data_6700 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 6700 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID . 'Drosophila (d)TAF1 was studied in complex with TATA-binding protein (TBP)' 'Structural analysis' 'The data were used to study the structure of dTAF1 in complex with TBP' 6700 1 stop_ loop_ _Study_keyword.Study_ID _Study_keyword.Keyword _Study_keyword.Entry_ID _Study_keyword.Study_list_ID . dTAF1 6700 1 . 'NMR structure' 6700 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6700 _Entry.Title ; Resonance Assignments of 30 kDa complexes of TFIID subunit TAF1 with TATA-binding protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-06-22 _Entry.Accession_date 2005-06-22 _Entry.Last_release_date 2005-10-28 _Entry.Original_release_date 2005-10-28 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Tapas Mal . K. . 6700 2 Dingjiang Liu . . . 6700 3 Yutaka Masutomi . . . 6700 4 Le Zheng . . . 6700 5 Yoshihiro Nakatani . . . 6700 6 Tetsuro Kokubo . . . 6700 7 Mitsuhiko Ikura . . . 6700 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . OCI . 6700 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6700 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 600 6700 '15N chemical shifts' 250 6700 '1H chemical shifts' 601 6700 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 . . 2005-10-28 2005-06-22 original author . 6700 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6700 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16222567 _Citation.Full_citation . _Citation.Title ; Resonance Assignments of 30 kDa Complexes of TFIID Subunit TAF1 with TATA-binding Protein ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 33 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 76 _Citation.Page_last 76 _Citation.Year 2005 _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 Tapas Mal . K. . 6700 1 2 Dingjiang Liu . . . 6700 1 3 Yutaka Masutomi . . . 6700 1 4 Le Zheng . . . 6700 1 5 Yoshihiro Nakatani . . . 6700 1 6 Tetsuro Kokubo . . . 6700 1 7 Mitsuhiko Ikura . . . 6700 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID NMR 6700 1 TBP 6700 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6700 _Assembly.ID 1 _Assembly.Name 'TBP associated factor 1 (TAF1)' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details 'Drosophila (d)TAF1 was studied in complex with yeast (y)TBP' _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID 'protein-protein complex' 6700 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 'TBP associated factor 1 (TAF1)' 1 $dTAF1 . . yes native no no . 'regulation of transcription' . 6700 1 2 'yeast TATA binding protein (y)TBP' 2 $yTBP . . yes native no no . 'regulation of transcription' . 6700 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_dTAF1 _Entity.Sf_category entity _Entity.Sf_framecode dTAF1 _Entity.Entry_ID 6700 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name dTAF1 _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 ; EGSIGNGLDLTGILFGNIDS EGRLLQDDDGEGRGGTGFDA ELRENIGSLSKLGLDSMLLE VIDLKEA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 67 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 6702 . yTBPc . . . . . 100.00 192 100.00 100.00 5.47e-136 . . . . 6700 1 2 no PDB 1NGM . "Crystal Structure Of A Yeast Brf1-Tbp-Dna Ternary Complex" . . . . . 93.75 180 100.00 100.00 7.38e-127 . . . . 6700 1 3 no PDB 1NH2 . "Crystal Structure Of A Yeast TfiiaTBPDNA COMPLEX" . . . . . 93.75 180 100.00 100.00 7.38e-127 . . . . 6700 1 4 no PDB 1RM1 . "Structure Of A Yeast TfiiaTBPTATA-Box Dna Complex" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 5 no PDB 1TBA . "Solution Structure Of A Tbp-Tafii230 Complex: Protein Mimicry Of The Minor Groove Surface Of The Tata Box Unwound By Tbp, Nmr, " . . . . . 93.75 180 100.00 100.00 7.38e-127 . . . . 6700 1 6 no PDB 1TBP . "Crystal Structure Of Yeast Tata-Binding Protein And Model For Interaction With Dna" . . . . . 93.23 180 100.00 100.00 3.93e-126 . . . . 6700 1 7 no PDB 1YTB . "Crystal Structure Of A Yeast TbpTATA-Box Complex" . . . . . 93.75 180 100.00 100.00 7.38e-127 . . . . 6700 1 8 no PDB 1YTF . "Yeast TfiiaTBPDNA COMPLEX" . . . . . 93.75 180 100.00 100.00 7.38e-127 . . . . 6700 1 9 no PDB 4B0A . "The High-resolution Structure Of Ytbp-ytaf1 Identifies Conserved And Competing Interaction Surfaces In Transcriptional Activati" . . . . . 95.31 278 98.36 98.91 7.10e-126 . . . . 6700 1 10 no DBJ GAA22978 . "K7_Spt15p [Saccharomyces cerevisiae Kyokai no. 7]" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 11 no EMBL CAA34751 . "unnamed protein product [Saccharomyces cerevisiae]" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 12 no EMBL CAG60477 . "unnamed protein product [Candida glabrata]" . . . . . 94.27 233 99.45 99.45 9.38e-127 . . . . 6700 1 13 no EMBL CAY79336 . "Spt15p [Saccharomyces cerevisiae EC1118]" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 14 no EMBL CCD25155 . "hypothetical protein NDAI_0E03380 [Naumovozyma dairenensis CBS 421]" . . . . . 98.44 264 97.88 97.88 5.85e-131 . . . . 6700 1 15 no EMBL CCE61293 . "hypothetical protein TPHA_0A02110 [Tetrapisispora phaffii CBS 4417]" . . . . . 94.79 244 98.35 99.45 4.04e-127 . . . . 6700 1 16 no GB AAA34458 . "TATA box factor [Saccharomyces cerevisiae]" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 17 no GB AAA35146 . "tata-box factor protein [Saccharomyces cerevisiae]" . . . . . 100.00 240 99.48 99.48 7.56e-135 . . . . 6700 1 18 no GB AAA35147 . "TATA-binding protein [Saccharomyces cerevisiae]" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 19 no GB AAB64675 . "Spt15p: TATA-box binding protein tfIId [Saccharomyces cerevisiae]" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 20 no GB AEP68354 . "TATA-binding protein [Saccharomyces cerevisiae]" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 21 no PRF 1515352A . "transcription initiation factor TFIID" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 22 no REF NP_011075 . "TATA-binding protein [Saccharomyces cerevisiae S288c]" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 23 no REF XP_001646300 . "hypothetical protein Kpol_1032p36 [Vanderwaltozyma polyspora DSM 70294]" . . . . . 98.44 251 97.35 97.88 3.99e-130 . . . . 6700 1 24 no REF XP_003670398 . "hypothetical protein NDAI_0E03380 [Naumovozyma dairenensis CBS 421]" . . . . . 98.44 264 97.88 97.88 5.85e-131 . . . . 6700 1 25 no REF XP_003683727 . "hypothetical protein TPHA_0A02110 [Tetrapisispora phaffii CBS 4417]" . . . . . 94.79 244 98.35 99.45 4.04e-127 . . . . 6700 1 26 no REF XP_003955666 . "hypothetical protein KAFR_0B02330 [Kazachstania africana CBS 2517]" . . . . . 97.40 230 97.33 98.93 8.50e-129 . . . . 6700 1 27 no SP P13393 . "RecName: Full=TATA-box-binding protein; AltName: Full=TATA sequence-binding protein; Short=TBP; AltName: Full=TATA-binding fact" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 28 no TPG DAA07809 . "TPA: TATA-binding protein [Saccharomyces cerevisiae S288c]" . . . . . 100.00 240 100.00 100.00 1.81e-135 . . . . 6700 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Transcriptional regulation' 6700 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID dTAF1 . 6700 1 stop_ loop_ _Entity_keyword.Keyword _Entity_keyword.Entry_ID _Entity_keyword.Entity_ID dATF1 6700 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 11 GLU . 6700 1 2 12 GLY . 6700 1 3 13 SER . 6700 1 4 14 ILE . 6700 1 5 15 GLY . 6700 1 6 16 ASN . 6700 1 7 17 GLY . 6700 1 8 18 LEU . 6700 1 9 19 ASP . 6700 1 10 20 LEU . 6700 1 11 21 THR . 6700 1 12 22 GLY . 6700 1 13 23 ILE . 6700 1 14 24 LEU . 6700 1 15 25 PHE . 6700 1 16 26 GLY . 6700 1 17 27 ASN . 6700 1 18 28 ILE . 6700 1 19 29 ASP . 6700 1 20 30 SER . 6700 1 21 31 GLU . 6700 1 22 32 GLY . 6700 1 23 33 ARG . 6700 1 24 34 LEU . 6700 1 25 35 LEU . 6700 1 26 36 GLN . 6700 1 27 37 ASP . 6700 1 28 38 ASP . 6700 1 29 39 ASP . 6700 1 30 40 GLY . 6700 1 31 41 GLU . 6700 1 32 42 GLY . 6700 1 33 43 ARG . 6700 1 34 44 GLY . 6700 1 35 45 GLY . 6700 1 36 46 THR . 6700 1 37 47 GLY . 6700 1 38 48 PHE . 6700 1 39 49 ASP . 6700 1 40 50 ALA . 6700 1 41 51 GLU . 6700 1 42 52 LEU . 6700 1 43 53 ARG . 6700 1 44 54 GLU . 6700 1 45 55 ASN . 6700 1 46 56 ILE . 6700 1 47 57 GLY . 6700 1 48 58 SER . 6700 1 49 59 LEU . 6700 1 50 60 SER . 6700 1 51 61 LYS . 6700 1 52 62 LEU . 6700 1 53 63 GLY . 6700 1 54 64 LEU . 6700 1 55 65 ASP . 6700 1 56 66 SER . 6700 1 57 67 MET . 6700 1 58 68 LEU . 6700 1 59 69 LEU . 6700 1 60 70 GLU . 6700 1 61 71 VAL . 6700 1 62 72 ILE . 6700 1 63 73 ASP . 6700 1 64 74 LEU . 6700 1 65 75 LYS . 6700 1 66 76 GLU . 6700 1 67 77 ALA . 6700 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 . GLU 1 1 6700 1 . GLY 2 2 6700 1 . SER 3 3 6700 1 . ILE 4 4 6700 1 . GLY 5 5 6700 1 . ASN 6 6 6700 1 . GLY 7 7 6700 1 . LEU 8 8 6700 1 . ASP 9 9 6700 1 . LEU 10 10 6700 1 . THR 11 11 6700 1 . GLY 12 12 6700 1 . ILE 13 13 6700 1 . LEU 14 14 6700 1 . PHE 15 15 6700 1 . GLY 16 16 6700 1 . ASN 17 17 6700 1 . ILE 18 18 6700 1 . ASP 19 19 6700 1 . SER 20 20 6700 1 . GLU 21 21 6700 1 . GLY 22 22 6700 1 . ARG 23 23 6700 1 . LEU 24 24 6700 1 . LEU 25 25 6700 1 . GLN 26 26 6700 1 . ASP 27 27 6700 1 . ASP 28 28 6700 1 . ASP 29 29 6700 1 . GLY 30 30 6700 1 . GLU 31 31 6700 1 . GLY 32 32 6700 1 . ARG 33 33 6700 1 . GLY 34 34 6700 1 . GLY 35 35 6700 1 . THR 36 36 6700 1 . GLY 37 37 6700 1 . PHE 38 38 6700 1 . ASP 39 39 6700 1 . ALA 40 40 6700 1 . GLU 41 41 6700 1 . LEU 42 42 6700 1 . ARG 43 43 6700 1 . GLU 44 44 6700 1 . ASN 45 45 6700 1 . ILE 46 46 6700 1 . GLY 47 47 6700 1 . SER 48 48 6700 1 . LEU 49 49 6700 1 . SER 50 50 6700 1 . LYS 51 51 6700 1 . LEU 52 52 6700 1 . GLY 53 53 6700 1 . LEU 54 54 6700 1 . ASP 55 55 6700 1 . SER 56 56 6700 1 . MET 57 57 6700 1 . LEU 58 58 6700 1 . LEU 59 59 6700 1 . GLU 60 60 6700 1 . VAL 61 61 6700 1 . ILE 62 62 6700 1 . ASP 63 63 6700 1 . LEU 64 64 6700 1 . LYS 65 65 6700 1 . GLU 66 66 6700 1 . ALA 67 67 6700 1 stop_ save_ save_yTBP _Entity.Sf_category entity _Entity.Sf_framecode yTBP _Entity.Entry_ID 6700 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name TBPc _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 ; AAPESEKDTSATSGIVPTLQ NIVATVTLGCRLDLKTVALH ARNAEYNPKRFAAVIMRIRE PKTTALIFASGKMVVTGAKS EDDSKLASRKYARIIQKIGF AAKFTDFKIQNIVGSCDVKF PIRLEGLAFSHGTFSSYEPE LFPGLIYRMVKPKIVLLIFV SGKIVLTGAKQREEIYQAFE AIYPVLSEFRKM ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 192 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Transcriptional regulation' 6700 2 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID TBPc . 6700 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 49 ALA . 6700 2 2 50 ALA . 6700 2 3 51 PRO . 6700 2 4 52 GLU . 6700 2 5 53 SER . 6700 2 6 54 GLU . 6700 2 7 55 LYS . 6700 2 8 56 ASP . 6700 2 9 57 THR . 6700 2 10 58 SER . 6700 2 11 59 ALA . 6700 2 12 60 THR . 6700 2 13 61 SER . 6700 2 14 62 GLY . 6700 2 15 63 ILE . 6700 2 16 64 VAL . 6700 2 17 65 PRO . 6700 2 18 66 THR . 6700 2 19 67 LEU . 6700 2 20 68 GLN . 6700 2 21 69 ASN . 6700 2 22 70 ILE . 6700 2 23 71 VAL . 6700 2 24 72 ALA . 6700 2 25 73 THR . 6700 2 26 74 VAL . 6700 2 27 75 THR . 6700 2 28 76 LEU . 6700 2 29 77 GLY . 6700 2 30 78 CYS . 6700 2 31 79 ARG . 6700 2 32 80 LEU . 6700 2 33 81 ASP . 6700 2 34 82 LEU . 6700 2 35 83 LYS . 6700 2 36 84 THR . 6700 2 37 85 VAL . 6700 2 38 86 ALA . 6700 2 39 87 LEU . 6700 2 40 88 HIS . 6700 2 41 89 ALA . 6700 2 42 90 ARG . 6700 2 43 91 ASN . 6700 2 44 92 ALA . 6700 2 45 93 GLU . 6700 2 46 94 TYR . 6700 2 47 95 ASN . 6700 2 48 96 PRO . 6700 2 49 97 LYS . 6700 2 50 98 ARG . 6700 2 51 99 PHE . 6700 2 52 100 ALA . 6700 2 53 101 ALA . 6700 2 54 102 VAL . 6700 2 55 103 ILE . 6700 2 56 104 MET . 6700 2 57 105 ARG . 6700 2 58 106 ILE . 6700 2 59 107 ARG . 6700 2 60 108 GLU . 6700 2 61 109 PRO . 6700 2 62 110 LYS . 6700 2 63 111 THR . 6700 2 64 112 THR . 6700 2 65 113 ALA . 6700 2 66 114 LEU . 6700 2 67 115 ILE . 6700 2 68 116 PHE . 6700 2 69 117 ALA . 6700 2 70 118 SER . 6700 2 71 119 GLY . 6700 2 72 120 LYS . 6700 2 73 121 MET . 6700 2 74 122 VAL . 6700 2 75 123 VAL . 6700 2 76 124 THR . 6700 2 77 125 GLY . 6700 2 78 126 ALA . 6700 2 79 127 LYS . 6700 2 80 128 SER . 6700 2 81 129 GLU . 6700 2 82 130 ASP . 6700 2 83 131 ASP . 6700 2 84 132 SER . 6700 2 85 133 LYS . 6700 2 86 134 LEU . 6700 2 87 135 ALA . 6700 2 88 136 SER . 6700 2 89 137 ARG . 6700 2 90 138 LYS . 6700 2 91 139 TYR . 6700 2 92 140 ALA . 6700 2 93 141 ARG . 6700 2 94 142 ILE . 6700 2 95 143 ILE . 6700 2 96 144 GLN . 6700 2 97 145 LYS . 6700 2 98 146 ILE . 6700 2 99 147 GLY . 6700 2 100 148 PHE . 6700 2 101 149 ALA . 6700 2 102 150 ALA . 6700 2 103 151 LYS . 6700 2 104 152 PHE . 6700 2 105 153 THR . 6700 2 106 154 ASP . 6700 2 107 155 PHE . 6700 2 108 156 LYS . 6700 2 109 157 ILE . 6700 2 110 158 GLN . 6700 2 111 159 ASN . 6700 2 112 160 ILE . 6700 2 113 161 VAL . 6700 2 114 162 GLY . 6700 2 115 163 SER . 6700 2 116 164 CYS . 6700 2 117 165 ASP . 6700 2 118 166 VAL . 6700 2 119 167 LYS . 6700 2 120 168 PHE . 6700 2 121 169 PRO . 6700 2 122 170 ILE . 6700 2 123 171 ARG . 6700 2 124 172 LEU . 6700 2 125 173 GLU . 6700 2 126 174 GLY . 6700 2 127 175 LEU . 6700 2 128 176 ALA . 6700 2 129 177 PHE . 6700 2 130 178 SER . 6700 2 131 179 HIS . 6700 2 132 180 GLY . 6700 2 133 181 THR . 6700 2 134 182 PHE . 6700 2 135 183 SER . 6700 2 136 184 SER . 6700 2 137 185 TYR . 6700 2 138 186 GLU . 6700 2 139 187 PRO . 6700 2 140 188 GLU . 6700 2 141 189 LEU . 6700 2 142 190 PHE . 6700 2 143 191 PRO . 6700 2 144 192 GLY . 6700 2 145 193 LEU . 6700 2 146 194 ILE . 6700 2 147 195 TYR . 6700 2 148 196 ARG . 6700 2 149 197 MET . 6700 2 150 198 VAL . 6700 2 151 199 LYS . 6700 2 152 200 PRO . 6700 2 153 201 LYS . 6700 2 154 202 ILE . 6700 2 155 203 VAL . 6700 2 156 204 LEU . 6700 2 157 205 LEU . 6700 2 158 206 ILE . 6700 2 159 207 PHE . 6700 2 160 208 VAL . 6700 2 161 209 SER . 6700 2 162 210 GLY . 6700 2 163 211 LYS . 6700 2 164 212 ILE . 6700 2 165 213 VAL . 6700 2 166 214 LEU . 6700 2 167 215 THR . 6700 2 168 216 GLY . 6700 2 169 217 ALA . 6700 2 170 218 LYS . 6700 2 171 219 GLN . 6700 2 172 220 ARG . 6700 2 173 221 GLU . 6700 2 174 222 GLU . 6700 2 175 223 ILE . 6700 2 176 224 TYR . 6700 2 177 225 GLN . 6700 2 178 226 ALA . 6700 2 179 227 PHE . 6700 2 180 228 GLU . 6700 2 181 229 ALA . 6700 2 182 230 ILE . 6700 2 183 231 TYR . 6700 2 184 232 PRO . 6700 2 185 233 VAL . 6700 2 186 234 LEU . 6700 2 187 235 SER . 6700 2 188 236 GLU . 6700 2 189 237 PHE . 6700 2 190 238 ARG . 6700 2 191 239 LYS . 6700 2 192 240 MET . 