102 ARG HA H 1 4.72 0.02 . 1 . . . . . . . . 4719 1 970 . 1 1 102 102 ARG HB2 H 1 2.00 0.02 . 1 . . . . . . . . 4719 1 971 . 1 1 102 102 ARG HB3 H 1 1.76 0.02 . 1 . . . . . . . . 4719 1 972 . 1 1 102 102 ARG HG2 H 1 1.67 0.02 . 1 . . . . . . . . 4719 1 973 . 1 1 102 102 ARG HG3 H 1 1.57 0.02 . 1 . . . . . . . . 4719 1 974 . 1 1 102 102 ARG HD2 H 1 3.46 0.02 . 1 . . . . . . . . 4719 1 975 . 1 1 102 102 ARG HD3 H 1 3.03 0.02 . 1 . . . . . . . . 4719 1 976 . 1 1 102 102 ARG C C 13 173.91 0.04 . 1 . . . . . . . . 4719 1 977 . 1 1 102 102 ARG CA C 13 55.58 0.04 . 1 . . . . . . . . 4719 1 978 . 1 1 102 102 ARG CB C 13 34.92 0.04 . 1 . . . . . . . . 4719 1 979 . 1 1 102 102 ARG CD C 13 42.49 0.04 . 1 . . . . . . . . 4719 1 980 . 1 1 102 102 ARG N N 15 121.83 0.05 . 1 . . . . . . . . 4719 1 981 . 1 1 103 103 ARG H H 1 8.88 0.02 . 1 . . . . . . . . 4719 1 982 . 1 1 103 103 ARG HA H 1 3.51 0.02 . 1 . . . . . . . . 4719 1 983 . 1 1 103 103 ARG HB2 H 1 1.58 0.02 . 1 . . . . . . . . 4719 1 984 . 1 1 103 103 ARG HB3 H 1 1.20 0.02 . 1 . . . . . . . . 4719 1 985 . 1 1 103 103 ARG HG2 H 1 0.92 0.02 . 1 . . . . . . . . 4719 1 986 . 1 1 103 103 ARG HD2 H 1 3.16 0.02 . 1 . . . . . . . . 4719 1 987 . 1 1 103 103 ARG HD3 H 1 3.07 0.02 . 1 . . . . . . . . 4719 1 988 . 1 1 103 103 ARG C C 13 175.87 0.04 . 1 . . . . . . . . 4719 1 989 . 1 1 103 103 ARG CA C 13 55.97 0.04 . 1 . . . . . . . . 4719 1 990 . 1 1 103 103 ARG CB C 13 30.25 0.04 . 1 . . . . . . . . 4719 1 991 . 1 1 103 103 ARG CG C 13 27.03 0.04 . 1 . . . . . . . . 4719 1 992 . 1 1 103 103 ARG CD C 13 43.44 0.04 . 1 . . . . . . . . 4719 1 993 . 1 1 103 103 ARG N N 15 129.79 0.05 . 1 . . . . . . . . 4719 1 994 . 1 1 104 104 LEU H H 1 9.05 0.02 . 1 . . . . . . . . 4719 1 995 . 1 1 104 104 LEU HA H 1 4.39 0.02 . 1 . . . . . . . . 4719 1 996 . 1 1 104 104 LEU C C 13 178.02 0.04 . 1 . . . . . . . . 4719 1 997 . 1 1 104 104 LEU CA C 13 56.66 0.04 . 1 . . . . . . . . 4719 1 998 . 1 1 104 104 LEU CB C 13 42.07 0.04 . 1 . . . . . . . . 4719 1 999 . 1 1 104 104 LEU CG C 13 26.71 0.04 . 1 . . . . . . . . 4719 1 1000 . 1 1 104 104 LEU N N 15 130.96 0.05 . 1 . . . . . . . . 4719 1 1001 . 1 1 105 105 ASP H H 1 9.70 0.02 . 1 . . . . . . . . 4719 1 1002 . 1 1 105 105 ASP HA H 1 4.79 0.02 . 1 . . . . . . . . 4719 1 1003 . 1 1 105 105 ASP HB2 H 1 2.98 0.02 . 1 . . . . . . . . 4719 1 1004 . 1 1 105 105 ASP HB3 H 1 2.86 0.02 . 1 . . . . . . . . 4719 1 1005 . 1 1 105 105 ASP C C 13 179.35 0.04 . 1 . . . . . . . . 4719 1 1006 . 1 1 105 105 ASP CA C 13 54.00 0.04 . 1 . . . . . . . . 4719 1 1007 . 1 1 105 105 ASP CB C 13 42.30 0.04 . 1 . . . . . . . . 4719 1 1008 . 1 1 105 105 ASP N N 15 122.52 0.05 . 1 . . . . . . . . 4719 1 1009 . 1 1 106 106 ILE H H 1 8.61 0.02 . 1 . . . . . . . . 4719 1 1010 . 1 1 106 106 ILE HA H 1 3.91 0.02 . 1 . . . . . . . . 4719 1 1011 . 1 1 106 106 ILE HB H 1 2.03 0.02 . 1 . . . . . . . . 4719 1 1012 . 1 1 106 106 ILE HG12 H 1 1.53 0.02 . 1 . . . . . . . . 4719 1 1013 . 1 1 106 106 ILE HG13 H 1 1.42 0.02 . 1 . . . . . . . . 4719 1 1014 . 1 1 106 106 ILE HG21 H 1 1.12 0.02 . 1 . . . . . . . . 4719 1 1015 . 1 1 106 106 ILE HG22 H 1 1.12 0.02 . 1 . . . . . . . . 4719 1 1016 . 1 1 106 106 ILE HG23 H 1 1.12 0.02 . 1 . . . . . . . . 4719 1 1017 . 1 1 106 106 ILE HD11 H 1 0.96 0.02 . 1 . . . . . . . . 4719 1 1018 . 1 1 106 106 ILE HD12 H 1 0.96 0.02 . 1 . . . . . . . . 