data_6142 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6142 _Entry.Title ; 1H 13C and 15N resonance assignments for peptide deformylase-actinonin complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2004-03-05 _Entry.Accession_date 2004-03-16 _Entry.Last_release_date . _Entry.Original_release_date . _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 Valery LARUE . . . 6142 2 Adrien BOULAROT . . . 6142 3 Isabelle ARTAUD . . . 6142 4 Thierry MEINNEL . . . 6142 5 Frederic DARDEL . . . 6142 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6142 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 903 6142 '13C chemical shifts' 421 6142 '15N chemical shifts' 135 6142 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 . . 2008-07-01 . update BMRB 'update entry citation' 6142 2 . . 2006-01-12 . original author 'original release' 6142 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6142 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17201406 _Citation.Full_citation . _Citation.Title 'Discovery and Refinement of a New Structural Class of Potent Peptide Deformylase Inhibitors' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Med. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 50 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 10 _Citation.Page_last 20 _Citation.Year 2007 _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 Adrien Boularot . . . 6142 1 2 Carmela Giglione . . . 6142 1 3 Sylvain Petit . . . 6142 1 4 Yann Duroc . . . 6142 1 5 Rodolphe 'de Sousa' . A. . 6142 1 6 Valery Larue . . . 6142 1 7 Thierry Cresteil . . . 6142 1 8 Frederic Dardel . . . 6142 1 9 Isabelle Artaud . . . 6142 1 10 Thierry Meinnel . . . 6142 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_molecular_system _Assembly.Sf_category assembly _Assembly.Sf_framecode molecular_system _Assembly.Entry_ID 6142 _Assembly.ID 1 _Assembly.Name 'PDF 147' _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 'free and other bound' _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 6142 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 'Deformylase complex' 1 $PDF_147 . . . native . . . . . 6142 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'PDF 147' system 6142 1 'PDF 147' abbreviation 6142 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PDF_147 _Entity.Sf_category entity _Entity.Sf_framecode PDF_147 _Entity.Entry_ID 6142 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Peptide Deformylase-actinonin complex' _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 ; AVLQVLHIPDERLRKVAKPV EEVNAEIQRIVDDMFETMYA EEGIGLAATQVDIHQRIIVI DVSENRDERLVLINPELLEK SGETGIEEGCLSIPEQRALV PRAEKVKIRALDRDGKPFEL EADGLLAICIQHEMDHLVGK LFMDYLS ; _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 147 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'free and other bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 4089 . peptide_deformylase . . . . . 100.00 147 100.00 100.00 8.78e-99 . . . . 6142 1 2 no BMRB 5404 . PDF . . . . . 100.00 147 99.32 100.00 2.20e-98 . . . . 6142 1 3 no PDB 1BS4 . "Peptide Deformylase As Zn2+ Containing Form (Native) In Complex With Inhibitor Polyethylene Glycol" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 4 no PDB 1BS5 . "Peptide Deformylase As Zn2+ Containing Form" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 5 no PDB 1BS6 . "Peptide Deformylase As Ni2+ Containing Form In Complex With Tripeptide Met-Ala-Ser" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 6 no PDB 1BS7 . "Peptide Deformylase As Ni2+ Containing Form" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 7 no PDB 1BS8 . "Peptide Deformylase As Zn2+ Containing Form In Complex With Tripeptide Met-Ala-Ser" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 8 no PDB 1BSJ . "Cobalt Deformylase Inhibitor Complex From E.Coli" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 9 no PDB 1BSK . "Zinc Deformylase Inhibitor Complex From E.Coli" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 10 no PDB 1BSZ . "Peptide Deformylase As Fe2+ Containing Form (Native) In Complex With Inhibitor Polyethylene Glycol" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 11 no PDB 1DEF . "Peptide Deformylase Catalytic Core (Residues 1-147), Nmr, 9 Structures" . . . . . 100.00 147 99.32 100.00 2.20e-98 . . . . 6142 1 12 no PDB 1DFF . "Peptide Deformylase" . . . . . 100.00 164 99.32 100.00 1.57e-98 . . . . 6142 1 13 no PDB 1G27 . "Crystal Structure Of E.Coli Polypeptide Deformylase Complexed With The Inhibitor Bb-3497" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 14 no PDB 1G2A . "The Crystal Structure Of E.Coli Peptide Deformylase Complexed With Actinonin" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 15 no PDB 1ICJ . "Pdf Protein Is Crystallized As Ni2+ Containing Form, Cocrystallized With Inhibitor Polyethylene Glycol (Peg)" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 16 no PDB 1LRU . "Crystal Structure Of E.Coli Peptide Deformylase Complexed With Antibiotic Actinonin" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 17 no PDB 1XEM . "High Resolution Crystal Structure Of Escherichia Coli Zinc- Peptide Deformylase Bound To Formate" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 18 no PDB 1XEN . "High Resolution Crystal Structure Of Escherichia Coli Iron- Peptide Deformylase Bound To Formate" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 19 no PDB 1XEO . "High Resolution Crystals Structure Of Cobalt- Peptide Deformylase Bound To Formate" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 20 no PDB 2AI8 . "E.Coli Polypeptide Deformylase Complexed With Sb-485343" . . . . . 100.00 168 99.32 100.00 1.46e-98 . . . . 6142 1 21 no PDB 2DEF . "Peptide Deformylase Catalytic Core (Residues 1-147), Nmr, 20 Structures" . . . . . 100.00 147 100.00 100.00 8.78e-99 . . . . 6142 1 22 no PDB 2KMN . "Solution Structure Of Peptide Deformylase Complexed With Actinonin" . . . . . 100.00 147 99.32 100.00 2.20e-98 . . . . 6142 1 23 no PDB 2W3T . "Chloro Complex Of The Ni-Form Of E.Coli Deformylase" . . . . . 100.00 188 99.32 100.00 1.75e-98 . . . . 6142 1 24 no PDB 2W3U . "Formate Complex Of The Ni-Form Of E.Coli Deformylase" . . . . . 100.00 188 99.32 100.00 1.75e-98 . . . . 6142 1 25 no PDB 3K6L . "The Structure Of E.Coli Peptide Deformylase (Pdf) In Complex With Peptidomimetic Ligand Bb2827" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 26 no PDB 4AL2 . "Peptide Deformylase (Ni-Form) With Hydrosulfide" . . . . . 100.00 186 99.32 100.00 1.52e-98 . . . . 6142 1 27 no PDB 4AL3 . "Peptide Deformylase (Co-Form) With Mercaptoethanol" . . . . . 100.00 186 98.64 99.32 4.06e-97 . . . . 6142 1 28 no PDB 4AZ4 . "E.Coli Deformylase With Co(Ii) And Hydrosulfide" . . . . . 100.00 186 98.64 99.32 4.06e-97 . . . . 6142 1 29 no DBJ BAB37575 . "peptide deformylase [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 30 no DBJ BAE78005 . "peptide deformylase [Escherichia coli str. K-12 substr. W3110]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 31 no DBJ BAG79085 . "polypeptide deformylase [Escherichia coli SE11]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 32 no DBJ BAH66202 . "N-formylmethionylaminoacyl-tRNA deformylase [Klebsiella pneumoniae subsp. pneumoniae NTUH-K2044]" . . . . . 100.00 169 97.96 99.32 1.09e-96 . . . . 6142 1 33 no DBJ BAI27558 . "peptide deformylase [Escherichia coli O26:H11 str. 11368]" . . . . . 100.00 169 98.64 100.00 5.85e-98 . . . . 6142 1 34 no EMBL CAA11508 . "hypothetical protein [Escherichia coli]" . . . . . 88.44 149 97.69 98.46 1.69e-80 . . . . 