6700 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 . ALA 1 1 6700 2 . ALA 2 2 6700 2 . PRO 3 3 6700 2 . GLU 4 4 6700 2 . SER 5 5 6700 2 . GLU 6 6 6700 2 . LYS 7 7 6700 2 . ASP 8 8 6700 2 . THR 9 9 6700 2 . SER 10 10 6700 2 . ALA 11 11 6700 2 . THR 12 12 6700 2 . SER 13 13 6700 2 . GLY 14 14 6700 2 . ILE 15 15 6700 2 . VAL 16 16 6700 2 . PRO 17 17 6700 2 . THR 18 18 6700 2 . LEU 19 19 6700 2 . GLN 20 20 6700 2 . ASN 21 21 6700 2 . ILE 22 22 6700 2 . VAL 23 23 6700 2 . ALA 24 24 6700 2 . THR 25 25 6700 2 . VAL 26 26 6700 2 . THR 27 27 6700 2 . LEU 28 28 6700 2 . GLY 29 29 6700 2 . CYS 30 30 6700 2 . ARG 31 31 6700 2 . LEU 32 32 6700 2 . ASP 33 33 6700 2 . LEU 34 34 6700 2 . LYS 35 35 6700 2 . THR 36 36 6700 2 . VAL 37 37 6700 2 . ALA 38 38 6700 2 . LEU 39 39 6700 2 . HIS 40 40 6700 2 . ALA 41 41 6700 2 . ARG 42 42 6700 2 . ASN 43 43 6700 2 . ALA 44 44 6700 2 . GLU 45 45 6700 2 . TYR 46 46 6700 2 . ASN 47 47 6700 2 . PRO 48 48 6700 2 . LYS 49 49 6700 2 . ARG 50 50 6700 2 . PHE 51 51 6700 2 . ALA 52 52 6700 2 . ALA 53 53 6700 2 . VAL 54 54 6700 2 . ILE 55 55 6700 2 . MET 56 56 6700 2 . ARG 57 57 6700 2 . ILE 58 58 6700 2 . ARG 59 59 6700 2 . GLU 60 60 6700 2 . PRO 61 61 6700 2 . LYS 62 62 6700 2 . THR 63 63 6700 2 . THR 64 64 6700 2 . ALA 65 65 6700 2 . LEU 66 66 6700 2 . ILE 67 67 6700 2 . PHE 68 68 6700 2 . ALA 69 69 6700 2 . SER 70 70 6700 2 . GLY 71 71 6700 2 . LYS 72 72 6700 2 . MET 73 73 6700 2 . VAL 74 74 6700 2 . VAL 75 75 6700 2 . THR 76 76 6700 2 . GLY 77 77 6700 2 . ALA 78 78 6700 2 . LYS 79 79 6700 2 . SER 80 80 6700 2 . GLU 81 81 6700 2 . ASP 82 82 6700 2 . ASP 83 83 6700 2 . SER 84 84 6700 2 . LYS 85 85 6700 2 . LEU 86 86 6700 2 . ALA 87 87 6700 2 . SER 88 88 6700 2 . ARG 89 89 6700 2 . LYS 90 90 6700 2 . TYR 91 91 6700 2 . ALA 92 92 6700 2 . ARG 93 93 6700 2 . ILE 94 94 6700 2 . ILE 95 95 6700 2 . GLN 96 96 6700 2 . LYS 97 97 6700 2 . ILE 98 98 6700 2 . GLY 99 99 6700 2 . PHE 100 100 6700 2 . ALA 101 101 6700 2 . ALA 102 102 6700 2 . LYS 103 103 6700 2 . PHE 104 104 6700 2 . THR 105 105 6700 2 . ASP 106 106 6700 2 . PHE 107 107 6700 2 . LYS 108 108 6700 2 . ILE 109 109 6700 2 . GLN 110 110 6700 2 . ASN 111 111 6700 2 . ILE 112 112 6700 2 . VAL 113 113 6700 2 . GLY 114 114 6700 2 . SER 115 115 6700 2 . CYS 116 116 6700 2 . ASP 117 117 6700 2 . VAL 118 118 6700 2 . LYS 119 119 6700 2 . PHE 120 120 6700 2 . PRO 121 121 6700 2 . ILE 122 122 6700 2 . ARG 123 123 6700 2 . LEU 124 124 6700 2 . GLU 125 125 6700 2 . GLY 126 126 6700 2 . LEU 127 127 6700 2 . ALA 128 128 6700 2 . PHE 129 129 6700 2 . SER 130 130 6700 2 . HIS 131 131 6700 2 . GLY 132 132 6700 2 . THR 133 133 6700 2 . PHE 134 134 6700 2 . SER 135 135 6700 2 . SER 136 136 6700 2 . TYR 137 137 6700 2 . GLU 138 138 6700 2 . PRO 139 139 6700 2 . GLU 140 140 6700 2 . LEU 141 141 6700 2 . PHE 142 142 6700 2 . PRO 143 143 6700 2 . GLY 144 144 6700 2 . LEU 145 145 6700 2 . ILE 146 146 6700 2 . TYR 147 147 6700 2 . ARG 148 148 6700 2 . MET 149 149 6700 2 . VAL 150 150 6700 2 . LYS 151 151 6700 2 . PRO 152 152 6700 2 . LYS 153 153 6700 2 . ILE 154 154 6700 2 . VAL 155 155 6700 2 . LEU 156 156 6700 2 . LEU 157 157 6700 2 . ILE 158 158 6700 2 . PHE 159 159 6700 2 . VAL 160 160 6700 2 . SER 161 161 6700 2 . GLY 162 162 6700 2 . LYS 163 163 6700 2 . ILE 164 164 6700 2 . VAL 165 165 6700 2 . LEU 166 166 6700 2 . THR 167 167 6700 2 . GLY 168 168 6700 2 . ALA 169 169 6700 2 . LYS 170 170 6700 2 . GLN 171 171 6700 2 . ARG 172 172 6700 2 . GLU 173 173 6700 2 . GLU 174 174 6700 2 . ILE 175 175 6700 2 . TYR 176 176 6700 2 . GLN 177 177 6700 2 . ALA 178 178 6700 2 . PHE 179 179 6700 2 . GLU 180 180 6700 2 . ALA 181 181 6700 2 . ILE 182 182 6700 2 . TYR 183 183 6700 2 . PRO 184 184 6700 2 . VAL 185 185 6700 2 . LEU 186 186 6700 2 . SER 187 187 6700 2 . GLU 188 188 6700 2 . PHE 189 189 6700 2 . ARG 190 190 6700 2 . LYS 191 191 6700 2 . MET 192 192 6700 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 6700 _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 $dTAF1 . 7227 organism . 'Drosophila Melanogaster' 'Drosophila Melanogaster' . . Eukaryota Metazoa Drosophila melanogaster . . . . . . . . . . . . . . . . . . . . . 6700 1 2 2 $yTBP . 4932 organism . 'Saccharomyces Cerevisiae' 'Saccharomyces Cerevisiae' . . Eukaryota Fungi Saccharomyces cerevisiae . . . . . . . . . . . . . . . . . . . . . 6700 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 6700 _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 $dTAF1 . 'recombinant technology' . 'E. Coli' . . . . . . . . . . . . . . . . . . . . . . . . . . . 6700 1 2 2 $yTBP . 'recombinant technology' . 'E. Coli' . . . . . . . . . . . . . . . . . . . . . . . . . . . 6700 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_dTAF1(11-77) _Sample.Sf_category sample _Sample.Sf_framecode dTAF1(11-77) _Sample.Entry_ID 6700 _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 dTAF1 '[U-15N; U-13C; U-2H]' . . 1 $dTAF1 . . . 0.8 1 mM . . . . 6700 1 2 TBPc '[U-15N; U-13C; U-2H]' . . 2 $yTBP . . . 0.8 1 mM . . . . 6700 1 3 phosphate . . . . . . . 20 . . mM . . . . 6700 1 4 Glycerol . . . . . . . 5 . . '% (v/v)' . . . . 6700 1 5 Na2SO4 . . . . . . . 250 . . mM . . . . 6700 1 6 MgCl2 . . . . . . . 5 . . mM . . . . 6700 1 7 DTT . . . . . . . 10 . . mM . . . . 6700 1 8 NaN3 . . . . . . . 0.05 . . mM . . . . 6700 1 stop_ save_ ####################### # Sample conditions # ####################### save_20_mM_phosphate_buffer _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode 20_mM_phosphate_buffer _Sample_condition_list.Entry_ID 6700 _Sample_condition_list.ID 1 _Sample_condition_list.Details '20 mM phosphate, 5% (v/v) Glycerol, 250 Na2SO4, 5 mM MgCl2, 10 mM DTT and 0.05 NaN3' 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 7.0 0.1 pH 6700 1 temperature 298 0.1 K 6700 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 6700 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 6700 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6700 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 HSQC no . . . . . . . . . . 1 $dTAF1(11-77) . . . 1 $20_mM_phosphate_buffer . . . . . . . . . . . . . . . . . . . . . 6700 1 2 HNCACA no . . . . . . . . . . 1 $dTAF1(11-77) . . . 1 $20_mM_phosphate_buffer . . . . . . . . . . . . . . . . . . . . . 6700 1 3 CBCACONNH no . . . . . . . . . . 1 $dTAF1(11-77) . . . 1 $20_mM_phosphate_buffer . . . . . . . . . . . . . . . . . . . . . 6700 1 4 HCCTOCSYNNH no . . . . . . . . . . 1 $dTAF1(11-77) . . . 1 $20_mM_phosphate_buffer . . . . . . . . . . . . . . . . . . . . . 6700 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6700 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 6700 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 6700 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 6700 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_Chemical_shift_assignment_of_dTAF1(11-77) _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode Chemical_shift_assignment_of_dTAF1(11-77) _Assigned_chem_shift_list.Entry_ID 6700 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $20_mM_phosphate_buffer _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.05 _Assigned_chem_shift_list.Chem_shift_13C_err 0.4 _Assigned_chem_shift_list.Chem_shift_15N_err 0.4 _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 . 1 $dTAF1(11-77) isotropic 6700 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 GLY H H 1 8.66 0.05 . . . . . . 12 GLY H . 6700 1 2 . 1 1 2 2 GLY HA2 H 1 4.01 0.05 . . . . . . 12 GLY HA2 . 6700 1 3 . 1 1 2 2 GLY HA3 H 1 4.01 0.05 . . . . . . 12 GLY HA3 . 6700 1 4 . 1 1 2 2 GLY C C 13 174.24 0.4 . . . . . . 12 GLY C . 6700 1 5 . 1 1 2 2 GLY CA C 13 45.51 0.4 . . . . . . 12 GLY CA . 6700 1 6 . 1 1 2 2 GLY N N 15 111.63 0.4 . . . . . . 12 GLY N . 6700 1 7 . 1 1 3 3 SER H H 1 8.22 0.05 . . . . . . 13 SER H . 6700 1 8 . 1 1 3 3 SER HA H 1 4.51 0.05 . . . . . . 13 SER HA . 6700 1 9 . 1 1 3 3 SER HB2 H 1 3.88 0.05 . . . . . . 13 SER HB2 . 6700 1 10 . 1 1 3 3 SER C C 13 174.77 0.4 . . . . . . 13 SER C . 6700 1 11 . 1 1 3 3 SER CA C 13 58.41 0.4 . . . . . . 13 SER CA . 6700 1 12 . 1 1 3 3 SER CB C 13 64.01 0.4 . . . . . . 13 SER CB . 6700 1 13 . 1 1 3 3 SER N N 15 116.11 0.4 . . . . . . 13 SER N . 6700 1 14 . 1 1 4 4 ILE H H 1 8.25 0.05 . . . . . . 14 ILE H . 6700 1 15 . 1 1 4 4 ILE HA H 1 4.22 0.05 . . . . . . 14 ILE HA . 6700 1 16 . 1 1 4 4 ILE HB H 1 1.94 0.05 . . . . . . 14 ILE HB . 6700 1 17 . 1 1 4 4 ILE HG12 H 1 1.47 0.05 . . . . . . 14 ILE HG12 . 6700 1 18 . 1 1 4 4 ILE HG13 H 1 1.19 0.05 . . . . . . 14 ILE HG13 . 6700 1 19 . 1 1 4 4 ILE HG21 H 1 0.91 0.05 . . . . . . 14 ILE HG2 . 6700 1 20 . 1 1 4 4 ILE HG22 H 1 0.91 0.05 . . . . . . 14 ILE HG2 . 6700 1 21 . 1 1 4 4 ILE HG23 H 1 0.91 0.05 . . . . . . 14 ILE HG2 . 6700 1 22 . 1 1 4 4 ILE HD11 H 1 0.82 0.05 . . . . . . 14 ILE HD1 . 6700 1 23 . 1 1 4 4 ILE HD12 H 1 0.82 0.05 . . . . . . 14 ILE HD1 . 6700 1 24 . 1 1 4 4 ILE HD13 H 1 0.82 0.05 . . . . . . 14 ILE HD1 . 6700 1 25 . 1 1 4 4 ILE C C 13 176.74 0.4 . . . . . . 14 ILE C . 6700 1 26 . 1 1 4 4 ILE CA C 13 61.6 0.4 . . . . . . 14 ILE CA . 6700 1 27 . 1 1 4 4 ILE CB C 13 38.74 0.4 . . . . . . 14 ILE CB . 6700 1 28 . 1 1 4 4 ILE CG1 C 13 27.62 0.4 . . . . . . 14 ILE CG1 . 6700 1 29 . 1 1 4 4 ILE CG2 C 13 17.67 0.4 . . . . . . 14 ILE CG2 . 6700 1 30 . 1 1 4 4 ILE CD1 C 13 13.24 0.4 . . . . . . 14 ILE CD1 . 6700 1 31 . 1 1 4 4 ILE N N 15 122.43 0.4 . . . . . . 14 ILE N . 6700 1 32 . 1 1 5 5 GLY H H 1 8.43 0.05 . . . . . . 15 GLY H . 6700 1 33 . 1 1 5 5 GLY HA2 H 1 3.98 0.05 . . . . . . 15 GLY HA2 . 6700 1 34 . 1 1 5 5 GLY HA3 H 1 3.98 0.05 . . . . . . 15 GLY HA3 . 6700 1 35 . 1 1 5 5 GLY C C 13 173.97 0.4 . . . . . . 15 GLY C . 6700 1 36 . 1 1 5 5 GLY CA C 13 45.51 0.4 . . . . . . 15 GLY CA . 6700 1 37 . 1 1 5 5 GLY N N 15 112.57 0.4 . . . . . . 15 GLY N . 6700 1 38 . 1 1 6 6 ASN H H 1 8.4 0.05 . . . . . . 16 ASN H . 6700 1 39 . 1 1 6 6 ASN HA H 1 4.78 0.05 . . . . . . 16 ASN HA . 6700 1 40 . 1 1 6 6 ASN HB2 H 1 2.78 0.05 . . . . . . 16 ASN HB2 . 6700 1 41 . 1 1 6 6 ASN HB3 H 1 2.89 0.05 . . . . . . 16 ASN HB3 . 6700 1 42 . 1 1 6 6 ASN HD21 H 1 7.61 0.05 . . . . . . 16 ASN HD21 . 6700 1 43 . 1 1 6 6 ASN HD22 H 1 6.91 0.05 . . . . . . 16 ASN HD22 . 6700 1 44 . 1 1 6 6 ASN C C 13 175.7 0.4 . . . . . . 16 ASN C . 6700 1 45 . 1 1 6 6 ASN CA C 13 53.24 0.4 . . . . . . 16 ASN CA . 6700 1 46 . 1 1 6 6 ASN CB C 13 39.21 0.4 . . . . . . 16 ASN CB . 6700 1 47 . 1 1 6 6 ASN N N 15 119.27 0.4 . . . . . . 16 ASN N . 6700 1 48 . 1 1 6 6 ASN ND2 N 15 113.06 0.4 . . . . . . 16 ASN ND2 . 6700 1 49 . 1 1 7 7 GLY H H 1 8.44 0.05 . . . . . . 17 GLY H . 6700 1 50 . 1 1 7 7 GLY HA2 H 1 3.96 0.05 . . . . . . 17 GLY HA2 . 6700 1 51 . 1 1 7 7 GLY HA3 H 1 3.96 0.05 . . . . . . 17 GLY HA3 . 6700 1 52 . 1 1 7 7 GLY C C 13 173.57 0.4 . . . . . . 17 GLY C . 6700 1 53 . 1 1 7 7 GLY CA C 13 45.55 0.4 . . . . . . 17 GLY CA . 6700 1 54 . 1 1 7 7 GLY N N 15 109.53 0.4 . . . . . . 17 GLY N . 6700 1 55 . 1 1 8 8 LEU H H 1 7.99 0.05 . . . . . . 18 LEU H . 6700 1 56 . 1 1 8 8 LEU HA H 1 4.3 0.05 . . . . . . 18 LEU HA . 6700 1 57 . 1 1 8 8 LEU HB2 H 1 1.32 0.05 . . . . . . 18 LEU HB2 . 6700 1 58 . 1 1 8 8 LEU HB3 H 1 1.45 0.05 . . . . . . 18 LEU HB3 . 6700 1 59 . 1 1 8 8 LEU HG H 1 1.28 0.05 . . . . . . 18 LEU HG . 6700 1 60 . 1 1 8 8 LEU HD11 H 1 0.67 0.05 . . . . . . 18 LEU HD1 . 6700 1 61 . 1 1 8 8 LEU HD12 H 1 0.67 0.05 . . . . . . 18 LEU HD1 . 6700 1 62 . 1 1 8 8 LEU HD13 H 1 0.67 0.05 . . . . . . 18 LEU HD1 . 6700 1 63 . 1 1 8 8 LEU HD21 H 1 0.57 0.05 . . . . . . 18 LEU HD2 . 6700 1 64 . 1 1 8 8 LEU HD22 H 1 0.57 0.05 . . . . . . 18 LEU HD2 . 6700 1 65 . 1 1 8 8 LEU HD23 H 1 0.57 0.05 . . . . . . 18 LEU HD2 . 6700 1 66 . 1 1 8 8 LEU C C 13 175.42 0.4 . . . . . . 18 LEU C . 6700 1 67 . 1 1 8 8 LEU CA C 13 54.92 0.4 . . . . . . 18 LEU CA . 6700 1 68 . 1 1 8 8 LEU CB C 13 43.64 0.4 . . . . . . 18 LEU CB . 6700 1 69 . 1 1 8 8 LEU CG C 13 27.16 0.4 . . . . . . 18 LEU CG . 6700 1 70 . 1 1 8 8 LEU CD1 C 13 24.05 0.4 . . . . . . 18 LEU CD1 . 6700 1 71 . 1 1 8 8 LEU CD2 C 13 24.75 0.4 . . . . . . 18 LEU CD2 . 6700 1 72 . 1 1 8 8 LEU N N 15 122.35 0.4 . . . . . . 18 LEU N . 6700 1 73 . 1 1 9 9 ASP H H 1 8.46 0.05 . . . . . . 19 ASP H . 6700 1 74 . 1 1 9 9 ASP HA H 1 4.72 0.05 . . . . . . 19 ASP HA . 6700 1 75 . 1 1 9 9 ASP HB2 H 1 2.66 0.05 . . . . . . 19 ASP HB2 . 6700 1 76 . 1 1 9 9 ASP HB3 H 1 2.88 0.05 . . . . . . 19 ASP HB3 . 6700 1 77 . 1 1 9 9 ASP C C 13 176.89 0.4 . . . . . . 19 ASP C . 6700 1 78 . 1 1 9 9 ASP CA C 13 53.74 0.4 . . . . . . 19 ASP CA . 6700 1 79 . 1 1 9 9 ASP CB C 13 41.85 0.4 . . . . . . 19 ASP CB . 6700 1 80 . 1 1 9 9 ASP N N 15 124.87 0.4 . . . . . . 19 ASP N . 6700 1 81 . 1 1 10 10 LEU H H 1 8.63 0.05 . . . . . . 20 LEU H . 6700 1 82 . 1 1 10 10 LEU HA H 1 4.38 0.05 . . . . . . 20 LEU HA . 6700 1 83 . 1 1 10 10 LEU HB2 H 1 1.66 0.05 . . . . . . 20 LEU HB2 . 6700 1 84 . 1 1 10 10 LEU HG H 1 1.32 0.05 . . . . . . 20 LEU HG . 6700 1 85 . 1 1 10 10 LEU HD11 H 1 0.46 0.05 . . . . . . 20 LEU HD1 . 6700 1 86 . 1 1 10 10 LEU HD12 H 1 0.46 0.05 . . . . . . 20 LEU HD1 . 6700 1 87 . 1 1 10 10 LEU HD13 H 1 0.46 0.05 . . . . . . 20 LEU HD1 . 6700 1 88 . 1 1 10 10 LEU HD21 H 1 0.34 0.05 . . . . . . 20 LEU HD2 . 6700 1 89 . 1 1 10 10 LEU HD22 H 1 0.34 0.05 . . . . . . 20 LEU HD2 . 6700 1 90 . 1 1 10 10 LEU HD23 H 1 0.34 0.05 . . . . . . 20 LEU HD2 . 6700 1 91 . 1 1 10 10 LEU C C 13 176.52 0.4 . . . . . . 20 LEU C . 6700 1 92 . 1 1 10 10 LEU CA C 13 54.82 0.4 . . . . . . 20 LEU CA . 6700 1 93 . 1 1 10 10 LEU CB C 13 42.47 0.4 . . . . . . 20 LEU CB . 6700 1 94 . 1 1 10 10 LEU CG C 13 26.85 0.4 . . . . . . 20 LEU CG . 6700 1 95 . 1 1 10 10 LEU CD1 C 13 25.55 0.4 . . . . . . 20 LEU CD1 . 6700 1 96 . 1 1 10 10 LEU CD2 C 13 22.87 0.4 . . . . . . 20 LEU CD2 . 6700 1 97 . 1 1 10 10 LEU N N 15 125.85 0.4 . . . . . . 20 LEU N . 6700 1 98 . 1 1 11 11 THR H H 1 8.26 0.05 . . . . . . 21 THR H . 6700 1 99 . 1 1 11 11 THR HA H 1 3.92 0.05 . . . . . . 21 THR HA . 6700 1 100 . 1 1 11 11 THR HB H 1 3.53 0.05 . . . . . . 21 THR HB . 6700 1 101 . 1 1 11 11 THR HG21 H 1 1.17 0.05 . . . . . . 21 THR HG2 . 6700 1 102 . 1 1 11 11 THR HG22 H 1 1.17 0.05 . . . . . . 21 THR HG2 . 6700 1 103 . 1 1 11 11 THR HG23 H 1 1.17 0.05 . . . . . . 21 THR HG2 . 6700 1 104 . 1 1 11 11 THR C C 13 175.31 0.4 . . . . . . 21 THR C . 6700 1 105 . 1 1 11 11 THR CA C 13 67.5 0.4 . . . . . . 21 THR CA . 6700 1 106 . 1 1 11 11 THR CB C 13 67.9 0.4 . . . . . . 21 THR CB . 6700 1 107 . 1 1 11 11 THR CG2 C 13 22.15 0.4 . . . . . . 21 THR CG2 . 6700 1 108 . 1 1 11 11 THR N N 15 117.45 0.4 . . . . . . 21 THR N . 6700 1 109 . 1 1 12 12 GLY H H 1 9.27 0.05 . . . . . . 22 GLY H . 6700 1 110 . 1 1 12 12 GLY HA2 H 1 3.57 0.05 . . . . . . 22 GLY HA2 . 6700 1 111 . 1 1 12 12 GLY HA3 H 1 3.57 0.05 . . . . . . 22 GLY HA3 . 6700 1 112 . 1 1 12 12 GLY C C 13 174.95 0.4 . . . . . . 22 GLY C . 6700 1 113 . 1 1 12 12 GLY N N 15 106.28 0.4 . . . . . . 22 GLY N . 6700 1 114 . 1 1 13 13 ILE H H 1 8.05 0.05 . . . . . . 23 ILE H . 6700 1 115 . 1 1 13 13 ILE HA H 1 4.45 0.05 . . . . . . 23 ILE HA . 6700 1 116 . 1 1 13 13 ILE HB H 1 1.89 0.05 . . . . . . 23 ILE HB . 6700 1 117 . 1 1 13 13 ILE HG12 H 1 1.4 0.05 . . . . . . 23 ILE HG12 . 6700 1 118 . 1 1 13 13 ILE HG13 H 1 1.4 0.05 . . . . . . 23 ILE HG13 . 6700 1 119 . 1 1 13 13 ILE HG21 H 1 0.93 0.05 . . . . . . 23 ILE HG2 . 6700 1 120 . 1 1 13 13 ILE HG22 H 1 0.93 0.05 . . . . . . 23 ILE HG2 . 6700 1 121 . 1 1 13 13 ILE HG23 H 1 0.93 0.05 . . . . . . 23 ILE HG2 . 6700 1 122 . 1 1 13 13 ILE HD11 H 1 0.73 0.05 . . . . . . 23 ILE HD1 . 6700 1 123 . 1 1 13 13 ILE HD12 H 1 0.73 0.05 . . . . . . 23 ILE HD1 . 6700 1 124 . 1 1 13 13 ILE HD13 H 1 0.73 0.05 . . . . . . 23 ILE HD1 . 6700 1 125 . 1 1 13 13 ILE C C 13 177.58 0.4 . . . . . . 23 ILE C . 6700 1 126 . 1 1 13 13 ILE CA C 13 62.38 0.4 . . . . . . 23 ILE CA . 6700 1 127 . 1 1 13 13 ILE CG1 C 13 27.14 0.4 . . . . . . 23 ILE CG1 . 6700 1 128 . 1 1 13 13 ILE CG2 C 13 18.23 0.4 . . . . . . 23 ILE CG2 . 6700 1 129 . 1 1 13 13 ILE CD1 C 13 15.35 0.4 . . . . . . 23 ILE CD1 . 6700 1 130 . 1 1 13 13 ILE N N 15 115.31 0.4 . . . . . . 23 ILE N . 6700 1 131 . 1 1 14 14 LEU H H 1 7.72 0.05 . . . . . . 24 LEU H . 6700 1 132 . 1 1 14 14 LEU HA H 1 3.57 0.05 . . . . . . 