4719 1 1019 . 1 1 106 106 ILE HD13 H 1 0.96 0.02 . 1 . . . . . . . . 4719 1 1020 . 1 1 106 106 ILE C C 13 175.21 0.04 . 1 . . . . . . . . 4719 1 1021 . 1 1 106 106 ILE CA C 13 64.40 0.04 . 1 . . . . . . . . 4719 1 1022 . 1 1 106 106 ILE CB C 13 38.99 0.04 . 1 . . . . . . . . 4719 1 1023 . 1 1 106 106 ILE CG2 C 13 18.59 0.04 . 1 . . . . . . . . 4719 1 1024 . 1 1 106 106 ILE CD1 C 13 14.18 0.04 . 1 . . . . . . . . 4719 1 1025 . 1 1 106 106 ILE N N 15 118.77 0.05 . 1 . . . . . . . . 4719 1 1026 . 1 1 107 107 ASP H H 1 8.38 0.02 . 1 . . . . . . . . 4719 1 1027 . 1 1 107 107 ASP HA H 1 4.74 0.02 . 1 . . . . . . . . 4719 1 1028 . 1 1 107 107 ASP HB2 H 1 2.84 0.02 . 1 . . . . . . . . 4719 1 1029 . 1 1 107 107 ASP HB3 H 1 2.68 0.02 . 1 . . . . . . . . 4719 1 1030 . 1 1 107 107 ASP C C 13 177.49 0.04 . 1 . . . . . . . . 4719 1 1031 . 1 1 107 107 ASP CA C 13 53.17 0.04 . 1 . . . . . . . . 4719 1 1032 . 1 1 107 107 ASP CB C 13 40.73 0.04 . 1 . . . . . . . . 4719 1 1033 . 1 1 107 107 ASP N N 15 116.19 0.05 . 1 . . . . . . . . 4719 1 1034 . 1 1 108 108 GLU H H 1 7.38 0.02 . 1 . . . . . . . . 4719 1 1035 . 1 1 108 108 GLU HA H 1 4.25 0.02 . 1 . . . . . . . . 4719 1 1036 . 1 1 108 108 GLU C C 13 174.94 0.04 . 1 . . . . . . . . 4719 1 1037 . 1 1 108 108 GLU CA C 13 57.77 0.04 . 1 . . . . . . . . 4719 1 1038 . 1 1 108 108 GLU CB C 13 31.57 0.04 . 1 . . . . . . . . 4719 1 1039 . 1 1 108 108 GLU N N 15 119.24 0.05 . 1 . . . . . . . . 4719 1 1040 . 1 1 109 109 LYS H H 1 8.65 0.02 . 1 . . . . . . . . 4719 1 1041 . 1 1 109 109 LYS HA H 1 5.34 0.02 . 1 . . . . . . . . 4719 1 1042 . 1 1 109 109 LYS HB2 H 1 1.95 0.02 . 1 . . . . . . . . 4719 1 1043 . 1 1 109 109 LYS HB3 H 1 1.76 0.02 . 1 . . . . . . . . 4719 1 1044 . 1 1 109 109 LYS HG2 H 1 1.30 0.02 . 1 . . . . . . . . 4719 1 1045 . 1 1 109 109 LYS CA C 13 52.66 0.04 . 1 . . . . . . . . 4719 1 1046 . 1 1 109 109 LYS CB C 13 31.10 0.04 . 1 . . . . . . . . 4719 1 1047 . 1 1 109 109 LYS CG C 13 24.50 0.04 . 1 . . . . . . . . 4719 1 1048 . 1 1 109 109 LYS CD C 13 28.61 0.04 . 1 . . . . . . . . 4719 1 1049 . 1 1 109 109 LYS CE C 13 42.49 0.04 . 1 . . . . . . . . 4719 1 1050 . 1 1 109 109 LYS N N 15 120.41 0.05 . 1 . . . . . . . . 4719 1 1051 . 1 1 110 110 PRO HA H 1 3.67 0.02 . 1 . . . . . . . . 4719 1 1052 . 1 1 110 110 PRO HB2 H 1 1.66 0.02 . 1 . . . . . . . . 4719 1 1053 . 1 1 110 110 PRO HB3 H 1 1.42 0.02 . 1 . . . . . . . . 4719 1 1054 . 1 1 110 110 PRO HD2 H 1 4.07 0.02 . 1 . . . . . . . . 4719 1 1055 . 1 1 110 110 PRO HD3 H 1 3.49 0.02 . 1 . . . . . . . . 4719 1 1056 . 1 1 110 110 PRO C C 13 175.63 0.04 . 1 . . . . . . . . 4719 1 1057 . 1 1 110 110 PRO CA C 13 66.27 0.04 . 1 . . . . . . . . 4719 1 1058 . 1 1 110 110 PRO CB C 13 31.69 0.04 . 1 . . . . . . . . 4719 1 1059 . 1 1 110 110 PRO CG C 13 27.34 0.04 . 1 . . . . . . . . 4719 1 1060 . 1 1 110 110 PRO CD C 13 50.07 0.04 . 1 . . . . . . . . 4719 1 1061 . 1 1 111 111 LEU H H 1 8.84 0.02 . 1 . . . . . . . . 4719 1 1062 . 1 1 111 111 LEU HA H 1 3.92 0.02 . 1 . . . . . . . . 4719 1 1063 . 1 1 111 111 LEU HB2 H 1 1.13 0.02 . 1 . . . . . . . . 4719 1 1064 . 1 1 111 111 LEU HB3 H 1 1.04 0.02 . 1 . . . . . . . . 4719 1 1065 . 1 1 111 111 LEU HG H 1 1.55 0.02 . 1 . . . . . . . . 4719 1 1066 . 1 1 111 111 LEU HD11 H 1 0.76 0.02 . 1 . . . . . . . . 4719 1 1067 . 1 1 111 111 LEU HD12 H 1 0.76 0.02 . 1 . . . . . . . . 4719 1 1068 . 