data_6095 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6095 _Entry.Title ; Solution structure of the KIX domain of CBP bound to the transactivation domain of c-Myb ; _Entry.Type . _Entry.Version_type original _Entry.Submission_date 2004-02-09 _Entry.Accession_date 2004-02-10 _Entry.Last_release_date 2004-05-15 _Entry.Original_release_date 2004-05-15 _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 Tsaffy Zor . . . 6095 2 Roberto 'De Guzman' . N. . 6095 3 'H. Jane' Dyson . . . 6095 4 Peter Wright . E. . 6095 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 6095 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 756 6095 '13C chemical shifts' 392 6095 '15N chemical shifts' 118 6095 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 . . 2004-05-15 2004-02-09 original author . 6095 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6095 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 15019774 _Citation.Full_citation . _Citation.Title ; Solution structure of the KIX domain of CBP bound to the transactivation domain of c-Myb ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 337 _Citation.Journal_issue 3 _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 521 _Citation.Page_last 534 _Citation.Year 2004 _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 Tsaffy Zor . . . 6095 1 2 Roberto 'De Guzman' . N. . 6095 1 3 'H. Jane' Dyson . . . 6095 1 4 Peter Wright . E. . 6095 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'CREB-binding protein' 6095 1 'transcriptional coactivation' 6095 1 'constitutive activation' 6095 1 'LXXLL motif' 6095 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_KIX _Assembly.Sf_category assembly _Assembly.Sf_framecode system_KIX _Assembly.Entry_ID 6095 _Assembly.ID 1 _Assembly.Name 'CBP KIX domain and c-Myb' _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 'not present' _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 6095 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 'CBP KIX domain' 1 $KIX . . . native . . . . . 6095 1 2 C-MYB 2 $c-Myb . . . native . . . . . 6095 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1SB0 . . . . . . 6095 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'CBP KIX domain and c-Myb' system 6095 1 KIX abbreviation 6095 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_KIX _Entity.Sf_category entity _Entity.Sf_framecode KIX _Entity.Entry_ID 6095 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'CBP KIX domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GVRKGWHEHVTQDLRSHLVH KLVQAIFPTPDPAALKDRRM ENLVAYAKKVEGDMYESANS RDEYYHLLAEKIYKIQKELE EKRRSRL ; _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 87 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1SB0 . "Solution Structure Of The Kix Domain Of Cbp Bound To The Transactivation Domain Of C-Myb" . . . . . 100.00 25 100.00 100.00 8.71e-06 . . . . 6095 1 2 no PDB 2AGH . "Structural Basis For Cooperative Transcription Factor Binding To The Cbp Coactivator" . . . . . 100.00 25 100.00 100.00 8.71e-06 . . . . 6095 1 3 no DBJ BAA05135 . "cellular oncogene [Bos taurus]" . . . . . 100.00 640 100.00 100.00 1.15e-04 . . . . 6095 1 4 no DBJ BAA05136 . "protooncogene c-myb [Bos taurus]" . . . . . 100.00 555 100.00 100.00 2.55e-05 . . . . 6095 1 5 no DBJ BAA05137 . "protooncogene c-myb [Bos taurus]" . . . . . 100.00 430 100.00 100.00 1.11e-05 . . . . 6095 1 6 no DBJ BAC40133 . "unnamed protein product [Mus musculus]" . . . . . 100.00 755 100.00 100.00 6.15e-05 . . . . 6095 1 7 no DBJ BAC40443 . "unnamed protein product [Mus musculus]" . . . . . 100.00 439 100.00 100.00 5.99e-05 . . . . 6095 1 8 no EMBL CAA24979 . "p153 protein [Avian leukemia virus]" . . . . . 100.00 669 100.00 100.00 2.42e-06 . . . . 6095 1 9 no EMBL CAA26551 . "unnamed protein product [Mus musculus]" . . . . . 100.00 648 100.00 100.00 4.56e-05 . . . . 6095 1 10 no EMBL CAA26552 . "unnamed protein product [Mus musculus]" . . . . . 100.00 636 100.00 100.00 5.76e-05 . . . . 6095 1 11 no EMBL CAA27197 . "unnamed protein product [Gallus gallus]" . . . . . 100.00 699 100.00 100.00 4.70e-05 . . . . 6095 1 12 no EMBL CAA27724 . "myb proto-oncogene [Mus musculus]" . . . . . 100.00 330 100.00 100.00 4.88e-05 . . . . 6095 1 13 no GB AAA39781 . "myb protein [Mus musculus]" . . . . . 100.00 715 100.00 100.00 3.17e-05 . . . . 6095 1 14 no GB AAA39785 . "tumor-specific myb protein [Mus musculus]" . . . . . 100.00 593 100.00 100.00 3.26e-05 . . . . 6095 1 15 no GB AAA42551 . "transforming protein [Avian myeloblastosis virus]" . . . . . 100.00 265 100.00 100.00 8.89e-07 . . . . 6095 1 16 no GB AAA42553 . "c-myb ORF startng at the first atg in the ORF [Avian myeloblastosis virus]" . . . . . 100.00 265 100.00 100.00 8.89e-07 . . . . 6095 1 17 no GB AAA48696 . "c-myb oncogene product, partial [Gallus gallus]" . . . . . 100.00 379 100.00 100.00 1.58e-05 . . . . 6095 1 18 no PRF 0912261A . "protein p135" . . . . . 100.00 669 100.00 100.00 2.42e-06 . . . . 6095 1 19 no PRF 1203379A . "gene c-myb [Gallus gallus]" . . . . . 100.00 699 100.00 100.00 4.70e-05 . . . . 6095 1 20 no REF NP_001123644 . "transcriptional activator Myb isoform 3 [Homo sapiens]" . . . . . 92.00 637 100.00 100.00 1.19e-03 . . . . 6095 1 21 no REF NP_001155128 . "transcriptional activator Myb isoform 4 [Homo sapiens]" . . . . . 92.00 758 100.00 100.00 7.18e-04 . . . . 6095 1 22 no REF NP_001185843 . "transcriptional activator Myb isoform 1 [Mus musculus]" . . . . . 100.00 755 100.00 100.00 6.20e-05 . . . . 6095 1 23 no REF NP_034978 . "transcriptional activator Myb isoform 2 [Mus musculus]" . . . . . 100.00 636 100.00 100.00 7.39e-05 . . . . 6095 1 24 no REF NP_778220 . "transcriptional activator Myb [Bos taurus]" . . . . . 100.00 555 100.00 100.00 2.55e-05 . . . . 6095 1 25 no SP P01103 . "RecName: Full=Transcriptional activator Myb; AltName: Full=Proto-oncogene c-Myb [Gallus gallus]" . . . . . 100.00 641 100.00 100.00 8.73e-05 . . . . 6095 1 26 no SP P01104 . "RecName: Full=Transforming protein Myb [Avian myeloblastosis virus]" . . . . . 100.00 382 100.00 100.00 6.81e-06 . . . . 6095 1 27 no SP P01105 . "RecName: Full=p135Gag-Myb-Ets-transforming protein; Contains: RecName: Full=Transforming protein v-Myb; Contains: RecName: Full" . . . . . 100.00 669 100.00 100.00 2.42e-06 . . . . 6095 1 28 no SP P06876 . "RecName: Full=Transcriptional activator Myb; AltName: Full=Proto-oncogene c-Myb [Mus musculus]" . . . . . 100.00 636 100.00 100.00 7.39e-05 . . . . 6095 1 29 no SP P46200 . "RecName: Full=Transcriptional activator Myb; AltName: Full=Proto-oncogene c-Myb [Bos taurus]" . . . . . 100.00 640 100.00 100.00 1.15e-04 . . . . 6095 1 30 no TPG DAA26093 . "TPA: myb proto-oncogene protein [Bos taurus]" . . . . . 100.00 555 100.00 100.00 2.52e-05 . . . . 6095 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'CBP KIX domain' common 6095 1 KIX abbreviation 6095 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 . GLY . 6095 1 2 . VAL . 6095 1 3 . ARG . 6095 1 4 . LYS . 6095 1 5 . GLY . 6095 1 6 . TRP . 6095 1 7 . HIS . 6095 1 8 . GLU . 6095 1 9 . HIS . 6095 1 10 . VAL . 6095 1 11 . THR . 6095 1 12 . GLN . 6095 1 13 . ASP . 6095 1 14 . LEU . 6095 1 15 . ARG . 6095 1 16 . SER . 6095 1 17 . HIS . 6095 1 18 . LEU . 6095 1 19 . VAL . 6095 1 20 . HIS . 6095 1 21 . LYS . 6095 1 22 . LEU . 6095 1 23 . VAL . 6095 1 24 . GLN . 6095 1 25 . ALA . 6095 1 26 . ILE . 6095 1 27 . PHE . 6095 1 28 . PRO . 6095 1 29 . THR . 6095 1 30 . PRO . 6095 1 31 . ASP . 6095 1 32 . PRO . 6095 1 33 . ALA . 6095 1 34 . ALA . 6095 1 35 . LEU . 6095 1 36 . LYS . 6095 1 37 . ASP . 6095 1 38 . ARG . 6095 1 39 . ARG . 6095 1 40 . MET . 6095 1 41 . GLU . 6095 1 42 . ASN . 6095 1 43 . LEU . 6095 1 44 . VAL . 6095 1 45 . ALA . 6095 1 46 . TYR . 6095 1 47 . ALA . 6095 1 48 . LYS . 6095 1 49 . LYS . 6095 1 50 . VAL . 6095 1 51 . GLU . 6095 1 52 . GLY . 6095 1 53 . ASP . 6095 1 54 . MET . 6095 1 55 . TYR . 6095 1 56 . GLU . 6095 1 57 . SER . 6095 1 58 . ALA . 6095 1 59 . ASN . 6095 1 60 . SER . 6095 1 61 . ARG . 6095 1 62 . ASP . 6095 1 63 . GLU . 6095 1 64 . TYR . 6095 1 65 . TYR . 6095 1 66 . HIS . 6095 1 67 . LEU . 6095 1 68 . LEU . 6095 1 69 . ALA . 6095 1 70 . GLU . 6095 1 71 . LYS . 6095 1 72 . ILE . 6095 1 73 . TYR . 6095 1 74 . LYS . 6095 1 75 . ILE . 6095 1 76 . GLN . 6095 1 77 . LYS . 6095 1 78 . GLU . 6095 1 79 . LEU . 6095 1 80 . GLU . 6095 1 81 . GLU . 6095 1 82 . LYS . 6095 1 83 . ARG . 6095 1 84 . ARG . 6095 1 85 . SER . 6095 1 86 . ARG . 6095 1 87 . LEU . 6095 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 6095 1 . VAL 2 2 6095 1 . ARG 3 3 6095 1 . LYS 4 4 6095 1 . GLY 5 5 6095 1 . TRP 6 6 6095 1 . HIS 7 7 6095 1 . GLU 8 8 6095 1 . HIS 9 9 6095 1 . VAL 10 10 6095 1 . THR 11 11 6095 1 . GLN 12 12 6095 1 . ASP 13 13 6095 1 . LEU 14 14 6095 1 . ARG 15 15 6095 1 . SER 16 16 6095 1 . HIS 17 17 6095 1 . LEU 18 18 6095 1 . VAL 19 19 6095 1 . HIS 20 20 6095 1 . LYS 21 21 6095 1 . LEU 22 22 6095 1 . VAL 23 23 6095 1 . GLN 24 24 6095 1 . ALA 25 25 6095 1 . ILE 26 26 6095 1 . PHE 27 27 6095 1 . PRO 28 28 6095 1 . THR 29 29 6095 1 . PRO 30 30 6095 1 . ASP 31 31 6095 1 . PRO 32 32 6095 1 . ALA 33 33 6095 1 . ALA 34 34 6095 1 . LEU 35 35 6095 1 . LYS 36 36 6095 1 . ASP 37 37 6095 1 . ARG 38 38 6095 1 . ARG 39 39 6095 1 . MET 40 40 6095 1 . GLU 41 41 6095 1 . ASN 42 42 6095 1 . LEU 43 43 6095 1 . VAL 44 44 6095 1 . ALA 45 45 6095 1 . TYR 46 46 6095 1 . ALA 47 47 6095 1 . LYS 48 48 6095 1 . LYS 49 49 6095 1 . VAL 50 50 6095 1 . GLU 51 51 6095 1 . GLY 52 52 6095 1 . ASP 53 53 6095 1 . MET 54 54 6095 1 . TYR 55 55 6095 1 . GLU 56 56 6095 1 . SER 57 57 6095 1 . ALA 58 58 6095 1 . ASN 59 59 6095 1 . SER 60 60 6095 1 . ARG 61 61 6095 1 . ASP 62 62 6095 1 . GLU 63 63 6095 1 . TYR 64 64 6095 1 . TYR 65 65 6095 1 . HIS 66 66 6095 1 . LEU 67 67 6095 1 . LEU 68 68 6095 1 . ALA 69 69 6095 1 . GLU 70 70 6095 1 . LYS 71 71 6095 1 . ILE 72 72 6095 1 . TYR 73 73 6095 1 . LYS 74 74 6095 1 . ILE 75 75 6095 1 . GLN 76 76 6095 1 . LYS 77 77 6095 1 . GLU 78 78 6095 1 . LEU 79 79 6095 1 . GLU 80 80 6095 1 . GLU 81 81 6095 1 . LYS 82 82 6095 1 . ARG 83 83 6095 1 . ARG 84 84 6095 1 . SER 85 85 6095 1 . ARG 86 86 6095 1 . LEU 87 87 6095 1 stop_ save_ save_c-Myb _Entity.Sf_category entity _Entity.Sf_framecode c-Myb _Entity.Entry_ID 6095 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name C-MYB _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 ; KEKRIKELELLLMSTENELK GQQAL ; _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 25 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date 2008-08-19 _Entity.DB_query_revised_last_date 2008-08-19 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 . . SWISS-PROT P06876 . 'Myb proto-oncogene protein (C-myb)' . . . . . 100.00 636 100.00 100.00 3.08e-04 . . . . 6095 2 . . SWISS-PROT P46200 . 'Myb proto-oncogene protein (C-myb)' . . . . . 100.00 640 100.00 100.00 4.64e-04 . . . . 6095 2 . . SWISS-PROT P01104 . 'Transforming protein Myb' . . . . . 100.00 382 100.00 100.00 5.48e-05 . . . . 6095 2 . . SWISS-PROT P01105 . 'p135Gag-Myb-Ets-transforming protein [Contains: Transforming protein v-Myb; Transforming protein v-Ets]' . . . . . 100.00 669 100.00 100.00 1.59e-05 . . . . 6095 2 . . REF XP_001061499 . 'PREDICTED: similar to Myb proto-oncogene protein (C-myb) [Rattus norvegicus]' . . . . . 100.00 634 100.00 100.00 2.48e-04 . . . . 6095 2 . . SWISS-PROT P01103 . 'Myb proto-oncogene protein (C-myb)' . . . . . 100.00 641 100.00 100.00 3.64e-04 . . . . 6095 2 . . REF NP_778220 . 'v-myb myeloblastosis viral oncogene homolog [Bos taurus]' . . . . . 100.00 555 100.00 100.00 1.33e-04 . . . . 6095 2 . . REF NP_990637 . 'v-myb myeloblastosis viral oncogene homolog [Gallus gallus]' . . . . . 100.00 699 100.00 100.00 2.07e-04 . . . . 6095 2 . . REF NP_001123644 . 'v-myb myeloblastosis viral oncogene homolog isoform 3 [Homo sapiens]' . . . . . 92.00 637 100.00 100.00 3.55e-03 . . . . 6095 2 . . REF NP_034978 . 'myeloblastosis proto-oncogene product [Mus musculus]' . . . . . 100.00 636 100.00 100.00 3.16e-04 . . . . 6095 2 . . PRF 0912261A . 'protein p135' . . . . . 100.00 669 100.00 100.00 1.59e-05 . . . . 6095 2 . . PRF 1203379A . 'gene c-myb' . . . . . 100.00 699 100.00 100.00 2.07e-04 . . . . 6095 2 . . GenBank AAA42553 . 'c-myb ORF startng at the first atg in the ORF' . . . . . 100.00 265 100.00 100.00 1.59e-05 . . . . 6095 2 . . GenBank AAA48696 . 'c-myb oncogene product' . . . . . 100.00 379 100.00 100.00 1.13e-04 . . . . 6095 2 . . GenBank AAA39785 . 'tumor-specific myb protein' . . . . . 100.00 593 100.00 100.00 1.59e-04 . . . . 6095 2 . . GenBank AAA42551 . 'transforming protein' . . . . . 100.00 265 100.00 100.00 1.59e-05 . . . . 6095 2 . . EMBL CAA27724 . 