data_5010 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5010 _Entry.Title ; 1H, 15N, and 13C chemical shift assignments for DNA polymerase X ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2001-05-11 _Entry.Accession_date 2001-05-11 _Entry.Last_release_date 2002-04-05 _Entry.Original_release_date 2002-04-05 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Mark Maciejewski . W. . 5010 2 Borlan Pan . . . 5010 3 Ronald Shin . . . 5010 4 Adam Denninger . . . 5010 5 Gregory Mullen . P. . 5010 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 5010 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 1213 5010 '13C chemical shifts' 725 5010 '15N chemical shifts' 178 5010 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 . . 2002-04-05 2001-05-10 original author . 5010 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5010 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 21584503 _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Letter to the Editor: 1H, 15N, and 13C Resonance Assignments for a 20 kDa DNA Polymerase from African Swine Fever Virus ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full 'Journal of Biomolecular NMR' _Citation.Journal_volume 21 _Citation.Journal_issue 2 _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 177 _Citation.Page_last 178 _Citation.Year 2001 _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 Mark Maciejewski . W. . 5010 1 2 Borlan Pan . . . 5010 1 3 Ronald Shin . . . 5010 1 4 Adam Denninger . . . 5010 1 5 Gregory Mullen . P. . 5010 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'DNA repair' 5010 1 'African swine fever virus' 5010 1 polymerase 5010 1 stop_ save_ save_ref_NMRPipe _Citation.Sf_category citations _Citation.Sf_framecode ref_NMRPipe _Citation.Entry_ID 5010 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 96088118 _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'NMRPipe: a multidimensional spectral processing system based on UNIX pipes' _Citation.Status . _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 6 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 277 _Citation.Page_last 293 _Citation.Year 1995 _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 F. Delaglio . . . 5010 2 2 S. Grzesiek . . . 5010 2 3 G. Vuister . W. . 5010 2 4 G. Zhu . . . 5010 2 5 J. Pfeifer . . . 5010 2 6 A. Bax . . . 5010 2 stop_ save_ save_ref_XEASY _Citation.Sf_category citations _Citation.Sf_framecode ref_XEASY _Citation.Entry_ID 5010 _Citation.ID 3 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; The program XEASY for computer-supported NMR spectral analysis of biological macromolecules. ; _Citation.Status . _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 6 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1 _Citation.Page_last 10 _Citation.Year 1995 _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 C. Bartels . . . 5010 3 2 T.-H. Xia . . . 5010 3 3 Martin Billeter . . . 5010 3 4 Peter Guntert . . . 5010 3 5 Kurt Wuthrich . . . 5010 3 stop_ save_ save_Reference_3 _Citation.Sf_category citations _Citation.Sf_framecode Reference_3 _Citation.Entry_ID 5010 _Citation.ID 4 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 11831707 _Citation.Full_citation 'Yanez, R.J., Rodriguez, J.M., Nogal, M.L., Yuste, L., Enriquez, C., Rodriguez, J.F., and Vinuela, E. (1995) Virology 208, 249-278' _Citation.Title 'Analysis of the complete nucleotide sequence of African swine fever virus.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Virology _Citation.Journal_name_full Virology _Citation.Journal_volume 208 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0042-6822 _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 249 _Citation.Page_last 278 _Citation.Year 1995 _Citation.Details ; We present an analysis of the complete genome of African swine fever virus (ASFV) strain BA71V, including 80 kbp of novel sequence and 90 kbp previously reported by several authors. The viral DNA is 170,101 nucleotides long and contains 151 open reading frames. Structural and/or functional information is available on 113 viral proteins. ASFV encodes five multigene families, putative membrane and secreted proteins, and enzymes involved in nucleotide and nucleic acid metabolism (including DNA repair) and protein modification. Database comparisons have provided clues about genes that may modulate the virus-host interaction, thus, possibly controlling ASFV virulence and persistence. The virus possesses genes similar to CD2, IkappaB, C-type lectins, MyD116/gadd34/gamma, 34.5, bcl-2/bax, iap, NifS, and ERV1, which may allow a viral regulation of cell adhesion, apoptosis, and redox metabolism, as well as of the host immune response against ASFV infection. The proteins encoded by different ASFV isolates are highly similar, the most variable ones being those belonging to multigene families, some membrane proteins, and those containing tandem repeats. DNA sequence data confirm the intermediate characteristics of ASFV between poxviruses and iridoviruses, supporting the notion that ASFV belongs to an independent virus family. ; 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 'R. J.' Yanez R. J. . 5010 4 2 'J. M.' Rodriguez J. M. . 5010 4 3 'M. L.' Nogal M. L. . 5010 4 4 L. Yuste L. . . 5010 4 5 C. Enriquez C. . . 5010 4 6 'J. F.' Rodriguez J. F. . 5010 4 7 E. Vinuela E. . . 5010 4 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_Pol_X _Assembly.Sf_category assembly _Assembly.Sf_framecode system_Pol_X _Assembly.Entry_ID 5010 _Assembly.ID 1 _Assembly.Name 'DNA Polymerase X' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all reduced' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 5010 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 'Pol X' 1 $Pol_X . . . native . . . . . 5010 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 1JAJ . . . . . . 5010 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'DNA Polymerase X' system 5010 1 'Pol X' abbreviation 5010 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'Template-directed nucleotidyl transferase' 5010 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Pol_X _Entity.Sf_category entity _Entity.Sf_framecode Pol_X _Entity.Entry_ID 5010 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'DNA Polymerase X' _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 ; MLTLIQGKKIVNHLRSRLAF EYNGQLIKILSKNIVAVGSL RREEKMLNDVDLLIIVPEKK LLKHVLPNIRIKGLSFSVKV CGERKCVLFIEWEKKTYQLD LFTALAEEKPYAIFHFTGPV SYLIRIRAALKKKNYKLNQY GLFKNQTLVPLKITTEKELI KELGFTYRIPKKRL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 174 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'all reduced' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 20314 _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 18933 . entity . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 2 no BMRB 18934 . entity_1 . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 3 no BMRB 18935 . entity . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 4 no PDB 1JAJ . "Solution Structure Of Dna Polymerase X From The African Swine Fever Virus" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 5 no PDB 1JQR . "Nmr Structure Of The African Swine Fever Virus Dna Polymerase X" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 6 no PDB 2M2T . "Asfv Pol X Structure" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 7 no PDB 2M2U . "Binary Complex Of African Swine Fever Virus Pol X With Mgdgtp" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 8 no PDB 2M2V . "African Swine Fever Virus Pol X In The Ternary Complex With Mgdgtp And Dna" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 9 no PDB 2M2W . "Ternary Complex Of Asfv Pol X With Dna And Mgdgtp" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 10 no EMBL CAN10196 . "DNA polymerase beta-like protein [African swine fever virus Benin 97/1]" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 11 no EMBL CAN10446 . "DNA polymerase beta-like protein [African swine fever virus OURT 88/3]" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 12 no EMBL CBH29197 . "BA71V-O174L [African swine fever virus E75]" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 13 no GB AAA65326 . "DNA polymerase beta-like protein [African swine fever virus]" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 14 no GB AIY22288 . "DNA polymerase beta-like protein [African swine fever virus]" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 15 no GB AIY22446 . "DNA polymerase beta-like protein [African swine fever virus]" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 16 no PRF 2113434DC . "DNA polymerase beta-like protein" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 17 no REF NP_042790 . "DNA polymerase beta-like protein [African swine fever virus]" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 18 no SP P0C984 . "RecName: Full=Repair DNA polymerase X; Short=Pol X [African swine fever virus Malawi LIL 20/1]" . . . . . 100.00 174 98.85 99.43 8.52e-118 . . . . 5010 1 19 no SP P42494 . "RecName: Full=Repair DNA polymerase X; Short=Pol X [African swine fever virus BA71V]" . . . . . 100.00 174 100.00 100.00 1.35e-119 . . . . 5010 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'DNA Polymerase X' common 5010 1 'Pol X' abbreviation 5010 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 5010 1 2 . LEU . 5010 1 3 . THR . 5010 1 4 . LEU . 5010 1 5 . ILE . 5010 1 6 . GLN . 5010 1 7 . GLY . 5010 1 8 . LYS . 5010 1 9 . LYS . 5010 1 10 . ILE . 5010 1 11 . VAL . 5010 1 12 . ASN . 5010 1 13 . HIS . 5010 1 14 . LEU . 5010 1 15 . ARG . 5010 1 16 . SER . 5010 1 17 . ARG . 5010 1 18 . LEU . 5010 1 19 . ALA . 5010 1 20 . PHE . 5010 1 21 . GLU . 5010 1 22 . TYR . 5010 1 23 . ASN . 5010 1 24 . GLY . 5010 1 25 . GLN . 5010 1 26 . LEU . 5010 1 27 . ILE . 5010 1 28 . LYS . 5010 1 29 . ILE . 5010 1 30 . LEU . 5010 1 31 . SER . 5010 1 32 . LYS . 5010 1 33 . ASN . 5010 1 34 . ILE . 5010 1 35 . VAL . 5010 1 36 . ALA . 5010 1 37 . VAL . 5010 1 38 . GLY . 5010 1 39 . SER . 5010 1 40 . LEU . 5010 1 41 . ARG . 5010 1 42 . ARG . 5010 1 43 . GLU . 5010 1 44 . GLU . 5010 1 45 . LYS . 5010 1 46 . MET . 5010 1 47 . LEU . 5010 1 48 . ASN . 5010 1 49 . ASP . 5010 1 50 . VAL . 5010 1 51 . ASP . 5010 1 52 . LEU . 5010 1 53 . LEU . 5010 1 54 . ILE . 5010 1 55 . ILE . 5010 1 56 . VAL . 5010 1 57 . PRO . 5010 1 58 . GLU . 5010 1 59 . LYS . 5010 1 60 . LYS . 5010 1 61 . LEU . 5010 1 62 . LEU . 5010 1 63 . LYS . 5010 1 64 . HIS . 5010 1 65 . VAL . 5010 1 66 . LEU . 5010 1 67 . PRO . 5010 1 68 . ASN . 5010 1 69 . ILE . 5010 1 70 . ARG . 5010 1 71 . ILE . 5010 1 72 . LYS . 5010 1 73 . GLY . 5010 1 74 . LEU . 5010 1 75 . SER . 5010 1 76 . PHE . 5010 1 77 . SER . 5010 1 78 . VAL . 5010 1 79 . LYS . 5010 1 80 . VAL . 5010 1 81 . CYS . 5010 1 82 . GLY . 5010 1 83 . GLU . 5010 1 84 . ARG . 5010 1 85 . LYS . 5010 1 86 . CYS . 5010 1 87 . VAL . 5010 1 88 . LEU . 5010 1 89 . PHE . 5010 1 90 . ILE . 5010 1 91 . GLU . 5010 1 92 . TRP . 5010 1 93 . GLU . 5010 1 94 . LYS . 5010 1 95 . LYS . 5010 1 96 . THR . 5010 1 97 . TYR . 5010 1 98 . GLN . 5010 1 99 . LEU . 5010 1 100 . ASP . 5010 1 101 . LEU . 5010 1 102 . PHE . 5010 1 103 . THR . 5010 1 104 . ALA . 5010 1 105 . LEU . 5010 1 106 . ALA . 5010 1 107 . GLU . 5010 1 108 . GLU . 5010 1 109 . LYS . 5010 1 110 . PRO . 5010 1 111 . TYR . 5010 1 112 . ALA . 5010 1 113 . ILE . 5010 1 114 . PHE . 5010 1 115 . HIS . 5010 1 116 . PHE . 5010 1 117 . THR . 5010 1 118 . GLY . 5010 1 119 . PRO . 5010 1 120 . VAL . 5010 1 121 . SER . 5010 1 122 . TYR . 5010 1 123 . LEU . 5010 1 124 . ILE . 5010 1 125 . ARG . 5010 1 126 . ILE . 5010 1 127 . ARG . 5010 1 128 . ALA . 5010 1 129 . ALA . 5010 1 130 . LEU . 5010 1 131 . LYS . 5010 1 132 . LYS . 5010 1 133 . LYS . 5010 1 134 . ASN . 5010 1 135 . TYR . 5010 1 136 . LYS . 5010 1 137 . LEU . 5010 1 138 . ASN . 5010 1 139 . GLN . 5010 1 140 . TYR . 5010 1 141 . GLY . 5010 1 142 . LEU . 5010 1 143 . PHE . 5010 1 144 . LYS . 5010 1 145 . ASN . 5010 1 146 . GLN . 5010 1 147 . THR . 5010 1 148 . LEU . 5010 1 149 . VAL . 5010 1 150 . PRO . 5010 1 151 . LEU . 5010 1 152 . LYS . 5010 1 153 . ILE . 5010 1 154 . THR . 5010 1 155 . THR . 5010 1 156 . GLU . 5010 1 157 . LYS . 5010 1 158 . GLU . 5010 1 159 . LEU . 5010 1 160 . ILE . 5010 1 161 . LYS . 5010 1 162 . GLU . 5010 1 163 . LEU . 5010 1 164 . GLY . 5010 1 165 . PHE . 5010 1 166 . THR . 5010 1 167 . TYR . 5010 1 168 . ARG . 5010 1 169 . ILE . 5010 1 170 . PRO . 5010 1 171 . LYS . 5010 1 172 . LYS . 5010 1 173 . ARG . 5010 1 174 . LEU . 5010 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 5010 1 . LEU 2 2 5010 1 . THR 3 3 5010 1 . LEU 4 4 5010 1 . ILE 5 5 5010 1 . GLN 6 6 5010 1 . GLY 7 7 5010 1 . LYS 8 8 5010 1 . LYS 9 9 5010 1 . ILE 10 10 5010 1 . VAL 11 11 5010 1 . ASN 12 12 5010 1 . HIS 13 13 5010 1 . LEU 14 14 5010 1 . ARG 15 15 5010 1 . SER 16 16 5010 1 . ARG 17 17 5010 1 . LEU 18 18 5010 1 . ALA 19 19 5010 1 . PHE 20 20 5010 1 . GLU 21 21 5010 1 . TYR 22 22 5010 1 . ASN 23 23 5010 1 . GLY 24 24 5010 1 . GLN 25 25 5010 1 . LEU 26 26 5010 1 . ILE 27 27 5010 1 . LYS 28 28 5010 1 . ILE 29 29 5010 1 . LEU 30 30 5010 1 . SER 31 31 5010 1 . LYS 32 32 5010 1 . ASN 33 33 5010 1 . ILE 34 34 5010 1 . VAL 35 35 5010 1 . ALA 36 36 5010 1 . VAL 37 37 5010 1 . GLY 38 38 5010 1 . SER 39 39 5010 1 . LEU 40 40 5010 1 . ARG 41 41 5010 1 . ARG 42 42 5010 1 . GLU 43 43 5010 1 . GLU 44 44 5010 1 . LYS 45 45 5010 1 . MET 46 46 5010 1 . LEU 47 47 5010 1 . ASN 48 48 5010 1 . ASP 49 49 5010 1 . VAL 50 50 5010 1 . ASP 51 51 5010 1 . LEU 52 52 5010 1 . LEU 53 53 5010 1 . ILE 54 54 5010 1 . ILE 55 55 5010 1 . VAL 56 56 5010 1 . PRO 57 57 5010 1 . GLU 58 58 5010 1 . LYS 59 59 5010 1 . LYS 60 60 5010 1 . LEU 61 61 5010 1 . LEU 62 62 5010 1 . LYS 63 63 5010 1 . HIS 64 64 5010 1 . VAL 65 65 5010 1 . LEU 66 66 5010 1 . PRO 67 67 5010 1 . ASN 68 68 5010 1 . ILE 69 69 5010 1 . ARG 70 70 5010 1 . ILE 71 71 5010 1 . LYS 72 72 5010 1 . GLY 73 73 5010 1 . LEU 74 74 5010 1 . SER 75 75 5010 1 . PHE 76 76 5010 1 . SER 77 77 5010 1 . VAL 78 78 5010 1 . LYS 79 79 5010 1 . VAL 80 80 5010 1 . CYS 81 81 5010 1 . GLY 82 82 5010 1 . GLU 83 83 5010 1 . ARG 84 84 5010 1 . LYS 85 85 5010 1 . CYS 86 86 5010 1 . VAL 87 87 5010 1 . LEU 88 88 5010 1 . PHE 89 89 5010 1 . ILE 90 90 5010 1 . GLU 91 91 5010 1 . TRP 92 92 5010 1 . GLU 93 93 5010 1 . LYS 94 94 5010 1 . LYS 95 95 5010 1 . THR 96 96 5010 1 . TYR 97 97 5010 1 . GLN 98 98 5010 1 . LEU 99 99 5010 1 . ASP 100 100 5010 1 . LEU 101 101 5010 1 . PHE 102 102 5010 1 . THR 103 103 5010 1 . ALA 104 104 5010 1 . LEU 105 105 5010 1 . ALA 106 106 5010 1 . GLU 107 107 5010 1 . GLU 108 108 5010 1 . LYS 109 109 5010 1 . PRO 110 110 5010 1 . TYR 111 111 5010 1 . ALA 112 112 5010 1 . ILE 113 113 5010 1 . PHE 114 114 5010 1 . HIS 115 115 5010 1 . PHE 116 116 5010 1 . THR 117 117 5010 1 . GLY 118 118 5010 1 . PRO 119 119 5010 1 . VAL 120 120 5010 1 . SER 121 121 5010 1 . TYR 122 122 5010 1 . LEU 123 123 5010 1 . ILE 124 124 5010 1 . ARG 125 125 5010 1 . ILE 126 126 5010 1 . ARG 127 127 5010 1 . ALA 128 128 5010 1 . ALA 129 129 5010 1 . LEU 130 130 5010 1 . LYS 131 131 5010 1 . LYS 132 132 5010 1 . LYS 133 133 5010 1 . ASN 134 134 5010 1 . TYR 135 135 5010 1 . LYS 136 136 5010 1 . LEU 137 137 5010 1 . ASN 138 138 5010 1 . GLN 139 139 5010 1 . TYR 140 140 5010 1 . GLY 141 141 5010 1 . LEU 142 142 5010 1 . PHE 143 143 5010 1 . LYS 144 144 5010 1 . ASN 145 145 5010 1 . GLN 146 146 5010 1 . THR 147 147 5010 1 . LEU 148 148 5010 1 . VAL 149 149 5010 1 . PRO 150 150 5010 1 . LEU 151 151 5010 1 . LYS 152 152 5010 1 . ILE 153 153 5010 1 . THR 154 154 5010 1 . THR 155 155 5010 1 . GLU 156 156 5010 1 . LYS 157 157 5010 1 . GLU 158 158 5010 1 . LEU 159 159 5010 1 . ILE 160 160 5010 1 . LYS 161 161 5010 1 . GLU 162 162 5010 1 . LEU 163 163 5010 1 . GLY 164 164 5010 1 . PHE 165 165 5010 1 . THR 166 166 5010 1 . TYR 167 167 5010 1 . ARG 168 168 5010 1 . ILE 169 169 5010 1 . PRO 170 170 5010 1 . LYS 171 171 5010 1 . LYS 172 172 5010 1 . ARG 173 173 5010 1 . LEU 174 174 5010 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 5010 _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 $Pol_X . 10498 organism . 'African swine fever-like viruses African swine fever virus' 'African swine fever virus BA71V' . . . . 'African swine fever-like viruses' 'African swine fever virus' . . . . . . . . . . . . . . . . . . . . . 5010 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 5010 _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 $Pol_X . 'recombinant technology' 'Escherichia coli' E.coli . . Escherichia coli BL21(DE3) . . . . . . . . . . . . plasmid . . pET23a . . . . . . 5010 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Pol_X_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode Pol_X_sample_1 _Sample.Entry_ID 5010 _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 'DNA Polymerase X' '[U-13C; U-15N]' . . 1 $Pol_X . . . 0.6 1.0 mM . . . . 5010 1 2 PIPES . . . . . . . 20 . . mM . . . . 5010 1 3 NaCl . . . . . . . 500 . . mM . . . . 5010 1 4 DTT . . . . . . . 10 . . mM . . . . 5010 1 5 AEBSF . . . . . . . 0.5 . . mM . . . . 5010 1 6 'sodium azide' . . . . . . . 0.02 . . % . . . . 5010 1 stop_ save_ save_Pol_X_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode Pol_X_sample_2 _Sample.Entry_ID 5010 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'DNA Polymerase X' [U-15N] . . 1 $Pol_X . . . 0.6 1.0 mM . . . . 5010 2 2 PIPES . . . . . . . 20 . . mM . . . . 5010 2 3 NaCl . . . . . . . 500 . . mM . . . . 5010 2 4 DTT . . . . . . . 10 . . mM . . . . 5010 2 5 AEBSF . . . . . . . 0.5 . . mM . . . . 5010 2 6 'sodium azide' . . . . . . . 0.02 . . % . . . . 5010 2 stop_ save_ save_Pol_X_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode Pol_X_sample_3 _Sample.Entry_ID 5010 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'DNA Polymerase X' . . . 1 $Pol_X . . . 0.6 1.0 mM . . . . 5010 3 2 PIPES . . . . . . . 20 . . mM . . . . 5010 3 3 NaCl . . . . . . . 500 . . mM . . . . 5010 3 4 DTT . . . . . . . 10 . . mM . . . . 5010 3 5 AEBSF . . . . . . . 0.5 . . mM . . . . 5010 3 6 'sodium azide' . . . . . . . 0.02 . . % . . . . 5010 3 stop_ save_ ####################### # Sample conditions # ####################### save_Pol_X_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Pol_X_conditions_1 _Sample_condition_list.Entry_ID 5010 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.5 0.25 n/a 5010 1 temperature 298 0.2 K 5010 1 'ionic strength' 500 . mM 5010 1 stop_ save_ ############################ # Computer software used # ############################ save_nmrPipe _Software.Sf_category software _Software.Sf_framecode nmrPipe _Software.Entry_ID 5010 _Software.ID 1 _Software.Name nmrPipe _Software.Version . _Software.Details ; Used an in-house developed web site to generate the nmrPipe scripts used for processing. ; loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'NMR data procesing' 5010 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 2 $ref_NMRPipe 5010 1 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 5010 _Software.ID 2 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'NMR data analysis' 5010 2 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 3 $ref_XEASY 5010 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer1 _NMR_spectrometer.Entry_ID 5010 _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_NMR_spectrometer2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer2 _NMR_spectrometer.Entry_ID 5010 _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_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5010 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer1 Varian INOVA . 500 . . . 5010 1 2 NMR_spectrometer2 Varian INOVA . 600 . . . 5010 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 5010 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '1H-15N HSQC' . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 2 '15N-edited NOESY-HSQC' . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 3 HNCA . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 4 HN(CO)CA . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 5 HNCACB . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 6 CBCA(CO)NH . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 7 HNCO . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 8 HNHA . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 9 HNHB . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 10 HCC(CO)NH-TOCSY . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 11 CC(CO)NH-TOCSY . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 12 HCCH-TOCSY . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 13 '1H-13C HSQC' . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 14 '13C-edited NOESY-HSQC' . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 15 '13C-edited HSQC-NOESY' . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 16 '2D TOCSY' . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 17 '2D NOESY' . . . . . . . . . . . . . . . . 1 $Pol_X_conditions_1 . . . . . . . . . . . . . . . . . . . . . 5010 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '1H-15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '15N-edited NOESY-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HNCA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HN(CO)CA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name HNCACB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name CBCA(CO)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name HNCO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name HNHA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_9 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name HNHB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_10 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name HCC(CO)NH-TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_11 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_11 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name CC(CO)NH-TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_12 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_12 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name HCCH-TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_13 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_13 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 13 _NMR_spec_expt.Name '1H-13C HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_14 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_14 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 14 _NMR_spec_expt.Name '13C-edited NOESY-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_15 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_15 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 15 _NMR_spec_expt.Name '13C-edited HSQC-NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_16 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_16 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 16 _NMR_spec_expt.Name '2D TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_17 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_17 _NMR_spec_expt.Entry_ID 5010 _NMR_spec_expt.ID 17 _NMR_spec_expt.Name '2D NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 5010 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 5010 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 5010 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 5010 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_Pol_X_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode Pol_X_shift_set_1 _Assigned_chem_shift_list.Entry_ID 5010 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Pol_X_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $Pol_X_sample_1 . 5010 1 . . 2 $Pol_X_sample_2 . 5010 1 . . 3 $Pol_X_sample_3 . 5010 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET C C 13 172.1 0.3 . 1 . . . . . . . . 5010 1 2 . 1 1 2 2 LEU N N 15 121.7 0.25 . 1 . . . . . . . . 5010 1 3 . 1 1 2 2 LEU H H 1 8.99 0.02 . 1 . . . . . . . . 5010 1 4 . 1 1 2 2 LEU CA C 13 54.5 0.3 . 1 . . . . . . . . 5010 1 5 . 1 1 2 2 LEU HA H 1 4.96 0.02 . 1 . . . . . . . . 5010 1 6 . 1 1 2 2 LEU CB C 13 43.8 0.3 . 1 . . . . . . . . 5010 1 7 . 1 1 2 2 LEU HB2 H 1 1.73 0.02 . 2 . . . . . . . . 5010 1 8 . 1 1 2 2 LEU HB3 H 1 1.65 0.02 . 2 . . . . . . . . 5010 1 9 . 1 1 2 2 LEU CG C 13 26.4 0.3 . 1 . . . . . . . . 5010 1 10 . 1 1 2 2 LEU HG H 1 1.53 0.02 . 1 . . . . . . . . 5010 1 11 . 1 1 2 2 LEU HD11 H 1 0.53 0.02 . 2 . . . . . . . . 5010 1 12 . 1 1 2 2 LEU HD12 H 1 0.53 0.02 . 2 . . . . . . . . 5010 1 13 . 1 1 2 2 LEU HD13 H 1 0.53 0.02 . 2 . . . . . . . . 5010 1 14 . 1 1 2 2 LEU HD21 H 1 0.42 0.02 . 2 . . . . . . . . 5010 1 15 . 1 1 2 2 LEU HD22 H 1 0.42 0.02 . 2 . . . . . . . . 5010 1 16 . 1 1 2 2 LEU HD23 H 1 0.42 0.02 . 2 . . . . . . . . 5010 1 17 . 1 1 2 2 LEU CD1 C 13 25.1 0.3 . 1 . . . . . . . . 5010 1 18 . 1 1 2 2 LEU CD2 C 13 26.1 0.3 . 1 . . . . . . . . 5010 1 19 . 1 1 2 2 LEU C C 13 175.6 0.3 . 1 . . . . . . . . 5010 1 20 . 1 1 3 3 THR N N 15 112.6 0.25 . 1 . . . . . . . . 5010 1 21 . 1 1 3 3 THR H H 1 8.61 0.02 . 1 . . . . . . . . 5010 1 22 . 1 1 3 3 THR CA C 13 60.7 0.3 . 1 . . . . . . . . 5010 1 23 . 1 1 3 3 THR HA H 1 5.06 0.02 . 1 . . . . . . . . 5010 1 24 . 1 1 3 3 THR CB C 13 71.2 0.3 . 1 . . . . . . . . 5010 1 25 . 1 1 3 3 THR HB H 1 4.88 0.02 . 1 . . . . . . . . 5010 1 26 . 1 1 3 3 THR HG21 H 1 1.47 0.02 . 1 . . . . . . . . 5010 1 27 . 1 1 3 3 THR HG22 H 1 1.47 0.02 . 1 . . . . . . . . 5010 1 28 . 1 1 3 3 THR HG23 H 1 1.47 0.02 . 1 . . . . . . . . 5010 1 29 . 1 1 3 3 THR CG2 C 13 22.1 0.3 . 1 . . . . . . . . 5010 1 30 . 1 1 3 3 THR C C 13 175.9 0.3 . 1 . . . . . . . . 5010 1 31 . 1 1 4 4 LEU N N 15 122.2 0.25 . 1 . . . . . . . . 5010 1 32 . 1 1 4 4 LEU H H 1 7.83 0.02 . 1 . . . . . . . . 5010 1 33 . 1 1 4 4 LEU CA C 13 58.5 0.3 . 1 . . . . . . . . 5010 1 34 . 1 1 4 4 LEU HA H 1 4.05 0.02 . 1 . . . . . . . . 5010 1 35 . 1 1 4 4 LEU CB C 13 40.7 0.3 . 1 . . . . . . . . 5010 1 36 . 1 1 4 4 LEU HB2 H 1 2.51 0.02 . 2 . . . . . . . . 5010 1 37 . 1 1 4 4 LEU HB3 H 1 1.78 0.02 . 2 . . . . . . . . 5010 1 38 . 1 1 4 4 LEU CG C 13 27.2 0.3 . 1 . . . . . . . . 5010 1 39 . 1 1 4 4 LEU HG H 1 1.49 0.02 . 1 . . . . . . . . 5010 1 40 . 1 1 4 4 LEU HD11 H 1 0.86 0.02 . 2 . . . . . . . . 5010 1 41 . 1 1 4 4 LEU HD12 H 1 0.86 0.02 . 2 . . . . . . . . 5010 1 42 . 1 1 4 4 LEU HD13 H 1 0.86 0.02 . 2 . . . . . . . . 5010 1 43 . 1 1 4 4 LEU HD21 H 1 1.20 0.02 . 2 . . . . . . . . 5010 1 44 . 1 1 4 4 LEU HD22 H 1 1.20 0.02 . 2 . . . . . . . . 5010 1 45 . 1 1 4 4 LEU HD23 H 1 1.20 0.02 . 2 . . . . . . . . 5010 1 46 . 1 1 4 4 LEU CD1 C 13 25.9 0.3 . 1 . . . . . . . . 5010 1 47 . 1 1 4 4 LEU CD2 C 13 23.4 0.3 . 1 . . . . . . . . 5010 1 48 . 1 1 4 4 LEU C C 13 178.4 0.3 . 1 . . . . . . . . 5010 1 49 . 1 1 5 5 ILE N N 15 115.4 0.25 . 1 . . . . . . . . 5010 1 50 . 1 1 5 5 ILE H H 1 7.78 0.02 . 1 . . . . . . . . 5010 1 51 . 1 1 5 5 ILE CA C 13 64.3 0.3 . 1 . . . . . . . . 5010 1 52 . 1 1 5 5 ILE HA H 1 3.80 0.02 . 1 . . . . . . . . 5010 1 53 . 1 1 5 5 ILE CB C 13 37.9 0.3 . 1 . . . . . . . . 5010 1 54 . 1 1 5 5 ILE HB H 1 1.91 0.02 . 1 . . . . . . . . 5010 1 55 . 1 1 5 5 ILE HG21 H 1 1.03 0.02 . 1 . . . . . . . . 5010 1 56 . 1 1 5 5 ILE HG22 H 1 1.03 0.02 . 1 . . . . . . . . 5010 1 57 . 1 1 5 5 ILE HG23 H 1 1.03 0.02 . 1 . . . . . . . . 5010 1 58 . 1 1 5 5 ILE CG2 C 13 17.7 0.3 . 1 . . . . . . . . 5010 1 59 . 1 1 5 5 ILE CG1 C 13 29.3 0.3 . 1 . . . . . . . . 5010 1 60 . 1 1 5 5 ILE HG12 H 1 1.68 0.02 . 2 . . . . . . . . 5010 1 61 . 1 1 5 5 ILE HG13 H 1 1.39 0.02 . 2 . . . . . . . . 5010 1 62 . 1 1 5 5 ILE HD11 H 1 1.01 0.02 . 1 . . . . . . . . 5010 1 63 . 1 1 5 5 ILE HD12 H 1 1.01 0.02 . 1 . . . . . . . . 5010 1 64 . 1 1 5 5 ILE HD13 H 1 1.01 0.02 . 1 . . . . . . . . 5010 1 65 . 1 1 5 5 ILE CD1 C 13 13.0 0.3 . 1 . . . . . . . . 5010 1 66 . 1 1 5 5 ILE C C 13 178.6 0.3 . 1 . . . . . . . . 5010 1 67 . 1 1 6 6 GLN N N 15 121.4 0.25 . 1 . . . . . . . . 5010 1 68 . 1 1 6 6 GLN H H 1 7.82 0.02 . 1 . . . . . . . . 5010 1 69 . 1 1 6 6 GLN CA C 13 58.7 0.3 . 1 . . . . . . . . 5010 1 70 . 1 1 6 6 GLN HA H 1 4.14 0.02 . 1 . . . . . . . . 5010 1 71 . 1 1 6 6 GLN CB C 13 29.1 0.3 . 1 . . . . . . . . 5010 1 72 . 1 1 6 6 GLN HB2 H 1 2.40 0.02 . 2 . . . . . . . . 5010 1 73 . 1 1 6 6 GLN HB3 H 1 2.00 0.02 . 2 . . . . . . . . 5010 1 74 . 1 1 6 6 GLN CG C 13 34.3 0.3 . 1 . . . . . . . . 5010 1 75 . 1 1 6 6 GLN HG2 H 1 2.54 0.02 . 2 . . . . . . . . 5010 1 76 . 1 1 6 6 GLN HG3 H 1 2.44 0.02 . 2 . . . . . . . . 5010 1 77 . 1 1 6 6 GLN NE2 N 15 111.0 0.25 . 1 . . . . . . . . 5010 1 78 . 1 1 6 6 GLN HE21 H 1 7.02 0.02 . 2 . . . . . . . . 5010 1 79 . 1 1 6 6 GLN HE22 H 1 7.30 0.02 . 2 . . . . . . . . 5010 1 80 . 1 1 6 6 GLN C C 13 179.0 0.3 . 1 . . . . . . . . 5010 1 81 . 1 1 7 7 GLY N N 15 107.5 0.25 . 1 . . . . . . . . 5010 1 82 . 1 1 7 7 GLY H H 1 8.80 0.02 . 1 . . . . . . . . 5010 1 83 . 1 1 7 7 GLY CA C 13 47.3 0.3 . 1 . . . . . . . . 5010 1 84 . 1 1 7 7 GLY HA2 H 1 3.42 0.02 . 2 . . . . . . . . 5010 1 85 . 1 1 7 7 GLY C C 13 174.7 0.3 . 1 . . . . . . . . 5010 1 86 . 1 1 8 8 LYS N N 15 120.7 0.25 . 1 . . . . . . . . 5010 1 87 . 1 1 8 8 LYS H H 1 8.65 0.02 . 1 . . . . . . . . 5010 1 88 . 1 1 8 8 LYS CA C 13 60.6 0.3 . 1 . . . . . . . . 5010 1 89 . 1 1 8 8 LYS HA H 1 3.87 0.02 . 1 . . . . . . . . 5010 1 90 . 1 1 8 8 LYS CB C 13 32.4 0.3 . 1 . . . . . . . . 5010 1 91 . 1 1 8 8 LYS HB2 H 1 1.90 0.02 . 2 . . . . . . . . 5010 1 92 . 1 1 8 8 LYS CG C 13 27.0 0.3 . 1 . . . . . . . . 5010 1 93 . 1 1 8 8 LYS HG2 H 1 1.40 0.02 . 2 . . . . . . . . 5010 1 94 . 1 1 8 8 LYS CD C 13 30.0 0.3 . 1 . . . . . . . . 5010 1 95 . 1 1 8 8 LYS HD2 H 1 1.70 0.02 . 2 . . . . . . . . 5010 1 96 . 1 1 8 8 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 5010 1 97 . 1 1 8 8 LYS HE2 H 1 2.88 0.02 . 2 . . . . . . . . 5010 1 98 . 1 1 8 8 LYS C C 13 179.5 0.3 . 1 . . . . . . . . 5010 1 99 . 1 1 9 9 LYS N N 15 120.3 0.25 . 1 . . . . . . . . 5010 1 100 . 1 1 9 9 LYS H H 1 7.88 0.02 . 1 . . . . . . . . 5010 1 101 . 1 1 9 9 LYS CA C 13 59.8 0.3 . 1 . . . . . . . . 5010 1 102 . 1 1 9 9 LYS HA H 1 4.14 0.02 . 1 . . . . . . . . 5010 1 103 . 1 1 9 9 LYS CB C 13 32.8 0.3 . 1 . . . . . . . . 5010 1 104 . 1 1 9 9 LYS HB2 H 1 2.14 0.02 . 2 . . . . . . . . 5010 1 105 . 1 1 9 9 LYS HB3 H 1 2.09 0.02 . 2 . . . . . . . . 5010 1 106 . 1 1 9 9 LYS CG C 13 25.9 0.3 . 1 . . . . . . . . 5010 1 107 . 1 1 9 9 LYS HG2 H 1 1.85 0.02 . 2 . . . . . . . . 5010 1 108 . 1 1 9 9 LYS HG3 H 1 1.61 0.02 . 2 . . . . . . . . 5010 1 109 . 1 1 9 9 LYS CD C 13 29.7 0.3 . 1 . . . . . . . . 5010 1 110 . 1 1 9 9 LYS HD2 H 1 1.90 0.02 . 2 . . . . . . . . 5010 1 111 . 1 1 9 9 LYS CE C 13 42.3 0.3 . 1 . . . . . . . . 5010 1 112 . 1 1 9 9 LYS HE2 H 1 3.11 0.02 . 2 . . . . . . . . 5010 1 113 . 1 1 9 9 LYS C C 13 179.9 0.3 . 1 . . . . . . . . 5010 1 114 . 1 1 10 10 ILE N N 15 121.2 0.25 . 1 . . . . . . . . 5010 1 115 . 1 1 10 10 ILE H H 1 7.90 0.02 . 1 . . . . . . . . 5010 1 116 . 1 1 10 10 ILE CA C 13 64.9 0.3 . 1 . . . . . . . . 5010 1 117 . 1 1 10 10 ILE HA H 1 2.93 0.02 . 1 . . . . . . . . 5010 1 118 . 1 1 10 10 ILE CB C 13 37.3 0.3 . 1 . . . . . . . . 5010 1 119 . 1 1 10 10 ILE HB H 1 1.53 0.02 . 1 . . . . . . . . 5010 1 120 . 1 1 10 10 ILE HG21 H 1 0.46 0.02 . 1 . . . . . . . . 5010 1 121 . 1 1 10 10 ILE HG22 H 1 0.46 0.02 . 1 . . . . . . . . 5010 1 122 . 1 1 10 10 ILE HG23 H 1 0.46 0.02 . 1 . . . . . . . . 5010 1 123 . 1 1 10 10 ILE CG2 C 13 16.6 0.3 . 1 . . . . . . . . 5010 1 124 . 1 1 10 10 ILE CG1 C 13 28.5 0.3 . 1 . . . . . . . . 5010 1 125 . 1 1 10 10 ILE HG12 H 1 -0.66 0.02 . 2 . . . . . . . . 5010 1 126 . 1 1 10 10 ILE HG13 H 1 0.75 0.02 . 2 . . . . . . . . 5010 1 127 . 1 1 10 10 ILE HD11 H 1 -0.07 0.02 . 1 . . . . . . . . 5010 1 128 . 1 1 10 10 ILE HD12 H 1 -0.07 0.02 . 1 . . . . . . . . 5010 1 129 . 1 1 10 10 ILE HD13 H 1 -0.07 0.02 . 1 . . . . . . . . 5010 1 130 . 1 1 10 10 ILE CD1 C 13 13.9 0.3 . 1 . . . . . . . . 5010 1 131 . 1 1 10 10 ILE C C 13 177.8 0.3 . 1 . . . . . . . . 5010 1 132 . 1 1 11 11 VAL N N 15 120.0 0.25 . 1 . . . . . . . . 5010 1 133 . 1 1 11 11 VAL H H 1 8.08 0.02 . 1 . . . . . . . . 5010 1 134 . 1 1 11 11 VAL CA C 13 67.9 0.3 . 1 . . . . . . . . 5010 1 135 . 1 1 11 11 VAL HA H 1 3.29 0.02 . 1 . . . . . . . . 5010 1 136 . 1 1 11 11 VAL CB C 13 31.0 0.3 . 1 . . . . . . . . 5010 1 137 . 1 1 11 11 VAL HB H 1 2.10 0.02 . 1 . . . . . . . . 5010 1 138 . 1 1 11 11 VAL HG11 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 139 . 1 1 11 11 VAL HG12 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 140 . 1 1 11 11 VAL HG13 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 141 . 1 1 11 11 VAL HG21 H 1 0.98 0.02 . 2 . . . . . . . . 5010 1 142 . 1 1 11 11 VAL HG22 H 1 0.98 0.02 . 2 . . . . . . . . 5010 1 143 . 1 1 11 11 VAL HG23 H 1 0.98 0.02 . 2 . . . . . . . . 5010 1 144 . 1 1 11 11 VAL CG1 C 13 21.8 0.3 . 1 . . . . . . . . 5010 1 145 . 1 1 11 11 VAL CG2 C 13 25.1 0.3 . 1 . . . . . . . . 5010 1 146 . 1 1 11 11 VAL C C 13 179.2 0.3 . 1 . . . . . . . . 5010 1 147 . 1 1 12 12 ASN N N 15 116.3 0.25 . 1 . . . . . . . . 5010 1 148 . 1 1 12 12 ASN H H 1 8.09 0.02 . 1 . . . . . . . . 5010 1 149 . 1 1 12 12 ASN CA C 13 56.6 0.3 . 1 . . . . . . . . 5010 1 150 . 1 1 12 12 ASN HA H 1 4.40 0.02 . 1 . . . . . . . . 5010 1 151 . 1 1 12 12 ASN CB C 13 38.4 0.3 . 1 . . . . . . . . 5010 1 152 . 1 1 12 12 ASN HB2 H 1 2.93 0.02 . 2 . . . . . . . . 5010 1 153 . 1 1 12 12 ASN ND2 N 15 113.8 0.25 . 1 . . . . . . . . 5010 1 154 . 1 1 12 12 ASN HD21 H 1 7.03 0.02 . 2 . . . . . . . . 5010 1 155 . 1 1 12 12 ASN HD22 H 1 7.73 0.02 . 2 . . . . . . . . 5010 1 156 . 1 1 12 12 ASN C C 13 177.4 0.3 . 1 . . . . . . . . 5010 1 157 . 1 1 13 13 HIS N N 15 119.4 0.25 . 1 . . . . . . . . 5010 1 158 . 1 1 13 13 HIS H H 1 7.85 0.02 . 1 . . . . . . . . 5010 1 159 . 1 1 13 13 HIS CA C 13 58.9 0.3 . 1 . . . . . . . . 5010 1 160 . 1 1 13 13 HIS HA H 1 4.28 0.02 . 1 . . . . . . . . 5010 1 161 . 1 1 13 13 HIS CB C 13 31.6 0.3 . 1 . . . . . . . . 5010 1 162 . 1 1 13 13 HIS HB2 H 1 3.19 0.02 . 2 . . . . . . . . 5010 1 163 . 1 1 13 13 HIS C C 13 177.7 0.3 . 1 . . . . . . . . 5010 1 164 . 1 1 14 14 LEU N N 15 116.1 0.25 . 1 . . . . . . . . 5010 1 165 . 1 1 14 14 LEU H H 1 8.37 0.02 . 1 . . . . . . . . 5010 1 166 . 1 1 14 14 LEU CA C 13 57.4 0.3 . 1 . . . . . . . . 5010 1 167 . 1 1 14 14 LEU HA H 1 3.86 0.02 . 1 . . . . . . . . 5010 1 168 . 1 1 14 14 LEU CB C 13 42.3 0.3 . 1 . . . . . . . . 5010 1 169 . 1 1 14 14 LEU HB2 H 1 1.84 0.02 . 2 . . . . . . . . 5010 1 170 . 1 1 14 14 LEU HB3 H 1 1.22 0.02 . 2 . . . . . . . . 5010 1 171 . 1 1 14 14 LEU CG C 13 27.2 0.3 . 1 . . . . . . . . 5010 1 172 . 1 1 14 14 LEU HG H 1 0.68 0.02 . 1 . . . . . . . . 5010 1 173 . 1 1 14 14 LEU HD11 H 1 0.76 0.02 . 2 . . . . . . . . 5010 1 174 . 1 1 14 14 LEU HD12 H 1 0.76 0.02 . 2 . . . . . . . . 5010 1 175 . 1 1 14 14 LEU HD13 H 1 0.76 0.02 . 2 . . . . . . . . 5010 1 176 . 1 1 14 14 LEU CD1 C 13 23.7 0.3 . 1 . . . . . . . . 5010 1 177 . 1 1 14 14 LEU C C 13 174.6 0.3 . 1 . . . . . . . . 5010 1 178 . 1 1 15 15 ARG N N 15 115.6 0.25 . 1 . . . . . . . . 5010 1 179 . 1 1 15 15 ARG H H 1 8.07 0.02 . 1 . . . . . . . . 5010 1 180 . 1 1 15 15 ARG CA C 13 60.4 0.3 . 1 . . . . . . . . 5010 1 181 . 1 1 15 15 ARG HA H 1 3.90 0.02 . 1 . . . . . . . . 5010 1 182 . 1 1 15 15 ARG CB C 13 30.1 0.3 . 1 . . . . . . . . 5010 1 183 . 1 1 15 15 ARG HB2 H 1 2.03 0.02 . 2 . . . . . . . . 5010 1 184 . 1 1 15 15 ARG HB3 H 1 1.92 0.02 . 2 . . . . . . . . 5010 1 185 . 1 1 15 15 ARG CG C 13 28.4 0.3 . 1 . . . . . . . . 5010 1 186 . 1 1 15 15 ARG HG2 H 1 1.74 0.02 . 2 . . . . . . . . 5010 1 187 . 1 1 15 15 ARG HG3 H 1 1.97 0.02 . 2 . . . . . . . . 5010 1 188 . 1 1 15 15 ARG CD C 13 43.4 0.3 . 1 . . . . . . . . 5010 1 189 . 1 1 15 15 ARG HD2 H 1 3.26 0.02 . 2 . . . . . . . . 5010 1 190 . 1 1 15 15 ARG NE N 15 114.2 0.25 . 1 . . . . . . . . 5010 1 191 . 1 1 15 15 ARG HE H 1 7.49 0.02 . 1 . . . . . . . . 5010 1 192 . 1 1 15 15 ARG C C 13 176.3 0.3 . 1 . . . . . . . . 5010 1 193 . 1 1 16 16 SER N N 15 108.7 0.25 . 1 . . . . . . . . 5010 1 194 . 1 1 16 16 SER H H 1 7.06 0.02 . 1 . . . . . . . . 5010 1 195 . 1 1 16 16 SER CA C 13 57.6 0.3 . 1 . . . . . . . . 5010 1 196 . 1 1 16 16 SER HA H 1 4.90 0.02 . 1 . . . . . . . . 5010 1 197 . 1 1 16 16 SER CB C 13 64.1 0.3 . 1 . . . . . . . . 5010 1 198 . 1 1 16 16 SER HB2 H 1 3.85 0.02 . 2 . . . . . . . . 5010 1 199 . 1 1 16 16 SER HB3 H 1 4.17 0.02 . 2 . . . . . . . . 5010 1 200 . 1 1 16 16 SER C C 13 176.2 0.3 . 1 . . . . . . . . 5010 1 201 . 1 1 17 17 ARG N N 15 122.6 0.25 . 1 . . . . . . . . 5010 1 202 . 1 1 17 17 ARG H H 1 7.91 0.02 . 1 . . . . . . . . 5010 1 203 . 1 1 17 17 ARG CA C 13 56.8 0.3 . 1 . . . . . . . . 5010 1 204 . 1 1 17 17 ARG HA H 1 4.56 0.02 . 1 . . . . . . . . 5010 1 205 . 1 1 17 17 ARG CB C 13 32.4 0.3 . 1 . . . . . . . . 5010 1 206 . 1 1 17 17 ARG HB2 H 1 1.62 0.02 . 2 . . . . . . . . 5010 1 207 . 1 1 17 17 ARG HB3 H 1 1.51 0.02 . 2 . . . . . . . . 5010 1 208 . 1 1 17 17 ARG CG C 13 29.1 0.3 . 1 . . . . . . . . 5010 1 209 . 1 1 17 17 ARG HG2 H 1 1.31 0.02 . 2 . . . . . . . . 5010 1 210 . 1 1 17 17 ARG HG3 H 1 1.17 0.02 . 2 . . . . . . . . 5010 1 211 . 1 1 17 17 ARG CD C 13 41.7 0.3 . 1 . . . . . . . . 5010 1 212 . 1 1 17 17 ARG HD2 H 1 2.48 0.02 . 2 . . . . . . . . 5010 1 213 . 1 1 17 17 ARG HD3 H 1 2.32 0.02 . 2 . . . . . . . . 5010 1 214 . 1 1 17 17 ARG NE N 15 116.1 0.25 . 1 . . . . . . . . 5010 1 215 . 1 1 17 17 ARG HE H 1 7.50 0.02 . 1 . . . . . . . . 5010 1 216 . 1 1 17 17 ARG C C 13 174.6 0.3 . 1 . . . . . . . . 5010 1 217 . 1 1 18 18 LEU N N 15 122.1 0.25 . 1 . . . . . . . . 5010 1 218 . 1 1 18 18 LEU H H 1 8.85 0.02 . 1 . . . . . . . . 5010 1 219 . 1 1 18 18 LEU CA C 13 55.1 0.3 . 1 . . . . . . . . 5010 1 220 . 1 1 18 18 LEU HA H 1 5.02 0.02 . 1 . . . . . . . . 5010 1 221 . 1 1 18 18 LEU CB C 13 44.5 0.3 . 1 . . . . . . . . 5010 1 222 . 1 1 18 18 LEU HB2 H 1 1.96 0.02 . 2 . . . . . . . . 5010 1 223 . 1 1 18 18 LEU HB3 H 1 1.34 0.02 . 2 . . . . . . . . 5010 1 224 . 1 1 18 18 LEU HD11 H 1 0.78 0.02 . 2 . . . . . . . . 5010 1 225 . 1 1 18 18 LEU HD12 H 1 0.78 0.02 . 2 . . . . . . . . 5010 1 226 . 1 1 18 18 LEU HD13 H 1 0.78 0.02 . 2 . . . . . . . . 5010 1 227 . 1 1 18 18 LEU HD21 H 1 0.72 0.02 . 2 . . . . . . . . 5010 1 228 . 1 1 18 18 LEU HD22 H 1 0.72 0.02 . 2 . . . . . . . . 5010 1 229 . 1 1 18 18 LEU HD23 H 1 0.72 0.02 . 2 . . . . . . . . 5010 1 230 . 1 1 18 18 LEU CD1 C 13 24.7 0.3 . 1 . . . . . . . . 5010 1 231 . 1 1 18 18 LEU CD2 C 13 25.8 0.3 . 1 . . . . . . . . 5010 1 232 . 1 1 18 18 LEU C C 13 176.3 0.3 . 1 . . . . . . . . 5010 1 233 . 1 1 19 19 ALA N N 15 126.0 0.25 . 1 . . . . . . . . 5010 1 234 . 1 1 19 19 ALA H H 1 8.74 0.02 . 1 . . . . . . . . 5010 1 235 . 1 1 19 19 ALA CA C 13 51.3 0.3 . 1 . . . . . . . . 5010 1 236 . 1 1 19 19 ALA HA H 1 5.15 0.02 . 1 . . . . . . . . 5010 1 237 . 1 1 19 19 ALA HB1 H 1 1.27 0.02 . 1 . . . . . . . . 5010 1 238 . 1 1 19 19 ALA HB2 H 1 1.27 0.02 . 1 . . . . . . . . 5010 1 239 . 1 1 19 19 ALA HB3 H 1 1.27 0.02 . 1 . . . . . . . . 5010 1 240 . 1 1 19 19 ALA CB C 13 24.0 0.3 . 1 . . . . . . . . 5010 1 241 . 1 1 19 19 ALA C C 13 173.9 0.3 . 1 . . . . . . . . 5010 1 242 . 1 1 20 20 PHE N N 15 114.0 0.25 . 1 . . . . . . . . 5010 1 243 . 1 1 20 20 PHE H H 1 8.91 0.02 . 1 . . . . . . . . 5010 1 244 . 1 1 20 20 PHE CA C 13 56.3 0.3 . 1 . . . . . . . . 5010 1 245 . 1 1 20 20 PHE HA H 1 5.59 0.02 . 1 . . . . . . . . 5010 1 246 . 1 1 20 20 PHE CB C 13 43.0 0.3 . 1 . . . . . . . . 5010 1 247 . 1 1 20 20 PHE HB2 H 1 3.21 0.02 . 2 . . . . . . . . 5010 1 248 . 1 1 20 20 PHE HB3 H 1 3.04 0.02 . 2 . . . . . . . . 5010 1 249 . 1 1 20 20 PHE HD1 H 1 7.08 0.02 . 1 . . . . . . . . 5010 1 250 . 1 1 20 20 PHE HD2 H 1 7.08 0.02 . 1 . . . . . . . . 5010 1 251 . 1 1 20 20 PHE HE1 H 1 7.15 0.02 . 1 . . . . . . . . 5010 1 252 . 1 1 20 20 PHE HE2 H 1 7.15 0.02 . 1 . . . . . . . . 5010 1 253 . 1 1 20 20 PHE HZ H 1 6.89 0.02 . 1 . . . . . . . . 5010 1 254 . 1 1 20 20 PHE C C 13 172.6 0.3 . 1 . . . . . . . . 5010 1 255 . 1 1 21 21 GLU N N 15 122.3 0.25 . 1 . . . . . . . . 5010 1 256 . 1 1 21 21 GLU H H 1 7.90 0.02 . 1 . . . . . . . . 5010 1 257 . 1 1 21 21 GLU CA C 13 55.4 0.3 . 1 . . . . . . . . 5010 1 258 . 1 1 21 21 GLU HA H 1 5.01 0.02 . 1 . . . . . . . . 5010 1 259 . 1 1 21 21 GLU CB C 13 31.5 0.3 . 1 . . . . . . . . 5010 1 260 . 1 1 21 21 GLU HB2 H 1 1.84 0.02 . 2 . . . . . . . . 5010 1 261 . 1 1 21 21 GLU HB3 H 1 2.11 0.02 . 2 . . . . . . . . 5010 1 262 . 1 1 21 21 GLU CG C 13 37.1 0.3 . 1 . . . . . . . . 5010 1 263 . 1 1 21 21 GLU HG2 H 1 2.05 0.02 . 2 . . . . . . . . 5010 1 264 . 1 1 21 21 GLU C C 13 174.9 0.3 . 1 . . . . . . . . 5010 1 265 . 1 1 22 22 TYR N N 15 126.0 0.25 . 1 . . . . . . . . 5010 1 266 . 1 1 22 22 TYR H H 1 8.94 0.02 . 1 . . . . . . . . 5010 1 267 . 1 1 22 22 TYR CA C 13 55.9 0.3 . 1 . . . . . . . . 5010 1 268 . 1 1 22 22 TYR HA H 1 4.85 0.02 . 1 . . . . . . . . 5010 1 269 . 1 1 22 22 TYR CB C 13 41.0 0.3 . 1 . . . . . . . . 5010 1 270 . 1 1 22 22 TYR HB2 H 1 2.67 0.02 . 