24 LEU HA . 6700 1 133 . 1 1 14 14 LEU HB2 H 1 1.4 0.05 . . . . . . 24 LEU HB2 . 6700 1 134 . 1 1 14 14 LEU HG H 1 1.02 0.05 . . . . . . 24 LEU HG . 6700 1 135 . 1 1 14 14 LEU HD11 H 1 0.73 0.05 . . . . . . 24 LEU HD1 . 6700 1 136 . 1 1 14 14 LEU HD12 H 1 0.73 0.05 . . . . . . 24 LEU HD1 . 6700 1 137 . 1 1 14 14 LEU HD13 H 1 0.73 0.05 . . . . . . 24 LEU HD1 . 6700 1 138 . 1 1 14 14 LEU HD21 H 1 0.54 0.05 . . . . . . 24 LEU HD2 . 6700 1 139 . 1 1 14 14 LEU HD22 H 1 0.54 0.05 . . . . . . 24 LEU HD2 . 6700 1 140 . 1 1 14 14 LEU HD23 H 1 0.54 0.05 . . . . . . 24 LEU HD2 . 6700 1 141 . 1 1 14 14 LEU C C 13 177.03 0.4 . . . . . . 24 LEU C . 6700 1 142 . 1 1 14 14 LEU CA C 13 56.93 0.4 . . . . . . 24 LEU CA . 6700 1 143 . 1 1 14 14 LEU CB C 13 41.23 0.4 . . . . . . 24 LEU CB . 6700 1 144 . 1 1 14 14 LEU CD1 C 13 25.63 0.4 . . . . . . 24 LEU CD1 . 6700 1 145 . 1 1 14 14 LEU CD2 C 13 22.26 0.4 . . . . . . 24 LEU CD2 . 6700 1 146 . 1 1 14 14 LEU N N 15 117.96 0.4 . . . . . . 24 LEU N . 6700 1 147 . 1 1 15 15 PHE H H 1 7.54 0.05 . . . . . . 25 PHE H . 6700 1 148 . 1 1 15 15 PHE HA H 1 4.27 0.05 . . . . . . 25 PHE HA . 6700 1 149 . 1 1 15 15 PHE HB2 H 1 2.71 0.05 . . . . . . 25 PHE HB2 . 6700 1 150 . 1 1 15 15 PHE HB3 H 1 3.12 0.05 . . . . . . 25 PHE HB3 . 6700 1 151 . 1 1 15 15 PHE HD1 H 1 6.99 0.05 . . . . . . 25 PHE HD1 . 6700 1 152 . 1 1 15 15 PHE HD2 H 1 6.99 0.05 . . . . . . 25 PHE HD2 . 6700 1 153 . 1 1 15 15 PHE HE1 H 1 6.85 0.05 . . . . . . 25 PHE HE1 . 6700 1 154 . 1 1 15 15 PHE HE2 H 1 6.85 0.05 . . . . . . 25 PHE HE2 . 6700 1 155 . 1 1 15 15 PHE HZ H 1 6.80 0.05 . . . . . . 25 PHE HZ . 6700 1 156 . 1 1 15 15 PHE C C 13 174.31 0.4 . . . . . . 25 PHE C . 6700 1 157 . 1 1 15 15 PHE N N 15 112.58 0.4 . . . . . . 25 PHE N . 6700 1 158 . 1 1 16 16 GLY H H 1 7.56 0.05 . . . . . . 26 GLY H . 6700 1 159 . 1 1 16 16 GLY HA2 H 1 3.56 0.05 . . . . . . 26 GLY HA2 . 6700 1 160 . 1 1 16 16 GLY HA3 H 1 3.56 0.05 . . . . . . 26 GLY HA3 . 6700 1 161 . 1 1 16 16 GLY CA C 13 45.67 0.4 . . . . . . 26 GLY CA . 6700 1 162 . 1 1 16 16 GLY N N 15 107.55 0.4 . . . . . . 26 GLY N . 6700 1 163 . 1 1 17 17 ASN H H 1 8.16 0.05 . . . . . . 27 ASN H . 6700 1 164 . 1 1 17 17 ASN HA H 1 4.2 0.05 . . . . . . 27 ASN HA . 6700 1 165 . 1 1 17 17 ASN N N 15 112.83 0.4 . . . . . . 27 ASN N . 6700 1 166 . 1 1 18 18 ILE H H 1 6.2 0.05 . . . . . . 28 ILE H . 6700 1 167 . 1 1 18 18 ILE HA H 1 5.5 0.05 . . . . . . 28 ILE HA . 6700 1 168 . 1 1 18 18 ILE HG21 H 1 0.6 0.05 . . . . . . 28 ILE HG2 . 6700 1 169 . 1 1 18 18 ILE HG22 H 1 0.6 0.05 . . . . . . 28 ILE HG2 . 6700 1 170 . 1 1 18 18 ILE HG23 H 1 0.6 0.05 . . . . . . 28 ILE HG2 . 6700 1 171 . 1 1 18 18 ILE HD11 H 1 0.73 0.05 . . . . . . 28 ILE HD1 . 6700 1 172 . 1 1 18 18 ILE HD12 H 1 0.73 0.05 . . . . . . 28 ILE HD1 . 6700 1 173 . 1 1 18 18 ILE HD13 H 1 0.73 0.05 . . . . . . 28 ILE HD1 . 6700 1 174 . 1 1 18 18 ILE CA C 13 57.9 0.4 . . . . . . 28 ILE CA . 6700 1 175 . 1 1 18 18 ILE CG2 C 13 16.79 0.4 . . . . . . 28 ILE CG2 . 6700 1 176 . 1 1 18 18 ILE CD1 C 13 14.19 0.4 . . . . . . 28 ILE CD1 . 6700 1 177 . 1 1 18 18 ILE N N 15 107.98 0.4 . . . . . . 28 ILE N . 6700 1 178 . 1 1 19 19 ASP H H 1 8.55 0.05 . . . . . . 29 ASP H . 6700 1 179 . 1 1 19 19 ASP HB2 H 1 2.61 0.05 . . . . . . 29 ASP HB2 . 6700 1 180 . 1 1 19 19 ASP HB3 H 1 3.36 0.05 . . . . . . 29 ASP HB3 . 6700 1 181 . 1 1 19 19 ASP CA C 13 59.54 0.4 . . . . . . 29 ASP CA . 6700 1 182 . 1 1 19 19 ASP CB C 13 41.77 0.4 . . . . . . 29 ASP CB . 6700 1 183 . 1 1 19 19 ASP N N 15 122.18 0.4 . . . . . . 29 ASP N . 6700 1 184 . 1 1 20 20 SER H H 1 8.3 0.05 . . . . . . 30 SER H . 6700 1 185 . 1 1 20 20 SER HA H 1 4.18 0.05 . . . . . . 30 SER HA . 6700 1 186 . 1 1 20 20 SER HB2 H 1 3.96 0.05 . . . . . . 30 SER HB2 . 6700 1 187 . 1 1 20 20 SER CA C 13 60.83 0.4 . . . . . . 30 SER CA . 6700 1 188 . 1 1 20 20 SER CB C 13 62.77 0.4 . . . . . . 30 SER CB . 6700 1 189 . 1 1 20 20 SER N N 15 111.36 0.4 . . . . . . 30 SER N . 6700 1 190 . 1 1 21 21 GLU H H 1 8.09 0.05 . . . . . . 31 GLU H . 6700 1 191 . 1 1 21 21 GLU HA H 1 4.41 0.05 . . . . . . 31 GLU HA . 6700 1 192 . 1 1 21 21 GLU HB2 H 1 1.9 0.05 . . . . . . 31 GLU HB2 . 6700 1 193 . 1 1 21 21 GLU HB3 H 1 2.3 0.05 . . . . . . 31 GLU HB3 . 6700 1 194 . 1 1 21 21 GLU HG2 H 1 2.09 0.05 . . . . . . 31 GLU HG2 . 6700 1 195 . 1 1 21 21 GLU HG3 H 1 2.20 0.05 . . . . . . 31 GLU HG3 . 6700 1 196 . 1 1 21 21 GLU CA C 13 55.27 0.4 . . . . . . 31 GLU CA . 6700 1 197 . 1 1 21 21 GLU CB C 13 30.26 0.4 . . . . . . 31 GLU CB . 6700 1 198 . 1 1 21 21 GLU CG C 13 36.78 0.4 . . . . . . 31 GLU CG . 6700 1 199 . 1 1 21 21 GLU N N 15 118.04 0.4 . . . . . . 31 GLU N . 6700 1 200 . 1 1 22 22 GLY H H 1 8.16 0.05 . . . . . . 32 GLY H . 6700 1 201 . 1 1 22 22 GLY N N 15 108.05 0.4 . . . . . . 32 GLY N . 6700 1 202 . 1 1 23 23 ARG H H 1 8.48 0.05 . . . . . . 33 ARG H . 6700 1 203 . 1 1 23 23 ARG HA H 1 4.24 0.05 . . . . . . 33 ARG HA . 6700 1 204 . 1 1 23 23 ARG HB2 H 1 1.89 0.05 . . . . . . 33 ARG HB2 . 6700 1 205 . 1 1 23 23 ARG HB3 H 1 1.89 0.05 . . . . . . 33 ARG HB3 . 6700 1 206 . 1 1 23 23 ARG HG2 H 1 1.46 0.05 . . . . . . 33 ARG HG2 . 6700 1 207 . 1 1 23 23 ARG HG3 H 1 1.61 0.05 . . . . . . 33 ARG HG3 . 6700 1 208 . 1 1 23 23 ARG HD2 H 1 3.13 0.05 . . . . . . 33 ARG HD2 . 6700 1 209 . 1 1 23 23 ARG HD3 H 1 3.23 0.05 . . . . . . 33 ARG HD3 . 6700 1 210 . 1 1 23 23 ARG HH11 H 1 7.73 0.05 . . . . . . 33 ARG HH11 . 6700 1 211 . 1 1 23 23 ARG HH12 H 1 7.77 0.05 . . . . . . 33 ARG HH12 . 6700 1 212 . 1 1 23 23 ARG CG C 13 28.24 0.4 . . . . . . 33 ARG CG . 6700 1 213 . 1 1 23 23 ARG CD C 13 43.3 0.4 . . . . . . 33 ARG CD . 6700 1 214 . 1 1 23 23 ARG N N 15 122.19 0.4 . . . . . . 33 ARG N . 6700 1 215 . 1 1 23 23 ARG NH1 N 15 86.37 0.4 . . . . . . 33 ARG NH1 . 6700 1 216 . 1 1 24 24 LEU H H 1 8.29 0.05 . . . . . . 34 LEU H . 6700 1 217 . 1 1 24 24 LEU HA H 1 4.29 0.05 . . . . . . 34 LEU HA . 6700 1 218 . 1 1 24 24 LEU HB2 H 1 1.4 0.05 . . . . . . 34 LEU HB2 . 6700 1 219 . 1 1 24 24 LEU HB3 H 1 1.4 0.05 . . . . . . 34 LEU HB3 . 6700 1 220 . 1 1 24 24 LEU HD11 H 1 0.7 0.05 . . . . . . 34 LEU HD1 . 6700 1 221 . 1 1 24 24 LEU HD12 H 1 0.7 0.05 . . . . . . 34 LEU HD1 . 6700 1 222 . 1 1 24 24 LEU HD13 H 1 0.7 0.05 . . . . . . 34 LEU HD1 . 6700 1 223 . 1 1 24 24 LEU HD21 H 1 0.85 0.05 . . . . . . 34 LEU HD2 . 6700 1 224 . 1 1 24 24 LEU HD22 H 1 0.85 0.05 . . . . . . 34 LEU HD2 . 6700 1 225 . 1 1 24 24 LEU HD23 H 1 0.85 0.05 . . . . . . 34 LEU HD2 . 6700 1 226 . 1 1 24 24 LEU C C 13 177.06 0.4 . . . . . . 34 LEU C . 6700 1 227 . 1 1 24 24 LEU CA C 13 54.5 0.4 . . . . . . 34 LEU CA . 6700 1 228 . 1 1 24 24 LEU CB C 13 43.43 0.4 . . . . . . 34 LEU CB . 6700 1 229 . 1 1 24 24 LEU CD1 C 13 25.62 0.4 . . . . . . 34 LEU CD1 . 6700 1 230 . 1 1 24 24 LEU CD2 C 13 23.9 0.4 . . . . . . 34 LEU CD2 . 6700 1 231 . 1 1 24 24 LEU N N 15 122.78 0.4 . . . . . . 34 LEU N . 6700 1 232 . 1 1 25 25 LEU H H 1 8.3 0.05 . . . . . . 35 LEU H . 6700 1 233 . 1 1 25 25 LEU HA H 1 4.28 0.05 . . . . . . 35 LEU HA . 6700 1 234 . 1 1 25 25 LEU HB2 H 1 1.59 0.05 . . . . . . 35 LEU HB2 . 6700 1 235 . 1 1 25 25 LEU HB3 H 1 1.59 0.05 . . . . . . 35 LEU HB3 . 6700 1 236 . 1 1 25 25 LEU HG H 1 1.59 0.05 . . . . . . 35 LEU HG . 6700 1 237 . 1 1 25 25 LEU HD11 H 1 0.69 0.05 . . . . . . 35 LEU HD1 . 6700 1 238 . 1 1 25 25 LEU HD12 H 1 0.69 0.05 . . . . . . 35 LEU HD1 . 6700 1 239 . 1 1 25 25 LEU HD13 H 1 0.69 0.05 . . . . . . 35 LEU HD1 . 6700 1 240 . 1 1 25 25 LEU HD21 H 1 0.8 0.05 . . . . . . 35 LEU HD2 . 6700 1 241 . 1 1 25 25 LEU HD22 H 1 0.8 0.05 . . . . . . 35 LEU HD2 . 6700 1 242 . 1 1 25 25 LEU HD23 H 1 0.8 0.05 . . . . . . 35 LEU HD2 . 6700 1 243 . 1 1 25 25 LEU C C 13 177.35 0.4 . . . . . . 35 LEU C . 6700 1 244 . 1 1 25 25 LEU CA C 13 54.51 0.4 . . . . . . 35 LEU CA . 6700 1 245 . 1 1 25 25 LEU CB C 13 42.53 0.4 . . . . . . 35 LEU CB . 6700 1 246 . 1 1 25 25 LEU CG C 13 27.62 0.4 . . . . . . 35 LEU CG . 6700 1 247 . 1 1 25 25 LEU CD1 C 13 25.63 0.4 . . . . . . 35 LEU CD1 . 6700 1 248 . 1 1 25 25 LEU CD2 C 13 23.05 0.4 . . . . . . 35 LEU CD2 . 6700 1 249 . 1 1 25 25 LEU N N 15 127.23 0.4 . . . . . . 35 LEU N . 6700 1 250 . 1 1 26 26 GLN H H 1 8.63 0.05 . . . . . . 36 GLN H . 6700 1 251 . 1 1 26 26 GLN HA H 1 4.35 0.05 . . . . . . 36 GLN HA . 6700 1 252 . 1 1 26 26 GLN HB2 H 1 1.91 0.05 . . . . . . 36 GLN HB2 . 6700 1 253 . 1 1 26 26 GLN HB3 H 1 2.05 0.05 . . . . . . 36 GLN HB3 . 6700 1 254 . 1 1 26 26 GLN HG2 H 1 2.3 0.05 . . . . . . 36 GLN HG2 . 6700 1 255 . 1 1 26 26 GLN HG3 H 1 2.3 0.05 . . . . . . 36 GLN HG3 . 6700 1 256 . 1 1 26 26 GLN HE21 H 1 7.68 0.05 . . . . . . 36 GLN HE21 . 6700 1 257 . 1 1 26 26 GLN HE22 H 1 6.87 0.05 . . . . . . 36 GLN HE22 . 6700 1 258 . 1 1 26 26 GLN C C 13 175.24 0.4 . . . . . . 36 GLN C . 6700 1 259 . 1 1 26 26 GLN CA C 13 55.66 0.4 . . . . . . 36 GLN CA . 6700 1 260 . 1 1 26 26 GLN CB C 13 30.14 0.4 . . . . . . 36 GLN CB . 6700 1 261 . 1 1 26 26 GLN CG C 13 34.15 0.4 . . . . . . 36 GLN CG . 6700 1 262 . 1 1 26 26 GLN N N 15 122.71 0.4 . . . . . . 36 GLN N . 6700 1 263 . 1 1 26 26 GLN NE2 N 15 112.4 0.4 . . . . . . 36 GLN NE2 . 6700 1 264 . 1 1 27 27 ASP H H 1 8.52 0.05 . . . . . . 37 ASP H . 6700 1 265 . 1 1 27 27 ASP HA H 1 4.63 0.05 . . . . . . 37 ASP HA . 6700 1 266 . 1 1 27 27 ASP HB2 H 1 2.59 0.05 . . . . . . 37 ASP HB2 . 6700 1 267 . 1 1 27 27 ASP HB3 H 1 2.71 0.05 . . . . . . 37 ASP HB3 . 6700 1 268 . 1 1 27 27 ASP C C 13 175.81 0.4 . . . . . . 37 ASP C . 6700 1 269 . 1 1 27 27 ASP CA C 13 54.38 0.4 . . . . . . 37 ASP CA . 6700 1 270 . 1 1 27 27 ASP CB C 13 41.68 0.4 . . . . . . 37 ASP CB . 6700 1 271 . 1 1 27 27 ASP N N 15 124.01 0.4 . . . . . . 37 ASP N . 6700 1 272 . 1 1 28 28 ASP H H 1 8.4 0.05 . . . . . . 38 ASP H . 6700 1 273 . 1 1 28 28 ASP HA H 1 4.6 0.05 . . . . . . 38 ASP HA . 6700 1 274 . 1 1 28 28 ASP HB2 H 1 2.71 0.05 . . . . . . 38 ASP HB2 . 6700 1 275 . 1 1 28 28 ASP HB3 H 1 2.71 0.05 . . . . . . 38 ASP HB3 . 6700 1 276 . 1 1 28 28 ASP C C 13 175.81 0.4 . . . . . . 38 ASP C . 6700 1 277 . 1 1 28 28 ASP CA C 13 54.54 0.4 . . . . . . 38 ASP CA . 6700 1 278 . 1 1 28 28 ASP CB C 13 41.63 0.4 . . . . . . 38 ASP CB . 6700 1 279 . 1 1 28 28 ASP N N 15 121.46 0.4 . . . . . . 38 ASP N . 6700 1 280 . 1 1 29 29 ASP H H 1 8.38 0.05 . . . . . . 39 ASP H . 6700 1 281 . 1 1 29 29 ASP HA H 1 4.59 0.05 . . . . . . 39 ASP HA . 6700 1 282 . 1 1 29 29 ASP HB2 H 1 2.71 0.05 . . . . . . 39 ASP HB2 . 6700 1 283 . 1 1 29 29 ASP HB3 H 1 2.71 0.05 . . . . . . 39 ASP HB3 . 6700 1 284 . 1 1 29 29 ASP C C 13 177.08 0.4 . . . . . . 39 ASP C . 6700 1 285 . 1 1 29 29 ASP CA C 13 54.6 0.4 . . . . . . 39 ASP CA . 6700 1 286 . 1 1 29 29 ASP CB C 13 41.33 0.4 . . . . . . 39 ASP CB . 6700 1 287 . 1 1 29 29 ASP N N 15 121.25 0.4 . . . . . . 39 ASP N . 6700 1 288 . 1 1 30 30 GLY H H 1 8.44 0.05 . . . . . . 40 GLY H . 6700 1 289 . 1 1 30 30 GLY HA2 H 1 3.96 0.05 . . . . . . 40 GLY HA2 . 6700 1 290 . 1 1 30 30 GLY HA3 H 1 3.96 0.05 . . . . . . 40 GLY HA3 . 6700 1 291 . 1 1 30 30 GLY C C 13 174.81 0.4 . . . . . . 40 GLY C . 6700 1 292 . 1 1 30 30 GLY CA C 13 45.84 0.4 . . . . . . 40 GLY CA . 6700 1 293 . 1 1 30 30 GLY N N 15 109.53 0.4 . . . . . . 40 GLY N . 6700 1 294 . 1 1 31 31 GLU H H 1 8.37 0.05 . . . . . . 41 GLU H . 6700 1 295 . 1 1 31 31 GLU HA H 1 4.27 0.05 . . . . . . 41 GLU HA . 6700 1 296 . 1 1 31 31 GLU HB2 H 1 1.96 0.05 . . . . . . 41 GLU HB2 . 6700 1 297 . 1 1 31 31 GLU HB3 H 1 2.09 0.05 . . . . . . 41 GLU HB3 . 6700 1 298 . 1 1 31 31 GLU HG2 H 1 2.23 0.05 . . . . . . 41 GLU HG2 . 6700 1 299 . 1 1 31 31 GLU HG3 H 1 2.26 0.05 . . . . . . 41 GLU HG3 . 6700 1 300 . 1 1 31 31 GLU C C 13 177.4 0.4 . . . . . . 41 GLU C . 6700 1 301 . 1 1 31 31 GLU CA C 13 56.83 0.4 . . . . . . 41 GLU CA . 6700 1 302 . 1 1 31 31 GLU CB C 13 30.11 0.4 . . . . . . 41 GLU CB . 6700 1 303 . 1 1 31 31 GLU CG C 13 36.31 0.4 . . . . . . 41 GLU CG . 6700 1 304 . 1 1 31 31 GLU N N 15 120.74 0.4 . . . . . . 41 GLU N . 6700 1 305 . 1 1 32 32 GLY H H 1 8.49 0.05 . . . . . . 42 GLY H . 6700 1 306 . 1 1 32 32 GLY HA2 H 1 3.97 0.05 . . . . . . 42 GLY HA2 . 6700 1 307 . 1 1 32 32 GLY HA3 H 1 3.97 0.05 . . . . . . 42 GLY HA3 . 6700 1 308 . 1 1 32 32 GLY C C 13 174.9 0.4 . . . . . . 42 GLY C . 6700 1 309 . 1 1 32 32 GLY CA C 13 45.87 0.4 . . . . . . 42 GLY CA . 6700 1 310 . 1 1 32 32 GLY N N 15 110 0.4 . . . . . . 42 GLY N . 6700 1 311 . 1 1 33 33 ARG H H 1 8.25 0.05 . . . . . . 43 ARG H . 6700 1 312 . 1 1 33 33 ARG HA H 1 4.36 0.05 . . . . . . 43 ARG HA . 6700 1 313 . 1 1 33 33 ARG HB2 H 1 1.93 0.05 . . . . . . 43 ARG HB2 . 6700 1 314 . 1 1 33 33 ARG HB3 H 1 1.76 0.05 . . . . . . 43 ARG HB3 . 6700 1 315 . 1 1 33 33 ARG HG2 H 1 1.6 0.05 . . . . . . 43 ARG HG2 . 6700 1 316 . 1 1 33 33 ARG HG3 H 1 1.6 0.05 . . . . . . 43 ARG HG3 . 6700 1 317 . 1 1 33 33 ARG HD2 H 1 3.17 0.05 . . . . . . 43 ARG HD2 . 6700 1 318 . 1 1 33 33 ARG HD3 H 1 3.17 0.05 . . . . . . 43 ARG HD3 . 6700 1 319 . 1 1 33 33 ARG C C 13 177.15 0.4 . . . . . . 43 ARG C . 6700 1 320 . 1 1 33 33 ARG CA C 13 56.4 0.4 . . . . . . 43 ARG CA . 6700 1 321 . 1 1 33 33 ARG CB C 13 30.54 0.4 . . . . . . 43 ARG CB . 6700 1 322 . 1 1 33 33 ARG CG C 13 27.31 0.4 . . . . . . 43 ARG CG . 6700 1 323 . 1 1 33 33 ARG CD C 13 43.15 0.4 . . . . . . 43 ARG CD . 6700 1 324 . 1 1 33 33 ARG N N 15 120.63 0.4 . . . . . . 43 ARG N . 6700 1 325 . 1 1 34 34 GLY H H 1 8.58 0.05 . . . . . . 44 GLY H . 6700 1 326 . 1 1 34 34 GLY HA2 H 1 3.98 0.05 . . . . . . 44 GLY HA2 . 6700 1 327 . 1 1 34 34 GLY HA3 H 1 3.98 0.05 . . . . . . 44 GLY HA3 . 6700 1 328 . 1 1 34 34 GLY C C 13 174.94 0.4 . . . . . . 44 GLY C . 6700 1 329 . 1 1 34 34 GLY CA C 13 45.62 0.4 . . . . . . 44 GLY CA . 6700 1 330 . 1 1 34 34 GLY N N 15 110.18 0.4 . . . . . . 44 GLY N . 6700 1 331 . 1 1 35 35 GLY H H 1 8.31 0.05 . . . . . . 45 GLY H . 6700 1 332 . 1 1 35 35 GLY HA2 H 1 4.01 0.05 . . . . . . 45 GLY HA2 . 6700 1 333 . 1 1 35 35 GLY HA3 H 1 4.01 0.05 . . . . . . 45 GLY HA3 . 6700 1 334 . 1 1 35 35 GLY C C 13 174.6 0.4 . . . . . . 45 GLY C . 6700 1 335 . 1 1 35 35 GLY CA C 13 45.53 0.4 . . . . . . 45 GLY CA . 6700 1 336 . 1 1 35 35 GLY N N 15 109.37 0.4 . . . . . . 45 GLY N . 6700 1 337 . 1 1 36 36 THR H H 1 8.11 0.05 . . . . . . 46 THR H . 6700 1 338 . 1 1 36 36 THR HA H 1 4.35 0.05 . . . . . . 46 THR HA . 6700 1 339 . 1 1 36 36 THR HB H 1 4.18 0.05 . . . . . . 46 THR HB . 6700 1 340 . 1 1 36 36 THR HG21 H 1 1.16 0.05 . . . . . . 46 THR HG1 . 6700 1 341 . 1 1 36 36 THR HG22 H 1 1.16 0.05 . . . . . . 46 THR HG1 . 6700 1 342 . 1 1 36 36 THR HG23 H 1 1.16 0.05 . . . . . . 46 THR HG1 . 6700 1 343 . 1 1 36 36 THR C C 13 175.04 0.4 . . . . . . 46 THR C . 6700 1 344 . 1 1 36 36 THR CA C 13 61.76 0.4 . . . . . . 46 THR CA . 6700 1 345 . 1 1 36 36 THR CB C 13 70.02 0.4 . . . . . . 46 THR CB . 6700 1 346 . 1 1 36 36 THR CG2 C 13 21.54 0.4 . . . . . . 46 THR CG2 . 6700 1 347 . 1 1 36 36 THR N N 15 112.75 0.4 . . . . . . 46 THR N . 6700 1 348 . 1 1 37 37 GLY H H 1 8.33 0.05 . . . . . . 47 GLY H . 6700 1 349 . 1 1 37 37 GLY HA2 H 1 3.78 0.05 . . . . . . 47 GLY HA2 . 6700 1 350 . 1 1 37 37 GLY HA3 H 1 3.78 0.05 . . . . . . 47 GLY HA3 . 6700 1 351 . 1 1 37 37 GLY C C 13 173.99 0.4 . . . . . . 47 GLY C . 6700 1 352 . 1 1 37 37 GLY CA C 13 44.99 0.4 . . . . . . 47 GLY CA . 6700 1 353 . 1 1 37 37 GLY N N 15 111.2 0.4 . . . . . . 47 GLY N . 6700 1 354 . 1 1 38 38 PHE H H 1 8.35 0.05 . . . . . . 48 PHE H . 6700 1 355 . 