'myb proto-oncogene [Mus musculus]' . . . . . 100.00 330 100.00 100.00 3.35e-04 . . . . 6095 2 . . GenBank AAA39781 . 'myb protein' . . . . . 100.00 715 100.00 100.00 1.46e-04 . . . . 6095 2 . . EMBL CAA26552 . 'unnamed protein product [Mus musculus]' . . . . . 100.00 636 100.00 100.00 2.54e-04 . . . . 6095 2 . . EMBL CAA27197 . 'unnamed protein product [Gallus gallus]' . . . . . 100.00 699 100.00 100.00 2.07e-04 . . . . 6095 2 . . EMBL CAA24979 . 'p153 protein [Avian leukemia virus]' . . . . . 100.00 669 100.00 100.00 1.59e-05 . . . . 6095 2 . . EMBL CAA26551 . 'unnamed protein product [Mus musculus]' . . . . . 100.00 648 100.00 100.00 2.07e-04 . . . . 6095 2 . . DBJ BAC40133 . 'unnamed protein product [Mus musculus]' . . . . . 100.00 755 100.00 100.00 2.54e-04 . . . . 6095 2 . . DBJ BAC40443 . 'unnamed protein product [Mus musculus]' . . . . . 100.00 439 100.00 100.00 3.16e-04 . . . . 6095 2 . . DBJ BAA05136 . 'protooncogene c-myb [Bos taurus]' . . . . . 100.00 555 100.00 100.00 1.33e-04 . . . . 6095 2 . . DBJ BAA05137 . 'protooncogene c-myb [Bos taurus]' . . . . . 100.00 430 100.00 100.00 7.53e-05 . . . . 6095 2 . . PDB 2AGH . 'Structural Basis For Cooperative Transcription Factor Binding To The Cbp Coactivator' . . . . . 100.00 25 100.00 100.00 6.76e-04 . . . . 6095 2 . . DBJ BAA05135 . 'cellular oncogene [Bos taurus]' . . . . . 100.00 640 100.00 100.00 4.64e-04 . . . . 6095 2 . . BMRB 6750 . MYB . . . . . 100.00 25 100.00 100.00 6.76e-04 . . . . 6095 2 . . PDB 1SB0 . 'Solution Structure Of The Kix Domain Of Cbp Bound To The Transactivation Domain Of C-Myb' . . . . . 100.00 25 100.00 100.00 6.76e-04 . . . . 6095 2 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID C-MYB common 6095 2 c-Myb abbreviation 6095 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . LYS . 6095 2 2 . GLU . 6095 2 3 . LYS . 6095 2 4 . ARG . 6095 2 5 . ILE . 6095 2 6 . LYS . 6095 2 7 . GLU . 6095 2 8 . LEU . 6095 2 9 . GLU . 6095 2 10 . LEU . 6095 2 11 . LEU . 6095 2 12 . LEU . 6095 2 13 . MET . 6095 2 14 . SER . 6095 2 15 . THR . 6095 2 16 . GLU . 6095 2 17 . ASN . 6095 2 18 . GLU . 6095 2 19 . LEU . 6095 2 20 . LYS . 6095 2 21 . GLY . 6095 2 22 . GLN . 6095 2 23 . GLN . 6095 2 24 . ALA . 6095 2 25 . LEU . 6095 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . LYS 1 1 6095 2 . GLU 2 2 6095 2 . LYS 3 3 6095 2 . ARG 4 4 6095 2 . ILE 5 5 6095 2 . LYS 6 6 6095 2 . GLU 7 7 6095 2 . LEU 8 8 6095 2 . GLU 9 9 6095 2 . LEU 10 10 6095 2 . LEU 11 11 6095 2 . LEU 12 12 6095 2 . MET 13 13 6095 2 . SER 14 14 6095 2 . THR 15 15 6095 2 . GLU 16 16 6095 2 . ASN 17 17 6095 2 . GLU 18 18 6095 2 . LEU 19 19 6095 2 . LYS 20 20 6095 2 . GLY 21 21 6095 2 . GLN 22 22 6095 2 . GLN 23 23 6095 2 . ALA 24 24 6095 2 . LEU 25 25 6095 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 6095 _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 $KIX . 10090 . . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 6095 1 2 2 $c-Myb . 10090 . . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 6095 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 6095 _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 $KIX . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6095 1 2 2 $c-Myb . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6095 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6095 _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 'CBP KIX domain' '[U-N15; U-C13]' . . 1 $KIX . . . 0.5 1 mM . . . . 6095 1 2 C-MYB '[U-N15; U-C13]' . . 2 $c-Myb . . . 0.5 1 mM . . . . 6095 1 stop_ save_ ####################### # Sample conditions # ####################### save_cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode cond_1 _Sample_condition_list.Entry_ID 6095 _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 5.5 0.1 n/a 6095 1 temperature 300 0.2 K 6095 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 6095 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer BRUKER _NMR_spectrometer.Model AMX _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 6095 _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 6095 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer BRUKER _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 6095 _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 AMX . 500 . . . 6095 1 2 NMR_spectrometer_2 BRUKER DRX . 600 . . . 6095 1 3 NMR_spectrometer_3 BRUKER DMX . 750 . . . 6095 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 6095 _Experiment_list.ID 1 _Experiment_list.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 6095 _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 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 6095 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 external direct 0.101329118 . . . . . . . . . 6095 1 C 13 DSS 'methyl protons' . . . . ppm 0.00 external direct 0.251449530 . . . . . . . . . 6095 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_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode 1 _Assigned_chem_shift_list.Entry_ID 6095 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $cond_1 _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 . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 6095 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY CA C 13 41.340 0.1 . 1 . . . . . . . . 6095 1 2 . 1 1 1 1 GLY HA3 H 1 3.883 0.02 . 2 . . . . . . . . 6095 1 3 . 1 1 2 2 VAL N N 15 119.186 0.1 . 1 . . . . . . . . 6095 1 4 . 1 1 2 2 VAL H H 1 8.506 0.02 . 1 . . . . . . . . 6095 1 5 . 1 1 2 2 VAL CA C 13 60.207 0.1 . 1 . . . . . . . . 6095 1 6 . 1 1 2 2 VAL HA H 1 4.172 0.02 . 1 . . . . . . . . 6095 1 7 . 1 1 2 2 VAL CB C 13 30.969 0.1 . 1 . . . . . . . . 6095 1 8 . 1 1 2 2 VAL HB H 1 2.041 0.02 . 1 . . . . . . . . 6095 1 9 . 1 1 2 2 VAL CG1 C 13 18.487 0.1 . 2 . . . . . . . . 6095 1 10 . 1 1 2 2 VAL HG11 H 1 0.928 0.02 . 4 . . . . . . . . 6095 1 11 . 1 1 2 2 VAL HG12 H 1 0.928 0.02 . 4 . . . . . . . . 6095 1 12 . 1 1 2 2 VAL HG13 H 1 0.928 0.02 . 4 . . . . . . . . 6095 1 13 . 1 1 3 3 ARG N N 15 125.412 0.1 . 1 . . . . . . . . 6095 1 14 . 1 1 3 3 ARG H H 1 8.541 0.02 . 1 . . . . . . . . 6095 1 15 . 1 1 3 3 ARG CA C 13 54.300 0.1 . 1 . . . . . . . . 6095 1 16 . 1 1 3 3 ARG HA H 1 4.345 0.02 . 1 . . . . . . . . 6095 1 17 . 1 1 3 3 ARG CB C 13 28.650 0.1 . 1 . . . . . . . . 6095 1 18 . 1 1 3 3 ARG HB3 H 1 1.820 0.02 . 2 . . . . . . . . 6095 1 19 . 1 1 3 3 ARG CG C 13 25.350 0.1 . 1 . . . . . . . . 6095 1 20 . 1 1 3 3 ARG HG2 H 1 1.675 0.02 . 2 . . . . . . . . 6095 1 21 . 1 1 3 3 ARG HG3 H 1 1.560 0.02 . 2 . . . . . . . . 6095 1 22 . 1 1 3 3 ARG CD C 13 41.400 0.1 . 1 . . . . . . . . 6095 1 23 . 1 1 3 3 ARG HD3 H 1 3.190 0.02 . 2 . . . . . . . . 6095 1 24 . 1 1 4 4 LYS N N 15 122.196 0.1 . 1 . . . . . . . . 6095 1 25 . 1 1 4 4 LYS H H 1 8.111 0.02 . 1 . . . . . . . . 6095 1 26 . 1 1 4 4 LYS CA C 13 53.057 0.1 . 1 . . . . . . . . 6095 1 27 . 1 1 4 4 LYS HA H 1 4.230 0.02 . 1 . . . . . . . . 6095 1 28 . 1 1 4 4 LYS CB C 13 31.141 0.1 . 1 . . . . . . . . 6095 1 29 . 1 1 4 4 LYS HB2 H 1 1.217 0.02 . 2 . . . . . . . . 6095 1 30 . 1 1 4 4 LYS HB3 H 1 0.637 0.02 . 2 . . . . . . . . 6095 1 31 . 1 1 4 4 LYS CG C 13 23.117 0.1 . 1 . . . . . . . . 6095 1 32 . 1 1 4 4 LYS HG2 H 1 1.287 0.02 . 2 . . . . . . . . 6095 1 33 . 1 1 4 4 LYS HG3 H 1 1.190 0.02 . 2 . . . . . . . . 6095 1 34 . 1 1 4 4 LYS CD C 13 27.501 0.1 . 1 . . . . . . . . 6095 1 35 . 1 1 4 4 LYS HD2 H 1 1.680 0.02 . 2 . . . . . . . . 6095 1 36 . 1 1 4 4 LYS HD3 H 1 1.468 0.02 . 2 . . . . . . . . 6095 1 37 . 1 1 4 4 LYS CE C 13 40.500 0.1 . 1 . . . . . . . . 6095 1 38 . 1 1 4 4 LYS HE2 H 1 2.990 0.02 . 2 . . . . . . . . 6095 1 39 . 1 1 4 4 LYS HE3 H 1 2.950 0.02 . 2 . . . . . . . . 6095 1 40 . 1 1 5 5 GLY N N 15 112.318 0.1 . 1 . . . . . . . . 6095 1 41 . 1 1 5 5 GLY H H 1 8.727 0.02 . 1 . . . . . . . . 6095 1 42 . 1 1 5 5 GLY CA C 13 45.379 0.1 . 1 . . . . . . . . 6095 1 43 . 1 1 5 5 GLY HA2 H 1 3.976 0.02 . 2 . . . . . . . . 6095 1 44 . 1 1 5 5 GLY HA3 H 1 3.766 0.02 . 2 . . . . . . . . 6095 1 45 . 1 1 6 6 TRP N N 15 119.021 0.1 . 1 . . . . . . . . 6095 1 46 . 1 1 6 6 TRP H H 1 8.037 0.02 . 1 . . . . . . . . 6095 1 47 . 1 1 6 6 TRP CA C 13 56.350 0.1 . 1 . . . . . . . . 6095 1 48 . 1 1 6 6 TRP HA H 1 4.530 0.02 . 1 . . . . . . . . 6095 1 49 . 1 1 6 6 TRP CB C 13 25.600 0.1 . 1 . . . . . . . . 6095 1 50 . 1 1 6 6 TRP HB2 H 1 3.600 0.02 . 2 . . . . . . . . 6095 1 51 . 1 1 6 6 TRP HB3 H 1 3.190 0.02 . 2 . . . . . . . . 6095 1 52 . 1 1 6 6 TRP CD1 C 13 123.701 0.1 . 3 . . . . . . . . 6095 1 53 . 1 1 6 6 TRP HD1 H 1 7.024 0.02 . 1 . . . . . . . . 6095 1 54 . 1 1 6 6 TRP NE1 N 15 128.886 0.1 . 1 . . . . . . . . 6095 1 55 . 1 1 6 6 TRP HE1 H 1 9.145 0.02 . 3 . . . . . . . . 6095 1 56 . 1 1 6 6 TRP CZ2 C 13 113.565 0.1 . 3 . . . . . . . . 6095 1 57 . 1 1 6 6 TRP HZ2 H 1 7.592 0.02 . 3 . . . . . . . . 6095 1 58 . 1 1 6 6 TRP CH2 C 13 123.892 0.1 . 1 . . . . . . . . 6095 1 59 . 1 1 6 6 TRP HH2 H 1 6.347 0.02 . 1 . . . . . . . . 6095 1 60 . 1 1 6 6 TRP CZ3 C 13 118.927 0.1 . 1 . . . . . . . . 6095 1 61 . 1 1 6 6 TRP HZ3 H 1 6.315 0.02 . 3 . . . . . . . . 6095 1 62 . 1 1 6 6 TRP CE3 C 13 117.796 0.1 . 3 . . . . . . . . 6095 1 63 . 1 1 6 6 TRP HE3 H 1 7.195 0.02 . 3 . . . . . . . . 6095 1 64 . 1 1 7 7 HIS N N 15 119.368 0.1 . 1 . . . . . . . . 6095 1 65 . 1 1 7 7 HIS H H 1 7.027 0.02 . 1 . . . . . . . . 6095 1 66 . 1 1 7 7 HIS CA C 13 54.331 0.1 . 1 . . . . . . . . 6095 1 67 . 1 1 7 7 HIS HA H 1 3.474 0.02 . 1 . . . . . . . . 6095 1 68 . 1 1 7 7 HIS CB C 13 26.900 0.1 . 1 . . . . . . . . 6095 1 69 . 1 1 7 7 HIS HB3 H 1 2.910 0.02 . 2 . . . . . . . . 6095 1 70 . 1 1 7 7 HIS CD2 C 13 117.900 0.1 . 1 . . . . . . . . 6095 1 71 . 1 1 7 7 HIS HD2 H 1 7.154 0.02 . 1 . . . . . . . . 6095 1 72 . 1 1 8 8 GLU N N 15 116.558 0.1 . 1 . . . . . . . . 6095 1 73 . 1 1 8 8 GLU H H 1 7.648 0.02 . 1 . . . . . . . . 6095 1 74 . 1 1 8 8 GLU CA C 13 56.350 0.1 . 1 . . . . . . . . 6095 1 75 . 1 1 8 8 GLU HA H 1 3.930 0.02 . 1 . . . . . . . . 6095 1 76 . 1 1 8 8 GLU CB C 13 27.450 0.1 . 1 . . . . . . . . 6095 1 77 . 1 1 8 8 GLU HB2 H 1 1.830 0.02 . 2 . . . . . . . . 6095 1 78 . 1 1 8 8 GLU HB3 H 1 1.750 0.02 . 2 . . . . . . . . 6095 1 79 . 1 1 8 8 GLU CG C 13 34.052 0.1 . 1 . . . . . . . . 6095 1 80 . 1 1 8 8 GLU HG3 H 1 2.094 0.02 . 2 . . . . . . . . 6095 1 81 . 1 1 9 9 HIS N N 15 112.676 0.1 . 1 . . . . . . . . 6095 1 82 . 1 1 9 9 HIS H H 1 7.443 0.02 . 1 . . . . . . . . 6095 1 83 . 1 1 9 9 HIS CA C 13 52.850 0.1 . 1 . . . . . . . . 6095 1 84 . 1 1 9 9 HIS HA H 1 4.900 0.02 . 1 . . . . . . . . 6095 1 85 . 1 1 9 9 HIS CB C 13 27.731 0.1 . 1 . . . . . . . . 6095 1 86 . 1 1 9 9 HIS HB2 H 1 3.694 0.02 . 2 . . . . . . . . 6095 1 87 . 1 1 9 9 HIS HB3 H 1 3.280 0.02 . 2 . . . . . . . . 6095 1 88 . 1 1 9 9 HIS CD2 C 13 117.900 0.1 . 1 . . . . . . . . 6095 1 89 . 1 1 9 9 HIS HD2 H 1 7.288 0.02 . 1 . . . . . . . . 6095 1 90 . 1 1 10 10 VAL N N 15 121.355 0.1 . 1 . . . . . . . . 6095 1 91 . 1 1 10 10 VAL H H 1 7.486 0.02 . 1 . . . . . . . . 6095 1 92 . 1 1 10 10 VAL CA C 13 60.165 0.1 . 1 . . . . . . . . 6095 1 93 . 1 1 10 10 VAL HA H 1 4.445 0.02 . 1 . . . . . . . . 6095 1 94 . 1 1 10 10 VAL CB C 13 30.969 0.1 . 1 . . . . . . . . 6095 1 95 . 1 1 10 10 VAL HB H 1 2.160 0.02 . 1 . . . . . . . . 6095 1 96 . 1 1 10 10 VAL CG1 C 13 19.950 0.1 . 2 . . . . . . . . 6095 1 97 . 1 1 10 10 VAL HG11 H 1 1.025 0.02 . 4 . . . . . . . . 6095 1 98 . 1 1 10 10 VAL HG12 H 1 1.025 0.02 . 4 . . . . . . . . 6095 1 99 . 1 1 10 10 VAL HG13 H 1 1.025 0.02 . 4 . . . . . . . . 6095 1 100 . 1 1 10 10 VAL CG2 C 13 19.050 0.1 . 2 . . . . . . . . 6095 1 101 . 1 1 10 10 VAL HG21 H 1 1.178 0.02 . 4 . . . . . . . . 6095 1 102 . 1 1 10 10 VAL HG22 H 1 1.178 0.02 . 4 . . . . . . . . 6095 1 103 . 1 1 10 10 VAL HG23 H 1 1.178 0.02 . 4 . . . . . . . . 6095 1 104 . 1 1 11 11 THR N N 15 115.006 0.1 . 1 . . . . . . . . 6095 1 105 . 1 1 11 11 THR H H 1 7.556 0.02 . 1 . . . . . . . . 6095 1 106 . 1 1 11 11 THR CA C 13 58.372 0.1 . 1 . . . . . . . . 6095 1 107 . 1 1 11 11 THR HA H 1 4.515 0.02 . 1 . . . . . . . . 6095 1 108 . 1 1 11 11 THR CB C 13 69.343 0.1 . 1 . . . . . . . . 6095 1 109 . 1 1 11 11 THR HB H 1 4.698 0.02 . 1 . . . . . . . . 6095 1 110 . 1 1 11 11 THR CG2 C 13 20.007 0.1 . 1 . . . . . . . . 6095 1 111 . 1 1 11 11 THR HG21 H 1 1.313 0.02 . 1 . . . . . . . . 6095 1 112 . 1 1 11 11 THR HG22 H 1 1.313 0.02 . 1 . . . . . . . . 6095 1 113 . 1 1 11 11 THR HG23 H 1 1.313 0.02 . 1 . . . . . . . . 6095 1 114 . 1 1 12 12 GLN N N 15 120.065 0.1 . 1 . . . . . . . . 6095 1 115 . 1 1 12 12 GLN H H 1 8.875 0.02 . 1 . . . . . . . . 6095 1 116 . 1 1 12 12 GLN CA C 13 57.050 0.1 . 1 . . . . . . . . 6095 1 117 . 1 1 12 12 GLN HA H 1 3.802 0.02 . 1 . . . . . . . . 6095 1 118 . 1 1 12 12 GLN CB C 13 26.123 0.1 . 1 . . . . . . . . 6095 1 119 . 