6142 1 35 no EMBL CAA45206 . "fms [Escherichia coli K-12]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 36 no EMBL CAA54367 . "N-formylmethionylaminoacyl-tRNA deformylase [Escherichia coli K-12]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 37 no EMBL CAA54826 . "deformylase [Escherichia coli]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 38 no EMBL CAD09179 . "polypeptide deformylase [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 100.00 169 97.28 99.32 1.69e-96 . . . . 6142 1 39 no GB AAA58084 . "N-formylmethionylaminoacyl-tRNA deformylase [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 40 no GB AAC76312 . "peptide deformylase [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 41 no GB AAF76758 . "unknown [Escherichia coli]" . . . . . 88.44 150 98.46 100.00 2.90e-83 . . . . 6142 1 42 no GB AAG58408 . "peptide deformylase [Escherichia coli O157:H7 str. EDL933]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 43 no GB AAL22269 . "peptide deformylase [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 100.00 169 97.96 99.32 4.13e-97 . . . . 6142 1 44 no PIR AB1010 . "formylmethionine deformylase (EC 3.5.1.31) - Salmonella enterica subsp. enterica serovar Typhi (strain CT18)" . . . . . 100.00 169 97.28 99.32 1.69e-96 . . . . 6142 1 45 no REF NP_289848 . "peptide deformylase [Escherichia coli O157:H7 str. EDL933]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 46 no REF NP_312179 . "peptide deformylase [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 47 no REF NP_417745 . "peptide deformylase [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 48 no REF NP_458493 . "polypeptide deformylase [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 100.00 169 97.28 99.32 1.69e-96 . . . . 6142 1 49 no REF NP_462310 . "peptide deformylase [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 100.00 169 97.96 99.32 4.13e-97 . . . . 6142 1 50 no SP A1AGH8 . "RecName: Full=Peptide deformylase; Short=PDF; AltName: Full=Polypeptide deformylase [Escherichia coli APEC O1]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 51 no SP A8A591 . "RecName: Full=Peptide deformylase; Short=PDF; AltName: Full=Polypeptide deformylase [Escherichia coli HS]" . . . . . 100.00 169 99.32 100.00 1.30e-98 . . . . 6142 1 52 no SP A8AQI1 . "RecName: Full=Peptide deformylase; Short=PDF; AltName: Full=Polypeptide deformylase [Citrobacter koseri ATCC BAA-895]" . . . . . 100.00 169 98.64 99.32 3.55e-97 . . . . 6142 1 53 no SP A9MN80 . "RecName: Full=Peptide deformylase; Short=PDF; AltName: Full=Polypeptide deformylase [Salmonella enterica subsp. arizonae serova" . . . . . 100.00 169 97.28 99.32 1.69e-96 . . . . 6142 1 54 no SP A9N8B1 . "RecName: Full=Peptide deformylase; Short=PDF; AltName: Full=Polypeptide deformylase [Salmonella enterica subsp. enterica serova" . . . . . 100.00 169 97.96 99.32 4.13e-97 . . . . 6142 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Peptide Deformylase-actinonin complex' common 6142 1 'Flavi C' abbreviation 6142 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 . ALA . 6142 1 2 . VAL . 6142 1 3 . LEU . 6142 1 4 . GLN . 6142 1 5 . VAL . 6142 1 6 . LEU . 6142 1 7 . HIS . 6142 1 8 . ILE . 6142 1 9 . PRO . 6142 1 10 . ASP . 6142 1 11 . GLU . 6142 1 12 . ARG . 6142 1 13 . LEU . 6142 1 14 . ARG . 6142 1 15 . LYS . 6142 1 16 . VAL . 6142 1 17 . ALA . 6142 1 18 . LYS . 6142 1 19 . PRO . 6142 1 20 . VAL . 6142 1 21 . GLU . 6142 1 22 . GLU . 6142 1 23 . VAL . 6142 1 24 . ASN . 6142 1 25 . ALA . 6142 1 26 . GLU . 6142 1 27 . ILE . 6142 1 28 . GLN . 6142 1 29 . ARG . 6142 1 30 . ILE . 6142 1 31 . VAL . 6142 1 32 . ASP . 6142 1 33 . ASP . 6142 1 34 . MET . 6142 1 35 . PHE . 6142 1 36 . GLU . 6142 1 37 . THR . 6142 1 38 . MET . 6142 1 39 . TYR . 6142 1 40 . ALA . 6142 1 41 . GLU . 6142 1 42 . GLU . 6142 1 43 . GLY . 6142 1 44 . ILE . 6142 1 45 . GLY . 6142 1 46 . LEU . 6142 1 47 . ALA . 6142 1 48 . ALA . 6142 1 49 . THR . 6142 1 50 . GLN . 6142 1 51 . VAL . 6142 1 52 . ASP . 6142 1 53 . ILE . 6142 1 54 . HIS . 6142 1 55 . GLN . 6142 1 56 . ARG . 6142 1 57 . ILE . 6142 1 58 . ILE . 6142 1 59 . VAL . 6142 1 60 . ILE . 6142 1 61 . ASP . 6142 1 62 . VAL . 6142 1 63 . SER . 6142 1 64 . GLU . 6142 1 65 . ASN . 6142 1 66 . ARG . 6142 1 67 . ASP . 6142 1 68 . GLU . 6142 1 69 . ARG . 6142 1 70 . LEU . 6142 1 71 . VAL . 6142 1 72 . LEU . 6142 1 73 . ILE . 6142 1 74 . ASN . 6142 1 75 . PRO . 6142 1 76 . GLU . 6142 1 77 . LEU . 6142 1 78 . LEU . 6142 1 79 . GLU . 6142 1 80 . LYS . 6142 1 81 . SER . 6142 1 82 . GLY . 6142 1 83 . GLU . 6142 1 84 . THR . 6142 1 85 . GLY . 6142 1 86 . ILE . 6142 1 87 . GLU . 6142 1 88 . GLU . 6142 1 89 . GLY . 6142 1 90 . CYS . 6142 1 91 . LEU . 6142 1 92 . SER . 6142 1 93 . ILE . 6142 1 94 . PRO . 6142 1 95 . GLU . 6142 1 96 . GLN . 6142 1 97 . ARG . 6142 1 98 . ALA . 6142 1 99 . LEU . 6142 1 100 . VAL . 6142 1 101 . PRO . 6142 1 102 . ARG . 6142 1 103 . ALA . 6142 1 104 . GLU . 6142 1 105 . LYS . 6142 1 106 . VAL . 6142 1 107 . LYS . 6142 1 108 . ILE . 6142 1 109 . ARG . 6142 1 110 . ALA . 6142 1 111 . LEU . 6142 1 112 . ASP . 6142 1 113 . ARG . 6142 1 114 . ASP . 6142 1 115 . GLY . 6142 1 116 . LYS . 6142 1 117 . PRO . 6142 1 118 . PHE . 6142 1 119 . GLU . 6142 1 120 . LEU . 6142 1 121 . GLU . 6142 1 122 . ALA . 6142 1 123 . ASP . 6142 1 124 . GLY . 6142 1 125 . LEU . 6142 1 126 . LEU . 6142 1 127 . ALA . 6142 1 128 . ILE . 6142 1 129 . CYS . 6142 1 130 . ILE . 6142 1 131 . GLN . 6142 1 132 . HIS . 6142 1 133 . GLU . 6142 1 134 . MET . 6142 1 135 . ASP . 6142 1 136 . HIS . 6142 1 137 . LEU . 6142 1 138 . VAL . 6142 1 139 . GLY . 6142 1 140 . LYS . 6142 1 141 . LEU . 6142 1 142 . PHE . 6142 1 143 . MET . 6142 1 144 . ASP . 6142 1 145 . TYR . 6142 1 146 . LEU . 6142 1 147 . SER . 6142 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 . ALA 1 1 6142 1 . VAL 2 2 6142 1 . LEU 3 3 6142 1 . GLN 4 4 6142 1 . VAL 5 5 6142 1 . LEU 6 6 6142 1 . HIS 7 7 6142 1 . ILE 8 8 6142 1 . PRO 9 9 6142 1 . ASP 10 10 6142 1 . GLU 11 11 6142 1 . ARG 12 12 6142 1 . LEU 13 13 6142 1 . ARG 14 14 6142 1 . LYS 15 15 6142 1 . VAL 16 16 6142 1 . ALA 17 17 6142 1 . LYS 18 18 6142 1 . PRO 19 19 6142 1 . VAL 20 20 6142 1 . GLU 21 21 6142 1 . GLU 22 22 6142 1 . VAL 23 23 6142 1 . ASN 24 24 6142 1 . ALA 25 25 6142 1 . GLU 26 26 6142 1 . ILE 27 27 6142 1 . GLN 28 28 6142 1 . ARG 29 29 6142 1 . ILE 30 30 6142 1 . VAL 31 31 6142 1 . ASP 32 32 6142 1 . ASP 33 33 6142 1 . MET 34 34 6142 1 . PHE 35 35 6142 1 . GLU 36 36 6142 1 . THR 37 37 6142 1 . MET 38 38 6142 1 . TYR 39 39 6142 1 . ALA 40 40 6142 1 . GLU 41 41 6142 1 . GLU 42 42 6142 1 . GLY 43 43 6142 1 . ILE 44 44 6142 1 . GLY 45 45 6142 1 . LEU 46 46 6142 1 . ALA 47 47 6142 1 . ALA 48 48 6142 1 . THR 49 49 6142 1 . GLN 50 50 6142 1 . VAL 51 51 6142 1 . ASP 52 52 6142 1 . ILE 53 53 6142 1 . HIS 54 54 6142 1 . GLN 55 55 6142 1 . ARG 56 56 6142 1 . ILE 57 57 6142 1 . ILE 58 58 6142 1 . VAL 59 59 6142 1 . ILE 60 60 6142 1 . ASP 61 61 6142 1 . VAL 62 62 6142 1 . SER 63 63 6142 1 . GLU 64 64 6142 1 . ASN 65 65 6142 1 . ARG 66 66 6142 1 . ASP 67 67 6142 1 . GLU 68 68 6142 1 . ARG 69 69 6142 1 . LEU 70 70 6142 1 . VAL 71 71 6142 1 . LEU 72 72 6142 1 . ILE 73 73 6142 1 . ASN 74 74 6142 1 . PRO 75 75 6142 1 . GLU 76 76 6142 1 . LEU 77 77 6142 1 . LEU 78 78 6142 1 . GLU 79 79 6142 1 . LYS 80 80 6142 1 . SER 81 81 6142 1 . GLY 82 82 6142 1 . GLU 83 83 6142 1 . THR 84 84 6142 1 . GLY 85 85 6142 1 . ILE 86 86 6142 1 . GLU 87 87 6142 1 . GLU 88 88 6142 1 . GLY 89 89 6142 1 . CYS 90 90 6142 1 . LEU 91 91 6142 1 . SER 92 92 6142 1 . ILE 93 93 6142 1 . PRO 94 94 6142 1 . GLU 95 95 6142 1 . GLN 96 96 6142 1 . ARG 97 97 