1 1 38 38 PHE HA H 1 4.64 0.05 . . . . . . 48 PHE HA . 6700 1 356 . 1 1 38 38 PHE HB2 H 1 2.71 0.05 . . . . . . 48 PHE HB2 . 6700 1 357 . 1 1 38 38 PHE HB3 H 1 3.09 0.05 . . . . . . 48 PHE HB3 . 6700 1 358 . 1 1 38 38 PHE HD1 H 1 7.24 0.05 . . . . . . 48 PHE HD1 . 6700 1 359 . 1 1 38 38 PHE HD2 H 1 7.24 0.05 . . . . . . 48 PHE HD2 . 6700 1 360 . 1 1 38 38 PHE HE1 H 1 7.35 0.05 . . . . . . 48 PHE HE1 . 6700 1 361 . 1 1 38 38 PHE HE2 H 1 7.35 0.05 . . . . . . 48 PHE HE2 . 6700 1 362 . 1 1 38 38 PHE HZ H 1 7.4 0.05 . . . . . . 48 PHE HZ . 6700 1 363 . 1 1 38 38 PHE C C 13 175.85 0.4 . . . . . . 48 PHE C . 6700 1 364 . 1 1 38 38 PHE CA C 13 56.2 0.4 . . . . . . 48 PHE CA . 6700 1 365 . 1 1 38 38 PHE CB C 13 42.53 0.4 . . . . . . 48 PHE CB . 6700 1 366 . 1 1 38 38 PHE N N 15 119.8 0.4 . . . . . . 48 PHE N . 6700 1 367 . 1 1 39 39 ASP H H 1 8.63 0.05 . . . . . . 49 ASP H . 6700 1 368 . 1 1 39 39 ASP HA H 1 4.35 0.05 . . . . . . 49 ASP HA . 6700 1 369 . 1 1 39 39 ASP HB2 H 1 2.2 0.05 . . . . . . 49 ASP HB2 . 6700 1 370 . 1 1 39 39 ASP HB3 H 1 2.43 0.05 . . . . . . 49 ASP HB3 . 6700 1 371 . 1 1 39 39 ASP C C 13 177.03 0.4 . . . . . . 49 ASP C . 6700 1 372 . 1 1 39 39 ASP CA C 13 53.73 0.4 . . . . . . 49 ASP CA . 6700 1 373 . 1 1 39 39 ASP CB C 13 42.24 0.4 . . . . . . 49 ASP CB . 6700 1 374 . 1 1 39 39 ASP N N 15 122.71 0.4 . . . . . . 49 ASP N . 6700 1 375 . 1 1 40 40 ALA H H 1 8.61 0.05 . . . . . . 50 ALA H . 6700 1 376 . 1 1 40 40 ALA HA H 1 3.83 0.05 . . . . . . 50 ALA HA . 6700 1 377 . 1 1 40 40 ALA HB1 H 1 1.37 0.05 . . . . . . 50 ALA HB . 6700 1 378 . 1 1 40 40 ALA HB2 H 1 1.37 0.05 . . . . . . 50 ALA HB . 6700 1 379 . 1 1 40 40 ALA HB3 H 1 1.37 0.05 . . . . . . 50 ALA HB . 6700 1 380 . 1 1 40 40 ALA C C 13 178.52 0.4 . . . . . . 50 ALA C . 6700 1 381 . 1 1 40 40 ALA CA C 13 55.82 0.4 . . . . . . 50 ALA CA . 6700 1 382 . 1 1 40 40 ALA CB C 13 18.73 0.4 . . . . . . 50 ALA CB . 6700 1 383 . 1 1 40 40 ALA N N 15 127.05 0.4 . . . . . . 50 ALA N . 6700 1 384 . 1 1 41 41 GLU H H 1 8.72 0.05 . . . . . . 51 GLU H . 6700 1 385 . 1 1 41 41 GLU HA H 1 3.82 0.05 . . . . . . 51 GLU HA . 6700 1 386 . 1 1 41 41 GLU HB2 H 1 1.57 0.05 . . . . . . 51 GLU HB2 . 6700 1 387 . 1 1 41 41 GLU HB3 H 1 1.69 0.05 . . . . . . 51 GLU HB3 . 6700 1 388 . 1 1 41 41 GLU HG2 H 1 1.97 0.05 . . . . . . 51 GLU HG2 . 6700 1 389 . 1 1 41 41 GLU HG3 H 1 2.1 0.05 . . . . . . 51 GLU HG3 . 6700 1 390 . 1 1 41 41 GLU C C 13 178.27 0.4 . . . . . . 51 GLU C . 6700 1 391 . 1 1 41 41 GLU CA C 13 59.37 0.4 . . . . . . 51 GLU CA . 6700 1 392 . 1 1 41 41 GLU CB C 13 29.47 0.4 . . . . . . 51 GLU CB . 6700 1 393 . 1 1 41 41 GLU CG C 13 37.09 0.4 . . . . . . 51 GLU CG . 6700 1 394 . 1 1 41 41 GLU N N 15 115.51 0.4 . . . . . . 51 GLU N . 6700 1 395 . 1 1 42 42 LEU H H 1 7.08 0.05 . . . . . . 52 LEU H . 6700 1 396 . 1 1 42 42 LEU HA H 1 4.18 0.05 . . . . . . 52 LEU HA . 6700 1 397 . 1 1 42 42 LEU HB2 H 1 1.32 0.05 . . . . . . 52 LEU HB2 . 6700 1 398 . 1 1 42 42 LEU HB3 H 1 1.55 0.05 . . . . . . 52 LEU HB3 . 6700 1 399 . 1 1 42 42 LEU HG H 1 1.06 0.05 . . . . . . 52 LEU HG . 6700 1 400 . 1 1 42 42 LEU HD11 H 1 0.4 0.05 . . . . . . 52 LEU HD1 . 6700 1 401 . 1 1 42 42 LEU HD12 H 1 0.4 0.05 . . . . . . 52 LEU HD1 . 6700 1 402 . 1 1 42 42 LEU HD13 H 1 0.4 0.05 . . . . . . 52 LEU HD1 . 6700 1 403 . 1 1 42 42 LEU HD21 H 1 0.11 0.05 . . . . . . 52 LEU HD2 . 6700 1 404 . 1 1 42 42 LEU HD22 H 1 0.11 0.05 . . . . . . 52 LEU HD2 . 6700 1 405 . 1 1 42 42 LEU HD23 H 1 0.11 0.05 . . . . . . 52 LEU HD2 . 6700 1 406 . 1 1 42 42 LEU C C 13 177.84 0.4 . . . . . . 52 LEU C . 6700 1 407 . 1 1 42 42 LEU CA C 13 57.84 0.4 . . . . . . 52 LEU CA . 6700 1 408 . 1 1 42 42 LEU CG C 13 27.78 0.4 . . . . . . 52 LEU CG . 6700 1 409 . 1 1 42 42 LEU CD1 C 13 24.4 0.4 . . . . . . 52 LEU CD1 . 6700 1 410 . 1 1 42 42 LEU CD2 C 13 24.56 0.4 . . . . . . 52 LEU CD2 . 6700 1 411 . 1 1 42 42 LEU N N 15 117.32 0.4 . . . . . . 52 LEU N . 6700 1 412 . 1 1 43 43 ARG H H 1 7.71 0.05 . . . . . . 53 ARG H . 6700 1 413 . 1 1 43 43 ARG HA H 1 3.6 0.05 . . . . . . 53 ARG HA . 6700 1 414 . 1 1 43 43 ARG HB2 H 1 1.74 0.05 . . . . . . 53 ARG HB2 . 6700 1 415 . 1 1 43 43 ARG HB3 H 1 1.77 0.05 . . . . . . 53 ARG HB3 . 6700 1 416 . 1 1 43 43 ARG HG2 H 1 1.45 0.05 . . . . . . 53 ARG HG2 . 6700 1 417 . 1 1 43 43 ARG HG3 H 1 1.6 0.05 . . . . . . 53 ARG HG3 . 6700 1 418 . 1 1 43 43 ARG HD2 H 1 3.13 0.05 . . . . . . 53 ARG HD2 . 6700 1 419 . 1 1 43 43 ARG HD3 H 1 3.13 0.05 . . . . . . 53 ARG HD3 . 6700 1 420 . 1 1 43 43 ARG C C 13 178.47 0.4 . . . . . . 53 ARG C . 6700 1 421 . 1 1 43 43 ARG CA C 13 60.52 0.4 . . . . . . 53 ARG CA . 6700 1 422 . 1 1 43 43 ARG CB C 13 30.99 0.4 . . . . . . 53 ARG CB . 6700 1 423 . 1 1 43 43 ARG CG C 13 28.55 0.4 . . . . . . 53 ARG CG . 6700 1 424 . 1 1 43 43 ARG CD C 13 43.31 0.4 . . . . . . 53 ARG CD . 6700 1 425 . 1 1 43 43 ARG N N 15 115.87 0.4 . . . . . . 53 ARG N . 6700 1 426 . 1 1 44 44 GLU H H 1 8.5 0.05 . . . . . . 54 GLU H . 6700 1 427 . 1 1 44 44 GLU HA H 1 4.19 0.05 . . . . . . 54 GLU HA . 6700 1 428 . 1 1 44 44 GLU HB2 H 1 1.86 0.05 . . . . . . 54 GLU HB2 . 6700 1 429 . 1 1 44 44 GLU HB3 H 1 2.12 0.05 . . . . . . 54 GLU HB3 . 6700 1 430 . 1 1 44 44 GLU HG2 H 1 2.27 0.05 . . . . . . 54 GLU HG2 . 6700 1 431 . 1 1 44 44 GLU HG3 H 1 2.37 0.05 . . . . . . 54 GLU HG3 . 6700 1 432 . 1 1 44 44 GLU C C 13 177.38 0.4 . . . . . . 54 GLU C . 6700 1 433 . 1 1 44 44 GLU CA C 13 57.58 0.4 . . . . . . 54 GLU CA . 6700 1 434 . 1 1 44 44 GLU CB C 13 30 0.4 . . . . . . 54 GLU CB . 6700 1 435 . 1 1 44 44 GLU CG C 13 36.63 0.4 . . . . . . 54 GLU CG . 6700 1 436 . 1 1 44 44 GLU N N 15 114.65 0.4 . . . . . . 54 GLU N . 6700 1 437 . 1 1 45 45 ASN H H 1 7.46 0.05 . . . . . . 55 ASN H . 6700 1 438 . 1 1 45 45 ASN HA H 1 5.32 0.05 . . . . . . 55 ASN HA . 6700 1 439 . 1 1 45 45 ASN HB2 H 1 2.69 0.05 . . . . . . 55 ASN HB2 . 6700 1 440 . 1 1 45 45 ASN HB3 H 1 3.29 0.05 . . . . . . 55 ASN HB3 . 6700 1 441 . 1 1 45 45 ASN C C 13 175.6 0.4 . . . . . . 55 ASN C . 6700 1 442 . 1 1 45 45 ASN CA C 13 53.82 0.4 . . . . . . 55 ASN CA . 6700 1 443 . 1 1 45 45 ASN CB C 13 40.94 0.4 . . . . . . 55 ASN CB . 6700 1 444 . 1 1 45 45 ASN N N 15 114.87 0.4 . . . . . . 55 ASN N . 6700 1 445 . 1 1 46 46 ILE H H 1 7.26 0.05 . . . . . . 56 ILE H . 6700 1 446 . 1 1 46 46 ILE HA H 1 3.72 0.05 . . . . . . 56 ILE HA . 6700 1 447 . 1 1 46 46 ILE HB H 1 1.88 0.05 . . . . . . 56 ILE HB . 6700 1 448 . 1 1 46 46 ILE HG12 H 1 1.13 0.05 . . . . . . 56 ILE HG12 . 6700 1 449 . 1 1 46 46 ILE HG13 H 1 1.45 0.05 . . . . . . 56 ILE HG13 . 6700 1 450 . 1 1 46 46 ILE HG21 H 1 0.81 0.05 . . . . . . 56 ILE HG2 . 6700 1 451 . 1 1 46 46 ILE HG22 H 1 0.81 0.05 . . . . . . 56 ILE HG2 . 6700 1 452 . 1 1 46 46 ILE HG23 H 1 0.81 0.05 . . . . . . 56 ILE HG2 . 6700 1 453 . 1 1 46 46 ILE HD11 H 1 0.50 0.05 . . . . . . 56 ILE HD1 . 6700 1 454 . 1 1 46 46 ILE HD12 H 1 0.50 0.05 . . . . . . 56 ILE HD1 . 6700 1 455 . 1 1 46 46 ILE HD13 H 1 0.50 0.05 . . . . . . 56 ILE HD1 . 6700 1 456 . 1 1 46 46 ILE C C 13 177.4 0.4 . . . . . . 56 ILE C . 6700 1 457 . 1 1 46 46 ILE CA C 13 63.86 0.4 . . . . . . 56 ILE CA . 6700 1 458 . 1 1 46 46 ILE CB C 13 38.05 0.4 . . . . . . 56 ILE CB . 6700 1 459 . 1 1 46 46 ILE CG1 C 13 28.24 0.4 . . . . . . 56 ILE CG1 . 6700 1 460 . 1 1 46 46 ILE CG2 C 13 17.91 0.4 . . . . . . 56 ILE CG2 . 6700 1 461 . 1 1 46 46 ILE CD1 C 13 13.63 0.4 . . . . . . 56 ILE CD1 . 6700 1 462 . 1 1 46 46 ILE N N 15 120.68 0.4 . . . . . . 56 ILE N . 6700 1 463 . 1 1 47 47 GLY H H 1 8.81 0.05 . . . . . . 57 GLY H . 6700 1 464 . 1 1 47 47 GLY HA2 H 1 4.05 0.05 . . . . . . 57 GLY HA2 . 6700 1 465 . 1 1 47 47 GLY HA3 H 1 4.05 0.05 . . . . . . 57 GLY HA3 . 6700 1 466 . 1 1 47 47 GLY C C 13 175.99 0.4 . . . . . . 57 GLY C . 6700 1 467 . 1 1 47 47 GLY CA C 13 46.77 0.4 . . . . . . 57 GLY CA . 6700 1 468 . 1 1 47 47 GLY N N 15 108.75 0.4 . . . . . . 57 GLY N . 6700 1 469 . 1 1 48 48 SER H H 1 7.85 0.05 . . . . . . 58 SER H . 6700 1 470 . 1 1 48 48 SER HA H 1 4.18 0.05 . . . . . . 58 SER HA . 6700 1 471 . 1 1 48 48 SER HB2 H 1 4.51 0.05 . . . . . . 58 SER HB2 . 6700 1 472 . 1 1 48 48 SER C C 13 175.56 0.4 . . . . . . 58 SER C . 6700 1 473 . 1 1 48 48 SER CA C 13 59.89 0.4 . . . . . . 58 SER CA . 6700 1 474 . 1 1 48 48 SER CB C 13 64.24 0.4 . . . . . . 58 SER CB . 6700 1 475 . 1 1 48 48 SER N N 15 115.83 0.4 . . . . . . 58 SER N . 6700 1 476 . 1 1 49 49 LEU H H 1 7.69 0.05 . . . . . . 59 LEU H . 6700 1 477 . 1 1 49 49 LEU HA H 1 3.76 0.05 . . . . . . 59 LEU HA . 6700 1 478 . 1 1 49 49 LEU HB2 H 1 1.8 0.05 . . . . . . 59 LEU HB2 . 6700 1 479 . 1 1 49 49 LEU HG H 1 1.38 0.05 . . . . . . 59 LEU HG . 6700 1 480 . 1 1 49 49 LEU HD11 H 1 0.56 0.05 . . . . . . 59 LEU HD1 . 6700 1 481 . 1 1 49 49 LEU HD12 H 1 0.56 0.05 . . . . . . 59 LEU HD1 . 6700 1 482 . 1 1 49 49 LEU HD13 H 1 0.56 0.05 . . . . . . 59 LEU HD1 . 6700 1 483 . 1 1 49 49 LEU HD21 H 1 -0.07 0.05 . . . . . . 59 LEU HD2 . 6700 1 484 . 1 1 49 49 LEU HD22 H 1 -0.07 0.05 . . . . . . 59 LEU HD2 . 6700 1 485 . 1 1 49 49 LEU HD23 H 1 -0.07 0.05 . . . . . . 59 LEU HD2 . 6700 1 486 . 1 1 49 49 LEU C C 13 179.33 0.4 . . . . . . 59 LEU C . 6700 1 487 . 1 1 49 49 LEU CA C 13 56.35 0.4 . . . . . . 59 LEU CA . 6700 1 488 . 1 1 49 49 LEU CB C 13 44.8 0.4 . . . . . . 59 LEU CB . 6700 1 489 . 1 1 49 49 LEU CG C 13 27.0 0.4 . . . . . . 59 LEU CG . 6700 1 490 . 1 1 49 49 LEU CD1 C 13 25.75 0.4 . . . . . . 59 LEU CD1 . 6700 1 491 . 1 1 49 49 LEU CD2 C 13 22.01 0.4 . . . . . . 59 LEU CD2 . 6700 1 492 . 1 1 49 49 LEU N N 15 120.22 0.4 . . . . . . 59 LEU N . 6700 1 493 . 1 1 50 50 SER H H 1 8.57 0.05 . . . . . . 60 SER H . 6700 1 494 . 1 1 50 50 SER HA H 1 4.04 0.05 . . . . . . 60 SER HA . 6700 1 495 . 1 1 50 50 SER HB2 H 1 4.0 0.05 . . . . . . 60 SER HB2 . 6700 1 496 . 1 1 50 50 SER C C 13 176.82 0.4 . . . . . . 60 SER C . 6700 1 497 . 1 1 50 50 SER CA C 13 62.56 0.4 . . . . . . 60 SER CA . 6700 1 498 . 1 1 50 50 SER CB C 13 62.56 0.4 . . . . . . 60 SER CB . 6700 1 499 . 1 1 50 50 SER N N 15 115.98 0.4 . . . . . . 60 SER N . 6700 1 500 . 1 1 51 51 LYS H H 1 7.57 0.05 . . . . . . 61 LYS H . 6700 1 501 . 1 1 51 51 LYS HA H 1 4.32 0.05 . . . . . . 61 LYS HA . 6700 1 502 . 1 1 51 51 LYS HB2 H 1 1.96 0.05 . . . . . . 61 LYS HB2 . 6700 1 503 . 1 1 51 51 LYS HB3 H 1 2.01 0.05 . . . . . . 61 LYS HB3 . 6700 1 504 . 1 1 51 51 LYS HG2 H 1 1.52 0.05 . . . . . . 61 LYS HG2 . 6700 1 505 . 1 1 51 51 LYS HG3 H 1 1.52 0.05 . . . . . . 61 LYS HG3 . 6700 1 506 . 1 1 51 51 LYS HD2 H 1 1.74 0.05 . . . . . . 61 LYS HD2 . 6700 1 507 . 1 1 51 51 LYS HD3 H 1 1.74 0.05 . . . . . . 61 LYS HD3 . 6700 1 508 . 1 1 51 51 LYS HE2 H 1 3.01 0.05 . . . . . . 61 LYS HE2 . 6700 1 509 . 1 1 51 51 LYS HE3 H 1 3.01 0.05 . . . . . . 61 LYS HE3 . 6700 1 510 . 1 1 51 51 LYS C C 13 177.47 0.4 . . . . . . 61 LYS C . 6700 1 511 . 1 1 51 51 LYS CA C 13 57.38 0.4 . . . . . . 61 LYS CA . 6700 1 512 . 1 1 51 51 LYS CB C 13 32.34 0.4 . . . . . . 61 LYS CB . 6700 1 513 . 1 1 51 51 LYS CG C 13 25.45 0.4 . . . . . . 61 LYS CG . 6700 1 514 . 1 1 51 51 LYS CD C 13 29.49 0.4 . . . . . . 61 LYS CD . 6700 1 515 . 1 1 51 51 LYS CE C 13 42.37 0.4 . . . . . . 61 LYS CE . 6700 1 516 . 1 1 51 51 LYS N N 15 119.85 0.4 . . . . . . 61 LYS N . 6700 1 517 . 1 1 52 52 LEU H H 1 7.35 0.05 . . . . . . 62 LEU H . 6700 1 518 . 1 1 52 52 LEU HA H 1 4.43 0.05 . . . . . . 62 LEU HA . 6700 1 519 . 1 1 52 52 LEU HB2 H 1 1.67 0.05 . . . . . . 62 LEU HB2 . 6700 1 520 . 1 1 52 52 LEU HG H 1 1.61 0.05 . . . . . . 62 LEU HG . 6700 1 521 . 1 1 52 52 LEU HD11 H 1 0.72 0.05 . . . . . . 62 LEU HD1 . 6700 1 522 . 1 1 52 52 LEU HD12 H 1 0.72 0.05 . . . . . . 62 LEU HD1 . 6700 1 523 . 1 1 52 52 LEU HD13 H 1 0.72 0.05 . . . . . . 62 LEU HD1 . 6700 1 524 . 1 1 52 52 LEU HD21 H 1 0.86 0.05 . . . . . . 62 LEU HD2 . 6700 1 525 . 1 1 52 52 LEU HD22 H 1 0.86 0.05 . . . . . . 62 LEU HD2 . 6700 1 526 . 1 1 52 52 LEU HD23 H 1 0.86 0.05 . . . . . . 62 LEU HD2 . 6700 1 527 . 1 1 52 52 LEU C C 13 176.87 0.4 . . . . . . 62 LEU C . 6700 1 528 . 1 1 52 52 LEU CA C 13 54.67 0.4 . . . . . . 62 LEU CA . 6700 1 529 . 1 1 52 52 LEU CB C 13 42.11 0.4 . . . . . . 62 LEU CB . 6700 1 530 . 1 1 52 52 LEU CD1 C 13 26.28 0.4 . . . . . . 62 LEU CD1 . 6700 1 531 . 1 1 52 52 LEU CD2 C 13 25.14 0.4 . . . . . . 62 LEU CD2 . 6700 1 532 . 1 1 52 52 LEU N N 15 119.03 0.4 . . . . . . 62 LEU N . 6700 1 533 . 1 1 53 53 GLY H H 1 7.84 0.05 . . . . . . 63 GLY H . 6700 1 534 . 1 1 53 53 GLY HA2 H 1 4.31 0.05 . . . . . . 63 GLY HA2 . 6700 1 535 . 1 1 53 53 GLY HA3 H 1 4.31 0.05 . . . . . . 63 GLY HA3 . 6700 1 536 . 1 1 53 53 GLY C C 13 175.99 0.4 . . . . . . 63 GLY C . 6700 1 537 . 1 1 53 53 GLY CA C 13 45.85 0.4 . . . . . . 63 GLY CA . 6700 1 538 . 1 1 53 53 GLY N N 15 105.87 0.4 . . . . . . 63 GLY N . 6700 1 539 . 1 1 54 54 LEU H H 1 7.98 0.05 . . . . . . 64 LEU H . 6700 1 540 . 1 1 54 54 LEU HA H 1 4.38 0.05 . . . . . . 64 LEU HA . 6700 1 541 . 1 1 54 54 LEU HB2 H 1 1.39 0.05 . . . . . . 64 LEU HB2 . 6700 1 542 . 1 1 54 54 LEU HB3 H 1 1.69 0.05 . . . . . . 64 LEU HB3 . 6700 1 543 . 1 1 54 54 LEU HG H 1 1.68 0.05 . . . . . . 64 LEU HG . 6700 1 544 . 1 1 54 54 LEU HD11 H 1 0.85 0.05 . . . . . . 64 LEU HD1 . 6700 1 545 . 1 1 54 54 LEU HD12 H 1 0.85 0.05 . . . . . . 64 LEU HD1 . 6700 1 546 . 1 1 54 54 LEU HD13 H 1 0.85 0.05 . . . . . . 64 LEU HD1 . 6700 1 547 . 1 1 54 54 LEU HD21 H 1 0.81 0.05 . . . . . . 64 LEU HD2 . 6700 1 548 . 1 1 54 54 LEU HD22 H 1 0.81 0.05 . . . . . . 64 LEU HD2 . 6700 1 549 . 1 1 54 54 LEU HD23 H 1 0.81 0.05 . . . . . . 64 LEU HD2 . 6700 1 550 . 1 1 54 54 LEU C C 13 177.04 0.4 . . . . . . 64 LEU C . 6700 1 551 . 1 1 54 54 LEU CA C 13 56.3 0.4 . . . . . . 64 LEU CA . 6700 1 552 . 1 1 54 54 LEU CB C 13 40.45 0.4 . . . . . . 64 LEU CB . 6700 1 553 . 1 1 54 54 LEU CG C 13 29.18 0.4 . . . . . . 64 LEU CG . 6700 1 554 . 1 1 54 54 LEU CD1 C 13 25.08 0.4 . . . . . . 64 LEU CD1 . 6700 1 555 . 1 1 54 54 LEU CD2 C 13 24.21 0.4 . . . . . . 64 LEU CD2 . 6700 1 556 . 1 1 54 54 LEU N N 15 120.87 0.4 . . . . . . 64 LEU N . 6700 1 557 . 1 1 55 55 ASP H H 1 8.9 0.05 . . . . . . 65 ASP H . 6700 1 558 . 1 1 55 55 ASP HA H 1 4.2 0.05 . . . . . . 65 ASP HA . 6700 1 559 . 1 1 55 55 ASP HB2 H 1 2.67 0.05 . . . . . . 65 ASP HB2 . 6700 1 560 . 1 1 55 55 ASP HB3 H 1 2.76 0.05 . . . . . . 65 ASP HB3 . 6700 1 561 . 1 1 55 55 ASP C C 13 178.56 0.4 . . . . . . 65 ASP C . 6700 1 562 . 1 1 55 55 ASP CA C 13 56.63 0.4 . . . . . . 65 ASP CA . 6700 1 563 . 1 1 55 55 ASP CB C 13 38.8 0.4 . . . . . . 65 ASP CB . 6700 1 564 . 1 1 55 55 ASP N N 15 120.01 0.4 . . . . . . 65 ASP N . 6700 1 565 . 1 1 56 56 SER H H 1 7.96 0.05 . . . . . . 66 SER H . 6700 1 566 . 1 1 56 56 SER HA H 1 4.07 0.05 . . . . . . 66 SER HA . 6700 1 567 . 1 1 56 56 SER HB2 H 1 4.37 0.05 . . . . . . 66 SER HB2 . 6700 1 568 . 1 1 56 56 SER C C 13 176.34 0.4 . . . . . . 66 SER C . 6700 1 569 . 1 1 56 56 SER CA C 13 60.97 0.4 . . . . . . 66 SER CA . 6700 1 570 . 1 1 56 56 SER CB C 13 62.63 0.4 . . . . . . 66 SER CB . 6700 1 571 . 1 1 56 56 SER N N 15 116.41 0.4 . . . . . . 66 SER N . 6700 1 572 . 1 1 57 57 MET H H 1 7.43 0.05 . . . . . . 67 MET H . 6700 1 573 . 1 1 57 57 MET HA H 1 4.15 0.05 . . . . . . 67 MET HA . 6700 1 574 . 1 1 57 57 MET HB2 H 1 1.99 0.05 . . . . . . 67 MET HB2 . 6700 1 575 . 1 1 57 57 MET HB3 H 1 2.0 0.05 . . . . . . 67 MET HB3 . 6700 1 576 . 1 1 57 57 MET HG2 H 1 2.37 0.05 . . . . . . 67 MET HG2 . 6700 1 577 . 