2 . . . . . . . . 5010 1 271 . 1 1 22 22 TYR HB3 H 1 2.99 0.02 . 2 . . . . . . . . 5010 1 272 . 1 1 22 22 TYR HD1 H 1 6.67 0.02 . 1 . . . . . . . . 5010 1 273 . 1 1 22 22 TYR HD2 H 1 6.67 0.02 . 1 . . . . . . . . 5010 1 274 . 1 1 22 22 TYR HE1 H 1 6.47 0.02 . 1 . . . . . . . . 5010 1 275 . 1 1 22 22 TYR HE2 H 1 6.47 0.02 . 1 . . . . . . . . 5010 1 276 . 1 1 22 22 TYR C C 13 174.9 0.3 . 1 . . . . . . . . 5010 1 277 . 1 1 23 23 ASN N N 15 128.2 0.25 . 1 . . . . . . . . 5010 1 278 . 1 1 23 23 ASN H H 1 9.10 0.02 . 1 . . . . . . . . 5010 1 279 . 1 1 23 23 ASN CA C 13 53.5 0.3 . 1 . . . . . . . . 5010 1 280 . 1 1 23 23 ASN HA H 1 4.16 0.02 . 1 . . . . . . . . 5010 1 281 . 1 1 23 23 ASN CB C 13 36.9 0.3 . 1 . . . . . . . . 5010 1 282 . 1 1 23 23 ASN HB2 H 1 2.80 0.02 . 2 . . . . . . . . 5010 1 283 . 1 1 23 23 ASN HB3 H 1 1.90 0.02 . 2 . . . . . . . . 5010 1 284 . 1 1 23 23 ASN ND2 N 15 111.0 0.25 . 1 . . . . . . . . 5010 1 285 . 1 1 23 23 ASN HD21 H 1 6.49 0.02 . 2 . . . . . . . . 5010 1 286 . 1 1 23 23 ASN HD22 H 1 6.94 0.02 . 2 . . . . . . . . 5010 1 287 . 1 1 23 23 ASN C C 13 175.5 0.3 . 1 . . . . . . . . 5010 1 288 . 1 1 24 24 GLY N N 15 103.6 0.25 . 1 . . . . . . . . 5010 1 289 . 1 1 24 24 GLY H H 1 8.68 0.02 . 1 . . . . . . . . 5010 1 290 . 1 1 24 24 GLY CA C 13 45.3 0.3 . 1 . . . . . . . . 5010 1 291 . 1 1 24 24 GLY HA2 H 1 4.14 0.02 . 2 . . . . . . . . 5010 1 292 . 1 1 24 24 GLY HA3 H 1 3.67 0.02 . 2 . . . . . . . . 5010 1 293 . 1 1 24 24 GLY C C 13 173.7 0.3 . 1 . . . . . . . . 5010 1 294 . 1 1 25 25 GLN N N 15 119.6 0.25 . 1 . . . . . . . . 5010 1 295 . 1 1 25 25 GLN H H 1 7.70 0.02 . 1 . . . . . . . . 5010 1 296 . 1 1 25 25 GLN CA C 13 53.5 0.3 . 1 . . . . . . . . 5010 1 297 . 1 1 25 25 GLN HA H 1 4.61 0.02 . 1 . . . . . . . . 5010 1 298 . 1 1 25 25 GLN CB C 13 31.7 0.3 . 1 . . . . . . . . 5010 1 299 . 1 1 25 25 GLN HB2 H 1 2.02 0.02 . 2 . . . . . . . . 5010 1 300 . 1 1 25 25 GLN HB3 H 1 2.07 0.02 . 2 . . . . . . . . 5010 1 301 . 1 1 25 25 GLN CG C 13 33.5 0.3 . 1 . . . . . . . . 5010 1 302 . 1 1 25 25 GLN HG2 H 1 2.31 0.02 . 2 . . . . . . . . 5010 1 303 . 1 1 25 25 GLN NE2 N 15 112.1 0.25 . 1 . . . . . . . . 5010 1 304 . 1 1 25 25 GLN HE21 H 1 6.88 0.02 . 2 . . . . . . . . 5010 1 305 . 1 1 25 25 GLN HE22 H 1 7.49 0.02 . 2 . . . . . . . . 5010 1 306 . 1 1 25 25 GLN C C 13 179.5 0.3 . 1 . . . . . . . . 5010 1 307 . 1 1 26 26 LEU N N 15 124.6 0.25 . 1 . . . . . . . . 5010 1 308 . 1 1 26 26 LEU H H 1 8.55 0.02 . 1 . . . . . . . . 5010 1 309 . 1 1 26 26 LEU CA C 13 54.6 0.3 . 1 . . . . . . . . 5010 1 310 . 1 1 26 26 LEU HA H 1 4.50 0.02 . 1 . . . . . . . . 5010 1 311 . 1 1 26 26 LEU CB C 13 42.0 0.3 . 1 . . . . . . . . 5010 1 312 . 1 1 26 26 LEU HB2 H 1 1.53 0.02 . 2 . . . . . . . . 5010 1 313 . 1 1 26 26 LEU CG C 13 27.5 0.3 . 1 . . . . . . . . 5010 1 314 . 1 1 26 26 LEU HG H 1 1.36 0.02 . 1 . . . . . . . . 5010 1 315 . 1 1 26 26 LEU HD11 H 1 0.79 0.02 . 2 . . . . . . . . 5010 1 316 . 1 1 26 26 LEU HD12 H 1 0.79 0.02 . 2 . . . . . . . . 5010 1 317 . 1 1 26 26 LEU HD13 H 1 0.79 0.02 . 2 . . . . . . . . 5010 1 318 . 1 1 26 26 LEU CD1 C 13 24.5 0.3 . 1 . . . . . . . . 5010 1 319 . 1 1 26 26 LEU C C 13 176.0 0.3 . 1 . . . . . . . . 5010 1 320 . 1 1 27 27 ILE N N 15 130.4 0.25 . 1 . . . . . . . . 5010 1 321 . 1 1 27 27 ILE H H 1 8.98 0.02 . 1 . . . . . . . . 5010 1 322 . 1 1 27 27 ILE CA C 13 59.8 0.3 . 1 . . . . . . . . 5010 1 323 . 1 1 27 27 ILE HA H 1 4.05 0.02 . 1 . . . . . . . . 5010 1 324 . 1 1 27 27 ILE CB C 13 36.7 0.3 . 1 . . . . . . . . 5010 1 325 . 1 1 27 27 ILE HB H 1 0.72 0.02 . 1 . . . . . . . . 5010 1 326 . 1 1 27 27 ILE HG21 H 1 0.77 0.02 . 1 . . . . . . . . 5010 1 327 . 1 1 27 27 ILE HG22 H 1 0.77 0.02 . 1 . . . . . . . . 5010 1 328 . 1 1 27 27 ILE HG23 H 1 0.77 0.02 . 1 . . . . . . . . 5010 1 329 . 1 1 27 27 ILE CG2 C 13 17.7 0.3 . 1 . . . . . . . . 5010 1 330 . 1 1 27 27 ILE CG1 C 13 27.2 0.3 . 1 . . . . . . . . 5010 1 331 . 1 1 27 27 ILE HG12 H 1 1.00 0.02 . 2 . . . . . . . . 5010 1 332 . 1 1 27 27 ILE HG13 H 1 1.15 0.02 . 2 . . . . . . . . 5010 1 333 . 1 1 27 27 ILE HD11 H 1 0.71 0.02 . 1 . . . . . . . . 5010 1 334 . 1 1 27 27 ILE HD12 H 1 0.71 0.02 . 1 . . . . . . . . 5010 1 335 . 1 1 27 27 ILE HD13 H 1 0.71 0.02 . 1 . . . . . . . . 5010 1 336 . 1 1 27 27 ILE CD1 C 13 12.2 0.3 . 1 . . . . . . . . 5010 1 337 . 1 1 27 27 ILE C C 13 175.2 0.3 . 1 . . . . . . . . 5010 1 338 . 1 1 28 28 LYS N N 15 126.0 0.25 . 1 . . . . . . . . 5010 1 339 . 1 1 28 28 LYS H H 1 8.32 0.02 . 1 . . . . . . . . 5010 1 340 . 1 1 28 28 LYS CA C 13 57.4 0.3 . 1 . . . . . . . . 5010 1 341 . 1 1 28 28 LYS HA H 1 4.17 0.02 . 1 . . . . . . . . 5010 1 342 . 1 1 28 28 LYS CB C 13 32.9 0.3 . 1 . . . . . . . . 5010 1 343 . 1 1 28 28 LYS HB2 H 1 1.81 0.02 . 2 . . . . . . . . 5010 1 344 . 1 1 28 28 LYS CG C 13 25.2 0.3 . 1 . . . . . . . . 5010 1 345 . 1 1 28 28 LYS HG2 H 1 1.58 0.02 . 2 . . . . . . . . 5010 1 346 . 1 1 28 28 LYS HG3 H 1 1.40 0.02 . 2 . . . . . . . . 5010 1 347 . 1 1 28 28 LYS CD C 13 29.0 0.3 . 1 . . . . . . . . 5010 1 348 . 1 1 28 28 LYS HD2 H 1 1.76 0.02 . 2 . . . . . . . . 5010 1 349 . 1 1 28 28 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5010 1 350 . 1 1 28 28 LYS HE2 H 1 3.06 0.02 . 2 . . . . . . . . 5010 1 351 . 1 1 28 28 LYS C C 13 176.8 0.3 . 1 . . . . . . . . 5010 1 352 . 1 1 29 29 ILE N N 15 126.2 0.25 . 1 . . . . . . . . 5010 1 353 . 1 1 29 29 ILE H H 1 8.15 0.02 . 1 . . . . . . . . 5010 1 354 . 1 1 29 29 ILE CA C 13 60.9 0.3 . 1 . . . . . . . . 5010 1 355 . 1 1 29 29 ILE HA H 1 4.26 0.02 . 1 . . . . . . . . 5010 1 356 . 1 1 29 29 ILE CB C 13 38.2 0.3 . 1 . . . . . . . . 5010 1 357 . 1 1 29 29 ILE HB H 1 1.62 0.02 . 1 . . . . . . . . 5010 1 358 . 1 1 29 29 ILE HG21 H 1 1.01 0.02 . 1 . . . . . . . . 5010 1 359 . 1 1 29 29 ILE HG22 H 1 1.01 0.02 . 1 . . . . . . . . 5010 1 360 . 1 1 29 29 ILE HG23 H 1 1.01 0.02 . 1 . . . . . . . . 5010 1 361 . 1 1 29 29 ILE CG2 C 13 17.7 0.3 . 1 . . . . . . . . 5010 1 362 . 1 1 29 29 ILE CG1 C 13 28.6 0.3 . 1 . . . . . . . . 5010 1 363 . 1 1 29 29 ILE HG13 H 1 1.81 0.02 . 2 . . . . . . . . 5010 1 364 . 1 1 29 29 ILE HD11 H 1 0.83 0.02 . 1 . . . . . . . . 5010 1 365 . 1 1 29 29 ILE HD12 H 1 0.83 0.02 . 1 . . . . . . . . 5010 1 366 . 1 1 29 29 ILE HD13 H 1 0.83 0.02 . 1 . . . . . . . . 5010 1 367 . 1 1 29 29 ILE CD1 C 13 13.8 0.3 . 1 . . . . . . . . 5010 1 368 . 1 1 29 29 ILE C C 13 175.8 0.3 . 1 . . . . . . . . 5010 1 369 . 1 1 30 30 LEU N N 15 129.0 0.25 . 1 . . . . . . . . 5010 1 370 . 1 1 30 30 LEU H H 1 9.14 0.02 . 1 . . . . . . . . 5010 1 371 . 1 1 30 30 LEU CA C 13 54.9 0.3 . 1 . . . . . . . . 5010 1 372 . 1 1 30 30 LEU HA H 1 4.37 0.02 . 1 . . . . . . . . 5010 1 373 . 1 1 30 30 LEU CB C 13 42.1 0.3 . 1 . . . . . . . . 5010 1 374 . 1 1 30 30 LEU HB2 H 1 1.85 0.02 . 2 . . . . . . . . 5010 1 375 . 1 1 30 30 LEU HB3 H 1 1.76 0.02 . 2 . . . . . . . . 5010 1 376 . 1 1 30 30 LEU CG C 13 25.9 0.3 . 1 . . . . . . . . 5010 1 377 . 1 1 30 30 LEU HG H 1 1.05 0.02 . 1 . . . . . . . . 5010 1 378 . 1 1 30 30 LEU HD11 H 1 0.97 0.02 . 2 . . . . . . . . 5010 1 379 . 1 1 30 30 LEU HD12 H 1 0.97 0.02 . 2 . . . . . . . . 5010 1 380 . 1 1 30 30 LEU HD13 H 1 0.97 0.02 . 2 . . . . . . . . 5010 1 381 . 1 1 30 30 LEU HD21 H 1 1.04 0.02 . 2 . . . . . . . . 5010 1 382 . 1 1 30 30 LEU HD22 H 1 1.04 0.02 . 2 . . . . . . . . 5010 1 383 . 1 1 30 30 LEU HD23 H 1 1.04 0.02 . 2 . . . . . . . . 5010 1 384 . 1 1 30 30 LEU CD1 C 13 22.6 0.3 . 1 . . . . . . . . 5010 1 385 . 1 1 30 30 LEU CD2 C 13 25.8 0.3 . 1 . . . . . . . . 5010 1 386 . 1 1 30 30 LEU C C 13 178.8 0.3 . 1 . . . . . . . . 5010 1 387 . 1 1 31 31 SER N N 15 117.7 0.25 . 1 . . . . . . . . 5010 1 388 . 1 1 31 31 SER H H 1 8.75 0.02 . 1 . . . . . . . . 5010 1 389 . 1 1 31 31 SER CA C 13 61.7 0.3 . 1 . . . . . . . . 5010 1 390 . 1 1 31 31 SER HA H 1 4.23 0.02 . 1 . . . . . . . . 5010 1 391 . 1 1 31 31 SER CB C 13 62.8 0.3 . 1 . . . . . . . . 5010 1 392 . 1 1 31 31 SER HB2 H 1 4.03 0.02 . 2 . . . . . . . . 5010 1 393 . 1 1 31 31 SER C C 13 177.5 0.3 . 1 . . . . . . . . 5010 1 394 . 1 1 32 32 LYS N N 15 115.6 0.25 . 1 . . . . . . . . 5010 1 395 . 1 1 32 32 LYS H H 1 8.22 0.02 . 1 . . . . . . . . 5010 1 396 . 1 1 32 32 LYS CA C 13 57.9 0.3 . 1 . . . . . . . . 5010 1 397 . 1 1 32 32 LYS HA H 1 4.32 0.02 . 1 . . . . . . . . 5010 1 398 . 1 1 32 32 LYS CB C 13 31.1 0.3 . 1 . . . . . . . . 5010 1 399 . 1 1 32 32 LYS HB2 H 1 1.87 0.02 . 2 . . . . . . . . 5010 1 400 . 1 1 32 32 LYS HB3 H 1 2.00 0.02 . 2 . . . . . . . . 5010 1 401 . 1 1 32 32 LYS CG C 13 23.7 0.3 . 1 . . . . . . . . 5010 1 402 . 1 1 32 32 LYS HG2 H 1 1.22 0.02 . 2 . . . . . . . . 5010 1 403 . 1 1 32 32 LYS HG3 H 1 1.45 0.02 . 2 . . . . . . . . 5010 1 404 . 1 1 32 32 LYS CD C 13 29.1 0.3 . 1 . . . . . . . . 5010 1 405 . 1 1 32 32 LYS HD2 H 1 1.74 0.02 . 2 . . . . . . . . 5010 1 406 . 1 1 32 32 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 5010 1 407 . 1 1 32 32 LYS HE2 H 1 3.02 0.02 . 2 . . . . . . . . 5010 1 408 . 1 1 32 32 LYS C C 13 176.2 0.3 . 1 . . . . . . . . 5010 1 409 . 1 1 33 33 ASN N N 15 118.8 0.25 . 1 . . . . . . . . 5010 1 410 . 1 1 33 33 ASN H H 1 8.00 0.02 . 1 . . . . . . . . 5010 1 411 . 1 1 33 33 ASN CA C 13 52.7 0.3 . 1 . . . . . . . . 5010 1 412 . 1 1 33 33 ASN HA H 1 5.03 0.02 . 1 . . . . . . . . 5010 1 413 . 1 1 33 33 ASN CB C 13 38.8 0.3 . 1 . . . . . . . . 5010 1 414 . 1 1 33 33 ASN HB2 H 1 4.01 0.02 . 2 . . . . . . . . 5010 1 415 . 1 1 33 33 ASN HB3 H 1 2.86 0.02 . 2 . . . . . . . . 5010 1 416 . 1 1 33 33 ASN ND2 N 15 112.8 0.25 . 1 . . . . . . . . 5010 1 417 . 1 1 33 33 ASN HD21 H 1 7.30 0.02 . 2 . . . . . . . . 5010 1 418 . 1 1 33 33 ASN HD22 H 1 8.18 0.02 . 2 . . . . . . . . 5010 1 419 . 1 1 33 33 ASN C C 13 172.4 0.3 . 1 . . . . . . . . 5010 1 420 . 1 1 34 34 ILE N N 15 119.5 0.25 . 1 . . . . . . . . 5010 1 421 . 1 1 34 34 ILE H H 1 7.58 0.02 . 1 . . . . . . . . 5010 1 422 . 1 1 34 34 ILE CA C 13 61.1 0.3 . 1 . . . . . . . . 5010 1 423 . 1 1 34 34 ILE HA H 1 4.88 0.02 . 1 . . . . . . . . 5010 1 424 . 1 1 34 34 ILE CB C 13 40.1 0.3 . 1 . . . . . . . . 5010 1 425 . 1 1 34 34 ILE HB H 1 1.92 0.02 . 1 . . . . . . . . 5010 1 426 . 1 1 34 34 ILE HG21 H 1 0.91 0.02 . 1 . . . . . . . . 5010 1 427 . 1 1 34 34 ILE HG22 H 1 0.91 0.02 . 1 . . . . . . . . 5010 1 428 . 1 1 34 34 ILE HG23 H 1 0.91 0.02 . 1 . . . . . . . . 5010 1 429 . 1 1 34 34 ILE CG2 C 13 16.0 0.3 . 1 . . . . . . . . 5010 1 430 . 1 1 34 34 ILE CG1 C 13 27.5 0.3 . 1 . . . . . . . . 5010 1 431 . 1 1 34 34 ILE HG12 H 1 1.38 0.02 . 2 . . . . . . . . 5010 1 432 . 1 1 34 34 ILE HG13 H 1 1.61 0.02 . 2 . . . . . . . . 5010 1 433 . 1 1 34 34 ILE HD11 H 1 0.71 0.02 . 1 . . . . . . . . 5010 1 434 . 1 1 34 34 ILE HD12 H 1 0.71 0.02 . 1 . . . . . . . . 5010 1 435 . 1 1 34 34 ILE HD13 H 1 0.71 0.02 . 1 . . . . . . . . 5010 1 436 . 1 1 34 34 ILE CD1 C 13 10.8 0.3 . 1 . . . . . . . . 5010 1 437 . 1 1 34 34 ILE C C 13 175.7 0.3 . 1 . . . . . . . . 5010 1 438 . 1 1 35 35 VAL N N 15 129.1 0.25 . 1 . . . . . . . . 5010 1 439 . 1 1 35 35 VAL H H 1 9.65 0.02 . 1 . . . . . . . . 5010 1 440 . 1 1 35 35 VAL CA C 13 60.5 0.3 . 1 . . . . . . . . 5010 1 441 . 1 1 35 35 VAL HA H 1 4.49 0.02 . 1 . . . . . . . . 5010 1 442 . 1 1 35 35 VAL CB C 13 35.5 0.3 . 1 . . . . . . . . 5010 1 443 . 1 1 35 35 VAL HB H 1 2.05 0.02 . 1 . . . . . . . . 5010 1 444 . 1 1 35 35 VAL HG11 H 1 0.99 0.02 . 2 . . . . . . . . 5010 1 445 . 1 1 35 35 VAL HG12 H 1 0.99 0.02 . 2 . . . . . . . . 5010 1 446 . 1 1 35 35 VAL HG13 H 1 0.99 0.02 . 2 . . . . . . . . 5010 1 447 . 1 1 35 35 VAL HG21 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 448 . 1 1 35 35 VAL HG22 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 449 . 1 1 35 35 VAL HG23 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 450 . 1 1 35 35 VAL CG1 C 13 20.7 0.3 . 1 . . . . . . . . 5010 1 451 . 1 1 35 35 VAL CG2 C 13 20.4 0.3 . 1 . . . . . . . . 5010 1 452 . 1 1 35 35 VAL C C 13 175.4 0.3 . 1 . . . . . . . . 5010 1 453 . 1 1 36 36 ALA N N 15 130.4 0.25 . 1 . . . . . . . . 5010 1 454 . 1 1 36 36 ALA H H 1 8.87 0.02 . 1 . . . . . . . . 5010 1 455 . 1 1 36 36 ALA CA C 13 52.9 0.3 . 1 . . . . . . . . 5010 1 456 . 1 1 36 36 ALA HA H 1 4.77 0.02 . 1 . . . . . . . . 5010 1 457 . 1 1 36 36 ALA HB1 H 1 1.44 0.02 . 1 . . . . . . . . 5010 1 458 . 1 1 36 36 ALA HB2 H 1 1.44 0.02 . 1 . . . . . . . . 5010 1 459 . 1 1 36 36 ALA HB3 H 1 1.44 0.02 . 1 . . . . . . . . 5010 1 460 . 1 1 36 36 ALA CB C 13 18.8 0.3 . 1 . . . . . . . . 5010 1 461 . 1 1 36 36 ALA C C 13 177.4 0.3 . 1 . . . . . . . . 5010 1 462 . 1 1 37 37 VAL N N 15 114.6 0.25 . 1 . . . . . . . . 5010 1 463 . 1 1 37 37 VAL H H 1 8.18 0.02 . 1 . . . . . . . . 5010 1 464 . 1 1 37 37 VAL CA C 13 59.5 0.3 . 1 . . . . . . . . 5010 1 465 . 1 1 37 37 VAL HA H 1 4.91 0.02 . 1 . . . . . . . . 5010 1 466 . 1 1 37 37 VAL CB C 13 33.8 0.3 . 1 . . . . . . . . 5010 1 467 . 1 1 37 37 VAL HB H 1 2.00 0.02 . 1 . . . . . . . . 5010 1 468 . 1 1 37 37 VAL HG11 H 1 0.77 0.02 . 2 . . . . . . . . 5010 1 469 . 1 1 37 37 VAL HG12 H 1 0.77 0.02 . 2 . . . . . . . . 5010 1 470 . 1 1 37 37 VAL HG13 H 1 0.77 0.02 . 2 . . . . . . . . 5010 1 471 . 1 1 37 37 VAL HG21 H 1 0.71 0.02 . 2 . . . . . . . . 5010 1 472 . 1 1 37 37 VAL HG22 H 1 0.71 0.02 . 2 . . . . . . . . 5010 1 473 . 1 1 37 37 VAL HG23 H 1 0.71 0.02 . 2 . . . . . . . . 5010 1 474 . 1 1 37 37 VAL CG1 C 13 18.2 0.3 . 1 . . . . . . . . 5010 1 475 . 1 1 37 37 VAL CG2 C 13 18.2 0.3 . 1 . . . . . . . . 5010 1 476 . 1 1 37 37 VAL C C 13 174.4 0.3 . 1 . . . . . . . . 5010 1 477 . 1 1 38 38 GLY N N 15 106.9 0.25 . 1 . . . . . . . . 5010 1 478 . 1 1 38 38 GLY H H 1 7.69 0.02 . 1 . . . . . . . . 5010 1 479 . 1 1 38 38 GLY CA C 13 46.1 0.3 . 1 . . . . . . . . 5010 1 480 . 1 1 38 38 GLY HA2 H 1 4.26 0.02 . 2 . . . . . . . . 5010 1 481 . 1 1 38 38 GLY HA3 H 1 3.88 0.02 . 2 . . . . . . . . 5010 1 482 . 1 1 39 39 SER H H 1 8.90 0.02 . 1 . . . . . . . . 5010 1 483 . 1 1 39 39 SER CA C 13 62.2 0.3 . 1 . . . . . . . . 5010 1 484 . 1 1 39 39 SER HA H 1 3.88 0.02 . 1 . . . . . . . . 5010 1 485 . 1 1 39 39 SER CB C 13 63.1 0.3 . 1 . . . . . . . . 5010 1 486 . 1 1 39 39 SER HB2 H 1 4.02 0.02 . 2 . . . . . . . . 5010 1 487 . 1 1 39 39 SER C C 13 175.6 0.3 . 1 . . . . . . . . 5010 1 488 . 1 1 40 40 LEU N N 15 121.4 0.25 . 1 . . . . . . . . 5010 1 489 . 1 1 40 40 LEU H H 1 8.22 0.02 . 1 . . . . . . . . 5010 1 490 . 1 1 40 40 LEU CA C 13 58.8 0.3 . 1 . . . . . . . . 5010 1 491 . 1 1 40 40 LEU HA H 1 4.05 0.02 . 1 . . . . . . . . 5010 1 492 . 1 1 40 40 LEU CB C 13 43.0 0.3 . 1 . . . . . . . . 5010 1 493 . 1 1 40 40 LEU HB2 H 1 1.85 0.02 . 2 . . . . . . . . 5010 1 494 . 1 1 40 40 LEU HB3 H 1 2.00 0.02 . 2 . . . . . . . . 5010 1 495 . 1 1 40 40 LEU CG C 13 27.5 0.3 . 1 . . . . . . . . 5010 1 496 . 1 1 40 40 LEU HG H 1 1.76 0.02 . 1 . . . . . . . . 5010 1 497 . 1 1 40 40 LEU HD11 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 498 . 1 1 40 40 LEU HD12 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 499 . 1 1 40 40 LEU HD13 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 500 . 1 1 40 40 LEU HD21 H 1 0.89 0.02 . 2 . . . . . . . . 5010 1 501 . 1 1 40 40 LEU HD22 H 1 0.89 0.02 . 2 . . . . . . . . 5010 1 502 . 1 1 40 40 LEU HD23 H 1 0.89 0.02 . 2 . . . . . . . . 5010 1 503 . 1 1 40 40 LEU CD1 C 13 26.7 0.3 . 1 . . . . . . . . 5010 1 504 . 1 1 40 40 LEU CD2 C 13 26.4 0.3 . 1 . . . . . . . . 5010 1 505 . 1 1 40 40 LEU C C 13 180.2 0.3 . 1 . . . . . . . . 5010 1 506 . 1 1 41 41 ARG N N 15 121.8 0.25 . 1 . . . . . . . . 5010 1 507 . 1 1 41 41 ARG H H 1 6.99 0.02 . 1 . . . . . . . . 5010 1 508 . 1 1 41 41 ARG CA C 13 59.0 0.3 . 1 . . . . . . . . 5010 1 509 . 1 1 41 41 ARG HA H 1 4.02 0.02 . 1 . . . . . . . . 5010 1 510 . 1 1 41 41 ARG CB C 13 29.3 0.3 . 1 . . . . . . . . 5010 1 511 . 1 1 41 41 ARG HB2 H 1 1.65 0.02 . 2 . . . . . . . . 5010 1 512 . 1 1 41 41 ARG CG C 13 29.3 0.3 . 1 . . . . . . . . 5010 1 513 . 1 1 41 41 ARG HG2 H 1 1.83 0.02 . 2 . . . . . . . . 5010 1 514 . 1 1 41 41 ARG CD C 13 41.5 0.3 . 1 . . . . . . . . 5010 1 515 . 1 1 41 41 ARG HD2 H 1 3.01 0.02 . 2 . . . . . . . . 5010 1 516 . 1 1 41 41 ARG NE N 15 113.3 0.25 . 1 . . . . . . . . 5010 1 517 . 1 1 41 41 ARG HE H 1 7.24 0.02 . 1 . . . . . . . . 5010 1 518 . 1 1 41 41 ARG C C 13 177.2 0.3 . 1 . . . . . . . . 5010 1 519 . 1 1 42 42 ARG N N 15 113.8 0.25 . 1 . . . . . . . . 5010 1 520 . 1 1 42 42 ARG H H 1 7.52 0.02 . 1 . . . . . . . . 5010 1 521 . 1 1 42 42 ARG CA C 13 57.3 0.3 . 1 . . . . . . . . 5010 1 522 . 1 1 42 42 ARG HA H 1 3.65 0.02 . 1 . . . . . . . . 5010 1 523 . 1 1 42 42 ARG CB C 13 30.5 0.3 . 1 . . . . . . . . 5010 1 524 . 1 1 42 42 ARG HB2 H 1 1.92 0.02 . 2 . . . . . . . . 5010 1 525 . 1 1 42 42 ARG CG C 13 28.8 0.3 . 1 . . . . . . . . 5010 1 526 . 1 1 42 42 ARG HG2 H 1 1.75 0.02 . 2 . . . . . . . . 5010 1 527 . 1 1 42 42 ARG CD C 13 43.9 0.3 . 1 . . . . . . . . 5010 1 528 . 1 1 42 42 ARG HD2 H 1 3.28 0.02 . 2 . . . . . . . . 5010 1 529 . 1 1 42 42 ARG NE N 15 113.3 0.25 . 1 . . . . . . . . 5010 1 530 . 1 1 42 42 ARG HE H 1 7.87 0.02 . 1 . . . . . . . . 5010 1 531 . 1 1 42 42 ARG C C 13 172.9 0.3 . 1 . . . . . . . . 5010 1 532 . 1 1 43 43 GLU N N 15 112.9 0.25 . 1 . . . . . . . . 5010 1 533 . 1 1 43 43 GLU H H 1 7.70 0.02 . 1 . . . . . . . . 5010 1 534 . 1 1 43 43 GLU CA C 13 57.1 0.3 . 1 . . . . . . . . 5010 1 535 . 1 1 43 43 GLU HA H 1 3.69 0.02 . 1 . . . . . . . . 5010 1 536 . 1 1 43 43 GLU CB C 13 26.4 0.3 . 1 . . . . . . . . 5010 1 537 . 1 1 43 43 GLU HB2 H 1 2.15 0.02 . 2 . . . . . . . . 5010 1 538 . 1 1 43 43 GLU CG C 13 36.7 0.3 . 1 . . . . . . . . 5010 1 539 . 1 1 43 43 GLU HG2 H 1 2.25 0.02 . 2 . . . . . . . . 5010 1 540 . 1 1 43 43 GLU C C 13 176.0 0.3 . 1 . . . . . . . . 5010 1 541 . 1 1 44 44 GLU N N 15 119.2 0.25 . 1 . . . . . . . . 5010 1 542 . 1 1 44 44 GLU H H 1 7.41 0.02 . 1 . . . . . . . . 5010 1 543 . 1 1 44 44 GLU CA C 13 57.4 0.3 . 1 . . . . . . . . 5010 1 544 . 1 1 44 44 GLU HA H 1 4.19 0.02 . 1 . . . . . . . . 5010 1 545 . 1 1 44 44 GLU CB C 13 29.5 0.3 . 1 . . . . . . . . 5010 1 546 . 1 1 44 44 GLU HB2 H 1 2.21 0.02 . 2 . . . . . . . . 5010 1 547 . 1 1 44 44 GLU CG C 13 37.6 0.3 . 1 . . . . . . . . 5010 1 548 . 1 1 44 44 GLU HG2 H 1 2.45 0.02 . 2 . . . . . . . . 5010 1 549 . 1 1 44 44 GLU C C 13 177.3 0.3 . 1 . . . . . . . . 5010 1 550 . 1 1 45 45 LYS N N 15 116.9 0.25 . 1 . . . . . . . . 5010 1 551 . 1 1 45 45 LYS H H 1 8.09 0.02 . 1 . . . . . . . . 5010 1 552 . 1 1 45 45 LYS CA C 13 59.7 0.3 . 1 . . . . . . . . 5010 1 553 . 1 1 45 45 LYS HA H 1 3.94 0.02 . 1 . . . . . . . . 5010 1 554 . 1 1 45 45 LYS CB C 13 33.2 0.3 . 1 . . . . . . . . 5010 1 555 . 1 1 45 45 LYS HB2 H 1 1.95 0.02 . 2 . . . . . . . . 5010 1 556 . 1 1 45 45 LYS HB3 H 1 1.71 0.02 . 2 . . . . . . . . 5010 1 557 . 1 1 45 45 LYS CG C 13 25.6 0.3 . 1 . . . . . . . . 5010 1 558 . 1 1 45 45 LYS HG2 H 1 1.60 0.02 . 2 . . . . . . . . 5010 1 559 . 1 1 45 45 LYS HG3 H 1 1.72 0.02 . 2 . . . . . . . . 5010 1 560 . 1 1 45 45 LYS CD C 13 29.1 0.3 . 1 . . . . . . . . 5010 1 561 . 1 1 45 45 LYS HD2 H 1 1.82 0.02 . 2 . . . . . . . . 5010 1 562 . 1 1 45 45 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 5010 1 563 . 1 1 45 45 LYS HE2 H 1 3.09 0.02 . 2 . . . . . . . . 5010 1 564 . 1 1 45 45 LYS C C 13 177.7 0.3 . 1 . . . . . . . . 5010 1 565 . 1 1 46 46 MET N N 15 115.2 0.25 . 1 . . . . . . . . 5010 1 566 . 1 1 46 46 MET H H 1 7.72 0.02 . 1 . . . . . . . . 5010 1 567 . 1 1 46 46 MET CA C 13 52.7 0.3 . 1 . . . . . . . . 5010 1 568 . 1 1 46 46 MET HA H 1 5.19 0.02 . 1 . . . . . . . . 5010 1 569 . 1 1 46 46 MET CB C 13 34.3 0.3 . 1 . . . . . . . . 5010 1 570 . 1 1 46 46 MET HB2 H 1 1.97 0.02 . 2 . . . . . . . . 5010 1 571 . 1 1 46 46 MET HB3 H 1 2.43 0.02 . 2 . . . . . . . . 5010 1 572 . 1 1 46 46 MET CG C 13 32.5 0.3 . 1 . . . . . . . . 5010 1 573 . 1 1 46 46 MET HG2 H 1 2.71 0.02 . 2 . . . . . . . . 5010 1 574 . 1 1 46 46 MET HG3 H 1 2.46 0.02 . 2 . . . . . . . . 5010 1 575 . 1 1 46 46 MET HE1 H 1 2.07 0.02 . 1 . . . . . . . . 5010 1 576 . 1 1 46 46 MET HE2 H 1 2.07 0.02 . 1 . . . . . . . . 5010 1 577 . 1 1 46 46 MET HE3 H 1 2.07 0.02 . 1 . . . . . . . . 5010 1 578 . 1 1 46 46 MET CE C 13 16.6 0.3 . 1 . . . . . . . . 5010 1 579 . 1 1 46 46 MET C C 13 174.6 0.3 . 1 . . . . . . . . 5010 1 580 . 1 1 47 47 LEU N N 15 120.9 0.25 . 1 . . . . . . . . 5010 1 581 . 1 1 47 47 LEU H H 1 9.42 0.02 . 1 . . . . . . . . 5010 1 582 . 1 1 47 47 LEU CA C 13 53.2 0.3 . 1 . . . . . . . . 5010 1 583 . 1 1 47 47 LEU HA H 1 4.68 0.02 . 1 . . . . . . . . 5010 1 584 . 1 1 47 47 LEU CB C 13 43.3 0.3 . 1 . . . . . . . . 5010 1 585 . 