1 1 12 12 GLN HB2 H 1 2.100 0.02 . 2 . . . . . . . . 6095 1 120 . 1 1 12 12 GLN HB3 H 1 2.040 0.02 . 2 . . . . . . . . 6095 1 121 . 1 1 12 12 GLN CG C 13 31.753 0.1 . 1 . . . . . . . . 6095 1 122 . 1 1 12 12 GLN HG3 H 1 2.374 0.02 . 2 . . . . . . . . 6095 1 123 . 1 1 12 12 GLN NE2 N 15 112.311 0.1 . 1 . . . . . . . . 6095 1 124 . 1 1 12 12 GLN HE21 H 1 6.660 0.02 . 2 . . . . . . . . 6095 1 125 . 1 1 12 12 GLN HE22 H 1 7.375 0.02 . 2 . . . . . . . . 6095 1 126 . 1 1 13 13 ASP N N 15 117.854 0.1 . 1 . . . . . . . . 6095 1 127 . 1 1 13 13 ASP H H 1 8.407 0.02 . 1 . . . . . . . . 6095 1 128 . 1 1 13 13 ASP CA C 13 55.250 0.1 . 1 . . . . . . . . 6095 1 129 . 1 1 13 13 ASP HA H 1 4.475 0.02 . 1 . . . . . . . . 6095 1 130 . 1 1 13 13 ASP CB C 13 38.650 0.1 . 1 . . . . . . . . 6095 1 131 . 1 1 13 13 ASP HB2 H 1 2.653 0.02 . 2 . . . . . . . . 6095 1 132 . 1 1 13 13 ASP HB3 H 1 2.562 0.02 . 2 . . . . . . . . 6095 1 133 . 1 1 14 14 LEU N N 15 122.534 0.1 . 1 . . . . . . . . 6095 1 134 . 1 1 14 14 LEU H H 1 7.694 0.02 . 1 . . . . . . . . 6095 1 135 . 1 1 14 14 LEU CA C 13 56.900 0.1 . 1 . . . . . . . . 6095 1 136 . 1 1 14 14 LEU HA H 1 4.090 0.02 . 1 . . . . . . . . 6095 1 137 . 1 1 14 14 LEU CB C 13 39.200 0.1 . 1 . . . . . . . . 6095 1 138 . 1 1 14 14 LEU HB2 H 1 2.150 0.02 . 2 . . . . . . . . 6095 1 139 . 1 1 14 14 LEU HB3 H 1 1.730 0.02 . 2 . . . . . . . . 6095 1 140 . 1 1 14 14 LEU CG C 13 25.800 0.1 . 1 . . . . . . . . 6095 1 141 . 1 1 14 14 LEU HG H 1 1.805 0.02 . 1 . . . . . . . . 6095 1 142 . 1 1 14 14 LEU CD1 C 13 21.250 0.1 . 2 . . . . . . . . 6095 1 143 . 1 1 14 14 LEU HD11 H 1 1.120 0.02 . 4 . . . . . . . . 6095 1 144 . 1 1 14 14 LEU HD12 H 1 1.120 0.02 . 4 . . . . . . . . 6095 1 145 . 1 1 14 14 LEU HD13 H 1 1.120 0.02 . 4 . . . . . . . . 6095 1 146 . 1 1 14 14 LEU CD2 C 13 24.287 0.1 . 2 . . . . . . . . 6095 1 147 . 1 1 14 14 LEU HD21 H 1 1.345 0.02 . 4 . . . . . . . . 6095 1 148 . 1 1 14 14 LEU HD22 H 1 1.345 0.02 . 4 . . . . . . . . 6095 1 149 . 1 1 14 14 LEU HD23 H 1 1.345 0.02 . 4 . . . . . . . . 6095 1 150 . 1 1 15 15 ARG N N 15 117.978 0.1 . 1 . . . . . . . . 6095 1 151 . 1 1 15 15 ARG H H 1 8.010 0.02 . 1 . . . . . . . . 6095 1 152 . 1 1 15 15 ARG CA C 13 58.700 0.1 . 1 . . . . . . . . 6095 1 153 . 1 1 15 15 ARG HA H 1 3.870 0.02 . 1 . . . . . . . . 6095 1 154 . 1 1 15 15 ARG CB C 13 28.800 0.1 . 1 . . . . . . . . 6095 1 155 . 1 1 15 15 ARG HB2 H 1 1.835 0.02 . 2 . . . . . . . . 6095 1 156 . 1 1 15 15 ARG HB3 H 1 1.560 0.02 . 2 . . . . . . . . 6095 1 157 . 1 1 15 15 ARG CG C 13 23.900 0.1 . 1 . . . . . . . . 6095 1 158 . 1 1 15 15 ARG HG2 H 1 1.740 0.02 . 2 . . . . . . . . 6095 1 159 . 1 1 15 15 ARG HG3 H 1 1.480 0.02 . 2 . . . . . . . . 6095 1 160 . 1 1 16 16 SER N N 15 112.699 0.1 . 1 . . . . . . . . 6095 1 161 . 1 1 16 16 SER H H 1 8.486 0.02 . 1 . . . . . . . . 6095 1 162 . 1 1 16 16 SER CA C 13 59.600 0.1 . 1 . . . . . . . . 6095 1 163 . 1 1 16 16 SER HA H 1 4.130 0.02 . 1 . . . . . . . . 6095 1 164 . 1 1 16 16 SER CB C 13 60.797 0.1 . 1 . . . . . . . . 6095 1 165 . 1 1 16 16 SER HB2 H 1 4.002 0.02 . 2 . . . . . . . . 6095 1 166 . 1 1 16 16 SER HB3 H 1 3.950 0.02 . 2 . . . . . . . . 6095 1 167 . 1 1 17 17 HIS N N 15 120.171 0.1 . 1 . . . . . . . . 6095 1 168 . 1 1 17 17 HIS H H 1 8.057 0.02 . 1 . . . . . . . . 6095 1 169 . 1 1 17 17 HIS CA C 13 57.900 0.1 . 1 . . . . . . . . 6095 1 170 . 1 1 17 17 HIS HA H 1 4.403 0.02 . 1 . . . . . . . . 6095 1 171 . 1 1 17 17 HIS CB C 13 26.750 0.1 . 1 . . . . . . . . 6095 1 172 . 1 1 17 17 HIS HB2 H 1 3.340 0.02 . 2 . . . . . . . . 6095 1 173 . 1 1 17 17 HIS HB3 H 1 3.240 0.02 . 2 . . . . . . . . 6095 1 174 . 1 1 17 17 HIS CD2 C 13 118.870 0.1 . 1 . . . . . . . . 6095 1 175 . 1 1 17 17 HIS HD2 H 1 7.500 0.02 . 1 . . . . . . . . 6095 1 176 . 1 1 18 18 LEU N N 15 123.194 0.1 . 1 . . . . . . . . 6095 1 177 . 1 1 18 18 LEU H H 1 8.834 0.02 . 1 . . . . . . . . 6095 1 178 . 1 1 18 18 LEU CA C 13 56.600 0.1 . 1 . . . . . . . . 6095 1 179 . 1 1 18 18 LEU HA H 1 4.173 0.02 . 1 . . . . . . . . 6095 1 180 . 1 1 18 18 LEU CB C 13 39.433 0.1 . 1 . . . . . . . . 6095 1 181 . 1 1 18 18 LEU HB2 H 1 2.312 0.02 . 2 . . . . . . . . 6095 1 182 . 1 1 18 18 LEU HB3 H 1 1.319 0.02 . 2 . . . . . . . . 6095 1 183 . 1 1 18 18 LEU CG C 13 25.500 0.1 . 1 . . . . . . . . 6095 1 184 . 1 1 18 18 LEU HG H 1 2.010 0.02 . 1 . . . . . . . . 6095 1 185 . 1 1 18 18 LEU CD1 C 13 22.749 0.1 . 2 . . . . . . . . 6095 1 186 . 1 1 18 18 LEU HD11 H 1 1.120 0.02 . 4 . . . . . . . . 6095 1 187 . 1 1 18 18 LEU HD12 H 1 1.120 0.02 . 4 . . . . . . . . 6095 1 188 . 1 1 18 18 LEU HD13 H 1 1.120 0.02 . 4 . . . . . . . . 6095 1 189 . 1 1 18 18 LEU CD2 C 13 25.210 0.1 . 2 . . . . . . . . 6095 1 190 . 1 1 18 18 LEU HD21 H 1 1.194 0.02 . 4 . . . . . . . . 6095 1 191 . 1 1 18 18 LEU HD22 H 1 1.194 0.02 . 4 . . . . . . . . 6095 1 192 . 1 1 18 18 LEU HD23 H 1 1.194 0.02 . 4 . . . . . . . . 6095 1 193 . 1 1 19 19 VAL N N 15 119.601 0.1 . 1 . . . . . . . . 6095 1 194 . 1 1 19 19 VAL H H 1 8.390 0.02 . 1 . . . . . . . . 6095 1 195 . 1 1 19 19 VAL CA C 13 65.900 0.1 . 1 . . . . . . . . 6095 1 196 . 1 1 19 19 VAL HA H 1 3.410 0.02 . 1 . . . . . . . . 6095 1 197 . 1 1 19 19 VAL CB C 13 29.400 0.1 . 1 . . . . . . . . 6095 1 198 . 1 1 19 19 VAL HB H 1 2.240 0.02 . 1 . . . . . . . . 6095 1 199 . 1 1 19 19 VAL CG1 C 13 19.550 0.1 . 2 . . . . . . . . 6095 1 200 . 1 1 19 19 VAL HG11 H 1 0.843 0.02 . 4 . . . . . . . . 6095 1 201 . 1 1 19 19 VAL HG12 H 1 0.843 0.02 . 4 . . . . . . . . 6095 1 202 . 1 1 19 19 VAL HG13 H 1 0.843 0.02 . 4 . . . . . . . . 6095 1 203 . 1 1 19 19 VAL CG2 C 13 22.000 0.1 . 2 . . . . . . . . 6095 1 204 . 1 1 19 19 VAL HG21 H 1 1.045 0.02 . 4 . . . . . . . . 6095 1 205 . 1 1 19 19 VAL HG22 H 1 1.045 0.02 . 4 . . . . . . . . 6095 1 206 . 1 1 19 19 VAL HG23 H 1 1.045 0.02 . 4 . . . . . . . . 6095 1 207 . 1 1 20 20 HIS N N 15 115.778 0.1 . 1 . . . . . . . . 6095 1 208 . 1 1 20 20 HIS H H 1 7.397 0.02 . 1 . . . . . . . . 6095 1 209 . 1 1 20 20 HIS CA C 13 57.500 0.1 . 1 . . . . . . . . 6095 1 210 . 1 1 20 20 HIS HA H 1 4.300 0.02 . 1 . . . . . . . . 6095 1 211 . 1 1 20 20 HIS CB C 13 26.900 0.1 . 1 . . . . . . . . 6095 1 212 . 1 1 20 20 HIS HB2 H 1 3.340 0.02 . 2 . . . . . . . . 6095 1 213 . 1 1 20 20 HIS HB3 H 1 3.260 0.02 . 2 . . . . . . . . 6095 1 214 . 1 1 20 20 HIS CD2 C 13 117.800 0.1 . 1 . . . . . . . . 6095 1 215 . 1 1 20 20 HIS HD2 H 1 7.155 0.02 . 1 . . . . . . . . 6095 1 216 . 1 1 21 21 LYS N N 15 119.065 0.1 . 1 . . . . . . . . 6095 1 217 . 1 1 21 21 LYS H H 1 7.950 0.02 . 1 . . . . . . . . 6095 1 218 . 1 1 21 21 LYS CA C 13 57.120 0.1 . 1 . . . . . . . . 6095 1 219 . 1 1 21 21 LYS HA H 1 4.065 0.02 . 1 . . . . . . . . 6095 1 220 . 1 1 21 21 LYS CB C 13 30.200 0.1 . 1 . . . . . . . . 6095 1 221 . 1 1 21 21 LYS HB2 H 1 2.110 0.02 . 2 . . . . . . . . 6095 1 222 . 1 1 21 21 LYS HB3 H 1 1.750 0.02 . 2 . . . . . . . . 6095 1 223 . 1 1 21 21 LYS CG C 13 23.550 0.1 . 1 . . . . . . . . 6095 1 224 . 1 1 21 21 LYS HG2 H 1 1.720 0.02 . 2 . . . . . . . . 6095 1 225 . 1 1 21 21 LYS HG3 H 1 1.563 0.02 . 2 . . . . . . . . 6095 1 226 . 1 1 22 22 LEU N N 15 120.997 0.1 . 1 . . . . . . . . 6095 1 227 . 1 1 22 22 LEU H H 1 8.495 0.02 . 1 . . . . . . . . 6095 1 228 . 1 1 22 22 LEU CA C 13 57.300 0.1 . 1 . . . . . . . . 6095 1 229 . 1 1 22 22 LEU HA H 1 3.840 0.02 . 1 . . . . . . . . 6095 1 230 . 1 1 22 22 LEU CB C 13 40.358 0.1 . 1 . . . . . . . . 6095 1 231 . 1 1 22 22 LEU HB2 H 1 2.050 0.02 . 2 . . . . . . . . 6095 1 232 . 1 1 22 22 LEU HB3 H 1 1.620 0.02 . 2 . . . . . . . . 6095 1 233 . 1 1 22 22 LEU CG C 13 25.950 0.1 . 1 . . . . . . . . 6095 1 234 . 1 1 22 22 LEU HG H 1 1.810 0.02 . 1 . . . . . . . . 6095 1 235 . 1 1 22 22 LEU CD1 C 13 24.250 0.1 . 2 . . . . . . . . 6095 1 236 . 1 1 22 22 LEU HD11 H 1 0.850 0.02 . 4 . . . . . . . . 6095 1 237 . 1 1 22 22 LEU HD12 H 1 0.850 0.02 . 4 . . . . . . . . 6095 1 238 . 1 1 22 22 LEU HD13 H 1 0.850 0.02 . 4 . . . . . . . . 6095 1 239 . 1 1 23 23 VAL N N 15 117.328 0.1 . 1 . . . . . . . . 6095 1 240 . 1 1 23 23 VAL H H 1 7.952 0.02 . 1 . . . . . . . . 6095 1 241 . 1 1 23 23 VAL CA C 13 65.500 0.1 . 1 . . . . . . . . 6095 1 242 . 1 1 23 23 VAL HA H 1 3.429 0.02 . 1 . . . . . . . . 6095 1 243 . 1 1 23 23 VAL CB C 13 29.750 0.1 . 1 . . . . . . . . 6095 1 244 . 1 1 23 23 VAL HB H 1 2.215 0.02 . 1 . . . . . . . . 6095 1 245 . 1 1 23 23 VAL CG1 C 13 19.927 0.1 . 2 . . . . . . . . 6095 1 246 . 1 1 23 23 VAL HG11 H 1 0.953 0.02 . 4 . . . . . . . . 6095 1 247 . 1 1 23 23 VAL HG12 H 1 0.953 0.02 . 4 . . . . . . . . 6095 1 248 . 1 1 23 23 VAL HG13 H 1 0.953 0.02 . 4 . . . . . . . . 6095 1 249 . 1 1 23 23 VAL CG2 C 13 22.250 0.1 . 2 . . . . . . . . 6095 1 250 . 1 1 23 23 VAL HG21 H 1 1.045 0.02 . 4 . . . . . . . . 6095 1 251 . 1 1 23 23 VAL HG22 H 1 1.045 0.02 . 4 . . . . . . . . 6095 1 252 . 1 1 23 23 VAL HG23 H 1 1.045 0.02 . 4 . . . . . . . . 6095 1 253 . 1 1 24 24 GLN N N 15 115.789 0.1 . 1 . . . . . . . . 6095 1 254 . 1 1 24 24 GLN H H 1 7.637 0.02 . 1 . . . . . . . . 6095 1 255 . 1 1 24 24 GLN CA C 13 56.050 0.1 . 1 . . . . . . . . 6095 1 256 . 1 1 24 24 GLN HA H 1 3.960 0.02 . 1 . . . . . . . . 6095 1 257 . 1 1 24 24 GLN CB C 13 26.800 0.1 . 1 . . . . . . . . 6095 1 258 . 1 1 24 24 GLN HB3 H 1 2.040 0.02 . 2 . . . . . . . . 6095 1 259 . 1 1 24 24 GLN CG C 13 32.150 0.1 . 1 . . . . . . . . 6095 1 260 . 1 1 24 24 GLN HG2 H 1 2.360 0.02 . 2 . . . . . . . . 6095 1 261 . 1 1 24 24 GLN HG3 H 1 2.280 0.02 . 2 . . . . . . . . 6095 1 262 . 1 1 24 24 GLN NE2 N 15 111.334 0.1 . 1 . . . . . . . . 6095 1 263 . 1 1 24 24 GLN HE21 H 1 6.820 0.02 . 2 . . . . . . . . 6095 1 264 . 1 1 24 24 GLN HE22 H 1 7.338 0.02 . 2 . . . . . . . . 6095 1 265 . 1 1 25 25 ALA N N 15 118.671 0.1 . 1 . . . . . . . . 6095 1 266 . 1 1 25 25 ALA H H 1 7.809 0.02 . 1 . . . . . . . . 6095 1 267 . 1 1 25 25 ALA CA C 13 51.850 0.1 . 1 . . . . . . . . 6095 1 268 . 1 1 25 25 ALA HA H 1 4.115 0.02 . 1 . . . . . . . . 6095 1 269 . 1 1 25 25 ALA CB C 13 16.700 0.1 . 1 . . . . . . . . 6095 1 270 . 1 1 25 25 ALA HB1 H 1 1.410 0.02 . 1 . . . . . . . . 6095 1 271 . 1 1 25 25 ALA HB2 H 1 1.410 0.02 . 1 . . . . . . . . 6095 1 272 . 1 1 25 25 ALA HB3 H 1 1.410 0.02 . 1 . . . . . . . . 6095 1 273 . 1 1 26 26 ILE N N 15 113.493 0.1 . 1 . . . . . . . . 6095 1 274 . 1 1 26 26 ILE H H 1 7.695 0.02 . 1 . . . . . . . . 6095 1 275 . 1 1 26 26 ILE CA C 13 61.000 0.1 . 1 . . . . . . . . 6095 1 276 . 1 1 26 26 ILE HA H 1 3.980 0.02 . 1 . . . . . . . . 6095 1 277 . 1 1 26 26 ILE CB C 13 37.000 0.1 . 1 . . . . . . . . 6095 1 278 . 1 1 26 26 ILE HB H 1 1.850 0.02 . 1 . . . . . . . . 6095 1 279 . 1 1 26 26 ILE CG2 C 13 16.237 0.1 . 2 . . . . . . . . 6095 1 280 . 1 1 26 26 ILE HG21 H 1 0.690 0.02 . 4 . . . . . . . . 6095 1 281 . 1 1 26 26 ILE HG22 H 1 0.690 0.02 . 4 . . . . . . . . 6095 1 282 . 1 1 26 26 ILE HG23 H 1 0.690 0.02 . 4 . . . . . . . . 6095 1 283 . 1 1 26 26 ILE CG1 C 13 25.500 0.1 . 2 . . . . . . . . 6095 1 284 . 1 1 26 26 ILE HG12 H 1 1.640 0.02 . 9 . . . . . . . . 6095 1 285 . 1 1 26 26 ILE HG13 H 1 1.270 0.02 . 9 . . . . . . . . 6095 1 286 . 1 1 26 26 ILE CD1 C 13 11.800 0.1 . 1 . . . . . . . . 6095 1 287 . 1 1 26 26 ILE HD11 H 1 0.820 0.02 . 1 . . . . . . . . 6095 1 288 . 1 1 26 26 ILE HD12 H 1 0.820 0.02 . 1 . . . . . . . . 6095 1 289 . 1 1 26 26 ILE HD13 H 1 0.820 0.02 . 1 . . . . . . . . 6095 1 290 . 1 1 27 27 PHE N N 15 119.992 0.1 . 1 . . . . . . . . 6095 1 291 . 1 1 27 27 PHE H H 1 7.940 0.02 . 1 . . . . . . . . 6095 1 292 . 1 1 27 27 PHE CA C 13 53.200 0.1 . 1 . . . . . . . . 6095 1 293 . 1 1 27 27 PHE HA H 1 4.880 0.02 . 1 . . . . . . . . 6095 1 294 . 1 1 27 27 PHE CB C 13 37.875 0.1 . 1 . . . . . . . . 6095 1 295 . 1 1 27 27 PHE HB2 H 1 3.143 0.02 . 2 . . . . . . . . 6095 1 296 . 1 1 27 27 PHE HB3 H 1 2.790 0.02 . 2 . . . . . . . . 6095 1 297 . 1 1 27 27 PHE CD1 C 13 130.258 0.1 . 3 . . . . . . . . 6095 1 298 . 1 1 27 27 PHE HD1 H 1 7.250 0.02 . 3 . . . . . . . . 6095 1 299 . 1 1 27 27 PHE CE1 C 13 129.023 0.1 . 3 . . . . . . . . 6095 1 300 . 1 1 27 27 PHE HE1 H 1 7.237 0.02 . 3 . . . . . . . . 6095 1 301 . 1 1 27 27 PHE CZ C 13 127.278 0.1 . 1 . . . . . . . . 6095 1 302 . 1 1 27 27 PHE HZ H 1 7.152 0.02 . 1 . . . . . . . . 6095 1 303 . 1 1 28 28 PRO CD C 13 48.150 0.1 . 1 . . . . . . . . 6095 1 304 . 1 1 28 28 PRO HD3 H 1 3.400 0.02 . 2 . . . . . . . . 6095 1 305 . 1 1 28 28 PRO CG C 13 25.400 0.1 . 1 . . . . . . . . 6095 1 306 . 1 1 28 28 PRO HG3 H 1 1.910 0.02 . 2 . . . . . . . . 6095 1 307 . 1 1 28 28 PRO CB C 13 29.850 0.1 . 1 . . . . . . . . 6095 1 308 . 1 1 28 28 PRO HB2 H 1 2.237 0.02 . 2 . . . . . . . . 6095 1 309 . 1 1 28 28 PRO HB3 H 1 1.875 0.02 . 2 . . . . . . . . 6095 1 310 . 1 1 28 28 PRO CA C 13 61.832 0.1 . 1 . . . . . . . . 6095 1 311 . 