1 1 57 57 MET HG3 H 1 2.65 0.05 . . . . . . 67 MET HG3 . 6700 1 578 . 1 1 57 57 MET HE1 H 1 2.08 0.05 . . . . . . 67 MET HE . 6700 1 579 . 1 1 57 57 MET HE2 H 1 2.08 0.05 . . . . . . 67 MET HE . 6700 1 580 . 1 1 57 57 MET HE3 H 1 2.08 0.05 . . . . . . 67 MET HE . 6700 1 581 . 1 1 57 57 MET C C 13 177.99 0.4 . . . . . . 67 MET C . 6700 1 582 . 1 1 57 57 MET CA C 13 58.58 0.4 . . . . . . 67 MET CA . 6700 1 583 . 1 1 57 57 MET CB C 13 32.96 0.4 . . . . . . 67 MET CB . 6700 1 584 . 1 1 57 57 MET CG C 13 32.44 0.4 . . . . . . 67 MET CG . 6700 1 585 . 1 1 57 57 MET CE C 13 17.22 0.4 . . . . . . 67 MET CE . 6700 1 586 . 1 1 57 57 MET N N 15 121.49 0.4 . . . . . . 67 MET N . 6700 1 587 . 1 1 58 58 LEU H H 1 7.66 0.05 . . . . . . 68 LEU H . 6700 1 588 . 1 1 58 58 LEU HA H 1 4.01 0.05 . . . . . . 68 LEU HA . 6700 1 589 . 1 1 58 58 LEU HB2 H 1 1.50 0.05 . . . . . . 68 LEU HB2 . 6700 1 590 . 1 1 58 58 LEU HB3 H 1 1.86 0.05 . . . . . . 68 LEU HB3 . 6700 1 591 . 1 1 58 58 LEU HG H 1 1.56 0.05 . . . . . . 68 LEU HG . 6700 1 592 . 1 1 58 58 LEU HD11 H 1 0.8 0.05 . . . . . . 68 LEU HD1 . 6700 1 593 . 1 1 58 58 LEU HD12 H 1 0.8 0.05 . . . . . . 68 LEU HD1 . 6700 1 594 . 1 1 58 58 LEU HD13 H 1 0.8 0.05 . . . . . . 68 LEU HD1 . 6700 1 595 . 1 1 58 58 LEU HD21 H 1 0.78 0.05 . . . . . . 68 LEU HD2 . 6700 1 596 . 1 1 58 58 LEU HD22 H 1 0.78 0.05 . . . . . . 68 LEU HD2 . 6700 1 597 . 1 1 58 58 LEU HD23 H 1 0.78 0.05 . . . . . . 68 LEU HD2 . 6700 1 598 . 1 1 58 58 LEU C C 13 178.34 0.4 . . . . . . 68 LEU C . 6700 1 599 . 1 1 58 58 LEU CA C 13 57.06 0.4 . . . . . . 68 LEU CA . 6700 1 600 . 1 1 58 58 LEU CB C 13 41.74 0.4 . . . . . . 68 LEU CB . 6700 1 601 . 1 1 58 58 LEU CG C 13 27.16 0.4 . . . . . . 68 LEU CG . 6700 1 602 . 1 1 58 58 LEU CD1 C 13 25.14 0.4 . . . . . . 68 LEU CD1 . 6700 1 603 . 1 1 58 58 LEU CD2 C 13 24.36 0.4 . . . . . . 68 LEU CD2 . 6700 1 604 . 1 1 58 58 LEU N N 15 119.74 0.4 . . . . . . 68 LEU N . 6700 1 605 . 1 1 59 59 LEU H H 1 7.83 0.05 . . . . . . 69 LEU H . 6700 1 606 . 1 1 59 59 LEU HA H 1 4.1 0.05 . . . . . . 69 LEU HA . 6700 1 607 . 1 1 59 59 LEU HB2 H 1 1.56 0.05 . . . . . . 69 LEU HB2 . 6700 1 608 . 1 1 59 59 LEU HB3 H 1 1.72 0.05 . . . . . . 69 LEU HB3 . 6700 1 609 . 1 1 59 59 LEU HG H 1 1.72 0.05 . . . . . . 69 LEU HG . 6700 1 610 . 1 1 59 59 LEU HD11 H 1 0.86 0.05 . . . . . . 69 LEU HD1 . 6700 1 611 . 1 1 59 59 LEU HD12 H 1 0.86 0.05 . . . . . . 69 LEU HD1 . 6700 1 612 . 1 1 59 59 LEU HD13 H 1 0.86 0.05 . . . . . . 69 LEU HD1 . 6700 1 613 . 1 1 59 59 LEU HD21 H 1 0.86 0.05 . . . . . . 69 LEU HD2 . 6700 1 614 . 1 1 59 59 LEU HD22 H 1 0.86 0.05 . . . . . . 69 LEU HD2 . 6700 1 615 . 1 1 59 59 LEU HD23 H 1 0.86 0.05 . . . . . . 69 LEU HD2 . 6700 1 616 . 1 1 59 59 LEU C C 13 178.38 0.4 . . . . . . 69 LEU C . 6700 1 617 . 1 1 59 59 LEU CA C 13 57.25 0.4 . . . . . . 69 LEU CA . 6700 1 618 . 1 1 59 59 LEU CB C 13 41.59 0.4 . . . . . . 69 LEU CB . 6700 1 619 . 1 1 59 59 LEU CG C 13 27.62 0.4 . . . . . . 69 LEU CG . 6700 1 620 . 1 1 59 59 LEU CD1 C 13 24.92 0.4 . . . . . . 69 LEU CD1 . 6700 1 621 . 1 1 59 59 LEU CD2 C 13 23.43 0.4 . . . . . . 69 LEU CD2 . 6700 1 622 . 1 1 59 59 LEU N N 15 118.63 0.4 . . . . . . 69 LEU N . 6700 1 623 . 1 1 60 60 GLU H H 1 7.33 0.05 . . . . . . 70 GLU H . 6700 1 624 . 1 1 60 60 GLU HA H 1 4.02 0.05 . . . . . . 70 GLU HA . 6700 1 625 . 1 1 60 60 GLU HB2 H 1 2.03 0.05 . . . . . . 70 GLU HB2 . 6700 1 626 . 1 1 60 60 GLU HG2 H 1 2.2 0.05 . . . . . . 70 GLU HG2 . 6700 1 627 . 1 1 60 60 GLU HG3 H 1 2.41 0.05 . . . . . . 70 GLU HG3 . 6700 1 628 . 1 1 60 60 GLU C C 13 177.38 0.4 . . . . . . 70 GLU C . 6700 1 629 . 1 1 60 60 GLU CA C 13 58.2 0.4 . . . . . . 70 GLU CA . 6700 1 630 . 1 1 60 60 GLU CB C 13 29.99 0.4 . . . . . . 70 GLU CB . 6700 1 631 . 1 1 60 60 GLU CG C 13 36.63 0.4 . . . . . . 70 GLU CG . 6700 1 632 . 1 1 60 60 GLU N N 15 116.12 0.4 . . . . . . 70 GLU N . 6700 1 633 . 1 1 61 61 VAL H H 1 7.46 0.05 . . . . . . 71 VAL H . 6700 1 634 . 1 1 61 61 VAL HA H 1 3.85 0.05 . . . . . . 71 VAL HA . 6700 1 635 . 1 1 61 61 VAL HB H 1 2.13 0.05 . . . . . . 71 VAL HB . 6700 1 636 . 1 1 61 61 VAL HG11 H 1 0.72 0.05 . . . . . . 71 VAL HG1 . 6700 1 637 . 1 1 61 61 VAL HG12 H 1 0.72 0.05 . . . . . . 71 VAL HG1 . 6700 1 638 . 1 1 61 61 VAL HG13 H 1 0.72 0.05 . . . . . . 71 VAL HG1 . 6700 1 639 . 1 1 61 61 VAL HG21 H 1 0.83 0.05 . . . . . . 71 VAL HG2 . 6700 1 640 . 1 1 61 61 VAL HG22 H 1 0.83 0.05 . . . . . . 71 VAL HG2 . 6700 1 641 . 1 1 61 61 VAL HG23 H 1 0.83 0.05 . . . . . . 71 VAL HG2 . 6700 1 642 . 1 1 61 61 VAL C C 13 175.23 0.4 . . . . . . 71 VAL C . 6700 1 643 . 1 1 61 61 VAL CA C 13 63.75 0.4 . . . . . . 71 VAL CA . 6700 1 644 . 1 1 61 61 VAL CB C 13 32.75 0.4 . . . . . . 71 VAL CB . 6700 1 645 . 1 1 61 61 VAL CG1 C 13 22.47 0.4 . . . . . . 71 VAL CG1 . 6700 1 646 . 1 1 61 61 VAL CG2 C 13 21.46 0.4 . . . . . . 71 VAL CG2 . 6700 1 647 . 1 1 61 61 VAL N N 15 114.87 0.4 . . . . . . 71 VAL N . 6700 1 648 . 1 1 62 62 ILE H H 1 7.77 0.05 . . . . . . 72 ILE H . 6700 1 649 . 1 1 62 62 ILE HA H 1 3.95 0.05 . . . . . . 72 ILE HA . 6700 1 650 . 1 1 62 62 ILE HB H 1 1.74 0.05 . . . . . . 72 ILE HB . 6700 1 651 . 1 1 62 62 ILE HG12 H 1 1.08 0.05 . . . . . . 72 ILE HG12 . 6700 1 652 . 1 1 62 62 ILE HG13 H 1 1.32 0.05 . . . . . . 72 ILE HG13 . 6700 1 653 . 1 1 62 62 ILE HG21 H 1 0.74 0.05 . . . . . . 72 ILE HG2 . 6700 1 654 . 1 1 62 62 ILE HG22 H 1 0.74 0.05 . . . . . . 72 ILE HG2 . 6700 1 655 . 1 1 62 62 ILE HG23 H 1 0.74 0.05 . . . . . . 72 ILE HG2 . 6700 1 656 . 1 1 62 62 ILE HD11 H 1 0.73 0.05 . . . . . . 72 ILE HD1 . 6700 1 657 . 1 1 62 62 ILE HD12 H 1 0.73 0.05 . . . . . . 72 ILE HD1 . 6700 1 658 . 1 1 62 62 ILE HD13 H 1 0.73 0.05 . . . . . . 72 ILE HD1 . 6700 1 659 . 1 1 62 62 ILE C C 13 173.75 0.4 . . . . . . 72 ILE C . 6700 1 660 . 1 1 62 62 ILE CA C 13 60.72 0.4 . . . . . . 72 ILE CA . 6700 1 661 . 1 1 62 62 ILE CB C 13 39.32 0.4 . . . . . . 72 ILE CB . 6700 1 662 . 1 1 62 62 ILE CG1 C 13 27.31 0.4 . . . . . . 72 ILE CG1 . 6700 1 663 . 1 1 62 62 ILE CG2 C 13 17.79 0.4 . . . . . . 72 ILE CG2 . 6700 1 664 . 1 1 62 62 ILE CD1 C 13 13.84 0.4 . . . . . . 72 ILE CD1 . 6700 1 665 . 1 1 62 62 ILE N N 15 115.47 0.4 . . . . . . 72 ILE N . 6700 1 666 . 1 1 63 63 ASP H H 1 7.49 0.05 . . . . . . 73 ASP H . 6700 1 667 . 1 1 63 63 ASP HA H 1 4.5 0.05 . . . . . . 73 ASP HA . 6700 1 668 . 1 1 63 63 ASP HB2 H 1 2.35 0.05 . . . . . . 73 ASP HB2 . 6700 1 669 . 1 1 63 63 ASP HB3 H 1 2.63 0.05 . . . . . . 73 ASP HB3 . 6700 1 670 . 1 1 63 63 ASP C C 13 176.08 0.4 . . . . . . 73 ASP C . 6700 1 671 . 1 1 63 63 ASP CA C 13 53.54 0.4 . . . . . . 73 ASP CA . 6700 1 672 . 1 1 63 63 ASP CB C 13 40.99 0.4 . . . . . . 73 ASP CB . 6700 1 673 . 1 1 63 63 ASP N N 15 122.16 0.4 . . . . . . 73 ASP N . 6700 1 674 . 1 1 64 64 LEU H H 1 8.11 0.05 . . . . . . 74 LEU H . 6700 1 675 . 1 1 64 64 LEU HA H 1 4.16 0.05 . . . . . . 74 LEU HA . 6700 1 676 . 1 1 64 64 LEU HB2 H 1 1.56 0.05 . . . . . . 74 LEU HB2 . 6700 1 677 . 1 1 64 64 LEU HB3 H 1 1.58 0.05 . . . . . . 74 LEU HB3 . 6700 1 678 . 1 1 64 64 LEU HG H 1 1.55 0.05 . . . . . . 74 LEU HG . 6700 1 679 . 1 1 64 64 LEU HD11 H 1 0.78 0.05 . . . . . . 74 LEU HD1 . 6700 1 680 . 1 1 64 64 LEU HD12 H 1 0.78 0.05 . . . . . . 74 LEU HD1 . 6700 1 681 . 1 1 64 64 LEU HD13 H 1 0.78 0.05 . . . . . . 74 LEU HD1 . 6700 1 682 . 1 1 64 64 LEU HD21 H 1 0.86 0.05 . . . . . . 74 LEU HD2 . 6700 1 683 . 1 1 64 64 LEU HD22 H 1 0.86 0.05 . . . . . . 74 LEU HD2 . 6700 1 684 . 1 1 64 64 LEU HD23 H 1 0.86 0.05 . . . . . . 74 LEU HD2 . 6700 1 685 . 1 1 64 64 LEU C C 13 177.46 0.4 . . . . . . 74 LEU C . 6700 1 686 . 1 1 64 64 LEU CA C 13 55.44 0.4 . . . . . . 74 LEU CA . 6700 1 687 . 1 1 64 64 LEU CB C 13 42.28 0.4 . . . . . . 74 LEU CB . 6700 1 688 . 1 1 64 64 LEU CG C 13 27.16 0.4 . . . . . . 74 LEU CG . 6700 1 689 . 1 1 64 64 LEU CD1 C 13 23.78 0.4 . . . . . . 74 LEU CD1 . 6700 1 690 . 1 1 64 64 LEU CD2 C 13 25.3 0.4 . . . . . . 74 LEU CD2 . 6700 1 691 . 1 1 64 64 LEU N N 15 123.44 0.4 . . . . . . 74 LEU N . 6700 1 692 . 1 1 65 65 LYS H H 1 8.21 0.05 . . . . . . 75 LYS H . 6700 1 693 . 1 1 65 65 LYS HA H 1 4.23 0.05 . . . . . . 75 LYS HA . 6700 1 694 . 1 1 65 65 LYS HB2 H 1 1.8 0.05 . . . . . . 75 LYS HB2 . 6700 1 695 . 1 1 65 65 LYS HG2 H 1 1.4 0.05 . . . . . . 75 LYS HG2 . 6700 1 696 . 1 1 65 65 LYS HG3 H 1 1.4 0.05 . . . . . . 75 LYS HG3 . 6700 1 697 . 1 1 65 65 LYS HD2 H 1 1.66 0.05 . . . . . . 75 LYS HD2 . 6700 1 698 . 1 1 65 65 LYS HD3 H 1 1.66 0.05 . . . . . . 75 LYS HD3 . 6700 1 699 . 1 1 65 65 LYS HE2 H 1 2.98 0.05 . . . . . . 75 LYS HE2 . 6700 1 700 . 1 1 65 65 LYS HE3 H 1 2.98 0.05 . . . . . . 75 LYS HE3 . 6700 1 701 . 1 1 65 65 LYS C C 13 176.73 0.4 . . . . . . 75 LYS C . 6700 1 702 . 1 1 65 65 LYS CA C 13 56.89 0.4 . . . . . . 75 LYS CA . 6700 1 703 . 1 1 65 65 LYS CB C 13 32.72 0.4 . . . . . . 75 LYS CB . 6700 1 704 . 1 1 65 65 LYS CG C 13 24.98 0.4 . . . . . . 75 LYS CG . 6700 1 705 . 1 1 65 65 LYS CD C 13 29.18 0.4 . . . . . . 75 LYS CD . 6700 1 706 . 1 1 65 65 LYS CE C 13 41.45 0.4 . . . . . . 75 LYS CE . 6700 1 707 . 1 1 65 65 LYS N N 15 121.09 0.4 . . . . . . 75 LYS N . 6700 1 708 . 1 1 66 66 GLU H H 1 8.11 0.05 . . . . . . 76 GLU H . 6700 1 709 . 1 1 66 66 GLU HA H 1 4.27 0.05 . . . . . . 76 GLU HA . 6700 1 710 . 1 1 66 66 GLU HB2 H 1 1.88 0.05 . . . . . . 76 GLU HB2 . 6700 1 711 . 1 1 66 66 GLU HB3 H 1 2.08 0.05 . . . . . . 76 GLU HB3 . 6700 1 712 . 1 1 66 66 GLU HG2 H 1 2.2 0.05 . . . . . . 76 GLU HG2 . 6700 1 713 . 1 1 66 66 GLU HG3 H 1 2.2 0.05 . . . . . . 76 GLU HG3 . 6700 1 714 . 1 1 66 66 GLU C C 13 175.1 0.4 . . . . . . 76 GLU C . 6700 1 715 . 1 1 66 66 GLU CA C 13 56.36 0.4 . . . . . . 76 GLU CA . 6700 1 716 . 1 1 66 66 GLU CB C 13 30.53 0.4 . . . . . . 76 GLU CB . 6700 1 717 . 1 1 66 66 GLU CG C 13 36.63 0.4 . . . . . . 76 GLU CG . 6700 1 718 . 1 1 66 66 GLU N N 15 121.48 0.4 . . . . . . 76 GLU N . 6700 1 719 . 1 1 67 67 ALA H H 1 7.77 0.05 . . . . . . 77 ALA H . 6700 1 720 . 1 1 67 67 ALA HA H 1 4.1 0.05 . . . . . . 77 ALA HA . 6700 1 721 . 1 1 67 67 ALA HB1 H 1 1.3 0.05 . . . . . . 77 ALA HB . 6700 1 722 . 1 1 67 67 ALA HB2 H 1 1.3 0.05 . . . . . . 77 ALA HB . 6700 1 723 . 1 1 67 67 ALA HB3 H 1 1.3 0.05 . . . . . . 77 ALA HB . 6700 1 724 . 1 1 67 67 ALA CA C 13 53.86 0.4 . . . . . . 77 ALA CA . 6700 1 725 . 1 1 67 67 ALA CB C 13 20.47 0.4 . . . . . . 77 ALA CB . 6700 1 726 . 1 1 67 67 ALA N N 15 130.44 0.4 . . . . . . 77 ALA N . 6700 1 727 . 2 2 4 4 GLU H H 1 8.62 0.05 . . . . . . 52 GLU H . 6700 1 728 . 2 2 4 4 GLU CA C 13 56.27 0.4 . . . . . . 52 GLU CA . 6700 1 729 . 2 2 4 4 GLU CB C 13 29.49 0.4 . . . . . . 52 GLU CB . 6700 1 730 . 2 2 4 4 GLU N N 15 121.02 0.3 . . . . . . 52 GLU N . 6700 1 731 . 2 2 5 5 SER H H 1 8.25 0.05 . . . . . . 53 SER H . 6700 1 732 . 2 2 5 5 SER CA C 13 57.86 0.4 . . . . . . 53 SER CA . 6700 1 733 . 2 2 5 5 SER CB C 13 63.78 0.4 . . . . . . 53 SER CB . 6700 1 734 . 2 2 5 5 SER N N 15 116.15 0.3 . . . . . . 53 SER N . 6700 1 735 . 2 2 6 6 GLU H H 1 8.37 0.05 . . . . . . 54 GLU H . 6700 1 736 . 2 2 6 6 GLU CA C 13 55.99 0.4 . . . . . . 54 GLU CA . 6700 1 737 . 2 2 6 6 GLU CB C 13 29.63 0.4 . . . . . . 54 GLU CB . 6700 1 738 . 2 2 6 6 GLU N N 15 122.87 0.3 . . . . . . 54 GLU N . 6700 1 739 . 2 2 7 7 LYS H H 1 8.17 0.05 . . . . . . 55 LYS H . 6700 1 740 . 2 2 7 7 LYS CA C 13 55.66 0.4 . . . . . . 55 LYS CA . 6700 1 741 . 2 2 7 7 LYS CB C 13 32.56 0.4 . . . . . . 55 LYS CB . 6700 1 742 . 2 2 7 7 LYS N N 15 121.86 0.3 . . . . . . 55 LYS N . 6700 1 743 . 2 2 8 8 ASP H H 1 8.36 0.05 . . . . . . 56 ASP H . 6700 1 744 . 2 2 8 8 ASP CA C 13 53.65 0.4 . . . . . . 56 ASP CA . 6700 1 745 . 2 2 8 8 ASP CB C 13 40.85 0.4 . . . . . . 56 ASP CB . 6700 1 746 . 2 2 8 8 ASP N N 15 121.86 0.3 . . . . . . 56 ASP N . 6700 1 747 . 2 2 9 9 THR H H 1 8.19 0.05 . . . . . . 57 THR H . 6700 1 748 . 2 2 9 9 THR CA C 13 61.03 0.4 . . . . . . 57 THR CA . 6700 1 749 . 2 2 9 9 THR CB C 13 69.15 0.4 . . . . . . 57 THR CB . 6700 1 750 . 2 2 9 9 THR N N 15 115.09 0.3 . . . . . . 57 THR N . 6700 1 751 . 2 2 10 10 SER H H 1 8.42 0.05 . . . . . . 58 SER H . 6700 1 752 . 2 2 10 10 SER CA C 13 58.68 0.4 . . . . . . 58 SER CA . 6700 1 753 . 2 2 10 10 SER CB C 13 63.44 0.4 . . . . . . 58 SER CB . 6700 1 754 . 2 2 10 10 SER N N 15 118.71 0.3 . . . . . . 58 SER N . 6700 1 755 . 2 2 11 11 ALA H H 1 8.40 0.05 . . . . . . 59 ALA H . 6700 1 756 . 2 2 11 11 ALA CA C 13 52.51 0.4 . . . . . . 59 ALA CA . 6700 1 757 . 2 2 11 11 ALA CB C 13 18.80 0.4 . . . . . . 59 ALA CB . 6700 1 758 . 2 2 11 11 ALA N N 15 126.04 0.3 . . . . . . 59 ALA N . 6700 1 759 . 2 2 12 12 THR H H 1 7.89 0.05 . . . . . . 60 THR H . 6700 1 760 . 2 2 12 12 THR CA C 13 60.46 0.4 . . . . . . 60 THR CA . 6700 1 761 . 2 2 12 12 THR CB C 13 69.03 0.4 . . . . . . 60 THR CB . 6700 1 762 . 2 2 12 12 THR N N 15 110.75 0.3 . . . . . . 60 THR N . 6700 1 763 . 2 2 13 13 SER H H 1 8.42 0.05 . . . . . . 61 SER H . 6700 1 764 . 2 2 13 13 SER CA C 13 58.82 0.4 . . . . . . 61 SER CA . 6700 1 765 . 2 2 13 13 SER CB C 13 63.20 0.4 . . . . . . 61 SER CB . 6700 1 766 . 2 2 13 13 SER N N 15 117.33 0.3 . . . . . . 61 SER N . 6700 1 767 . 2 2 14 14 GLY H H 1 8.20 0.05 . . . . . . 62 GLY H . 6700 1 768 . 2 2 14 14 GLY CA C 13 44.60 0.4 . . . . . . 62 GLY CA . 6700 1 769 . 2 2 14 14 GLY N N 15 109.04 0.3 . . . . . . 62 GLY N . 6700 1 770 . 2 2 15 15 ILE H H 1 7.95 0.05 . . . . . . 63 ILE H . 6700 1 771 . 2 2 15 15 ILE CA C 13 60.28 0.4 . . . . . . 63 ILE CA . 6700 1 772 . 2 2 15 15 ILE CB C 13 38.09 0.4 . . . . . . 63 ILE CB . 6700 1 773 . 2 2 15 15 ILE N N 15 122.41 0.3 . . . . . . 63 ILE N . 6700 1 774 . 2 2 16 16 VAL H H 1 8.08 0.05 . . . . . . 64 VAL H . 6700 1 775 . 2 2 16 16 VAL CA C 13 57.90 0.4 . . . . . . 64 VAL CA . 6700 1 776 . 2 2 16 16 VAL CB C 13 33.99 0.4 . . . . . . 64 VAL CB . 6700 1 777 . 2 2 16 16 VAL N N 15 124.96 0.3 . . . . . . 64 VAL N . 6700 1 778 . 2 2 17 17 PRO CA C 13 62.09 0.4 . . . . . . 65 PRO CA . 6700 1 779 . 2 2 17 17 PRO CB C 13 31.94 0.4 . . . . . . 65 PRO CB . 6700 1 780 . 2 2 18 18 THR H H 1 8.81 0.05 . . . . . . 66 THR H . 6700 1 781 . 2 2 18 18 THR CA C 13 60.40 0.4 . . . . . . 66 THR CA . 6700 1 782 . 2 2 18 18 THR CB C 13 70.68 0.4 . . . . . . 66 THR CB . 6700 1 783 . 2 2 18 18 THR N N 15 117.55 0.3 . . . . . . 66 THR N . 6700 1 784 . 2 2 19 19 LEU H H 1 8.93 0.05 . . . . . . 67 LEU H . 6700 1 785 . 2 2 19 19 LEU CA C 13 55.53 0.4 . . . . . . 67 LEU CA . 6700 1 786 . 2 2 19 19 LEU CB C 13 39.84 0.4 . . . . . . 67 LEU CB . 6700 1 787 . 2 2 19 19 LEU N N 15 125.68 0.3 . . . . . . 67 LEU N . 6700 1 788 . 2 2 20 20 GLN H H 1 9.13 0.05 . . . . . . 68 GLN H . 6700 1 789 . 2 2 20 20 GLN CA C 13 54.06 0.4 . . . . . . 68 GLN CA . 6700 1 790 . 2 2 20 20 GLN CB C 13 31.55 0.4 . . . . . . 68 GLN CB . 6700 1 791 . 2 2 20 20 GLN N N 15 119.99 0.3 . . . . . . 68 GLN N . 6700 1 792 . 2 2 21 21 ASN H H 1 7.58 0.05 . . . . . . 69 ASN H . 6700 1 793 . 2 2 21 21 ASN CA C 13 54.26 0.4 . . . . . . 69 ASN CA . 6700 1 794 . 2 2 21 21 ASN CB C 13 42.53 0.4 . . . . . . 69 ASN CB . 6700 1 795 . 2 2 21 21 ASN N N 15 112.11 0.3 . . . . . . 69 ASN N . 6700 1 796 . 2 2 22 22 ILE H H 1 7.94 0.05 . . . . . . 70 ILE H . 6700 1 797 . 2 2 22 22 ILE CA C 13 59.30 0.4 . . . . . . 70 ILE CA . 6700 1 798 . 2 2 22 22 ILE CB C 13 40.40 0.4 . . . . . . 70 ILE CB . 6700 1 799 . 2 2 22 22 ILE N N 15 124.75 0.3 . . . . . . 70 ILE N . 6700 1 800 . 2 2 23 23 VAL H H 1 9.27 0.05 . . . . . . 71 VAL H . 