1 1 47 47 LEU HB2 H 1 1.64 0.02 . 2 . . . . . . . . 5010 1 586 . 1 1 47 47 LEU HB3 H 1 1.84 0.02 . 2 . . . . . . . . 5010 1 587 . 1 1 47 47 LEU CG C 13 27.2 0.3 . 1 . . . . . . . . 5010 1 588 . 1 1 47 47 LEU HG H 1 1.52 0.02 . 1 . . . . . . . . 5010 1 589 . 1 1 47 47 LEU HD11 H 1 0.82 0.02 . 2 . . . . . . . . 5010 1 590 . 1 1 47 47 LEU HD12 H 1 0.82 0.02 . 2 . . . . . . . . 5010 1 591 . 1 1 47 47 LEU HD13 H 1 0.82 0.02 . 2 . . . . . . . . 5010 1 592 . 1 1 47 47 LEU HD21 H 1 0.88 0.02 . 2 . . . . . . . . 5010 1 593 . 1 1 47 47 LEU HD22 H 1 0.88 0.02 . 2 . . . . . . . . 5010 1 594 . 1 1 47 47 LEU HD23 H 1 0.88 0.02 . 2 . . . . . . . . 5010 1 595 . 1 1 47 47 LEU CD1 C 13 23.7 0.3 . 1 . . . . . . . . 5010 1 596 . 1 1 47 47 LEU CD2 C 13 23.7 0.3 . 1 . . . . . . . . 5010 1 597 . 1 1 47 47 LEU C C 13 176.5 0.3 . 1 . . . . . . . . 5010 1 598 . 1 1 48 48 ASN N N 15 119.3 0.25 . 1 . . . . . . . . 5010 1 599 . 1 1 48 48 ASN H H 1 9.21 0.02 . 1 . . . . . . . . 5010 1 600 . 1 1 48 48 ASN CA C 13 54.3 0.3 . 1 . . . . . . . . 5010 1 601 . 1 1 48 48 ASN HA H 1 4.96 0.02 . 1 . . . . . . . . 5010 1 602 . 1 1 48 48 ASN CB C 13 40.4 0.3 . 1 . . . . . . . . 5010 1 603 . 1 1 48 48 ASN HB2 H 1 2.90 0.02 . 2 . . . . . . . . 5010 1 604 . 1 1 48 48 ASN HB3 H 1 2.71 0.02 . 2 . . . . . . . . 5010 1 605 . 1 1 48 48 ASN ND2 N 15 112.6 0.25 . 1 . . . . . . . . 5010 1 606 . 1 1 48 48 ASN HD21 H 1 6.92 0.02 . 2 . . . . . . . . 5010 1 607 . 1 1 48 48 ASN HD22 H 1 7.55 0.02 . 2 . . . . . . . . 5010 1 608 . 1 1 48 48 ASN C C 13 174.6 0.3 . 1 . . . . . . . . 5010 1 609 . 1 1 49 49 ASP N N 15 116.3 0.25 . 1 . . . . . . . . 5010 1 610 . 1 1 49 49 ASP H H 1 7.88 0.02 . 1 . . . . . . . . 5010 1 611 . 1 1 49 49 ASP CA C 13 52.4 0.3 . 1 . . . . . . . . 5010 1 612 . 1 1 49 49 ASP HA H 1 4.81 0.02 . 1 . . . . . . . . 5010 1 613 . 1 1 49 49 ASP CB C 13 42.5 0.3 . 1 . . . . . . . . 5010 1 614 . 1 1 49 49 ASP HB2 H 1 2.74 0.02 . 2 . . . . . . . . 5010 1 615 . 1 1 49 49 ASP HB3 H 1 2.70 0.02 . 2 . . . . . . . . 5010 1 616 . 1 1 49 49 ASP C C 13 173.2 0.3 . 1 . . . . . . . . 5010 1 617 . 1 1 50 50 VAL N N 15 118.9 0.25 . 1 . . . . . . . . 5010 1 618 . 1 1 50 50 VAL H H 1 8.28 0.02 . 1 . . . . . . . . 5010 1 619 . 1 1 50 50 VAL CA C 13 62.2 0.3 . 1 . . . . . . . . 5010 1 620 . 1 1 50 50 VAL HA H 1 4.11 0.02 . 1 . . . . . . . . 5010 1 621 . 1 1 50 50 VAL CB C 13 32.7 0.3 . 1 . . . . . . . . 5010 1 622 . 1 1 50 50 VAL HB H 1 2.00 0.02 . 1 . . . . . . . . 5010 1 623 . 1 1 50 50 VAL HG11 H 1 0.66 0.02 . 2 . . . . . . . . 5010 1 624 . 1 1 50 50 VAL HG12 H 1 0.66 0.02 . 2 . . . . . . . . 5010 1 625 . 1 1 50 50 VAL HG13 H 1 0.66 0.02 . 2 . . . . . . . . 5010 1 626 . 1 1 50 50 VAL HG21 H 1 0.77 0.02 . 2 . . . . . . . . 5010 1 627 . 1 1 50 50 VAL HG22 H 1 0.77 0.02 . 2 . . . . . . . . 5010 1 628 . 1 1 50 50 VAL HG23 H 1 0.77 0.02 . 2 . . . . . . . . 5010 1 629 . 1 1 50 50 VAL CG1 C 13 21.8 0.3 . 1 . . . . . . . . 5010 1 630 . 1 1 50 50 VAL CG2 C 13 21.5 0.3 . 1 . . . . . . . . 5010 1 631 . 1 1 50 50 VAL C C 13 173.2 0.3 . 1 . . . . . . . . 5010 1 632 . 1 1 51 51 ASP N N 15 127.1 0.25 . 1 . . . . . . . . 5010 1 633 . 1 1 51 51 ASP H H 1 8.17 0.02 . 1 . . . . . . . . 5010 1 634 . 1 1 51 51 ASP CA C 13 52.1 0.3 . 1 . . . . . . . . 5010 1 635 . 1 1 51 51 ASP HA H 1 4.81 0.02 . 1 . . . . . . . . 5010 1 636 . 1 1 51 51 ASP CB C 13 42.8 0.3 . 1 . . . . . . . . 5010 1 637 . 1 1 51 51 ASP HB2 H 1 2.84 0.02 . 2 . . . . . . . . 5010 1 638 . 1 1 51 51 ASP HB3 H 1 2.65 0.02 . 2 . . . . . . . . 5010 1 639 . 1 1 51 51 ASP C C 13 174.5 0.3 . 1 . . . . . . . . 5010 1 640 . 1 1 52 52 LEU N N 15 121.6 0.25 . 1 . . . . . . . . 5010 1 641 . 1 1 52 52 LEU H H 1 8.99 0.02 . 1 . . . . . . . . 5010 1 642 . 1 1 52 52 LEU CA C 13 53.2 0.3 . 1 . . . . . . . . 5010 1 643 . 1 1 52 52 LEU HA H 1 4.96 0.02 . 1 . . . . . . . . 5010 1 644 . 1 1 52 52 LEU CB C 13 45.4 0.3 . 1 . . . . . . . . 5010 1 645 . 1 1 52 52 LEU HB2 H 1 1.12 0.02 . 2 . . . . . . . . 5010 1 646 . 1 1 52 52 LEU CG C 13 25.3 0.3 . 1 . . . . . . . . 5010 1 647 . 1 1 52 52 LEU HG H 1 1.97 0.02 . 1 . . . . . . . . 5010 1 648 . 1 1 52 52 LEU HD11 H 1 0.78 0.02 . 2 . . . . . . . . 5010 1 649 . 1 1 52 52 LEU HD12 H 1 0.78 0.02 . 2 . . . . . . . . 5010 1 650 . 1 1 52 52 LEU HD13 H 1 0.78 0.02 . 2 . . . . . . . . 5010 1 651 . 1 1 52 52 LEU HD21 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 652 . 1 1 52 52 LEU HD22 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 653 . 1 1 52 52 LEU HD23 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 654 . 1 1 52 52 LEU CD1 C 13 24.0 0.3 . 1 . . . . . . . . 5010 1 655 . 1 1 52 52 LEU CD2 C 13 25.1 0.3 . 1 . . . . . . . . 5010 1 656 . 1 1 52 52 LEU C C 13 173.3 0.3 . 1 . . . . . . . . 5010 1 657 . 1 1 53 53 LEU N N 15 123.9 0.25 . 1 . . . . . . . . 5010 1 658 . 1 1 53 53 LEU H H 1 9.24 0.02 . 1 . . . . . . . . 5010 1 659 . 1 1 53 53 LEU HA H 1 4.80 0.02 . 1 . . . . . . . . 5010 1 660 . 1 1 53 53 LEU HD11 H 1 0.73 0.02 . 2 . . . . . . . . 5010 1 661 . 1 1 53 53 LEU HD12 H 1 0.73 0.02 . 2 . . . . . . . . 5010 1 662 . 1 1 53 53 LEU HD13 H 1 0.73 0.02 . 2 . . . . . . . . 5010 1 663 . 1 1 53 53 LEU C C 13 177.1 0.3 . 1 . . . . . . . . 5010 1 664 . 1 1 54 54 ILE N N 15 127.4 0.25 . 1 . . . . . . . . 5010 1 665 . 1 1 54 54 ILE H H 1 9.40 0.02 . 1 . . . . . . . . 5010 1 666 . 1 1 54 54 ILE HA H 1 4.89 0.02 . 1 . . . . . . . . 5010 1 667 . 1 1 54 54 ILE HB H 1 1.77 0.02 . 1 . . . . . . . . 5010 1 668 . 1 1 54 54 ILE HG12 H 1 1.46 0.02 . 2 . . . . . . . . 5010 1 669 . 1 1 54 54 ILE HG13 H 1 1.09 0.02 . 2 . . . . . . . . 5010 1 670 . 1 1 54 54 ILE HD11 H 1 0.70 0.02 . 1 . . . . . . . . 5010 1 671 . 1 1 54 54 ILE HD12 H 1 0.70 0.02 . 1 . . . . . . . . 5010 1 672 . 1 1 54 54 ILE HD13 H 1 0.70 0.02 . 1 . . . . . . . . 5010 1 673 . 1 1 54 54 ILE CD1 C 13 14.1 0.3 . 1 . . . . . . . . 5010 1 674 . 1 1 54 54 ILE C C 13 177.8 0.3 . 1 . . . . . . . . 5010 1 675 . 1 1 55 55 ILE N N 15 119.5 0.25 . 1 . . . . . . . . 5010 1 676 . 1 1 55 55 ILE H H 1 7.63 0.02 . 1 . . . . . . . . 5010 1 677 . 1 1 55 55 ILE CA C 13 54.7 0.3 . 1 . . . . . . . . 5010 1 678 . 1 1 55 55 ILE HA H 1 3.94 0.02 . 1 . . . . . . . . 5010 1 679 . 1 1 55 55 ILE CB C 13 39.8 0.3 . 1 . . . . . . . . 5010 1 680 . 1 1 55 55 ILE HB H 1 1.77 0.02 . 1 . . . . . . . . 5010 1 681 . 1 1 55 55 ILE HG21 H 1 0.80 0.02 . 1 . . . . . . . . 5010 1 682 . 1 1 55 55 ILE HG22 H 1 0.80 0.02 . 1 . . . . . . . . 5010 1 683 . 1 1 55 55 ILE HG23 H 1 0.80 0.02 . 1 . . . . . . . . 5010 1 684 . 1 1 55 55 ILE CG2 C 13 17.7 0.3 . 1 . . . . . . . . 5010 1 685 . 1 1 55 55 ILE HG12 H 1 1.40 0.02 . 2 . . . . . . . . 5010 1 686 . 1 1 55 55 ILE HG13 H 1 1.60 0.02 . 2 . . . . . . . . 5010 1 687 . 1 1 55 55 ILE HD11 H 1 0.71 0.02 . 1 . . . . . . . . 5010 1 688 . 1 1 55 55 ILE HD12 H 1 0.71 0.02 . 1 . . . . . . . . 5010 1 689 . 1 1 55 55 ILE HD13 H 1 0.71 0.02 . 1 . . . . . . . . 5010 1 690 . 1 1 55 55 ILE C C 13 175.8 0.3 . 1 . . . . . . . . 5010 1 691 . 1 1 56 56 VAL N N 15 129.5 0.25 . 1 . . . . . . . . 5010 1 692 . 1 1 56 56 VAL H H 1 9.12 0.02 . 1 . . . . . . . . 5010 1 693 . 1 1 56 56 VAL CA C 13 59.2 0.3 . 1 . . . . . . . . 5010 1 694 . 1 1 56 56 VAL HA H 1 4.43 0.02 . 1 . . . . . . . . 5010 1 695 . 1 1 56 56 VAL CB C 13 33.5 0.3 . 1 . . . . . . . . 5010 1 696 . 1 1 56 56 VAL HB H 1 1.97 0.02 . 1 . . . . . . . . 5010 1 697 . 1 1 56 56 VAL HG11 H 1 0.89 0.02 . 2 . . . . . . . . 5010 1 698 . 1 1 56 56 VAL HG12 H 1 0.89 0.02 . 2 . . . . . . . . 5010 1 699 . 1 1 56 56 VAL HG13 H 1 0.89 0.02 . 2 . . . . . . . . 5010 1 700 . 1 1 56 56 VAL CG1 C 13 22.0 0.3 . 1 . . . . . . . . 5010 1 701 . 1 1 57 57 PRO CD C 13 51.6 0.3 . 1 . . . . . . . . 5010 1 702 . 1 1 57 57 PRO CA C 13 65.0 0.3 . 1 . . . . . . . . 5010 1 703 . 1 1 57 57 PRO HA H 1 4.46 0.02 . 1 . . . . . . . . 5010 1 704 . 1 1 57 57 PRO CB C 13 33.2 0.3 . 1 . . . . . . . . 5010 1 705 . 1 1 57 57 PRO HB2 H 1 2.48 0.02 . 2 . . . . . . . . 5010 1 706 . 1 1 57 57 PRO HB3 H 1 2.17 0.02 . 2 . . . . . . . . 5010 1 707 . 1 1 57 57 PRO CG C 13 27.5 0.3 . 1 . . . . . . . . 5010 1 708 . 1 1 57 57 PRO HG2 H 1 2.13 0.02 . 1 . . . . . . . . 5010 1 709 . 1 1 57 57 PRO HG3 H 1 2.13 0.02 . 1 . . . . . . . . 5010 1 710 . 1 1 57 57 PRO HD2 H 1 3.96 0.02 . 2 . . . . . . . . 5010 1 711 . 1 1 57 57 PRO HD3 H 1 4.08 0.02 . 2 . . . . . . . . 5010 1 712 . 1 1 57 57 PRO C C 13 176.4 0.3 . 1 . . . . . . . . 5010 1 713 . 1 1 58 58 GLU N N 15 114.3 0.25 . 1 . . . . . . . . 5010 1 714 . 1 1 58 58 GLU H H 1 6.83 0.02 . 1 . . . . . . . . 5010 1 715 . 1 1 58 58 GLU CA C 13 54.6 0.3 . 1 . . . . . . . . 5010 1 716 . 1 1 58 58 GLU HA H 1 4.83 0.02 . 1 . . . . . . . . 5010 1 717 . 1 1 58 58 GLU CB C 13 32.4 0.3 . 1 . . . . . . . . 5010 1 718 . 1 1 58 58 GLU HB2 H 1 1.97 0.02 . 2 . . . . . . . . 5010 1 719 . 1 1 58 58 GLU HB3 H 1 2.19 0.02 . 2 . . . . . . . . 5010 1 720 . 1 1 58 58 GLU CG C 13 36.0 0.3 . 1 . . . . . . . . 5010 1 721 . 1 1 58 58 GLU HG2 H 1 2.33 0.02 . 2 . . . . . . . . 5010 1 722 . 1 1 58 58 GLU HG3 H 1 2.20 0.02 . 2 . . . . . . . . 5010 1 723 . 1 1 58 58 GLU C C 13 176.0 0.3 . 1 . . . . . . . . 5010 1 724 . 1 1 59 59 LYS N N 15 126.7 0.25 . 1 . . . . . . . . 5010 1 725 . 1 1 59 59 LYS H H 1 9.01 0.02 . 1 . . . . . . . . 5010 1 726 . 1 1 59 59 LYS CA C 13 60.3 0.3 . 1 . . . . . . . . 5010 1 727 . 1 1 59 59 LYS HA H 1 3.93 0.02 . 1 . . . . . . . . 5010 1 728 . 1 1 59 59 LYS CB C 13 32.4 0.3 . 1 . . . . . . . . 5010 1 729 . 1 1 59 59 LYS HB2 H 1 1.97 0.02 . 2 . . . . . . . . 5010 1 730 . 1 1 59 59 LYS HB3 H 1 2.04 0.02 . 2 . . . . . . . . 5010 1 731 . 1 1 59 59 LYS CG C 13 25.0 0.3 . 1 . . . . . . . . 5010 1 732 . 1 1 59 59 LYS HG2 H 1 1.56 0.02 . 2 . . . . . . . . 5010 1 733 . 1 1 59 59 LYS CD C 13 29.5 0.3 . 1 . . . . . . . . 5010 1 734 . 1 1 59 59 LYS HD2 H 1 1.80 0.02 . 2 . . . . . . . . 5010 1 735 . 1 1 59 59 LYS CE C 13 42.0 0.3 . 1 . . . . . . . . 5010 1 736 . 1 1 59 59 LYS HE2 H 1 3.07 0.02 . 2 . . . . . . . . 5010 1 737 . 1 1 59 59 LYS C C 13 179.1 0.3 . 1 . . . . . . . . 5010 1 738 . 1 1 60 60 LYS N N 15 117.9 0.25 . 1 . . . . . . . . 5010 1 739 . 1 1 60 60 LYS H H 1 9.04 0.02 . 1 . . . . . . . . 5010 1 740 . 1 1 60 60 LYS CA C 13 58.6 0.3 . 1 . . . . . . . . 5010 1 741 . 1 1 60 60 LYS HA H 1 4.31 0.02 . 1 . . . . . . . . 5010 1 742 . 1 1 60 60 LYS CB C 13 32.2 0.3 . 1 . . . . . . . . 5010 1 743 . 1 1 60 60 LYS HB2 H 1 1.95 0.02 . 2 . . . . . . . . 5010 1 744 . 1 1 60 60 LYS CG C 13 24.6 0.3 . 1 . . . . . . . . 5010 1 745 . 1 1 60 60 LYS HG2 H 1 1.49 0.02 . 2 . . . . . . . . 5010 1 746 . 1 1 60 60 LYS CD C 13 31.6 0.3 . 1 . . . . . . . . 5010 1 747 . 1 1 60 60 LYS HD2 H 1 1.98 0.02 . 2 . . . . . . . . 5010 1 748 . 1 1 60 60 LYS CE C 13 42.4 0.3 . 1 . . . . . . . . 5010 1 749 . 1 1 60 60 LYS HE2 H 1 3.03 0.02 . 2 . . . . . . . . 5010 1 750 . 1 1 60 60 LYS C C 13 177.1 0.3 . 1 . . . . . . . . 5010 1 751 . 1 1 61 61 LEU N N 15 115.5 0.25 . 1 . . . . . . . . 5010 1 752 . 1 1 61 61 LEU H H 1 7.43 0.02 . 1 . . . . . . . . 5010 1 753 . 1 1 61 61 LEU CA C 13 55.4 0.3 . 1 . . . . . . . . 5010 1 754 . 1 1 61 61 LEU HA H 1 4.27 0.02 . 1 . . . . . . . . 5010 1 755 . 1 1 61 61 LEU CB C 13 42.1 0.3 . 1 . . . . . . . . 5010 1 756 . 1 1 61 61 LEU HB2 H 1 1.75 0.02 . 2 . . . . . . . . 5010 1 757 . 1 1 61 61 LEU HB3 H 1 1.37 0.02 . 2 . . . . . . . . 5010 1 758 . 1 1 61 61 LEU CG C 13 27.0 0.3 . 1 . . . . . . . . 5010 1 759 . 1 1 61 61 LEU HG H 1 1.48 0.02 . 1 . . . . . . . . 5010 1 760 . 1 1 61 61 LEU HD11 H 1 0.99 0.02 . 2 . . . . . . . . 5010 1 761 . 1 1 61 61 LEU HD12 H 1 0.99 0.02 . 2 . . . . . . . . 5010 1 762 . 1 1 61 61 LEU HD13 H 1 0.99 0.02 . 2 . . . . . . . . 5010 1 763 . 1 1 61 61 LEU HD21 H 1 0.46 0.02 . 2 . . . . . . . . 5010 1 764 . 1 1 61 61 LEU HD22 H 1 0.46 0.02 . 2 . . . . . . . . 5010 1 765 . 1 1 61 61 LEU HD23 H 1 0.46 0.02 . 2 . . . . . . . . 5010 1 766 . 1 1 61 61 LEU CD1 C 13 25.6 0.3 . 1 . . . . . . . . 5010 1 767 . 1 1 61 61 LEU CD2 C 13 21.8 0.3 . 1 . . . . . . . . 5010 1 768 . 1 1 61 61 LEU C C 13 178.6 0.3 . 1 . . . . . . . . 5010 1 769 . 1 1 62 62 LEU N N 15 119.6 0.25 . 1 . . . . . . . . 5010 1 770 . 1 1 62 62 LEU H H 1 7.47 0.02 . 1 . . . . . . . . 5010 1 771 . 1 1 62 62 LEU CA C 13 59.2 0.3 . 1 . . . . . . . . 5010 1 772 . 1 1 62 62 LEU HA H 1 3.88 0.02 . 1 . . . . . . . . 5010 1 773 . 1 1 62 62 LEU CB C 13 41.9 0.3 . 1 . . . . . . . . 5010 1 774 . 1 1 62 62 LEU HB2 H 1 1.70 0.02 . 2 . . . . . . . . 5010 1 775 . 1 1 62 62 LEU HB3 H 1 1.87 0.02 . 2 . . . . . . . . 5010 1 776 . 1 1 62 62 LEU CG C 13 27.0 0.3 . 1 . . . . . . . . 5010 1 777 . 1 1 62 62 LEU HG H 1 1.64 0.02 . 1 . . . . . . . . 5010 1 778 . 1 1 62 62 LEU HD11 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 779 . 1 1 62 62 LEU HD12 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 780 . 1 1 62 62 LEU HD13 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 781 . 1 1 62 62 LEU CD1 C 13 24.2 0.3 . 1 . . . . . . . . 5010 1 782 . 1 1 62 62 LEU C C 13 178.0 0.3 . 1 . . . . . . . . 5010 1 783 . 1 1 63 63 LYS N N 15 114.0 0.25 . 1 . . . . . . . . 5010 1 784 . 1 1 63 63 LYS H H 1 8.15 0.02 . 1 . . . . . . . . 5010 1 785 . 1 1 63 63 LYS CA C 13 58.1 0.3 . 1 . . . . . . . . 5010 1 786 . 1 1 63 63 LYS HA H 1 4.01 0.02 . 1 . . . . . . . . 5010 1 787 . 1 1 63 63 LYS CB C 13 31.6 0.3 . 1 . . . . . . . . 5010 1 788 . 1 1 63 63 LYS HB2 H 1 1.60 0.02 . 2 . . . . . . . . 5010 1 789 . 1 1 63 63 LYS HB3 H 1 1.55 0.02 . 2 . . . . . . . . 5010 1 790 . 1 1 63 63 LYS CG C 13 23.7 0.3 . 1 . . . . . . . . 5010 1 791 . 1 1 63 63 LYS HG2 H 1 1.20 0.02 . 2 . . . . . . . . 5010 1 792 . 1 1 63 63 LYS HG3 H 1 0.79 0.02 . 2 . . . . . . . . 5010 1 793 . 1 1 63 63 LYS CD C 13 28.9 0.3 . 1 . . . . . . . . 5010 1 794 . 1 1 63 63 LYS HD2 H 1 1.64 0.02 . 2 . . . . . . . . 5010 1 795 . 1 1 63 63 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 5010 1 796 . 1 1 63 63 LYS HE2 H 1 3.01 0.02 . 2 . . . . . . . . 5010 1 797 . 1 1 63 63 LYS C C 13 175.4 0.3 . 1 . . . . . . . . 5010 1 798 . 1 1 64 64 HIS N N 15 114.7 0.25 . 1 . . . . . . . . 5010 1 799 . 1 1 64 64 HIS H H 1 7.69 0.02 . 1 . . . . . . . . 5010 1 800 . 1 1 64 64 HIS CA C 13 56.2 0.3 . 1 . . . . . . . . 5010 1 801 . 1 1 64 64 HIS HA H 1 4.59 0.02 . 1 . . . . . . . . 5010 1 802 . 1 1 64 64 HIS CB C 13 33.3 0.3 . 1 . . . . . . . . 5010 1 803 . 1 1 64 64 HIS HB2 H 1 3.50 0.02 . 2 . . . . . . . . 5010 1 804 . 1 1 64 64 HIS HB3 H 1 2.94 0.02 . 2 . . . . . . . . 5010 1 805 . 1 1 64 64 HIS C C 13 176.4 0.3 . 1 . . . . . . . . 5010 1 806 . 1 1 65 65 VAL N N 15 118.4 0.25 . 1 . . . . . . . . 5010 1 807 . 1 1 65 65 VAL H H 1 6.92 0.02 . 1 . . . . . . . . 5010 1 808 . 1 1 65 65 VAL CA C 13 66.6 0.3 . 1 . . . . . . . . 5010 1 809 . 1 1 65 65 VAL HA H 1 3.02 0.02 . 1 . . . . . . . . 5010 1 810 . 1 1 65 65 VAL CB C 13 30.7 0.3 . 1 . . . . . . . . 5010 1 811 . 1 1 65 65 VAL HB H 1 1.82 0.02 . 1 . . . . . . . . 5010 1 812 . 1 1 65 65 VAL HG11 H 1 0.00 0.02 . 2 . . . . . . . . 5010 1 813 . 1 1 65 65 VAL HG12 H 1 0.00 0.02 . 2 . . . . . . . . 5010 1 814 . 1 1 65 65 VAL HG13 H 1 0.00 0.02 . 2 . . . . . . . . 5010 1 815 . 1 1 65 65 VAL HG21 H 1 0.40 0.02 . 2 . . . . . . . . 5010 1 816 . 1 1 65 65 VAL HG22 H 1 0.40 0.02 . 2 . . . . . . . . 5010 1 817 . 1 1 65 65 VAL HG23 H 1 0.40 0.02 . 2 . . . . . . . . 5010 1 818 . 1 1 65 65 VAL CG1 C 13 21.0 0.3 . 1 . . . . . . . . 5010 1 819 . 1 1 65 65 VAL CG2 C 13 20.4 0.3 . 1 . . . . . . . . 5010 1 820 . 1 1 67 67 PRO CA C 13 65.5 0.3 . 1 . . . . . . . . 5010 1 821 . 1 1 67 67 PRO HA H 1 4.52 0.02 . 1 . . . . . . . . 5010 1 822 . 1 1 67 67 PRO CB C 13 31.9 0.3 . 1 . . . . . . . . 5010 1 823 . 1 1 67 67 PRO HB2 H 1 2.47 0.02 . 2 . . . . . . . . 5010 1 824 . 1 1 67 67 PRO HB3 H 1 1.72 0.02 . 2 . . . . . . . . 5010 1 825 . 1 1 67 67 PRO CG C 13 28.3 0.3 . 1 . . . . . . . . 5010 1 826 . 1 1 67 67 PRO HG2 H 1 2.13 0.02 . 2 . . . . . . . . 5010 1 827 . 1 1 67 67 PRO HD2 H 1 3.77 0.02 . 2 . . . . . . . . 5010 1 828 . 1 1 67 67 PRO HD3 H 1 4.00 0.02 . 2 . . . . . . . . 5010 1 829 . 1 1 67 67 PRO C C 13 176.6 0.3 . 1 . . . . . . . . 5010 1 830 . 1 1 68 68 ASN N N 15 111.7 0.25 . 1 . . . . . . . . 5010 1 831 . 1 1 68 68 ASN H H 1 7.12 0.02 . 1 . . . . . . . . 5010 1 832 . 1 1 68 68 ASN CA C 13 51.4 0.3 . 1 . . . . . . . . 5010 1 833 . 1 1 68 68 ASN HA H 1 5.36 0.02 . 1 . . . . . . . . 5010 1 834 . 1 1 68 68 ASN CB C 13 41.0 0.3 . 1 . . . . . . . . 5010 1 835 . 1 1 68 68 ASN HB2 H 1 3.47 0.02 . 2 . . . . . . . . 5010 1 836 . 1 1 68 68 ASN C C 13 175.0 0.3 . 1 . . . . . . . . 5010 1 837 . 1 1 69 69 ILE N N 15 123.0 0.25 . 1 . . . . . . . . 5010 1 838 . 1 1 69 69 ILE H H 1 7.27 0.02 . 1 . . . . . . . . 5010 1 839 . 1 1 69 69 ILE CA C 13 60.3 0.3 . 1 . . . . . . . . 5010 1 840 . 1 1 69 69 ILE HA H 1 4.66 0.02 . 1 . . . . . . . . 5010 1 841 . 1 1 69 69 ILE CB C 13 39.5 0.3 . 1 . . . . . . . . 5010 1 842 . 1 1 69 69 ILE HB H 1 2.34 0.02 . 1 . . . . . . . . 5010 1 843 . 1 1 69 69 ILE HG21 H 1 0.88 0.02 . 1 . . . . . . . . 5010 1 844 . 1 1 69 69 ILE HG22 H 1 0.88 0.02 . 1 . . . . . . . . 5010 1 845 . 1 1 69 69 ILE HG23 H 1 0.88 0.02 . 1 . . . . . . . . 5010 1 846 . 1 1 69 69 ILE CG2 C 13 19.0 0.3 . 1 . . . . . . . . 5010 1 847 . 1 1 69 69 ILE CG1 C 13 27.2 0.3 . 1 . . . . . . . . 5010 1 848 . 1 1 69 69 ILE HG12 H 1 1.52 0.02 . 2 . . . . . . . . 5010 1 849 . 1 1 69 69 ILE HG13 H 1 0.91 0.02 . 2 . . . . . . . . 5010 1 850 . 1 1 69 69 ILE HD11 H 1 0.85 0.02 . 1 . . . . . . . . 5010 1 851 . 1 1 69 69 ILE HD12 H 1 0.85 0.02 . 1 . . . . . . . . 5010 1 852 . 1 1 69 69 ILE HD13 H 1 0.85 0.02 . 1 . . . . . . . . 5010 1 853 . 1 1 69 69 ILE CD1 C 13 14.1 0.3 . 1 . . . . . . . . 5010 1 854 . 1 1 70 70 ARG H H 1 9.02 0.02 . 1 . . . . . . . . 5010 1 855 . 1 1 70 70 ARG C C 13 174.6 0.3 . 1 . . . . . . . . 5010 1 856 . 1 1 71 71 ILE N N 15 119.5 0.25 . 1 . . . . . . . . 5010 1 857 . 1 1 71 71 ILE H H 1 7.66 0.02 . 1 . . . . . . . . 5010 1 858 . 1 1 71 71 ILE CA C 13 60.3 0.3 . 1 . . . . . . . . 5010 1 859 . 1 1 71 71 ILE HA H 1 4.72 0.02 . 1 . . . . . . . . 5010 1 860 . 1 1 71 71 ILE CB C 13 39.1 0.3 . 1 . . . . . . . . 5010 1 861 . 1 1 71 71 ILE HB H 1 1.79 0.02 . 1 . . . . . . . . 5010 1 862 . 1 1 71 71 ILE HG21 H 1 0.76 0.02 . 1 . . . . . . . . 5010 1 863 . 1 1 71 71 ILE HG22 H 1 0.76 0.02 . 1 . . . . . . . . 5010 1 864 . 1 1 71 71 ILE HG23 H 1 0.76 0.02 . 1 . . . . . . . . 5010 1 865 . 1 1 71 71 ILE CG2 C 13 18.8 0.3 . 1 . . . . . . . . 5010 1 866 . 1 1 71 71 ILE CG1 C 13 26.2 0.3 . 1 . . . . . . . . 5010 1 867 . 1 1 71 71 ILE HG12 H 1 0.99 0.02 . 2 . . . . . . . . 5010 1 868 . 1 1 71 71 ILE HG13 H 1 0.68 0.02 . 2 . . . . . . . . 5010 1 869 . 1 1 71 71 ILE HD11 H 1 0.17 0.02 . 1 . . . . . . . . 5010 1 870 . 1 1 71 71 ILE HD12 H 1 0.17 0.02 . 1 . . . . . . . . 5010 1 871 . 1 1 71 71 ILE HD13 H 1 0.17 0.02 . 1 . . . . . . . . 5010 1 872 . 1 1 71 71 ILE CD1 C 13 13.0 0.3 . 1 . . . . . . . . 5010 1 873 . 1 1 71 71 ILE C C 13 175.6 0.3 . 1 . . . . . . . . 5010 1 874 . 1 1 72 72 LYS N N 15 128.3 0.25 . 1 . . . . . . . . 5010 1 875 . 1 1 72 72 LYS H H 1 8.70 0.02 . 1 . . . . . . . . 5010 1 876 . 1 1 72 72 LYS CA C 13 58.1 0.3 . 1 . . . . . . . . 5010 1 877 . 1 1 72 72 LYS HA H 1 4.31 0.02 . 1 . . . . . . . . 5010 1 878 . 1 1 72 72 LYS CB C 13 32.5 0.3 . 1 . . . . . . . . 5010 1 879 . 1 1 72 72 LYS HB2 H 1 1.94 0.02 . 2 . . . . . . . . 5010 1 880 . 1 1 72 72 LYS CG C 13 24.8 0.3 . 1 . . . . . . . . 5010 1 881 . 1 1 72 72 LYS HG2 H 1 1.50 0.02 . 2 . . . . . . . . 5010 1 882 . 1 1 72 72 LYS HG3 H 1 1.33 0.02 . 2 . . . . . . . . 5010 1 883 . 1 1 72 72 LYS CD C 13 29.2 0.3 . 1 . . . . . . . . 5010 1 884 . 1 1 72 72 LYS HD2 H 1 1.78 0.02 . 2 . . . . . . . . 5010 1 885 . 1 1 72 72 LYS CE C 13 42.0 0.3 . 1 . . . . . . . . 5010 1 886 . 1 1 72 72 LYS HE3 H 1 3.04 0.02 . 2 . . . . . . . . 5010 1 887 . 1 1 72 72 LYS C C 13 177.7 0.3 . 1 . . . . . . . . 5010 1 888 . 1 1 73 73 GLY N N 15 113.5 0.25 . 1 . . . . . . . . 5010 1 889 . 1 1 73 73 GLY H H 1 8.92 0.02 . 1 . . . . . . . . 5010 1 890 . 1 1 73 73 GLY CA C 13 46.4 0.3 . 1 . . . . . . . . 5010 1 891 . 1 1 73 73 GLY HA2 H 1 4.28 0.02 . 2 . . . . . . . . 5010 1 892 . 1 1 73 73 GLY HA3 H 1 3.91 0.02 . 2 . . . . . . . . 5010 1 893 . 1 1 73 73 GLY C C 13 173.9 0.3 . 1 . . . . . . . . 5010 1 894 . 1 1 74 74 LEU N N 15 120.0 0.25 . 1 . . . . . . . . 5010 1 895 . 1 1 74 74 LEU H H 1 7.50 0.02 . 1 . . . . . . . . 5010 1 896 . 1 1 74 74 LEU CA C 13 54.1 0.3 . 1 . . . . . . . . 5010 1 897 . 1 1 74 74 LEU HA H 1 5.03 0.02 . 1 . . . . . . . . 5010 1 898 . 1 1 74 74 LEU CB C 13 45.3 0.3 . 1 . . . . . . . . 5010 1 899 . 1 1 74 74 LEU HB2 H 1 1.64 0.02 . 2 . . . . . . . . 5010 1 900 . 1 1 74 74 LEU HB3 H 1 1.94 0.02 . 