1 1 111 111 LEU HD13 H 1 0.76 0.02 . 1 . . . . . . . . 4719 1 1069 . 1 1 111 111 LEU HD21 H 1 0.67 0.02 . 1 . . . . . . . . 4719 1 1070 . 1 1 111 111 LEU HD22 H 1 0.67 0.02 . 1 . . . . . . . . 4719 1 1071 . 1 1 111 111 LEU HD23 H 1 0.67 0.02 . 1 . . . . . . . . 4719 1 1072 . 1 1 111 111 LEU C C 13 178.58 0.04 . 1 . . . . . . . . 4719 1 1073 . 1 1 111 111 LEU CA C 13 57.63 0.04 . 1 . . . . . . . . 4719 1 1074 . 1 1 111 111 LEU CB C 13 42.34 0.04 . 1 . . . . . . . . 4719 1 1075 . 1 1 111 111 LEU CG C 13 25.87 0.04 . 1 . . . . . . . . 4719 1 1076 . 1 1 111 111 LEU CD1 C 13 22.67 0.04 . 1 . . . . . . . . 4719 1 1077 . 1 1 111 111 LEU CD2 C 13 28.01 0.04 . 1 . . . . . . . . 4719 1 1078 . 1 1 111 111 LEU N N 15 115.96 0.05 . 1 . . . . . . . . 4719 1 1079 . 1 1 112 112 VAL H H 1 6.89 0.02 . 1 . . . . . . . . 4719 1 1080 . 1 1 112 112 VAL HA H 1 3.45 0.02 . 1 . . . . . . . . 4719 1 1081 . 1 1 112 112 VAL HB H 1 2.32 0.02 . 1 . . . . . . . . 4719 1 1082 . 1 1 112 112 VAL HG11 H 1 1.02 0.02 . 1 . . . . . . . . 4719 1 1083 . 1 1 112 112 VAL HG12 H 1 1.02 0.02 . 1 . . . . . . . . 4719 1 1084 . 1 1 112 112 VAL HG13 H 1 1.02 0.02 . 1 . . . . . . . . 4719 1 1085 . 1 1 112 112 VAL HG21 H 1 0.97 0.02 . 1 . . . . . . . . 4719 1 1086 . 1 1 112 112 VAL HG22 H 1 0.97 0.02 . 1 . . . . . . . . 4719 1 1087 . 1 1 112 112 VAL HG23 H 1 0.97 0.02 . 1 . . . . . . . . 4719 1 1088 . 1 1 112 112 VAL C C 13 178.31 0.04 . 1 . . . . . . . . 4719 1 1089 . 1 1 112 112 VAL CA C 13 65.90 0.04 . 1 . . . . . . . . 4719 1 1090 . 1 1 112 112 VAL CB C 13 31.45 0.04 . 1 . . . . . . . . 4719 1 1091 . 1 1 112 112 VAL CG1 C 13 21.07 0.04 . 1 . . . . . . . . 4719 1 1092 . 1 1 112 112 VAL CG2 C 13 22.67 0.04 . 1 . . . . . . . . 4719 1 1093 . 1 1 112 112 VAL N N 15 117.83 0.05 . 1 . . . . . . . . 4719 1 1094 . 1 1 113 113 VAL H H 1 7.82 0.02 . 1 . . . . . . . . 4719 1 1095 . 1 1 113 113 VAL HA H 1 3.53 0.02 . 1 . . . . . . . . 4719 1 1096 . 1 1 113 113 VAL HB H 1 2.29 0.02 . 1 . . . . . . . . 4719 1 1097 . 1 1 113 113 VAL HG11 H 1 1.05 0.02 . 1 . . . . . . . . 4719 1 1098 . 1 1 113 113 VAL HG12 H 1 1.05 0.02 . 1 . . . . . . . . 4719 1 1099 . 1 1 113 113 VAL HG13 H 1 1.05 0.02 . 1 . . . . . . . . 4719 1 1100 . 1 1 113 113 VAL HG21 H 1 1.00 0.02 . 1 . . . . . . . . 4719 1 1101 . 1 1 113 113 VAL HG22 H 1 1.00 0.02 . 1 . . . . . . . . 4719 1 1102 . 1 1 113 113 VAL HG23 H 1 1.00 0.02 . 1 . . . . . . . . 4719 1 1103 . 1 1 113 113 VAL C C 13 178.07 0.04 . 1 . . . . . . . . 4719 1 1104 . 1 1 113 113 VAL CA C 13 66.33 0.04 . 1 . . . . . . . . 4719 1 1105 . 1 1 113 113 VAL CB C 13 30.79 0.04 . 1 . . . . . . . . 4719 1 1106 . 1 1 113 113 VAL CG1 C 13 22.67 0.04 . 1 . . . . . . . . 4719 1 1107 . 1 1 113 113 VAL CG2 C 13 21.07 0.04 . 1 . . . . . . . . 4719 1 1108 . 1 1 113 113 VAL N N 15 120.88 0.05 . 1 . . . . . . . . 4719 1 1109 . 1 1 114 114 GLN H H 1 7.43 0.02 . 1 . . . . . . . . 4719 1 1110 . 1 1 114 114 GLN HA H 1 3.96 0.02 . 1 . . . . . . . . 4719 1 1111 . 1 1 114 114 GLN C C 13 177.97 0.04 . 1 . . . . . . . . 4719 1 1112 . 1 1 114 114 GLN CA C 13 57.74 0.04 . 1 . . . . . . . . 4719 1 1113 . 1 1 114 114 GLN CB C 13 29.80 0.04 . 1 . . . . . . . . 4719 1 1114 . 1 1 114 114 GLN N N 15 116.66 0.05 . 1 . . . . . . . . 4719 1 1115 . 1 1 115 115 LEU H H 1 7.80 0.02 . 1 . . . . . . . . 4719 1 1116 . 1 1 115 115 LEU HA H 1 4.35 0.02 . 1 . . . . . . . . 4719 1 1117 . 