6700 1 801 . 2 2 23 23 VAL CA C 13 59.86 0.4 . . . . . . 71 VAL CA . 6700 1 802 . 2 2 23 23 VAL CB C 13 33.06 0.4 . . . . . . 71 VAL CB . 6700 1 803 . 2 2 23 23 VAL N N 15 127.46 0.3 . . . . . . 71 VAL N . 6700 1 804 . 2 2 24 24 ALA H H 1 9.26 0.05 . . . . . . 72 ALA H . 6700 1 805 . 2 2 24 24 ALA CA C 13 49.83 0.4 . . . . . . 72 ALA CA . 6700 1 806 . 2 2 24 24 ALA CB C 13 24.66 0.4 . . . . . . 72 ALA CB . 6700 1 807 . 2 2 24 24 ALA N N 15 131.50 0.3 . . . . . . 72 ALA N . 6700 1 808 . 2 2 25 25 THR H H 1 8.82 0.05 . . . . . . 73 THR H . 6700 1 809 . 2 2 25 25 THR CA C 13 58.68 0.4 . . . . . . 73 THR CA . 6700 1 810 . 2 2 25 25 THR CB C 13 71.14 0.4 . . . . . . 73 THR CB . 6700 1 811 . 2 2 25 25 THR N N 15 109.69 0.3 . . . . . . 73 THR N . 6700 1 812 . 2 2 26 26 VAL H H 1 8.59 0.05 . . . . . . 74 VAL H . 6700 1 813 . 2 2 26 26 VAL CA C 13 60.11 0.4 . . . . . . 74 VAL CA . 6700 1 814 . 2 2 26 26 VAL CB C 13 37.02 0.4 . . . . . . 74 VAL CB . 6700 1 815 . 2 2 26 26 VAL N N 15 118.46 0.3 . . . . . . 74 VAL N . 6700 1 816 . 2 2 27 27 THR H H 1 8.36 0.05 . . . . . . 75 THR H . 6700 1 817 . 2 2 27 27 THR CA C 13 60.72 0.4 . . . . . . 75 THR CA . 6700 1 818 . 2 2 27 27 THR CB C 13 69.56 0.4 . . . . . . 75 THR CB . 6700 1 819 . 2 2 27 27 THR N N 15 121.86 0.3 . . . . . . 75 THR N . 6700 1 820 . 2 2 28 28 LEU H H 1 8.77 0.05 . . . . . . 76 LEU H . 6700 1 821 . 2 2 28 28 LEU CA C 13 54.71 0.4 . . . . . . 76 LEU CA . 6700 1 822 . 2 2 28 28 LEU CB C 13 41.21 0.4 . . . . . . 76 LEU CB . 6700 1 823 . 2 2 28 28 LEU N N 15 125.02 0.3 . . . . . . 76 LEU N . 6700 1 824 . 2 2 29 29 GLY H H 1 7.94 0.05 . . . . . . 77 GLY H . 6700 1 825 . 2 2 29 29 GLY CA C 13 45.79 0.4 . . . . . . 77 GLY CA . 6700 1 826 . 2 2 29 29 GLY N N 15 129.28 0.3 . . . . . . 77 GLY N . 6700 1 827 . 2 2 30 30 CYS H H 1 7.38 0.05 . . . . . . 78 CYS H . 6700 1 828 . 2 2 30 30 CYS CA C 13 53.44 0.4 . . . . . . 78 CYS CA . 6700 1 829 . 2 2 30 30 CYS CB C 13 30.93 0.4 . . . . . . 78 CYS CB . 6700 1 830 . 2 2 30 30 CYS N N 15 113.98 0.3 . . . . . . 78 CYS N . 6700 1 831 . 2 2 31 31 ARG H H 1 7.99 0.05 . . . . . . 79 ARG H . 6700 1 832 . 2 2 31 31 ARG CA C 13 54.65 0.4 . . . . . . 79 ARG CA . 6700 1 833 . 2 2 31 31 ARG CB C 13 29.89 0.4 . . . . . . 79 ARG CB . 6700 1 834 . 2 2 31 31 ARG N N 15 117.60 0.3 . . . . . . 79 ARG N . 6700 1 835 . 2 2 32 32 LEU H H 1 8.72 0.05 . . . . . . 80 LEU H . 6700 1 836 . 2 2 32 32 LEU CA C 13 52.51 0.4 . . . . . . 80 LEU CA . 6700 1 837 . 2 2 32 32 LEU CB C 13 44.90 0.4 . . . . . . 80 LEU CB . 6700 1 838 . 2 2 32 32 LEU N N 15 121.06 0.3 . . . . . . 80 LEU N . 6700 1 839 . 2 2 33 33 ASP H H 1 5.80 0.05 . . . . . . 81 ASP H . 6700 1 840 . 2 2 33 33 ASP CA C 13 52.32 0.4 . . . . . . 81 ASP CA . 6700 1 841 . 2 2 33 33 ASP CB C 13 41.37 0.4 . . . . . . 81 ASP CB . 6700 1 842 . 2 2 33 33 ASP N N 15 120.29 0.3 . . . . . . 81 ASP N . 6700 1 843 . 2 2 34 34 LEU H H 1 8.58 0.05 . . . . . . 82 LEU H . 6700 1 844 . 2 2 34 34 LEU CA C 13 57.08 0.4 . . . . . . 82 LEU CA . 6700 1 845 . 2 2 34 34 LEU CB C 13 37.81 0.4 . . . . . . 82 LEU CB . 6700 1 846 . 2 2 34 34 LEU N N 15 126.33 0.3 . . . . . . 82 LEU N . 6700 1 847 . 2 2 35 35 LYS H H 1 8.19 0.05 . . . . . . 83 LYS H . 6700 1 848 . 2 2 35 35 LYS CA C 13 59.09 0.4 . . . . . . 83 LYS CA . 6700 1 849 . 2 2 35 35 LYS CB C 13 31.14 0.4 . . . . . . 83 LYS CB . 6700 1 850 . 2 2 35 35 LYS N N 15 117.58 0.3 . . . . . . 83 LYS N . 6700 1 851 . 2 2 36 36 THR H H 1 7.46 0.05 . . . . . . 84 THR H . 6700 1 852 . 2 2 36 36 THR CA C 13 66.39 0.4 . . . . . . 84 THR CA . 6700 1 853 . 2 2 36 36 THR CB C 13 67.88 0.4 . . . . . . 84 THR CB . 6700 1 854 . 2 2 36 36 THR N N 15 116.57 0.3 . . . . . . 84 THR N . 6700 1 855 . 2 2 37 37 VAL H H 1 7.76 0.05 . . . . . . 85 VAL H . 6700 1 856 . 2 2 37 37 VAL CA C 13 66.22 0.4 . . . . . . 85 VAL CA . 6700 1 857 . 2 2 37 37 VAL CB C 13 30.85 0.4 . . . . . . 85 VAL CB . 6700 1 858 . 2 2 37 37 VAL N N 15 120.64 0.3 . . . . . . 85 VAL N . 6700 1 859 . 2 2 38 38 ALA H H 1 8.01 0.05 . . . . . . 86 ALA H . 6700 1 860 . 2 2 38 38 ALA CA C 13 53.81 0.4 . . . . . . 86 ALA CA . 6700 1 861 . 2 2 38 38 ALA CB C 13 18.26 0.4 . . . . . . 86 ALA CB . 6700 1 862 . 2 2 38 38 ALA N N 15 117.67 0.3 . . . . . . 86 ALA N . 6700 1 863 . 2 2 39 39 LEU H H 1 7.66 0.05 . . . . . . 87 LEU H . 6700 1 864 . 2 2 39 39 LEU CA C 13 56.16 0.4 . . . . . . 87 LEU CA . 6700 1 865 . 2 2 39 39 LEU CB C 13 42.20 0.4 . . . . . . 87 LEU CB . 6700 1 866 . 2 2 39 39 LEU N N 15 116.09 0.3 . . . . . . 87 LEU N . 6700 1 867 . 2 2 40 40 HIS H H 1 7.38 0.05 . . . . . . 88 HIS H . 6700 1 868 . 2 2 40 40 HIS CA C 13 56.60 0.4 . . . . . . 88 HIS CA . 6700 1 869 . 2 2 40 40 HIS CB C 13 32.02 0.4 . . . . . . 88 HIS CB . 6700 1 870 . 2 2 40 40 HIS N N 15 113.98 0.3 . . . . . . 88 HIS N . 6700 1 871 . 2 2 41 41 ALA H H 1 8.02 0.05 . . . . . . 89 ALA H . 6700 1 872 . 2 2 41 41 ALA CA C 13 50.93 0.4 . . . . . . 89 ALA CA . 6700 1 873 . 2 2 41 41 ALA CB C 13 19.32 0.4 . . . . . . 89 ALA CB . 6700 1 874 . 2 2 41 41 ALA N N 15 123.31 0.3 . . . . . . 89 ALA N . 6700 1 875 . 2 2 42 42 ARG H H 1 8.54 0.05 . . . . . . 90 ARG H . 6700 1 876 . 2 2 42 42 ARG CA C 13 56.40 0.4 . . . . . . 90 ARG CA . 6700 1 877 . 2 2 42 42 ARG CB C 13 29.71 0.4 . . . . . . 90 ARG CB . 6700 1 878 . 2 2 42 42 ARG N N 15 122.60 0.3 . . . . . . 90 ARG N . 6700 1 879 . 2 2 43 43 ASN H H 1 8.89 0.05 . . . . . . 91 ASN H . 6700 1 880 . 2 2 43 43 ASN CA C 13 52.95 0.4 . . . . . . 91 ASN CA . 6700 1 881 . 2 2 43 43 ASN CB C 13 37.30 0.4 . . . . . . 91 ASN CB . 6700 1 882 . 2 2 43 43 ASN N N 15 116.65 0.3 . . . . . . 91 ASN N . 6700 1 883 . 2 2 44 44 ALA H H 1 7.90 0.05 . . . . . . 92 ALA H . 6700 1 884 . 2 2 44 44 ALA CA C 13 50.35 0.4 . . . . . . 92 ALA CA . 6700 1 885 . 2 2 44 44 ALA CB C 13 22.09 0.4 . . . . . . 92 ALA CB . 6700 1 886 . 2 2 44 44 ALA N N 15 121.14 0.3 . . . . . . 92 ALA N . 6700 1 887 . 2 2 45 45 GLU H H 1 9.11 0.05 . . . . . . 93 GLU H . 6700 1 888 . 2 2 45 45 GLU CA C 13 54.48 0.4 . . . . . . 93 GLU CA . 6700 1 889 . 2 2 45 45 GLU CB C 13 32.72 0.4 . . . . . . 93 GLU CB . 6700 1 890 . 2 2 45 45 GLU N N 15 120.65 0.3 . . . . . . 93 GLU N . 6700 1 891 . 2 2 46 46 TYR H H 1 8.92 0.05 . . . . . . 94 TYR H . 6700 1 892 . 2 2 46 46 TYR CA C 13 55.46 0.4 . . . . . . 94 TYR CA . 6700 1 893 . 2 2 46 46 TYR CB C 13 40.89 0.4 . . . . . . 94 TYR CB . 6700 1 894 . 2 2 46 46 TYR N N 15 123.17 0.3 . . . . . . 94 TYR N . 6700 1 895 . 2 2 47 47 ASN H H 1 9.13 0.05 . . . . . . 95 ASN H . 6700 1 896 . 2 2 47 47 ASN CA C 13 49.40 0.4 . . . . . . 95 ASN CA . 6700 1 897 . 2 2 47 47 ASN CB C 13 38.63 0.4 . . . . . . 95 ASN CB . 6700 1 898 . 2 2 47 47 ASN N N 15 125.23 0.3 . . . . . . 95 ASN N . 6700 1 899 . 2 2 48 48 PRO CA C 13 62.97 0.4 . . . . . . 96 PRO CA . 6700 1 900 . 2 2 48 48 PRO CB C 13 30.65 0.4 . . . . . . 96 PRO CB . 6700 1 901 . 2 2 49 49 LYS H H 1 7.78 0.05 . . . . . . 97 LYS H . 6700 1 902 . 2 2 49 49 LYS CA C 13 57.23 0.4 . . . . . . 97 LYS CA . 6700 1 903 . 2 2 49 49 LYS CB C 13 31.23 0.4 . . . . . . 97 LYS CB . 6700 1 904 . 2 2 49 49 LYS N N 15 117.01 0.3 . . . . . . 97 LYS N . 6700 1 905 . 2 2 50 50 ARG H H 1 7.56 0.05 . . . . . . 98 ARG H . 6700 1 906 . 2 2 50 50 ARG CA C 13 56.45 0.4 . . . . . . 98 ARG CA . 6700 1 907 . 2 2 50 50 ARG CB C 13 31.45 0.4 . . . . . . 98 ARG CB . 6700 1 908 . 2 2 50 50 ARG N N 15 117.63 0.3 . . . . . . 98 ARG N . 6700 1 909 . 2 2 51 51 PHE H H 1 7.81 0.05 . . . . . . 99 PHE H . 6700 1 910 . 2 2 51 51 PHE CA C 13 56.64 0.4 . . . . . . 99 PHE CA . 6700 1 911 . 2 2 51 51 PHE CB C 13 40.97 0.4 . . . . . . 99 PHE CB . 6700 1 912 . 2 2 51 51 PHE N N 15 114.93 0.3 . . . . . . 99 PHE N . 6700 1 913 . 2 2 52 52 ALA H H 1 8.52 0.05 . . . . . . 100 ALA H . 6700 1 914 . 2 2 52 52 ALA CA C 13 51.34 0.4 . . . . . . 100 ALA CA . 6700 1 915 . 2 2 52 52 ALA CB C 13 16.84 0.4 . . . . . . 100 ALA CB . 6700 1 916 . 2 2 52 52 ALA N N 15 131.11 0.3 . . . . . . 100 ALA N . 6700 1 917 . 2 2 53 53 ALA H H 1 7.41 0.05 . . . . . . 101 ALA H . 6700 1 918 . 2 2 53 53 ALA CA C 13 50.75 0.4 . . . . . . 101 ALA CA . 6700 1 919 . 2 2 53 53 ALA CB C 13 20.29 0.4 . . . . . . 101 ALA CB . 6700 1 920 . 2 2 53 53 ALA N N 15 119.78 0.3 . . . . . . 101 ALA N . 6700 1 921 . 2 2 54 54 VAL H H 1 8.46 0.05 . . . . . . 102 VAL H . 6700 1 922 . 2 2 54 54 VAL CA C 13 60.90 0.4 . . . . . . 102 VAL CA . 6700 1 923 . 2 2 54 54 VAL CB C 13 32.61 0.4 . . . . . . 102 VAL CB . 6700 1 924 . 2 2 54 54 VAL N N 15 120.79 0.3 . . . . . . 102 VAL N . 6700 1 925 . 2 2 55 55 ILE H H 1 8.85 0.05 . . . . . . 103 ILE H . 6700 1 926 . 2 2 55 55 ILE CA C 13 59.47 0.4 . . . . . . 103 ILE CA . 6700 1 927 . 2 2 55 55 ILE CB C 13 38.55 0.4 . . . . . . 103 ILE CB . 6700 1 928 . 2 2 55 55 ILE N N 15 127.22 0.3 . . . . . . 103 ILE N . 6700 1 929 . 2 2 56 56 MET H H 1 9.45 0.05 . . . . . . 104 MET H . 6700 1 930 . 2 2 56 56 MET CA C 13 53.57 0.4 . . . . . . 104 MET CA . 6700 1 931 . 2 2 56 56 MET CB C 13 37.40 0.4 . . . . . . 104 MET CB . 6700 1 932 . 2 2 56 56 MET N N 15 127.72 0.3 . . . . . . 104 MET N . 6700 1 933 . 2 2 57 57 ARG H H 1 7.75 0.05 . . . . . . 105 ARG H . 6700 1 934 . 2 2 57 57 ARG CA C 13 55.14 0.4 . . . . . . 105 ARG CA . 6700 1 935 . 2 2 57 57 ARG CB C 13 33.62 0.4 . . . . . . 105 ARG CB . 6700 1 936 . 2 2 57 57 ARG N N 15 118.60 0.3 . . . . . . 105 ARG N . 6700 1 937 . 2 2 58 58 ILE H H 1 7.33 0.05 . . . . . . 106 ILE H . 6700 1 938 . 2 2 58 58 ILE CA C 13 59.24 0.4 . . . . . . 106 ILE CA . 6700 1 939 . 2 2 58 58 ILE CB C 13 40.64 0.4 . . . . . . 106 ILE CB . 6700 1 940 . 2 2 58 58 ILE N N 15 116.75 0.3 . . . . . . 106 ILE N . 6700 1 941 . 2 2 59 59 ARG H H 1 8.50 0.05 . . . . . . 107 ARG H . 6700 1 942 . 2 2 59 59 ARG CA C 13 57.26 0.4 . . . . . . 107 ARG CA . 6700 1 943 . 2 2 59 59 ARG CB C 13 30.55 0.4 . . . . . . 107 ARG CB . 6700 1 944 . 2 2 59 59 ARG N N 15 120.16 0.3 . . . . . . 107 ARG N . 6700 1 945 . 2 2 60 60 GLU H H 1 7.25 0.05 . . . . . . 108 GLU H . 6700 1 946 . 2 2 60 60 GLU CA C 13 52.11 0.4 . . . . . . 108 GLU CA . 6700 1 947 . 2 2 60 60 GLU CB C 13 32.35 0.4 . . . . . . 108 GLU CB . 6700 1 948 . 2 2 60 60 GLU N N 15 116.12 0.3 . . . . . . 108 GLU N . 6700 1 949 . 2 2 61 61 PRO CA C 13 61.94 0.4 . . . . . . 109 PRO CA . 6700 1 950 . 2 2 61 61 PRO CB C 13 33.24 0.4 . . . . . . 109 PRO CB . 6700 1 951 . 2 2 62 62 LYS H H 1 8.60 0.05 . . . . . . 110 LYS H . 6700 1 952 . 2 2 62 62 LYS CA C 13 57.87 0.4 . . . . . . 110 LYS CA . 6700 1 953 . 2 2 62 62 LYS CB C 13 30.70 0.4 . . . . . . 110 LYS CB . 6700 1 954 . 2 2 62 62 LYS N N 15 126.29 0.3 . . . . . . 110 LYS N . 6700 1 955 . 2 2 63 63 THR H H 1 7.76 0.05 . . . . . . 111 THR H . 6700 1 956 . 2 2 63 63 THR CA C 13 60.88 0.4 . . . . . . 111 THR CA . 6700 1 957 . 2 2 63 63 THR CB C 13 76.23 0.4 . . . . . . 111 THR CB . 6700 1 958 . 2 2 63 63 THR N N 15 120.25 0.3 . . . . . . 111 THR N . 6700 1 959 . 2 2 64 64 THR H H 1 8.63 0.05 . . . . . . 112 THR H . 6700 1 960 . 2 2 64 64 THR CA C 13 61.90 0.4 . . . . . . 112 THR CA . 6700 1 961 . 2 2 64 64 THR CB C 13 71.52 0.4 . . . . . . 112 THR CB . 6700 1 962 . 2 2 64 64 THR N N 15 115.37 0.3 . . . . . . 112 THR N . 6700 1 963 . 2 2 65 65 ALA H H 1 9.40 0.05 . . . . . . 113 ALA H . 6700 1 964 . 2 2 65 65 ALA CA C 13 48.60 0.4 . . . . . . 113 ALA CA . 6700 1 965 . 2 2 65 65 ALA CB C 13 19.71 0.4 . . . . . . 113 ALA CB . 6700 1 966 . 2 2 65 65 ALA N N 15 128.06 0.3 . . . . . . 113 ALA N . 6700 1 967 . 2 2 66 66 LEU H H 1 9.13 0.05 . . . . . . 114 LEU H . 6700 1 968 . 2 2 66 66 LEU CA C 13 55.51 0.4 . . . . . . 114 LEU CA . 6700 1 969 . 2 2 66 66 LEU CB C 13 39.73 0.4 . . . . . . 114 LEU CB . 6700 1 970 . 2 2 66 66 LEU N N 15 119.99 0.3 . . . . . . 114 LEU N . 6700 1 971 . 2 2 67 67 ILE H H 1 8.90 0.05 . . . . . . 115 ILE H . 6700 1 972 . 2 2 67 67 ILE CA C 13 59.66 0.4 . . . . . . 115 ILE CA . 6700 1 973 . 2 2 67 67 ILE CB C 13 39.19 0.4 . . . . . . 115 ILE CB . 6700 1 974 . 2 2 67 67 ILE N N 15 123.02 0.3 . . . . . . 115 ILE N . 6700 1 975 . 2 2 68 68 PHE H H 1 8.39 0.05 . . . . . . 116 PHE H . 6700 1 976 . 2 2 68 68 PHE CA C 13 56.97 0.4 . . . . . . 116 PHE CA . 6700 1 977 . 2 2 68 68 PHE CB C 13 40.20 0.4 . . . . . . 116 PHE CB . 6700 1 978 . 2 2 68 68 PHE N N 15 123.70 0.3 . . . . . . 116 PHE N . 6700 1 979 . 2 2 69 69 ALA H H 1 9.50 0.05 . . . . . . 117 ALA H . 6700 1 980 . 2 2 69 69 ALA CA C 13 54.38 0.4 . . . . . . 117 ALA CA . 6700 1 981 . 2 2 69 69 ALA CB C 13 18.16 0.4 . . . . . . 117 ALA CB . 6700 1 982 . 2 2 69 69 ALA N N 15 124.70 0.3 . . . . . . 117 ALA N . 6700 1 983 . 2 2 70 70 SER H H 1 7.83 0.05 . . . . . . 118 SER H . 6700 1 984 . 2 2 70 70 SER CA C 13 57.68 0.4 . . . . . . 118 SER CA . 6700 1 985 . 2 2 70 70 SER CB C 13 63.97 0.4 . . . . . . 118 SER CB . 6700 1 986 . 2 2 70 70 SER N N 15 108.32 0.3 . . . . . . 118 SER N . 6700 1 987 . 2 2 71 71 GLY H H 1 8.38 0.05 . . . . . . 119 GLY H . 6700 1 988 . 2 2 71 71 GLY CA C 13 44.86 0.4 . . . . . . 119 GLY CA . 6700 1 989 . 2 2 71 71 GLY N N 15 110.74 0.3 . . . . . . 119 GLY N . 6700 1 990 . 2 2 72 72 LYS H H 1 7.29 0.05 . . . . . . 120 LYS H . 6700 1 991 . 2 2 72 72 LYS CA C 13 55.64 0.4 . . . . . . 120 LYS CA . 6700 1 992 . 2 2 72 72 LYS CB C 13 32.26 0.4 . . . . . . 120 LYS CB . 6700 1 993 . 2 2 72 72 LYS N N 15 120.60 0.3 . . . . . . 120 LYS N . 6700 1 994 . 2 2 73 73 MET H H 1 8.89 0.05 . . . . . . 121 MET H . 6700 1 995 . 2 2 73 73 MET CA C 13 53.16 0.4 . . . . . . 121 MET CA . 6700 1 996 . 2 2 73 73 MET CB C 13 37.47 0.4 . . . . . . 121 MET CB . 6700 1 997 . 2 2 73 73 MET N N 15 123.02 0.3 . . . . . . 121 MET N . 6700 1 998 . 2 2 74 74 VAL H H 1 9.05 0.05 . . . . . . 122 VAL H . 6700 1 999 . 2 2 74 74 VAL CA C 13 59.53 0.4 . . . . . . 122 VAL CA . 6700 1 1000 . 2 2 74 74 VAL CB C 13 34.12 0.4 . . . . . . 122 VAL CB . 6700 1 1001 . 2 2 74 74 VAL N N 15 125.60 0.3 . . . . . . 122 VAL N . 6700 1 1002 . 2 2 75 75 VAL H H 1 9.37 0.05 . . . . . . 123 VAL H . 6700 1 1003 . 2 2 75 75 VAL CA C 13 60.68 0.4 . . . . . . 123 VAL CA . 6700 1 1004 . 2 2 75 75 VAL CB C 13 34.44 0.4 . . . . . . 123 VAL CB . 6700 1 1005 . 2 2 75 75 VAL N N 15 126.41 0.3 . . . . . . 123 VAL N . 6700 1 1006 . 2 2 76 76 THR H H 1 9.62 0.05 . . . . . . 124 THR H . 6700 1 1007 . 2 2 76 76 THR CA C 13 57.87 0.4 . . . . . . 124 THR CA . 6700 1 1008 . 2 2 76 76 THR CB C 13 71.17 0.4 . . . . . . 124 THR CB . 6700 1 1009 . 2 2 76 76 THR N N 15 125.07 0.3 . . . . . . 124 THR N . 6700 1 1010 . 2 2 77 77 GLY H H 1 8.43 0.05 . . . . . . 125 GLY H . 6700 1 1011 . 2 2 77 77 GLY CA C 13 45.04 0.4 . . . . . . 125 GLY CA . 6700 1 1012 . 2 2 77 77 GLY N N 15 113.08 0.3 . . . . . . 125 GLY N . 6700 1 1013 . 2 2 78 78 ALA H H 1 6.95 0.05 . . . . . . 126 ALA H . 6700 1 1014 . 2 2 78 78 ALA CA C 13 50.61 0.4 . . . . . . 126 ALA CA . 6700 1 1015 . 2 2 78 78 ALA CB C 13 19.49 0.4 . . . . . . 126 ALA CB . 6700 1 1016 . 2 2 78 78 ALA N N 15 120.40 0.3 . . . . . . 126 ALA N . 6700 1 1017 . 2 2 79 79 LYS H H 1 9.38 0.05 . . . . . . 127 LYS H . 6700 1 1018 . 2 2 79 79 LYS CA C 13 54.69 0.4 . . . . . . 127 LYS CA . 6700 1 1019 . 2 2 79 79 LYS CB C 13 32.17 0.4 . . . . . . 127 LYS CB . 6700 1 1020 . 2 2 79 79 LYS N N 15 114.97 0.3 . . . . . . 127 LYS N . 6700 1 1021 . 2 2 80 80 SER H H 1 7.34 0.05 . . . . . . 128 SER H . 6700 1 1022 . 2 2 80 80 SER CA C 13 55.89 0.4 . . . . . . 128 SER CA . 6700 1 1023 . 2 2 80 80 SER CB C 13 66.84 0.4 . . . . . . 128 SER CB . 6700 1 1024 . 