2 . . . . . . . . 5010 1 901 . 1 1 74 74 LEU CG C 13 27.2 0.3 . 1 . . . . . . . . 5010 1 902 . 1 1 74 74 LEU HG H 1 1.93 0.02 . 1 . . . . . . . . 5010 1 903 . 1 1 74 74 LEU HD11 H 1 1.18 0.02 . 2 . . . . . . . . 5010 1 904 . 1 1 74 74 LEU HD12 H 1 1.18 0.02 . 2 . . . . . . . . 5010 1 905 . 1 1 74 74 LEU HD13 H 1 1.18 0.02 . 2 . . . . . . . . 5010 1 906 . 1 1 74 74 LEU CD1 C 13 25.6 0.3 . 1 . . . . . . . . 5010 1 907 . 1 1 74 74 LEU C C 13 175.9 0.3 . 1 . . . . . . . . 5010 1 908 . 1 1 75 75 SER N N 15 119.5 0.25 . 1 . . . . . . . . 5010 1 909 . 1 1 75 75 SER H H 1 9.05 0.02 . 1 . . . . . . . . 5010 1 910 . 1 1 75 75 SER CA C 13 58.2 0.3 . 1 . . . . . . . . 5010 1 911 . 1 1 75 75 SER HA H 1 4.80 0.02 . 1 . . . . . . . . 5010 1 912 . 1 1 75 75 SER CB C 13 63.9 0.3 . 1 . . . . . . . . 5010 1 913 . 1 1 75 75 SER HB2 H 1 3.98 0.02 . 2 . . . . . . . . 5010 1 914 . 1 1 75 75 SER HB3 H 1 3.91 0.02 . 2 . . . . . . . . 5010 1 915 . 1 1 75 75 SER C C 13 173.2 0.3 . 1 . . . . . . . . 5010 1 916 . 1 1 76 76 PHE N N 15 118.9 0.25 . 1 . . . . . . . . 5010 1 917 . 1 1 76 76 PHE H H 1 8.15 0.02 . 1 . . . . . . . . 5010 1 918 . 1 1 76 76 PHE CA C 13 55.9 0.3 . 1 . . . . . . . . 5010 1 919 . 1 1 76 76 PHE HA H 1 5.82 0.02 . 1 . . . . . . . . 5010 1 920 . 1 1 76 76 PHE CB C 13 42.6 0.3 . 1 . . . . . . . . 5010 1 921 . 1 1 76 76 PHE HB2 H 1 3.02 0.02 . 2 . . . . . . . . 5010 1 922 . 1 1 76 76 PHE HB3 H 1 3.20 0.02 . 2 . . . . . . . . 5010 1 923 . 1 1 76 76 PHE HD1 H 1 7.12 0.02 . 1 . . . . . . . . 5010 1 924 . 1 1 76 76 PHE HD2 H 1 7.12 0.02 . 1 . . . . . . . . 5010 1 925 . 1 1 76 76 PHE HE1 H 1 7.52 0.02 . 1 . . . . . . . . 5010 1 926 . 1 1 76 76 PHE HE2 H 1 7.52 0.02 . 1 . . . . . . . . 5010 1 927 . 1 1 76 76 PHE C C 13 173.6 0.3 . 1 . . . . . . . . 5010 1 928 . 1 1 77 77 SER N N 15 114.6 0.25 . 1 . . . . . . . . 5010 1 929 . 1 1 77 77 SER H H 1 9.01 0.02 . 1 . . . . . . . . 5010 1 930 . 1 1 77 77 SER CA C 13 56.5 0.3 . 1 . . . . . . . . 5010 1 931 . 1 1 77 77 SER HA H 1 4.87 0.02 . 1 . . . . . . . . 5010 1 932 . 1 1 77 77 SER CB C 13 65.8 0.3 . 1 . . . . . . . . 5010 1 933 . 1 1 77 77 SER HB2 H 1 3.91 0.02 . 2 . . . . . . . . 5010 1 934 . 1 1 77 77 SER HB3 H 1 3.93 0.02 . 2 . . . . . . . . 5010 1 935 . 1 1 77 77 SER C C 13 173.4 0.3 . 1 . . . . . . . . 5010 1 936 . 1 1 78 78 VAL N N 15 124.7 0.25 . 1 . . . . . . . . 5010 1 937 . 1 1 78 78 VAL H H 1 9.05 0.02 . 1 . . . . . . . . 5010 1 938 . 1 1 78 78 VAL CA C 13 62.5 0.3 . 1 . . . . . . . . 5010 1 939 . 1 1 78 78 VAL HA H 1 4.39 0.02 . 1 . . . . . . . . 5010 1 940 . 1 1 78 78 VAL CB C 13 33.3 0.3 . 1 . . . . . . . . 5010 1 941 . 1 1 78 78 VAL HB H 1 2.18 0.02 . 1 . . . . . . . . 5010 1 942 . 1 1 78 78 VAL HG11 H 1 0.91 0.02 . 2 . . . . . . . . 5010 1 943 . 1 1 78 78 VAL HG12 H 1 0.91 0.02 . 2 . . . . . . . . 5010 1 944 . 1 1 78 78 VAL HG13 H 1 0.91 0.02 . 2 . . . . . . . . 5010 1 945 . 1 1 78 78 VAL HG21 H 1 1.17 0.02 . 2 . . . . . . . . 5010 1 946 . 1 1 78 78 VAL HG22 H 1 1.17 0.02 . 2 . . . . . . . . 5010 1 947 . 1 1 78 78 VAL HG23 H 1 1.17 0.02 . 2 . . . . . . . . 5010 1 948 . 1 1 78 78 VAL CG1 C 13 21.8 0.3 . 1 . . . . . . . . 5010 1 949 . 1 1 78 78 VAL CG2 C 13 21.2 0.3 . 1 . . . . . . . . 5010 1 950 . 1 1 78 78 VAL C C 13 176.0 0.3 . 1 . . . . . . . . 5010 1 951 . 1 1 79 79 LYS N N 15 129.8 0.25 . 1 . . . . . . . . 5010 1 952 . 1 1 79 79 LYS H H 1 9.18 0.02 . 1 . . . . . . . . 5010 1 953 . 1 1 79 79 LYS CA C 13 57.0 0.3 . 1 . . . . . . . . 5010 1 954 . 1 1 79 79 LYS HA H 1 4.53 0.02 . 1 . . . . . . . . 5010 1 955 . 1 1 79 79 LYS CB C 13 33.0 0.3 . 1 . . . . . . . . 5010 1 956 . 1 1 79 79 LYS HB2 H 1 1.74 0.02 . 2 . . . . . . . . 5010 1 957 . 1 1 79 79 LYS CG C 13 25.1 0.3 . 1 . . . . . . . . 5010 1 958 . 1 1 79 79 LYS HG2 H 1 1.36 0.02 . 2 . . . . . . . . 5010 1 959 . 1 1 79 79 LYS CD C 13 28.6 0.3 . 1 . . . . . . . . 5010 1 960 . 1 1 79 79 LYS HD2 H 1 1.63 0.02 . 2 . . . . . . . . 5010 1 961 . 1 1 79 79 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 5010 1 962 . 1 1 79 79 LYS HE2 H 1 2.89 0.02 . 2 . . . . . . . . 5010 1 963 . 1 1 80 80 VAL CA C 13 61.1 0.3 . 1 . . . . . . . . 5010 1 964 . 1 1 80 80 VAL HA H 1 4.41 0.02 . 1 . . . . . . . . 5010 1 965 . 1 1 80 80 VAL CB C 13 33.0 0.3 . 1 . . . . . . . . 5010 1 966 . 1 1 80 80 VAL HB H 1 2.07 0.02 . 1 . . . . . . . . 5010 1 967 . 1 1 80 80 VAL HG11 H 1 0.96 0.02 . 2 . . . . . . . . 5010 1 968 . 1 1 80 80 VAL HG12 H 1 0.96 0.02 . 2 . . . . . . . . 5010 1 969 . 1 1 80 80 VAL HG13 H 1 0.96 0.02 . 2 . . . . . . . . 5010 1 970 . 1 1 80 80 VAL HG21 H 1 1.01 0.02 . 2 . . . . . . . . 5010 1 971 . 1 1 80 80 VAL HG22 H 1 1.01 0.02 . 2 . . . . . . . . 5010 1 972 . 1 1 80 80 VAL HG23 H 1 1.01 0.02 . 2 . . . . . . . . 5010 1 973 . 1 1 80 80 VAL CG1 C 13 20.4 0.3 . 1 . . . . . . . . 5010 1 974 . 1 1 80 80 VAL C C 13 174.3 0.3 . 1 . . . . . . . . 5010 1 975 . 1 1 81 81 CYS N N 15 126.5 0.25 . 1 . . . . . . . . 5010 1 976 . 1 1 81 81 CYS H H 1 9.03 0.02 . 1 . . . . . . . . 5010 1 977 . 1 1 81 81 CYS HA H 1 4.39 0.02 . 1 . . . . . . . . 5010 1 978 . 1 1 81 81 CYS HB2 H 1 2.14 0.02 . 2 . . . . . . . . 5010 1 979 . 1 1 81 81 CYS HB3 H 1 2.68 0.02 . 2 . . . . . . . . 5010 1 980 . 1 1 81 81 CYS C C 13 172.4 0.3 . 1 . . . . . . . . 5010 1 981 . 1 1 82 82 GLY N N 15 118.2 0.25 . 1 . . . . . . . . 5010 1 982 . 1 1 82 82 GLY H H 1 8.21 0.02 . 1 . . . . . . . . 5010 1 983 . 1 1 82 82 GLY CA C 13 44.5 0.3 . 1 . . . . . . . . 5010 1 984 . 1 1 82 82 GLY HA2 H 1 4.49 0.02 . 2 . . . . . . . . 5010 1 985 . 1 1 82 82 GLY HA3 H 1 4.11 0.02 . 2 . . . . . . . . 5010 1 986 . 1 1 82 82 GLY C C 13 171.7 0.3 . 1 . . . . . . . . 5010 1 987 . 1 1 83 83 GLU N N 15 116.8 0.25 . 1 . . . . . . . . 5010 1 988 . 1 1 83 83 GLU H H 1 8.42 0.02 . 1 . . . . . . . . 5010 1 989 . 1 1 83 83 GLU CA C 13 59.3 0.3 . 1 . . . . . . . . 5010 1 990 . 1 1 83 83 GLU HA H 1 4.08 0.02 . 1 . . . . . . . . 5010 1 991 . 1 1 83 83 GLU CB C 13 30.7 0.3 . 1 . . . . . . . . 5010 1 992 . 1 1 83 83 GLU HB2 H 1 2.07 0.02 . 2 . . . . . . . . 5010 1 993 . 1 1 83 83 GLU HB3 H 1 2.01 0.02 . 2 . . . . . . . . 5010 1 994 . 1 1 83 83 GLU CG C 13 37.4 0.3 . 1 . . . . . . . . 5010 1 995 . 1 1 83 83 GLU HG2 H 1 2.33 0.02 . 2 . . . . . . . . 5010 1 996 . 1 1 83 83 GLU HG3 H 1 2.22 0.02 . 2 . . . . . . . . 5010 1 997 . 1 1 83 83 GLU C C 13 178.8 0.3 . 1 . . . . . . . . 5010 1 998 . 1 1 84 84 ARG N N 15 113.8 0.25 . 1 . . . . . . . . 5010 1 999 . 1 1 84 84 ARG H H 1 8.51 0.02 . 1 . . . . . . . . 5010 1 1000 . 1 1 84 84 ARG CA C 13 54.3 0.3 . 1 . . . . . . . . 5010 1 1001 . 1 1 84 84 ARG HA H 1 4.99 0.02 . 1 . . . . . . . . 5010 1 1002 . 1 1 84 84 ARG CB C 13 33.0 0.3 . 1 . . . . . . . . 5010 1 1003 . 1 1 84 84 ARG HB2 H 1 1.93 0.02 . 2 . . . . . . . . 5010 1 1004 . 1 1 84 84 ARG HB3 H 1 2.07 0.02 . 2 . . . . . . . . 5010 1 1005 . 1 1 84 84 ARG HG2 H 1 1.73 0.02 . 2 . . . . . . . . 5010 1 1006 . 1 1 84 84 ARG HD2 H 1 2.45 0.02 . 2 . . . . . . . . 5010 1 1007 . 1 1 84 84 ARG C C 13 175.8 0.3 . 1 . . . . . . . . 5010 1 1008 . 1 1 85 85 LYS N N 15 118.9 0.25 . 1 . . . . . . . . 5010 1 1009 . 1 1 85 85 LYS H H 1 6.95 0.02 . 1 . . . . . . . . 5010 1 1010 . 1 1 85 85 LYS CA C 13 54.8 0.3 . 1 . . . . . . . . 5010 1 1011 . 1 1 85 85 LYS HA H 1 5.30 0.02 . 1 . . . . . . . . 5010 1 1012 . 1 1 85 85 LYS CB C 13 36.0 0.3 . 1 . . . . . . . . 5010 1 1013 . 1 1 85 85 LYS HB2 H 1 1.91 0.02 . 2 . . . . . . . . 5010 1 1014 . 1 1 85 85 LYS HB3 H 1 1.67 0.02 . 2 . . . . . . . . 5010 1 1015 . 1 1 85 85 LYS CG C 13 25.3 0.3 . 1 . . . . . . . . 5010 1 1016 . 1 1 85 85 LYS HG2 H 1 0.99 0.02 . 2 . . . . . . . . 5010 1 1017 . 1 1 85 85 LYS CD C 13 30.0 0.3 . 1 . . . . . . . . 5010 1 1018 . 1 1 85 85 LYS HD2 H 1 1.67 0.02 . 2 . . . . . . . . 5010 1 1019 . 1 1 85 85 LYS CE C 13 42.0 0.3 . 1 . . . . . . . . 5010 1 1020 . 1 1 85 85 LYS HE2 H 1 2.73 0.02 . 2 . . . . . . . . 5010 1 1021 . 1 1 85 85 LYS C C 13 174.6 0.3 . 1 . . . . . . . . 5010 1 1022 . 1 1 86 86 CYS N N 15 125.6 0.25 . 1 . . . . . . . . 5010 1 1023 . 1 1 86 86 CYS H H 1 9.19 0.02 . 1 . . . . . . . . 5010 1 1024 . 1 1 86 86 CYS CA C 13 56.0 0.3 . 1 . . . . . . . . 5010 1 1025 . 1 1 86 86 CYS HA H 1 5.07 0.02 . 1 . . . . . . . . 5010 1 1026 . 1 1 86 86 CYS CB C 13 31.1 0.3 . 1 . . . . . . . . 5010 1 1027 . 1 1 86 86 CYS HB2 H 1 3.23 0.02 . 2 . . . . . . . . 5010 1 1028 . 1 1 86 86 CYS HB3 H 1 2.74 0.02 . 2 . . . . . . . . 5010 1 1029 . 1 1 86 86 CYS C C 13 171.7 0.3 . 1 . . . . . . . . 5010 1 1030 . 1 1 87 87 VAL N N 15 126.5 0.25 . 1 . . . . . . . . 5010 1 1031 . 1 1 87 87 VAL H H 1 8.79 0.02 . 1 . . . . . . . . 5010 1 1032 . 1 1 87 87 VAL CA C 13 61.7 0.3 . 1 . . . . . . . . 5010 1 1033 . 1 1 87 87 VAL HA H 1 4.88 0.02 . 1 . . . . . . . . 5010 1 1034 . 1 1 87 87 VAL CB C 13 34.3 0.3 . 1 . . . . . . . . 5010 1 1035 . 1 1 87 87 VAL HB H 1 1.89 0.02 . 1 . . . . . . . . 5010 1 1036 . 1 1 87 87 VAL HG11 H 1 0.84 0.02 . 2 . . . . . . . . 5010 1 1037 . 1 1 87 87 VAL HG12 H 1 0.84 0.02 . 2 . . . . . . . . 5010 1 1038 . 1 1 87 87 VAL HG13 H 1 0.84 0.02 . 2 . . . . . . . . 5010 1 1039 . 1 1 87 87 VAL HG21 H 1 0.92 0.02 . 2 . . . . . . . . 5010 1 1040 . 1 1 87 87 VAL HG22 H 1 0.92 0.02 . 2 . . . . . . . . 5010 1 1041 . 1 1 87 87 VAL HG23 H 1 0.92 0.02 . 2 . . . . . . . . 5010 1 1042 . 1 1 87 87 VAL CG1 C 13 21.0 0.3 . 1 . . . . . . . . 5010 1 1043 . 1 1 87 87 VAL CG2 C 13 21.0 0.3 . 1 . . . . . . . . 5010 1 1044 . 1 1 87 87 VAL C C 13 174.4 0.3 . 1 . . . . . . . . 5010 1 1045 . 1 1 88 88 LEU N N 15 127.2 0.25 . 1 . . . . . . . . 5010 1 1046 . 1 1 88 88 LEU H H 1 9.55 0.02 . 1 . . . . . . . . 5010 1 1047 . 1 1 88 88 LEU CA C 13 52.9 0.3 . 1 . . . . . . . . 5010 1 1048 . 1 1 88 88 LEU HA H 1 5.38 0.02 . 1 . . . . . . . . 5010 1 1049 . 1 1 88 88 LEU CB C 13 45.6 0.3 . 1 . . . . . . . . 5010 1 1050 . 1 1 88 88 LEU HB2 H 1 1.80 0.02 . 2 . . . . . . . . 5010 1 1051 . 1 1 88 88 LEU CG C 13 28.6 0.3 . 1 . . . . . . . . 5010 1 1052 . 1 1 88 88 LEU HG H 1 1.71 0.02 . 1 . . . . . . . . 5010 1 1053 . 1 1 88 88 LEU HD11 H 1 0.84 0.02 . 2 . . . . . . . . 5010 1 1054 . 1 1 88 88 LEU HD12 H 1 0.84 0.02 . 2 . . . . . . . . 5010 1 1055 . 1 1 88 88 LEU HD13 H 1 0.84 0.02 . 2 . . . . . . . . 5010 1 1056 . 1 1 88 88 LEU CD1 C 13 26.4 0.3 . 1 . . . . . . . . 5010 1 1057 . 1 1 88 88 LEU C C 13 175.3 0.3 . 1 . . . . . . . . 5010 1 1058 . 1 1 89 89 PHE N N 15 120.0 0.25 . 1 . . . . . . . . 5010 1 1059 . 1 1 89 89 PHE H H 1 9.04 0.02 . 1 . . . . . . . . 5010 1 1060 . 1 1 89 89 PHE CA C 13 55.9 0.3 . 1 . . . . . . . . 5010 1 1061 . 1 1 89 89 PHE HA H 1 5.69 0.02 . 1 . . . . . . . . 5010 1 1062 . 1 1 89 89 PHE CB C 13 39.8 0.3 . 1 . . . . . . . . 5010 1 1063 . 1 1 89 89 PHE HB2 H 1 2.90 0.02 . 2 . . . . . . . . 5010 1 1064 . 1 1 89 89 PHE HB3 H 1 3.07 0.02 . 2 . . . . . . . . 5010 1 1065 . 1 1 89 89 PHE HD1 H 1 7.17 0.02 . 1 . . . . . . . . 5010 1 1066 . 1 1 89 89 PHE HD2 H 1 7.17 0.02 . 1 . . . . . . . . 5010 1 1067 . 1 1 89 89 PHE HE1 H 1 7.37 0.02 . 1 . . . . . . . . 5010 1 1068 . 1 1 89 89 PHE HE2 H 1 7.37 0.02 . 1 . . . . . . . . 5010 1 1069 . 1 1 89 89 PHE HZ H 1 7.32 0.02 . 1 . . . . . . . . 5010 1 1070 . 1 1 89 89 PHE C C 13 177.1 0.3 . 1 . . . . . . . . 5010 1 1071 . 1 1 90 90 ILE N N 15 119.8 0.25 . 1 . . . . . . . . 5010 1 1072 . 1 1 90 90 ILE H H 1 9.40 0.02 . 1 . . . . . . . . 5010 1 1073 . 1 1 90 90 ILE CA C 13 59.2 0.3 . 1 . . . . . . . . 5010 1 1074 . 1 1 90 90 ILE HA H 1 5.18 0.02 . 1 . . . . . . . . 5010 1 1075 . 1 1 90 90 ILE CB C 13 41.4 0.3 . 1 . . . . . . . . 5010 1 1076 . 1 1 90 90 ILE HB H 1 1.93 0.02 . 1 . . . . . . . . 5010 1 1077 . 1 1 90 90 ILE HG21 H 1 0.97 0.02 . 1 . . . . . . . . 5010 1 1078 . 1 1 90 90 ILE HG22 H 1 0.97 0.02 . 1 . . . . . . . . 5010 1 1079 . 1 1 90 90 ILE HG23 H 1 0.97 0.02 . 1 . . . . . . . . 5010 1 1080 . 1 1 90 90 ILE CG2 C 13 18.8 0.3 . 1 . . . . . . . . 5010 1 1081 . 1 1 90 90 ILE CG1 C 13 26.7 0.3 . 1 . . . . . . . . 5010 1 1082 . 1 1 90 90 ILE HG12 H 1 1.24 0.02 . 2 . . . . . . . . 5010 1 1083 . 1 1 90 90 ILE HG13 H 1 1.20 0.02 . 2 . . . . . . . . 5010 1 1084 . 1 1 90 90 ILE HD11 H 1 0.85 0.02 . 1 . . . . . . . . 5010 1 1085 . 1 1 90 90 ILE HD12 H 1 0.85 0.02 . 1 . . . . . . . . 5010 1 1086 . 1 1 90 90 ILE HD13 H 1 0.85 0.02 . 1 . . . . . . . . 5010 1 1087 . 1 1 90 90 ILE CD1 C 13 14.7 0.3 . 1 . . . . . . . . 5010 1 1088 . 1 1 90 90 ILE C C 13 173.8 0.3 . 1 . . . . . . . . 5010 1 1089 . 1 1 91 91 GLU N N 15 123.7 0.25 . 1 . . . . . . . . 5010 1 1090 . 1 1 91 91 GLU H H 1 8.31 0.02 . 1 . . . . . . . . 5010 1 1091 . 1 1 91 91 GLU CA C 13 54.9 0.3 . 1 . . . . . . . . 5010 1 1092 . 1 1 91 91 GLU HA H 1 5.28 0.02 . 1 . . . . . . . . 5010 1 1093 . 1 1 91 91 GLU CB C 13 30.8 0.3 . 1 . . . . . . . . 5010 1 1094 . 1 1 91 91 GLU HB2 H 1 2.11 0.02 . 2 . . . . . . . . 5010 1 1095 . 1 1 91 91 GLU HB3 H 1 2.02 0.02 . 2 . . . . . . . . 5010 1 1096 . 1 1 91 91 GLU CG C 13 36.5 0.3 . 1 . . . . . . . . 5010 1 1097 . 1 1 91 91 GLU HG2 H 1 2.13 0.02 . 2 . . . . . . . . 5010 1 1098 . 1 1 91 91 GLU HG3 H 1 2.04 0.02 . 2 . . . . . . . . 5010 1 1099 . 1 1 91 91 GLU C C 13 175.6 0.3 . 1 . . . . . . . . 5010 1 1100 . 1 1 92 92 TRP N N 15 126.8 0.25 . 1 . . . . . . . . 5010 1 1101 . 1 1 92 92 TRP H H 1 9.37 0.02 . 1 . . . . . . . . 5010 1 1102 . 1 1 92 92 TRP CA C 13 56.2 0.3 . 1 . . . . . . . . 5010 1 1103 . 1 1 92 92 TRP HA H 1 4.94 0.02 . 1 . . . . . . . . 5010 1 1104 . 1 1 92 92 TRP CB C 13 31.6 0.3 . 1 . . . . . . . . 5010 1 1105 . 1 1 92 92 TRP HB2 H 1 3.39 0.02 . 2 . . . . . . . . 5010 1 1106 . 1 1 92 92 TRP HB3 H 1 2.99 0.02 . 2 . . . . . . . . 5010 1 1107 . 1 1 92 92 TRP NE1 N 15 129.3 0.25 . 1 . . . . . . . . 5010 1 1108 . 1 1 92 92 TRP HD1 H 1 7.07 0.02 . 1 . . . . . . . . 5010 1 1109 . 1 1 92 92 TRP HE3 H 1 7.51 0.02 . 1 . . . . . . . . 5010 1 1110 . 1 1 92 92 TRP HE1 H 1 9.81 0.02 . 1 . . . . . . . . 5010 1 1111 . 1 1 92 92 TRP HZ3 H 1 6.52 0.02 . 1 . . . . . . . . 5010 1 1112 . 1 1 92 92 TRP HZ2 H 1 7.12 0.02 . 1 . . . . . . . . 5010 1 1113 . 1 1 92 92 TRP HH2 H 1 6.79 0.02 . 1 . . . . . . . . 5010 1 1114 . 1 1 92 92 TRP C C 13 175.1 0.3 . 1 . . . . . . . . 5010 1 1115 . 1 1 93 93 GLU N N 15 127.4 0.25 . 1 . . . . . . . . 5010 1 1116 . 1 1 93 93 GLU H H 1 8.95 0.02 . 1 . . . . . . . . 5010 1 1117 . 1 1 93 93 GLU CA C 13 57.4 0.3 . 1 . . . . . . . . 5010 1 1118 . 1 1 93 93 GLU HA H 1 3.60 0.02 . 1 . . . . . . . . 5010 1 1119 . 1 1 93 93 GLU CB C 13 26.9 0.3 . 1 . . . . . . . . 5010 1 1120 . 1 1 93 93 GLU HB2 H 1 1.88 0.02 . 2 . . . . . . . . 5010 1 1121 . 1 1 93 93 GLU HB3 H 1 1.70 0.02 . 2 . . . . . . . . 5010 1 1122 . 1 1 93 93 GLU CG C 13 35.4 0.3 . 1 . . . . . . . . 5010 1 1123 . 1 1 93 93 GLU HG2 H 1 1.46 0.02 . 2 . . . . . . . . 5010 1 1124 . 1 1 93 93 GLU HG3 H 1 1.18 0.02 . 2 . . . . . . . . 5010 1 1125 . 1 1 93 93 GLU C C 13 175.7 0.3 . 1 . . . . . . . . 5010 1 1126 . 1 1 94 94 LYS N N 15 108.8 0.25 . 1 . . . . . . . . 5010 1 1127 . 1 1 94 94 LYS H H 1 8.62 0.02 . 1 . . . . . . . . 5010 1 1128 . 1 1 94 94 LYS CA C 13 57.8 0.3 . 1 . . . . . . . . 5010 1 1129 . 1 1 94 94 LYS HA H 1 3.82 0.02 . 1 . . . . . . . . 5010 1 1130 . 1 1 94 94 LYS CB C 13 29.7 0.3 . 1 . . . . . . . . 5010 1 1131 . 1 1 94 94 LYS HB2 H 1 2.06 0.02 . 2 . . . . . . . . 5010 1 1132 . 1 1 94 94 LYS HB3 H 1 2.20 0.02 . 2 . . . . . . . . 5010 1 1133 . 1 1 94 94 LYS CG C 13 25.4 0.3 . 1 . . . . . . . . 5010 1 1134 . 1 1 94 94 LYS HG2 H 1 1.38 0.02 . 2 . . . . . . . . 5010 1 1135 . 1 1 94 94 LYS HG3 H 1 1.39 0.02 . 2 . . . . . . . . 5010 1 1136 . 1 1 94 94 LYS CD C 13 28.9 0.3 . 1 . . . . . . . . 5010 1 1137 . 1 1 94 94 LYS HD2 H 1 1.67 0.02 . 2 . . . . . . . . 5010 1 1138 . 1 1 94 94 LYS HD3 H 1 1.72 0.02 . 2 . . . . . . . . 5010 1 1139 . 1 1 94 94 LYS CE C 13 42.0 0.3 . 1 . . . . . . . . 5010 1 1140 . 1 1 94 94 LYS HE2 H 1 3.02 0.02 . 2 . . . . . . . . 5010 1 1141 . 1 1 94 94 LYS C C 13 175.5 0.3 . 1 . . . . . . . . 5010 1 1142 . 1 1 95 95 LYS N N 15 121.4 0.25 . 1 . . . . . . . . 5010 1 1143 . 1 1 95 95 LYS H H 1 7.91 0.02 . 1 . . . . . . . . 5010 1 1144 . 1 1 95 95 LYS CA C 13 54.9 0.3 . 1 . . . . . . . . 5010 1 1145 . 1 1 95 95 LYS HA H 1 4.67 0.02 . 1 . . . . . . . . 5010 1 1146 . 1 1 95 95 LYS CB C 13 35.4 0.3 . 1 . . . . . . . . 5010 1 1147 . 1 1 95 95 LYS HB2 H 1 1.83 0.02 . 2 . . . . . . . . 5010 1 1148 . 1 1 95 95 LYS HB3 H 1 1.58 0.02 . 2 . . . . . . . . 5010 1 1149 . 1 1 95 95 LYS CG C 13 25.3 0.3 . 1 . . . . . . . . 5010 1 1150 . 1 1 95 95 LYS HG2 H 1 1.57 0.02 . 2 . . . . . . . . 5010 1 1151 . 1 1 95 95 LYS HG3 H 1 1.41 0.02 . 2 . . . . . . . . 5010 1 1152 . 1 1 95 95 LYS CD C 13 28.9 0.3 . 1 . . . . . . . . 5010 1 1153 . 1 1 95 95 LYS HD2 H 1 1.81 0.02 . 2 . . . . . . . . 5010 1 1154 . 1 1 95 95 LYS CE C 13 42.3 0.3 . 1 . . . . . . . . 5010 1 1155 . 1 1 95 95 LYS HE2 H 1 3.13 0.02 . 2 . . . . . . . . 5010 1 1156 . 1 1 95 95 LYS C C 13 174.5 0.3 . 1 . . . . . . . . 5010 1 1157 . 1 1 96 96 THR N N 15 116.0 0.25 . 1 . . . . . . . . 5010 1 1158 . 1 1 96 96 THR H H 1 7.93 0.02 . 1 . . . . . . . . 5010 1 1159 . 1 1 96 96 THR CA C 13 61.4 0.3 . 1 . . . . . . . . 5010 1 1160 . 1 1 96 96 THR HA H 1 5.37 0.02 . 1 . . . . . . . . 5010 1 1161 . 1 1 96 96 THR CB C 13 69.9 0.3 . 1 . . . . . . . . 5010 1 1162 . 1 1 96 96 THR HB H 1 3.80 0.02 . 1 . . . . . . . . 5010 1 1163 . 1 1 96 96 THR HG21 H 1 1.16 0.02 . 1 . . . . . . . . 5010 1 1164 . 1 1 96 96 THR HG22 H 1 1.16 0.02 . 1 . . . . . . . . 5010 1 1165 . 1 1 96 96 THR HG23 H 1 1.16 0.02 . 1 . . . . . . . . 5010 1 1166 . 1 1 96 96 THR CG2 C 13 22.1 0.3 . 1 . . . . . . . . 5010 1 1167 . 1 1 96 96 THR C C 13 174.4 0.3 . 1 . . . . . . . . 5010 1 1168 . 1 1 97 97 TYR N N 15 123.9 0.25 . 1 . . . . . . . . 5010 1 1169 . 1 1 97 97 TYR H H 1 9.15 0.02 . 1 . . . . . . . . 5010 1 1170 . 1 1 97 97 TYR CA C 13 56.2 0.3 . 1 . . . . . . . . 5010 1 1171 . 1 1 97 97 TYR HA H 1 4.93 0.02 . 1 . . . . . . . . 5010 1 1172 . 1 1 97 97 TYR CB C 13 42.3 0.3 . 1 . . . . . . . . 5010 1 1173 . 1 1 97 97 TYR HB2 H 1 2.96 0.02 . 2 . . . . . . . . 5010 1 1174 . 1 1 97 97 TYR HB3 H 1 2.47 0.02 . 2 . . . . . . . . 5010 1 1175 . 1 1 97 97 TYR HD1 H 1 7.08 0.02 . 1 . . . . . . . . 5010 1 1176 . 1 1 97 97 TYR HD2 H 1 7.08 0.02 . 1 . . . . . . . . 5010 1 1177 . 1 1 97 97 TYR HE1 H 1 7.04 0.02 . 1 . . . . . . . . 5010 1 1178 . 1 1 97 97 TYR HE2 H 1 7.04 0.02 . 1 . . . . . . . . 5010 1 1179 . 1 1 97 97 TYR C C 13 173.5 0.3 . 1 . . . . . . . . 5010 1 1180 . 1 1 98 98 GLN N N 15 123.3 0.25 . 1 . . . . . . . . 5010 1 1181 . 1 1 98 98 GLN H H 1 9.00 0.02 . 1 . . . . . . . . 5010 1 1182 . 1 1 98 98 GLN CA C 13 55.4 0.3 . 1 . . . . . . . . 5010 1 1183 . 1 1 98 98 GLN HA H 1 4.67 0.02 . 1 . . . . . . . . 5010 1 1184 . 1 1 98 98 GLN CB C 13 30.0 0.3 . 1 . . . . . . . . 5010 1 1185 . 1 1 98 98 GLN HB2 H 1 2.00 0.02 . 2 . . . . . . . . 5010 1 1186 . 1 1 98 98 GLN HG2 H 1 2.06 0.02 . 2 . . . . . . . . 5010 1 1187 . 1 1 98 98 GLN C C 13 173.1 0.3 . 1 . . . . . . . . 5010 1 1188 . 1 1 99 99 LEU N N 15 130.0 0.25 . 1 . . . . . . . . 5010 1 1189 . 1 1 99 99 LEU H H 1 9.20 0.02 . 1 . . . . . . . . 5010 1 1190 . 1 1 99 99 LEU CA C 13 53.1 0.3 . 1 . . . . . . . . 5010 1 1191 . 1 1 99 99 LEU HA H 1 5.21 0.02 . 1 . . . . . . . . 5010 1 1192 . 1 1 99 99 LEU HD11 H 1 0.53 0.02 . 2 . . . . . . . . 5010 1 1193 . 1 1 99 99 LEU HD12 H 1 0.53 0.02 . 2 . . . . . . . . 5010 1 1194 . 1 1 99 99 LEU HD13 H 1 0.53 0.02 . 2 . . . . . . . . 5010 1 1195 . 1 1 99 99 LEU CD1 C 13 26.1 0.3 . 1 . . . . . . . . 5010 1 1196 . 1 1 99 99 LEU C C 13 173.7 0.3 . 1 . . . . . . . . 5010 1 1197 . 1 1 100 100 ASP N N 15 125.4 0.25 . 1 . . . . . . . . 5010 1 1198 . 1 1 100 100 ASP H H 1 9.28 0.02 . 1 . . . . . . . . 5010 1 1199 . 1 1 100 100 ASP CA C 13 52.4 0.3 . 1 . . . . . . . . 5010 1 1200 . 1 1 100 100 ASP HA H 1 5.23 0.02 . 1 . . . . . . . . 5010 1 1201 . 1 1 100 100 ASP HB2 H 1 3.23 0.02 . 2 . . . . . . . . 5010 1 1202 . 1 1 100 100 ASP C C 13 172.8 0.3 . 1 . . . . . . . . 5010 1 1203 . 1 1 101 101 LEU N N 15 120.7 0.25 . 1 . . . . . . . . 5010 1 1204 . 1 1 101 101 LEU H H 1 8.55 0.02 . 1 . . . . . . . . 5010 1 1205 . 1 1 101 101 LEU CA C 13 52.4 0.3 . 1 . . . . . . . . 5010 1 1206 . 1 1 101 101 LEU HA H 1 5.23 0.02 . 1 . . . . . . . . 5010 1 1207 . 1 1 101 101 LEU CB C 13 45.8 0.3 . 1 . . . . . . . . 5010 1 1208 . 1 1 101 101 LEU HB2 H 1 1.72 0.02 . 2 . . . . . . . . 5010 1 1209 . 1 1 101 101 LEU HB3 H 1 1.11 0.02 . 2 . . . . . . . . 5010 1 1210 . 1 1 101 101 LEU CG C 13 27.8 0.3 . 1 . . . . . . . . 5010 1 1211 . 1 1 101 101 LEU HG H 1 1.38 0.02 . 1 . . . . . . . . 5010 1 1212 . 1 1 101 101 LEU HD11 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 1213 . 