1 1 115 115 LEU HB2 H 1 1.70 0.02 . 1 . . . . . . . . 4719 1 1118 . 1 1 115 115 LEU HB3 H 1 1.59 0.02 . 1 . . . . . . . . 4719 1 1119 . 1 1 115 115 LEU HD11 H 1 0.91 0.02 . 1 . . . . . . . . 4719 1 1120 . 1 1 115 115 LEU HD12 H 1 0.91 0.02 . 1 . . . . . . . . 4719 1 1121 . 1 1 115 115 LEU HD13 H 1 0.91 0.02 . 1 . . . . . . . . 4719 1 1122 . 1 1 115 115 LEU C C 13 176.16 0.04 . 1 . . . . . . . . 4719 1 1123 . 1 1 115 115 LEU CA C 13 56.39 0.04 . 1 . . . . . . . . 4719 1 1124 . 1 1 115 115 LEU CB C 13 41.55 0.04 . 1 . . . . . . . . 4719 1 1125 . 1 1 115 115 LEU N N 15 119.94 0.05 . 1 . . . . . . . . 4719 1 1126 . 1 1 116 116 ASN H H 1 7.57 0.02 . 1 . . . . . . . . 4719 1 1127 . 1 1 116 116 ASN HA H 1 4.57 0.02 . 1 . . . . . . . . 4719 1 1128 . 1 1 116 116 ASN HB2 H 1 2.89 0.02 . 1 . . . . . . . . 4719 1 1129 . 1 1 116 116 ASN HB3 H 1 2.74 0.02 . 1 . . . . . . . . 4719 1 1130 . 1 1 116 116 ASN C C 13 176.38 0.04 . 1 . . . . . . . . 4719 1 1131 . 1 1 116 116 ASN CA C 13 53.58 0.04 . 1 . . . . . . . . 4719 1 1132 . 1 1 116 116 ASN CB C 13 38.77 0.04 . 1 . . . . . . . . 4719 1 1133 . 1 1 116 116 ASN N N 15 112.68 0.05 . 1 . . . . . . . . 4719 1 1134 . 1 1 117 117 TRP H H 1 7.78 0.02 . 1 . . . . . . . . 4719 1 1135 . 1 1 117 117 TRP HA H 1 5.12 0.02 . 1 . . . . . . . . 4719 1 1136 . 1 1 117 117 TRP HB2 H 1 3.96 0.02 . 1 . . . . . . . . 4719 1 1137 . 1 1 117 117 TRP HB3 H 1 3.15 0.02 . 1 . . . . . . . . 4719 1 1138 . 1 1 117 117 TRP C C 13 175.00 0.04 . 1 . . . . . . . . 4719 1 1139 . 1 1 117 117 TRP CA C 13 55.78 0.04 . 1 . . . . . . . . 4719 1 1140 . 1 1 117 117 TRP CB C 13 29.95 0.04 . 1 . . . . . . . . 4719 1 1141 . 1 1 117 117 TRP N N 15 123.22 0.05 . 1 . . . . . . . . 4719 1 1142 . 1 1 118 118 ASN H H 1 8.07 0.02 . 1 . . . . . . . . 4719 1 1143 . 1 1 118 118 ASN HA H 1 4.43 0.02 . 1 . . . . . . . . 4719 1 1144 . 1 1 118 118 ASN CA C 13 54.88 0.04 . 1 . . . . . . . . 4719 1 1145 . 1 1 118 118 ASN CB C 13 40.85 0.04 . 1 . . . . . . . . 4719 1 1146 . 1 1 118 118 ASN N N 15 125.33 0.05 . 1 . . . . . . . . 4719 1 1147 . 1 1 123 123 GLU C C 13 176.46 0.04 . 1 . . . . . . . . 4719 1 1148 . 1 1 123 123 GLU CA C 13 55.50 0.04 . 1 . . . . . . . . 4719 1 1149 . 1 1 123 123 GLU CB C 13 28.73 0.04 . 1 . . . . . . . . 4719 1 1150 . 1 1 124 124 GLY H H 1 7.23 0.02 . 1 . . . . . . . . 4719 1 1151 . 1 1 124 124 GLY HA2 H 1 3.53 0.02 . 1 . . . . . . . . 4719 1 1152 . 1 1 124 124 GLY HA3 H 1 2.35 0.02 . 1 . . . . . . . . 4719 1 1153 . 1 1 124 124 GLY C C 13 171.54 0.04 . 1 . . . . . . . . 4719 1 1154 . 1 1 124 124 GLY CA C 13 45.31 0.04 . 1 . . . . . . . . 4719 1 1155 . 1 1 124 124 GLY N N 15 107.52 0.05 . 1 . . . . . . . . 4719 1 1156 . 1 1 125 125 ARG H H 1 7.99 0.02 . 1 . . . . . . . . 4719 1 1157 . 1 1 125 125 ARG HA H 1 5.02 0.02 . 1 . . . . . . . . 4719 1 1158 . 1 1 125 125 ARG HB2 H 1 1.57 0.02 . 1 . . . . . . . . 4719 1 1159 . 1 1 125 125 ARG HB3 H 1 1.39 0.02 . 1 . . . . . . . . 4719 1 1160 . 1 1 125 125 ARG HG2 H 1 1.38 0.02 . 1 . . . . . . . . 4719 1 1161 . 1 1 125 125 ARG HG3 H 1 1.29 0.02 . 1 . . . . . . . . 4719 1 1162 . 1 1 125 125 ARG HD2 H 1 2.25 0.02 . 1 . . . . . . . . 4719 1 1163 . 1 1 125 125 ARG HD3 H 1 2.25 0.02 . 1 . . . . . . . . 4719 1 1164 . 1 1 125 125 ARG C C 13 174.48 0.04 . 1 . . . . . . . . 4719 1 1165 . 1 1 125 125 ARG CA C 13 53.66 0.04 . 1 . . . . . . . . 4719 1 1166 . 1 1 125 125 ARG CB C 13 34.25 0.04 . 