2 2 80 80 SER N N 15 108.77 0.3 . . . . . . 128 SER N . 6700 1 1025 . 2 2 81 81 GLU H H 1 8.75 0.05 . . . . . . 129 GLU H . 6700 1 1026 . 2 2 81 81 GLU CB C 13 29.45 0.4 . . . . . . 129 GLU CB . 6700 1 1027 . 2 2 81 81 GLU N N 15 123.18 0.3 . . . . . . 129 GLU N . 6700 1 1028 . 2 2 82 82 ASP H H 1 7.95 0.05 . . . . . . 130 ASP H . 6700 1 1029 . 2 2 82 82 ASP CA C 13 56.76 0.4 . . . . . . 130 ASP CA . 6700 1 1030 . 2 2 82 82 ASP CB C 13 39.67 0.4 . . . . . . 130 ASP CB . 6700 1 1031 . 2 2 82 82 ASP N N 15 121.67 0.3 . . . . . . 130 ASP N . 6700 1 1032 . 2 2 83 83 ASP H H 1 7.95 0.05 . . . . . . 131 ASP H . 6700 1 1033 . 2 2 83 83 ASP CA C 13 56.45 0.4 . . . . . . 131 ASP CA . 6700 1 1034 . 2 2 83 83 ASP CB C 13 39.48 0.4 . . . . . . 131 ASP CB . 6700 1 1035 . 2 2 83 83 ASP N N 15 121.67 0.3 . . . . . . 131 ASP N . 6700 1 1036 . 2 2 84 84 SER H H 1 8.08 0.05 . . . . . . 132 SER H . 6700 1 1037 . 2 2 84 84 SER CA C 13 61.70 0.4 . . . . . . 132 SER CA . 6700 1 1038 . 2 2 84 84 SER CB C 13 63.36 0.4 . . . . . . 132 SER CB . 6700 1 1039 . 2 2 84 84 SER N N 15 115.93 0.3 . . . . . . 132 SER N . 6700 1 1040 . 2 2 85 85 LYS H H 1 7.83 0.05 . . . . . . 133 LYS H . 6700 1 1041 . 2 2 85 85 LYS CA C 13 59.51 0.4 . . . . . . 133 LYS CA . 6700 1 1042 . 2 2 85 85 LYS CB C 13 31.68 0.4 . . . . . . 133 LYS CB . 6700 1 1043 . 2 2 85 85 LYS N N 15 122.93 0.3 . . . . . . 133 LYS N . 6700 1 1044 . 2 2 86 86 LEU H H 1 8.01 0.05 . . . . . . 134 LEU H . 6700 1 1045 . 2 2 86 86 LEU CA C 13 57.47 0.4 . . . . . . 134 LEU CA . 6700 1 1046 . 2 2 86 86 LEU CB C 13 41.53 0.4 . . . . . . 134 LEU CB . 6700 1 1047 . 2 2 86 86 LEU N N 15 119.94 0.3 . . . . . . 134 LEU N . 6700 1 1048 . 2 2 87 87 ALA H H 1 8.68 0.05 . . . . . . 135 ALA H . 6700 1 1049 . 2 2 87 87 ALA CA C 13 54.57 0.4 . . . . . . 135 ALA CA . 6700 1 1050 . 2 2 87 87 ALA CB C 13 18.68 0.4 . . . . . . 135 ALA CB . 6700 1 1051 . 2 2 87 87 ALA N N 15 119.15 0.3 . . . . . . 135 ALA N . 6700 1 1052 . 2 2 88 88 SER H H 1 8.10 0.05 . . . . . . 136 SER H . 6700 1 1053 . 2 2 88 88 SER CA C 13 63.74 0.4 . . . . . . 136 SER CA . 6700 1 1054 . 2 2 88 88 SER CB C 13 63.25 0.4 . . . . . . 136 SER CB . 6700 1 1055 . 2 2 88 88 SER N N 15 111.98 0.3 . . . . . . 136 SER N . 6700 1 1056 . 2 2 89 89 ARG H H 1 8.07 0.05 . . . . . . 137 ARG H . 6700 1 1057 . 2 2 89 89 ARG CA C 13 58.96 0.4 . . . . . . 137 ARG CA . 6700 1 1058 . 2 2 89 89 ARG CB C 13 29.41 0.4 . . . . . . 137 ARG CB . 6700 1 1059 . 2 2 89 89 ARG N N 15 121.47 0.3 . . . . . . 137 ARG N . 6700 1 1060 . 2 2 90 90 LYS H H 1 8.47 0.05 . . . . . . 138 LYS H . 6700 1 1061 . 2 2 90 90 LYS CB C 13 30.97 0.4 . . . . . . 138 LYS CB . 6700 1 1062 . 2 2 90 90 LYS N N 15 118.10 0.3 . . . . . . 138 LYS N . 6700 1 1063 . 2 2 91 91 TYR H H 1 8.47 0.05 . . . . . . 139 TYR H . 6700 1 1064 . 2 2 91 91 TYR CB C 13 38.87 0.4 . . . . . . 139 TYR CB . 6700 1 1065 . 2 2 91 91 TYR N N 15 118.10 0.3 . . . . . . 139 TYR N . 6700 1 1066 . 2 2 92 92 ALA H H 1 7.96 0.05 . . . . . . 140 ALA H . 6700 1 1067 . 2 2 92 92 ALA CA C 13 55.03 0.4 . . . . . . 140 ALA CA . 6700 1 1068 . 2 2 92 92 ALA CB C 13 17.69 0.4 . . . . . . 140 ALA CB . 6700 1 1069 . 2 2 92 92 ALA N N 15 118.98 0.3 . . . . . . 140 ALA N . 6700 1 1070 . 2 2 93 93 ARG H H 1 7.90 0.05 . . . . . . 141 ARG H . 6700 1 1071 . 2 2 93 93 ARG CA C 13 57.80 0.4 . . . . . . 141 ARG CA . 6700 1 1072 . 2 2 93 93 ARG CB C 13 29.25 0.4 . . . . . . 141 ARG CB . 6700 1 1073 . 2 2 93 93 ARG N N 15 117.43 0.3 . . . . . . 141 ARG N . 6700 1 1074 . 2 2 94 94 ILE H H 1 7.89 0.05 . . . . . . 142 ILE H . 6700 1 1075 . 2 2 94 94 ILE CA C 13 65.20 0.4 . . . . . . 142 ILE CA . 6700 1 1076 . 2 2 94 94 ILE CB C 13 37.50 0.4 . . . . . . 142 ILE CB . 6700 1 1077 . 2 2 94 94 ILE N N 15 121.14 0.3 . . . . . . 142 ILE N . 6700 1 1078 . 2 2 95 95 ILE H H 1 7.62 0.05 . . . . . . 143 ILE H . 6700 1 1079 . 2 2 95 95 ILE CB C 13 35.83 0.4 . . . . . . 143 ILE CB . 6700 1 1080 . 2 2 95 95 ILE N N 15 118.35 0.3 . . . . . . 143 ILE N . 6700 1 1081 . 2 2 96 96 GLN H H 1 8.36 0.05 . . . . . . 144 GLN H . 6700 1 1082 . 2 2 96 96 GLN CA C 13 57.64 0.4 . . . . . . 144 GLN CA . 6700 1 1083 . 2 2 96 96 GLN CB C 13 28.28 0.4 . . . . . . 144 GLN CB . 6700 1 1084 . 2 2 96 96 GLN N N 15 119.80 0.3 . . . . . . 144 GLN N . 6700 1 1085 . 2 2 97 97 LYS H H 1 8.42 0.05 . . . . . . 145 LYS H . 6700 1 1086 . 2 2 97 97 LYS CA C 13 58.23 0.4 . . . . . . 145 LYS CA . 6700 1 1087 . 2 2 97 97 LYS CB C 13 31.49 0.4 . . . . . . 145 LYS CB . 6700 1 1088 . 2 2 97 97 LYS N N 15 120.21 0.3 . . . . . . 145 LYS N . 6700 1 1089 . 2 2 98 98 ILE H H 1 7.66 0.05 . . . . . . 146 ILE H . 6700 1 1090 . 2 2 98 98 ILE CA C 13 62.58 0.4 . . . . . . 146 ILE CA . 6700 1 1091 . 2 2 98 98 ILE CB C 13 37.62 0.4 . . . . . . 146 ILE CB . 6700 1 1092 . 2 2 98 98 ILE N N 15 117.46 0.3 . . . . . . 146 ILE N . 6700 1 1093 . 2 2 99 99 GLY H H 1 7.58 0.05 . . . . . . 147 GLY H . 6700 1 1094 . 2 2 99 99 GLY CA C 13 44.09 0.4 . . . . . . 147 GLY CA . 6700 1 1095 . 2 2 99 99 GLY N N 15 129.31 0.3 . . . . . . 147 GLY N . 6700 1 1096 . 2 2 100 100 PHE H H 1 7.11 0.05 . . . . . . 148 PHE H . 6700 1 1097 . 2 2 100 100 PHE CA C 13 57.02 0.4 . . . . . . 148 PHE CA . 6700 1 1098 . 2 2 100 100 PHE CB C 13 40.35 0.4 . . . . . . 148 PHE CB . 6700 1 1099 . 2 2 100 100 PHE N N 15 118.25 0.3 . . . . . . 148 PHE N . 6700 1 1100 . 2 2 101 101 ALA H H 1 9.06 0.05 . . . . . . 149 ALA H . 6700 1 1101 . 2 2 101 101 ALA CA C 13 50.61 0.4 . . . . . . 149 ALA CA . 6700 1 1102 . 2 2 101 101 ALA CB C 13 15.85 0.4 . . . . . . 149 ALA CB . 6700 1 1103 . 2 2 101 101 ALA N N 15 130.61 0.3 . . . . . . 149 ALA N . 6700 1 1104 . 2 2 102 102 ALA H H 1 7.86 0.05 . . . . . . 150 ALA H . 6700 1 1105 . 2 2 102 102 ALA CA C 13 50.32 0.4 . . . . . . 150 ALA CA . 6700 1 1106 . 2 2 102 102 ALA CB C 13 21.30 0.4 . . . . . . 150 ALA CB . 6700 1 1107 . 2 2 102 102 ALA N N 15 123.92 0.3 . . . . . . 150 ALA N . 6700 1 1108 . 2 2 103 103 LYS H H 1 9.25 0.05 . . . . . . 151 LYS H . 6700 1 1109 . 2 2 103 103 LYS CA C 13 54.21 0.4 . . . . . . 151 LYS CA . 6700 1 1110 . 2 2 103 103 LYS CB C 13 35.10 0.4 . . . . . . 151 LYS CB . 6700 1 1111 . 2 2 103 103 LYS N N 15 123.57 0.3 . . . . . . 151 LYS N . 6700 1 1112 . 2 2 104 104 PHE H H 1 8.54 0.05 . . . . . . 152 PHE H . 6700 1 1113 . 2 2 104 104 PHE CA C 13 57.05 0.4 . . . . . . 152 PHE CA . 6700 1 1114 . 2 2 104 104 PHE CB C 13 38.81 0.4 . . . . . . 152 PHE CB . 6700 1 1115 . 2 2 104 104 PHE N N 15 121.64 0.3 . . . . . . 152 PHE N . 6700 1 1116 . 2 2 105 105 THR H H 1 7.45 0.05 . . . . . . 153 THR H . 6700 1 1117 . 2 2 105 105 THR CA C 13 60.26 0.4 . . . . . . 153 THR CA . 6700 1 1118 . 2 2 105 105 THR CB C 13 70.98 0.4 . . . . . . 153 THR CB . 6700 1 1119 . 2 2 105 105 THR N N 15 119.91 0.3 . . . . . . 153 THR N . 6700 1 1120 . 2 2 106 106 ASP H H 1 8.52 0.05 . . . . . . 154 ASP H . 6700 1 1121 . 2 2 106 106 ASP CA C 13 53.81 0.4 . . . . . . 154 ASP CA . 6700 1 1122 . 2 2 106 106 ASP CB C 13 39.60 0.4 . . . . . . 154 ASP CB . 6700 1 1123 . 2 2 106 106 ASP N N 15 119.54 0.3 . . . . . . 154 ASP N . 6700 1 1124 . 2 2 107 107 PHE H H 1 7.97 0.05 . . . . . . 155 PHE H . 6700 1 1125 . 2 2 107 107 PHE CA C 13 58.49 0.4 . . . . . . 155 PHE CA . 6700 1 1126 . 2 2 107 107 PHE CB C 13 39.26 0.4 . . . . . . 155 PHE CB . 6700 1 1127 . 2 2 107 107 PHE N N 15 118.70 0.3 . . . . . . 155 PHE N . 6700 1 1128 . 2 2 108 108 LYS H H 1 8.35 0.05 . . . . . . 156 LYS H . 6700 1 1129 . 2 2 108 108 LYS CA C 13 54.47 0.4 . . . . . . 156 LYS CA . 6700 1 1130 . 2 2 108 108 LYS CB C 13 35.33 0.4 . . . . . . 156 LYS CB . 6700 1 1131 . 2 2 108 108 LYS N N 15 129.42 0.3 . . . . . . 156 LYS N . 6700 1 1132 . 2 2 109 109 ILE H H 1 8.48 0.05 . . . . . . 157 ILE H . 6700 1 1133 . 2 2 109 109 ILE CA C 13 61.71 0.4 . . . . . . 157 ILE CA . 6700 1 1134 . 2 2 109 109 ILE CB C 13 35.88 0.4 . . . . . . 157 ILE CB . 6700 1 1135 . 2 2 109 109 ILE N N 15 124.63 0.3 . . . . . . 157 ILE N . 6700 1 1136 . 2 2 110 110 GLN H H 1 8.99 0.05 . . . . . . 158 GLN H . 6700 1 1137 . 2 2 110 110 GLN CA C 13 54.18 0.4 . . . . . . 158 GLN CA . 6700 1 1138 . 2 2 110 110 GLN CB C 13 30.64 0.4 . . . . . . 158 GLN CB . 6700 1 1139 . 2 2 110 110 GLN N N 15 125.18 0.3 . . . . . . 158 GLN N . 6700 1 1140 . 2 2 111 111 ASN H H 1 7.65 0.05 . . . . . . 159 ASN H . 6700 1 1141 . 2 2 111 111 ASN CA C 13 53.81 0.4 . . . . . . 159 ASN CA . 6700 1 1142 . 2 2 111 111 ASN CB C 13 41.33 0.4 . . . . . . 159 ASN CB . 6700 1 1143 . 2 2 111 111 ASN N N 15 114.53 0.3 . . . . . . 159 ASN N . 6700 1 1144 . 2 2 112 112 ILE H H 1 8.28 0.05 . . . . . . 160 ILE H . 6700 1 1145 . 2 2 112 112 ILE CA C 13 60.32 0.4 . . . . . . 160 ILE CA . 6700 1 1146 . 2 2 112 112 ILE CB C 13 40.17 0.4 . . . . . . 160 ILE CB . 6700 1 1147 . 2 2 112 112 ILE N N 15 127.75 0.3 . . . . . . 160 ILE N . 6700 1 1148 . 2 2 113 113 VAL H H 1 8.71 0.05 . . . . . . 161 VAL H . 6700 1 1149 . 2 2 113 113 VAL CA C 13 58.85 0.4 . . . . . . 161 VAL CA . 6700 1 1150 . 2 2 113 113 VAL CB C 13 34.03 0.4 . . . . . . 161 VAL CB . 6700 1 1151 . 2 2 113 113 VAL N N 15 123.92 0.3 . . . . . . 161 VAL N . 6700 1 1152 . 2 2 114 114 GLY H H 1 9.54 0.05 . . . . . . 162 GLY H . 6700 1 1153 . 2 2 114 114 GLY CA C 13 42.99 0.4 . . . . . . 162 GLY CA . 6700 1 1154 . 2 2 114 114 GLY N N 15 113.31 0.3 . . . . . . 162 GLY N . 6700 1 1155 . 2 2 115 115 SER H H 1 9.24 0.05 . . . . . . 163 SER H . 6700 1 1156 . 2 2 115 115 SER CA C 13 56.59 0.4 . . . . . . 163 SER CA . 6700 1 1157 . 2 2 115 115 SER CB C 13 66.91 0.4 . . . . . . 163 SER CB . 6700 1 1158 . 2 2 115 115 SER N N 15 114.44 0.3 . . . . . . 163 SER N . 6700 1 1159 . 2 2 116 116 CYS H H 1 8.92 0.05 . . . . . . 164 CYS H . 6700 1 1160 . 2 2 116 116 CYS CA C 13 56.20 0.4 . . . . . . 164 CYS CA . 6700 1 1161 . 2 2 116 116 CYS CB C 13 30.47 0.4 . . . . . . 164 CYS CB . 6700 1 1162 . 2 2 116 116 CYS N N 15 116.48 0.3 . . . . . . 164 CYS N . 6700 1 1163 . 2 2 117 117 ASP H H 1 8.17 0.05 . . . . . . 165 ASP H . 6700 1 1164 . 2 2 117 117 ASP CA C 13 51.69 0.4 . . . . . . 165 ASP CA . 6700 1 1165 . 2 2 117 117 ASP CB C 13 42.30 0.4 . . . . . . 165 ASP CB . 6700 1 1166 . 2 2 117 117 ASP N N 15 121.86 0.3 . . . . . . 165 ASP N . 6700 1 1167 . 2 2 118 118 VAL H H 1 8.52 0.05 . . . . . . 166 VAL H . 6700 1 1168 . 2 2 118 118 VAL CA C 13 61.32 0.4 . . . . . . 166 VAL CA . 6700 1 1169 . 2 2 118 118 VAL CB C 13 30.97 0.4 . . . . . . 166 VAL CB . 6700 1 1170 . 2 2 118 118 VAL N N 15 116.99 0.3 . . . . . . 166 VAL N . 6700 1 1171 . 2 2 119 119 LYS H H 1 8.63 0.05 . . . . . . 167 LYS H . 6700 1 1172 . 2 2 119 119 LYS CA C 13 56.81 0.4 . . . . . . 167 LYS CA . 6700 1 1173 . 2 2 119 119 LYS CB C 13 28.24 0.4 . . . . . . 167 LYS CB . 6700 1 1174 . 2 2 119 119 LYS N N 15 111.77 0.3 . . . . . . 167 LYS N . 6700 1 1175 . 2 2 120 120 PHE H H 1 7.11 0.05 . . . . . . 168 PHE H . 6700 1 1176 . 2 2 120 120 PHE CA C 13 53.76 0.4 . . . . . . 168 PHE CA . 6700 1 1177 . 2 2 120 120 PHE CB C 13 38.32 0.4 . . . . . . 168 PHE CB . 6700 1 1178 . 2 2 120 120 PHE N N 15 115.14 0.3 . . . . . . 168 PHE N . 6700 1 1179 . 2 2 121 121 PRO CA C 13 60.46 0.4 . . . . . . 169 PRO CA . 6700 1 1180 . 2 2 121 121 PRO CB C 13 31.50 0.4 . . . . . . 169 PRO CB . 6700 1 1181 . 2 2 122 122 ILE H H 1 8.36 0.05 . . . . . . 170 ILE H . 6700 1 1182 . 2 2 122 122 ILE CA C 13 59.45 0.4 . . . . . . 170 ILE CA . 6700 1 1183 . 2 2 122 122 ILE CB C 13 40.54 0.4 . . . . . . 170 ILE CB . 6700 1 1184 . 2 2 122 122 ILE N N 15 119.80 0.3 . . . . . . 170 ILE N . 6700 1 1185 . 2 2 123 123 ARG H H 1 9.08 0.05 . . . . . . 171 ARG H . 6700 1 1186 . 2 2 123 123 ARG CA C 13 54.17 0.4 . . . . . . 171 ARG CA . 6700 1 1187 . 2 2 123 123 ARG CB C 13 28.18 0.4 . . . . . . 171 ARG CB . 6700 1 1188 . 2 2 123 123 ARG N N 15 126.01 0.3 . . . . . . 171 ARG N . 6700 1 1189 . 2 2 124 124 LEU H H 1 7.79 0.05 . . . . . . 172 LEU H . 6700 1 1190 . 2 2 124 124 LEU CA C 13 57.22 0.4 . . . . . . 172 LEU CA . 6700 1 1191 . 2 2 124 124 LEU CB C 13 39.68 0.4 . . . . . . 172 LEU CB . 6700 1 1192 . 2 2 124 124 LEU N N 15 126.17 0.3 . . . . . . 172 LEU N . 6700 1 1193 . 2 2 125 125 GLU H H 1 9.25 0.05 . . . . . . 173 GLU H . 6700 1 1194 . 2 2 125 125 GLU CA C 13 59.04 0.4 . . . . . . 173 GLU CA . 6700 1 1195 . 2 2 125 125 GLU CB C 13 27.91 0.4 . . . . . . 173 GLU CB . 6700 1 1196 . 2 2 125 125 GLU N N 15 116.17 0.3 . . . . . . 173 GLU N . 6700 1 1197 . 2 2 126 126 GLY H H 1 7.36 0.05 . . . . . . 174 GLY H . 6700 1 1198 . 2 2 126 126 GLY CA C 13 46.42 0.4 . . . . . . 174 GLY CA . 6700 1 1199 . 2 2 126 126 GLY N N 15 131.80 0.3 . . . . . . 174 GLY N . 6700 1 1200 . 2 2 127 127 LEU H H 1 7.14 0.05 . . . . . . 175 LEU H . 6700 1 1201 . 2 2 127 127 LEU CA C 13 57.50 0.4 . . . . . . 175 LEU CA . 6700 1 1202 . 2 2 127 127 LEU CB C 13 40.96 0.4 . . . . . . 175 LEU CB . 6700 1 1203 . 2 2 127 127 LEU N N 15 127.10 0.3 . . . . . . 175 LEU N . 6700 1 1204 . 2 2 128 128 ALA H H 1 8.19 0.05 . . . . . . 176 ALA H . 6700 1 1205 . 2 2 128 128 ALA CA C 13 53.54 0.4 . . . . . . 176 ALA CA . 6700 1 1206 . 2 2 128 128 ALA CB C 13 17.85 0.4 . . . . . . 176 ALA CB . 6700 1 1207 . 2 2 128 128 ALA N N 15 119.18 0.3 . . . . . . 176 ALA N . 6700 1 1208 . 2 2 129 129 PHE H H 1 7.44 0.05 . . . . . . 177 PHE H . 6700 1 1209 . 2 2 129 129 PHE CA C 13 59.45 0.4 . . . . . . 177 PHE CA . 6700 1 1210 . 2 2 129 129 PHE CB C 13 39.07 0.4 . . . . . . 177 PHE CB . 6700 1 1211 . 2 2 129 129 PHE N N 15 114.68 0.3 . . . . . . 177 PHE N . 6700 1 1212 . 2 2 130 130 SER H H 1 7.99 0.05 . . . . . . 178 SER H . 6700 1 1213 . 2 2 130 130 SER CA C 13 60.62 0.4 . . . . . . 178 SER CA . 6700 1 1214 . 2 2 130 130 SER CB C 13 64.06 0.4 . . . . . . 178 SER CB . 6700 1 1215 . 2 2 130 130 SER N N 15 114.20 0.3 . . . . . . 178 SER N . 6700 1 1216 . 2 2 131 131 HIS H H 1 8.42 0.05 . . . . . . 179 HIS H . 6700 1 1217 . 2 2 131 131 HIS CA C 13 54.61 0.4 . . . . . . 179 HIS CA . 6700 1 1218 . 2 2 131 131 HIS CB C 13 29.60 0.4 . . . . . . 179 HIS CB . 6700 1 1219 . 2 2 131 131 HIS N N 15 121.77 0.3 . . . . . . 179 HIS N . 6700 1 1220 . 2 2 132 132 GLY H H 1 7.61 0.05 . . . . . . 180 GLY H . 6700 1 1221 . 2 2 132 132 GLY CA C 13 47.52 0.4 . . . . . . 180 GLY CA . 6700 1 1222 . 2 2 132 132 GLY N N 15 111.85 0.3 . . . . . . 180 GLY N . 6700 1 1223 . 2 2 133 133 THR H H 1 6.93 0.05 . . . . . . 181 THR H . 6700 1 1224 . 2 2 133 133 THR CA C 13 68.17 0.4 . . . . . . 181 THR CA . 6700 1 1225 . 2 2 133 133 THR CB C 13 63.83 0.4 . . . . . . 181 THR CB . 6700 1 1226 . 2 2 133 133 THR N N 15 116.35 0.3 . . . . . . 181 THR N . 6700 1 1227 . 2 2 134 134 PHE H H 1 6.93 0.05 . . . . . . 182 PHE H . 6700 1 1228 . 2 2 134 134 PHE CA C 13 56.45 0.4 . . . . . . 182 PHE CA . 6700 1 1229 . 2 2 134 134 PHE CB C 13 40.56 0.4 . . . . . . 182 PHE CB . 6700 1 1230 . 2 2 134 134 PHE N N 15 116.35 0.3 . . . . . . 182 PHE N . 6700 1 1231 . 2 2 135 135 SER H H 1 7.27 0.05 . . . . . . 183 SER H . 6700 1 1232 . 2 2 135 135 SER CA C 13 57.86 0.4 . . . . . . 183 SER CA . 6700 1 1233 . 2 2 135 135 SER CB C 13 67.21 0.4 . . . . . . 183 SER CB . 6700 1 1234 . 2 2 135 135 SER N N 15 112.36 0.3 . . . . . . 183 SER N . 6700 1 1235 . 2 2 136 136 SER H H 1 9.14 0.05 . . . . . . 184 SER H . 6700 1 1236 . 2 2 136 136 SER CA C 13 57.16 0.4 . . . . . . 184 SER CA . 6700 1 1237 . 2 2 136 136 SER CB C 13 65.03 0.4 . . . . . . 184 SER CB . 6700 1 1238 . 2 2 136 136 SER N N 15 117.27 0.3 . . . . . . 184 SER N . 6700 1 1239 . 