1 1 101 101 LEU HD12 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 1214 . 1 1 101 101 LEU HD13 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 1215 . 1 1 101 101 LEU HD21 H 1 0.73 0.02 . 2 . . . . . . . . 5010 1 1216 . 1 1 101 101 LEU HD22 H 1 0.73 0.02 . 2 . . . . . . . . 5010 1 1217 . 1 1 101 101 LEU HD23 H 1 0.73 0.02 . 2 . . . . . . . . 5010 1 1218 . 1 1 101 101 LEU CD1 C 13 26.4 0.3 . 1 . . . . . . . . 5010 1 1219 . 1 1 101 101 LEU CD2 C 13 24.0 0.3 . 1 . . . . . . . . 5010 1 1220 . 1 1 101 101 LEU C C 13 174.6 0.3 . 1 . . . . . . . . 5010 1 1221 . 1 1 102 102 PHE N N 15 119.1 0.25 . 1 . . . . . . . . 5010 1 1222 . 1 1 102 102 PHE H H 1 8.37 0.02 . 1 . . . . . . . . 5010 1 1223 . 1 1 102 102 PHE CA C 13 54.6 0.3 . 1 . . . . . . . . 5010 1 1224 . 1 1 102 102 PHE HA H 1 5.61 0.02 . 1 . . . . . . . . 5010 1 1225 . 1 1 102 102 PHE CB C 13 43.1 0.3 . 1 . . . . . . . . 5010 1 1226 . 1 1 102 102 PHE HB2 H 1 2.70 0.02 . 2 . . . . . . . . 5010 1 1227 . 1 1 102 102 PHE HD1 H 1 6.74 0.02 . 1 . . . . . . . . 5010 1 1228 . 1 1 102 102 PHE HD2 H 1 6.74 0.02 . 1 . . . . . . . . 5010 1 1229 . 1 1 102 102 PHE HE1 H 1 6.99 0.02 . 1 . . . . . . . . 5010 1 1230 . 1 1 102 102 PHE HE2 H 1 6.99 0.02 . 1 . . . . . . . . 5010 1 1231 . 1 1 102 102 PHE HZ H 1 7.14 0.02 . 1 . . . . . . . . 5010 1 1232 . 1 1 102 102 PHE C C 13 176.3 0.3 . 1 . . . . . . . . 5010 1 1233 . 1 1 103 103 THR N N 15 108.0 0.25 . 1 . . . . . . . . 5010 1 1234 . 1 1 103 103 THR H H 1 8.01 0.02 . 1 . . . . . . . . 5010 1 1235 . 1 1 103 103 THR CA C 13 58.1 0.3 . 1 . . . . . . . . 5010 1 1236 . 1 1 103 103 THR HA H 1 5.77 0.02 . 1 . . . . . . . . 5010 1 1237 . 1 1 103 103 THR CB C 13 72.1 0.3 . 1 . . . . . . . . 5010 1 1238 . 1 1 103 103 THR HB H 1 3.98 0.02 . 1 . . . . . . . . 5010 1 1239 . 1 1 103 103 THR HG21 H 1 1.11 0.02 . 1 . . . . . . . . 5010 1 1240 . 1 1 103 103 THR HG22 H 1 1.11 0.02 . 1 . . . . . . . . 5010 1 1241 . 1 1 103 103 THR HG23 H 1 1.11 0.02 . 1 . . . . . . . . 5010 1 1242 . 1 1 103 103 THR CG2 C 13 23.1 0.3 . 1 . . . . . . . . 5010 1 1243 . 1 1 103 103 THR C C 13 174.9 0.3 . 1 . . . . . . . . 5010 1 1244 . 1 1 104 104 ALA N N 15 122.6 0.25 . 1 . . . . . . . . 5010 1 1245 . 1 1 104 104 ALA H H 1 8.79 0.02 . 1 . . . . . . . . 5010 1 1246 . 1 1 104 104 ALA CA C 13 50.4 0.3 . 1 . . . . . . . . 5010 1 1247 . 1 1 104 104 ALA HA H 1 4.71 0.02 . 1 . . . . . . . . 5010 1 1248 . 1 1 104 104 ALA HB1 H 1 1.48 0.02 . 1 . . . . . . . . 5010 1 1249 . 1 1 104 104 ALA HB2 H 1 1.48 0.02 . 1 . . . . . . . . 5010 1 1250 . 1 1 104 104 ALA HB3 H 1 1.48 0.02 . 1 . . . . . . . . 5010 1 1251 . 1 1 104 104 ALA CB C 13 23.6 0.3 . 1 . . . . . . . . 5010 1 1252 . 1 1 104 104 ALA C C 13 175.7 0.3 . 1 . . . . . . . . 5010 1 1253 . 1 1 105 105 LEU N N 15 120.5 0.25 . 1 . . . . . . . . 5010 1 1254 . 1 1 105 105 LEU H H 1 8.33 0.02 . 1 . . . . . . . . 5010 1 1255 . 1 1 105 105 LEU CA C 13 53.8 0.3 . 1 . . . . . . . . 5010 1 1256 . 1 1 105 105 LEU HA H 1 5.02 0.02 . 1 . . . . . . . . 5010 1 1257 . 1 1 105 105 LEU CB C 13 42.9 0.3 . 1 . . . . . . . . 5010 1 1258 . 1 1 105 105 LEU HB2 H 1 1.47 0.02 . 2 . . . . . . . . 5010 1 1259 . 1 1 105 105 LEU HB3 H 1 2.07 0.02 . 2 . . . . . . . . 5010 1 1260 . 1 1 105 105 LEU CG C 13 25.6 0.3 . 1 . . . . . . . . 5010 1 1261 . 1 1 105 105 LEU HG H 1 1.06 0.02 . 1 . . . . . . . . 5010 1 1262 . 1 1 105 105 LEU HD11 H 1 0.88 0.02 . 2 . . . . . . . . 5010 1 1263 . 1 1 105 105 LEU HD12 H 1 0.88 0.02 . 2 . . . . . . . . 5010 1 1264 . 1 1 105 105 LEU HD13 H 1 0.88 0.02 . 2 . . . . . . . . 5010 1 1265 . 1 1 105 105 LEU HD21 H 1 0.97 0.02 . 2 . . . . . . . . 5010 1 1266 . 1 1 105 105 LEU HD22 H 1 0.97 0.02 . 2 . . . . . . . . 5010 1 1267 . 1 1 105 105 LEU HD23 H 1 0.97 0.02 . 2 . . . . . . . . 5010 1 1268 . 1 1 105 105 LEU CD1 C 13 24.2 0.3 . 1 . . . . . . . . 5010 1 1269 . 1 1 105 105 LEU CD2 C 13 23.1 0.3 . 1 . . . . . . . . 5010 1 1270 . 1 1 105 105 LEU C C 13 173.7 0.3 . 1 . . . . . . . . 5010 1 1271 . 1 1 106 106 ALA N N 15 124.6 0.25 . 1 . . . . . . . . 5010 1 1272 . 1 1 106 106 ALA H H 1 8.54 0.02 . 1 . . . . . . . . 5010 1 1273 . 1 1 106 106 ALA CA C 13 56.8 0.3 . 1 . . . . . . . . 5010 1 1274 . 1 1 106 106 ALA HA H 1 3.93 0.02 . 1 . . . . . . . . 5010 1 1275 . 1 1 106 106 ALA HB1 H 1 1.55 0.02 . 1 . . . . . . . . 5010 1 1276 . 1 1 106 106 ALA HB2 H 1 1.55 0.02 . 1 . . . . . . . . 5010 1 1277 . 1 1 106 106 ALA HB3 H 1 1.55 0.02 . 1 . . . . . . . . 5010 1 1278 . 1 1 106 106 ALA CB C 13 18.1 0.3 . 1 . . . . . . . . 5010 1 1279 . 1 1 106 106 ALA C C 13 180.8 0.3 . 1 . . . . . . . . 5010 1 1280 . 1 1 107 107 GLU N N 15 115.9 0.25 . 1 . . . . . . . . 5010 1 1281 . 1 1 107 107 GLU H H 1 9.74 0.02 . 1 . . . . . . . . 5010 1 1282 . 1 1 107 107 GLU CA C 13 58.9 0.3 . 1 . . . . . . . . 5010 1 1283 . 1 1 107 107 GLU HA H 1 4.36 0.02 . 1 . . . . . . . . 5010 1 1284 . 1 1 107 107 GLU CB C 13 28.6 0.3 . 1 . . . . . . . . 5010 1 1285 . 1 1 107 107 GLU HB2 H 1 2.26 0.02 . 2 . . . . . . . . 5010 1 1286 . 1 1 107 107 GLU CG C 13 36.5 0.3 . 1 . . . . . . . . 5010 1 1287 . 1 1 107 107 GLU HG2 H 1 2.48 0.02 . 2 . . . . . . . . 5010 1 1288 . 1 1 107 107 GLU C C 13 177.7 0.3 . 1 . . . . . . . . 5010 1 1289 . 1 1 108 108 GLU N N 15 115.7 0.25 . 1 . . . . . . . . 5010 1 1290 . 1 1 108 108 GLU H H 1 7.70 0.02 . 1 . . . . . . . . 5010 1 1291 . 1 1 108 108 GLU CA C 13 55.1 0.3 . 1 . . . . . . . . 5010 1 1292 . 1 1 108 108 GLU HA H 1 4.61 0.02 . 1 . . . . . . . . 5010 1 1293 . 1 1 108 108 GLU HB2 H 1 1.81 0.02 . 2 . . . . . . . . 5010 1 1294 . 1 1 108 108 GLU HB3 H 1 2.01 0.02 . 2 . . . . . . . . 5010 1 1295 . 1 1 108 108 GLU HG2 H 1 1.51 0.02 . 2 . . . . . . . . 5010 1 1296 . 1 1 108 108 GLU HG3 H 1 1.42 0.02 . 2 . . . . . . . . 5010 1 1297 . 1 1 109 109 LYS CA C 13 58.1 0.3 . 1 . . . . . . . . 5010 1 1298 . 1 1 109 109 LYS HA H 1 4.42 0.02 . 1 . . . . . . . . 5010 1 1299 . 1 1 109 109 LYS CB C 13 32.7 0.3 . 1 . . . . . . . . 5010 1 1300 . 1 1 109 109 LYS HB2 H 1 1.53 0.02 . 2 . . . . . . . . 5010 1 1301 . 1 1 109 109 LYS HB3 H 1 2.06 0.02 . 2 . . . . . . . . 5010 1 1302 . 1 1 109 109 LYS CG C 13 24.2 0.3 . 1 . . . . . . . . 5010 1 1303 . 1 1 109 109 LYS HG2 H 1 1.27 0.02 . 2 . . . . . . . . 5010 1 1304 . 1 1 109 109 LYS HG3 H 1 1.40 0.02 . 2 . . . . . . . . 5010 1 1305 . 1 1 109 109 LYS CD C 13 29.1 0.3 . 1 . . . . . . . . 5010 1 1306 . 1 1 109 109 LYS HD2 H 1 1.72 0.02 . 2 . . . . . . . . 5010 1 1307 . 1 1 109 109 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 5010 1 1308 . 1 1 109 109 LYS HE2 H 1 3.02 0.02 . 2 . . . . . . . . 5010 1 1309 . 1 1 110 110 PRO CD C 13 48.6 0.3 . 1 . . . . . . . . 5010 1 1310 . 1 1 110 110 PRO CA C 13 66.9 0.3 . 1 . . . . . . . . 5010 1 1311 . 1 1 110 110 PRO HA H 1 4.07 0.02 . 1 . . . . . . . . 5010 1 1312 . 1 1 110 110 PRO CB C 13 30.8 0.3 . 1 . . . . . . . . 5010 1 1313 . 1 1 110 110 PRO HB2 H 1 1.63 0.02 . 2 . . . . . . . . 5010 1 1314 . 1 1 110 110 PRO HB3 H 1 1.02 0.02 . 2 . . . . . . . . 5010 1 1315 . 1 1 110 110 PRO CG C 13 28.3 0.3 . 1 . . . . . . . . 5010 1 1316 . 1 1 110 110 PRO HG2 H 1 1.47 0.02 . 2 . . . . . . . . 5010 1 1317 . 1 1 110 110 PRO HD2 H 1 3.65 0.02 . 2 . . . . . . . . 5010 1 1318 . 1 1 110 110 PRO HD3 H 1 3.71 0.02 . 2 . . . . . . . . 5010 1 1319 . 1 1 110 110 PRO C C 13 177.2 0.3 . 1 . . . . . . . . 5010 1 1320 . 1 1 111 111 TYR N N 15 114.5 0.25 . 1 . . . . . . . . 5010 1 1321 . 1 1 111 111 TYR H H 1 6.52 0.02 . 1 . . . . . . . . 5010 1 1322 . 1 1 111 111 TYR CA C 13 59.5 0.3 . 1 . . . . . . . . 5010 1 1323 . 1 1 111 111 TYR HA H 1 3.92 0.02 . 1 . . . . . . . . 5010 1 1324 . 1 1 111 111 TYR CB C 13 36.6 0.3 . 1 . . . . . . . . 5010 1 1325 . 1 1 111 111 TYR HB2 H 1 3.53 0.02 . 2 . . . . . . . . 5010 1 1326 . 1 1 111 111 TYR HB3 H 1 2.98 0.02 . 2 . . . . . . . . 5010 1 1327 . 1 1 111 111 TYR HD1 H 1 7.06 0.02 . 1 . . . . . . . . 5010 1 1328 . 1 1 111 111 TYR HD2 H 1 7.06 0.02 . 1 . . . . . . . . 5010 1 1329 . 1 1 111 111 TYR HE1 H 1 6.84 0.02 . 1 . . . . . . . . 5010 1 1330 . 1 1 111 111 TYR HE2 H 1 6.84 0.02 . 1 . . . . . . . . 5010 1 1331 . 1 1 111 111 TYR C C 13 179.5 0.3 . 1 . . . . . . . . 5010 1 1332 . 1 1 112 112 ALA N N 15 124.8 0.25 . 1 . . . . . . . . 5010 1 1333 . 1 1 112 112 ALA H H 1 8.70 0.02 . 1 . . . . . . . . 5010 1 1334 . 1 1 112 112 ALA CA C 13 55.4 0.3 . 1 . . . . . . . . 5010 1 1335 . 1 1 112 112 ALA HA H 1 3.99 0.02 . 1 . . . . . . . . 5010 1 1336 . 1 1 112 112 ALA HB1 H 1 1.73 0.02 . 1 . . . . . . . . 5010 1 1337 . 1 1 112 112 ALA HB2 H 1 1.73 0.02 . 1 . . . . . . . . 5010 1 1338 . 1 1 112 112 ALA HB3 H 1 1.73 0.02 . 1 . . . . . . . . 5010 1 1339 . 1 1 112 112 ALA CB C 13 19.3 0.3 . 1 . . . . . . . . 5010 1 1340 . 1 1 112 112 ALA C C 13 179.1 0.3 . 1 . . . . . . . . 5010 1 1341 . 1 1 113 113 ILE N N 15 119.2 0.25 . 1 . . . . . . . . 5010 1 1342 . 1 1 113 113 ILE H H 1 8.82 0.02 . 1 . . . . . . . . 5010 1 1343 . 1 1 113 113 ILE CA C 13 67.0 0.3 . 1 . . . . . . . . 5010 1 1344 . 1 1 113 113 ILE HA H 1 3.49 0.02 . 1 . . . . . . . . 5010 1 1345 . 1 1 113 113 ILE CB C 13 38.5 0.3 . 1 . . . . . . . . 5010 1 1346 . 1 1 113 113 ILE HB H 1 1.79 0.02 . 1 . . . . . . . . 5010 1 1347 . 1 1 113 113 ILE HG21 H 1 0.93 0.02 . 1 . . . . . . . . 5010 1 1348 . 1 1 113 113 ILE HG22 H 1 0.93 0.02 . 1 . . . . . . . . 5010 1 1349 . 1 1 113 113 ILE HG23 H 1 0.93 0.02 . 1 . . . . . . . . 5010 1 1350 . 1 1 113 113 ILE CG2 C 13 16.6 0.3 . 1 . . . . . . . . 5010 1 1351 . 1 1 113 113 ILE CG1 C 13 30.5 0.3 . 1 . . . . . . . . 5010 1 1352 . 1 1 113 113 ILE HG12 H 1 1.90 0.02 . 2 . . . . . . . . 5010 1 1353 . 1 1 113 113 ILE HG13 H 1 0.78 0.02 . 2 . . . . . . . . 5010 1 1354 . 1 1 113 113 ILE HD11 H 1 0.94 0.02 . 1 . . . . . . . . 5010 1 1355 . 1 1 113 113 ILE HD12 H 1 0.94 0.02 . 1 . . . . . . . . 5010 1 1356 . 1 1 113 113 ILE HD13 H 1 0.94 0.02 . 1 . . . . . . . . 5010 1 1357 . 1 1 113 113 ILE CD1 C 13 14.9 0.3 . 1 . . . . . . . . 5010 1 1358 . 1 1 113 113 ILE C C 13 178.5 0.3 . 1 . . . . . . . . 5010 1 1359 . 1 1 114 114 PHE N N 15 122.6 0.25 . 1 . . . . . . . . 5010 1 1360 . 1 1 114 114 PHE H H 1 7.86 0.02 . 1 . . . . . . . . 5010 1 1361 . 1 1 114 114 PHE HD1 H 1 7.42 0.02 . 1 . . . . . . . . 5010 1 1362 . 1 1 114 114 PHE HD2 H 1 7.42 0.02 . 1 . . . . . . . . 5010 1 1363 . 1 1 114 114 PHE HE1 H 1 7.13 0.02 . 1 . . . . . . . . 5010 1 1364 . 1 1 114 114 PHE HE2 H 1 7.13 0.02 . 1 . . . . . . . . 5010 1 1365 . 1 1 114 114 PHE HZ H 1 6.98 0.02 . 1 . . . . . . . . 5010 1 1366 . 1 1 114 114 PHE C C 13 178.2 0.3 . 1 . . . . . . . . 5010 1 1367 . 1 1 115 115 HIS N N 15 117.7 0.25 . 1 . . . . . . . . 5010 1 1368 . 1 1 115 115 HIS H H 1 8.24 0.02 . 1 . . . . . . . . 5010 1 1369 . 1 1 115 115 HIS CA C 13 59.6 0.3 . 1 . . . . . . . . 5010 1 1370 . 1 1 115 115 HIS HA H 1 3.93 0.02 . 1 . . . . . . . . 5010 1 1371 . 1 1 115 115 HIS CB C 13 32.0 0.3 . 1 . . . . . . . . 5010 1 1372 . 1 1 115 115 HIS HB2 H 1 2.84 0.02 . 2 . . . . . . . . 5010 1 1373 . 1 1 115 115 HIS HB3 H 1 2.99 0.02 . 2 . . . . . . . . 5010 1 1374 . 1 1 115 115 HIS C C 13 177.2 0.3 . 1 . . . . . . . . 5010 1 1375 . 1 1 116 116 PHE N N 15 111.2 0.25 . 1 . . . . . . . . 5010 1 1376 . 1 1 116 116 PHE H H 1 8.72 0.02 . 1 . . . . . . . . 5010 1 1377 . 1 1 116 116 PHE CA C 13 59.8 0.3 . 1 . . . . . . . . 5010 1 1378 . 1 1 116 116 PHE HA H 1 4.20 0.02 . 1 . . . . . . . . 5010 1 1379 . 1 1 116 116 PHE CB C 13 37.9 0.3 . 1 . . . . . . . . 5010 1 1380 . 1 1 116 116 PHE HB2 H 1 3.12 0.02 . 2 . . . . . . . . 5010 1 1381 . 1 1 116 116 PHE HB3 H 1 2.65 0.02 . 2 . . . . . . . . 5010 1 1382 . 1 1 116 116 PHE HD1 H 1 7.05 0.02 . 1 . . . . . . . . 5010 1 1383 . 1 1 116 116 PHE HD2 H 1 7.05 0.02 . 1 . . . . . . . . 5010 1 1384 . 1 1 116 116 PHE HE1 H 1 6.68 0.02 . 1 . . . . . . . . 5010 1 1385 . 1 1 116 116 PHE HE2 H 1 6.68 0.02 . 1 . . . . . . . . 5010 1 1386 . 1 1 116 116 PHE C C 13 179.0 0.3 . 1 . . . . . . . . 5010 1 1387 . 1 1 117 117 THR N N 15 118.5 0.25 . 1 . . . . . . . . 5010 1 1388 . 1 1 117 117 THR H H 1 7.74 0.02 . 1 . . . . . . . . 5010 1 1389 . 1 1 117 117 THR CA C 13 67.4 0.3 . 1 . . . . . . . . 5010 1 1390 . 1 1 117 117 THR HA H 1 4.07 0.02 . 1 . . . . . . . . 5010 1 1391 . 1 1 117 117 THR CB C 13 68.2 0.3 . 1 . . . . . . . . 5010 1 1392 . 1 1 117 117 THR HB H 1 4.44 0.02 . 1 . . . . . . . . 5010 1 1393 . 1 1 117 117 THR HG21 H 1 1.18 0.02 . 1 . . . . . . . . 5010 1 1394 . 1 1 117 117 THR HG22 H 1 1.18 0.02 . 1 . . . . . . . . 5010 1 1395 . 1 1 117 117 THR HG23 H 1 1.18 0.02 . 1 . . . . . . . . 5010 1 1396 . 1 1 117 117 THR CG2 C 13 21.0 0.3 . 1 . . . . . . . . 5010 1 1397 . 1 1 117 117 THR C C 13 172.9 0.3 . 1 . . . . . . . . 5010 1 1398 . 1 1 118 118 GLY N N 15 107.3 0.25 . 1 . . . . . . . . 5010 1 1399 . 1 1 118 118 GLY H H 1 6.76 0.02 . 1 . . . . . . . . 5010 1 1400 . 1 1 118 118 GLY CA C 13 44.5 0.3 . 1 . . . . . . . . 5010 1 1401 . 1 1 118 118 GLY HA2 H 1 3.93 0.02 . 2 . . . . . . . . 5010 1 1402 . 1 1 118 118 GLY HA3 H 1 3.01 0.02 . 2 . . . . . . . . 5010 1 1403 . 1 1 119 119 PRO CA C 13 62.8 0.3 . 1 . . . . . . . . 5010 1 1404 . 1 1 119 119 PRO HA H 1 4.93 0.02 . 1 . . . . . . . . 5010 1 1405 . 1 1 119 119 PRO CB C 13 34.9 0.3 . 1 . . . . . . . . 5010 1 1406 . 1 1 119 119 PRO HB2 H 1 2.23 0.02 . 2 . . . . . . . . 5010 1 1407 . 1 1 119 119 PRO HB3 H 1 2.58 0.02 . 2 . . . . . . . . 5010 1 1408 . 1 1 119 119 PRO CG C 13 31.9 0.3 . 1 . . . . . . . . 5010 1 1409 . 1 1 119 119 PRO HG2 H 1 2.17 0.02 . 2 . . . . . . . . 5010 1 1410 . 1 1 119 119 PRO HD2 H 1 3.92 0.02 . 2 . . . . . . . . 5010 1 1411 . 1 1 119 119 PRO C C 13 177.6 0.3 . 1 . . . . . . . . 5010 1 1412 . 1 1 120 120 VAL N N 15 122.1 0.25 . 1 . . . . . . . . 5010 1 1413 . 1 1 120 120 VAL H H 1 8.92 0.02 . 1 . . . . . . . . 5010 1 1414 . 1 1 120 120 VAL CA C 13 67.4 0.3 . 1 . . . . . . . . 5010 1 1415 . 1 1 120 120 VAL HA H 1 3.61 0.02 . 1 . . . . . . . . 5010 1 1416 . 1 1 120 120 VAL CB C 13 31.6 0.3 . 1 . . . . . . . . 5010 1 1417 . 1 1 120 120 VAL HB H 1 2.16 0.02 . 1 . . . . . . . . 5010 1 1418 . 1 1 120 120 VAL HG11 H 1 1.12 0.02 . 2 . . . . . . . . 5010 1 1419 . 1 1 120 120 VAL HG12 H 1 1.12 0.02 . 2 . . . . . . . . 5010 1 1420 . 1 1 120 120 VAL HG13 H 1 1.12 0.02 . 2 . . . . . . . . 5010 1 1421 . 1 1 120 120 VAL HG21 H 1 1.03 0.02 . 2 . . . . . . . . 5010 1 1422 . 1 1 120 120 VAL HG22 H 1 1.03 0.02 . 2 . . . . . . . . 5010 1 1423 . 1 1 120 120 VAL HG23 H 1 1.03 0.02 . 2 . . . . . . . . 5010 1 1424 . 1 1 120 120 VAL CG1 C 13 22.6 0.3 . 1 . . . . . . . . 5010 1 1425 . 1 1 120 120 VAL CG2 C 13 20.9 0.3 . 1 . . . . . . . . 5010 1 1426 . 1 1 120 120 VAL C C 13 177.6 0.3 . 1 . . . . . . . . 5010 1 1427 . 1 1 121 121 SER N N 15 113.0 0.25 . 1 . . . . . . . . 5010 1 1428 . 1 1 121 121 SER H H 1 8.46 0.02 . 1 . . . . . . . . 5010 1 1429 . 1 1 121 121 SER CA C 13 61.4 0.3 . 1 . . . . . . . . 5010 1 1430 . 1 1 121 121 SER HA H 1 3.99 0.02 . 1 . . . . . . . . 5010 1 1431 . 1 1 121 121 SER CB C 13 60.7 0.3 . 1 . . . . . . . . 5010 1 1432 . 1 1 121 121 SER HB2 H 1 3.91 0.02 . 2 . . . . . . . . 5010 1 1433 . 1 1 121 121 SER C C 13 176.1 0.3 . 1 . . . . . . . . 5010 1 1434 . 1 1 122 122 TYR N N 15 124.5 0.25 . 1 . . . . . . . . 5010 1 1435 . 1 1 122 122 TYR H H 1 6.61 0.02 . 1 . . . . . . . . 5010 1 1436 . 1 1 122 122 TYR CA C 13 59.3 0.3 . 1 . . . . . . . . 5010 1 1437 . 1 1 122 122 TYR HA H 1 4.33 0.02 . 1 . . . . . . . . 5010 1 1438 . 1 1 122 122 TYR CB C 13 39.5 0.3 . 1 . . . . . . . . 5010 1 1439 . 1 1 122 122 TYR HB2 H 1 2.63 0.02 . 2 . . . . . . . . 5010 1 1440 . 1 1 122 122 TYR HB3 H 1 2.75 0.02 . 2 . . . . . . . . 5010 1 1441 . 1 1 122 122 TYR HD1 H 1 6.90 0.02 . 1 . . . . . . . . 5010 1 1442 . 1 1 122 122 TYR HD2 H 1 6.90 0.02 . 1 . . . . . . . . 5010 1 1443 . 1 1 122 122 TYR HE1 H 1 6.83 0.02 . 1 . . . . . . . . 5010 1 1444 . 1 1 122 122 TYR HE2 H 1 6.83 0.02 . 1 . . . . . . . . 5010 1 1445 . 1 1 122 122 TYR C C 13 176.2 0.3 . 1 . . . . . . . . 5010 1 1446 . 1 1 123 123 LEU N N 15 117.5 0.25 . 1 . . . . . . . . 5010 1 1447 . 1 1 123 123 LEU H H 1 7.55 0.02 . 1 . . . . . . . . 5010 1 1448 . 1 1 123 123 LEU CA C 13 57.1 0.3 . 1 . . . . . . . . 5010 1 1449 . 1 1 123 123 LEU HA H 1 3.61 0.02 . 1 . . . . . . . . 5010 1 1450 . 1 1 123 123 LEU CB C 13 41.2 0.3 . 1 . . . . . . . . 5010 1 1451 . 1 1 123 123 LEU HB2 H 1 1.85 0.02 . 2 . . . . . . . . 5010 1 1452 . 1 1 123 123 LEU HB3 H 1 1.26 0.02 . 2 . . . . . . . . 5010 1 1453 . 1 1 123 123 LEU CG C 13 26.5 0.3 . 1 . . . . . . . . 5010 1 1454 . 1 1 123 123 LEU HG H 1 1.45 0.02 . 1 . . . . . . . . 5010 1 1455 . 1 1 123 123 LEU HD11 H 1 0.69 0.02 . 2 . . . . . . . . 5010 1 1456 . 1 1 123 123 LEU HD12 H 1 0.69 0.02 . 2 . . . . . . . . 5010 1 1457 . 1 1 123 123 LEU HD13 H 1 0.69 0.02 . 2 . . . . . . . . 5010 1 1458 . 1 1 123 123 LEU HD21 H 1 0.29 0.02 . 2 . . . . . . . . 5010 1 1459 . 1 1 123 123 LEU HD22 H 1 0.29 0.02 . 2 . . . . . . . . 5010 1 1460 . 1 1 123 123 LEU HD23 H 1 0.29 0.02 . 2 . . . . . . . . 5010 1 1461 . 1 1 123 123 LEU CD1 C 13 26.5 0.3 . 1 . . . . . . . . 5010 1 1462 . 1 1 123 123 LEU CD2 C 13 21.8 0.3 . 1 . . . . . . . . 5010 1 1463 . 1 1 123 123 LEU C C 13 179.7 0.3 . 1 . . . . . . . . 5010 1 1464 . 1 1 124 124 ILE N N 15 118.6 0.25 . 1 . . . . . . . . 5010 1 1465 . 1 1 124 124 ILE H H 1 8.59 0.02 . 1 . . . . . . . . 5010 1 1466 . 1 1 124 124 ILE CA C 13 65.8 0.3 . 1 . . . . . . . . 5010 1 1467 . 1 1 124 124 ILE HA H 1 3.67 0.02 . 1 . . . . . . . . 5010 1 1468 . 1 1 124 124 ILE CB C 13 38.2 0.3 . 1 . . . . . . . . 5010 1 1469 . 1 1 124 124 ILE HB H 1 1.86 0.02 . 1 . . . . . . . . 5010 1 1470 . 1 1 124 124 ILE HG21 H 1 0.95 0.02 . 1 . . . . . . . . 5010 1 1471 . 1 1 124 124 ILE HG22 H 1 0.95 0.02 . 1 . . . . . . . . 5010 1 1472 . 1 1 124 124 ILE HG23 H 1 0.95 0.02 . 1 . . . . . . . . 5010 1 1473 . 1 1 124 124 ILE CG2 C 13 17.4 0.3 . 1 . . . . . . . . 5010 1 1474 . 1 1 124 124 ILE CG1 C 13 29.4 0.3 . 1 . . . . . . . . 5010 1 1475 . 1 1 124 124 ILE HG12 H 1 1.20 0.02 . 2 . . . . . . . . 5010 1 1476 . 1 1 124 124 ILE HG13 H 1 1.78 0.02 . 2 . . . . . . . . 5010 1 1477 . 1 1 124 124 ILE HD11 H 1 0.87 0.02 . 1 . . . . . . . . 5010 1 1478 . 1 1 124 124 ILE HD12 H 1 0.87 0.02 . 1 . . . . . . . . 5010 1 1479 . 1 1 124 124 ILE HD13 H 1 0.87 0.02 . 1 . . . . . . . . 5010 1 1480 . 1 1 124 124 ILE CD1 C 13 13.9 0.3 . 1 . . . . . . . . 5010 1 1481 . 1 1 124 124 ILE C C 13 178.8 0.3 . 1 . . . . . . . . 5010 1 1482 . 1 1 125 125 ARG N N 15 120.7 0.25 . 1 . . . . . . . . 5010 1 1483 . 1 1 125 125 ARG H H 1 7.10 0.02 . 1 . . . . . . . . 5010 1 1484 . 1 1 125 125 ARG CA C 13 59.4 0.3 . 1 . . . . . . . . 5010 1 1485 . 1 1 125 125 ARG HA H 1 4.21 0.02 . 1 . . . . . . . . 5010 1 1486 . 1 1 125 125 ARG CB C 13 29.9 0.3 . 1 . . . . . . . . 5010 1 1487 . 1 1 125 125 ARG HB2 H 1 1.99 0.02 . 2 . . . . . . . . 5010 1 1488 . 1 1 125 125 ARG CG C 13 27.8 0.3 . 1 . . . . . . . . 5010 1 1489 . 1 1 125 125 ARG HG2 H 1 1.89 0.02 . 2 . . . . . . . . 5010 1 1490 . 1 1 125 125 ARG HG3 H 1 1.66 0.02 . 2 . . . . . . . . 5010 1 1491 . 1 1 125 125 ARG CD C 13 43.4 0.3 . 1 . . . . . . . . 5010 1 1492 . 1 1 125 125 ARG HD2 H 1 3.43 0.02 . 2 . . . . . . . . 5010 1 1493 . 1 1 125 125 ARG HD3 H 1 3.37 0.02 . 2 . . . . . . . . 5010 1 1494 . 1 1 125 125 ARG C C 13 179.7 0.3 . 1 . . . . . . . . 5010 1 1495 . 1 1 126 126 ILE N N 15 122.3 0.25 . 1 . . . . . . . . 5010 1 1496 . 1 1 126 126 ILE H H 1 7.74 0.02 . 1 . . . . . . . . 5010 1 1497 . 1 1 126 126 ILE CA C 13 62.5 0.3 . 1 . . . . . . . . 5010 1 1498 . 1 1 126 126 ILE HA H 1 3.50 0.02 . 1 . . . . . . . . 5010 1 1499 . 1 1 126 126 ILE CB C 13 36.4 0.3 . 1 . . . . . . . . 5010 1 1500 . 1 1 126 126 ILE HB H 1 1.79 0.02 . 1 . . . . . . . . 5010 1 1501 . 1 1 126 126 ILE HG21 H 1 0.60 0.02 . 1 . . . . . . . . 5010 1 1502 . 1 1 126 126 ILE HG22 H 1 0.60 0.02 . 1 . . . . . . . . 5010 1 1503 . 1 1 126 126 ILE HG23 H 1 0.60 0.02 . 1 . . . . . . . . 5010 1 1504 . 1 1 126 126 ILE CG2 C 13 17.4 0.3 . 1 . . . . . . . . 5010 1 1505 . 1 1 126 126 ILE CG1 C 13 27.0 0.3 . 1 . . . . . . . . 5010 1 1506 . 1 1 126 126 ILE HG12 H 1 0.47 0.02 . 2 . . . . . . . . 5010 1 1507 . 1 1 126 126 ILE HG13 H 1 0.60 0.02 . 2 . . . . . . . . 5010 1 1508 . 1 1 126 126 ILE HD11 H 1 -0.16 0.02 . 1 . . . . . . . . 5010 1 1509 . 1 1 126 126 ILE HD12 H 1 -0.16 0.02 . 1 . . . . . . . . 5010 1 1510 . 1 1 126 126 ILE HD13 H 1 -0.16 0.02 . 1 . . . . . . . . 5010 1 1511 . 1 1 126 126 ILE CD1 C 13 9.2 0.3 . 1 . . . . . . . . 5010 1 1512 . 1 1 126 126 ILE C C 13 178.4 0.3 . 1 . . . . . . . . 5010 1 1513 . 1 1 127 127 ARG N N 15 119.0 0.25 . 1 . . . . . . . . 5010 1 1514 . 1 1 127 127 ARG H H 1 8.88 0.02 . 1 . . . . . . . . 5010 1 1515 . 1 1 127 127 ARG CA C 13 60.5 0.3 . 