1 1 28 28 PRO HA H 1 4.493 0.02 . 1 . . . . . . . . 6095 1 312 . 1 1 29 29 THR N N 15 114.482 0.1 . 1 . . . . . . . . 6095 1 313 . 1 1 29 29 THR H H 1 7.962 0.02 . 1 . . . . . . . . 6095 1 314 . 1 1 29 29 THR CA C 13 56.900 0.1 . 1 . . . . . . . . 6095 1 315 . 1 1 29 29 THR HA H 1 4.550 0.02 . 1 . . . . . . . . 6095 1 316 . 1 1 29 29 THR CB C 13 68.056 0.1 . 1 . . . . . . . . 6095 1 317 . 1 1 29 29 THR HB H 1 4.099 0.02 . 1 . . . . . . . . 6095 1 318 . 1 1 29 29 THR CG2 C 13 19.350 0.1 . 1 . . . . . . . . 6095 1 319 . 1 1 29 29 THR HG21 H 1 1.130 0.02 . 1 . . . . . . . . 6095 1 320 . 1 1 29 29 THR HG22 H 1 1.130 0.02 . 1 . . . . . . . . 6095 1 321 . 1 1 29 29 THR HG23 H 1 1.130 0.02 . 1 . . . . . . . . 6095 1 322 . 1 1 30 30 PRO CD C 13 48.860 0.1 . 1 . . . . . . . . 6095 1 323 . 1 1 30 30 PRO HD3 H 1 3.665 0.02 . 2 . . . . . . . . 6095 1 324 . 1 1 30 30 PRO CG C 13 25.200 0.1 . 1 . . . . . . . . 6095 1 325 . 1 1 30 30 PRO HG3 H 1 1.900 0.02 . 2 . . . . . . . . 6095 1 326 . 1 1 30 30 PRO CB C 13 29.873 0.1 . 1 . . . . . . . . 6095 1 327 . 1 1 30 30 PRO HB2 H 1 2.095 0.02 . 2 . . . . . . . . 6095 1 328 . 1 1 30 30 PRO HB3 H 1 1.890 0.02 . 2 . . . . . . . . 6095 1 329 . 1 1 30 30 PRO CA C 13 61.435 0.1 . 1 . . . . . . . . 6095 1 330 . 1 1 30 30 PRO HA H 1 4.333 0.02 . 1 . . . . . . . . 6095 1 331 . 1 1 31 31 ASP N N 15 120.316 0.1 . 1 . . . . . . . . 6095 1 332 . 1 1 31 31 ASP H H 1 8.004 0.02 . 1 . . . . . . . . 6095 1 333 . 1 1 31 31 ASP CA C 13 49.593 0.1 . 1 . . . . . . . . 6095 1 334 . 1 1 31 31 ASP HA H 1 4.894 0.02 . 1 . . . . . . . . 6095 1 335 . 1 1 31 31 ASP CB C 13 39.818 0.1 . 1 . . . . . . . . 6095 1 336 . 1 1 31 31 ASP HB2 H 1 2.770 0.02 . 2 . . . . . . . . 6095 1 337 . 1 1 31 31 ASP HB3 H 1 2.610 0.02 . 2 . . . . . . . . 6095 1 338 . 1 1 32 32 PRO CD C 13 48.985 0.1 . 1 . . . . . . . . 6095 1 339 . 1 1 32 32 PRO HD3 H 1 3.877 0.02 . 2 . . . . . . . . 6095 1 340 . 1 1 32 32 PRO CG C 13 25.350 0.1 . 1 . . . . . . . . 6095 1 341 . 1 1 32 32 PRO HG2 H 1 2.030 0.02 . 2 . . . . . . . . 6095 1 342 . 1 1 32 32 PRO HG3 H 1 1.990 0.02 . 2 . . . . . . . . 6095 1 343 . 1 1 32 32 PRO CB C 13 29.994 0.1 . 1 . . . . . . . . 6095 1 344 . 1 1 32 32 PRO HB2 H 1 2.319 0.02 . 2 . . . . . . . . 6095 1 345 . 1 1 32 32 PRO HB3 H 1 1.950 0.02 . 2 . . . . . . . . 6095 1 346 . 1 1 32 32 PRO CA C 13 62.736 0.1 . 1 . . . . . . . . 6095 1 347 . 1 1 32 32 PRO HA H 1 4.248 0.02 . 1 . . . . . . . . 6095 1 348 . 1 1 33 33 ALA N N 15 120.356 0.1 . 1 . . . . . . . . 6095 1 349 . 1 1 33 33 ALA H H 1 8.230 0.02 . 1 . . . . . . . . 6095 1 350 . 1 1 33 33 ALA CA C 13 51.700 0.1 . 1 . . . . . . . . 6095 1 351 . 1 1 33 33 ALA HA H 1 4.170 0.02 . 1 . . . . . . . . 6095 1 352 . 1 1 33 33 ALA CB C 13 16.500 0.1 . 1 . . . . . . . . 6095 1 353 . 1 1 33 33 ALA HB1 H 1 1.390 0.02 . 1 . . . . . . . . 6095 1 354 . 1 1 33 33 ALA HB2 H 1 1.390 0.02 . 1 . . . . . . . . 6095 1 355 . 1 1 33 33 ALA HB3 H 1 1.390 0.02 . 1 . . . . . . . . 6095 1 356 . 1 1 34 34 ALA N N 15 120.848 0.1 . 1 . . . . . . . . 6095 1 357 . 1 1 34 34 ALA H H 1 7.743 0.02 . 1 . . . . . . . . 6095 1 358 . 1 1 34 34 ALA CA C 13 51.200 0.1 . 1 . . . . . . . . 6095 1 359 . 1 1 34 34 ALA HA H 1 4.250 0.02 . 1 . . . . . . . . 6095 1 360 . 1 1 34 34 ALA CB C 13 17.100 0.1 . 1 . . . . . . . . 6095 1 361 . 1 1 34 34 ALA HB1 H 1 1.461 0.02 . 1 . . . . . . . . 6095 1 362 . 1 1 34 34 ALA HB2 H 1 1.461 0.02 . 1 . . . . . . . . 6095 1 363 . 1 1 34 34 ALA HB3 H 1 1.461 0.02 . 1 . . . . . . . . 6095 1 364 . 1 1 35 35 LEU N N 15 117.984 0.1 . 1 . . . . . . . . 6095 1 365 . 1 1 35 35 LEU H H 1 7.661 0.02 . 1 . . . . . . . . 6095 1 366 . 1 1 35 35 LEU CA C 13 54.200 0.1 . 1 . . . . . . . . 6095 1 367 . 1 1 35 35 LEU HA H 1 4.170 0.02 . 1 . . . . . . . . 6095 1 368 . 1 1 35 35 LEU CB C 13 39.898 0.1 . 1 . . . . . . . . 6095 1 369 . 1 1 35 35 LEU HB2 H 1 1.690 0.02 . 2 . . . . . . . . 6095 1 370 . 1 1 35 35 LEU HB3 H 1 1.569 0.02 . 2 . . . . . . . . 6095 1 371 . 1 1 35 35 LEU CG C 13 25.250 0.1 . 1 . . . . . . . . 6095 1 372 . 1 1 35 35 LEU HG H 1 1.600 0.02 . 1 . . . . . . . . 6095 1 373 . 1 1 35 35 LEU CD1 C 13 21.500 0.1 . 2 . . . . . . . . 6095 1 374 . 1 1 35 35 LEU HD11 H 1 0.825 0.02 . 4 . . . . . . . . 6095 1 375 . 1 1 35 35 LEU HD12 H 1 0.825 0.02 . 4 . . . . . . . . 6095 1 376 . 1 1 35 35 LEU HD13 H 1 0.825 0.02 . 4 . . . . . . . . 6095 1 377 . 1 1 35 35 LEU CD2 C 13 23.237 0.1 . 2 . . . . . . . . 6095 1 378 . 1 1 35 35 LEU HD21 H 1 0.880 0.02 . 4 . . . . . . . . 6095 1 379 . 1 1 35 35 LEU HD22 H 1 0.880 0.02 . 4 . . . . . . . . 6095 1 380 . 1 1 35 35 LEU HD23 H 1 0.880 0.02 . 4 . . . . . . . . 6095 1 381 . 1 1 36 36 LYS N N 15 118.917 0.1 . 1 . . . . . . . . 6095 1 382 . 1 1 36 36 LYS H H 1 7.846 0.02 . 1 . . . . . . . . 6095 1 383 . 1 1 36 36 LYS CA C 13 54.550 0.1 . 1 . . . . . . . . 6095 1 384 . 1 1 36 36 LYS HA H 1 4.260 0.02 . 1 . . . . . . . . 6095 1 385 . 1 1 36 36 LYS CB C 13 30.640 0.1 . 1 . . . . . . . . 6095 1 386 . 1 1 36 36 LYS HB2 H 1 1.896 0.02 . 2 . . . . . . . . 6095 1 387 . 1 1 36 36 LYS HB3 H 1 1.780 0.02 . 2 . . . . . . . . 6095 1 388 . 1 1 36 36 LYS CG C 13 22.800 0.1 . 1 . . . . . . . . 6095 1 389 . 1 1 36 36 LYS HG2 H 1 1.445 0.02 . 2 . . . . . . . . 6095 1 390 . 1 1 36 36 LYS HG3 H 1 1.410 0.02 . 2 . . . . . . . . 6095 1 391 . 1 1 37 37 ASP N N 15 119.961 0.1 . 1 . . . . . . . . 6095 1 392 . 1 1 37 37 ASP H H 1 7.910 0.02 . 1 . . . . . . . . 6095 1 393 . 1 1 37 37 ASP CA C 13 52.375 0.1 . 1 . . . . . . . . 6095 1 394 . 1 1 37 37 ASP HA H 1 4.555 0.02 . 1 . . . . . . . . 6095 1 395 . 1 1 37 37 ASP CB C 13 40.000 0.1 . 1 . . . . . . . . 6095 1 396 . 1 1 37 37 ASP HB3 H 1 2.730 0.02 . 2 . . . . . . . . 6095 1 397 . 1 1 38 38 ARG N N 15 120.710 0.1 . 1 . . . . . . . . 6095 1 398 . 1 1 38 38 ARG H H 1 8.305 0.02 . 1 . . . . . . . . 6095 1 399 . 1 1 38 38 ARG CA C 13 55.800 0.1 . 1 . . . . . . . . 6095 1 400 . 1 1 38 38 ARG HA H 1 4.180 0.02 . 1 . . . . . . . . 6095 1 401 . 1 1 38 38 ARG CB C 13 27.900 0.1 . 1 . . . . . . . . 6095 1 402 . 1 1 38 38 ARG HB3 H 1 1.880 0.02 . 2 . . . . . . . . 6095 1 403 . 1 1 38 38 ARG CG C 13 25.500 0.1 . 1 . . . . . . . . 6095 1 404 . 1 1 38 38 ARG HG2 H 1 1.743 0.02 . 2 . . . . . . . . 6095 1 405 . 1 1 38 38 ARG HG3 H 1 1.642 0.02 . 2 . . . . . . . . 6095 1 406 . 1 1 38 38 ARG CD C 13 41.500 0.1 . 1 . . . . . . . . 6095 1 407 . 1 1 38 38 ARG HD3 H 1 3.155 0.02 . 2 . . . . . . . . 6095 1 408 . 1 1 38 38 ARG NE N 15 84.521 0.1 . 1 . . . . . . . . 6095 1 409 . 1 1 38 38 ARG HE H 1 7.235 0.02 . 1 . . . . . . . . 6095 1 410 . 1 1 39 39 ARG N N 15 119.764 0.1 . 1 . . . . . . . . 6095 1 411 . 1 1 39 39 ARG H H 1 8.390 0.02 . 1 . . . . . . . . 6095 1 412 . 1 1 39 39 ARG CA C 13 56.000 0.1 . 1 . . . . . . . . 6095 1 413 . 1 1 39 39 ARG HA H 1 4.160 0.02 . 1 . . . . . . . . 6095 1 414 . 1 1 39 39 ARG CB C 13 28.400 0.1 . 1 . . . . . . . . 6095 1 415 . 1 1 39 39 ARG HB3 H 1 1.900 0.02 . 2 . . . . . . . . 6095 1 416 . 1 1 39 39 ARG CG C 13 27.100 0.1 . 1 . . . . . . . . 6095 1 417 . 1 1 39 39 ARG HG3 H 1 1.660 0.02 . 2 . . . . . . . . 6095 1 418 . 1 1 39 39 ARG CD C 13 41.300 0.1 . 1 . . . . . . . . 6095 1 419 . 1 1 39 39 ARG HD3 H 1 3.210 0.02 . 2 . . . . . . . . 6095 1 420 . 1 1 40 40 MET N N 15 118.847 0.1 . 1 . . . . . . . . 6095 1 421 . 1 1 40 40 MET H H 1 8.250 0.02 . 1 . . . . . . . . 6095 1 422 . 1 1 40 40 MET CA C 13 54.650 0.1 . 1 . . . . . . . . 6095 1 423 . 1 1 40 40 MET HA H 1 4.380 0.02 . 1 . . . . . . . . 6095 1 424 . 1 1 40 40 MET CB C 13 29.350 0.1 . 1 . . . . . . . . 6095 1 425 . 1 1 40 40 MET HB2 H 1 2.130 0.02 . 2 . . . . . . . . 6095 1 426 . 1 1 40 40 MET HB3 H 1 2.050 0.02 . 2 . . . . . . . . 6095 1 427 . 1 1 40 40 MET CG C 13 30.400 0.1 . 1 . . . . . . . . 6095 1 428 . 1 1 40 40 MET HG2 H 1 2.565 0.02 . 2 . . . . . . . . 6095 1 429 . 1 1 40 40 MET HG3 H 1 2.485 0.02 . 2 . . . . . . . . 6095 1 430 . 1 1 40 40 MET CE C 13 14.971 0.1 . 1 . . . . . . . . 6095 1 431 . 1 1 40 40 MET HE1 H 1 1.892 0.02 . 1 . . . . . . . . 6095 1 432 . 1 1 40 40 MET HE2 H 1 1.892 0.02 . 1 . . . . . . . . 6095 1 433 . 1 1 40 40 MET HE3 H 1 1.892 0.02 . 1 . . . . . . . . 6095 1 434 . 1 1 41 41 GLU N N 15 119.056 0.1 . 1 . . . . . . . . 6095 1 435 . 1 1 41 41 GLU H H 1 8.374 0.02 . 1 . . . . . . . . 6095 1 436 . 1 1 41 41 GLU CA C 13 57.800 0.1 . 1 . . . . . . . . 6095 1 437 . 1 1 41 41 GLU HA H 1 3.967 0.02 . 1 . . . . . . . . 6095 1 438 . 1 1 41 41 GLU CB C 13 27.100 0.1 . 1 . . . . . . . . 6095 1 439 . 1 1 41 41 GLU HB3 H 1 2.020 0.02 . 2 . . . . . . . . 6095 1 440 . 1 1 41 41 GLU CG C 13 34.250 0.1 . 1 . . . . . . . . 6095 1 441 . 1 1 41 41 GLU HG3 H 1 2.307 0.02 . 2 . . . . . . . . 6095 1 442 . 1 1 42 42 ASN N N 15 117.533 0.1 . 1 . . . . . . . . 6095 1 443 . 1 1 42 42 ASN H H 1 8.177 0.02 . 1 . . . . . . . . 6095 1 444 . 1 1 42 42 ASN CA C 13 53.632 0.1 . 1 . . . . . . . . 6095 1 445 . 1 1 42 42 ASN HA H 1 4.564 0.02 . 1 . . . . . . . . 6095 1 446 . 1 1 42 42 ASN CB C 13 35.977 0.1 . 1 . . . . . . . . 6095 1 447 . 1 1 42 42 ASN HB2 H 1 2.882 0.02 . 2 . . . . . . . . 6095 1 448 . 1 1 42 42 ASN HB3 H 1 2.788 0.02 . 2 . . . . . . . . 6095 1 449 . 1 1 42 42 ASN ND2 N 15 112.063 0.1 . 1 . . . . . . . . 6095 1 450 . 1 1 42 42 ASN HD21 H 1 6.910 0.02 . 2 . . . . . . . . 6095 1 451 . 1 1 42 42 ASN HD22 H 1 7.618 0.02 . 2 . . . . . . . . 6095 1 452 . 1 1 43 43 LEU N N 15 123.162 0.1 . 1 . . . . . . . . 6095 1 453 . 1 1 43 43 LEU H H 1 7.851 0.02 . 1 . . . . . . . . 6095 1 454 . 1 1 43 43 LEU CA C 13 55.900 0.1 . 1 . . . . . . . . 6095 1 455 . 1 1 43 43 LEU HA H 1 4.180 0.02 . 1 . . . . . . . . 6095 1 456 . 1 1 43 43 LEU CB C 13 39.400 0.1 . 1 . . . . . . . . 6095 1 457 . 1 1 43 43 LEU HB3 H 1 1.875 0.02 . 2 . . . . . . . . 6095 1 458 . 1 1 43 43 LEU CG C 13 25.200 0.1 . 1 . . . . . . . . 6095 1 459 . 1 1 43 43 LEU HG H 1 1.670 0.02 . 1 . . . . . . . . 6095 1 460 . 1 1 43 43 LEU CD1 C 13 22.150 0.1 . 2 . . . . . . . . 6095 1 461 . 1 1 43 43 LEU HD11 H 1 0.708 0.02 . 4 . . . . . . . . 6095 1 462 . 1 1 43 43 LEU HD12 H 1 0.708 0.02 . 4 . . . . . . . . 6095 1 463 . 1 1 43 43 LEU HD13 H 1 0.708 0.02 . 4 . . . . . . . . 6095 1 464 . 1 1 43 43 LEU CD2 C 13 22.800 0.1 . 2 . . . . . . . . 6095 1 465 . 1 1 43 43 LEU HD21 H 1 0.826 0.02 . 4 . . . . . . . . 6095 1 466 . 1 1 43 43 LEU HD22 H 1 0.826 0.02 . 4 . . . . . . . . 6095 1 467 . 1 1 43 43 LEU HD23 H 1 0.826 0.02 . 4 . . . . . . . . 6095 1 468 . 1 1 44 44 VAL N N 15 119.607 0.1 . 1 . . . . . . . . 6095 1 469 . 1 1 44 44 VAL H H 1 8.320 0.02 . 1 . . . . . . . . 6095 1 470 . 1 1 44 44 VAL CA C 13 64.900 0.1 . 1 . . . . . . . . 6095 1 471 . 1 1 44 44 VAL HA H 1 3.478 0.02 . 1 . . . . . . . . 6095 1 472 . 1 1 44 44 VAL CB C 13 29.700 0.1 . 1 . . . . . . . . 6095 1 473 . 1 1 44 44 VAL HB H 1 2.090 0.02 . 1 . . . . . . . . 6095 1 474 . 1 1 44 44 VAL CG1 C 13 19.293 0.1 . 2 . . . . . . . . 6095 1 475 . 1 1 44 44 VAL HG11 H 1 0.903 0.02 . 4 . . . . . . . . 6095 1 476 . 1 1 44 44 VAL HG12 H 1 0.903 0.02 . 4 . . . . . . . . 6095 1 477 . 1 1 44 44 VAL HG13 H 1 0.903 0.02 . 4 . . . . . . . . 6095 1 478 . 1 1 44 44 VAL CG2 C 13 21.223 0.1 . 2 . . . . . . . . 6095 1 479 . 1 1 44 44 VAL HG21 H 1 1.072 0.02 . 4 . . . . . . . . 6095 1 480 . 1 1 44 44 VAL HG22 H 1 1.072 0.02 . 4 . . . . . . . . 6095 1 481 . 1 1 44 44 VAL HG23 H 1 1.072 0.02 . 4 . . . . . . . . 6095 1 482 . 1 1 45 45 ALA N N 15 120.273 0.1 . 1 . . . . . . . . 6095 1 483 . 1 1 45 45 ALA H H 1 7.751 0.02 . 1 . . . . . . . . 6095 1 484 . 1 1 45 45 ALA CA C 13 53.468 0.1 . 1 . . . . . . . . 6095 1 485 . 1 1 45 45 ALA HA H 1 4.046 0.02 . 1 . . . . . . . . 6095 1 486 . 1 1 45 45 ALA CB C 13 16.014 0.1 . 1 . . . . . . . . 6095 1 487 . 1 1 45 45 ALA HB1 H 1 1.528 0.02 . 1 . . . . . . . . 6095 1 488 . 1 1 45 45 ALA HB2 H 1 1.528 0.02 . 1 . . . . . . . . 6095 1 489 . 1 1 45 45 ALA HB3 H 1 1.528 0.02 . 1 . . . . . . . . 6095 1 490 . 1 1 46 46 TYR N N 15 120.091 0.1 . 1 . . . . . . . . 6095 1 491 . 1 1 46 46 TYR H H 1 7.900 0.02 . 1 . . . . . . . . 6095 1 492 . 1 1 46 46 TYR CA C 13 59.030 0.1 . 1 . . . . . . . . 6095 1 493 . 1 1 46 46 TYR HA H 1 4.305 0.02 . 1 . . . . . . . . 6095 1 494 . 1 1 46 46 TYR CB C 13 36.308 0.1 . 1 . . . . . . . . 6095 1 495 . 1 1 46 46 TYR HB3 H 1 3.250 0.02 . 2 . . . . . . . . 6095 1 496 . 1 1 46 46 TYR CD1 C 13 130.638 0.1 . 3 . . . . . . . . 6095 1 497 . 1 1 46 46 TYR HD1 H 1 7.051 0.02 . 3 . . . . . . . . 6095 1 498 . 1 1 46 46 TYR CE1 C 13 116.314 0.1 . 3 . . . . . . . . 6095 1 499 . 1 1 46 46 TYR HE1 H 1 6.705 0.02 . 3 . . . . . . . . 6095 1 500 . 1 1 47 47 ALA N N 15 121.826 0.1 . 1 . . . . . . . . 6095 1 501 . 1 1 47 47 ALA H H 1 8.601 0.02 . 1 . . . . . . . . 6095 1 502 . 1 1 47 47 ALA CA C 13 53.392 0.1 . 1 . . . . . . . . 6095 1 503 . 1 1 47 47 ALA HA H 1 3.740 0.02 . 1 . . . . . . . . 6095 1 504 . 