1 . . . . . . . . 4719 1 1167 . 1 1 125 125 ARG CG C 13 26.08 0.04 . 1 . . . . . . . . 4719 1 1168 . 1 1 125 125 ARG CD C 13 42.49 0.04 . 1 . . . . . . . . 4719 1 1169 . 1 1 125 125 ARG N N 15 115.96 0.05 . 1 . . . . . . . . 4719 1 1170 . 1 1 126 126 PHE H H 1 9.12 0.02 . 1 . . . . . . . . 4719 1 1171 . 1 1 126 126 PHE HA H 1 5.75 0.02 . 1 . . . . . . . . 4719 1 1172 . 1 1 126 126 PHE HB2 H 1 3.20 0.02 . 1 . . . . . . . . 4719 1 1173 . 1 1 126 126 PHE HB3 H 1 3.15 0.02 . 1 . . . . . . . . 4719 1 1174 . 1 1 126 126 PHE HD1 H 1 7.28 0.02 . 1 . . . . . . . . 4719 1 1175 . 1 1 126 126 PHE HE1 H 1 7.13 0.02 . 1 . . . . . . . . 4719 1 1176 . 1 1 126 126 PHE C C 13 175.60 0.04 . 1 . . . . . . . . 4719 1 1177 . 1 1 126 126 PHE CA C 13 57.61 0.04 . 1 . . . . . . . . 4719 1 1178 . 1 1 126 126 PHE CB C 13 42.37 0.04 . 1 . . . . . . . . 4719 1 1179 . 1 1 126 126 PHE N N 15 119.94 0.05 . 1 . . . . . . . . 4719 1 1180 . 1 1 127 127 VAL H H 1 9.39 0.02 . 1 . . . . . . . . 4719 1 1181 . 1 1 127 127 VAL HA H 1 5.14 0.02 . 1 . . . . . . . . 4719 1 1182 . 1 1 127 127 VAL HB H 1 1.85 0.02 . 1 . . . . . . . . 4719 1 1183 . 1 1 127 127 VAL HG11 H 1 0.92 0.02 . 1 . . . . . . . . 4719 1 1184 . 1 1 127 127 VAL HG12 H 1 0.92 0.02 . 1 . . . . . . . . 4719 1 1185 . 1 1 127 127 VAL HG13 H 1 0.92 0.02 . 1 . . . . . . . . 4719 1 1186 . 1 1 127 127 VAL HG21 H 1 0.78 0.02 . 1 . . . . . . . . 4719 1 1187 . 1 1 127 127 VAL HG22 H 1 0.78 0.02 . 1 . . . . . . . . 4719 1 1188 . 1 1 127 127 VAL HG23 H 1 0.78 0.02 . 1 . . . . . . . . 4719 1 1189 . 1 1 127 127 VAL C C 13 174.95 0.04 . 1 . . . . . . . . 4719 1 1190 . 1 1 127 127 VAL CA C 13 60.47 0.04 . 1 . . . . . . . . 4719 1 1191 . 1 1 127 127 VAL CB C 13 35.97 0.04 . 1 . . . . . . . . 4719 1 1192 . 1 1 127 127 VAL CG1 C 13 21.07 0.04 . 1 . . . . . . . . 4719 1 1193 . 1 1 127 127 VAL CG2 C 13 21.07 0.04 . 1 . . . . . . . . 4719 1 1194 . 1 1 127 127 VAL N N 15 123.22 0.05 . 1 . . . . . . . . 4719 1 1195 . 1 1 128 128 LEU H H 1 9.57 0.02 . 1 . . . . . . . . 4719 1 1196 . 1 1 128 128 LEU HA H 1 5.32 0.02 . 1 . . . . . . . . 4719 1 1197 . 1 1 128 128 LEU HB2 H 1 2.04 0.02 . 1 . . . . . . . . 4719 1 1198 . 1 1 128 128 LEU HB3 H 1 1.19 0.02 . 1 . . . . . . . . 4719 1 1199 . 1 1 128 128 LEU HG H 1 1.50 0.02 . 1 . . . . . . . . 4719 1 1200 . 1 1 128 128 LEU HD11 H 1 0.82 0.02 . 1 . . . . . . . . 4719 1 1201 . 1 1 128 128 LEU HD12 H 1 0.82 0.02 . 1 . . . . . . . . 4719 1 1202 . 1 1 128 128 LEU HD13 H 1 0.82 0.02 . 1 . . . . . . . . 4719 1 1203 . 1 1 128 128 LEU HD21 H 1 0.35 0.02 . 1 . . . . . . . . 4719 1 1204 . 1 1 128 128 LEU HD22 H 1 0.35 0.02 . 1 . . . . . . . . 4719 1 1205 . 1 1 128 128 LEU HD23 H 1 0.35 0.02 . 1 . . . . . . . . 4719 1 1206 . 1 1 128 128 LEU C C 13 175.24 0.04 . 1 . . . . . . . . 4719 1 1207 . 1 1 128 128 LEU CA C 13 53.80 0.04 . 1 . . . . . . . . 4719 1 1208 . 1 1 128 128 LEU CB C 13 44.26 0.04 . 1 . . . . . . . . 4719 1 1209 . 1 1 128 128 LEU CG C 13 26.94 0.04 . 1 . . . . . . . . 4719 1 1210 . 1 1 128 128 LEU CD1 C 13 25.76 0.04 . 1 . . . . . . . . 4719 1 1211 . 1 1 128 128 LEU CD2 C 13 25.45 0.04 . 1 . . . . . . . . 4719 1 1212 . 1 1 128 128 LEU N N 15 130.96 0.05 . 1 . . . . . . . . 4719 1 1213 . 1 1 129 129 LYS H H 1 9.33 0.02 . 1 . . . . . . . . 4719 1 1214 . 1 1 129 129 LYS HA H 1 5.05 0.02 . 1 . . . . . . . . 4719 1 1215 . 1 1 129 129 LYS HB2 H 1 1.87 0.02 . 