6142 1 . ALA 98 98 6142 1 . LEU 99 99 6142 1 . VAL 100 100 6142 1 . PRO 101 101 6142 1 . ARG 102 102 6142 1 . ALA 103 103 6142 1 . GLU 104 104 6142 1 . LYS 105 105 6142 1 . VAL 106 106 6142 1 . LYS 107 107 6142 1 . ILE 108 108 6142 1 . ARG 109 109 6142 1 . ALA 110 110 6142 1 . LEU 111 111 6142 1 . ASP 112 112 6142 1 . ARG 113 113 6142 1 . ASP 114 114 6142 1 . GLY 115 115 6142 1 . LYS 116 116 6142 1 . PRO 117 117 6142 1 . PHE 118 118 6142 1 . GLU 119 119 6142 1 . LEU 120 120 6142 1 . GLU 121 121 6142 1 . ALA 122 122 6142 1 . ASP 123 123 6142 1 . GLY 124 124 6142 1 . LEU 125 125 6142 1 . LEU 126 126 6142 1 . ALA 127 127 6142 1 . ILE 128 128 6142 1 . CYS 129 129 6142 1 . ILE 130 130 6142 1 . GLN 131 131 6142 1 . HIS 132 132 6142 1 . GLU 133 133 6142 1 . MET 134 134 6142 1 . ASP 135 135 6142 1 . HIS 136 136 6142 1 . LEU 137 137 6142 1 . VAL 138 138 6142 1 . GLY 139 139 6142 1 . LYS 140 140 6142 1 . LEU 141 141 6142 1 . PHE 142 142 6142 1 . MET 143 143 6142 1 . ASP 144 144 6142 1 . TYR 145 145 6142 1 . LEU 146 146 6142 1 . SER 147 147 6142 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 6142 _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 $PDF_147 . 562 . . 'Escherichia coli' 'E. coli' . . Eubacteria . Escherichia coli . . . . . . . . . . . . . . . . . . . . . 6142 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 6142 _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 $PDF_147 . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli HMS174(DE3) . . . . . . . . . . . . PLASMID . . PTRC99A . . . . . . 6142 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6142 _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 'Peptide Deformylase-actinonin complex' '[U-13C; U-15N]' . . 1 $PDF_147 . . 0.001 . . M . . . . 6142 1 2 Actinonin . . . . . . . 0.001 . . M . . . . 6142 1 stop_ save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond_1 _Sample_condition_list.Entry_ID 6142 _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 7 0.1 pH 6142 1 temperature 310 0.1 K 6142 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 6142 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer BRUKER _NMR_spectrometer.Model ADVANCE _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 6142 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer BRUKER ADVANCE . 600 . . . 6142 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 6142 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 HSQC . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6142 1 2 HNCA . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6142 1 3 HNCACB . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6142 1 4 CBCACONH . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6142 1 5 TOCSYHSQC . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6142 1 6 HCCH-TOCSY . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6142 1 7 NOESYHSQC . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6142 1 stop_ 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 6142 _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 TMSP 'methyl protons' . . . . ppm 0 internal indirect 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6142 1 C 13 TMSP 'methyl carbons' . . . . ppm 0 internal indirect 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6142 1 N 15 TMSP nitrogen . . . . ppm 0 internal indirect 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6142 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts _Assigned_chem_shift_list.Entry_ID 6142 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 6142 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 ALA HA H 1 3.95 0.01 . 1 . . . . 1 . . . 6142 1 2 . 1 1 1 1 ALA HB1 H 1 1.38 0.01 . 1 . . . . 1 . . . 6142 1 3 . 1 1 1 1 ALA HB2 H 1 1.38 0.01 . 1 . . . . 1 . . . 6142 1 4 . 1 1 1 1 ALA HB3 H 1 1.38 0.01 . 1 . . . . 1 . . . 6142 1 5 . 1 1 2 2 VAL H H 1 7.92 0.01 . 1 . . . . 2 . . . 6142 1 6 . 1 1 2 2 VAL N N 15 114.8 0.2 . 1 . . . . 2 . . . 6142 1 7 . 1 1 2 2 VAL CA C 13 62.2 0.3 . 1 . . . . 2 . . . 6142 1 8 . 1 1 2 2 VAL HA H 1 4.03 0.01 . 1 . . . . 2 . . . 6142 1 9 . 1 1 2 2 VAL CB C 13 31.2 0.3 . 1 . . . . 2 . . . 6142 1 10 . 1 1 2 2 VAL HB H 1 1.94 0.01 . 1 . . . . 2 . . . 6142 1 11 . 1 1 2 2 VAL CG1 C 13 23.5 0.3 . 1 . . . . 2 . . . 6142 1 12 . 1 1 2 2 VAL HG11 H 1 0.98 0.01 . 1 . . . . 2 . . . 6142 1 13 . 1 1 2 2 VAL HG12 H 1 0.98 0.01 . 1 . . . . 2 . . . 6142 1 14 . 1 1 2 2 VAL HG13 H 1 0.98 0.01 . 1 . . . . 2 . . . 6142 1 15 . 1 1 2 2 VAL CG2 C 13 23.5 0.3 . 1 . . . . 2 . . . 6142 1 16 . 1 1 2 2 VAL HG21 H 1 0.98 0.01 . 1 . . . . 2 . . . 6142 1 17 . 1 1 2 2 VAL HG22 H 1 0.98 0.01 . 1 . . . . 2 . . . 6142 1 18 . 1 1 2 2 VAL HG23 H 1 0.98 0.01 . 1 . . . . 2 . . . 6142 1 19 . 1 1 3 3 LEU H H 1 8.75 0.01 . 1 . . . . 3 . . . 6142 1 20 . 1 1 3 3 LEU N N 15 127.4 0.2 . 1 . . . . 3 . . . 6142 1 21 . 1 1 3 3 LEU CA C 13 52.2 0.3 . 1 . . . . 3 . . . 6142 1 22 . 1 1 3 3 LEU HA H 1 4.47 0.01 . 1 . . . . 3 . . . 6142 1 23 . 1 1 3 3 LEU CB C 13 41.6 0.3 . 1 . . . . 3 . . . 6142 1 24 . 1 1 3 3 LEU HB2 H 1 1.62 0.01 . 1 . . . . 3 . . . 6142 1 25 . 1 1 3 3 LEU HB3 H 1 1.62 0.01 . 1 . . . . 3 . . . 6142 1 26 . 1 1 3 3 LEU CG C 13 27.2 0.3 . 1 . . . . 3 . . . 6142 1 27 . 1 1 3 3 LEU CD1 C 13 27.2 0.3 . 1 . . . . 3 . . . 6142 1 28 . 1 1 3 3 LEU HD11 H 1 0.8 0.01 . 1 . . . . 3 . . . 6142 1 29 . 1 1 3 3 LEU HD12 H 1 0.8 0.01 . 1 . . . . 3 . . . 6142 1 30 . 1 1 3 3 LEU HD13 H 1 0.8 0.01 . 1 . . . . 3 . . . 6142 1 31 . 1 1 3 3 LEU CD2 C 13 27.2 0.3 . 1 . . . . 3 . . . 6142 1 32 . 1 1 3 3 LEU HD21 H 1 0.83 0.01 . 1 . . . . 3 . . . 6142 1 33 . 1 1 3 3 LEU HD22 H 1 0.83 0.01 . 1 . . . . 3 . . . 6142 1 34 . 1 1 3 3 LEU HD23 H 1 0.83 0.01 . 1 . . . . 3 . . . 6142 1 35 . 1 1 4 4 GLN H H 1 8.09 0.01 . 1 . . . . 4 . . . 6142 1 36 . 1 1 4 4 GLN N N 15 116.1 0.2 . 1 . . . . 4 . . . 6142 1 37 . 1 1 4 4 GLN CA C 13 55.9 0.3 . 1 . . . . 4 . . . 6142 1 38 . 1 1 4 4 GLN HA H 1 4.16 0.01 . 1 . . . . 4 . . . 6142 1 39 . 1 1 4 4 GLN CB C 13 28.5 0.3 . 1 . . . . 4 . . . 6142 1 40 . 1 1 4 4 GLN HB2 H 1 1.94 0.01 . 1 . . . . 4 . . . 6142 1 41 . 1 1 4 4 GLN HB3 H 1 1.94 0.01 . 1 . . . . 4 . . . 6142 1 42 . 1 1 4 4 GLN CG C 13 36.4 0.3 . 1 . . . . 4 . . . 6142 1 43 . 1 1 4 4 GLN HG2 H 1 2.21 0.01 . 1 . . . . 4 . . . 6142 1 44 . 1 1 4 4 GLN HG3 H 1 2.31 0.01 . 1 . . . . 4 . . . 6142 1 45 . 1 1 5 5 VAL H H 1 8.14 0.01 . 1 . . . . 5 . . . 6142 1 46 . 1 1 5 5 VAL N N 15 124.0 0.2 . 1 . . . . 5 . . . 6142 1 47 . 1 1 5 5 VAL CA C 13 61.3 0.3 . 1 . . . . 5 . . . 6142 1 48 . 1 1 5 5 VAL HA H 1 4.21 0.01 . 1 . . . . 5 . . . 6142 1 49 . 1 1 5 5 VAL CB C 13 31.5 0.3 . 1 . . . . 5 . . . 6142 1 50 . 1 1 5 5 VAL HB H 1 1.9 0.01 . 1 . . . . 5 . . . 6142 1 51 . 1 1 5 5 VAL CG1 C 13 23.8 0.3 . 1 . . . . 5 . . . 6142 1 52 . 1 1 5 5 VAL HG11 H 1 0.79 0.01 . 1 . . . . 5 . . . 6142 1 53 . 1 1 5 5 VAL HG12 H 1 0.79 0.01 . 1 . . . . 5 . . . 6142 1 54 . 1 1 5 5 VAL HG13 H 1 0.79 0.01 . 1 . . . . 5 . . . 6142 1 55 . 1 1 5 5 VAL CG2 C 13 21.3 0.3 . 1 . . . . 5 . . . 6142 1 56 . 1 1 5 5 VAL HG21 H 1 0.73 0.01 . 1 . . . . 5 . . . 6142 1 57 . 1 1 5 5 VAL HG22 H 1 0.73 0.01 . 1 . . . . 5 . . . 6142 1 58 . 1 1 5 5 VAL HG23 H 1 0.73 0.01 . 1 . . . . 5 . . . 6142 1 59 . 1 1 6 6 LEU H H 1 9.03 0.01 . 1 . . . . 6 . . . 6142 1 60 . 1 1 6 6 LEU N N 15 124.3 0.2 . 1 . . . . 6 . . . 6142 1 61 . 1 1 6 6 LEU CA C 13 54.4 0.3 . 1 . . . . 6 . . . 6142 1 62 . 1 1 6 6 LEU HA H 1 4.27 0.01 . 1 . . . . 6 . . . 6142 1 63 . 1 1 6 6 LEU CB C 13 42 0.3 . 1 . . . . 6 . . . 6142 1 64 . 1 1 6 6 LEU HB2 H 1 1.71 0.01 . 1 . . . . 6 . . . 6142 1 65 . 1 1 6 6 LEU HB3 H 1 1.21 0.01 . 1 . . . . 6 . . . 6142 1 66 . 