1 1 47 47 ALA CB C 13 18.250 0.1 . 1 . . . . . . . . 6095 1 505 . 1 1 47 47 ALA HB1 H 1 1.540 0.02 . 1 . . . . . . . . 6095 1 506 . 1 1 47 47 ALA HB2 H 1 1.540 0.02 . 1 . . . . . . . . 6095 1 507 . 1 1 47 47 ALA HB3 H 1 1.540 0.02 . 1 . . . . . . . . 6095 1 508 . 1 1 48 48 LYS N N 15 116.156 0.1 . 1 . . . . . . . . 6095 1 509 . 1 1 48 48 LYS H H 1 8.617 0.02 . 1 . . . . . . . . 6095 1 510 . 1 1 48 48 LYS CA C 13 57.700 0.1 . 1 . . . . . . . . 6095 1 511 . 1 1 48 48 LYS HA H 1 3.982 0.02 . 1 . . . . . . . . 6095 1 512 . 1 1 48 48 LYS CB C 13 30.900 0.1 . 1 . . . . . . . . 6095 1 513 . 1 1 48 48 LYS HB3 H 1 1.880 0.02 . 2 . . . . . . . . 6095 1 514 . 1 1 48 48 LYS CG C 13 24.600 0.1 . 1 . . . . . . . . 6095 1 515 . 1 1 48 48 LYS HG2 H 1 1.670 0.02 . 2 . . . . . . . . 6095 1 516 . 1 1 48 48 LYS HG3 H 1 1.385 0.02 . 2 . . . . . . . . 6095 1 517 . 1 1 48 48 LYS CD C 13 27.800 0.1 . 1 . . . . . . . . 6095 1 518 . 1 1 48 48 LYS HD3 H 1 1.650 0.02 . 2 . . . . . . . . 6095 1 519 . 1 1 48 48 LYS CE C 13 40.100 0.1 . 1 . . . . . . . . 6095 1 520 . 1 1 48 48 LYS HE2 H 1 2.910 0.02 . 2 . . . . . . . . 6095 1 521 . 1 1 48 48 LYS HE3 H 1 2.840 0.02 . 2 . . . . . . . . 6095 1 522 . 1 1 49 49 LYS N N 15 122.851 0.1 . 1 . . . . . . . . 6095 1 523 . 1 1 49 49 LYS H H 1 7.703 0.02 . 1 . . . . . . . . 6095 1 524 . 1 1 49 49 LYS CA C 13 57.200 0.1 . 1 . . . . . . . . 6095 1 525 . 1 1 49 49 LYS HA H 1 4.065 0.02 . 1 . . . . . . . . 6095 1 526 . 1 1 49 49 LYS CB C 13 30.050 0.1 . 1 . . . . . . . . 6095 1 527 . 1 1 49 49 LYS HB2 H 1 2.090 0.02 . 2 . . . . . . . . 6095 1 528 . 1 1 49 49 LYS HB3 H 1 1.915 0.02 . 2 . . . . . . . . 6095 1 529 . 1 1 49 49 LYS CG C 13 23.000 0.1 . 1 . . . . . . . . 6095 1 530 . 1 1 49 49 LYS HG2 H 1 1.485 0.02 . 2 . . . . . . . . 6095 1 531 . 1 1 49 49 LYS HG3 H 1 1.405 0.02 . 2 . . . . . . . . 6095 1 532 . 1 1 49 49 LYS CD C 13 27.000 0.1 . 1 . . . . . . . . 6095 1 533 . 1 1 49 49 LYS HD2 H 1 1.700 0.02 . 2 . . . . . . . . 6095 1 534 . 1 1 49 49 LYS HD3 H 1 1.640 0.02 . 2 . . . . . . . . 6095 1 535 . 1 1 50 50 VAL N N 15 118.548 0.1 . 1 . . . . . . . . 6095 1 536 . 1 1 50 50 VAL H H 1 8.058 0.02 . 1 . . . . . . . . 6095 1 537 . 1 1 50 50 VAL CA C 13 64.011 0.1 . 1 . . . . . . . . 6095 1 538 . 1 1 50 50 VAL HA H 1 3.725 0.02 . 1 . . . . . . . . 6095 1 539 . 1 1 50 50 VAL CB C 13 29.800 0.1 . 1 . . . . . . . . 6095 1 540 . 1 1 50 50 VAL HB H 1 1.910 0.02 . 1 . . . . . . . . 6095 1 541 . 1 1 50 50 VAL CG1 C 13 20.143 0.1 . 2 . . . . . . . . 6095 1 542 . 1 1 50 50 VAL HG11 H 1 0.639 0.02 . 4 . . . . . . . . 6095 1 543 . 1 1 50 50 VAL HG12 H 1 0.639 0.02 . 4 . . . . . . . . 6095 1 544 . 1 1 50 50 VAL HG13 H 1 0.639 0.02 . 4 . . . . . . . . 6095 1 545 . 1 1 50 50 VAL CG2 C 13 19.801 0.1 . 2 . . . . . . . . 6095 1 546 . 1 1 50 50 VAL HG21 H 1 0.760 0.02 . 4 . . . . . . . . 6095 1 547 . 1 1 50 50 VAL HG22 H 1 0.760 0.02 . 4 . . . . . . . . 6095 1 548 . 1 1 50 50 VAL HG23 H 1 0.760 0.02 . 4 . . . . . . . . 6095 1 549 . 1 1 51 51 GLU N N 15 119.700 0.1 . 1 . . . . . . . . 6095 1 550 . 1 1 51 51 GLU H H 1 8.451 0.02 . 1 . . . . . . . . 6095 1 551 . 1 1 51 51 GLU CA C 13 59.728 0.1 . 1 . . . . . . . . 6095 1 552 . 1 1 51 51 GLU HA H 1 3.799 0.02 . 1 . . . . . . . . 6095 1 553 . 1 1 51 51 GLU CB C 13 26.800 0.1 . 1 . . . . . . . . 6095 1 554 . 1 1 51 51 GLU HB2 H 1 2.306 0.02 . 2 . . . . . . . . 6095 1 555 . 1 1 51 51 GLU HB3 H 1 1.620 0.02 . 2 . . . . . . . . 6095 1 556 . 1 1 51 51 GLU CG C 13 33.570 0.1 . 1 . . . . . . . . 6095 1 557 . 1 1 51 51 GLU HG2 H 1 2.400 0.02 . 2 . . . . . . . . 6095 1 558 . 1 1 51 51 GLU HG3 H 1 2.330 0.02 . 2 . . . . . . . . 6095 1 559 . 1 1 52 52 GLY N N 15 105.987 0.1 . 1 . . . . . . . . 6095 1 560 . 1 1 52 52 GLY H H 1 8.026 0.02 . 1 . . . . . . . . 6095 1 561 . 1 1 52 52 GLY CA C 13 45.484 0.1 . 1 . . . . . . . . 6095 1 562 . 1 1 52 52 GLY HA2 H 1 3.915 0.02 . 2 . . . . . . . . 6095 1 563 . 1 1 52 52 GLY HA3 H 1 3.583 0.02 . 2 . . . . . . . . 6095 1 564 . 1 1 53 53 ASP N N 15 122.305 0.1 . 1 . . . . . . . . 6095 1 565 . 1 1 53 53 ASP H H 1 8.280 0.02 . 1 . . . . . . . . 6095 1 566 . 1 1 53 53 ASP CA C 13 55.100 0.1 . 1 . . . . . . . . 6095 1 567 . 1 1 53 53 ASP HA H 1 4.526 0.02 . 1 . . . . . . . . 6095 1 568 . 1 1 53 53 ASP CB C 13 38.050 0.1 . 1 . . . . . . . . 6095 1 569 . 1 1 53 53 ASP HB2 H 1 2.960 0.02 . 2 . . . . . . . . 6095 1 570 . 1 1 53 53 ASP HB3 H 1 2.680 0.02 . 2 . . . . . . . . 6095 1 571 . 1 1 54 54 MET N N 15 120.317 0.1 . 1 . . . . . . . . 6095 1 572 . 1 1 54 54 MET H H 1 8.290 0.02 . 1 . . . . . . . . 6095 1 573 . 1 1 54 54 MET CA C 13 55.800 0.1 . 1 . . . . . . . . 6095 1 574 . 1 1 54 54 MET HA H 1 4.520 0.02 . 1 . . . . . . . . 6095 1 575 . 1 1 54 54 MET CB C 13 29.700 0.1 . 1 . . . . . . . . 6095 1 576 . 1 1 54 54 MET HB2 H 1 2.370 0.02 . 2 . . . . . . . . 6095 1 577 . 1 1 54 54 MET HB3 H 1 2.070 0.02 . 2 . . . . . . . . 6095 1 578 . 1 1 54 54 MET CG C 13 31.358 0.1 . 1 . . . . . . . . 6095 1 579 . 1 1 54 54 MET HG2 H 1 3.002 0.02 . 2 . . . . . . . . 6095 1 580 . 1 1 54 54 MET HG3 H 1 2.490 0.02 . 2 . . . . . . . . 6095 1 581 . 1 1 54 54 MET CE C 13 17.697 0.1 . 1 . . . . . . . . 6095 1 582 . 1 1 54 54 MET HE1 H 1 2.047 0.02 . 1 . . . . . . . . 6095 1 583 . 1 1 54 54 MET HE2 H 1 2.047 0.02 . 1 . . . . . . . . 6095 1 584 . 1 1 54 54 MET HE3 H 1 2.047 0.02 . 1 . . . . . . . . 6095 1 585 . 1 1 55 55 TYR N N 15 121.734 0.1 . 1 . . . . . . . . 6095 1 586 . 1 1 55 55 TYR H H 1 9.351 0.02 . 1 . . . . . . . . 6095 1 587 . 1 1 55 55 TYR CA C 13 60.346 0.1 . 1 . . . . . . . . 6095 1 588 . 1 1 55 55 TYR HA H 1 4.378 0.02 . 1 . . . . . . . . 6095 1 589 . 1 1 55 55 TYR CB C 13 36.965 0.1 . 1 . . . . . . . . 6095 1 590 . 1 1 55 55 TYR HB2 H 1 3.609 0.02 . 2 . . . . . . . . 6095 1 591 . 1 1 55 55 TYR HB3 H 1 3.090 0.02 . 2 . . . . . . . . 6095 1 592 . 1 1 55 55 TYR CD1 C 13 130.623 0.1 . 3 . . . . . . . . 6095 1 593 . 1 1 55 55 TYR HD1 H 1 6.601 0.02 . 3 . . . . . . . . 6095 1 594 . 1 1 55 55 TYR CE1 C 13 114.967 0.1 . 3 . . . . . . . . 6095 1 595 . 1 1 55 55 TYR HE1 H 1 5.986 0.02 . 3 . . . . . . . . 6095 1 596 . 1 1 56 56 GLU N N 15 114.225 0.1 . 1 . . . . . . . . 6095 1 597 . 1 1 56 56 GLU H H 1 7.880 0.02 . 1 . . . . . . . . 6095 1 598 . 1 1 56 56 GLU CA C 13 55.600 0.1 . 1 . . . . . . . . 6095 1 599 . 1 1 56 56 GLU HA H 1 4.358 0.02 . 1 . . . . . . . . 6095 1 600 . 1 1 56 56 GLU CB C 13 27.950 0.1 . 1 . . . . . . . . 6095 1 601 . 1 1 56 56 GLU HB2 H 1 2.246 0.02 . 2 . . . . . . . . 6095 1 602 . 1 1 56 56 GLU HB3 H 1 2.147 0.02 . 2 . . . . . . . . 6095 1 603 . 1 1 56 56 GLU CG C 13 33.800 0.1 . 1 . . . . . . . . 6095 1 604 . 1 1 56 56 GLU HG2 H 1 2.580 0.02 . 2 . . . . . . . . 6095 1 605 . 1 1 56 56 GLU HG3 H 1 2.520 0.02 . 2 . . . . . . . . 6095 1 606 . 1 1 57 57 SER N N 15 112.234 0.1 . 1 . . . . . . . . 6095 1 607 . 1 1 57 57 SER H H 1 7.878 0.02 . 1 . . . . . . . . 6095 1 608 . 1 1 57 57 SER CA C 13 58.164 0.1 . 1 . . . . . . . . 6095 1 609 . 1 1 57 57 SER HA H 1 4.424 0.02 . 1 . . . . . . . . 6095 1 610 . 1 1 57 57 SER CB C 13 62.700 0.1 . 1 . . . . . . . . 6095 1 611 . 1 1 57 57 SER HB3 H 1 3.940 0.02 . 2 . . . . . . . . 6095 1 612 . 1 1 58 58 ALA N N 15 123.584 0.1 . 1 . . . . . . . . 6095 1 613 . 1 1 58 58 ALA H H 1 8.192 0.02 . 1 . . . . . . . . 6095 1 614 . 1 1 58 58 ALA CA C 13 50.700 0.1 . 1 . . . . . . . . 6095 1 615 . 1 1 58 58 ALA HA H 1 4.185 0.02 . 1 . . . . . . . . 6095 1 616 . 1 1 58 58 ALA CB C 13 17.650 0.1 . 1 . . . . . . . . 6095 1 617 . 1 1 58 58 ALA HB1 H 1 1.560 0.02 . 1 . . . . . . . . 6095 1 618 . 1 1 58 58 ALA HB2 H 1 1.560 0.02 . 1 . . . . . . . . 6095 1 619 . 1 1 58 58 ALA HB3 H 1 1.560 0.02 . 1 . . . . . . . . 6095 1 620 . 1 1 59 59 ASN N N 15 117.074 0.1 . 1 . . . . . . . . 6095 1 621 . 1 1 59 59 ASN H H 1 9.195 0.02 . 1 . . . . . . . . 6095 1 622 . 1 1 59 59 ASN CA C 13 51.506 0.1 . 1 . . . . . . . . 6095 1 623 . 1 1 59 59 ASN HA H 1 5.104 0.02 . 1 . . . . . . . . 6095 1 624 . 1 1 59 59 ASN CB C 13 38.215 0.1 . 1 . . . . . . . . 6095 1 625 . 1 1 59 59 ASN HB2 H 1 2.950 0.02 . 2 . . . . . . . . 6095 1 626 . 1 1 59 59 ASN HB3 H 1 2.755 0.02 . 2 . . . . . . . . 6095 1 627 . 1 1 59 59 ASN ND2 N 15 116.145 0.1 . 1 . . . . . . . . 6095 1 628 . 1 1 59 59 ASN HD21 H 1 7.010 0.02 . 2 . . . . . . . . 6095 1 629 . 1 1 59 59 ASN HD22 H 1 8.064 0.02 . 2 . . . . . . . . 6095 1 630 . 1 1 60 60 SER N N 15 111.335 0.1 . 1 . . . . . . . . 6095 1 631 . 1 1 60 60 SER H H 1 6.872 0.02 . 1 . . . . . . . . 6095 1 632 . 1 1 60 60 SER CA C 13 54.632 0.1 . 1 . . . . . . . . 6095 1 633 . 1 1 60 60 SER HA H 1 3.718 0.02 . 1 . . . . . . . . 6095 1 634 . 1 1 60 60 SER CB C 13 63.000 0.1 . 1 . . . . . . . . 6095 1 635 . 1 1 60 60 SER HB3 H 1 3.890 0.02 . 2 . . . . . . . . 6095 1 636 . 1 1 61 61 ARG N N 15 121.716 0.1 . 1 . . . . . . . . 6095 1 637 . 1 1 61 61 ARG H H 1 8.704 0.02 . 1 . . . . . . . . 6095 1 638 . 1 1 61 61 ARG CA C 13 57.081 0.1 . 1 . . . . . . . . 6095 1 639 . 1 1 61 61 ARG HA H 1 3.221 0.02 . 1 . . . . . . . . 6095 1 640 . 1 1 61 61 ARG CB C 13 28.400 0.1 . 1 . . . . . . . . 6095 1 641 . 1 1 61 61 ARG HB2 H 1 2.020 0.02 . 2 . . . . . . . . 6095 1 642 . 1 1 61 61 ARG HB3 H 1 1.880 0.02 . 2 . . . . . . . . 6095 1 643 . 1 1 61 61 ARG CG C 13 25.850 0.1 . 1 . . . . . . . . 6095 1 644 . 1 1 61 61 ARG HG2 H 1 1.800 0.02 . 2 . . . . . . . . 6095 1 645 . 1 1 61 61 ARG HG3 H 1 1.760 0.02 . 2 . . . . . . . . 6095 1 646 . 1 1 61 61 ARG CD C 13 41.876 0.1 . 1 . . . . . . . . 6095 1 647 . 1 1 61 61 ARG HD2 H 1 3.446 0.02 . 2 . . . . . . . . 6095 1 648 . 1 1 61 61 ARG HD3 H 1 3.379 0.02 . 2 . . . . . . . . 6095 1 649 . 1 1 62 62 ASP N N 15 116.200 0.1 . 1 . . . . . . . . 6095 1 650 . 1 1 62 62 ASP H H 1 8.125 0.02 . 1 . . . . . . . . 6095 1 651 . 1 1 62 62 ASP CA C 13 55.400 0.1 . 1 . . . . . . . . 6095 1 652 . 1 1 62 62 ASP HA H 1 4.355 0.02 . 1 . . . . . . . . 6095 1 653 . 1 1 62 62 ASP CB C 13 38.200 0.1 . 1 . . . . . . . . 6095 1 654 . 1 1 62 62 ASP HB2 H 1 2.560 0.02 . 2 . . . . . . . . 6095 1 655 . 1 1 62 62 ASP HB3 H 1 2.445 0.02 . 2 . . . . . . . . 6095 1 656 . 1 1 63 63 GLU N N 15 120.351 0.1 . 1 . . . . . . . . 6095 1 657 . 1 1 63 63 GLU H H 1 7.713 0.02 . 1 . . . . . . . . 6095 1 658 . 1 1 63 63 GLU CA C 13 57.400 0.1 . 1 . . . . . . . . 6095 1 659 . 1 1 63 63 GLU HA H 1 4.000 0.02 . 1 . . . . . . . . 6095 1 660 . 1 1 63 63 GLU CB C 13 28.200 0.1 . 1 . . . . . . . . 6095 1 661 . 1 1 63 63 GLU HB3 H 1 1.880 0.02 . 2 . . . . . . . . 6095 1 662 . 1 1 63 63 GLU CG C 13 34.950 0.1 . 1 . . . . . . . . 6095 1 663 . 1 1 63 63 GLU HG2 H 1 2.328 0.02 . 2 . . . . . . . . 6095 1 664 . 1 1 63 63 GLU HG3 H 1 2.227 0.02 . 2 . . . . . . . . 6095 1 665 . 1 1 64 64 TYR N N 15 121.625 0.1 . 1 . . . . . . . . 6095 1 666 . 1 1 64 64 TYR H H 1 7.367 0.02 . 1 . . . . . . . . 6095 1 667 . 1 1 64 64 TYR CA C 13 58.850 0.1 . 1 . . . . . . . . 6095 1 668 . 1 1 64 64 TYR HA H 1 3.910 0.02 . 1 . . . . . . . . 6095 1 669 . 1 1 64 64 TYR CB C 13 36.500 0.1 . 1 . . . . . . . . 6095 1 670 . 1 1 64 64 TYR HB2 H 1 2.800 0.02 . 2 . . . . . . . . 6095 1 671 . 1 1 64 64 TYR HB3 H 1 2.436 0.02 . 2 . . . . . . . . 6095 1 672 . 1 1 64 64 TYR CD1 C 13 130.632 0.1 . 3 . . . . . . . . 6095 1 673 . 1 1 64 64 TYR HD1 H 1 6.705 0.02 . 3 . . . . . . . . 6095 1 674 . 1 1 64 64 TYR CE1 C 13 115.579 0.1 . 3 . . . . . . . . 6095 1 675 . 1 1 64 64 TYR HE1 H 1 7.053 0.02 . 3 . . . . . . . . 6095 1 676 . 1 1 64 64 TYR CE2 C 13 116.303 0.1 . 1 . . . . . . . . 6095 1 677 . 1 1 64 64 TYR HE2 H 1 7.049 0.02 . 3 . . . . . . . . 6095 1 678 . 1 1 65 65 TYR N N 15 114.571 0.1 . 1 . . . . . . . . 6095 1 679 . 1 1 65 65 TYR H H 1 7.684 0.02 . 1 . . . . . . . . 6095 1 680 . 1 1 65 65 TYR CA C 13 60.450 0.1 . 1 . . . . . . . . 6095 1 681 . 1 1 65 65 TYR HA H 1 4.010 0.02 . 1 . . . . . . . . 6095 1 682 . 1 1 65 65 TYR CB C 13 36.500 0.1 . 1 . . . . . . . . 6095 1 683 . 1 1 65 65 TYR HB2 H 1 2.990 0.02 . 2 . . . . . . . . 6095 1 684 . 1 1 65 65 TYR HB3 H 1 2.890 0.02 . 2 . . . . . . . . 6095 1 685 . 1 1 65 65 TYR CD1 C 13 130.639 0.1 . 3 . . . . . . . . 6095 1 686 . 1 1 65 65 TYR HD1 H 1 7.120 0.02 . 3 . . . . . . . . 6095 1 687 . 1 1 65 65 TYR CE1 C 13 116.060 0.1 . 3 . . . . . . . . 6095 1 688 . 1 1 65 65 TYR HE1 H 1 6.865 0.02 . 3 . . . . . . . . 6095 1 689 . 1 1 66 66 HIS N N 15 117.620 0.1 . 1 . . . . . . . . 6095 1 690 . 1 1 66 66 HIS H H 1 8.139 0.02 . 1 . . . . . . . . 6095 1 691 . 1 1 66 66 HIS CA C 13 58.000 0.1 . 1 . . . . . . . . 6095 1 692 . 1 1 66 66 HIS HA H 1 4.300 0.02 . 1 . . . . . . . . 6095 1 693 . 1 1 66 66 HIS CB C 13 26.700 0.1 . 1 . . . . . . . . 6095 1 694 . 1 1 66 66 HIS HB2 H 1 3.370 0.02 . 2 . . . . . . . . 6095 1 695 . 1 1 66 66 HIS HB3 H 1 3.280 0.02 . 2 . . . . . . . . 6095 1 696 . 1 1 66 66 HIS CD2 C 13 117.800 0.1 . 1 . . . . . . . . 