1 . . . . . . . . 4719 1 1216 . 1 1 129 129 LYS HB3 H 1 1.87 0.02 . 1 . . . . . . . . 4719 1 1217 . 1 1 129 129 LYS HG2 H 1 1.43 0.02 . 1 . . . . . . . . 4719 1 1218 . 1 1 129 129 LYS HG3 H 1 1.24 0.02 . 1 . . . . . . . . 4719 1 1219 . 1 1 129 129 LYS HE2 H 1 3.12 0.02 . 1 . . . . . . . . 4719 1 1220 . 1 1 129 129 LYS HE3 H 1 6.83 0.02 . 1 . . . . . . . . 4719 1 1221 . 1 1 129 129 LYS C C 13 175.75 0.04 . 1 . . . . . . . . 4719 1 1222 . 1 1 129 129 LYS CA C 13 55.31 0.04 . 1 . . . . . . . . 4719 1 1223 . 1 1 129 129 LYS CB C 13 35.97 0.04 . 1 . . . . . . . . 4719 1 1224 . 1 1 129 129 LYS CG C 13 25.13 0.04 . 1 . . . . . . . . 4719 1 1225 . 1 1 129 129 LYS N N 15 123.69 0.05 . 1 . . . . . . . . 4719 1 1226 . 1 1 130 130 ASN H H 1 8.96 0.02 . 1 . . . . . . . . 4719 1 1227 . 1 1 130 130 ASN HA H 1 4.93 0.02 . 1 . . . . . . . . 4719 1 1228 . 1 1 130 130 ASN HB2 H 1 3.07 0.02 . 1 . . . . . . . . 4719 1 1229 . 1 1 130 130 ASN HB3 H 1 2.64 0.02 . 1 . . . . . . . . 4719 1 1230 . 1 1 130 130 ASN HD21 H 1 6.69 0.02 . 1 . . . . . . . . 4719 1 1231 . 1 1 130 130 ASN HD22 H 1 7.00 0.02 . 1 . . . . . . . . 4719 1 1232 . 1 1 130 130 ASN C C 13 176.07 0.04 . 1 . . . . . . . . 4719 1 1233 . 1 1 130 130 ASN CA C 13 52.23 0.04 . 1 . . . . . . . . 4719 1 1234 . 1 1 130 130 ASN CB C 13 38.98 0.04 . 1 . . . . . . . . 4719 1 1235 . 1 1 130 130 ASN N N 15 119.71 0.05 . 1 . . . . . . . . 4719 1 1236 . 1 1 131 131 GLU H H 1 8.92 0.02 . 1 . . . . . . . . 4719 1 1237 . 1 1 131 131 GLU HA H 1 4.38 0.02 . 1 . . . . . . . . 4719 1 1238 . 1 1 131 131 GLU HB2 H 1 1.85 0.02 . 1 . . . . . . . . 4719 1 1239 . 1 1 131 131 GLU HB3 H 1 1.81 0.02 . 1 . . . . . . . . 4719 1 1240 . 1 1 131 131 GLU HG2 H 1 2.31 0.02 . 1 . . . . . . . . 4719 1 1241 . 1 1 131 131 GLU HG3 H 1 2.17 0.02 . 1 . . . . . . . . 4719 1 1242 . 1 1 131 131 GLU C C 13 176.69 0.04 . 1 . . . . . . . . 4719 1 1243 . 1 1 131 131 GLU CA C 13 56.79 0.04 . 1 . . . . . . . . 4719 1 1244 . 1 1 131 131 GLU CB C 13 30.01 0.04 . 1 . . . . . . . . 4719 1 1245 . 1 1 131 131 GLU N N 15 125.33 0.05 . 1 . . . . . . . . 4719 1 1246 . 1 1 132 132 ASN H H 1 8.14 0.02 . 1 . . . . . . . . 4719 1 1247 . 1 1 132 132 ASN HA H 1 4.72 0.02 . 1 . . . . . . . . 4719 1 1248 . 1 1 132 132 ASN HB2 H 1 2.86 0.02 . 1 . . . . . . . . 4719 1 1249 . 1 1 132 132 ASN HB3 H 1 2.75 0.02 . 1 . . . . . . . . 4719 1 1250 . 1 1 132 132 ASN C C 13 175.31 0.04 . 1 . . . . . . . . 4719 1 1251 . 1 1 132 132 ASN CA C 13 53.38 0.04 . 1 . . . . . . . . 4719 1 1252 . 1 1 132 132 ASN CB C 13 38.45 0.04 . 1 . . . . . . . . 4719 1 1253 . 1 1 132 132 ASN N N 15 117.88 0.05 . 1 . . . . . . . . 4719 1 1254 . 1 1 133 133 ASP H H 1 8.07 0.02 . 1 . . . . . . . . 4719 1 1255 . 1 1 133 133 ASP HA H 1 4.58 0.02 . 1 . . . . . . . . 4719 1 1256 . 1 1 133 133 ASP HB2 H 1 2.72 0.02 . 1 . . . . . . . . 4719 1 1257 . 1 1 133 133 ASP HB3 H 1 2.69 0.02 . 1 . . . . . . . . 4719 1 1258 . 1 1 133 133 ASP C C 13 175.89 0.04 . 1 . . . . . . . . 4719 1 1259 . 1 1 133 133 ASP CA C 13 54.32 0.04 . 1 . . . . . . . . 4719 1 1260 . 1 1 133 133 ASP CB C 13 41.02 0.04 . 1 . . . . . . . . 4719 1 1261 . 1 1 133 133 ASP N N 15 120.41 0.05 . 1 . . . . . . . . 4719 1 1262 . 1 1 134 134 ALA H H 1 7.95 0.02 . 1 . . . . . . . . 4719 1 1263 . 1 1 134 134 ALA HA H 1 4.27 0.02 . 1 . . . . . . . . 4719 1 1264 . 1 1 134 134 ALA HB1 H 1 1.35 0.02 . 1 . . . . . . . . 