1 . . . . . . . . 5010 1 1516 . 1 1 127 127 ARG HA H 1 4.01 0.02 . 1 . . . . . . . . 5010 1 1517 . 1 1 127 127 ARG CB C 13 29.8 0.3 . 1 . . . . . . . . 5010 1 1518 . 1 1 127 127 ARG HB2 H 1 2.01 0.02 . 2 . . . . . . . . 5010 1 1519 . 1 1 127 127 ARG CG C 13 28.5 0.3 . 1 . . . . . . . . 5010 1 1520 . 1 1 127 127 ARG HG2 H 1 1.75 0.02 . 2 . . . . . . . . 5010 1 1521 . 1 1 127 127 ARG CD C 13 43.6 0.3 . 1 . . . . . . . . 5010 1 1522 . 1 1 127 127 ARG HD2 H 1 3.25 0.02 . 2 . . . . . . . . 5010 1 1523 . 1 1 127 127 ARG C C 13 179.8 0.3 . 1 . . . . . . . . 5010 1 1524 . 1 1 128 128 ALA N N 15 122.6 0.25 . 1 . . . . . . . . 5010 1 1525 . 1 1 128 128 ALA H H 1 8.11 0.02 . 1 . . . . . . . . 5010 1 1526 . 1 1 128 128 ALA CA C 13 55.2 0.3 . 1 . . . . . . . . 5010 1 1527 . 1 1 128 128 ALA HA H 1 4.30 0.02 . 1 . . . . . . . . 5010 1 1528 . 1 1 128 128 ALA HB1 H 1 1.63 0.02 . 1 . . . . . . . . 5010 1 1529 . 1 1 128 128 ALA HB2 H 1 1.63 0.02 . 1 . . . . . . . . 5010 1 1530 . 1 1 128 128 ALA HB3 H 1 1.63 0.02 . 1 . . . . . . . . 5010 1 1531 . 1 1 128 128 ALA CB C 13 17.9 0.3 . 1 . . . . . . . . 5010 1 1532 . 1 1 128 128 ALA C C 13 180.4 0.3 . 1 . . . . . . . . 5010 1 1533 . 1 1 129 129 ALA N N 15 121.4 0.25 . 1 . . . . . . . . 5010 1 1534 . 1 1 129 129 ALA H H 1 7.65 0.02 . 1 . . . . . . . . 5010 1 1535 . 1 1 129 129 ALA CA C 13 55.1 0.3 . 1 . . . . . . . . 5010 1 1536 . 1 1 129 129 ALA HA H 1 4.38 0.02 . 1 . . . . . . . . 5010 1 1537 . 1 1 129 129 ALA HB1 H 1 1.86 0.02 . 1 . . . . . . . . 5010 1 1538 . 1 1 129 129 ALA HB2 H 1 1.86 0.02 . 1 . . . . . . . . 5010 1 1539 . 1 1 129 129 ALA HB3 H 1 1.86 0.02 . 1 . . . . . . . . 5010 1 1540 . 1 1 129 129 ALA CB C 13 18.1 0.3 . 1 . . . . . . . . 5010 1 1541 . 1 1 129 129 ALA C C 13 180.4 0.3 . 1 . . . . . . . . 5010 1 1542 . 1 1 130 130 LEU N N 15 118.8 0.25 . 1 . . . . . . . . 5010 1 1543 . 1 1 130 130 LEU H H 1 8.43 0.02 . 1 . . . . . . . . 5010 1 1544 . 1 1 130 130 LEU CA C 13 57.2 0.3 . 1 . . . . . . . . 5010 1 1545 . 1 1 130 130 LEU HA H 1 4.33 0.02 . 1 . . . . . . . . 5010 1 1546 . 1 1 130 130 LEU CB C 13 41.4 0.3 . 1 . . . . . . . . 5010 1 1547 . 1 1 130 130 LEU HB2 H 1 2.07 0.02 . 2 . . . . . . . . 5010 1 1548 . 1 1 130 130 LEU HB3 H 1 1.73 0.02 . 2 . . . . . . . . 5010 1 1549 . 1 1 130 130 LEU CG C 13 27.5 0.3 . 1 . . . . . . . . 5010 1 1550 . 1 1 130 130 LEU HG H 1 2.24 0.02 . 1 . . . . . . . . 5010 1 1551 . 1 1 130 130 LEU HD11 H 1 1.10 0.02 . 2 . . . . . . . . 5010 1 1552 . 1 1 130 130 LEU HD12 H 1 1.10 0.02 . 2 . . . . . . . . 5010 1 1553 . 1 1 130 130 LEU HD13 H 1 1.10 0.02 . 2 . . . . . . . . 5010 1 1554 . 1 1 130 130 LEU HD21 H 1 1.03 0.02 . 2 . . . . . . . . 5010 1 1555 . 1 1 130 130 LEU HD22 H 1 1.03 0.02 . 2 . . . . . . . . 5010 1 1556 . 1 1 130 130 LEU HD23 H 1 1.03 0.02 . 2 . . . . . . . . 5010 1 1557 . 1 1 130 130 LEU CD1 C 13 23.1 0.3 . 1 . . . . . . . . 5010 1 1558 . 1 1 130 130 LEU CD2 C 13 28.5 0.3 . 1 . . . . . . . . 5010 1 1559 . 1 1 130 130 LEU C C 13 180.0 0.3 . 1 . . . . . . . . 5010 1 1560 . 1 1 131 131 LYS N N 15 122.1 0.25 . 1 . . . . . . . . 5010 1 1561 . 1 1 131 131 LYS H H 1 8.48 0.02 . 1 . . . . . . . . 5010 1 1562 . 1 1 131 131 LYS CA C 13 59.5 0.3 . 1 . . . . . . . . 5010 1 1563 . 1 1 131 131 LYS HA H 1 4.39 0.02 . 1 . . . . . . . . 5010 1 1564 . 1 1 131 131 LYS CB C 13 32.8 0.3 . 1 . . . . . . . . 5010 1 1565 . 1 1 131 131 LYS HB2 H 1 2.12 0.02 . 2 . . . . . . . . 5010 1 1566 . 1 1 131 131 LYS HB3 H 1 2.21 0.02 . 2 . . . . . . . . 5010 1 1567 . 1 1 131 131 LYS CG C 13 25.3 0.3 . 1 . . . . . . . . 5010 1 1568 . 1 1 131 131 LYS HG2 H 1 1.70 0.02 . 2 . . . . . . . . 5010 1 1569 . 1 1 131 131 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 5010 1 1570 . 1 1 131 131 LYS HD2 H 1 1.87 0.02 . 2 . . . . . . . . 5010 1 1571 . 1 1 131 131 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 5010 1 1572 . 1 1 131 131 LYS HE2 H 1 3.13 0.02 . 2 . . . . . . . . 5010 1 1573 . 1 1 131 131 LYS C C 13 180.4 0.3 . 1 . . . . . . . . 5010 1 1574 . 1 1 132 132 LYS N N 15 118.3 0.25 . 1 . . . . . . . . 5010 1 1575 . 1 1 132 132 LYS H H 1 7.43 0.02 . 1 . . . . . . . . 5010 1 1576 . 1 1 132 132 LYS CA C 13 58.9 0.3 . 1 . . . . . . . . 5010 1 1577 . 1 1 132 132 LYS HA H 1 4.28 0.02 . 1 . . . . . . . . 5010 1 1578 . 1 1 132 132 LYS CB C 13 32.6 0.3 . 1 . . . . . . . . 5010 1 1579 . 1 1 132 132 LYS HB2 H 1 2.11 0.02 . 2 . . . . . . . . 5010 1 1580 . 1 1 132 132 LYS HB3 H 1 2.08 0.02 . 2 . . . . . . . . 5010 1 1581 . 1 1 132 132 LYS CG C 13 25.6 0.3 . 1 . . . . . . . . 5010 1 1582 . 1 1 132 132 LYS HG2 H 1 1.85 0.02 . 2 . . . . . . . . 5010 1 1583 . 1 1 132 132 LYS HG3 H 1 1.67 0.02 . 2 . . . . . . . . 5010 1 1584 . 1 1 132 132 LYS CD C 13 28.9 0.3 . 1 . . . . . . . . 5010 1 1585 . 1 1 132 132 LYS HD2 H 1 1.88 0.02 . 2 . . . . . . . . 5010 1 1586 . 1 1 132 132 LYS CE C 13 42.0 0.3 . 1 . . . . . . . . 5010 1 1587 . 1 1 132 132 LYS HE2 H 1 3.13 0.02 . 2 . . . . . . . . 5010 1 1588 . 1 1 132 132 LYS C C 13 177.5 0.3 . 1 . . . . . . . . 5010 1 1589 . 1 1 133 133 LYS N N 15 116.8 0.25 . 1 . . . . . . . . 5010 1 1590 . 1 1 133 133 LYS H H 1 7.45 0.02 . 1 . . . . . . . . 5010 1 1591 . 1 1 133 133 LYS CA C 13 55.3 0.3 . 1 . . . . . . . . 5010 1 1592 . 1 1 133 133 LYS HA H 1 4.54 0.02 . 1 . . . . . . . . 5010 1 1593 . 1 1 133 133 LYS CB C 13 33.2 0.3 . 1 . . . . . . . . 5010 1 1594 . 1 1 133 133 LYS HB2 H 1 1.84 0.02 . 2 . . . . . . . . 5010 1 1595 . 1 1 133 133 LYS HB3 H 1 2.17 0.02 . 2 . . . . . . . . 5010 1 1596 . 1 1 133 133 LYS CG C 13 25.4 0.3 . 1 . . . . . . . . 5010 1 1597 . 1 1 133 133 LYS HG2 H 1 1.59 0.02 . 2 . . . . . . . . 5010 1 1598 . 1 1 133 133 LYS HG3 H 1 1.51 0.02 . 2 . . . . . . . . 5010 1 1599 . 1 1 133 133 LYS CD C 13 29.7 0.3 . 1 . . . . . . . . 5010 1 1600 . 1 1 133 133 LYS HD2 H 1 1.81 0.02 . 2 . . . . . . . . 5010 1 1601 . 1 1 133 133 LYS CE C 13 42.0 0.3 . 1 . . . . . . . . 5010 1 1602 . 1 1 133 133 LYS HE2 H 1 3.06 0.02 . 2 . . . . . . . . 5010 1 1603 . 1 1 133 133 LYS C C 13 174.5 0.3 . 1 . . . . . . . . 5010 1 1604 . 1 1 134 134 ASN N N 15 112.3 0.25 . 1 . . . . . . . . 5010 1 1605 . 1 1 134 134 ASN H H 1 8.04 0.02 . 1 . . . . . . . . 5010 1 1606 . 1 1 134 134 ASN CA C 13 54.8 0.3 . 1 . . . . . . . . 5010 1 1607 . 1 1 134 134 ASN HA H 1 4.44 0.02 . 1 . . . . . . . . 5010 1 1608 . 1 1 134 134 ASN CB C 13 36.8 0.3 . 1 . . . . . . . . 5010 1 1609 . 1 1 134 134 ASN HB2 H 1 3.20 0.02 . 2 . . . . . . . . 5010 1 1610 . 1 1 134 134 ASN HB3 H 1 2.85 0.02 . 2 . . . . . . . . 5010 1 1611 . 1 1 134 134 ASN ND2 N 15 112.8 0.25 . 1 . . . . . . . . 5010 1 1612 . 1 1 134 134 ASN HD21 H 1 6.92 0.02 . 2 . . . . . . . . 5010 1 1613 . 1 1 134 134 ASN HD22 H 1 7.54 0.02 . 2 . . . . . . . . 5010 1 1614 . 1 1 134 134 ASN C C 13 173.9 0.3 . 1 . . . . . . . . 5010 1 1615 . 1 1 135 135 TYR N N 15 115.1 0.25 . 1 . . . . . . . . 5010 1 1616 . 1 1 135 135 TYR H H 1 7.86 0.02 . 1 . . . . . . . . 5010 1 1617 . 1 1 135 135 TYR CA C 13 56.2 0.3 . 1 . . . . . . . . 5010 1 1618 . 1 1 135 135 TYR HA H 1 5.77 0.02 . 1 . . . . . . . . 5010 1 1619 . 1 1 135 135 TYR CB C 13 42.5 0.3 . 1 . . . . . . . . 5010 1 1620 . 1 1 135 135 TYR HB2 H 1 2.98 0.02 . 2 . . . . . . . . 5010 1 1621 . 1 1 135 135 TYR HB3 H 1 2.90 0.02 . 2 . . . . . . . . 5010 1 1622 . 1 1 135 135 TYR HD1 H 1 7.11 0.02 . 1 . . . . . . . . 5010 1 1623 . 1 1 135 135 TYR HD2 H 1 7.11 0.02 . 1 . . . . . . . . 5010 1 1624 . 1 1 135 135 TYR HE1 H 1 7.03 0.02 . 1 . . . . . . . . 5010 1 1625 . 1 1 135 135 TYR HE2 H 1 7.03 0.02 . 1 . . . . . . . . 5010 1 1626 . 1 1 135 135 TYR C C 13 176.4 0.3 . 1 . . . . . . . . 5010 1 1627 . 1 1 136 136 LYS N N 15 122.3 0.25 . 1 . . . . . . . . 5010 1 1628 . 1 1 136 136 LYS H H 1 9.39 0.02 . 1 . . . . . . . . 5010 1 1629 . 1 1 136 136 LYS CA C 13 55.1 0.3 . 1 . . . . . . . . 5010 1 1630 . 1 1 136 136 LYS HA H 1 4.74 0.02 . 1 . . . . . . . . 5010 1 1631 . 1 1 136 136 LYS CB C 13 35.8 0.3 . 1 . . . . . . . . 5010 1 1632 . 1 1 136 136 LYS HB2 H 1 1.86 0.02 . 2 . . . . . . . . 5010 1 1633 . 1 1 136 136 LYS HB3 H 1 1.82 0.02 . 2 . . . . . . . . 5010 1 1634 . 1 1 136 136 LYS CG C 13 25.1 0.3 . 1 . . . . . . . . 5010 1 1635 . 1 1 136 136 LYS HG2 H 1 1.28 0.02 . 2 . . . . . . . . 5010 1 1636 . 1 1 136 136 LYS HG3 H 1 1.60 0.02 . 2 . . . . . . . . 5010 1 1637 . 1 1 136 136 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 5010 1 1638 . 1 1 136 136 LYS HD2 H 1 1.65 0.02 . 2 . . . . . . . . 5010 1 1639 . 1 1 136 136 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 5010 1 1640 . 1 1 136 136 LYS HE2 H 1 2.78 0.02 . 2 . . . . . . . . 5010 1 1641 . 1 1 136 136 LYS HE3 H 1 2.87 0.02 . 2 . . . . . . . . 5010 1 1642 . 1 1 136 136 LYS C C 13 173.5 0.3 . 1 . . . . . . . . 5010 1 1643 . 1 1 137 137 LEU N N 15 127.2 0.25 . 1 . . . . . . . . 5010 1 1644 . 1 1 137 137 LEU H H 1 8.97 0.02 . 1 . . . . . . . . 5010 1 1645 . 1 1 137 137 LEU CA C 13 53.5 0.3 . 1 . . . . . . . . 5010 1 1646 . 1 1 137 137 LEU HA H 1 5.48 0.02 . 1 . . . . . . . . 5010 1 1647 . 1 1 137 137 LEU CB C 13 46.9 0.3 . 1 . . . . . . . . 5010 1 1648 . 1 1 137 137 LEU HB2 H 1 1.83 0.02 . 2 . . . . . . . . 5010 1 1649 . 1 1 137 137 LEU HB3 H 1 1.39 0.02 . 2 . . . . . . . . 5010 1 1650 . 1 1 137 137 LEU CG C 13 27.2 0.3 . 1 . . . . . . . . 5010 1 1651 . 1 1 137 137 LEU HG H 1 0.97 0.02 . 1 . . . . . . . . 5010 1 1652 . 1 1 137 137 LEU HD11 H 1 0.95 0.02 . 2 . . . . . . . . 5010 1 1653 . 1 1 137 137 LEU HD12 H 1 0.95 0.02 . 2 . . . . . . . . 5010 1 1654 . 1 1 137 137 LEU HD13 H 1 0.95 0.02 . 2 . . . . . . . . 5010 1 1655 . 1 1 137 137 LEU HD21 H 1 1.29 0.02 . 2 . . . . . . . . 5010 1 1656 . 1 1 137 137 LEU HD22 H 1 1.29 0.02 . 2 . . . . . . . . 5010 1 1657 . 1 1 137 137 LEU HD23 H 1 1.29 0.02 . 2 . . . . . . . . 5010 1 1658 . 1 1 137 137 LEU CD1 C 13 24.5 0.3 . 1 . . . . . . . . 5010 1 1659 . 1 1 137 137 LEU CD2 C 13 24.0 0.3 . 1 . . . . . . . . 5010 1 1660 . 1 1 138 138 ASN N N 15 125.3 0.25 . 1 . . . . . . . . 5010 1 1661 . 1 1 138 138 ASN H H 1 8.94 0.02 . 1 . . . . . . . . 5010 1 1662 . 1 1 138 138 ASN CA C 13 52.7 0.3 . 1 . . . . . . . . 5010 1 1663 . 1 1 138 138 ASN HA H 1 4.87 0.02 . 1 . . . . . . . . 5010 1 1664 . 1 1 138 138 ASN CB C 13 38.4 0.3 . 1 . . . . . . . . 5010 1 1665 . 1 1 138 138 ASN HB2 H 1 3.00 0.02 . 2 . . . . . . . . 5010 1 1666 . 1 1 138 138 ASN ND2 N 15 114.7 0.25 . 1 . . . . . . . . 5010 1 1667 . 1 1 138 138 ASN HD21 H 1 7.01 0.02 . 2 . . . . . . . . 5010 1 1668 . 1 1 138 138 ASN HD22 H 1 7.82 0.02 . 2 . . . . . . . . 5010 1 1669 . 1 1 138 138 ASN C C 13 175.1 0.3 . 1 . . . . . . . . 5010 1 1670 . 1 1 139 139 GLN N N 15 116.5 0.25 . 1 . . . . . . . . 5010 1 1671 . 1 1 139 139 GLN H H 1 9.42 0.02 . 1 . . . . . . . . 5010 1 1672 . 1 1 139 139 GLN CA C 13 57.3 0.3 . 1 . . . . . . . . 5010 1 1673 . 1 1 139 139 GLN HA H 1 4.85 0.02 . 1 . . . . . . . . 5010 1 1674 . 1 1 139 139 GLN CB C 13 26.7 0.3 . 1 . . . . . . . . 5010 1 1675 . 1 1 139 139 GLN HB2 H 1 1.77 0.02 . 2 . . . . . . . . 5010 1 1676 . 1 1 139 139 GLN HB3 H 1 1.39 0.02 . 2 . . . . . . . . 5010 1 1677 . 1 1 139 139 GLN CG C 13 38.2 0.3 . 1 . . . . . . . . 5010 1 1678 . 1 1 139 139 GLN HG2 H 1 2.96 0.02 . 2 . . . . . . . . 5010 1 1679 . 1 1 139 139 GLN HG3 H 1 2.90 0.02 . 2 . . . . . . . . 5010 1 1680 . 1 1 139 139 GLN NE2 N 15 113.8 0.25 . 1 . . . . . . . . 5010 1 1681 . 1 1 139 139 GLN HE21 H 1 7.03 0.02 . 2 . . . . . . . . 5010 1 1682 . 1 1 139 139 GLN HE22 H 1 7.74 0.02 . 2 . . . . . . . . 5010 1 1683 . 1 1 139 139 GLN C C 13 174.0 0.3 . 1 . . . . . . . . 5010 1 1684 . 1 1 140 140 TYR N N 15 120.3 0.25 . 1 . . . . . . . . 5010 1 1685 . 1 1 140 140 TYR H H 1 8.69 0.02 . 1 . . . . . . . . 5010 1 1686 . 1 1 140 140 TYR CA C 13 57.1 0.3 . 1 . . . . . . . . 5010 1 1687 . 1 1 140 140 TYR HA H 1 4.60 0.02 . 1 . . . . . . . . 5010 1 1688 . 1 1 140 140 TYR CB C 13 38.1 0.3 . 1 . . . . . . . . 5010 1 1689 . 1 1 140 140 TYR HB2 H 1 3.40 0.02 . 2 . . . . . . . . 5010 1 1690 . 1 1 140 140 TYR HB3 H 1 2.98 0.02 . 2 . . . . . . . . 5010 1 1691 . 1 1 140 140 TYR HD1 H 1 7.08 0.02 . 1 . . . . . . . . 5010 1 1692 . 1 1 140 140 TYR HD2 H 1 7.08 0.02 . 1 . . . . . . . . 5010 1 1693 . 1 1 140 140 TYR HE1 H 1 6.74 0.02 . 1 . . . . . . . . 5010 1 1694 . 1 1 140 140 TYR HE2 H 1 6.74 0.02 . 1 . . . . . . . . 5010 1 1695 . 1 1 140 140 TYR C C 13 175.2 0.3 . 1 . . . . . . . . 5010 1 1696 . 1 1 141 141 GLY N N 15 106.0 0.25 . 1 . . . . . . . . 5010 1 1697 . 1 1 141 141 GLY H H 1 7.33 0.02 . 1 . . . . . . . . 5010 1 1698 . 1 1 141 141 GLY CA C 13 44.2 0.3 . 1 . . . . . . . . 5010 1 1699 . 1 1 141 141 GLY HA2 H 1 3.21 0.02 . 2 . . . . . . . . 5010 1 1700 . 1 1 141 141 GLY HA3 H 1 3.48 0.02 . 2 . . . . . . . . 5010 1 1701 . 1 1 141 141 GLY C C 13 175.4 0.3 . 1 . . . . . . . . 5010 1 1702 . 1 1 142 142 LEU N N 15 125.4 0.25 . 1 . . . . . . . . 5010 1 1703 . 1 1 142 142 LEU H H 1 8.94 0.02 . 1 . . . . . . . . 5010 1 1704 . 1 1 142 142 LEU HA H 1 5.09 0.02 . 1 . . . . . . . . 5010 1 1705 . 1 1 142 142 LEU C C 13 174.1 0.3 . 1 . . . . . . . . 5010 1 1706 . 1 1 143 143 PHE N N 15 122.7 0.25 . 1 . . . . . . . . 5010 1 1707 . 1 1 143 143 PHE H H 1 9.52 0.02 . 1 . . . . . . . . 5010 1 1708 . 1 1 143 143 PHE CA C 13 56.4 0.3 . 1 . . . . . . . . 5010 1 1709 . 1 1 143 143 PHE HA H 1 5.22 0.02 . 1 . . . . . . . . 5010 1 1710 . 1 1 143 143 PHE CB C 13 43.1 0.3 . 1 . . . . . . . . 5010 1 1711 . 1 1 143 143 PHE HB2 H 1 2.64 0.02 . 2 . . . . . . . . 5010 1 1712 . 1 1 143 143 PHE HB3 H 1 2.84 0.02 . 2 . . . . . . . . 5010 1 1713 . 1 1 143 143 PHE HD1 H 1 6.83 0.02 . 1 . . . . . . . . 5010 1 1714 . 1 1 143 143 PHE HD2 H 1 6.83 0.02 . 1 . . . . . . . . 5010 1 1715 . 1 1 143 143 PHE HE1 H 1 7.30 0.02 . 1 . . . . . . . . 5010 1 1716 . 1 1 143 143 PHE HE2 H 1 7.30 0.02 . 1 . . . . . . . . 5010 1 1717 . 1 1 143 143 PHE HZ H 1 7.08 0.02 . 1 . . . . . . . . 5010 1 1718 . 1 1 143 143 PHE C C 13 175.5 0.3 . 1 . . . . . . . . 5010 1 1719 . 1 1 144 144 LYS N N 15 123.0 0.25 . 1 . . . . . . . . 5010 1 1720 . 1 1 144 144 LYS H H 1 9.00 0.02 . 1 . . . . . . . . 5010 1 1721 . 1 1 144 144 LYS CA C 13 55.7 0.3 . 1 . . . . . . . . 5010 1 1722 . 1 1 144 144 LYS HA H 1 4.78 0.02 . 1 . . . . . . . . 5010 1 1723 . 1 1 144 144 LYS CB C 13 34.6 0.3 . 1 . . . . . . . . 5010 1 1724 . 1 1 144 144 LYS HB2 H 1 1.57 0.02 . 2 . . . . . . . . 5010 1 1725 . 1 1 144 144 LYS HB3 H 1 1.82 0.02 . 2 . . . . . . . . 5010 1 1726 . 1 1 144 144 LYS CG C 13 25.1 0.3 . 1 . . . . . . . . 5010 1 1727 . 1 1 144 144 LYS HG2 H 1 1.23 0.02 . 2 . . . . . . . . 5010 1 1728 . 1 1 144 144 LYS HG3 H 1 1.40 0.02 . 2 . . . . . . . . 5010 1 1729 . 1 1 144 144 LYS CD C 13 30.3 0.3 . 1 . . . . . . . . 5010 1 1730 . 1 1 144 144 LYS HD2 H 1 2.04 0.02 . 2 . . . . . . . . 5010 1 1731 . 1 1 144 144 LYS CE C 13 42.3 0.3 . 1 . . . . . . . . 5010 1 1732 . 1 1 144 144 LYS HE2 H 1 2.84 0.02 . 2 . . . . . . . . 5010 1 1733 . 1 1 144 144 LYS C C 13 174.0 0.3 . 1 . . . . . . . . 5010 1 1734 . 1 1 145 145 ASN N N 15 127.2 0.25 . 1 . . . . . . . . 5010 1 1735 . 1 1 145 145 ASN H H 1 9.39 0.02 . 1 . . . . . . . . 5010 1 1736 . 1 1 145 145 ASN CA C 13 55.4 0.3 . 1 . . . . . . . . 5010 1 1737 . 1 1 145 145 ASN HA H 1 4.37 0.02 . 1 . . . . . . . . 5010 1 1738 . 1 1 145 145 ASN CB C 13 37.1 0.3 . 1 . . . . . . . . 5010 1 1739 . 1 1 145 145 ASN HB2 H 1 3.14 0.02 . 2 . . . . . . . . 5010 1 1740 . 1 1 145 145 ASN HB3 H 1 3.01 0.02 . 2 . . . . . . . . 5010 1 1741 . 1 1 145 145 ASN ND2 N 15 113.5 0.25 . 1 . . . . . . . . 5010 1 1742 . 1 1 145 145 ASN HD21 H 1 7.04 0.02 . 2 . . . . . . . . 5010 1 1743 . 1 1 145 145 ASN HD22 H 1 7.78 0.02 . 2 . . . . . . . . 5010 1 1744 . 1 1 145 145 ASN C C 13 174.9 0.3 . 1 . . . . . . . . 5010 1 1745 . 1 1 146 146 GLN N N 15 112.6 0.25 . 1 . . . . . . . . 5010 1 1746 . 1 1 146 146 GLN H H 1 9.05 0.02 . 1 . . . . . . . . 5010 1 1747 . 1 1 146 146 GLN CA C 13 57.1 0.3 . 1 . . . . . . . . 5010 1 1748 . 1 1 146 146 GLN HA H 1 4.06 0.02 . 1 . . . . . . . . 5010 1 1749 . 1 1 146 146 GLN CB C 13 27.8 0.3 . 1 . . . . . . . . 5010 1 1750 . 1 1 146 146 GLN HB2 H 1 2.35 0.02 . 2 . . . . . . . . 5010 1 1751 . 1 1 146 146 GLN CG C 13 34.6 0.3 . 1 . . . . . . . . 5010 1 1752 . 1 1 146 146 GLN HG2 H 1 2.32 0.02 . 2 . . . . . . . . 5010 1 1753 . 1 1 146 146 GLN NE2 N 15 111.9 0.25 . 1 . . . . . . . . 5010 1 1754 . 1 1 146 146 GLN HE21 H 1 6.88 0.02 . 2 . . . . . . . . 5010 1 1755 . 1 1 146 146 GLN HE22 H 1 7.49 0.02 . 2 . . . . . . . . 5010 1 1756 . 1 1 146 146 GLN C C 13 175.3 0.3 . 1 . . . . . . . . 5010 1 1757 . 1 1 147 147 THR N N 15 117.2 0.25 . 1 . . . . . . . . 5010 1 1758 . 1 1 147 147 THR H H 1 8.07 0.02 . 1 . . . . . . . . 5010 1 1759 . 1 1 147 147 THR CA C 13 61.9 0.3 . 1 . . . . . . . . 5010 1 1760 . 1 1 147 147 THR HA H 1 4.68 0.02 . 1 . . . . . . . . 5010 1 1761 . 1 1 147 147 THR CB C 13 71.0 0.3 . 1 . . . . . . . . 5010 1 1762 . 1 1 147 147 THR HB H 1 4.25 0.02 . 1 . . . . . . . . 5010 1 1763 . 1 1 147 147 THR HG21 H 1 1.40 0.02 . 1 . . . . . . . . 5010 1 1764 . 1 1 147 147 THR HG22 H 1 1.40 0.02 . 1 . . . . . . . . 5010 1 1765 . 1 1 147 147 THR HG23 H 1 1.40 0.02 . 1 . . . . . . . . 5010 1 1766 . 1 1 147 147 THR CG2 C 13 21.5 0.3 . 1 . . . . . . . . 5010 1 1767 . 1 1 147 147 THR C C 13 173.2 0.3 . 1 . . . . . . . . 5010 1 1768 . 1 1 148 148 LEU N N 15 130.2 0.25 . 1 . . . . . . . . 5010 1 1769 . 1 1 148 148 LEU H H 1 8.80 0.02 . 1 . . . . . . . . 5010 1 1770 . 1 1 148 148 LEU CA C 13 55.7 0.3 . 1 . . . . . . . . 5010 1 1771 . 1 1 148 148 LEU HA H 1 3.75 0.02 . 1 . . . . . . . . 5010 1 1772 . 1 1 148 148 LEU CB C 13 42.8 0.3 . 1 . . . . . . . . 5010 1 1773 . 1 1 148 148 LEU HB2 H 1 1.55 0.02 . 2 . . . . . . . . 5010 1 1774 . 1 1 148 148 LEU HB3 H 1 1.41 0.02 . 2 . . . . . . . . 5010 1 1775 . 1 1 148 148 LEU CG C 13 26.7 0.3 . 1 . . . . . . . . 5010 1 1776 . 1 1 148 148 LEU HG H 1 1.16 0.02 . 1 . . . . . . . . 5010 1 1777 . 1 1 148 148 LEU HD11 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 1778 . 1 1 148 148 LEU HD12 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 1779 . 1 1 148 148 LEU HD13 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 1780 . 1 1 148 148 LEU HD21 H 1 0.47 0.02 . 2 . . . . . . . . 5010 1 1781 . 1 1 148 148 LEU HD22 H 1 0.47 0.02 . 2 . . . . . . . . 5010 1 1782 . 1 1 148 148 LEU HD23 H 1 0.47 0.02 . 2 . . . . . . . . 5010 1 1783 . 1 1 148 148 LEU CD1 C 13 25.9 0.3 . 1 . . . . . . . . 5010 1 1784 . 1 1 148 148 LEU CD2 C 13 24.0 0.3 . 1 . . . . . . . . 5010 1 1785 . 1 1 148 148 LEU C C 13 176.8 0.3 . 1 . . . . . . . . 5010 1 1786 . 1 1 149 149 VAL N N 15 130.7 0.25 . 1 . . . . . . . . 5010 1 1787 . 1 1 149 149 VAL H H 1 9.15 0.02 . 1 . . . . . . . . 5010 1 1788 . 1 1 149 149 VAL CA C 13 59.4 0.3 . 1 . . . . . . . . 5010 1 1789 . 1 1 149 149 VAL HA H 1 4.34 0.02 . 1 . . . . . . . . 5010 1 1790 . 1 1 149 149 VAL CB C 13 32.7 0.3 . 1 . . . . . . . . 5010 1 1791 . 1 1 149 149 VAL HB H 1 1.91 0.02 . 1 . . . . . . . . 5010 1 1792 . 1 1 149 149 VAL HG11 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 1793 . 1 1 149 149 VAL HG12 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 1794 . 1 1 149 149 VAL HG13 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 1795 . 1 1 149 149 VAL HG21 H 1 1.03 0.02 . 2 . . . . . . . . 5010 1 1796 . 1 1 149 149 VAL HG22 H 1 1.03 0.02 . 2 . . . . . . . . 5010 1 1797 . 1 1 149 149 VAL HG23 H 1 1.03 0.02 . 2 . . . . . . . . 5010 1 1798 . 1 1 149 149 VAL CG1 C 13 21.0 0.3 . 1 . . . . . . . . 5010 1 1799 . 1 1 149 149 VAL CG2 C 13 22.1 0.3 . 1 . . . . . . . . 5010 1 1800 . 1 1 150 150 PRO CD C 13 50.7 0.3 . 1 . . . . . . . . 5010 1 1801 . 1 1 150 150 PRO CA C 13 62.5 0.3 . 1 . . . . . . . . 5010 1 1802 . 1 1 150 150 PRO HA H 1 4.64 0.02 . 1 . . . . . . . . 5010 1 1803 . 1 1 150 150 PRO CB C 13 30.0 0.3 . 1 . . . . . . . . 5010 1 1804 . 1 1 150 150 PRO HB2 H 1 2.05 0.02 . 2 . . . . . . . . 5010 1 1805 . 1 1 150 150 PRO HB3 H 1 2.15 0.02 . 2 . . . . . . . . 5010 1 1806 . 1 1 150 150 PRO CG C 13 27.2 0.3 . 1 . . . . . . . . 5010 1 1807 . 1 1 150 150 PRO HG2 H 1 2.10 0.02 . 2 . . . . . . . . 5010 1 1808 . 1 1 150 150 PRO HD2 H 1 3.78 0.02 . 2 . . . . . . . . 5010 1 1809 . 1 1 150 150 PRO HD3 H 1 3.98 0.02 . 2 . . . . . . . . 5010 1 1810 . 1 1 150 150 PRO C C 13 176.1 0.3 . 1 . . . . . . . . 5010 1 1811 . 1 1 151 151 LEU N N 15 123.7 0.25 . 1 . . . . . . . . 5010 1 1812 . 1 1 151 151 LEU H H 1 8.05 0.02 . 1 . . . . . . . . 5010 1 1813 . 1 1 151 151 LEU CA C 13 54.3 0.3 . 1 . . . . . . . . 5010 1 1814 . 1 1 151 151 LEU HA H 1 4.50 0.02 . 1 . . . . . . . . 5010 1 1815 . 1 1 151 151 LEU CB C 13 45.3 0.3 . 1 . . . . . . . . 5010 1 1816 . 1 1 151 151 LEU HB2 H 1 1.82 0.02 . 