6095 1 697 . 1 1 66 66 HIS HD2 H 1 7.155 0.02 . 1 . . . . . . . . 6095 1 698 . 1 1 67 67 LEU N N 15 118.845 0.1 . 1 . . . . . . . . 6095 1 699 . 1 1 67 67 LEU H H 1 9.139 0.02 . 1 . . . . . . . . 6095 1 700 . 1 1 67 67 LEU CA C 13 55.800 0.1 . 1 . . . . . . . . 6095 1 701 . 1 1 67 67 LEU HA H 1 3.935 0.02 . 1 . . . . . . . . 6095 1 702 . 1 1 67 67 LEU CB C 13 40.000 0.1 . 1 . . . . . . . . 6095 1 703 . 1 1 67 67 LEU HB2 H 1 1.970 0.02 . 2 . . . . . . . . 6095 1 704 . 1 1 67 67 LEU HB3 H 1 1.800 0.02 . 2 . . . . . . . . 6095 1 705 . 1 1 67 67 LEU CG C 13 25.150 0.1 . 1 . . . . . . . . 6095 1 706 . 1 1 67 67 LEU HG H 1 2.040 0.02 . 1 . . . . . . . . 6095 1 707 . 1 1 67 67 LEU CD1 C 13 20.150 0.1 . 2 . . . . . . . . 6095 1 708 . 1 1 67 67 LEU HD11 H 1 0.930 0.02 . 4 . . . . . . . . 6095 1 709 . 1 1 67 67 LEU HD12 H 1 0.930 0.02 . 4 . . . . . . . . 6095 1 710 . 1 1 67 67 LEU HD13 H 1 0.930 0.02 . 4 . . . . . . . . 6095 1 711 . 1 1 67 67 LEU CD2 C 13 23.854 0.1 . 2 . . . . . . . . 6095 1 712 . 1 1 67 67 LEU HD21 H 1 0.978 0.02 . 4 . . . . . . . . 6095 1 713 . 1 1 67 67 LEU HD22 H 1 0.978 0.02 . 4 . . . . . . . . 6095 1 714 . 1 1 67 67 LEU HD23 H 1 0.978 0.02 . 4 . . . . . . . . 6095 1 715 . 1 1 68 68 LEU N N 15 119.181 0.1 . 1 . . . . . . . . 6095 1 716 . 1 1 68 68 LEU H H 1 7.920 0.02 . 1 . . . . . . . . 6095 1 717 . 1 1 68 68 LEU CA C 13 56.165 0.1 . 1 . . . . . . . . 6095 1 718 . 1 1 68 68 LEU HA H 1 3.778 0.02 . 1 . . . . . . . . 6095 1 719 . 1 1 68 68 LEU CB C 13 41.329 0.1 . 1 . . . . . . . . 6095 1 720 . 1 1 68 68 LEU HB2 H 1 1.871 0.02 . 2 . . . . . . . . 6095 1 721 . 1 1 68 68 LEU HB3 H 1 1.073 0.02 . 2 . . . . . . . . 6095 1 722 . 1 1 68 68 LEU CG C 13 24.603 0.1 . 1 . . . . . . . . 6095 1 723 . 1 1 68 68 LEU HG H 1 1.500 0.02 . 1 . . . . . . . . 6095 1 724 . 1 1 68 68 LEU CD1 C 13 23.396 0.1 . 2 . . . . . . . . 6095 1 725 . 1 1 68 68 LEU HD11 H 1 0.330 0.02 . 4 . . . . . . . . 6095 1 726 . 1 1 68 68 LEU HD12 H 1 0.330 0.02 . 4 . . . . . . . . 6095 1 727 . 1 1 68 68 LEU HD13 H 1 0.330 0.02 . 4 . . . . . . . . 6095 1 728 . 1 1 68 68 LEU CD2 C 13 22.000 0.1 . 2 . . . . . . . . 6095 1 729 . 1 1 68 68 LEU HD21 H 1 0.694 0.02 . 4 . . . . . . . . 6095 1 730 . 1 1 68 68 LEU HD22 H 1 0.694 0.02 . 4 . . . . . . . . 6095 1 731 . 1 1 68 68 LEU HD23 H 1 0.694 0.02 . 4 . . . . . . . . 6095 1 732 . 1 1 69 69 ALA N N 15 121.057 0.1 . 1 . . . . . . . . 6095 1 733 . 1 1 69 69 ALA H H 1 8.103 0.02 . 1 . . . . . . . . 6095 1 734 . 1 1 69 69 ALA CA C 13 53.816 0.1 . 1 . . . . . . . . 6095 1 735 . 1 1 69 69 ALA HA H 1 3.798 0.02 . 1 . . . . . . . . 6095 1 736 . 1 1 69 69 ALA CB C 13 18.050 0.1 . 1 . . . . . . . . 6095 1 737 . 1 1 69 69 ALA HB1 H 1 1.515 0.02 . 1 . . . . . . . . 6095 1 738 . 1 1 69 69 ALA HB2 H 1 1.515 0.02 . 1 . . . . . . . . 6095 1 739 . 1 1 69 69 ALA HB3 H 1 1.515 0.02 . 1 . . . . . . . . 6095 1 740 . 1 1 70 70 GLU N N 15 116.201 0.1 . 1 . . . . . . . . 6095 1 741 . 1 1 70 70 GLU H H 1 8.410 0.02 . 1 . . . . . . . . 6095 1 742 . 1 1 70 70 GLU CA C 13 57.750 0.1 . 1 . . . . . . . . 6095 1 743 . 1 1 70 70 GLU HA H 1 3.770 0.02 . 1 . . . . . . . . 6095 1 744 . 1 1 70 70 GLU CB C 13 27.600 0.1 . 1 . . . . . . . . 6095 1 745 . 1 1 70 70 GLU HB2 H 1 2.030 0.02 . 2 . . . . . . . . 6095 1 746 . 1 1 70 70 GLU HB3 H 1 1.880 0.02 . 2 . . . . . . . . 6095 1 747 . 1 1 70 70 GLU CG C 13 34.270 0.1 . 1 . . . . . . . . 6095 1 748 . 1 1 70 70 GLU HG2 H 1 2.090 0.02 . 2 . . . . . . . . 6095 1 749 . 1 1 70 70 GLU HG3 H 1 1.975 0.02 . 2 . . . . . . . . 6095 1 750 . 1 1 71 71 LYS N N 15 119.610 0.1 . 1 . . . . . . . . 6095 1 751 . 1 1 71 71 LYS H H 1 7.871 0.02 . 1 . . . . . . . . 6095 1 752 . 1 1 71 71 LYS CA C 13 55.850 0.1 . 1 . . . . . . . . 6095 1 753 . 1 1 71 71 LYS HA H 1 4.183 0.02 . 1 . . . . . . . . 6095 1 754 . 1 1 71 71 LYS CB C 13 29.500 0.1 . 1 . . . . . . . . 6095 1 755 . 1 1 71 71 LYS HB2 H 1 2.030 0.02 . 2 . . . . . . . . 6095 1 756 . 1 1 71 71 LYS HB3 H 1 1.973 0.02 . 2 . . . . . . . . 6095 1 757 . 1 1 71 71 LYS CG C 13 22.350 0.1 . 1 . . . . . . . . 6095 1 758 . 1 1 71 71 LYS HG2 H 1 1.575 0.02 . 2 . . . . . . . . 6095 1 759 . 1 1 71 71 LYS HG3 H 1 1.425 0.02 . 2 . . . . . . . . 6095 1 760 . 1 1 71 71 LYS CD C 13 26.150 0.1 . 1 . . . . . . . . 6095 1 761 . 1 1 71 71 LYS HD2 H 1 1.857 0.02 . 2 . . . . . . . . 6095 1 762 . 1 1 71 71 LYS HD3 H 1 1.703 0.02 . 2 . . . . . . . . 6095 1 763 . 1 1 71 71 LYS CE C 13 40.000 0.1 . 1 . . . . . . . . 6095 1 764 . 1 1 71 71 LYS HE3 H 1 2.930 0.02 . 2 . . . . . . . . 6095 1 765 . 1 1 72 72 ILE N N 15 118.660 0.1 . 1 . . . . . . . . 6095 1 766 . 1 1 72 72 ILE H H 1 8.310 0.02 . 1 . . . . . . . . 6095 1 767 . 1 1 72 72 ILE CA C 13 63.640 0.1 . 1 . . . . . . . . 6095 1 768 . 1 1 72 72 ILE HA H 1 3.504 0.02 . 1 . . . . . . . . 6095 1 769 . 1 1 72 72 ILE CB C 13 35.598 0.1 . 1 . . . . . . . . 6095 1 770 . 1 1 72 72 ILE HB H 1 1.969 0.02 . 1 . . . . . . . . 6095 1 771 . 1 1 72 72 ILE CG2 C 13 17.057 0.1 . 2 . . . . . . . . 6095 1 772 . 1 1 72 72 ILE HG21 H 1 0.804 0.02 . 4 . . . . . . . . 6095 1 773 . 1 1 72 72 ILE HG22 H 1 0.804 0.02 . 4 . . . . . . . . 6095 1 774 . 1 1 72 72 ILE HG23 H 1 0.804 0.02 . 4 . . . . . . . . 6095 1 775 . 1 1 72 72 ILE CG1 C 13 27.048 0.1 . 2 . . . . . . . . 6095 1 776 . 1 1 72 72 ILE HG12 H 1 1.865 0.02 . 9 . . . . . . . . 6095 1 777 . 1 1 72 72 ILE HG13 H 1 0.968 0.02 . 9 . . . . . . . . 6095 1 778 . 1 1 72 72 ILE CD1 C 13 12.000 0.1 . 1 . . . . . . . . 6095 1 779 . 1 1 72 72 ILE HD11 H 1 0.820 0.02 . 1 . . . . . . . . 6095 1 780 . 1 1 72 72 ILE HD12 H 1 0.820 0.02 . 1 . . . . . . . . 6095 1 781 . 1 1 72 72 ILE HD13 H 1 0.820 0.02 . 1 . . . . . . . . 6095 1 782 . 1 1 73 73 TYR N N 15 119.778 0.1 . 1 . . . . . . . . 6095 1 783 . 1 1 73 73 TYR H H 1 8.304 0.02 . 1 . . . . . . . . 6095 1 784 . 1 1 73 73 TYR CA C 13 59.900 0.1 . 1 . . . . . . . . 6095 1 785 . 1 1 73 73 TYR HA H 1 3.975 0.02 . 1 . . . . . . . . 6095 1 786 . 1 1 73 73 TYR CB C 13 36.900 0.1 . 1 . . . . . . . . 6095 1 787 . 1 1 73 73 TYR HB2 H 1 3.145 0.02 . 2 . . . . . . . . 6095 1 788 . 1 1 73 73 TYR HB3 H 1 2.855 0.02 . 2 . . . . . . . . 6095 1 789 . 1 1 73 73 TYR CD1 C 13 131.194 0.1 . 3 . . . . . . . . 6095 1 790 . 1 1 73 73 TYR HD1 H 1 7.050 0.02 . 3 . . . . . . . . 6095 1 791 . 1 1 73 73 TYR CE1 C 13 115.590 0.1 . 3 . . . . . . . . 6095 1 792 . 1 1 73 73 TYR HE1 H 1 6.786 0.02 . 3 . . . . . . . . 6095 1 793 . 1 1 74 74 LYS N N 15 118.230 0.1 . 1 . . . . . . . . 6095 1 794 . 1 1 74 74 LYS H H 1 8.007 0.02 . 1 . . . . . . . . 6095 1 795 . 1 1 74 74 LYS CA C 13 57.900 0.1 . 1 . . . . . . . . 6095 1 796 . 1 1 74 74 LYS HA H 1 3.773 0.02 . 1 . . . . . . . . 6095 1 797 . 1 1 74 74 LYS CB C 13 30.950 0.1 . 1 . . . . . . . . 6095 1 798 . 1 1 74 74 LYS HB2 H 1 2.070 0.02 . 2 . . . . . . . . 6095 1 799 . 1 1 74 74 LYS HB3 H 1 2.015 0.02 . 2 . . . . . . . . 6095 1 800 . 1 1 74 74 LYS CG C 13 23.580 0.1 . 1 . . . . . . . . 6095 1 801 . 1 1 74 74 LYS HG2 H 1 1.718 0.02 . 2 . . . . . . . . 6095 1 802 . 1 1 74 74 LYS HG3 H 1 1.480 0.02 . 2 . . . . . . . . 6095 1 803 . 1 1 74 74 LYS CD C 13 27.750 0.1 . 1 . . . . . . . . 6095 1 804 . 1 1 74 74 LYS HD3 H 1 1.720 0.02 . 2 . . . . . . . . 6095 1 805 . 1 1 74 74 LYS CE C 13 40.100 0.1 . 1 . . . . . . . . 6095 1 806 . 1 1 74 74 LYS HE3 H 1 3.010 0.02 . 2 . . . . . . . . 6095 1 807 . 1 1 75 75 ILE N N 15 120.310 0.1 . 1 . . . . . . . . 6095 1 808 . 1 1 75 75 ILE H H 1 8.269 0.02 . 1 . . . . . . . . 6095 1 809 . 1 1 75 75 ILE CA C 13 62.900 0.1 . 1 . . . . . . . . 6095 1 810 . 1 1 75 75 ILE HA H 1 3.769 0.02 . 1 . . . . . . . . 6095 1 811 . 1 1 75 75 ILE CB C 13 36.300 0.1 . 1 . . . . . . . . 6095 1 812 . 1 1 75 75 ILE HB H 1 1.893 0.02 . 1 . . . . . . . . 6095 1 813 . 1 1 75 75 ILE CG2 C 13 15.875 0.1 . 2 . . . . . . . . 6095 1 814 . 1 1 75 75 ILE HG21 H 1 0.907 0.02 . 4 . . . . . . . . 6095 1 815 . 1 1 75 75 ILE HG22 H 1 0.907 0.02 . 4 . . . . . . . . 6095 1 816 . 1 1 75 75 ILE HG23 H 1 0.907 0.02 . 4 . . . . . . . . 6095 1 817 . 1 1 75 75 ILE CG1 C 13 26.871 0.1 . 2 . . . . . . . . 6095 1 818 . 1 1 75 75 ILE HG12 H 1 1.830 0.02 . 9 . . . . . . . . 6095 1 819 . 1 1 75 75 ILE HG13 H 1 1.181 0.02 . 9 . . . . . . . . 6095 1 820 . 1 1 75 75 ILE CD1 C 13 12.100 0.1 . 1 . . . . . . . . 6095 1 821 . 1 1 75 75 ILE HD11 H 1 0.830 0.02 . 1 . . . . . . . . 6095 1 822 . 1 1 75 75 ILE HD12 H 1 0.830 0.02 . 1 . . . . . . . . 6095 1 823 . 1 1 75 75 ILE HD13 H 1 0.830 0.02 . 1 . . . . . . . . 6095 1 824 . 1 1 76 76 GLN N N 15 118.581 0.1 . 1 . . . . . . . . 6095 1 825 . 1 1 76 76 GLN H H 1 8.685 0.02 . 1 . . . . . . . . 6095 1 826 . 1 1 76 76 GLN CA C 13 57.850 0.1 . 1 . . . . . . . . 6095 1 827 . 1 1 76 76 GLN HA H 1 3.865 0.02 . 1 . . . . . . . . 6095 1 828 . 1 1 76 76 GLN CB C 13 25.900 0.1 . 1 . . . . . . . . 6095 1 829 . 1 1 76 76 GLN HB2 H 1 2.170 0.02 . 2 . . . . . . . . 6095 1 830 . 1 1 76 76 GLN HB3 H 1 1.870 0.02 . 2 . . . . . . . . 6095 1 831 . 1 1 76 76 GLN CG C 13 32.452 0.1 . 1 . . . . . . . . 6095 1 832 . 1 1 76 76 GLN HG2 H 1 2.680 0.02 . 2 . . . . . . . . 6095 1 833 . 1 1 76 76 GLN HG3 H 1 2.288 0.02 . 2 . . . . . . . . 6095 1 834 . 1 1 76 76 GLN NE2 N 15 109.351 0.1 . 1 . . . . . . . . 6095 1 835 . 1 1 76 76 GLN HE21 H 1 6.561 0.02 . 2 . . . . . . . . 6095 1 836 . 1 1 76 76 GLN HE22 H 1 7.301 0.02 . 2 . . . . . . . . 6095 1 837 . 1 1 77 77 LYS N N 15 119.730 0.1 . 1 . . . . . . . . 6095 1 838 . 1 1 77 77 LYS H H 1 8.132 0.02 . 1 . . . . . . . . 6095 1 839 . 1 1 77 77 LYS CA C 13 56.300 0.1 . 1 . . . . . . . . 6095 1 840 . 1 1 77 77 LYS HA H 1 3.935 0.02 . 1 . . . . . . . . 6095 1 841 . 1 1 77 77 LYS CB C 13 29.470 0.1 . 1 . . . . . . . . 6095 1 842 . 1 1 77 77 LYS HB2 H 1 1.710 0.02 . 2 . . . . . . . . 6095 1 843 . 1 1 77 77 LYS HB3 H 1 1.535 0.02 . 2 . . . . . . . . 6095 1 844 . 1 1 77 77 LYS CG C 13 22.000 0.1 . 1 . . . . . . . . 6095 1 845 . 1 1 77 77 LYS HG2 H 1 1.209 0.02 . 2 . . . . . . . . 6095 1 846 . 1 1 77 77 LYS HG3 H 1 1.172 0.02 . 2 . . . . . . . . 6095 1 847 . 1 1 77 77 LYS CD C 13 26.350 0.1 . 1 . . . . . . . . 6095 1 848 . 1 1 77 77 LYS HD2 H 1 1.570 0.02 . 2 . . . . . . . . 6095 1 849 . 1 1 77 77 LYS HD3 H 1 1.510 0.02 . 2 . . . . . . . . 6095 1 850 . 1 1 77 77 LYS CE C 13 39.800 0.1 . 1 . . . . . . . . 6095 1 851 . 1 1 77 77 LYS HE2 H 1 2.950 0.02 . 2 . . . . . . . . 6095 1 852 . 1 1 77 77 LYS HE3 H 1 2.860 0.02 . 2 . . . . . . . . 6095 1 853 . 1 1 78 78 GLU N N 15 120.226 0.1 . 1 . . . . . . . . 6095 1 854 . 1 1 78 78 GLU H H 1 7.934 0.02 . 1 . . . . . . . . 6095 1 855 . 1 1 78 78 GLU CA C 13 57.500 0.1 . 1 . . . . . . . . 6095 1 856 . 1 1 78 78 GLU HA H 1 4.045 0.02 . 1 . . . . . . . . 6095 1 857 . 1 1 78 78 GLU CB C 13 27.350 0.1 . 1 . . . . . . . . 6095 1 858 . 1 1 78 78 GLU HB2 H 1 2.200 0.02 . 2 . . . . . . . . 6095 1 859 . 1 1 78 78 GLU HB3 H 1 2.070 0.02 . 2 . . . . . . . . 6095 1 860 . 1 1 78 78 GLU CG C 13 34.400 0.1 . 1 . . . . . . . . 6095 1 861 . 1 1 78 78 GLU HG2 H 1 2.460 0.02 . 2 . . . . . . . . 6095 1 862 . 1 1 78 78 GLU HG3 H 1 2.220 0.02 . 2 . . . . . . . . 6095 1 863 . 1 1 79 79 LEU N N 15 119.571 0.1 . 1 . . . . . . . . 6095 1 864 . 1 1 79 79 LEU H H 1 8.231 0.02 . 1 . . . . . . . . 6095 1 865 . 1 1 79 79 LEU CA C 13 55.700 0.1 . 1 . . . . . . . . 6095 1 866 . 1 1 79 79 LEU HA H 1 4.040 0.02 . 1 . . . . . . . . 6095 1 867 . 1 1 79 79 LEU CB C 13 39.700 0.1 . 1 . . . . . . . . 6095 1 868 . 1 1 79 79 LEU HB2 H 1 1.890 0.02 . 2 . . . . . . . . 6095 1 869 . 1 1 79 79 LEU HB3 H 1 1.520 0.02 . 2 . . . . . . . . 6095 1 870 . 1 1 79 79 LEU CG C 13 24.900 0.1 . 1 . . . . . . . . 6095 1 871 . 1 1 79 79 LEU HG H 1 1.831 0.02 . 1 . . . . . . . . 6095 1 872 . 1 1 79 79 LEU CD1 C 13 21.250 0.1 . 2 . . . . . . . . 6095 1 873 . 1 1 79 79 LEU HD11 H 1 0.847 0.02 . 4 . . . . . . . . 6095 1 874 . 1 1 79 79 LEU HD12 H 1 0.847 0.02 . 4 . . . . . . . . 6095 1 875 . 1 1 79 79 LEU HD13 H 1 0.847 0.02 . 4 . . . . . . . . 6095 1 876 . 1 1 79 79 LEU CD2 C 13 23.750 0.1 . 2 . . . . . . . . 6095 1 877 . 1 1 79 79 LEU HD21 H 1 0.860 0.02 . 4 . . . . . . . . 6095 1 878 . 1 1 79 79 LEU HD22 H 1 0.860 0.02 . 4 . . . . . . . . 6095 1 879 . 1 1 79 79 LEU HD23 H 1 0.860 0.02 . 4 . . . . . . . . 6095 1 880 . 1 1 80 80 GLU N N 15 119.884 0.1 . 1 . . . . . . . . 6095 1 881 . 1 1 80 80 GLU H H 1 7.940 0.02 . 1 . . . . . . . . 6095 1 882 . 1 1 80 80 GLU HA H 1 4.020 0.02 . 1 . . . . . . . . 6095 1 883 . 1 1 80 80 GLU HB2 H 1 2.120 0.02 . 2 . . . . . . . . 6095 1 884 . 1 1 80 80 GLU HB3 H 1 2.244 0.02 . 2 . . . . . . . . 6095 1 885 . 1 1 80 80 GLU HG3 H 1 2.375 0.02 . 2 . . . . . . . . 6095 1 886 . 1 1 81 81 GLU N N 15 118.938 0.1 . 1 . . . . . . . . 6095 1 887 . 1 1 81 81 GLU H H 1 8.001 0.02 . 1 . . . . . . . . 6095 1 888 . 1 1 81 81 GLU CA C 13 56.700 0.1 . 1 . . . . . . . . 6095 1 889 . 