4719 1 1265 . 1 1 134 134 ALA HB2 H 1 1.35 0.02 . 1 . . . . . . . . 4719 1 1266 . 1 1 134 134 ALA HB3 H 1 1.35 0.02 . 1 . . . . . . . . 4719 1 1267 . 1 1 134 134 ALA C C 13 177.48 0.04 . 1 . . . . . . . . 4719 1 1268 . 1 1 134 134 ALA CA C 13 52.21 0.04 . 1 . . . . . . . . 4719 1 1269 . 1 1 134 134 ALA CB C 13 19.16 0.04 . 1 . . . . . . . . 4719 1 1270 . 1 1 134 134 ALA N N 15 123.46 0.05 . 1 . . . . . . . . 4719 1 1271 . 1 1 135 135 ILE H H 1 8.07 0.02 . 1 . . . . . . . . 4719 1 1272 . 1 1 135 135 ILE HA H 1 4.42 0.02 . 1 . . . . . . . . 4719 1 1273 . 1 1 135 135 ILE HB H 1 1.90 0.02 . 1 . . . . . . . . 4719 1 1274 . 1 1 135 135 ILE HG12 H 1 1.53 0.02 . 1 . . . . . . . . 4719 1 1275 . 1 1 135 135 ILE HG13 H 1 1.22 0.02 . 1 . . . . . . . . 4719 1 1276 . 1 1 135 135 ILE HG21 H 1 0.98 0.02 . 1 . . . . . . . . 4719 1 1277 . 1 1 135 135 ILE HG22 H 1 0.98 0.02 . 1 . . . . . . . . 4719 1 1278 . 1 1 135 135 ILE HG23 H 1 0.98 0.02 . 1 . . . . . . . . 4719 1 1279 . 1 1 135 135 ILE HD11 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 1280 . 1 1 135 135 ILE HD12 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 1281 . 1 1 135 135 ILE HD13 H 1 0.90 0.02 . 1 . . . . . . . . 4719 1 1282 . 1 1 135 135 ILE CA C 13 58.62 0.04 . 1 . . . . . . . . 4719 1 1283 . 1 1 135 135 ILE CB C 13 38.38 0.04 . 1 . . . . . . . . 4719 1 1284 . 1 1 135 135 ILE CG1 C 13 26.94 0.04 . 1 . . . . . . . . 4719 1 1285 . 1 1 135 135 ILE CG2 C 13 16.80 0.04 . 1 . . . . . . . . 4719 1 1286 . 1 1 135 135 ILE CD1 C 13 12.00 0.04 . 1 . . . . . . . . 4719 1 1287 . 1 1 135 135 ILE N N 15 121.83 0.05 . 1 . . . . . . . . 4719 1 1288 . 1 1 136 136 PRO HA H 1 4.39 0.02 . 1 . . . . . . . . 4719 1 1289 . 1 1 136 136 PRO HB2 H 1 2.31 0.02 . 1 . . . . . . . . 4719 1 1290 . 1 1 136 136 PRO HB3 H 1 1.90 0.02 . 1 . . . . . . . . 4719 1 1291 . 1 1 136 136 PRO HG2 H 1 2.04 0.02 . 1 . . . . . . . . 4719 1 1292 . 1 1 136 136 PRO HG3 H 1 1.98 0.02 . 1 . . . . . . . . 4719 1 1293 . 1 1 136 136 PRO HD2 H 1 3.90 0.02 . 1 . . . . . . . . 4719 1 1294 . 1 1 136 136 PRO HD3 H 1 3.68 0.02 . 1 . . . . . . . . 4719 1 1295 . 1 1 136 136 PRO C C 13 176.69 0.04 . 1 . . . . . . . . 4719 1 1296 . 1 1 136 136 PRO CA C 13 63.00 0.04 . 1 . . . . . . . . 4719 1 1297 . 1 1 136 136 PRO CB C 13 32.05 0.04 . 1 . . . . . . . . 4719 1 1298 . 1 1 136 136 PRO CG C 13 27.13 0.04 . 1 . . . . . . . . 4719 1 1299 . 1 1 136 136 PRO CD C 13 51.02 0.04 . 1 . . . . . . . . 4719 1 1300 . 1 1 137 137 ALA H H 1 8.32 0.02 . 1 . . . . . . . . 4719 1 1301 . 1 1 137 137 ALA HA H 1 4.33 0.02 . 1 . . . . . . . . 4719 1 1302 . 1 1 137 137 ALA HB1 H 1 1.42 0.02 . 1 . . . . . . . . 4719 1 1303 . 1 1 137 137 ALA HB2 H 1 1.42 0.02 . 1 . . . . . . . . 4719 1 1304 . 1 1 137 137 ALA HB3 H 1 1.42 0.02 . 1 . . . . . . . . 4719 1 1305 . 1 1 137 137 ALA C C 13 177.85 0.04 . 1 . . . . . . . . 4719 1 1306 . 1 1 137 137 ALA CA C 13 52.24 0.04 . 1 . . . . . . . . 4719 1 1307 . 1 1 137 137 ALA CB C 13 19.16 0.04 . 1 . . . . . . . . 4719 1 1308 . 1 1 137 137 ALA N N 15 124.40 0.05 . 1 . . . . . . . . 4719 1 1309 . 1 1 138 138 LYS H H 1 8.25 0.02 . 1 . . . . . . . . 4719 1 1310 . 1 1 138 138 LYS HA H 1 4.26 0.02 . 1 . . . . . . . . 4719 1 1311 . 1 1 138 138 LYS HB2 H 1 1.76 0.02 . 1 . . . . . . . . 4719 1 1312 . 1 1 138 138 LYS HB3 H 1 1.76 0.02 . 1 . . . . . . . . 4719 1 1313 . 1 1 138 138 LYS HG2 H 1 1.42 0.02 . 