1 1 6 6 LEU CG C 13 42.1 0.3 . 1 . . . . 6 . . . 6142 1 67 . 1 1 6 6 LEU CD1 C 13 23.3 0.3 . 1 . . . . 6 . . . 6142 1 68 . 1 1 6 6 LEU HD11 H 1 0.79 0.01 . 1 . . . . 6 . . . 6142 1 69 . 1 1 6 6 LEU HD12 H 1 0.79 0.01 . 1 . . . . 6 . . . 6142 1 70 . 1 1 6 6 LEU HD13 H 1 0.79 0.01 . 1 . . . . 6 . . . 6142 1 71 . 1 1 6 6 LEU CD2 C 13 23.3 0.3 . 1 . . . . 6 . . . 6142 1 72 . 1 1 6 6 LEU HD21 H 1 0.79 0.01 . 1 . . . . 6 . . . 6142 1 73 . 1 1 6 6 LEU HD22 H 1 0.79 0.01 . 1 . . . . 6 . . . 6142 1 74 . 1 1 6 6 LEU HD23 H 1 0.79 0.01 . 1 . . . . 6 . . . 6142 1 75 . 1 1 6 6 LEU HG H 1 1.51 0.01 . 1 . . . . 6 . . . 6142 1 76 . 1 1 7 7 HIS H H 1 8.68 0.01 . 1 . . . . 7 . . . 6142 1 77 . 1 1 7 7 HIS N N 15 114.7 0.2 . 1 . . . . 7 . . . 6142 1 78 . 1 1 7 7 HIS CA C 13 51.5 0.3 . 1 . . . . 7 . . . 6142 1 79 . 1 1 7 7 HIS HA H 1 5.75 0.01 . 1 . . . . 7 . . . 6142 1 80 . 1 1 7 7 HIS CB C 13 32.5 0.3 . 1 . . . . 7 . . . 6142 1 81 . 1 1 7 7 HIS HB2 H 1 3.09 0.01 . 1 . . . . 7 . . . 6142 1 82 . 1 1 7 7 HIS HB3 H 1 3.29 0.01 . 1 . . . . 7 . . . 6142 1 83 . 1 1 8 8 ILE H H 1 8.49 0.01 . 1 . . . . 8 . . . 6142 1 84 . 1 1 8 8 ILE N N 15 114.4 0.2 . 1 . . . . 8 . . . 6142 1 85 . 1 1 8 8 ILE CA C 13 60.2 0.3 . 1 . . . . 8 . . . 6142 1 86 . 1 1 8 8 ILE HA H 1 4.36 0.01 . 1 . . . . 8 . . . 6142 1 87 . 1 1 8 8 ILE CB C 13 37.5 0.3 . 1 . . . . 8 . . . 6142 1 88 . 1 1 8 8 ILE HB H 1 2.09 0.01 . 1 . . . . 8 . . . 6142 1 89 . 1 1 8 8 ILE CG2 C 13 21.7 0.3 . 1 . . . . 8 . . . 6142 1 90 . 1 1 8 8 ILE HG21 H 1 1.08 0.01 . 1 . . . . 8 . . . 6142 1 91 . 1 1 8 8 ILE HG22 H 1 1.08 0.01 . 1 . . . . 8 . . . 6142 1 92 . 1 1 8 8 ILE HG23 H 1 1.08 0.01 . 1 . . . . 8 . . . 6142 1 93 . 1 1 8 8 ILE CG1 C 13 23.5 0.3 . 1 . . . . 8 . . . 6142 1 94 . 1 1 8 8 ILE HG12 H 1 1.69 0.01 . 1 . . . . 8 . . . 6142 1 95 . 1 1 8 8 ILE HG13 H 1 1.69 0.01 . 1 . . . . 8 . . . 6142 1 96 . 1 1 8 8 ILE CD1 C 13 16.7 0.3 . 1 . . . . 8 . . . 6142 1 97 . 1 1 8 8 ILE HD11 H 1 0.93 0.01 . 1 . . . . 8 . . . 6142 1 98 . 1 1 8 8 ILE HD12 H 1 0.93 0.01 . 1 . . . . 8 . . . 6142 1 99 . 1 1 8 8 ILE HD13 H 1 0.93 0.01 . 1 . . . . 8 . . . 6142 1 100 . 1 1 11 11 GLU CA C 13 59.1 0.3 . 1 . . . . 11 . . . 6142 1 101 . 1 1 11 11 GLU CB C 13 29 0.3 . 1 . . . . 11 . . . 6142 1 102 . 1 1 12 12 ARG H H 1 9.49 0.01 . 1 . . . . 12 . . . 6142 1 103 . 1 1 12 12 ARG N N 15 120.0 0.2 . 1 . . . . 12 . . . 6142 1 104 . 1 1 12 12 ARG CA C 13 59.2 0.3 . 1 . . . . 12 . . . 6142 1 105 . 1 1 12 12 ARG HA H 1 3.88 0.01 . 1 . . . . 12 . . . 6142 1 106 . 1 1 12 12 ARG CB C 13 29.5 0.3 . 1 . . . . 12 . . . 6142 1 107 . 1 1 12 12 ARG HB2 H 1 1.87 0.01 . 1 . . . . 12 . . . 6142 1 108 . 1 1 12 12 ARG HB3 H 1 1.97 0.01 . 1 . . . . 12 . . . 6142 1 109 . 1 1 12 12 ARG CG C 13 29.8 0.3 . 1 . . . . 12 . . . 6142 1 110 . 1 1 12 12 ARG HG2 H 1 1.87 0.01 . 1 . . . . 12 . . . 6142 1 111 . 1 1 12 12 ARG HG3 H 1 1.78 0.01 . 1 . . . . 12 . . . 6142 1 112 . 1 1 12 12 ARG CD C 13 43.3 0.3 . 1 . . . . 12 . . . 6142 1 113 . 1 1 12 12 ARG HD2 H 1 3.17 0.01 . 1 . . . . 12 . . . 6142 1 114 . 1 1 12 12 ARG HD3 H 1 3.17 0.01 . 1 . . . . 12 . . . 6142 1 115 . 1 1 13 13 LEU H H 1 7.32 0.01 . 1 . . . . 13 . . . 6142 1 116 . 1 1 13 13 LEU N N 15 110.6 0.2 . 1 . . . . 13 . . . 6142 1 117 . 1 1 13 13 LEU CA C 13 55.9 0.3 . 1 . . . . 13 . . . 6142 1 118 . 1 1 13 13 LEU CB C 13 42.4 0.3 . 1 . . . . 13 . . . 6142 1 119 . 1 1 13 13 LEU HB2 H 1 2.05 0.01 . 1 . . . . 13 . . . 6142 1 120 . 1 1 13 13 LEU HB3 H 1 2.05 0.01 . 1 . . . . 13 . . . 6142 1 121 . 1 1 13 13 LEU HD11 H 1 0.95 0.01 . 1 . . . . 13 . . . 6142 1 122 . 1 1 13 13 LEU HD12 H 1 0.95 0.01 . 1 . . . . 13 . . . 6142 1 123 . 1 1 13 13 LEU HD13 H 1 0.95 0.01 . 1 . . . . 13 . . . 6142 1 124 . 1 1 13 13 LEU HD21 H 1 0.95 0.01 . 1 . . . . 13 . . . 6142 1 125 . 1 1 13 13 LEU HD22 H 1 0.95 0.01 . 1 . . . . 13 . . . 6142 1 126 . 1 1 13 13 LEU HD23 H 1 0.95 0.01 . 1 . . . . 13 . . . 6142 1 127 . 1 1 13 13 LEU HG H 1 1.58 0.01 . 1 . . . . 13 . . . 6142 1 128 . 1 1 14 14 ARG H H 1 7.45 0.01 . 1 . . . . 14 . . . 6142 1 129 . 1 1 14 14 ARG N N 15 111.4 0.2 . 1 . . . . 14 . . . 6142 1 130 . 1 1 14 14 ARG CA C 13 53.2 0.3 . 1 . . . . 14 . . . 6142 1 131 . 1 1 14 14 ARG HA H 1 4.59 0.01 . 1 . . . . 14 . . . 6142 1 132 . 1 1 14 14 ARG CB C 13 29.6 0.3 . 1 . . . . 14 . . . 6142 1 133 . 1 1 14 14 ARG HB2 H 1 1.95 0.01 . 1 . . . . 14 . . . 6142 1 134 . 1 1 14 14 ARG HB3 H 1 2.25 0.01 . 1 . . . . 14 . . . 6142 1 135 . 1 1 14 14 ARG CG C 13 29.0 0.3 . 1 . . . . 14 . . . 6142 1 136 . 1 1 14 14 ARG HG2 H 1 1.57 0.01 . 1 . . . . 14 . . . 6142 1 137 . 1 1 14 14 ARG HG3 H 1 1.57 0.01 . 1 . . . . 14 . . . 6142 1 138 . 1 1 14 14 ARG CD C 13 43.4 0.3 . 1 . . . . 14 . . . 6142 1 139 . 1 1 14 14 ARG HD2 H 1 3.06 0.01 . 1 . . . . 14 . . . 6142 1 140 . 1 1 14 14 ARG HD3 H 1 3.06 0.01 . 1 . . . . 14 . . . 6142 1 141 . 1 1 15 15 LYS H H 1 6.88 0.01 . 1 . . . . 15 . . . 6142 1 142 . 1 1 15 15 LYS N N 15 118.5 0.2 . 1 . . . . 15 . . . 6142 1 143 . 1 1 15 15 LYS CA C 13 56.9 0.3 . 1 . . . . 15 . . . 6142 1 144 . 1 1 15 15 LYS HA H 1 3.99 0.01 . 1 . . . . 15 . . . 6142 1 145 . 1 1 15 15 LYS CB C 13 31.9 0.3 . 1 . . . . 15 . . . 6142 1 146 . 1 1 15 15 LYS HB2 H 1 1.37 0.01 . 1 . . . . 15 . . . 6142 1 147 . 1 1 15 15 LYS HB3 H 1 1.52 0.01 . 1 . . . . 15 . . . 6142 1 148 . 1 1 15 15 LYS CG C 13 27.6 0.3 . 1 . . . . 15 . . . 6142 1 149 . 1 1 15 15 LYS HG2 H 1 1.18 0.01 . 1 . . . . 15 . . . 6142 1 150 . 1 1 15 15 LYS HG3 H 1 1.18 0.01 . 1 . . . . 15 . . . 6142 1 151 . 1 1 15 15 LYS CD C 13 30.2 0.3 . 1 . . . . 15 . . . 6142 1 152 . 1 1 15 15 LYS HD2 H 1 0.95 0.01 . 1 . . . . 15 . . . 6142 1 153 . 1 1 15 15 LYS HD3 H 1 1.24 0.01 . 1 . . . . 15 . . . 6142 1 154 . 1 1 15 15 LYS CE C 13 41.4 0.3 . 1 . . . . 15 . . . 6142 1 155 . 1 1 15 15 LYS HE2 H 1 2.51 0.01 . 1 . . . . 15 . . . 6142 1 156 . 1 1 15 15 LYS HE3 H 1 2.61 0.01 . 1 . . . . 15 . . . 6142 1 157 . 1 1 16 16 VAL H H 1 7.99 0.01 . 1 . . . . 16 . . . 6142 1 158 . 1 1 16 16 VAL N N 15 118.7 0.2 . 1 . . . . 16 . . . 6142 1 159 . 1 1 16 16 VAL CA C 13 62.1 0.3 . 1 . . . . 16 . . . 6142 1 160 . 1 1 16 16 VAL HA H 1 3.97 0.01 . 1 . . . . 16 . . . 6142 1 161 . 1 1 16 16 VAL CB C 13 31.3 0.3 . 1 . . . . 16 . . . 6142 1 162 . 1 1 16 16 VAL HB H 1 1.96 0.01 . 1 . . . . 16 . . . 6142 1 163 . 1 1 16 16 VAL CG1 C 13 23.8 0.3 . 1 . . . . 16 . . . 6142 1 164 . 1 1 16 16 VAL HG11 H 1 1.06 0.01 . 1 . . . . 16 . . . 6142 1 165 . 1 1 16 16 VAL HG12 H 1 1.06 0.01 . 1 . . . . 16 . . . 6142 1 166 . 1 1 16 16 VAL HG13 H 1 1.06 0.01 . 1 . . . . 16 . . . 6142 1 167 . 1 1 16 16 VAL CG2 C 13 23.8 0.3 . 1 . . . . 16 . . . 6142 1 168 . 1 1 16 16 VAL HG21 H 1 0.93 0.01 . 1 . . . . 16 . . . 6142 1 169 . 1 1 16 16 VAL HG22 H 1 0.93 0.01 . 1 . . . . 16 . . . 6142 1 170 . 1 1 16 16 VAL HG23 H 1 0.93 0.01 . 1 . . . . 16 . . . 6142 1 171 . 1 1 17 17 ALA H H 1 8.4 0.01 . 1 . . . . 17 . . . 6142 1 172 . 1 1 17 17 ALA N N 15 128.8 0.2 . 1 . . . . 17 . . . 6142 1 173 . 1 1 17 17 ALA CA C 13 52.7 0.3 . 1 . . . . 17 . . . 6142 1 174 . 1 1 17 17 ALA HA H 1 4.07 0.01 . 1 . . . . 17 . . . 6142 1 175 . 1 1 17 17 ALA CB C 13 19.8 0.3 . 1 . . . . 17 . . . 6142 1 176 . 1 1 17 17 ALA HB1 H 1 1.38 0.01 . 1 . . . . 17 . . . 6142 1 177 . 1 1 17 17 ALA HB2 H 1 1.38 0.01 . 1 . . . . 17 . . . 6142 1 178 . 1 1 17 17 ALA HB3 H 1 1.38 0.01 . 1 . . . . 17 . . . 6142 1 179 . 1 1 18 18 LYS H H 1 8.11 0.01 . 1 . . . . 18 . . . 6142 1 180 . 1 1 18 18 LYS N N 15 120.2 0.2 . 1 . . . . 18 . . . 6142 1 181 . 1 1 18 18 LYS CA C 13 53.1 0.3 . 1 . . . . 18 . . . 6142 1 182 . 1 1 18 18 LYS HA H 1 4.87 0.01 . 1 . . . . 18 . . . 6142 1 183 . 1 1 18 18 LYS CB C 13 31.5 0.3 . 1 . . . . 18 . . . 6142 1 184 . 