1 1 81 81 GLU HA H 1 4.045 0.02 . 1 . . . . . . . . 6095 1 890 . 1 1 81 81 GLU CB C 13 27.500 0.1 . 1 . . . . . . . . 6095 1 891 . 1 1 81 81 GLU HB2 H 1 2.130 0.02 . 2 . . . . . . . . 6095 1 892 . 1 1 81 81 GLU HB3 H 1 2.090 0.02 . 2 . . . . . . . . 6095 1 893 . 1 1 81 81 GLU CG C 13 34.250 0.1 . 1 . . . . . . . . 6095 1 894 . 1 1 81 81 GLU HG2 H 1 2.422 0.02 . 2 . . . . . . . . 6095 1 895 . 1 1 81 81 GLU HG3 H 1 2.288 0.02 . 2 . . . . . . . . 6095 1 896 . 1 1 82 82 LYS N N 15 119.157 0.1 . 1 . . . . . . . . 6095 1 897 . 1 1 82 82 LYS H H 1 7.900 0.02 . 1 . . . . . . . . 6095 1 898 . 1 1 82 82 LYS CA C 13 56.000 0.1 . 1 . . . . . . . . 6095 1 899 . 1 1 82 82 LYS HA H 1 4.140 0.02 . 1 . . . . . . . . 6095 1 900 . 1 1 82 82 LYS CB C 13 30.350 0.1 . 1 . . . . . . . . 6095 1 901 . 1 1 82 82 LYS HB3 H 1 1.915 0.02 . 2 . . . . . . . . 6095 1 902 . 1 1 82 82 LYS CG C 13 23.250 0.1 . 1 . . . . . . . . 6095 1 903 . 1 1 82 82 LYS HG2 H 1 1.580 0.02 . 2 . . . . . . . . 6095 1 904 . 1 1 82 82 LYS HG3 H 1 1.485 0.02 . 2 . . . . . . . . 6095 1 905 . 1 1 82 82 LYS CD C 13 26.900 0.1 . 1 . . . . . . . . 6095 1 906 . 1 1 82 82 LYS HD3 H 1 1.660 0.02 . 2 . . . . . . . . 6095 1 907 . 1 1 82 82 LYS CE C 13 40.000 0.1 . 1 . . . . . . . . 6095 1 908 . 1 1 82 82 LYS HE3 H 1 2.970 0.02 . 2 . . . . . . . . 6095 1 909 . 1 1 83 83 ARG N N 15 118.960 0.1 . 1 . . . . . . . . 6095 1 910 . 1 1 83 83 ARG H H 1 8.260 0.02 . 1 . . . . . . . . 6095 1 911 . 1 1 83 83 ARG CA C 13 56.000 0.1 . 1 . . . . . . . . 6095 1 912 . 1 1 83 83 ARG HA H 1 4.160 0.02 . 1 . . . . . . . . 6095 1 913 . 1 1 83 83 ARG CB C 13 28.400 0.1 . 1 . . . . . . . . 6095 1 914 . 1 1 83 83 ARG HB3 H 1 1.900 0.02 . 2 . . . . . . . . 6095 1 915 . 1 1 83 83 ARG CG C 13 27.100 0.1 . 1 . . . . . . . . 6095 1 916 . 1 1 83 83 ARG HG3 H 1 1.660 0.02 . 2 . . . . . . . . 6095 1 917 . 1 1 83 83 ARG CD C 13 41.300 0.1 . 1 . . . . . . . . 6095 1 918 . 1 1 83 83 ARG HD3 H 1 3.210 0.02 . 2 . . . . . . . . 6095 1 919 . 1 1 84 84 ARG N N 15 119.040 0.1 . 1 . . . . . . . . 6095 1 920 . 1 1 84 84 ARG H H 1 7.891 0.02 . 1 . . . . . . . . 6095 1 921 . 1 1 84 84 ARG CA C 13 54.900 0.1 . 1 . . . . . . . . 6095 1 922 . 1 1 84 84 ARG HA H 1 4.250 0.02 . 1 . . . . . . . . 6095 1 923 . 1 1 84 84 ARG CB C 13 28.600 0.1 . 1 . . . . . . . . 6095 1 924 . 1 1 84 84 ARG HB2 H 1 1.915 0.02 . 2 . . . . . . . . 6095 1 925 . 1 1 84 84 ARG HB3 H 1 1.840 0.02 . 2 . . . . . . . . 6095 1 926 . 1 1 84 84 ARG CG C 13 25.500 0.1 . 1 . . . . . . . . 6095 1 927 . 1 1 84 84 ARG HG2 H 1 1.740 0.02 . 2 . . . . . . . . 6095 1 928 . 1 1 84 84 ARG HG3 H 1 1.660 0.02 . 2 . . . . . . . . 6095 1 929 . 1 1 84 84 ARG CD C 13 41.600 0.1 . 1 . . . . . . . . 6095 1 930 . 1 1 84 84 ARG HD3 H 1 3.205 0.02 . 2 . . . . . . . . 6095 1 931 . 1 1 84 84 ARG NE N 15 84.450 0.1 . 1 . . . . . . . . 6095 1 932 . 1 1 84 84 ARG HE H 1 7.364 0.02 . 1 . . . . . . . . 6095 1 933 . 1 1 85 85 SER N N 15 114.896 0.1 . 1 . . . . . . . . 6095 1 934 . 1 1 85 85 SER H H 1 7.986 0.02 . 1 . . . . . . . . 6095 1 935 . 1 1 85 85 SER CA C 13 56.967 0.1 . 1 . . . . . . . . 6095 1 936 . 1 1 85 85 SER HA H 1 4.407 0.02 . 1 . . . . . . . . 6095 1 937 . 1 1 85 85 SER CB C 13 61.891 0.1 . 1 . . . . . . . . 6095 1 938 . 1 1 85 85 SER HB3 H 1 3.917 0.02 . 2 . . . . . . . . 6095 1 939 . 1 1 86 86 ARG N N 15 122.115 0.1 . 1 . . . . . . . . 6095 1 940 . 1 1 86 86 ARG H H 1 8.020 0.02 . 1 . . . . . . . . 6095 1 941 . 1 1 86 86 ARG CA C 13 54.000 0.1 . 1 . . . . . . . . 6095 1 942 . 1 1 86 86 ARG HA H 1 4.360 0.02 . 1 . . . . . . . . 6095 1 943 . 1 1 86 86 ARG CB C 13 28.600 0.1 . 1 . . . . . . . . 6095 1 944 . 1 1 86 86 ARG HB2 H 1 1.930 0.02 . 2 . . . . . . . . 6095 1 945 . 1 1 86 86 ARG HB3 H 1 1.790 0.02 . 2 . . . . . . . . 6095 1 946 . 1 1 86 86 ARG CG C 13 25.200 0.1 . 1 . . . . . . . . 6095 1 947 . 1 1 86 86 ARG HG3 H 1 1.650 0.02 . 2 . . . . . . . . 6095 1 948 . 1 1 86 86 ARG CD C 13 41.400 0.1 . 1 . . . . . . . . 6095 1 949 . 1 1 86 86 ARG HD3 H 1 3.180 0.02 . 2 . . . . . . . . 6095 1 950 . 1 1 86 86 ARG NE N 15 84.745 0.1 . 1 . . . . . . . . 6095 1 951 . 1 1 86 86 ARG HE H 1 7.191 0.02 . 1 . . . . . . . . 6095 1 952 . 1 1 87 87 LEU N N 15 128.142 0.1 . 1 . . . . . . . . 6095 1 953 . 1 1 87 87 LEU H H 1 7.755 0.02 . 1 . . . . . . . . 6095 1 954 . 1 1 87 87 LEU CA C 13 54.700 0.1 . 1 . . . . . . . . 6095 1 955 . 1 1 87 87 LEU HA H 1 4.157 0.02 . 1 . . . . . . . . 6095 1 956 . 1 1 87 87 LEU CB C 13 41.364 0.1 . 1 . . . . . . . . 6095 1 957 . 1 1 87 87 LEU HB3 H 1 1.563 0.02 . 2 . . . . . . . . 6095 1 958 . 1 1 87 87 LEU CG C 13 25.250 0.1 . 1 . . . . . . . . 6095 1 959 . 1 1 87 87 LEU HG H 1 1.575 0.02 . 1 . . . . . . . . 6095 1 960 . 1 1 87 87 LEU CD1 C 13 23.500 0.1 . 2 . . . . . . . . 6095 1 961 . 1 1 87 87 LEU HD11 H 1 0.860 0.02 . 4 . . . . . . . . 6095 1 962 . 1 1 87 87 LEU HD12 H 1 0.860 0.02 . 4 . . . . . . . . 6095 1 963 . 1 1 87 87 LEU HD13 H 1 0.860 0.02 . 4 . . . . . . . . 6095 1 stop_ loop_ _Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID _Ambiguous_atom_chem_shift.Atom_chem_shift_ID _Ambiguous_atom_chem_shift.Entry_ID _Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID 1 12 6095 1 1 11 6095 1 1 10 6095 1 2 103 6095 1 2 102 6095 1 2 101 6095 1 2 99 6095 1 2 98 6095 1 2 97 6095 1 3 149 6095 1 3 148 6095 1 3 147 6095 1 3 145 6095 1 3 144 6095 1 3 143 6095 1 4 206 6095 1 4 205 6095 1 4 204 6095 1 4 202 6095 1 4 201 6095 1 4 200 6095 1 5 238 6095 1 5 237 6095 1 5 236 6095 1 6 252 6095 1 6 251 6095 1 6 250 6095 1 6 248 6095 1 6 247 6095 1 6 246 6095 1 7 282 6095 1 7 281 6095 1 7 280 6095 1 8 380 6095 1 8 379 6095 1 8 378 6095 1 8 376 6095 1 8 375 6095 1 8 374 6095 1 9 467 6095 1 9 466 6095 1 9 465 6095 1 9 463 6095 1 9 462 6095 1 9 461 6095 1 10 481 6095 1 10 480 6095 1 10 479 6095 1 10 477 6095 1 10 476 6095 1 10 475 6095 1 11 714 6095 1 11 713 6095 1 11 712 6095 1 11 710 6095 1 11 709 6095 1 11 708 6095 1 12 731 6095 1 12 730 6095 1 12 729 6095 1 12 727 6095 1 12 726 6095 1 12 725 6095 1 13 774 6095 1 13 773 6095 1 13 772 6095 1 14 816 6095 1 14 815 6095 1 14 814 6095 1 15 879 6095 1 15 878 6095 1 15 877 6095 1 15 875 6095 1 15 874 6095 1 15 873 6095 1 16 963 6095 1 16 962 6095 1 16 961 6095 1 stop_ save_ save_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode 2 _Assigned_chem_shift_list.Entry_ID 6095 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $cond_1 _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 . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 6095 2 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 . 2 2 1 1 LYS CA C 13 55.701 . . 1 . . . . . . . . 6095 2 2 . 2 2 1 1 LYS HA H 1 3.987 . . 1 . . . . . . . . 6095 2 3 . 2 2 1 1 LYS CB C 13 33.100 . . 1 . . . . . . . . 6095 2 4 . 2 2 1 1 LYS HB3 H 1 1.866 . . . . . . . . . . . 6095 2 5 . 2 2 1 1 LYS CG C 13 24.092 . . 1 . . . . . . . . 6095 2 6 . 2 2 1 1 LYS HG2 H 1 1.470 . . . . . . . . . . . 6095 2 7 . 2 2 1 1 LYS HG3 H 1 1.414 . . . . . . . . . . . 6095 2 8 . 2 2 1 1 LYS CD C 13 29.070 . . 1 . . . . . . . . 6095 2 9 . 2 2 1 1 LYS HD3 H 1 1.688 . . . . . . . . . . . 6095 2 10 . 2 2 1 1 LYS CE C 13 41.550 . . 1 . . . . . . . . 6095 2 11 . 2 2 1 1 LYS HE3 H 1 2.940 . . . . . . . . . . . 6095 2 12 . 2 2 2 2 GLU CA C 13 56.832 . . 1 . . . . . . . . 6095 2 13 . 2 2 2 2 GLU HA H 1 4.280 . . 1 . . . . . . . . 6095 2 14 . 2 2 2 2 GLU CB C 13 29.700 . . 1 . . . . . . . . 6095 2 15 . 2 2 2 2 GLU HB2 H 1 2.040 . . . . . . . . . . . 6095 2 16 . 2 2 2 2 GLU HB3 H 1 1.918 . . . . . . . . . . . 6095 2 17 . 2 2 2 2 GLU CG C 13 36.140 . . 1 . . . . . . . . 6095 2 18 . 2 2 2 2 GLU HG3 H 1 2.305 . . . . . . . . . . . 6095 2 19 . 2 2 3 3 LYS N N 15 125.105 . . 1 . . . . . . . . 6095 2 20 . 2 2 3 3 LYS H H 1 8.761 . . 1 . . . . . . . . 6095 2 21 . 2 2 3 3 LYS CA C 13 58.400 . . 1 . . . . . . . . 6095 2 22 . 2 2 3 3 LYS HA H 1 4.143 . . 1 . . . . . . . . 6095 2 23 . 2 2 3 3 LYS CB C 13 32.700 . . 1 . . . . . . . . 6095 2 24 . 2 2 3 3 LYS HB3 H 1 1.860 . . . . . . . . . . . 6095 2 25 . 2 2 3 3 LYS CG C 13 24.800 . . 1 . . . . . . . . 6095 2 26 . 2 2 3 3 LYS HG2 H 1 1.490 . . . . . . . . . . . 6095 2 27 . 2 2 3 3 LYS HG3 H 1 1.440 . . . . . . . . . . . 6095 2 28 . 2 2 3 3 LYS CD C 13 29.200 . . 1 . . . . . . . . 6095 2 29 . 2 2 3 3 LYS HD3 H 1 1.700 . . . . . . . . . . . 6095 2 30 . 2 2 3 3 LYS CE C 13 41.900 . . 1 . . . . . . . . 6095 2 31 . 2 2 3 3 LYS HE3 H 1 3.014 . . . . . . . . . . . 6095 2 32 . 2 2 4 4 ARG N N 15 119.324 . . 1 . . . . . . . . 6095 2 33 . 2 2 4 4 ARG H H 1 8.582 . . 1 . . . . . . . . 6095 2 34 . 2 2 4 4 ARG CA C 13 57.350 . . 1 . . . . . . . . 6095 2 35 . 2 2 4 4 ARG HA H 1 4.230 . . 1 . . . . . . . . 6095 2 36 . 2 2 4 4 ARG CB C 13 30.129 . . 1 . . . . . . . . 6095 2 37 . 2 2 4 4 ARG HB2 H 1 1.890 . . . . . . . . . . . 6095 2 38 . 2 2 4 4 ARG HB3 H 1 1.840 . . . . . . . . . . . 6095 2 39 . 2 2 4 4 ARG CG C 13 27.186 . . 1 . . . . . . . . 6095 2 40 . 2 2 4 4 ARG HG2 H 1 1.897 . . . . . . . . . . . 6095 2 41 . 2 2 4 4 ARG HG3 H 1 1.710 . . . . . . . . . . . 6095 2 42 . 2 2 4 4 ARG CD C 13 43.012 . . 1 . . . . . . . . 6095 2 43 . 2 2 4 4 ARG HD2 H 1 3.466 . . . . . . . . . . . 6095 2 44 . 2 2 4 4 ARG HD3 H 1 3.240 . . . . . . . . . . . 6095 2 45 . 2 2 5 5 ILE N N 15 118.680 . . 1 . . . . . . . . 6095 2 46 . 2 2 5 5 ILE H H 1 7.531 . . 1 . . . . . . . . 6095 2 47 . 2 2 5 5 ILE CA C 13 64.660 . . 1 . . . . . . . . 6095 2 48 . 2 2 5 5 ILE HA H 1 3.602 . . 1 . . . . . . . . 6095 2 49 . 2 2 5 5 ILE CB C 13 36.826 . . 1 . . . . . . . . 6095 2 50 . 2 2 5 5 ILE HB H 1 1.812 . . 1 . . . . . . . . 6095 2 51 . 2 2 5 5 ILE CG2 C 13 17.441 . . . . . . . . . . . 6095 2 52 . 2 2 5 5 ILE HG21 H 1 0.811 . . . . . . . . . . . 6095 2 53 . 2 2 5 5 ILE HG22 H 1 0.811 . . . . . . . . . . . 6095 2 54 . 2 2 5 5 ILE HG23 H 1 0.811 . . . . . . . . . . . 6095 2 55 . 2 2 5 5 ILE CG1 C 13 29.140 . . . . . . . . . . . 6095 2 56 . 2 2 5 5 ILE HG12 H 1 1.181 . . . . . . . . . . . 6095 2 57 . 2 2 5 5 ILE HG13 H 1 0.790 . . . . . . . . . . . 6095 2 58 . 2 2 5 5 ILE CD1 C 13 12.479 . . 1 . . . . . . . . 6095 2 59 . 2 2 5 5 ILE HD11 H 1 0.629 . . . . . . . . . . . 6095 2 60 . 2 2 5 5 ILE HD12 H 1 0.629 . . . . . . . . . . . 6095 2 61 . 2 2 5 5 ILE HD13 H 1 0.629 . . . . . . . . . . . 6095 2 62 . 2 2 6 6 LYS N N 15 119.986 . . 1 . . . . . . . . 6095 2 63 . 2 2 6 6 LYS H H 1 7.703 . . 1 . . . . . . . . 6095 2 64 . 2 2 6 6 LYS CA C 13 58.627 . . 1 . . . . . . . . 6095 2 65 . 2 2 6 6 LYS HA H 1 4.117 . . 1 . . . . . . . . 6095 2 66 . 2 2 6 6 LYS CB C 13 31.635 . . 1 . . . . . . . . 6095 2 67 . 2 2 6 6 LYS HB2 H 1 1.939 . . . . . . . . . . . 6095 2 68 . 2 2 6 6 LYS HB3 H 1 1.844 . . . . . . . . . . . 6095 2 69 . 2 2 6 6 LYS CG C 13 24.700 . . 1 . . . . . . . . 6095 2 70 . 2 2 6 6 LYS HG3 H 1 1.475 . . . . . . . . . . . 6095 2 71 . 2 2 6 6 LYS CD C 13 28.500 . . 1 . . . . . . . . 6095 2 72 . 2 2 6 6 LYS HD2 H 1 1.726 . . . . . . . . . . . 6095 2 73 . 2 2 6 6 LYS HD3 H 1 1.680 . . . . . . . . . . . 6095 2 74 . 2 2 6 6 LYS CE C 13 41.800 . . 1 . . . . . . . . 6095 2 75 . 2 2 6 6 LYS HE3 H 1 2.940 . . . . . . . . . . . 6095 2 76 . 2 2 7 7 GLU N N 15 117.730 . . 1 . . . . . . . . 6095 2 77 . 2 2 7 7 GLU H H 1 7.936 . . 1 . . . . . . . . 6095 2 78 . 2 2 7 7 GLU CA C 13 59.433 . . 1 . . . . . . . . 6095 2 79 . 2 2 7 7 GLU HA H 1 3.975 . . 1 . . . . . . . . 6095 2 80 . 2 2 7 7 GLU CB C 13 29.500 . . 1 . . . . . . . . 6095 2 81 . 2 2 7 7 GLU HB2 H 1 2.236 . . . . . . . . . . . 6095 2 82 . 2 2 7 7 GLU HB3 H 1 2.091 . . . . . . . . . . . 6095 2 83 . 2 2 7 7 GLU CG C 13 36.500 . . 1 . . . . . . . . 6095 2 84 . 2 2 7 7 GLU HG2 H 1 2.430 . . . . . . . . . . . 6095 2 85 . 2 2 7 7 GLU HG3 H 1 2.250 . . . . . . . . . . . 6095 2 86 . 2 2 8 8 LEU N N 15 121.253 . . 1 . . . . . . . . 6095 2 87 . 2 2 8 8 LEU H H 1 8.048 . . 1 . . . . . . . . 6095 2 88 . 2 2 8 8 LEU CA C 13 57.672 . . 1 . . . . . . . . 6095 2 89 . 2 2 8 8 LEU HA H 1 4.134 . . 1 . . . . . . . . 6095 2 90 . 2 2 8 8 LEU CB C 13 43.151 . . 1 . . . . . . . . 6095 2 91 . 2 2 8 8 LEU HB2 H 1 2.186 . . . . . . . . . . . 6095 2 92 . 2 2 8 8 LEU HB3 H 1 1.255 . . . . . . . . . . . 6095 2 93 . 2 2 8 8 LEU CG C 13 27.400 . . 1 . . . . . . . . 6095 2 94 . 2 2 8 8 LEU HG H 1 1.790 . . 1 . . . . . . . . 6095 2 95 . 2 2 8 8 LEU CD1 C 13 23.400 . . . . . . . . . . . 6095 2 96 . 2 2 8 8 LEU HD11 H 1 0.927 . . . . . . . . . . . 6095 2 97 . 2 2 8 8 LEU HD12 H 1 0.927 . . . . . . . . . . . 6095 2 98 . 2 2 8 8 LEU HD13 H 1 0.927 . . . . . . . . . . . 6095 2 99 . 2 2 8 8 LEU CD2 C 13 25.780 . . . . . . . . . . . 6095 2 100 . 2 2 8 8 LEU HD21 H 1 0.998 . . . . . . . . . . . 6095 2 101 . 2 2 8 8 LEU HD22 H 1 0.998 . . . . . . . . . . . 6095 2 102 . 2 2 8 8 LEU HD23 H 1 0.998 . . . . . . . . . . . 6095 2 103 . 2 2 9 9 GLU N N 15 120.478 . . 