1 . . . . . . . . 4719 1 1314 . 1 1 138 138 LYS HG3 H 1 1.42 0.02 . 1 . . . . . . . . 4719 1 1315 . 1 1 138 138 LYS HD2 H 1 1.71 0.02 . 1 . . . . . . . . 4719 1 1316 . 1 1 138 138 LYS HD3 H 1 1.74 0.02 . 1 . . . . . . . . 4719 1 1317 . 1 1 138 138 LYS HE2 H 1 3.01 0.02 . 1 . . . . . . . . 4719 1 1318 . 1 1 138 138 LYS HE3 H 1 3.01 0.02 . 1 . . . . . . . . 4719 1 1319 . 1 1 138 138 LYS C C 13 176.36 0.04 . 1 . . . . . . . . 4719 1 1320 . 1 1 138 138 LYS CA C 13 56.06 0.04 . 1 . . . . . . . . 4719 1 1321 . 1 1 138 138 LYS CB C 13 33.18 0.04 . 1 . . . . . . . . 4719 1 1322 . 1 1 138 138 LYS CG C 13 24.47 0.04 . 1 . . . . . . . . 4719 1 1323 . 1 1 138 138 LYS CD C 13 28.54 0.04 . 1 . . . . . . . . 4719 1 1324 . 1 1 138 138 LYS CE C 13 41.34 0.04 . 1 . . . . . . . . 4719 1 1325 . 1 1 138 138 LYS N N 15 120.88 0.05 . 1 . . . . . . . . 4719 1 1326 . 1 1 139 139 LYS H H 1 8.35 0.02 . 1 . . . . . . . . 4719 1 1327 . 1 1 139 139 LYS HA H 1 4.30 0.02 . 1 . . . . . . . . 4719 1 1328 . 1 1 139 139 LYS HB2 H 1 1.85 0.02 . 1 . . . . . . . . 4719 1 1329 . 1 1 139 139 LYS HB3 H 1 1.85 0.02 . 1 . . . . . . . . 4719 1 1330 . 1 1 139 139 LYS HG2 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 1331 . 1 1 139 139 LYS HG3 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 1332 . 1 1 139 139 LYS HD2 H 1 1.71 0.02 . 1 . . . . . . . . 4719 1 1333 . 1 1 139 139 LYS HD3 H 1 1.74 0.02 . 1 . . . . . . . . 4719 1 1334 . 1 1 139 139 LYS HE2 H 1 3.01 0.02 . 1 . . . . . . . . 4719 1 1335 . 1 1 139 139 LYS HE3 H 1 3.01 0.02 . 1 . . . . . . . . 4719 1 1336 . 1 1 139 139 LYS C C 13 176.09 0.04 . 1 . . . . . . . . 4719 1 1337 . 1 1 139 139 LYS CA C 13 56.00 0.04 . 1 . . . . . . . . 4719 1 1338 . 1 1 139 139 LYS CB C 13 33.18 0.04 . 1 . . . . . . . . 4719 1 1339 . 1 1 139 139 LYS CG C 13 24.47 0.04 . 1 . . . . . . . . 4719 1 1340 . 1 1 139 139 LYS CD C 13 28.54 0.04 . 1 . . . . . . . . 4719 1 1341 . 1 1 139 139 LYS CE C 13 41.34 0.04 . 1 . . . . . . . . 4719 1 1342 . 1 1 139 139 LYS N N 15 123.50 0.05 . 1 . . . . . . . . 4719 1 1343 . 1 1 140 140 ALA H H 1 8.39 0.02 . 1 . . . . . . . . 4719 1 1344 . 1 1 140 140 ALA HA H 1 4.38 0.02 . 1 . . . . . . . . 4719 1 1345 . 1 1 140 140 ALA HB1 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 1346 . 1 1 140 140 ALA HB2 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 1347 . 1 1 140 140 ALA HB3 H 1 1.46 0.02 . 1 . . . . . . . . 4719 1 1348 . 1 1 140 140 ALA C C 13 176.63 0.04 . 1 . . . . . . . . 4719 1 1349 . 1 1 140 140 ALA CA C 13 52.48 0.04 . 1 . . . . . . . . 4719 1 1350 . 1 1 140 140 ALA CB C 13 19.17 0.04 . 1 . . . . . . . . 4719 1 1351 . 1 1 140 140 ALA N N 15 126.51 0.05 . 1 . . . . . . . . 4719 1 1352 . 1 1 141 141 GLN H H 1 7.90 0.02 . 1 . . . . . . . . 4719 1 1353 . 1 1 141 141 GLN HA H 1 4.16 0.02 . 1 . . . . . . . . 4719 1 1354 . 1 1 141 141 GLN HB2 H 1 2.11 0.02 . 1 . . . . . . . . 4719 1 1355 . 1 1 141 141 GLN HB3 H 1 1.90 0.02 . 1 . . . . . . . . 4719 1 1356 . 1 1 141 141 GLN HG2 H 1 2.31 0.02 . 1 . . . . . . . . 4719 1 1357 . 1 1 141 141 GLN HG3 H 1 2.31 0.02 . 1 . . . . . . . . 4719 1 1358 . 1 1 141 141 GLN CA C 13 57.26 0.04 . 1 . . . . . . . . 4719 1 1359 . 1 1 141 141 GLN CB C 13 30.32 0.04 . 1 . . . . . . . . 4719 1 1360 . 1 1 141 141 GLN CG C 13 34.22 0.04 . 1 . . . . . . . . 4719 1 1361 . 1 1 141 141 GLN N N 15 124.40 0.05 . 1 . . . . . . . . 4719 1 stop_ save_