2 2 137 137 TYR H H 1 9.20 0.05 . . . . . . 185 TYR H . 6700 1 1240 . 2 2 137 137 TYR CA C 13 55.74 0.4 . . . . . . 185 TYR CA . 6700 1 1241 . 2 2 137 137 TYR CB C 13 39.20 0.4 . . . . . . 185 TYR CB . 6700 1 1242 . 2 2 137 137 TYR N N 15 127.20 0.3 . . . . . . 185 TYR N . 6700 1 1243 . 2 2 138 138 GLU H H 1 9.60 0.05 . . . . . . 186 GLU H . 6700 1 1244 . 2 2 138 138 GLU CA C 13 52.13 0.4 . . . . . . 186 GLU CA . 6700 1 1245 . 2 2 138 138 GLU CB C 13 29.83 0.4 . . . . . . 186 GLU CB . 6700 1 1246 . 2 2 138 138 GLU N N 15 129.34 0.3 . . . . . . 186 GLU N . 6700 1 1247 . 2 2 139 139 PRO CA C 13 63.30 0.4 . . . . . . 187 PRO CA . 6700 1 1248 . 2 2 139 139 PRO CB C 13 30.58 0.4 . . . . . . 187 PRO CB . 6700 1 1249 . 2 2 140 140 GLU H H 1 8.73 0.05 . . . . . . 188 GLU H . 6700 1 1250 . 2 2 140 140 GLU CA C 13 57.60 0.4 . . . . . . 188 GLU CA . 6700 1 1251 . 2 2 140 140 GLU CB C 13 28.45 0.4 . . . . . . 188 GLU CB . 6700 1 1252 . 2 2 140 140 GLU N N 15 117.80 0.3 . . . . . . 188 GLU N . 6700 1 1253 . 2 2 141 141 LEU H H 1 7.96 0.05 . . . . . . 189 LEU H . 6700 1 1254 . 2 2 141 141 LEU CA C 13 55.03 0.4 . . . . . . 189 LEU CA . 6700 1 1255 . 2 2 141 141 LEU CB C 13 43.55 0.4 . . . . . . 189 LEU CB . 6700 1 1256 . 2 2 141 141 LEU N N 15 118.98 0.3 . . . . . . 189 LEU N . 6700 1 1257 . 2 2 142 142 PHE H H 1 8.02 0.05 . . . . . . 190 PHE H . 6700 1 1258 . 2 2 142 142 PHE CA C 13 54.43 0.4 . . . . . . 190 PHE CA . 6700 1 1259 . 2 2 142 142 PHE CB C 13 41.81 0.4 . . . . . . 190 PHE CB . 6700 1 1260 . 2 2 142 142 PHE N N 15 118.79 0.3 . . . . . . 190 PHE N . 6700 1 1261 . 2 2 143 143 PRO CA C 13 63.49 0.4 . . . . . . 191 PRO CA . 6700 1 1262 . 2 2 143 143 PRO CB C 13 31.30 0.4 . . . . . . 191 PRO CB . 6700 1 1263 . 2 2 144 144 GLY H H 1 5.99 0.05 . . . . . . 192 GLY H . 6700 1 1264 . 2 2 144 144 GLY CA C 13 42.87 0.4 . . . . . . 192 GLY CA . 6700 1 1265 . 2 2 144 144 GLY N N 15 130.24 0.3 . . . . . . 192 GLY N . 6700 1 1266 . 2 2 145 145 LEU H H 1 9.03 0.05 . . . . . . 193 LEU H . 6700 1 1267 . 2 2 145 145 LEU CA C 13 54.22 0.4 . . . . . . 193 LEU CA . 6700 1 1268 . 2 2 145 145 LEU CB C 13 45.06 0.4 . . . . . . 193 LEU CB . 6700 1 1269 . 2 2 145 145 LEU N N 15 123.71 0.3 . . . . . . 193 LEU N . 6700 1 1270 . 2 2 146 146 ILE H H 1 8.86 0.05 . . . . . . 194 ILE H . 6700 1 1271 . 2 2 146 146 ILE CA C 13 59.67 0.4 . . . . . . 194 ILE CA . 6700 1 1272 . 2 2 146 146 ILE CB C 13 38.16 0.4 . . . . . . 194 ILE CB . 6700 1 1273 . 2 2 146 146 ILE N N 15 127.22 0.3 . . . . . . 194 ILE N . 6700 1 1274 . 2 2 147 147 TYR H H 1 9.85 0.05 . . . . . . 195 TYR H . 6700 1 1275 . 2 2 147 147 TYR CA C 13 56.01 0.4 . . . . . . 195 TYR CA . 6700 1 1276 . 2 2 147 147 TYR CB C 13 41.92 0.4 . . . . . . 195 TYR CB . 6700 1 1277 . 2 2 147 147 TYR N N 15 108.18 0.3 . . . . . . 195 TYR N . 6700 1 1278 . 2 2 148 148 ARG H H 1 8.96 0.05 . . . . . . 196 ARG H . 6700 1 1279 . 2 2 148 148 ARG CA C 13 55.02 0.4 . . . . . . 196 ARG CA . 6700 1 1280 . 2 2 148 148 ARG CB C 13 28.92 0.4 . . . . . . 196 ARG CB . 6700 1 1281 . 2 2 148 148 ARG N N 15 129.77 0.3 . . . . . . 196 ARG N . 6700 1 1282 . 2 2 149 149 MET H H 1 8.34 0.05 . . . . . . 197 MET H . 6700 1 1283 . 2 2 149 149 MET CA C 13 55.64 0.4 . . . . . . 197 MET CA . 6700 1 1284 . 2 2 149 149 MET CB C 13 34.27 0.4 . . . . . . 197 MET CB . 6700 1 1285 . 2 2 149 149 MET N N 15 124.89 0.3 . . . . . . 197 MET N . 6700 1 1286 . 2 2 150 150 VAL H H 1 8.04 0.05 . . . . . . 198 VAL H . 6700 1 1287 . 2 2 150 150 VAL CA C 13 63.74 0.4 . . . . . . 198 VAL CA . 6700 1 1288 . 2 2 150 150 VAL CB C 13 32.35 0.4 . . . . . . 198 VAL CB . 6700 1 1289 . 2 2 150 150 VAL N N 15 121.97 0.3 . . . . . . 198 VAL N . 6700 1 1290 . 2 2 151 151 LYS H H 1 7.24 0.05 . . . . . . 199 LYS H . 6700 1 1291 . 2 2 151 151 LYS CA C 13 53.11 0.4 . . . . . . 199 LYS CA . 6700 1 1292 . 2 2 151 151 LYS CB C 13 34.58 0.4 . . . . . . 199 LYS CB . 6700 1 1293 . 2 2 151 151 LYS N N 15 119.62 0.3 . . . . . . 199 LYS N . 6700 1 1294 . 2 2 152 152 PRO CA C 13 62.51 0.4 . . . . . . 200 PRO CA . 6700 1 1295 . 2 2 152 152 PRO CB C 13 33.32 0.4 . . . . . . 200 PRO CB . 6700 1 1296 . 2 2 153 153 LYS H H 1 8.21 0.05 . . . . . . 201 LYS H . 6700 1 1297 . 2 2 153 153 LYS CA C 13 55.22 0.4 . . . . . . 201 LYS CA . 6700 1 1298 . 2 2 153 153 LYS CB C 13 30.14 0.4 . . . . . . 201 LYS CB . 6700 1 1299 . 2 2 153 153 LYS N N 15 120.03 0.3 . . . . . . 201 LYS N . 6700 1 1300 . 2 2 154 154 ILE H H 1 7.56 0.05 . . . . . . 202 ILE H . 6700 1 1301 . 2 2 154 154 ILE CA C 13 56.51 0.4 . . . . . . 202 ILE CA . 6700 1 1302 . 2 2 154 154 ILE CB C 13 40.55 0.4 . . . . . . 202 ILE CB . 6700 1 1303 . 2 2 154 154 ILE N N 15 128.10 0.3 . . . . . . 202 ILE N . 6700 1 1304 . 2 2 155 155 VAL H H 1 8.58 0.05 . . . . . . 203 VAL H . 6700 1 1305 . 2 2 155 155 VAL CA C 13 60.90 0.4 . . . . . . 203 VAL CA . 6700 1 1306 . 2 2 155 155 VAL CB C 13 32.70 0.4 . . . . . . 203 VAL CB . 6700 1 1307 . 2 2 155 155 VAL N N 15 125.50 0.3 . . . . . . 203 VAL N . 6700 1 1308 . 2 2 156 156 LEU H H 1 9.81 0.05 . . . . . . 204 LEU H . 6700 1 1309 . 2 2 156 156 LEU CA C 13 53.72 0.4 . . . . . . 204 LEU CA . 6700 1 1310 . 2 2 156 156 LEU CB C 13 43.00 0.4 . . . . . . 204 LEU CB . 6700 1 1311 . 2 2 156 156 LEU N N 15 127.47 0.3 . . . . . . 204 LEU N . 6700 1 1312 . 2 2 157 157 LEU H H 1 9.55 0.05 . . . . . . 205 LEU H . 6700 1 1313 . 2 2 157 157 LEU CA C 13 56.70 0.4 . . . . . . 205 LEU CA . 6700 1 1314 . 2 2 157 157 LEU CB C 13 42.30 0.4 . . . . . . 205 LEU CB . 6700 1 1315 . 2 2 157 157 LEU N N 15 121.97 0.3 . . . . . . 205 LEU N . 6700 1 1316 . 2 2 158 158 ILE H H 1 9.19 0.05 . . . . . . 206 ILE H . 6700 1 1317 . 2 2 158 158 ILE CA C 13 60.68 0.4 . . . . . . 206 ILE CA . 6700 1 1318 . 2 2 158 158 ILE CB C 13 27.80 0.4 . . . . . . 206 ILE CB . 6700 1 1319 . 2 2 158 158 ILE N N 15 124.05 0.3 . . . . . . 206 ILE N . 6700 1 1320 . 2 2 159 159 PHE H H 1 8.73 0.05 . . . . . . 207 PHE H . 6700 1 1321 . 2 2 159 159 PHE CA C 13 56.69 0.4 . . . . . . 207 PHE CA . 6700 1 1322 . 2 2 159 159 PHE CB C 13 39.75 0.4 . . . . . . 207 PHE CB . 6700 1 1323 . 2 2 159 159 PHE N N 15 119.16 0.3 . . . . . . 207 PHE N . 6700 1 1324 . 2 2 160 160 VAL H H 1 9.55 0.05 . . . . . . 208 VAL H . 6700 1 1325 . 2 2 160 160 VAL CA C 13 64.22 0.4 . . . . . . 208 VAL CA . 6700 1 1326 . 2 2 160 160 VAL CB C 13 31.66 0.4 . . . . . . 208 VAL CB . 6700 1 1327 . 2 2 160 160 VAL N N 15 121.97 0.3 . . . . . . 208 VAL N . 6700 1 1328 . 2 2 161 161 SER H H 1 7.56 0.05 . . . . . . 209 SER H . 6700 1 1329 . 2 2 161 161 SER CA C 13 57.84 0.4 . . . . . . 209 SER CA . 6700 1 1330 . 2 2 161 161 SER CB C 13 64.23 0.4 . . . . . . 209 SER CB . 6700 1 1331 . 2 2 161 161 SER N N 15 109.54 0.3 . . . . . . 209 SER N . 6700 1 1332 . 2 2 162 162 GLY H H 1 8.18 0.05 . . . . . . 210 GLY H . 6700 1 1333 . 2 2 162 162 GLY CA C 13 44.81 0.4 . . . . . . 210 GLY CA . 6700 1 1334 . 2 2 162 162 GLY N N 15 111.06 0.3 . . . . . . 210 GLY N . 6700 1 1335 . 2 2 163 163 LYS H H 1 7.28 0.05 . . . . . . 211 LYS H . 6700 1 1336 . 2 2 163 163 LYS CA C 13 56.05 0.4 . . . . . . 211 LYS CA . 6700 1 1337 . 2 2 163 163 LYS CB C 13 32.06 0.4 . . . . . . 211 LYS CB . 6700 1 1338 . 2 2 163 163 LYS N N 15 119.80 0.3 . . . . . . 211 LYS N . 6700 1 1339 . 2 2 164 164 ILE H H 1 8.86 0.05 . . . . . . 212 ILE H . 6700 1 1340 . 2 2 164 164 ILE CA C 13 58.02 0.4 . . . . . . 212 ILE CA . 6700 1 1341 . 2 2 164 164 ILE CB C 13 39.99 0.4 . . . . . . 212 ILE CB . 6700 1 1342 . 2 2 164 164 ILE N N 15 120.06 0.3 . . . . . . 212 ILE N . 6700 1 1343 . 2 2 165 165 VAL H H 1 9.49 0.05 . . . . . . 213 VAL H . 6700 1 1344 . 2 2 165 165 VAL CA C 13 60.49 0.4 . . . . . . 213 VAL CA . 6700 1 1345 . 2 2 165 165 VAL CB C 13 34.33 0.4 . . . . . . 213 VAL CB . 6700 1 1346 . 2 2 165 165 VAL N N 15 126.32 0.3 . . . . . . 213 VAL N . 6700 1 1347 . 2 2 166 166 LEU H H 1 9.33 0.05 . . . . . . 214 LEU H . 6700 1 1348 . 2 2 166 166 LEU CA C 13 55.18 0.4 . . . . . . 214 LEU CA . 6700 1 1349 . 2 2 166 166 LEU CB C 13 43.59 0.4 . . . . . . 214 LEU CB . 6700 1 1350 . 2 2 166 166 LEU N N 15 126.28 0.3 . . . . . . 214 LEU N . 6700 1 1351 . 2 2 167 167 THR H H 1 9.28 0.05 . . . . . . 215 THR H . 6700 1 1352 . 2 2 167 167 THR CA C 13 59.50 0.4 . . . . . . 215 THR CA . 6700 1 1353 . 2 2 167 167 THR CB C 13 71.04 0.4 . . . . . . 215 THR CB . 6700 1 1354 . 2 2 167 167 THR N N 15 115.82 0.3 . . . . . . 215 THR N . 6700 1 1355 . 2 2 168 168 GLY H H 1 8.58 0.05 . . . . . . 216 GLY H . 6700 1 1356 . 2 2 168 168 GLY CA C 13 44.03 0.4 . . . . . . 216 GLY CA . 6700 1 1357 . 2 2 168 168 GLY N N 15 112.99 0.3 . . . . . . 216 GLY N . 6700 1 1358 . 2 2 169 169 ALA H H 1 7.02 0.05 . . . . . . 217 ALA H . 6700 1 1359 . 2 2 169 169 ALA CA C 13 51.31 0.4 . . . . . . 217 ALA CA . 6700 1 1360 . 2 2 169 169 ALA CB C 13 21.14 0.4 . . . . . . 217 ALA CB . 6700 1 1361 . 2 2 169 169 ALA N N 15 121.03 0.3 . . . . . . 217 ALA N . 6700 1 1362 . 2 2 170 170 LYS H H 1 8.99 0.05 . . . . . . 218 LYS H . 6700 1 1363 . 2 2 170 170 LYS CA C 13 54.57 0.4 . . . . . . 218 LYS CA . 6700 1 1364 . 2 2 170 170 LYS CB C 13 32.87 0.4 . . . . . . 218 LYS CB . 6700 1 1365 . 2 2 170 170 LYS N N 15 116.01 0.3 . . . . . . 218 LYS N . 6700 1 1366 . 2 2 171 171 GLN H H 1 7.48 0.05 . . . . . . 219 GLN H . 6700 1 1367 . 2 2 171 171 GLN CA C 13 53.40 0.4 . . . . . . 219 GLN CA . 6700 1 1368 . 2 2 171 171 GLN CB C 13 31.93 0.4 . . . . . . 219 GLN CB . 6700 1 1369 . 2 2 171 171 GLN N N 15 115.00 0.3 . . . . . . 219 GLN N . 6700 1 1370 . 2 2 172 172 ARG H H 1 9.71 0.05 . . . . . . 220 ARG H . 6700 1 1371 . 2 2 172 172 ARG CA C 13 59.63 0.4 . . . . . . 220 ARG CA . 6700 1 1372 . 2 2 172 172 ARG CB C 13 29.94 0.4 . . . . . . 220 ARG CB . 6700 1 1373 . 2 2 172 172 ARG N N 15 125.02 0.3 . . . . . . 220 ARG N . 6700 1 1374 . 2 2 173 173 GLU H H 1 9.43 0.05 . . . . . . 221 GLU H . 6700 1 1375 . 2 2 173 173 GLU CA C 13 59.50 0.4 . . . . . . 221 GLU CA . 6700 1 1376 . 2 2 173 173 GLU CB C 13 28.31 0.4 . . . . . . 221 GLU CB . 6700 1 1377 . 2 2 173 173 GLU N N 15 118.54 0.3 . . . . . . 221 GLU N . 6700 1 1378 . 2 2 174 174 GLU H H 1 7.51 0.05 . . . . . . 222 GLU H . 6700 1 1379 . 2 2 174 174 GLU CA C 13 58.26 0.4 . . . . . . 222 GLU CA . 6700 1 1380 . 2 2 174 174 GLU CB C 13 30.14 0.4 . . . . . . 222 GLU CB . 6700 1 1381 . 2 2 174 174 GLU N N 15 116.04 0.3 . . . . . . 222 GLU N . 6700 1 1382 . 2 2 175 175 ILE H H 1 7.08 0.05 . . . . . . 223 ILE H . 6700 1 1383 . 2 2 175 175 ILE CA C 13 61.72 0.4 . . . . . . 223 ILE CA . 6700 1 1384 . 2 2 175 175 ILE CB C 13 34.94 0.4 . . . . . . 223 ILE CB . 6700 1 1385 . 2 2 175 175 ILE N N 15 116.79 0.3 . . . . . . 223 ILE N . 6700 1 1386 . 2 2 176 176 TYR H H 1 6.80 0.05 . . . . . . 224 TYR H . 6700 1 1387 . 2 2 176 176 TYR CA C 13 58.78 0.4 . . . . . . 224 TYR CA . 6700 1 1388 . 2 2 176 176 TYR CB C 13 35.93 0.4 . . . . . . 224 TYR CB . 6700 1 1389 . 2 2 176 176 TYR N N 15 118.60 0.3 . . . . . . 224 TYR N . 6700 1 1390 . 2 2 177 177 GLN H H 1 8.55 0.05 . . . . . . 225 GLN H . 6700 1 1391 . 2 2 177 177 GLN CA C 13 57.87 0.4 . . . . . . 225 GLN CA . 6700 1 1392 . 2 2 177 177 GLN CB C 13 28.18 0.4 . . . . . . 225 GLN CB . 6700 1 1393 . 2 2 177 177 GLN N N 15 118.74 0.3 . . . . . . 225 GLN N . 6700 1 1394 . 2 2 178 178 ALA H H 1 8.17 0.05 . . . . . . 226 ALA H . 6700 1 1395 . 2 2 178 178 ALA CA C 13 54.17 0.4 . . . . . . 226 ALA CA . 6700 1 1396 . 2 2 178 178 ALA CB C 13 19.87 0.4 . . . . . . 226 ALA CB . 6700 1 1397 . 2 2 178 178 ALA N N 15 121.86 0.3 . . . . . . 226 ALA N . 6700 1 1398 . 2 2 179 179 PHE H H 1 8.03 0.05 . . . . . . 227 PHE H . 6700 1 1399 . 2 2 179 179 PHE CA C 13 60.49 0.4 . . . . . . 227 PHE CA . 6700 1 1400 . 2 2 179 179 PHE CB C 13 38.56 0.4 . . . . . . 227 PHE CB . 6700 1 1401 . 2 2 179 179 PHE N N 15 116.64 0.3 . . . . . . 227 PHE N . 6700 1 1402 . 2 2 180 180 GLU H H 1 8.16 0.05 . . . . . . 228 GLU H . 6700 1 1403 . 2 2 180 180 GLU CA C 13 58.41 0.4 . . . . . . 228 GLU CA . 6700 1 1404 . 2 2 180 180 GLU CB C 13 28.88 0.4 . . . . . . 228 GLU CB . 6700 1 1405 . 2 2 180 180 GLU N N 15 117.44 0.3 . . . . . . 228 GLU N . 6700 1 1406 . 2 2 181 181 ALA H H 1 7.57 0.05 . . . . . . 229 ALA H . 6700 1 1407 . 2 2 181 181 ALA CA C 13 53.42 0.4 . . . . . . 229 ALA CA . 6700 1 1408 . 2 2 181 181 ALA CB C 13 18.21 0.4 . . . . . . 229 ALA CB . 6700 1 1409 . 2 2 181 181 ALA N N 15 118.10 0.3 . . . . . . 229 ALA N . 6700 1 1410 . 2 2 182 182 ILE H H 1 7.86 0.05 . . . . . . 230 ILE H . 6700 1 1411 . 2 2 182 182 ILE CA C 13 57.05 0.4 . . . . . . 230 ILE CA . 6700 1 1412 . 2 2 182 182 ILE CB C 13 39.11 0.4 . . . . . . 230 ILE CB . 6700 1 1413 . 2 2 182 182 ILE N N 15 116.57 0.3 . . . . . . 230 ILE N . 6700 1 1414 . 2 2 183 183 TYR H H 1 8.05 0.05 . . . . . . 231 TYR H . 6700 1 1415 . 2 2 183 183 TYR CA C 13 63.53 0.4 . . . . . . 231 TYR CA . 6700 1 1416 . 2 2 183 183 TYR CB C 13 34.76 0.4 . . . . . . 231 TYR CB . 6700 1 1417 . 2 2 183 183 TYR N N 15 125.97 0.3 . . . . . . 231 TYR N . 6700 1 1418 . 2 2 184 184 PRO CA C 13 64.55 0.4 . . . . . . 232 PRO CA . 6700 1 1419 . 2 2 184 184 PRO CB C 13 30.98 0.4 . . . . . . 232 PRO CB . 6700 1 1420 . 2 2 185 185 VAL H H 1 6.97 0.05 . . . . . . 233 VAL H . 6700 1 1421 . 2 2 185 185 VAL CA C 13 64.55 0.4 . . . . . . 233 VAL CA . 6700 1 1422 . 2 2 185 185 VAL CB C 13 30.98 0.4 . . . . . . 233 VAL CB . 6700 1 1423 . 2 2 185 185 VAL N N 15 118.75 0.3 . . . . . . 233 VAL N . 6700 1 1424 . 2 2 186 186 LEU H H 1 7.85 0.05 . . . . . . 234 LEU H . 6700 1 1425 . 2 2 186 186 LEU CA C 13 57.40 0.4 . . . . . . 234 LEU CA . 6700 1 1426 . 2 2 186 186 LEU CB C 13 39.11 0.4 . . . . . . 234 LEU CB . 6700 1 1427 . 2 2 186 186 LEU N N 15 116.72 0.3 . . . . . . 234 LEU N . 6700 1 1428 . 2 2 187 187 SER H H 1 7.81 0.05 . . . . . . 235 SER H . 6700 1 1429 . 2 2 187 187 SER CA C 13 60.54 0.4 . . . . . . 235 SER CA . 6700 1 1430 . 2 2 187 187 SER CB C 13 62.61 0.4 . . . . . . 235 SER CB . 6700 1 1431 . 2 2 187 187 SER N N 15 108.65 0.3 . . . . . . 235 SER N . 6700 1 1432 . 2 2 188 188 GLU H H 1 7.47 0.05 . . . . . . 236 GLU H . 6700 1 1433 . 2 2 188 188 GLU CA C 13 57.65 0.4 . . . . . . 236 GLU CA . 6700 1 1434 . 2 2 188 188 GLU CB C 13 28.47 0.4 . . . . . . 236 GLU CB . 6700 1 1435 . 2 2 188 188 GLU N N 15 121.97 0.3 . . . . . . 236 GLU N . 6700 1 1436 . 2 2 189 189 PHE H H 1 7.41 0.05 . . . . . . 237 PHE H . 6700 1 1437 . 2 2 189 189 PHE CA C 13 57.65 0.4 . . . . . . 237 PHE CA . 6700 1 1438 . 2 2 189 189 PHE CB C 13 37.81 0.4 . . . . . . 237 PHE CB . 6700 1 1439 . 2 2 189 189 PHE N N 15 115.92 0.3 . . . . . . 237 PHE N . 6700 1 1440 . 2 2 190 190 ARG H H 1 6.91 0.05 . . . . . . 238 ARG H . 6700 1 1441 . 2 2 190 190 ARG CA C 13 55.77 0.4 . . . . . . 238 ARG CA . 6700 1 1442 . 2 2 190 190 ARG CB C 13 30.64 0.4 . . . . . . 238 ARG CB . 6700 1 1443 . 2 2 190 190 ARG N N 15 120.96 0.3 . . . . . . 238 ARG N . 6700 1 1444 . 2 2 191 191 LYS H H 1 8.63 0.05 . . . . . . 239 LYS H . 6700 1 1445 . 2 2 191 191 LYS CA C 13 55.89 0.4 . . . . . . 239 LYS CA . 6700 1 1446 . 2 2 191 191 LYS CB C 13 32.60 0.4 . . . . . . 239 LYS CB . 6700 1 1447 . 2 2 191 191 LYS N N 15 128.45 0.3 . . . . . . 239 LYS N . 6700 1 1448 . 2 2 192 192 MET H H 1 8.11 0.05 . . . . . . 240 MET H . 6700 1 1449 . 2 2 192 192 MET CA C 13 56.00 0.4 . . . . . . 240 MET CA . 6700 1 1450 . 2 2 192 192 MET CB C 13 32.97 0.4 . . . . . . 240 MET CB . 6700 1 1451 . 2 2 192 192 MET N N 15 130.99 0.3 . . . . . . 240 MET N . 6700 1 stop_ save_