1 1 18 18 LYS HB2 H 1 2.04 0.01 . 1 . . . . 18 . . . 6142 1 185 . 1 1 18 18 LYS HB3 H 1 1.99 0.01 . 1 . . . . 18 . . . 6142 1 186 . 1 1 18 18 LYS CG C 13 26.5 0.3 . 1 . . . . 18 . . . 6142 1 187 . 1 1 18 18 LYS HG2 H 1 1.70 0.01 . 1 . . . . 18 . . . 6142 1 188 . 1 1 18 18 LYS HG3 H 1 1.73 0.01 . 1 . . . . 18 . . . 6142 1 189 . 1 1 18 18 LYS HD2 H 1 1.61 0.01 . 1 . . . . 18 . . . 6142 1 190 . 1 1 18 18 LYS HD3 H 1 1.61 0.01 . 1 . . . . 18 . . . 6142 1 191 . 1 1 19 19 PRO CA C 13 63 0.3 . 1 . . . . 19 . . . 6142 1 192 . 1 1 19 19 PRO HA H 1 4.4 0.01 . 1 . . . . 19 . . . 6142 1 193 . 1 1 19 19 PRO CB C 13 31 0.3 . 1 . . . . 19 . . . 6142 1 194 . 1 1 19 19 PRO HB2 H 1 2.4 0.01 . 1 . . . . 19 . . . 6142 1 195 . 1 1 19 19 PRO HB3 H 1 1.94 0.01 . 1 . . . . 19 . . . 6142 1 196 . 1 1 20 20 VAL H H 1 10.3 0.01 . 1 . . . . 20 . . . 6142 1 197 . 1 1 20 20 VAL N N 15 123.5 0.2 . 1 . . . . 20 . . . 6142 1 198 . 1 1 20 20 VAL CA C 13 62.4 0.3 . 1 . . . . 20 . . . 6142 1 199 . 1 1 20 20 VAL HA H 1 4.03 0.01 . 1 . . . . 20 . . . 6142 1 200 . 1 1 20 20 VAL CB C 13 31.3 0.3 . 1 . . . . 20 . . . 6142 1 201 . 1 1 20 20 VAL HB H 1 1.84 0.01 . 1 . . . . 20 . . . 6142 1 202 . 1 1 20 20 VAL CG1 C 13 25.0 0.3 . 1 . . . . 20 . . . 6142 1 203 . 1 1 20 20 VAL HG11 H 1 0.99 0.01 . 1 . . . . 20 . . . 6142 1 204 . 1 1 20 20 VAL HG12 H 1 0.99 0.01 . 1 . . . . 20 . . . 6142 1 205 . 1 1 20 20 VAL HG13 H 1 0.99 0.01 . 1 . . . . 20 . . . 6142 1 206 . 1 1 20 20 VAL CG2 C 13 24.1 0.3 . 1 . . . . 20 . . . 6142 1 207 . 1 1 20 20 VAL HG21 H 1 0.81 0.01 . 1 . . . . 20 . . . 6142 1 208 . 1 1 20 20 VAL HG22 H 1 0.81 0.01 . 1 . . . . 20 . . . 6142 1 209 . 1 1 20 20 VAL HG23 H 1 0.81 0.01 . 1 . . . . 20 . . . 6142 1 210 . 1 1 21 21 GLU H H 1 9.11 0.01 . 1 . . . . 21 . . . 6142 1 211 . 1 1 21 21 GLU N N 15 126.6 0.2 . 1 . . . . 21 . . . 6142 1 212 . 1 1 21 21 GLU CA C 13 58.8 0.3 . 1 . . . . 21 . . . 6142 1 213 . 1 1 21 21 GLU HA H 1 4.18 0.01 . 1 . . . . 21 . . . 6142 1 214 . 1 1 21 21 GLU CB C 13 29.7 0.3 . 1 . . . . 21 . . . 6142 1 215 . 1 1 21 21 GLU HB2 H 1 2.05 0.01 . 1 . . . . 21 . . . 6142 1 216 . 1 1 21 21 GLU HB3 H 1 2.05 0.01 . 1 . . . . 21 . . . 6142 1 217 . 1 1 21 21 GLU CG C 13 28.4 0.3 . 1 . . . . 21 . . . 6142 1 218 . 1 1 21 21 GLU HG2 H 1 1.84 0.01 . 1 . . . . 21 . . . 6142 1 219 . 1 1 21 21 GLU HG3 H 1 1.84 0.01 . 1 . . . . 21 . . . 6142 1 220 . 1 1 22 22 GLU H H 1 7.21 0.01 . 1 . . . . 22 . . . 6142 1 221 . 1 1 22 22 GLU N N 15 113.2 0.2 . 1 . . . . 22 . . . 6142 1 222 . 1 1 22 22 GLU CA C 13 53.5 0.3 . 1 . . . . 22 . . . 6142 1 223 . 1 1 22 22 GLU HA H 1 4.45 0.01 . 1 . . . . 22 . . . 6142 1 224 . 1 1 22 22 GLU CB C 13 29.6 0.3 . 1 . . . . 22 . . . 6142 1 225 . 1 1 22 22 GLU HB2 H 1 2.22 0.01 . 1 . . . . 22 . . . 6142 1 226 . 1 1 22 22 GLU HB3 H 1 1.66 0.01 . 1 . . . . 22 . . . 6142 1 227 . 1 1 22 22 GLU CG C 13 36.2 0.3 . 1 . . . . 22 . . . 6142 1 228 . 1 1 22 22 GLU HG2 H 1 2.03 0.01 . 1 . . . . 22 . . . 6142 1 229 . 1 1 22 22 GLU HG3 H 1 2.03 0.01 . 1 . . . . 22 . . . 6142 1 230 . 1 1 23 23 VAL CA C 13 64 0.3 . 1 . . . . 23 . . . 6142 1 231 . 1 1 23 23 VAL CB C 13 29.1 0.3 . 1 . . . . 23 . . . 6142 1 232 . 1 1 24 24 ASN H H 1 6.86 0.01 . 1 . . . . 24 . . . 6142 1 233 . 1 1 24 24 ASN N N 15 122.9 0.2 . 1 . . . . 24 . . . 6142 1 234 . 1 1 24 24 ASN CA C 13 49.8 0.3 . 1 . . . . 24 . . . 6142 1 235 . 1 1 24 24 ASN HA H 1 4.92 0.01 . 1 . . . . 24 . . . 6142 1 236 . 1 1 24 24 ASN CB C 13 39.2 0.3 . 1 . . . . 24 . . . 6142 1 237 . 1 1 24 24 ASN HB2 H 1 3.42 0.01 . 1 . . . . 24 . . . 6142 1 238 . 1 1 24 24 ASN HB3 H 1 2.85 0.01 . 1 . . . . 24 . . . 6142 1 239 . 1 1 25 25 ALA CA C 13 55.5 0.3 . 1 . . . . 25 . . . 6142 1 240 . 1 1 25 25 ALA CB C 13 17.6 0.3 . 1 . . . . 25 . . . 6142 1 241 . 1 1 26 26 GLU H H 1 7.92 0.01 . 1 . . . . 26 . . . 6142 1 242 . 1 1 26 26 GLU N N 15 116.7 0.2 . 1 . . . . 26 . . . 6142 1 243 . 1 1 26 26 GLU CA C 13 59.5 0.3 . 1 . . . . 26 . . . 6142 1 244 . 1 1 26 26 GLU HA H 1 4.23 0.01 . 1 . . . . 26 . . . 6142 1 245 . 1 1 26 26 GLU CB C 13 28.5 0.3 . 1 . . . . 26 . . . 6142 1 246 . 1 1 26 26 GLU HB2 H 1 2.18 0.01 . 1 . . . . 26 . . . 6142 1 247 . 1 1 26 26 GLU HB3 H 1 2.18 0.01 . 1 . . . . 26 . . . 6142 1 248 . 1 1 26 26 GLU CG C 13 36.4 0.3 . 1 . . . . 26 . . . 6142 1 249 . 1 1 26 26 GLU HG2 H 1 2.33 0.01 . 1 . . . . 26 . . . 6142 1 250 . 1 1 26 26 GLU HG3 H 1 2.33 0.01 . 1 . . . . 26 . . . 6142 1 251 . 1 1 27 27 ILE H H 1 7.81 0.01 . 1 . . . . 27 . . . 6142 1 252 . 1 1 27 27 ILE N N 15 116.3 0.2 . 1 . . . . 27 . . . 6142 1 253 . 1 1 27 27 ILE CA C 13 60.5 0.3 . 1 . . . . 27 . . . 6142 1 254 . 1 1 27 27 ILE HA H 1 3.97 0.01 . 1 . . . . 27 . . . 6142 1 255 . 1 1 27 27 ILE CB C 13 34.5 0.3 . 1 . . . . 27 . . . 6142 1 256 . 1 1 27 27 ILE HB H 1 2.42 0.01 . 1 . . . . 27 . . . 6142 1 257 . 1 1 28 28 GLN H H 1 8.22 0.01 . 1 . . . . 28 . . . 6142 1 258 . 1 1 28 28 GLN N N 15 115.3 0.2 . 1 . . . . 28 . . . 6142 1 259 . 1 1 28 28 GLN CA C 13 60.2 0.3 . 1 . . . . 28 . . . 6142 1 260 . 1 1 28 28 GLN HA H 1 3.8 0.01 . 1 . . . . 28 . . . 6142 1 261 . 1 1 28 28 GLN CB C 13 26.4 0.3 . 1 . . . . 28 . . . 6142 1 262 . 1 1 28 28 GLN HB2 H 1 2.29 0.01 . 1 . . . . 28 . . . 6142 1 263 . 1 1 28 28 GLN HB3 H 1 2.29 0.01 . 1 . . . . 28 . . . 6142 1 264 . 1 1 29 29 ARG H H 1 7.8 0.01 . 1 . . . . 29 . . . 6142 1 265 . 1 1 29 29 ARG N N 15 116.8 0.2 . 1 . . . . 29 . . . 6142 1 266 . 1 1 29 29 ARG CA C 13 59.2 0.3 . 1 . . . . 29 . . . 6142 1 267 . 1 1 29 29 ARG HA H 1 4.2 0.01 . 1 . . . . 29 . . . 6142 1 268 . 1 1 29 29 ARG CB C 13 28.5 0.3 . 1 . . . . 29 . . . 6142 1 269 . 1 1 29 29 ARG HB2 H 1 2.19 0.01 . 1 . . . . 29 . . . 6142 1 270 . 1 1 29 29 ARG HB3 H 1 2.02 0.01 . 1 . . . . 29 . . . 6142 1 271 . 1 1 29 29 ARG CG C 13 28.5 0.3 . 1 . . . . 29 . . . 6142 1 272 . 1 1 29 29 ARG HG2 H 1 1.93 0.01 . 1 . . . . 29 . . . 6142 1 273 . 1 1 29 29 ARG HG3 H 1 1.93 0.01 . 1 . . . . 29 . . . 6142 1 274 . 1 1 29 29 ARG CD C 13 43.3 0.3 . 1 . . . . 29 . . . 6142 1 275 . 1 1 29 29 ARG HD2 H 1 3.29 0.01 . 1 . . . . 29 . . . 6142 1 276 . 1 1 29 29 ARG HD3 H 1 3.33 0.01 . 1 . . . . 29 . . . 6142 1 277 . 1 1 30 30 ILE H H 1 7.77 0.01 . 1 . . . . 30 . . . 6142 1 278 . 1 1 30 30 ILE N N 15 118.0 0.2 . 1 . . . . 30 . . . 6142 1 279 . 1 1 30 30 ILE CA C 13 65.9 0.3 . 1 . . . . 30 . . . 6142 1 280 . 1 1 30 30 ILE HA H 1 3.68 0.01 . 1 . . . . 30 . . . 6142 1 281 . 1 1 30 30 ILE CB C 13 37.9 0.3 . 1 . . . . 30 . . . 6142 1 282 . 1 1 30 30 ILE HB H 1 2.09 0.01 . 1 . . . . 30 . . . 6142 1 283 . 1 1 30 30 ILE CG2 C 13 15.9 0.3 . 1 . . . . 30 . . . 6142 1 284 . 1 1 30 30 ILE HG21 H 1 0.89 0.01 . 1 . . . . 30 . . . 6142 1 285 . 1 1 30 30 ILE HG22 H 1 0.89 0.01 . 1 . . . . 30 . . . 6142 1 286 . 1 1 30 30 ILE HG23 H 1 0.89 0.01 . 1 . . . . 30 . . . 6142 1 287 . 1 1 30 30 ILE CG1 C 13 22.0 0.3 . 1 . . . . 30 . . . 6142 1 288 . 1 1 30 30 ILE HG12 H 1 1.9 0.01 . 1 . . . . 30 . . . 6142 1 289 . 1 1 30 30 ILE HG13 H 1 1.12 0.01 . 1 . . . . 30 . . . 6142 1 290 . 1 1 30 30 ILE CD1 C 13 20.0 0.3 . 1 . . . . 30 . . . 6142 1 291 . 1 1 30 30 ILE HD11 H 1 0.81 0.01 . 1 . . . . 30 . . . 6142 1 292 . 1 1 30 30 ILE HD12 H 1 0.81 0.01 . 1 . . . . 30 . . . 6142 1 293 . 1 1 30 30 ILE HD13 H 1 0.81 0.01 . 1 . . . . 30 . . . 6142 1 294 . 1 1 31 31 VAL H H 1 8.35 0.01 . 1 . . . . 31 . . . 6142 1 295 . 1 1 31 31 VAL N N 15 118.4 0.2 . 1 . . . . 31 . . . 6142 1 296 . 1 1 31 31 VAL CA C 13 66.8 0.3 . 1 . . . . 31 . . . 6142 1 297 . 1 1 31 31 VAL HA H 1 5.33 0.01 . 1 . . . . 31 . . . 6142 1 298 . 1 1 31 31 VAL CB C 13 31.1 0.3 . 1 . . . . 31 . . . 6142 1 299 . 1 1 31 31 VAL HB H 1 3.37 0.01 . 1 . . . . 31 . . . 6142 1 300 . 1 1 32 32 ASP H H 1 8.13 0.01 . 