2 . . . . . . . . 5010 1 1817 . 1 1 151 151 LEU HB3 H 1 1.29 0.02 . 2 . . . . . . . . 5010 1 1818 . 1 1 151 151 LEU CG C 13 26.7 0.3 . 1 . . . . . . . . 5010 1 1819 . 1 1 151 151 LEU HG H 1 1.69 0.02 . 1 . . . . . . . . 5010 1 1820 . 1 1 151 151 LEU HD11 H 1 0.84 0.02 . 2 . . . . . . . . 5010 1 1821 . 1 1 151 151 LEU HD12 H 1 0.84 0.02 . 2 . . . . . . . . 5010 1 1822 . 1 1 151 151 LEU HD13 H 1 0.84 0.02 . 2 . . . . . . . . 5010 1 1823 . 1 1 151 151 LEU HD21 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 1824 . 1 1 151 151 LEU HD22 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 1825 . 1 1 151 151 LEU HD23 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 1826 . 1 1 151 151 LEU CD1 C 13 23.1 0.3 . 1 . . . . . . . . 5010 1 1827 . 1 1 151 151 LEU CD2 C 13 25.9 0.3 . 1 . . . . . . . . 5010 1 1828 . 1 1 151 151 LEU C C 13 177.7 0.3 . 1 . . . . . . . . 5010 1 1829 . 1 1 152 152 LYS N N 15 126.5 0.25 . 1 . . . . . . . . 5010 1 1830 . 1 1 152 152 LYS H H 1 9.09 0.02 . 1 . . . . . . . . 5010 1 1831 . 1 1 152 152 LYS CA C 13 55.1 0.3 . 1 . . . . . . . . 5010 1 1832 . 1 1 152 152 LYS HA H 1 4.55 0.02 . 1 . . . . . . . . 5010 1 1833 . 1 1 152 152 LYS CB C 13 33.3 0.3 . 1 . . . . . . . . 5010 1 1834 . 1 1 152 152 LYS HB2 H 1 1.85 0.02 . 2 . . . . . . . . 5010 1 1835 . 1 1 152 152 LYS CG C 13 24.8 0.3 . 1 . . . . . . . . 5010 1 1836 . 1 1 152 152 LYS HG2 H 1 1.38 0.02 . 2 . . . . . . . . 5010 1 1837 . 1 1 152 152 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 5010 1 1838 . 1 1 152 152 LYS HD2 H 1 1.81 0.02 . 2 . . . . . . . . 5010 1 1839 . 1 1 152 152 LYS CE C 13 42.3 0.3 . 1 . . . . . . . . 5010 1 1840 . 1 1 152 152 LYS HE2 H 1 3.07 0.02 . 2 . . . . . . . . 5010 1 1841 . 1 1 152 152 LYS C C 13 175.4 0.3 . 1 . . . . . . . . 5010 1 1842 . 1 1 153 153 ILE N N 15 114.2 0.25 . 1 . . . . . . . . 5010 1 1843 . 1 1 153 153 ILE H H 1 7.28 0.02 . 1 . . . . . . . . 5010 1 1844 . 1 1 153 153 ILE CA C 13 58.9 0.3 . 1 . . . . . . . . 5010 1 1845 . 1 1 153 153 ILE HA H 1 4.69 0.02 . 1 . . . . . . . . 5010 1 1846 . 1 1 153 153 ILE CB C 13 42.8 0.3 . 1 . . . . . . . . 5010 1 1847 . 1 1 153 153 ILE HB H 1 1.93 0.02 . 1 . . . . . . . . 5010 1 1848 . 1 1 153 153 ILE HG21 H 1 0.81 0.02 . 1 . . . . . . . . 5010 1 1849 . 1 1 153 153 ILE HG22 H 1 0.81 0.02 . 1 . . . . . . . . 5010 1 1850 . 1 1 153 153 ILE HG23 H 1 0.81 0.02 . 1 . . . . . . . . 5010 1 1851 . 1 1 153 153 ILE CG2 C 13 20.7 0.3 . 1 . . . . . . . . 5010 1 1852 . 1 1 153 153 ILE CG1 C 13 25.9 0.3 . 1 . . . . . . . . 5010 1 1853 . 1 1 153 153 ILE HG12 H 1 1.29 0.02 . 2 . . . . . . . . 5010 1 1854 . 1 1 153 153 ILE HG13 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 1855 . 1 1 153 153 ILE HD11 H 1 0.56 0.02 . 1 . . . . . . . . 5010 1 1856 . 1 1 153 153 ILE HD12 H 1 0.56 0.02 . 1 . . . . . . . . 5010 1 1857 . 1 1 153 153 ILE HD13 H 1 0.56 0.02 . 1 . . . . . . . . 5010 1 1858 . 1 1 153 153 ILE CD1 C 13 15.5 0.3 . 1 . . . . . . . . 5010 1 1859 . 1 1 153 153 ILE C C 13 176.0 0.3 . 1 . . . . . . . . 5010 1 1860 . 1 1 154 154 THR N N 15 111.5 0.25 . 1 . . . . . . . . 5010 1 1861 . 1 1 154 154 THR H H 1 9.41 0.02 . 1 . . . . . . . . 5010 1 1862 . 1 1 154 154 THR CA C 13 62.3 0.3 . 1 . . . . . . . . 5010 1 1863 . 1 1 154 154 THR HA H 1 4.65 0.02 . 1 . . . . . . . . 5010 1 1864 . 1 1 154 154 THR CB C 13 71.0 0.3 . 1 . . . . . . . . 5010 1 1865 . 1 1 154 154 THR HB H 1 4.38 0.02 . 1 . . . . . . . . 5010 1 1866 . 1 1 154 154 THR HG21 H 1 1.25 0.02 . 1 . . . . . . . . 5010 1 1867 . 1 1 154 154 THR HG22 H 1 1.25 0.02 . 1 . . . . . . . . 5010 1 1868 . 1 1 154 154 THR HG23 H 1 1.25 0.02 . 1 . . . . . . . . 5010 1 1869 . 1 1 154 154 THR CG2 C 13 21.7 0.3 . 1 . . . . . . . . 5010 1 1870 . 1 1 154 154 THR C C 13 174.9 0.3 . 1 . . . . . . . . 5010 1 1871 . 1 1 155 155 THR N N 15 111.4 0.25 . 1 . . . . . . . . 5010 1 1872 . 1 1 155 155 THR H H 1 7.73 0.02 . 1 . . . . . . . . 5010 1 1873 . 1 1 155 155 THR CA C 13 59.0 0.3 . 1 . . . . . . . . 5010 1 1874 . 1 1 155 155 THR HA H 1 5.02 0.02 . 1 . . . . . . . . 5010 1 1875 . 1 1 155 155 THR CB C 13 73.2 0.3 . 1 . . . . . . . . 5010 1 1876 . 1 1 155 155 THR HB H 1 4.79 0.02 . 1 . . . . . . . . 5010 1 1877 . 1 1 155 155 THR HG21 H 1 1.25 0.02 . 1 . . . . . . . . 5010 1 1878 . 1 1 155 155 THR HG22 H 1 1.25 0.02 . 1 . . . . . . . . 5010 1 1879 . 1 1 155 155 THR HG23 H 1 1.25 0.02 . 1 . . . . . . . . 5010 1 1880 . 1 1 155 155 THR CG2 C 13 21.5 0.3 . 1 . . . . . . . . 5010 1 1881 . 1 1 155 155 THR C C 13 174.8 0.3 . 1 . . . . . . . . 5010 1 1882 . 1 1 156 156 GLU N N 15 124.3 0.25 . 1 . . . . . . . . 5010 1 1883 . 1 1 156 156 GLU H H 1 9.49 0.02 . 1 . . . . . . . . 5010 1 1884 . 1 1 156 156 GLU CA C 13 59.5 0.3 . 1 . . . . . . . . 5010 1 1885 . 1 1 156 156 GLU HA H 1 3.76 0.02 . 1 . . . . . . . . 5010 1 1886 . 1 1 156 156 GLU CB C 13 30.0 0.3 . 1 . . . . . . . . 5010 1 1887 . 1 1 156 156 GLU HB2 H 1 2.21 0.02 . 2 . . . . . . . . 5010 1 1888 . 1 1 156 156 GLU CG C 13 36.8 0.3 . 1 . . . . . . . . 5010 1 1889 . 1 1 156 156 GLU HG2 H 1 2.54 0.02 . 2 . . . . . . . . 5010 1 1890 . 1 1 156 156 GLU C C 13 177.7 0.3 . 1 . . . . . . . . 5010 1 1891 . 1 1 157 157 LYS N N 15 119.1 0.25 . 1 . . . . . . . . 5010 1 1892 . 1 1 157 157 LYS H H 1 8.36 0.02 . 1 . . . . . . . . 5010 1 1893 . 1 1 157 157 LYS CA C 13 60.3 0.3 . 1 . . . . . . . . 5010 1 1894 . 1 1 157 157 LYS HA H 1 3.87 0.02 . 1 . . . . . . . . 5010 1 1895 . 1 1 157 157 LYS CB C 13 32.4 0.3 . 1 . . . . . . . . 5010 1 1896 . 1 1 157 157 LYS HB2 H 1 1.62 0.02 . 2 . . . . . . . . 5010 1 1897 . 1 1 157 157 LYS HB3 H 1 1.51 0.02 . 2 . . . . . . . . 5010 1 1898 . 1 1 157 157 LYS CG C 13 25.0 0.3 . 1 . . . . . . . . 5010 1 1899 . 1 1 157 157 LYS HG2 H 1 0.77 0.02 . 2 . . . . . . . . 5010 1 1900 . 1 1 157 157 LYS HG3 H 1 0.93 0.02 . 2 . . . . . . . . 5010 1 1901 . 1 1 157 157 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 5010 1 1902 . 1 1 157 157 LYS HD2 H 1 1.31 0.02 . 2 . . . . . . . . 5010 1 1903 . 1 1 157 157 LYS HD3 H 1 1.18 0.02 . 2 . . . . . . . . 5010 1 1904 . 1 1 157 157 LYS CE C 13 42.0 0.3 . 1 . . . . . . . . 5010 1 1905 . 1 1 157 157 LYS HE2 H 1 2.99 0.02 . 2 . . . . . . . . 5010 1 1906 . 1 1 157 157 LYS C C 13 178.6 0.3 . 1 . . . . . . . . 5010 1 1907 . 1 1 158 158 GLU N N 15 117.7 0.25 . 1 . . . . . . . . 5010 1 1908 . 1 1 158 158 GLU H H 1 7.67 0.02 . 1 . . . . . . . . 5010 1 1909 . 1 1 158 158 GLU CA C 13 59.2 0.3 . 1 . . . . . . . . 5010 1 1910 . 1 1 158 158 GLU HA H 1 3.92 0.02 . 1 . . . . . . . . 5010 1 1911 . 1 1 158 158 GLU CB C 13 30.4 0.3 . 1 . . . . . . . . 5010 1 1912 . 1 1 158 158 GLU HB2 H 1 2.09 0.02 . 2 . . . . . . . . 5010 1 1913 . 1 1 158 158 GLU HB3 H 1 2.12 0.02 . 2 . . . . . . . . 5010 1 1914 . 1 1 158 158 GLU CG C 13 36.8 0.3 . 1 . . . . . . . . 5010 1 1915 . 1 1 158 158 GLU HG2 H 1 2.32 0.02 . 2 . . . . . . . . 5010 1 1916 . 1 1 158 158 GLU C C 13 179.1 0.3 . 1 . . . . . . . . 5010 1 1917 . 1 1 159 159 LEU N N 15 120.3 0.25 . 1 . . . . . . . . 5010 1 1918 . 1 1 159 159 LEU H H 1 7.71 0.02 . 1 . . . . . . . . 5010 1 1919 . 1 1 159 159 LEU CA C 13 58.5 0.3 . 1 . . . . . . . . 5010 1 1920 . 1 1 159 159 LEU HA H 1 3.74 0.02 . 1 . . . . . . . . 5010 1 1921 . 1 1 159 159 LEU CB C 13 40.8 0.3 . 1 . . . . . . . . 5010 1 1922 . 1 1 159 159 LEU HB2 H 1 0.99 0.02 . 2 . . . . . . . . 5010 1 1923 . 1 1 159 159 LEU HB3 H 1 2.13 0.02 . 2 . . . . . . . . 5010 1 1924 . 1 1 159 159 LEU CG C 13 27.2 0.3 . 1 . . . . . . . . 5010 1 1925 . 1 1 159 159 LEU HG H 1 1.01 0.02 . 1 . . . . . . . . 5010 1 1926 . 1 1 159 159 LEU HD11 H 1 0.37 0.02 . 2 . . . . . . . . 5010 1 1927 . 1 1 159 159 LEU HD12 H 1 0.37 0.02 . 2 . . . . . . . . 5010 1 1928 . 1 1 159 159 LEU HD13 H 1 0.37 0.02 . 2 . . . . . . . . 5010 1 1929 . 1 1 159 159 LEU HD21 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 1930 . 1 1 159 159 LEU HD22 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 1931 . 1 1 159 159 LEU HD23 H 1 0.67 0.02 . 2 . . . . . . . . 5010 1 1932 . 1 1 159 159 LEU CD1 C 13 26.1 0.3 . 1 . . . . . . . . 5010 1 1933 . 1 1 159 159 LEU CD2 C 13 23.4 0.3 . 1 . . . . . . . . 5010 1 1934 . 1 1 159 159 LEU C C 13 176.4 0.3 . 1 . . . . . . . . 5010 1 1935 . 1 1 160 160 ILE N N 15 118.0 0.25 . 1 . . . . . . . . 5010 1 1936 . 1 1 160 160 ILE H H 1 7.89 0.02 . 1 . . . . . . . . 5010 1 1937 . 1 1 160 160 ILE CA C 13 65.8 0.3 . 1 . . . . . . . . 5010 1 1938 . 1 1 160 160 ILE HA H 1 3.24 0.02 . 1 . . . . . . . . 5010 1 1939 . 1 1 160 160 ILE CB C 13 38.7 0.3 . 1 . . . . . . . . 5010 1 1940 . 1 1 160 160 ILE HB H 1 1.90 0.02 . 1 . . . . . . . . 5010 1 1941 . 1 1 160 160 ILE HG21 H 1 0.98 0.02 . 1 . . . . . . . . 5010 1 1942 . 1 1 160 160 ILE HG22 H 1 0.98 0.02 . 1 . . . . . . . . 5010 1 1943 . 1 1 160 160 ILE HG23 H 1 0.98 0.02 . 1 . . . . . . . . 5010 1 1944 . 1 1 160 160 ILE CG2 C 13 18.0 0.3 . 1 . . . . . . . . 5010 1 1945 . 1 1 160 160 ILE CG1 C 13 30.5 0.3 . 1 . . . . . . . . 5010 1 1946 . 1 1 160 160 ILE HG12 H 1 1.51 0.02 . 2 . . . . . . . . 5010 1 1947 . 1 1 160 160 ILE HG13 H 1 0.80 0.02 . 2 . . . . . . . . 5010 1 1948 . 1 1 160 160 ILE HD11 H 1 1.04 0.02 . 1 . . . . . . . . 5010 1 1949 . 1 1 160 160 ILE HD12 H 1 1.04 0.02 . 1 . . . . . . . . 5010 1 1950 . 1 1 160 160 ILE HD13 H 1 1.04 0.02 . 1 . . . . . . . . 5010 1 1951 . 1 1 160 160 ILE CD1 C 13 14.4 0.3 . 1 . . . . . . . . 5010 1 1952 . 1 1 160 160 ILE C C 13 177.3 0.3 . 1 . . . . . . . . 5010 1 1953 . 1 1 161 161 LYS N N 15 117.5 0.25 . 1 . . . . . . . . 5010 1 1954 . 1 1 161 161 LYS H H 1 7.57 0.02 . 1 . . . . . . . . 5010 1 1955 . 1 1 161 161 LYS CA C 13 59.3 0.3 . 1 . . . . . . . . 5010 1 1956 . 1 1 161 161 LYS HA H 1 4.31 0.02 . 1 . . . . . . . . 5010 1 1957 . 1 1 161 161 LYS CB C 13 32.2 0.3 . 1 . . . . . . . . 5010 1 1958 . 1 1 161 161 LYS HB2 H 1 1.96 0.02 . 2 . . . . . . . . 5010 1 1959 . 1 1 161 161 LYS CG C 13 24.8 0.3 . 1 . . . . . . . . 5010 1 1960 . 1 1 161 161 LYS HG2 H 1 1.49 0.02 . 2 . . . . . . . . 5010 1 1961 . 1 1 161 161 LYS HG3 H 1 1.62 0.02 . 2 . . . . . . . . 5010 1 1962 . 1 1 161 161 LYS CD C 13 29.2 0.3 . 1 . . . . . . . . 5010 1 1963 . 1 1 161 161 LYS HD2 H 1 1.74 0.02 . 2 . . . . . . . . 5010 1 1964 . 1 1 161 161 LYS CE C 13 41.5 0.3 . 1 . . . . . . . . 5010 1 1965 . 1 1 161 161 LYS HE2 H 1 3.01 0.02 . 2 . . . . . . . . 5010 1 1966 . 1 1 161 161 LYS C C 13 180.9 0.3 . 1 . . . . . . . . 5010 1 1967 . 1 1 162 162 GLU N N 15 121.9 0.25 . 1 . . . . . . . . 5010 1 1968 . 1 1 162 162 GLU H H 1 8.38 0.02 . 1 . . . . . . . . 5010 1 1969 . 1 1 162 162 GLU CA C 13 58.4 0.3 . 1 . . . . . . . . 5010 1 1970 . 1 1 162 162 GLU HA H 1 4.06 0.02 . 1 . . . . . . . . 5010 1 1971 . 1 1 162 162 GLU CB C 13 29.0 0.3 . 1 . . . . . . . . 5010 1 1972 . 1 1 162 162 GLU HB2 H 1 2.04 0.02 . 2 . . . . . . . . 5010 1 1973 . 1 1 162 162 GLU HB3 H 1 2.12 0.02 . 2 . . . . . . . . 5010 1 1974 . 1 1 162 162 GLU CG C 13 35.4 0.3 . 1 . . . . . . . . 5010 1 1975 . 1 1 162 162 GLU HG2 H 1 2.13 0.02 . 2 . . . . . . . . 5010 1 1976 . 1 1 162 162 GLU HG3 H 1 2.39 0.02 . 2 . . . . . . . . 5010 1 1977 . 1 1 162 162 GLU C C 13 178.8 0.3 . 1 . . . . . . . . 5010 1 1978 . 1 1 163 163 LEU N N 15 116.3 0.25 . 1 . . . . . . . . 5010 1 1979 . 1 1 163 163 LEU H H 1 7.91 0.02 . 1 . . . . . . . . 5010 1 1980 . 1 1 163 163 LEU CA C 13 55.4 0.3 . 1 . . . . . . . . 5010 1 1981 . 1 1 163 163 LEU HA H 1 4.06 0.02 . 1 . . . . . . . . 5010 1 1982 . 1 1 163 163 LEU CB C 13 42.4 0.3 . 1 . . . . . . . . 5010 1 1983 . 1 1 163 163 LEU HB2 H 1 1.58 0.02 . 2 . . . . . . . . 5010 1 1984 . 1 1 163 163 LEU CG C 13 25.9 0.3 . 1 . . . . . . . . 5010 1 1985 . 1 1 163 163 LEU HG H 1 2.04 0.02 . 1 . . . . . . . . 5010 1 1986 . 1 1 163 163 LEU HD11 H 1 0.80 0.02 . 2 . . . . . . . . 5010 1 1987 . 1 1 163 163 LEU HD12 H 1 0.80 0.02 . 2 . . . . . . . . 5010 1 1988 . 1 1 163 163 LEU HD13 H 1 0.80 0.02 . 2 . . . . . . . . 5010 1 1989 . 1 1 163 163 LEU HD21 H 1 0.72 0.02 . 2 . . . . . . . . 5010 1 1990 . 1 1 163 163 LEU HD22 H 1 0.72 0.02 . 2 . . . . . . . . 5010 1 1991 . 1 1 163 163 LEU HD23 H 1 0.72 0.02 . 2 . . . . . . . . 5010 1 1992 . 1 1 163 163 LEU CD1 C 13 22.9 0.3 . 1 . . . . . . . . 5010 1 1993 . 1 1 163 163 LEU C C 13 176.8 0.3 . 1 . . . . . . . . 5010 1 1994 . 1 1 164 164 GLY N N 15 104.3 0.25 . 1 . . . . . . . . 5010 1 1995 . 1 1 164 164 GLY H H 1 7.69 0.02 . 1 . . . . . . . . 5010 1 1996 . 1 1 164 164 GLY CA C 13 45.0 0.3 . 1 . . . . . . . . 5010 1 1997 . 1 1 164 164 GLY HA2 H 1 3.95 0.02 . 2 . . . . . . . . 5010 1 1998 . 1 1 164 164 GLY HA3 H 1 3.67 0.02 . 2 . . . . . . . . 5010 1 1999 . 1 1 164 164 GLY C C 13 174.5 0.3 . 1 . . . . . . . . 5010 1 2000 . 1 1 165 165 PHE N N 15 118.6 0.25 . 1 . . . . . . . . 5010 1 2001 . 1 1 165 165 PHE H H 1 7.34 0.02 . 1 . . . . . . . . 5010 1 2002 . 1 1 165 165 PHE CA C 13 56.1 0.3 . 1 . . . . . . . . 5010 1 2003 . 1 1 165 165 PHE HA H 1 4.94 0.02 . 1 . . . . . . . . 5010 1 2004 . 1 1 165 165 PHE CB C 13 41.2 0.3 . 1 . . . . . . . . 5010 1 2005 . 1 1 165 165 PHE HB2 H 1 3.49 0.02 . 2 . . . . . . . . 5010 1 2006 . 1 1 165 165 PHE HB3 H 1 2.70 0.02 . 2 . . . . . . . . 5010 1 2007 . 1 1 165 165 PHE HD1 H 1 7.24 0.02 . 1 . . . . . . . . 5010 1 2008 . 1 1 165 165 PHE HD2 H 1 7.24 0.02 . 1 . . . . . . . . 5010 1 2009 . 1 1 165 165 PHE HE1 H 1 7.23 0.02 . 1 . . . . . . . . 5010 1 2010 . 1 1 165 165 PHE HE2 H 1 7.23 0.02 . 1 . . . . . . . . 5010 1 2011 . 1 1 165 165 PHE C C 13 174.8 0.3 . 1 . . . . . . . . 5010 1 2012 . 1 1 166 166 THR N N 15 117.5 0.25 . 1 . . . . . . . . 5010 1 2013 . 1 1 166 166 THR H H 1 8.66 0.02 . 1 . . . . . . . . 5010 1 2014 . 1 1 166 166 THR CA C 13 62.6 0.3 . 1 . . . . . . . . 5010 1 2015 . 1 1 166 166 THR HA H 1 4.23 0.02 . 1 . . . . . . . . 5010 1 2016 . 1 1 166 166 THR CB C 13 69.6 0.3 . 1 . . . . . . . . 5010 1 2017 . 1 1 166 166 THR HB H 1 4.10 0.02 . 1 . . . . . . . . 5010 1 2018 . 1 1 166 166 THR HG21 H 1 1.31 0.02 . 1 . . . . . . . . 5010 1 2019 . 1 1 166 166 THR HG22 H 1 1.31 0.02 . 1 . . . . . . . . 5010 1 2020 . 1 1 166 166 THR HG23 H 1 1.31 0.02 . 1 . . . . . . . . 5010 1 2021 . 1 1 166 166 THR CG2 C 13 21.8 0.3 . 1 . . . . . . . . 5010 1 2022 . 1 1 166 166 THR C C 13 174.3 0.3 . 1 . . . . . . . . 5010 1 2023 . 1 1 167 167 TYR N N 15 128.6 0.25 . 1 . . . . . . . . 5010 1 2024 . 1 1 167 167 TYR H H 1 9.08 0.02 . 1 . . . . . . . . 5010 1 2025 . 1 1 167 167 TYR CA C 13 60.8 0.3 . 1 . . . . . . . . 5010 1 2026 . 1 1 167 167 TYR HA H 1 4.13 0.02 . 1 . . . . . . . . 5010 1 2027 . 1 1 167 167 TYR CB C 13 38.2 0.3 . 1 . . . . . . . . 5010 1 2028 . 1 1 167 167 TYR HB2 H 1 3.13 0.02 . 2 . . . . . . . . 5010 1 2029 . 1 1 167 167 TYR HB3 H 1 2.88 0.02 . 2 . . . . . . . . 5010 1 2030 . 1 1 167 167 TYR HD1 H 1 7.06 0.02 . 1 . . . . . . . . 5010 1 2031 . 1 1 167 167 TYR HD2 H 1 7.06 0.02 . 1 . . . . . . . . 5010 1 2032 . 1 1 167 167 TYR HE1 H 1 6.71 0.02 . 1 . . . . . . . . 5010 1 2033 . 1 1 167 167 TYR HE2 H 1 6.71 0.02 . 1 . . . . . . . . 5010 1 2034 . 1 1 167 167 TYR C C 13 174.1 0.3 . 1 . . . . . . . . 5010 1 2035 . 1 1 168 168 ARG N N 15 127.2 0.25 . 1 . . . . . . . . 5010 1 2036 . 1 1 168 168 ARG H H 1 7.29 0.02 . 1 . . . . . . . . 5010 1 2037 . 1 1 168 168 ARG CA C 13 52.7 0.3 . 1 . . . . . . . . 5010 1 2038 . 1 1 168 168 ARG HA H 1 4.64 0.02 . 1 . . . . . . . . 5010 1 2039 . 1 1 168 168 ARG CB C 13 33.0 0.3 . 1 . . . . . . . . 5010 1 2040 . 1 1 168 168 ARG HB2 H 1 1.39 0.02 . 2 . . . . . . . . 5010 1 2041 . 1 1 168 168 ARG HB3 H 1 1.17 0.02 . 2 . . . . . . . . 5010 1 2042 . 1 1 168 168 ARG CG C 13 27.0 0.3 . 1 . . . . . . . . 5010 1 2043 . 1 1 168 168 ARG HG2 H 1 1.58 0.02 . 2 . . . . . . . . 5010 1 2044 . 1 1 168 168 ARG CD C 13 43.6 0.3 . 1 . . . . . . . . 5010 1 2045 . 1 1 168 168 ARG HD2 H 1 3.24 0.02 . 2 . . . . . . . . 5010 1 2046 . 1 1 168 168 ARG HD3 H 1 3.03 0.02 . 2 . . . . . . . . 5010 1 2047 . 1 1 168 168 ARG C C 13 175.9 0.3 . 1 . . . . . . . . 5010 1 2048 . 1 1 169 169 ILE N N 15 121.2 0.25 . 1 . . . . . . . . 5010 1 2049 . 1 1 169 169 ILE H H 1 8.49 0.02 . 1 . . . . . . . . 5010 1 2050 . 1 1 169 169 ILE CA C 13 60.9 0.3 . 1 . . . . . . . . 5010 1 2051 . 1 1 169 169 ILE HA H 1 4.23 0.02 . 1 . . . . . . . . 5010 1 2052 . 1 1 169 169 ILE CB C 13 36.0 0.3 . 1 . . . . . . . . 5010 1 2053 . 1 1 169 169 ILE HB H 1 2.27 0.02 . 1 . . . . . . . . 5010 1 2054 . 1 1 169 169 ILE HG21 H 1 1.28 0.02 . 1 . . . . . . . . 5010 1 2055 . 1 1 169 169 ILE HG22 H 1 1.28 0.02 . 1 . . . . . . . . 5010 1 2056 . 1 1 169 169 ILE HG23 H 1 1.28 0.02 . 1 . . . . . . . . 5010 1 2057 . 1 1 169 169 ILE CG2 C 13 17.9 0.3 . 1 . . . . . . . . 5010 1 2058 . 1 1 169 169 ILE CG1 C 13 25.3 0.3 . 1 . . . . . . . . 5010 1 2059 . 1 1 169 169 ILE HG12 H 1 1.44 0.02 . 2 . . . . . . . . 5010 1 2060 . 1 1 169 169 ILE HD11 H 1 1.00 0.02 . 1 . . . . . . . . 5010 1 2061 . 1 1 169 169 ILE HD12 H 1 1.00 0.02 . 1 . . . . . . . . 5010 1 2062 . 1 1 169 169 ILE HD13 H 1 1.00 0.02 . 1 . . . . . . . . 5010 1 2063 . 1 1 169 169 ILE CD1 C 13 14.4 0.3 . 1 . . . . . . . . 5010 1 2064 . 1 1 170 170 PRO HA H 1 3.93 0.02 . 1 . . . . . . . . 5010 1 2065 . 1 1 170 170 PRO HB2 H 1 2.08 0.02 . 2 . . . . . . . . 5010 1 2066 . 1 1 170 170 PRO C C 13 177.4 0.3 . 1 . . . . . . . . 5010 1 2067 . 1 1 171 171 LYS N N 15 113.3 0.25 . 1 . . . . . . . . 5010 1 2068 . 1 1 171 171 LYS H H 1 8.41 0.02 . 1 . . . . . . . . 5010 1 2069 . 1 1 171 171 LYS CA C 13 58.1 0.3 . 1 . . . . . . . . 5010 1 2070 . 1 1 171 171 LYS HA H 1 4.32 0.02 . 1 . . . . . . . . 5010 1 2071 . 1 1 171 171 LYS CB C 13 33.2 0.3 . 1 . . . . . . . . 5010 1 2072 . 1 1 171 171 LYS HB2 H 1 1.90 0.02 . 2 . . . . . . . . 5010 1 2073 . 1 1 171 171 LYS CG C 13 24.2 0.3 . 1 . . . . . . . . 5010 1 2074 . 1 1 171 171 LYS HG2 H 1 1.46 0.02 . 2 . . . . . . . . 5010 1 2075 . 1 1 171 171 LYS CD C 13 29.8 0.3 . 1 . . . . . . . . 5010 1 2076 . 1 1 171 171 LYS HD2 H 1 1.42 0.02 . 2 . . . . . . . . 5010 1 2077 . 1 1 171 171 LYS CE C 13 41.5 0.3 . 1 . . . . . . . . 5010 1 2078 . 1 1 171 171 LYS HE2 H 1 3.02 0.02 . 2 . . . . . . . . 5010 1 2079 . 1 1 171 171 LYS C C 13 176.4 0.3 . 1 . . . . . . . . 5010 1 2080 . 1 1 172 172 LYS N N 15 117.1 0.25 . 1 . . . . . . . . 5010 1 2081 . 1 1 172 172 LYS H H 1 7.88 0.02 . 1 . . . . . . . . 5010 1 2082 . 1 1 172 172 LYS CA C 13 54.8 0.3 . 1 . . . . . . . . 5010 1 2083 . 1 1 172 172 LYS HA H 1 4.41 0.02 . 1 . . . . . . . . 5010 1 2084 . 1 1 172 172 LYS CB C 13 32.7 0.3 . 1 . . . . . . . . 5010 1 2085 . 1 1 172 172 LYS HB2 H 1 1.59 0.02 . 2 . . . . . . . . 5010 1 2086 . 1 1 172 172 LYS CG C 13 25.6 0.3 . 1 . . . . . . . . 5010 1 2087 . 1 1 172 172 LYS HG2 H 1 1.42 0.02 . 2 . . . . . . . . 5010 1 2088 . 1 1 172 172 LYS HG3 H 1 1.23 0.02 . 2 . . . . . . . . 5010 1 2089 . 1 1 172 172 LYS CD C 13 28.3 0.3 . 1 . . . . . . . . 5010 1 2090 . 1 1 172 172 LYS HD2 H 1 1.76 0.02 . 2 . . . . . . . . 5010 1 2091 . 1 1 172 172 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 5010 1 2092 . 1 1 172 172 LYS HE2 H 1 2.99 0.02 . 2 . . . . . . . . 5010 1 2093 . 1 1 172 172 LYS C C 13 175.7 0.3 . 1 . . . . . . . . 5010 1 2094 . 1 1 173 173 ARG N N 15 121.4 0.25 . 1 . . . . . . . . 5010 1 2095 . 1 1 173 173 ARG H H 1 6.96 0.02 . 1 . . . . . . . . 5010 1 2096 . 1 1 173 173 ARG CA C 13 57.5 0.3 . 1 . . . . . . . . 5010 1 2097 . 1 1 173 173 ARG HA H 1 3.52 0.02 . 1 . . . . . . . . 5010 1 2098 . 1 1 173 173 ARG CB C 13 28.1 0.3 . 1 . . . . . . . . 5010 1 2099 . 1 1 173 173 ARG HB2 H 1 1.38 0.02 . 2 . . . . . . . . 5010 1 2100 . 1 1 173 173 ARG C C 13 173.0 0.3 . 1 . . . . . . . . 5010 1 2101 . 1 1 174 174 LEU N N 15 128.6 0.25 . 1 . . . . . . . . 5010 1 2102 . 1 1 174 174 LEU H H 1 7.40 0.02 . 1 . . . . . . . . 5010 1 2103 . 1 1 174 174 LEU CA C 13 57.0 0.3 . 1 . . . . . . . . 5010 1 2104 . 1 1 174 174 LEU HA H 1 4.12 0.02 . 1 . . . . . . . . 5010 1 2105 . 1 1 174 174 LEU CB C 13 45.3 0.3 . 1 . . . . . . . . 5010 1 2106 . 1 1 174 174 LEU HB2 H 1 1.52 0.02 . 2 . . . . . . . . 5010 1 2107 . 1 1 174 174 LEU HB3 H 1 1.65 0.02 . 2 . . . . . . . . 5010 1 2108 . 1 1 174 174 LEU CG C 13 27.2 0.3 . 1 . . . . . . . . 5010 1 2109 . 1 1 174 174 LEU HG H 1 1.51 0.02 . 1 . . . . . . . . 5010 1 2110 . 1 1 174 174 LEU HD11 H 1 0.91 0.02 . 2 . . . . . . . . 5010 1 2111 . 1 1 174 174 LEU HD12 H 1 0.91 0.02 . 2 . . . . . . . . 5010 1 2112 . 1 1 174 174 LEU HD13 H 1 0.91 0.02 . 2 . . . . . . . . 5010 1 2113 . 1 1 174 174 LEU HD21 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 2114 . 1 1 174 174 LEU HD22 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 2115 . 1 1 174 174 LEU HD23 H 1 0.90 0.02 . 2 . . . . . . . . 5010 1 2116 . 1 1 174 174 LEU CD1 C 13 25.0 0.3 . 1 . . . . . . . . 5010 1 stop_ save_