1 . . . . . . . . 6095 2 104 . 2 2 9 9 GLU H H 1 8.576 . . 1 . . . . . . . . 6095 2 105 . 2 2 9 9 GLU CA C 13 60.740 . . 1 . . . . . . . . 6095 2 106 . 2 2 9 9 GLU HA H 1 3.704 . . 1 . . . . . . . . 6095 2 107 . 2 2 9 9 GLU CB C 13 29.689 . . 1 . . . . . . . . 6095 2 108 . 2 2 9 9 GLU HB2 H 1 2.314 . . . . . . . . . . . 6095 2 109 . 2 2 9 9 GLU HB3 H 1 2.010 . . . . . . . . . . . 6095 2 110 . 2 2 9 9 GLU CG C 13 37.222 . . 1 . . . . . . . . 6095 2 111 . 2 2 9 9 GLU HG2 H 1 2.484 . . . . . . . . . . . 6095 2 112 . 2 2 9 9 GLU HG3 H 1 2.109 . . . . . . . . . . . 6095 2 113 . 2 2 10 10 LEU N N 15 118.323 . . 1 . . . . . . . . 6095 2 114 . 2 2 10 10 LEU H H 1 7.853 . . 1 . . . . . . . . 6095 2 115 . 2 2 10 10 LEU CA C 13 57.916 . . 1 . . . . . . . . 6095 2 116 . 2 2 10 10 LEU HA H 1 4.016 . . 1 . . . . . . . . 6095 2 117 . 2 2 10 10 LEU CB C 13 41.507 . . 1 . . . . . . . . 6095 2 118 . 2 2 10 10 LEU HB2 H 1 1.840 . . . . . . . . . . . 6095 2 119 . 2 2 10 10 LEU HB3 H 1 1.575 . . . . . . . . . . . 6095 2 120 . 2 2 10 10 LEU CG C 13 27.036 . . 1 . . . . . . . . 6095 2 121 . 2 2 10 10 LEU HG H 1 1.780 . . 1 . . . . . . . . 6095 2 122 . 2 2 10 10 LEU CD1 C 13 23.325 . . . . . . . . . . . 6095 2 123 . 2 2 10 10 LEU HD11 H 1 0.880 . . . . . . . . . . . 6095 2 124 . 2 2 10 10 LEU HD12 H 1 0.880 . . . . . . . . . . . 6095 2 125 . 2 2 10 10 LEU HD13 H 1 0.880 . . . . . . . . . . . 6095 2 126 . 2 2 10 10 LEU CD2 C 13 24.978 . . . . . . . . . . . 6095 2 127 . 2 2 10 10 LEU HD21 H 1 0.895 . . . . . . . . . . . 6095 2 128 . 2 2 10 10 LEU HD22 H 1 0.895 . . . . . . . . . . . 6095 2 129 . 2 2 10 10 LEU HD23 H 1 0.895 . . . . . . . . . . . 6095 2 130 . 2 2 11 11 LEU N N 15 122.227 . . 1 . . . . . . . . 6095 2 131 . 2 2 11 11 LEU H H 1 7.923 . . 1 . . . . . . . . 6095 2 132 . 2 2 11 11 LEU CA C 13 58.016 . . 1 . . . . . . . . 6095 2 133 . 2 2 11 11 LEU HA H 1 4.111 . . 1 . . . . . . . . 6095 2 134 . 2 2 11 11 LEU CB C 13 42.006 . . 1 . . . . . . . . 6095 2 135 . 2 2 11 11 LEU HB2 H 1 1.969 . . . . . . . . . . . 6095 2 136 . 2 2 11 11 LEU HB3 H 1 1.825 . . . . . . . . . . . 6095 2 137 . 2 2 11 11 LEU CG C 13 27.050 . . 1 . . . . . . . . 6095 2 138 . 2 2 11 11 LEU HG H 1 1.608 . . 1 . . . . . . . . 6095 2 139 . 2 2 11 11 LEU CD1 C 13 24.800 . . . . . . . . . . . 6095 2 140 . 2 2 11 11 LEU HD11 H 1 0.910 . . . . . . . . . . . 6095 2 141 . 2 2 11 11 LEU HD12 H 1 0.910 . . . . . . . . . . . 6095 2 142 . 2 2 11 11 LEU HD13 H 1 0.910 . . . . . . . . . . . 6095 2 143 . 2 2 11 11 LEU CD2 C 13 24.500 . . . . . . . . . . . 6095 2 144 . 2 2 11 11 LEU HD21 H 1 0.936 . . . . . . . . . . . 6095 2 145 . 2 2 11 11 LEU HD22 H 1 0.936 . . . . . . . . . . . 6095 2 146 . 2 2 11 11 LEU HD23 H 1 0.936 . . . . . . . . . . . 6095 2 147 . 2 2 12 12 LEU N N 15 119.314 . . 1 . . . . . . . . 6095 2 148 . 2 2 12 12 LEU H H 1 8.299 . . 1 . . . . . . . . 6095 2 149 . 2 2 12 12 LEU CA C 13 57.935 . . 1 . . . . . . . . 6095 2 150 . 2 2 12 12 LEU HA H 1 3.933 . . 1 . . . . . . . . 6095 2 151 . 2 2 12 12 LEU CB C 13 41.655 . . 1 . . . . . . . . 6095 2 152 . 2 2 12 12 LEU HB2 H 1 2.060 . . . . . . . . . . . 6095 2 153 . 2 2 12 12 LEU HB3 H 1 1.440 . . . . . . . . . . . 6095 2 154 . 2 2 12 12 LEU CG C 13 26.506 . . 1 . . . . . . . . 6095 2 155 . 2 2 12 12 LEU HG H 1 2.052 . . 1 . . . . . . . . 6095 2 156 . 2 2 12 12 LEU CD1 C 13 22.038 . . . . . . . . . . . 6095 2 157 . 2 2 12 12 LEU HD11 H 1 0.764 . . . . . . . . . . . 6095 2 158 . 2 2 12 12 LEU HD12 H 1 0.764 . . . . . . . . . . . 6095 2 159 . 2 2 12 12 LEU HD13 H 1 0.764 . . . . . . . . . . . 6095 2 160 . 2 2 12 12 LEU CD2 C 13 27.021 . . . . . . . . . . . 6095 2 161 . 2 2 12 12 LEU HD21 H 1 0.920 . . . . . . . . . . . 6095 2 162 . 2 2 12 12 LEU HD22 H 1 0.920 . . . . . . . . . . . 6095 2 163 . 2 2 12 12 LEU HD23 H 1 0.920 . . . . . . . . . . . 6095 2 164 . 2 2 13 13 MET N N 15 119.941 . . 1 . . . . . . . . 6095 2 165 . 2 2 13 13 MET H H 1 8.483 . . 1 . . . . . . . . 6095 2 166 . 2 2 13 13 MET CA C 13 59.082 . . 1 . . . . . . . . 6095 2 167 . 2 2 13 13 MET HA H 1 3.593 . . 1 . . . . . . . . 6095 2 168 . 2 2 13 13 MET CB C 13 32.865 . . 1 . . . . . . . . 6095 2 169 . 2 2 13 13 MET HB2 H 1 1.820 . . . . . . . . . . . 6095 2 170 . 2 2 13 13 MET HB3 H 1 1.745 . . . . . . . . . . . 6095 2 171 . 2 2 13 13 MET CG C 13 31.989 . . 1 . . . . . . . . 6095 2 172 . 2 2 13 13 MET HG3 H 1 2.225 . . . . . . . . . . . 6095 2 173 . 2 2 13 13 MET CE C 13 17.123 . . 1 . . . . . . . . 6095 2 174 . 2 2 13 13 MET HE1 H 1 1.993 . . . . . . . . . . . 6095 2 175 . 2 2 13 13 MET HE2 H 1 1.993 . . . . . . . . . . . 6095 2 176 . 2 2 13 13 MET HE3 H 1 1.993 . . . . . . . . . . . 6095 2 177 . 2 2 14 14 SER N N 15 115.196 . . 1 . . . . . . . . 6095 2 178 . 2 2 14 14 SER H H 1 7.958 . . 1 . . . . . . . . 6095 2 179 . 2 2 14 14 SER CA C 13 61.053 . . 1 . . . . . . . . 6095 2 180 . 2 2 14 14 SER HA H 1 4.314 . . 1 . . . . . . . . 6095 2 181 . 2 2 14 14 SER CB C 13 63.001 . . 1 . . . . . . . . 6095 2 182 . 2 2 14 14 SER HB3 H 1 4.057 . . . . . . . . . . . 6095 2 183 . 2 2 15 15 THR N N 15 118.059 . . 1 . . . . . . . . 6095 2 184 . 2 2 15 15 THR H H 1 7.806 . . 1 . . . . . . . . 6095 2 185 . 2 2 15 15 THR CA C 13 65.312 . . 1 . . . . . . . . 6095 2 186 . 2 2 15 15 THR HA H 1 4.065 . . 1 . . . . . . . . 6095 2 187 . 2 2 15 15 THR CB C 13 68.706 . . 1 . . . . . . . . 6095 2 188 . 2 2 15 15 THR HB H 1 4.213 . . 1 . . . . . . . . 6095 2 189 . 2 2 15 15 THR CG2 C 13 22.614 . . 1 . . . . . . . . 6095 2 190 . 2 2 15 15 THR HG21 H 1 1.317 . . . . . . . . . . . 6095 2 191 . 2 2 15 15 THR HG22 H 1 1.317 . . . . . . . . . . . 6095 2 192 . 2 2 15 15 THR HG23 H 1 1.317 . . . . . . . . . . . 6095 2 193 . 2 2 16 16 GLU N N 15 118.684 . . 1 . . . . . . . . 6095 2 194 . 2 2 16 16 GLU H H 1 7.915 . . 1 . . . . . . . . 6095 2 195 . 2 2 16 16 GLU CA C 13 59.433 . . 1 . . . . . . . . 6095 2 196 . 2 2 16 16 GLU HA H 1 3.975 . . 1 . . . . . . . . 6095 2 197 . 2 2 16 16 GLU CB C 13 29.500 . . 1 . . . . . . . . 6095 2 198 . 2 2 16 16 GLU HB2 H 1 2.236 . . . . . . . . . . . 6095 2 199 . 2 2 16 16 GLU HB3 H 1 2.090 . . . . . . . . . . . 6095 2 200 . 2 2 16 16 GLU CG C 13 36.700 . . 1 . . . . . . . . 6095 2 201 . 2 2 16 16 GLU HG2 H 1 2.695 . . . . . . . . . . . 6095 2 202 . 2 2 16 16 GLU HG3 H 1 2.430 . . . . . . . . . . . 6095 2 203 . 2 2 17 17 ASN N N 15 116.423 . . 1 . . . . . . . . 6095 2 204 . 2 2 17 17 ASN H H 1 7.823 . . 1 . . . . . . . . 6095 2 205 . 2 2 17 17 ASN CA C 13 54.594 . . 1 . . . . . . . . 6095 2 206 . 2 2 17 17 ASN HA H 1 4.650 . . 1 . . . . . . . . 6095 2 207 . 2 2 17 17 ASN CB C 13 38.451 . . 1 . . . . . . . . 6095 2 208 . 2 2 17 17 ASN HB2 H 1 2.895 . . . . . . . . . . . 6095 2 209 . 2 2 17 17 ASN HB3 H 1 2.935 . . . . . . . . . . . 6095 2 210 . 2 2 17 17 ASN ND2 N 15 112.900 . . 1 . . . . . . . . 6095 2 211 . 2 2 17 17 ASN HD21 H 1 7.650 . . . . . . . . . . . 6095 2 212 . 2 2 17 17 ASN HD22 H 1 6.970 . . . . . . . . . . . 6095 2 213 . 2 2 18 18 GLU N N 15 119.930 . . 1 . . . . . . . . 6095 2 214 . 2 2 18 18 GLU H H 1 7.881 . . 1 . . . . . . . . 6095 2 215 . 2 2 18 18 GLU CA C 13 57.395 . . 1 . . . . . . . . 6095 2 216 . 2 2 18 18 GLU HA H 1 4.225 . . 1 . . . . . . . . 6095 2 217 . 2 2 18 18 GLU CB C 13 29.600 . . 1 . . . . . . . . 6095 2 218 . 2 2 18 18 GLU HB3 H 1 2.140 . . . . . . . . . . . 6095 2 219 . 2 2 18 18 GLU CG C 13 36.000 . . 1 . . . . . . . . 6095 2 220 . 2 2 18 18 GLU HG2 H 1 2.380 . . . . . . . . . . . 6095 2 221 . 2 2 19 19 LEU N N 15 119.313 . . 1 . . . . . . . . 6095 2 222 . 2 2 19 19 LEU H H 1 7.595 . . 1 . . . . . . . . 6095 2 223 . 2 2 19 19 LEU CA C 13 55.473 . . 1 . . . . . . . . 6095 2 224 . 2 2 19 19 LEU HA H 1 4.200 . . 1 . . . . . . . . 6095 2 225 . 2 2 19 19 LEU CB C 13 41.565 . . 1 . . . . . . . . 6095 2 226 . 2 2 19 19 LEU HB2 H 1 1.670 . . . . . . . . . . . 6095 2 227 . 2 2 19 19 LEU HB3 H 1 1.610 . . . . . . . . . . . 6095 2 228 . 2 2 19 19 LEU CG C 13 26.722 . . 1 . . . . . . . . 6095 2 229 . 2 2 19 19 LEU HG H 1 1.656 . . 1 . . . . . . . . 6095 2 230 . 2 2 19 19 LEU CD1 C 13 22.500 . . . . . . . . . . . 6095 2 231 . 2 2 19 19 LEU HD11 H 1 0.470 . . . . . . . . . . . 6095 2 232 . 2 2 19 19 LEU HD12 H 1 0.470 . . . . . . . . . . . 6095 2 233 . 2 2 19 19 LEU HD13 H 1 0.470 . . . . . . . . . . . 6095 2 234 . 2 2 19 19 LEU CD2 C 13 25.220 . . . . . . . . . . . 6095 2 235 . 2 2 19 19 LEU HD21 H 1 0.732 . . . . . . . . . . . 6095 2 236 . 2 2 19 19 LEU HD22 H 1 0.732 . . . . . . . . . . . 6095 2 237 . 2 2 19 19 LEU HD23 H 1 0.732 . . . . . . . . . . . 6095 2 238 . 2 2 20 20 LYS N N 15 119.969 . . 1 . . . . . . . . 6095 2 239 . 2 2 20 20 LYS H H 1 7.838 . . 1 . . . . . . . . 6095 2 240 . 2 2 20 20 LYS CA C 13 56.808 . . 1 . . . . . . . . 6095 2 241 . 2 2 20 20 LYS HA H 1 4.300 . . 1 . . . . . . . . 6095 2 242 . 2 2 20 20 LYS CB C 13 32.900 . . 1 . . . . . . . . 6095 2 243 . 2 2 20 20 LYS HB2 H 1 1.920 . . . . . . . . . . . 6095 2 244 . 2 2 20 20 LYS HB3 H 1 1.860 . . . . . . . . . . . 6095 2 245 . 2 2 20 20 LYS CG C 13 24.910 . . 1 . . . . . . . . 6095 2 246 . 2 2 20 20 LYS HG2 H 1 1.551 . . . . . . . . . . . 6095 2 247 . 2 2 20 20 LYS HG3 H 1 1.472 . . . . . . . . . . . 6095 2 248 . 2 2 20 20 LYS CD C 13 29.015 . . 1 . . . . . . . . 6095 2 249 . 2 2 20 20 LYS HD3 H 1 1.725 . . . . . . . . . . . 6095 2 250 . 2 2 20 20 LYS CE C 13 42.000 . . 1 . . . . . . . . 6095 2 251 . 2 2 20 20 LYS HE3 H 1 3.020 . . . . . . . . . . . 6095 2 252 . 2 2 21 21 GLY N N 15 108.729 . . 1 . . . . . . . . 6095 2 253 . 2 2 21 21 GLY H H 1 8.205 . . 1 . . . . . . . . 6095 2 254 . 2 2 21 21 GLY CA C 13 45.384 . . 1 . . . . . . . . 6095 2 255 . 2 2 21 21 GLY HA3 H 1 3.980 . . . . . . . . . . . 6095 2 256 . 2 2 22 22 GLN N N 15 119.656 . . 1 . . . . . . . . 6095 2 257 . 2 2 22 22 GLN H H 1 8.135 . . 1 . . . . . . . . 6095 2 258 . 2 2 22 22 GLN CA C 13 55.800 . . 1 . . . . . . . . 6095 2 259 . 2 2 22 22 GLN HA H 1 4.350 . . 1 . . . . . . . . 6095 2 260 . 2 2 22 22 GLN CB C 13 29.504 . . 1 . . . . . . . . 6095 2 261 . 2 2 22 22 GLN HB2 H 1 2.150 . . . . . . . . . . . 6095 2 262 . 2 2 22 22 GLN HB3 H 1 2.013 . . . . . . . . . . . 6095 2 263 . 2 2 22 22 GLN CG C 13 33.819 . . 1 . . . . . . . . 6095 2 264 . 2 2 22 22 GLN HG3 H 1 2.377 . . . . . . . . . . . 6095 2 265 . 2 2 22 22 GLN NE2 N 15 111.850 . . 1 . . . . . . . . 6095 2 266 . 2 2 22 22 GLN HE21 H 1 7.540 . . . . . . . . . . . 6095 2 267 . 2 2 22 22 GLN HE22 H 1 6.850 . . . . . . . . . . . 6095 2 268 . 2 2 23 23 GLN N N 15 121.236 . . 1 . . . . . . . . 6095 2 269 . 2 2 23 23 GLN H H 1 8.353 . . 1 . . . . . . . . 6095 2 270 . 2 2 23 23 GLN CA C 13 55.700 . . 1 . . . . . . . . 6095 2 271 . 2 2 23 23 GLN HA H 1 4.330 . . 1 . . . . . . . . 6095 2 272 . 2 2 23 23 GLN CB C 13 29.600 . . 1 . . . . . . . . 6095 2 273 . 2 2 23 23 GLN HB2 H 1 2.130 . . . . . . . . . . . 6095 2 274 . 2 2 23 23 GLN HB3 H 1 2.010 . . . . . . . . . . . 6095 2 275 . 2 2 23 23 GLN CG C 13 33.821 . . 1 . . . . . . . . 6095 2 276 . 2 2 23 23 GLN HG3 H 1 2.380 . . . . . . . . . . . 6095 2 277 . 2 2 23 23 GLN NE2 N 15 112.500 . . 1 . . . . . . . . 6095 2 278 . 2 2 23 23 GLN HE21 H 1 7.540 . . . . . . . . . . . 6095 2 279 . 2 2 23 23 GLN HE22 H 1 6.850 . . . . . . . . . . . 6095 2 280 . 2 2 24 24 ALA N N 15 126.070 . . 1 . . . . . . . . 6095 2 281 . 2 2 24 24 ALA H H 1 8.282 . . 1 . . . . . . . . 6095 2 282 . 2 2 24 24 ALA CA C 13 52.263 . . 1 . . . . . . . . 6095 2 283 . 2 2 24 24 ALA HA H 1 4.360 . . 1 . . . . . . . . 6095 2 284 . 2 2 24 24 ALA CB C 13 19.172 . . 1 . . . . . . . . 6095 2 285 . 2 2 24 24 ALA HB1 H 1 1.386 . . 1 . . . . . . . . 6095 2 286 . 2 2 24 24 ALA HB2 H 1 1.386 . . 1 . . . . . . . . 6095 2 287 . 2 2 24 24 ALA HB3 H 1 1.386 . . 1 . . . . . . . . 6095 2 288 . 2 2 25 25 LEU N N 15 127.568 . . 1 . . . . . . . . 6095 2 289 . 2 2 25 25 LEU H H 1 7.822 . . 1 . . . . . . . . 6095 2 290 . 2 2 25 25 LEU CA C 13 56.551 . . 1 . . . . . . . . 6095 2 291 . 2 2 25 25 LEU HA H 1 4.182 . . 1 . . . . . . . . 6095 2 292 . 2 2 25 25 LEU CB C 13 43.410 . . 1 . . . . . . . . 6095 2 293 . 2 2 25 25 LEU HB3 H 1 1.586 . . . . . . . . . . . 6095 2 294 . 2 2 25 25 LEU CG C 13 27.251 . . 1 . . . . . . . . 6095 2 295 . 2 2 25 25 LEU HG H 1 1.609 . . 1 . . . . . . . . 6095 2 296 . 2 2 25 25 LEU CD1 C 13 23.613 . . . . . . . . . . . 6095 2 297 . 2 2 25 25 LEU HD11 H 1 0.865 . . . . . . . . . . . 6095 2 298 . 2 2 25 25 LEU HD12 H 1 0.865 . . . . . . . . . . . 6095 2 299 . 2 2 25 25 LEU HD13 H 1 0.865 . . . . . . . . . . . 6095 2 300 . 2 2 25 25 LEU CD2 C 13 25.274 . . . . . . . . . . . 6095 2 301 . 2 2 25 25 LEU HD21 H 1 0.903 . . . . . . . . . . . 6095 2 302 . 2 2 25 25 LEU HD22 H 1 0.903 . . . . . . . . . . . 6095 2 303 . 2 2 25 25 LEU HD23 H 1 0.903 . . . . . . . . . . . 6095 2 stop_ save_