1 . . . . 32 . . . 6142 1 301 . 1 1 32 32 ASP N N 15 117.9 0.2 . 1 . . . . 32 . . . 6142 1 302 . 1 1 32 32 ASP CA C 13 58.3 0.3 . 1 . . . . 32 . . . 6142 1 303 . 1 1 32 32 ASP HA H 1 4.73 0.01 . 1 . . . . 32 . . . 6142 1 304 . 1 1 32 32 ASP CB C 13 39.2 0.3 . 1 . . . . 32 . . . 6142 1 305 . 1 1 32 32 ASP HB2 H 1 2.99 0.01 . 1 . . . . 32 . . . 6142 1 306 . 1 1 32 32 ASP HB3 H 1 2.99 0.01 . 1 . . . . 32 . . . 6142 1 307 . 1 1 33 33 ASP H H 1 8.84 0.01 . 1 . . . . 33 . . . 6142 1 308 . 1 1 33 33 ASP N N 15 121.4 0.2 . 1 . . . . 33 . . . 6142 1 309 . 1 1 33 33 ASP CA C 13 57.2 0.3 . 1 . . . . 33 . . . 6142 1 310 . 1 1 33 33 ASP HA H 1 4.77 0.01 . 1 . . . . 33 . . . 6142 1 311 . 1 1 33 33 ASP CB C 13 39.7 0.3 . 1 . . . . 33 . . . 6142 1 312 . 1 1 33 33 ASP HB2 H 1 2.90 0.01 . 1 . . . . 33 . . . 6142 1 313 . 1 1 33 33 ASP HB3 H 1 2.73 0.01 . 1 . . . . 33 . . . 6142 1 314 . 1 1 34 34 MET H H 1 9.4 0.01 . 1 . . . . 34 . . . 6142 1 315 . 1 1 34 34 MET N N 15 122.4 0.2 . 1 . . . . 34 . . . 6142 1 316 . 1 1 34 34 MET CA C 13 60.8 0.3 . 1 . . . . 34 . . . 6142 1 317 . 1 1 34 34 MET HA H 1 3.58 0.01 . 1 . . . . 34 . . . 6142 1 318 . 1 1 34 34 MET CB C 13 32.4 0.3 . 1 . . . . 34 . . . 6142 1 319 . 1 1 34 34 MET HB2 H 1 2.77 0.01 . 1 . . . . 34 . . . 6142 1 320 . 1 1 34 34 MET HB3 H 1 2.77 0.01 . 1 . . . . 34 . . . 6142 1 321 . 1 1 34 34 MET CG C 13 31.3 0.3 . 1 . . . . 34 . . . 6142 1 322 . 1 1 34 34 MET HG2 H 1 2.27 0.01 . 1 . . . . 34 . . . 6142 1 323 . 1 1 34 34 MET HG3 H 1 2.27 0.01 . 1 . . . . 34 . . . 6142 1 324 . 1 1 34 34 MET CE C 13 14.2 0.3 . 1 . . . . 34 . . . 6142 1 325 . 1 1 34 34 MET HE1 H 1 2.02 0.01 . 1 . . . . 34 . . . 6142 1 326 . 1 1 34 34 MET HE2 H 1 2.02 0.01 . 1 . . . . 34 . . . 6142 1 327 . 1 1 34 34 MET HE3 H 1 2.02 0.01 . 1 . . . . 34 . . . 6142 1 328 . 1 1 35 35 PHE H H 1 8.69 0.01 . 1 . . . . 35 . . . 6142 1 329 . 1 1 35 35 PHE N N 15 116.2 0.2 . 1 . . . . 35 . . . 6142 1 330 . 1 1 35 35 PHE CA C 13 64.1 0.3 . 1 . . . . 35 . . . 6142 1 331 . 1 1 35 35 PHE HA H 1 3.98 0.01 . 1 . . . . 35 . . . 6142 1 332 . 1 1 35 35 PHE CB C 13 38.5 0.3 . 1 . . . . 35 . . . 6142 1 333 . 1 1 35 35 PHE HB2 H 1 3.2 0.01 . 1 . . . . 35 . . . 6142 1 334 . 1 1 35 35 PHE HB3 H 1 3.2 0.01 . 1 . . . . 35 . . . 6142 1 335 . 1 1 35 35 PHE HD1 H 1 7.27 0.01 . 1 . . . . 35 . . . 6142 1 336 . 1 1 35 35 PHE HD2 H 1 7.27 0.01 . 1 . . . . 35 . . . 6142 1 337 . 1 1 35 35 PHE HE1 H 1 7.13 0.01 . 1 . . . . 35 . . . 6142 1 338 . 1 1 35 35 PHE HE2 H 1 7.13 0.01 . 1 . . . . 35 . . . 6142 1 339 . 1 1 36 36 GLU H H 1 8.1 0.01 . 1 . . . . 36 . . . 6142 1 340 . 1 1 36 36 GLU N N 15 115.0 0.2 . 1 . . . . 36 . . . 6142 1 341 . 1 1 36 36 GLU CA C 13 60.6 0.3 . 1 . . . . 36 . . . 6142 1 342 . 1 1 36 36 GLU HA H 1 4.11 0.01 . 1 . . . . 36 . . . 6142 1 343 . 1 1 36 36 GLU CB C 13 28.8 0.3 . 1 . . . . 36 . . . 6142 1 344 . 1 1 36 36 GLU HB2 H 1 2.27 0.01 . 1 . . . . 36 . . . 6142 1 345 . 1 1 36 36 GLU HB3 H 1 2.27 0.01 . 1 . . . . 36 . . . 6142 1 346 . 1 1 36 36 GLU CG C 13 36.7 0.3 . 1 . . . . 36 . . . 6142 1 347 . 1 1 36 36 GLU HG2 H 1 2.58 0.01 . 1 . . . . 36 . . . 6142 1 348 . 1 1 36 36 GLU HG3 H 1 2.58 0.01 . 1 . . . . 36 . . . 6142 1 349 . 1 1 37 37 THR H H 1 8.39 0.01 . 1 . . . . 37 . . . 6142 1 350 . 1 1 37 37 THR N N 15 113.7 0.2 . 1 . . . . 37 . . . 6142 1 351 . 1 1 37 37 THR CA C 13 67 0.3 . 1 . . . . 37 . . . 6142 1 352 . 1 1 37 37 THR HA H 1 3.93 0.01 . 1 . . . . 37 . . . 6142 1 353 . 1 1 37 37 THR CB C 13 68.8 0.3 . 1 . . . . 37 . . . 6142 1 354 . 1 1 37 37 THR HB H 1 4.23 0.01 . 1 . . . . 37 . . . 6142 1 355 . 1 1 37 37 THR CG2 C 13 22.7 0.3 . 1 . . . . 37 . . . 6142 1 356 . 1 1 37 37 THR HG21 H 1 1.14 0.01 . 1 . . . . 37 . . . 6142 1 357 . 1 1 37 37 THR HG22 H 1 1.14 0.01 . 1 . . . . 37 . . . 6142 1 358 . 1 1 37 37 THR HG23 H 1 1.14 0.01 . 1 . . . . 37 . . . 6142 1 359 . 1 1 38 38 MET H H 1 8.64 0.01 . 1 . . . . 38 . . . 6142 1 360 . 1 1 38 38 MET N N 15 119.8 0.2 . 1 . . . . 38 . . . 6142 1 361 . 1 1 38 38 MET CA C 13 60 0.3 . 1 . . . . 38 . . . 6142 1 362 . 1 1 38 38 MET HA H 1 3.37 0.01 . 1 . . . . 38 . . . 6142 1 363 . 1 1 38 38 MET CB C 13 32.7 0.3 . 1 . . . . 38 . . . 6142 1 364 . 1 1 38 38 MET HB2 H 1 1.95 0.01 . 1 . . . . 38 . . . 6142 1 365 . 1 1 38 38 MET HB3 H 1 1.95 0.01 . 1 . . . . 38 . . . 6142 1 366 . 1 1 38 38 MET CG C 13 32.9 0.3 . 1 . . . . 38 . . . 6142 1 367 . 1 1 38 38 MET HG2 H 1 1.73 0.01 . 1 . . . . 38 . . . 6142 1 368 . 1 1 38 38 MET HG3 H 1 1.73 0.01 . 1 . . . . 38 . . . 6142 1 369 . 1 1 39 39 TYR H H 1 8.67 0.01 . 1 . . . . 39 . . . 6142 1 370 . 1 1 39 39 TYR N N 15 112.6 0.2 . 1 . . . . 39 . . . 6142 1 371 . 1 1 39 39 TYR CA C 13 60.2 0.3 . 1 . . . . 39 . . . 6142 1 372 . 1 1 39 39 TYR HA H 1 4.7 0.01 . 1 . . . . 39 . . . 6142 1 373 . 1 1 39 39 TYR CB C 13 36.7 0.3 . 1 . . . . 39 . . . 6142 1 374 . 1 1 39 39 TYR HB2 H 1 2.98 0.01 . 1 . . . . 39 . . . 6142 1 375 . 1 1 39 39 TYR HB3 H 1 3.25 0.01 . 1 . . . . 39 . . . 6142 1 376 . 1 1 39 39 TYR HD1 H 1 7.28 0.01 . 1 . . . . 39 . . . 6142 1 377 . 1 1 39 39 TYR HD2 H 1 7.28 0.01 . 1 . . . . 39 . . . 6142 1 378 . 1 1 39 39 TYR HE1 H 1 7.13 0.01 . 1 . . . . 39 . . . 6142 1 379 . 1 1 39 39 TYR HE2 H 1 7.13 0.01 . 1 . . . . 39 . . . 6142 1 380 . 1 1 40 40 ALA H H 1 8.2 0.01 . 1 . . . . 40 . . . 6142 1 381 . 1 1 40 40 ALA N N 15 121.2 0.2 . 1 . . . . 40 . . . 6142 1 382 . 1 1 40 40 ALA CA C 13 56.2 0.3 . 1 . . . . 40 . . . 6142 1 383 . 1 1 40 40 ALA HA H 1 4.3 0.01 . 1 . . . . 40 . . . 6142 1 384 . 1 1 40 40 ALA CB C 13 17.5 0.3 . 1 . . . . 40 . . . 6142 1 385 . 1 1 40 40 ALA HB1 H 1 1.73 0.01 . 1 . . . . 40 . . . 6142 1 386 . 1 1 40 40 ALA HB2 H 1 1.73 0.01 . 1 . . . . 40 . . . 6142 1 387 . 1 1 40 40 ALA HB3 H 1 1.73 0.01 . 1 . . . . 40 . . . 6142 1 388 . 1 1 41 41 GLU H H 1 7.97 0.01 . 1 . . . . 41 . . . 6142 1 389 . 1 1 41 41 GLU N N 15 112.7 0.2 . 1 . . . . 41 . . . 6142 1 390 . 1 1 41 41 GLU CA C 13 56.2 0.3 . 1 . . . . 41 . . . 6142 1 391 . 1 1 41 41 GLU HA H 1 4.4 0.01 . 1 . . . . 41 . . . 6142 1 392 . 1 1 41 41 GLU CB C 13 29.9 0.3 . 1 . . . . 41 . . . 6142 1 393 . 1 1 41 41 GLU HB2 H 1 1.72 0.01 . 1 . . . . 41 . . . 6142 1 394 . 1 1 41 41 GLU HB3 H 1 1.72 0.01 . 1 . . . . 41 . . . 6142 1 395 . 1 1 41 41 GLU CG C 13 41.5 0.3 . 1 . . . . 41 . . . 6142 1 396 . 1 1 41 41 GLU HG2 H 1 2.63 0.01 . 1 . . . . 41 . . . 6142 1 397 . 1 1 41 41 GLU HG3 H 1 2.63 0.01 . 1 . . . . 41 . . . 6142 1 398 . 1 1 42 42 GLU H H 1 7.86 0.01 . 1 . . . . 42 . . . 6142 1 399 . 1 1 42 42 GLU N N 15 110.4 0.2 . 1 . . . . 42 . . . 6142 1 400 . 1 1 42 42 GLU CA C 13 57.5 0.3 . 1 . . . . 42 . . . 6142 1 401 . 1 1 42 42 GLU HA H 1 4.0 0.01 . 1 . . . . 42 . . . 6142 1 402 . 1 1 42 42 GLU CB C 13 25.6 0.3 . 1 . . . . 42 . . . 6142 1 403 . 1 1 42 42 GLU HB2 H 1 2.17 0.01 . 1 . . . . 42 . . . 6142 1 404 . 1 1 42 42 GLU HB3 H 1 2.36 0.01 . 1 . . . . 42 . . . 6142 1 405 . 1 1 42 42 GLU CG C 13 36.5 0.3 . 1 . . . . 42 . . . 6142 1 406 . 1 1 42 42 GLU HG2 H 1 2.32 0.01 . 1 . . . . 42 . . . 6142 1 407 . 1 1 42 42 GLU HG3 H 1 2.27 0.01 . 1 . . . . 42 . . . 6142 1 408 . 1 1 43 43 GLY H H 1 8.24 0.01 . 1 . . . . 43 . . . 6142 1 409 . 1 1 43 43 GLY N N 15 100.5 0.2 . 1 . . . . 43 . . . 6142 1 410 . 1 1 43 43 GLY CA C 13 43.3 0.3 . 1 . . . . 43 . . . 6142 1 411 . 1 1 43 43 GLY HA2 H 1 4.96 0.01 . 2 . . . . 43 . . . 6142 1 412 . 1 1 43 43 GLY HA3 H 1 3.32 0.01 . 2 . . . . 43 . . . 6142 1 413 . 1 1 44 44 ILE H H 1 8.56 0.01 . 1 . . . . 44 . . . 6142 1 414 . 1 1 44 44 ILE N N 15 106.1 0.2 . 1 . . . . 44 . . . 6142 1 415 . 1 1 44 44 ILE CA C 13 61.2 0.3 . 1 . . . . 44 . . . 6142 1 416 . 1 1 44 44 ILE HA H 1 4.72 0.01 . 1 . . . . 44 . . . 6142 1 417 . 1 1 44 44 ILE CB C 13 37.7 0.3 . 1 . . . . 44 . . . 6142 1 418 . 1 1 44 44 ILE HB H 1 3.25 0.01 . 1 . . . . 44 . . . 6142 1 419 . 1 1 44 44 ILE CG2 C 13 18.3 0.3 . 1 . . . . 44 . . . 6142 1 420 . 1 1 44 44 ILE HG21 H 1 1.18 0.01 . 1 . . . . 44 . . . 6142 1 421 . 1 1 44 44 ILE HG22 H 1 1.18 0.01 . 1 . . . . 44 . . . 6142 1 422 . 1 1 44 44 ILE HG23 H 1 1.18 0.01 . 1 . . . . 44 . . . 6142 1 423 . 1 1 44 44 ILE CG1 C 13 29.1 0.3 . 1 . . . . 44 . . . 6142 1 424 . 1 1 44 44 ILE HG12 H 1 1.6 0.01 . 1 . . . . 44 . . . 6142 1 425 . 1 1 44 44 ILE HG13 H 1 1.18 0.01 . 1 . . . . 44 . . . 6142 1 426 . 1 1 44 44 ILE CD1 C 13 18.2 0.3 . 1 . . . . 44 . . . 6142 1 427 . 1 1 44 44 ILE HD11 H 1 0.75 0.01 . 1 . . . . 44 . . . 6142 1 428 . 1 1 44 44 ILE HD12 H 1 0.75 0.01 . 1 . . . . 44 . . . 6142 1 429 . 1 1 44 44 ILE HD13 H 1 0.75 0.01 . 1 . . . . 44 . . . 6142 1 430 . 1 1 45 45 GLY H H 1 7.19 0.01 . 1 . . . . 45 . . . 6142 1 431 . 1 1 45 45 GLY N N 15 104.8 0.2 . 1 . . . . 45 . . . 6142 1 432 . 1 1 45 45 GLY CA C 13 45.8 0.3 . 1 . . . . 45 . . . 6142 1 433 . 1 1 45 45 GLY HA2 H 1 4.7 0.01 . 2 . . . . 45 . . . 6142 1 434 . 1 1 45 45 GLY HA3 H 1 3.6 0.01 . 2 . . . . 45 . . . 6142 1 435 . 1 1 46 46 LEU H H 1 8.74 0.01 . 1 . . . . 46 . . . 6142 1 436 . 1 1 46 46 LEU N N 15 115.4 0.2 . 1 . . . . 46 . . . 6142 1 437 . 1 1 46 46 LEU CA C 13 54.9 0.3 . 1 . . . . 46 . . . 6142 1 438 . 1 1 46 46 LEU HA H 1 4.47 0.01 . 1 . . . . 46 . . . 6142 1 439 . 1 1 46 46 LEU CB C 13 47.2 0.3 . 1 . . . . 46 . . . 6142 1 440 . 1 1 46 46 LEU HB2 H 1 1.29 0.01 . 1 . . . . 46 . . . 6142 1 441 . 1 1 46 46 LEU HB3 H 1 1.29 0.01 . 1 . . . . 46 . . . 6142 1 442 . 1 1 47 47 ALA H H 1 8.99 0.01 . 1 . . . . 47 . . . 6142 1 443 . 1 1 47 47 ALA N N 15 124.4 0.2 . 1 . . . . 47 . . . 6142 1 444 . 1 1 47 47 ALA CA C 13 49.3 0.3 . 1 . . . . 47 . . . 6142 1 445 . 1 1 47 47 ALA HA H 1 5.19 0.01 . 1 . . . . 47 . . . 6142 1 446 . 1 1 47 47 ALA CB C 13 21.3 0.3 . 1 . . . . 47 . . . 6142 1 447 . 1 1 47 47 ALA HB1 H 1 1.69 0.01 . 1 . . . . 47 . . . 6142 1 448 . 1 1 47 47 ALA HB2 H 1 1.69 0.01 . 1 . . . . 47 . . . 6142 1 449 . 1 1 47 47 ALA HB3 H 1 1.69 0.01 . 1 . . . . 47 . . . 6142 1 450 . 1 1 48 48 ALA H H 1 8.6 0.01 . 1 . . . . 48 . . . 6142 1 451 . 1 1 48 48 ALA N N 15 124.3 0.2 . 1 . . . . 48 . . . 6142 1 452 . 1 1 48 48 ALA CA C 13 55.8 0.3 . 1 . . . . 48 . . . 6142 1 453 . 1 1 48 48 ALA HA H 1 3.96 0.01 . 1 . . . . 48 . . . 6142 1 454 . 1 1 48 48 ALA CB C 13 17.5 0.3 . 1 . . . . 48 . . . 6142 1 455 . 1 1 48 48 ALA HB1 H 1 1.76 0.01 . 1 . . . . 48 . . . 6142 1 456 . 1 1 48 48 ALA HB2 H 1 1.76 0.01 . 1 . . . . 48 . . . 6142 1 457 . 1 1 48 48 ALA HB3 H 1 1.76 0.01 . 1 . . . . 48 . . . 6142 1 458 . 1 1 49 49 THR H H 1 7.08 0.01 . 1 . . . . 49 . . . 6142 1 459 . 1 1 49 49 THR N N 15 110.4 0.2 . 1 . . . . 49 . . . 6142 1 460 . 1 1 49 49 THR CA C 13 67.2 0.3 . 1 . . . . 49 . . . 6142 1 461 . 1 1 49 49 THR HA H 1 3.3 0.01 . 1 . . . . 49 . . . 6142 1 462 . 1 1 49 49 THR CB C 13 72.2 0.3 . 1 . . . . 49 . . . 6142 1 463 . 1 1 49 49 THR HB H 1 4.71 0.01 . 1 . . . . 49 . . . 6142 1 464 . 1 1 50 50 GLN H H 1 7.5 0.01 . 1 . . . . 50 . . . 6142 1 465 . 1 1 50 50 GLN N N 15 108.5 0.2 . 1 . . . . 50 . . . 6142 1 466 . 1 1 50 50 GLN CA C 13 58 0.3 . 1 . . . . 50 . . . 6142 1 467 . 1 1 50 50 GLN HA H 1 3.8 0.01 . 1 . . . . 50 . . . 6142 1 468 . 1 1 50 50 GLN CB C 13 31.7 0.3 . 1 . . . . 50 . . . 6142 1 469 . 1 1 50 50 GLN HB2 H 1 2.35 0.01 . 1 . . . . 50 . . . 6142 1 470 . 1 1 50 50 GLN HB3 H 1 2.05 0.01 . 1 . . . . 50 . . . 6142 1 471 . 1 1 50 50 GLN CG C 13 36.5 0.3 . 1 . . . . 50 . . . 6142 1 472 . 1 1 50 50 GLN HG2 H 1 1.95 0.01 . 1 . . . . 50 . . . 6142 1 473 . 1 1 50 50 GLN HG3 H 1 1.37 0.01 . 1 . . . . 50 . . . 6142 1 474 . 1 1 51 51 VAL H H 1 7.86 0.01 . 1 . . . . 51 . . . 6142 1 475 . 1 1 51 51 VAL N N 15 105.8 0.2 . 1 . . . . 51 . . . 6142 1 476 . 1 1 51 51 VAL CA C 13 60.8 0.3 . 1 . . . . 51 . . . 6142 1 477 . 1 1 51 51 VAL HA H 1 5.02 0.01 . 1 . . . . 51 . . . 6142 1 478 . 1 1 51 51 VAL CB C 13 29 0.3 . 1 . . . . 51 . . . 6142 1 479 . 1 1 51 51 VAL HB H 1 2.5 0.01 . 1 . . . . 51 . . . 6142 1 480 . 1 1 52 52 ASP H H 1 7.85 0.01 . 1 . . . . 52 . . . 6142 1 481 . 1 1 52 52 ASP N N 15 115.5 0.2 . 1 . . . . 52 . . . 6142 1 482 . 1 1 52 52 ASP CA C 13 54.4 0.3 . 1 . . . . 52 . . . 6142 1 483 . 1 1 52 52 ASP HA H 1 4.1 0.01 . 1 . . . . 52 . . . 6142 1 484 . 1 1 52 52 ASP CB C 13 40.5 0.3 . 1 . . . . 52 . . . 6142 1 485 . 1 1 52 52 ASP HB2 H 1 2.1 0.01 . 1 . . . . 52 . . . 6142 1 486 . 1 1 52 52 ASP HB3 H 1 3.4 0.01 . 1 . . . . 52 . . . 6142 1 487 . 1 1 53 53 ILE H H 1 7.2 0.01 . 1 . . . . 53 . . . 6142 1 488 . 1 1 53 53 ILE N N 15 116.5 0.2 . 1 . . . . 53 . . . 6142 1 489 . 1 1 53 53 ILE CA C 13 60 0.3 . 1 . . . . 53 . . . 6142 1 490 . 1 1 53 53 ILE HA H 1 3.98 0.01 . 1 . . . . 53 . . . 6142 1 491 . 1 1 53 53 ILE CB C 13 38.6 0.3 . 1 . . . . 53 . . . 6142 1 492 . 1 1 53 53 ILE HB H 1 1.58 0.01 . 1 . . . . 53 . . . 6142 1 493 . 1 1 53 53 ILE CG2 C 13 17.7 0.3 . 1 . . . . 53 . . . 6142 1 494 . 1 1 53 53 ILE HG21 H 1 0.75 0.01 . 1 . . . . 53 . . . 6142 1 495 . 1 1 53 53 ILE HG22 H 1 0.75 0.01 . 1 . . . . 53 . . . 6142 1 496 . 1 1 53 53 ILE HG23 H 1 0.75 0.01 . 1 . . . . 53 . . . 6142 1 497 . 1 1 53 53 ILE CG1 C 13 21.9 0.3 . 1 . . . . 53 . . . 6142 1 498 . 1 1 53 53 ILE HG12 H 1 0.81 0.01 . 1 . . . . 53 . . . 6142 1 499 . 1 1 53 53 ILE HG13 H 1 1.34 0.01 . 1 . . . . 53 . . . 6142 1 500 . 1 1 53 53 ILE HD11 H 1 0.75 0.01 . 1 . . . . 53 . . . 6142 1 501 . 1 1 53 53 ILE HD12 H 1 0.75 0.01 . 1 . . . . 53 . . . 6142 1 502 . 1 1 53 53 ILE HD13 H 1 0.75 0.01 . 1 . . . . 53 . . . 6142 1 503 . 1 1 54 54 HIS H H 1 8.21 0.01 . 1 . . . . 54 . . . 6142 1 504 . 1 1 54 54 HIS N N 15 125.3 0.2 . 1 . . . . 54 . . . 6142 1 505 . 1 1 54 54 HIS CA C 13 55.7 0.3 . 1 . . . . 54 . . . 6142 1 506 . 1 1 54 54 HIS HA H 1 4.69 0.01 . 1 . . . . 54 . . . 6142 1 507 . 1 1 54 54 HIS CB C 13 27.9 0.3 . 1 . . . . 54 . . . 6142 1 508 . 1 1 54 54 HIS HB2 H 1 2.87 0.01 . 1 . . . . 54 . . . 6142 1 509 . 1 1 54 54 HIS HB3 H 1 2.99 0.01 . 1 . . . . 54 . . . 6142 1 510 . 1 1 55 55 GLN H H 1 8.1 0.01 . 1 . . . . 55 . . . 6142 1 511 . 1 1 55 55 GLN N N 15 117.7 0.2 . 1 . . . . 55 . . . 6142 1 512 . 1 1 55 55 GLN CA C 13 54.5 0.3 . 1 . . . . 55 . . . 6142 1 513 . 1 1 55 55 GLN HA H 1 4.15 0.01 . 1 . . . . 55 . . . 6142 1 514 . 1 1 55 55 GLN CB C 13 29.1 0.3 . 1 . . . . 55 . . . 6142 1 515 . 1 1 55 55 GLN HB2 H 1 2.21 0.01 . 1 . . . . 55 . . . 6142 1 516 . 1 1 55 55 GLN HB3 H 1 1.95 0.01 . 1 . . . . 55 . . . 6142 1 517 . 1 1 55 55 GLN CG C 13 36.5 0.3 . 1 . . . . 55 . . . 6142 1 518 . 1 1 55 55 GLN HG2 H 1 2.04 0.01 . 1 . . . . 55 . . . 6142 1 519 . 1 1 55 55 GLN HG3 H 1 2.32 0.01 . 1 . . . . 55 . . . 6142 1 520 . 1 1 56 56 ARG H H 1 7.86 0.01 . 1 . . . . 56 . . . 6142 1 521 . 1 1 56 56 ARG N N 15 116.0 0.2 . 1 . . . . 56 . . . 6142 1 522 . 1 1 56 56 ARG CA C 13 57.7 0.3 . 1 . . . . 56 . . . 6142 1 523 . 1 1 56 56 ARG HA H 1 4.1 0.01 . 1 . . . . 56 . . . 6142 1 524 . 1 1 56 56 ARG CB C 13 27.6 0.3 . 1 . . . . 56 . . . 6142 1 525 . 1 1 56 56 ARG HB2 H 1 3.41 0.01 . 1 . . . . 56 . . . 6142 1 526 . 1 1 56 56 ARG HB3 H 1 2.09 0.01 . 1 . . . . 56 . . . 6142 1 527 . 1 1 57 57 ILE H H 1 8.08 0.01 . 1 . . . . 57 . . . 6142 1 528 . 1 1 57 57 ILE N N 15 123.7 0.2 . 1 . . . . 57 . . . 6142 1 529 . 1 1 57 57 ILE CA C 13 61 0.3 . 1 . . . . 57 . . . 6142 1 530 . 1 1 57 57 ILE HA H 1 4.58 0.01 . 1 . . . . 57 . . . 6142 1 531 . 1 1 57 57 ILE CB C 13 41.7 0.3 . 1 . . . . 57 . . . 6142 1 532 . 1 1 57 57 ILE HB H 1 1.52 0.01 . 1 . . . . 57 . . . 6142 1 533 . 1 1 57 57 ILE CG2 C 13 23.5 0.3 . 1 . . . . 57 . . . 6142 1 534 . 1 1 57 57 ILE HG21 H 1 0.75 0.01 . 1 . . . . 57 . . . 6142 1 535 . 1 1 57 57 ILE HG22 H 1 0.75 0.01 . 1 . . . . 57 . . . 6142 1 536 . 1 1 57 57 ILE HG23 H 1 0.75 0.01 . 1 . . . . 57 . . . 6142 1 537 . 1 1 57 57 ILE CG1 C 13 27.4 0.3 . 1 . . . . 57 . . . 6142 1 538 . 1 1 57 57 ILE HG12 H 1 0.78 0.01 . 1 . . . . 57 . . . 6142 1 539 . 1 1 57 57 ILE HG13 H 1 0.78 0.01 . 1 . . . . 57 . . . 6142 1 540 . 1 1 57 57 ILE CD1 C 13 20.1 0.3 . 1 . . . . 57 . . . 6142 1 541 . 1 1 57 57 ILE HD11 H 1 0.67 0.01 . 1 . . . . 57 . . . 6142 1 542 . 1 1 57 57 ILE HD12 H 1 0.67 0.01 . 1 . . . . 57 . . . 6142 1 543 . 1 1 57 57 ILE HD13 H 1 0.67 0.01 . 1 . . . . 57 . . . 6142 1 544 . 1 1 58 58 ILE H H 1 8.73 0.01 . 1 . . . . 58 . . . 6142 1 545 . 1 1 58 58 ILE N N 15 125.6 0.2 . 1 . . . . 58 . . . 6142 1 546 . 1 1 58 58 ILE CA C 13 59.2 0.3 . 1 . . . . 58 . . . 6142 1 547 . 1 1 58 58 ILE HA H 1 4.9 0.01 . 1 . . . . 58 . . . 6142 1 548 . 1 1 58 58 ILE CB C 13 42.5 0.3 . 1 . . . . 58 . . . 6142 1 549 . 1 1 58 58 ILE HB H 1 1.82 0.01 . 1 . . . . 58 . . . 6142 1 550 . 1 1 58 58 ILE CG2 C 13 19.3 0.3 . 1 . . . . 58 . . . 6142 1 551 . 1 1 58 58 ILE HG21 H 1 0.81 0.01 . 1 . . . . 58 . . . 6142 1 552 . 1 1 58 58 ILE HG22 H 1 0.81 0.01 . 1 . . . . 58 . . . 6142 1 553 . 1 1 58 58 ILE HG23 H 1 0.81 0.01 . 1 . . . . 58 . . . 6142 1 554 . 1 1 58 58 ILE CG1 C 13 27.5 0.3 . 1 . . . . 58 . . . 6142 1 555 . 1 1 58 58 ILE HG12 H 1 0.93 0.01 . 1 . . . . 58 . . . 6142 1 556 . 1 1 58 58 ILE HG13 H 1 1.08 0.01 . 1 . . . . 58 . . . 6142 1 557 . 1 1 58 58 ILE CD1 C 13 17.9 0.3 . 1 . . . . 58 . . . 6142 1 558 . 1 1 58 58 ILE HD11 H 1 0.9 0.01 . 1 . . . . 58 . . . 6142 1 559 . 1 1 58 58 ILE HD12 H 1 0.9 0.01 . 1 . . . . 58 . . . 6142 1 560 . 1 1 58 58 ILE HD13 H 1 0.9 0.01 . 1 . . . . 58 . . . 6142 1 561 . 1 1 59 59 VAL H H 1 8.5 0.01 . 1 . . . . 59 . . . 6142 1 562 . 1 1 59 59 VAL N N 15 116.0 0.2 . 1 . . . . 59 . . . 6142 1 563 . 1 1 59 59 VAL CA C 13 58.6 0.3 . 1 . . . . 59 . . . 6142 1 564 . 1 1 59 59 VAL HA H 1 5.05 0.01 . 1 . . . . 59 . . . 6142 1 565 . 1 1 59 59 VAL CB C 13 32.2 0.3 . 1 . . . . 59 . . . 6142 1 566 . 1 1 59 59 VAL HB H 1 0.87 0.01 . 1 . . . . 59 . . . 6142 1 567 . 1 1 59 59 VAL CG1 C 13 21.3 0.3 . 1 . . . . 59 . . . 6142 1 568 . 1 1 59 59 VAL HG11 H 1 0.44 0.01 . 1 . . . . 59 . . . 6142 1 569 . 1 1 59 59 VAL HG12 H 1 0.44 0.01 . 1 . . . . 59 . . . 6142 1 570 . 1 1 59 59 VAL HG13 H 1 0.44 0.01 . 1 . . . . 59 . . . 6142 1 571 . 1 1 59 59 VAL CG2 C 13 21.5 0.3 . 1 . . . . 59 . . . 6142 1 572 . 1 1 59 59 VAL HG21 H 1 0.31 0.01 . 1 . . . . 59 . . . 6142 1 573 . 1 1 59 59 VAL HG22 H 1 0.31 0.01 . 1 . . . . 59 . . . 6142 1 574 . 1 1 59 59 VAL HG23 H 1 0.31 0.01 . 1 . . . . 59 . . . 6142 1 575 . 1 1 60 60 ILE H H 1 8.86 0.01 . 1 . . . . 60 . . . 6142 1 576 . 1 1 60 60 ILE N N 15 119.2 0.2 . 1 . . . . 60 . . . 6142 1 577 . 1 1 60 60 ILE CA C 13 60.3 0.3 . 1 . . . . 60 . . . 6142 1 578 . 1 1 60 60 ILE HA H 1 4.74 0.01 . 1 . . . . 60 . . . 6142 1 579 . 1 1 60 60 ILE CB C 13 45.4 0.3 . 1 . . . . 60 . . . 6142 1 580 . 1 1 60 60 ILE HB H 1 1.58 0.01 . 1 . . . . 60 . . . 6142 1 581 . 1 1 60 60 ILE HG12 H 1 1.17 0.01 . 1 . . . . 60 . . . 6142 1 582 . 1 1 60 60 ILE CD1 C 13 18.3 0.3 . 1 . . . . 60 . . . 6142 1 583 . 1 1 60 60 ILE HD11 H 1 0.74 0.01 . 1 . . . . 60 . . . 6142 1 584 . 1 1 60 60 ILE HD12 H 1 0.74 0.01 . 1 . . . . 60 . . . 6142 1 585 . 1 1 60 60 ILE HD13 H 1 0.74 0.01 . 1 . . . . 60 . . . 6142 1 586 . 1 1 61 61 ASP H H 1 8.37 0.01 . 1 . . . . 61 . . . 6142 1 587 . 1 1 61 61 ASP N N 15 118.5 0.2 . 1 . . . . 61 . . . 6142 1 588 . 1 1 61 61 ASP CA C 13 57.4 0.3 . 1 . . . . 61 . . . 6142 1 589 . 1 1 61 61 ASP HA H 1 5.03 0.01 . 1 . . . . 61 . . . 6142 1 590 . 1 1 61 61 ASP CB C 13 40.5 0.3 . 1 . . . . 61 . . . 6142 1 591 . 1 1 61 61 ASP HB2 H 1 3.04 0.01 . 1 . . . . 61 . . . 6142 1 592 . 1 1 61 61 ASP HB3 H 1 2.90 0.01 . 1 . . . . 61 . . . 6142 1 593 . 1 1 62 62 VAL H H 1 9.23 0.01 . 1 . . . . 62 . . . 6142 1 594 . 1 1 62 62 VAL N N 15 115.6 0.2 . 1 . . . . 62 . . . 6142 1 595 . 1 1 62 62 VAL CA C 13 60.3 0.3 . 1 . . . . 62 . . . 6142 1 596 . 1 1 62 62 VAL HA H 1 4.67 0.01 . 1 . . . . 62 . . . 6142 1 597 . 1 1 62 62 VAL CB C 13 30.7 0.3 . 1 . . . . 62 . . . 6142 1 598 . 1 1 62 62 VAL HB H 1 3.92 0.01 . 1 . . . . 62 . . . 6142 1 599 . 1 1 62 62 VAL CG1 C 13 21.2 0.3 . 1 . . . . 62 . . . 6142 1 600 . 1 1 62 62 VAL HG11 H 1 0.85 0.01 . 1 . . . . 62 . . . 6142 1 601 . 1 1 62 62 VAL HG12 H 1 0.85 0.01 . 1 . . . . 62 . . . 6142 1 602 . 1 1 62 62 VAL HG13 H 1 0.85 0.01 . 1 . . . . 62 . . . 6142 1 603 . 1 1 62 62 VAL CG2 C 13 21.2 0.3 . 1 . . . . 62 . . . 6142 1 604 . 1 1 62 62 VAL HG21 H 1 0.85 0.01 . 1 . . . . 62 . . . 6142 1 605 . 1 1 62 62 VAL HG22 H 1 0.85 0.01 . 1 . . . . 62 . . . 6142 1 606 . 1 1 62 62 VAL HG23 H 1 0.85 0.01 . 1 . . . . 62 . . . 6142 1 607 . 1 1 63 63 SER H H 1 9.25 0.01 . 1 . . . . 63 . . . 6142 1 608 . 1 1 63 63 SER N N 15 119.6 0.2 . 1 . . . . 63 . . . 6142 1 609 . 1 1 63 63 SER CA C 13 58.6 0.3 . 1 . . . . 63 . . . 6142 1 610 . 1 1 63 63 SER HA H 1 4.47 0.01 . 1 . . . . 63 . . . 6142 1 611 . 1 1 63 63 SER CB C 13 65 0.3 . 1 . . . . 63 . . . 6142 1 612 . 1 1 63 63 SER HB2 H 1 4.33 0.01 . 1 . . . . 63 . . . 6142 1 613 . 1 1 63 63 SER HB3 H 1 4.18 0.01 . 1 . . . . 63 . . . 6142 1 614 . 1 1 64 64 GLU H H 1 8.96 0.01 . 1 . . . . 64 . . . 6142 1 615 . 1 1 64 64 GLU N N 15 119.9 0.2 . 1 . . . . 64 . . . 6142 1 616 . 1 1 64 64 GLU CA C 13 58.6 0.3 . 1 . . . . 64 . . . 6142 1 617 . 1 1 64 64 GLU HA H 1 4.2 0.01 . 1 . . . . 64 . . . 6142 1 618 . 1 1 64 64 GLU CB C 13 32.3 0.3 . 1 . . . . 64 . . . 6142 1 619 . 1 1 65 65 ASN H H 1 8.54 0.01 . 1 . . . . 65 . . . 6142 1 620 . 1 1 65 65 ASN N N 15 111.5 0.2 . 1 . . . . 65 . . . 6142 1 621 . 1 1 65 65 ASN CA C 13 52.7 0.3 . 1 . . . . 65 . . . 6142 1 622 . 1 1 65 65 ASN HA H 1 4.72 0.01 . 1 . . . . 65 . . . 6142 1 623 . 1 1 65 65 ASN CB C 13 39.8 0.3 . 1 . . . . 65 . . . 6142 1 624 . 1 1 65 65 ASN HB2 H 1 2.83 0.01 . 1 . . . . 65 . . . 6142 1 625 . 1 1 65 65 ASN HB3 H 1 2.75 0.01 . 1 . . . . 65 . . . 6142 1 626 . 1 1 66 66 ARG H H 1 7.9 0.01 . 1 . . . . 66 . . . 6142 1 627 . 1 1 66 66 ARG N N 15 113.9 0.2 . 1 . . . . 66 . . . 6142 1 628 . 1 1 66 66 ARG CA C 13 55.6 0.3 . 1 . . . . 66 . . . 6142 1 629 . 1 1 66 66 ARG HA H 1 4.22 0.01 . 1 . . . . 66 . . . 6142 1 630 . 1 1 66 66 ARG CB C 13 24.5 0.3 . 1 . . . . 66 . . . 6142 1 631 . 1 1 66 66 ARG HB2 H 1 1.94 0.01 . 1 . . . . 66 . . . 6142 1 632 . 1 1 66 66 ARG HB3 H 1 1.63 0.01 . 1 . . . . 66 . . . 6142 1 633 . 1 1 66 66 ARG CD C 13 36.8 0.3 . 1 . . . . 66 . . . 6142 1 634 . 1 1 66 66 ARG HD2 H 1 3.05 0.01 . 1 . . . . 66 . . . 6142 1 635 . 1 1 66 66 ARG HD3 H 1 3.07 0.01 . 1 . . . . 66 . . . 6142 1 636 . 1 1 67 67 ASP H H 1 8.17 0.01 . 1 . . . . 67 . . . 6142 1 637 . 1 1 67 67 ASP N N 15 114.1 0.2 . 1 . . . . 67 . . . 6142 1 638 . 1 1 67 67 ASP CA C 13 51.9 0.3 . 1 . . . . 67 . . . 6142 1 639 . 1 1 67 67 ASP HA H 1 4.6 0.01 . 1 . . . . 67 . . . 6142 1 640 . 1 1 67 67 ASP CB C 13 41 0.3 . 1 . . . . 67 . . . 6142 1 641 . 1 1 67 67 ASP HB2 H 1 2.31 0.01 . 1 . . . . 67 . . . 6142 1 642 . 1 1 67 67 ASP HB3 H 1 2.76 0.01 . 1 . . . . 67 . . . 6142 1 643 . 1 1 68 68 GLU H H 1 8.18 0.01 . 1 . . . . 68 . . . 6142 1 644 . 1 1 68 68 GLU N N 15 121.7 0.2 . 1 . . . . 68 . . . 6142 1 645 . 1 1 68 68 GLU CA C 13 55 0.3 . 1 . . . . 68 . . . 6142 1 646 . 1 1 68 68 GLU HA H 1 4.63 0.01 . 1 . . . . 68 . . . 6142 1 647 . 1 1 68 68 GLU CB C 13 30.2 0.3 . 1 . . . . 68 . . . 6142 1 648 . 1 1 68 68 GLU HB2 H 1 1.89 0.01 . 1 . . . . 68 . . . 6142 1 649 . 1 1 68 68 GLU HB3 H 1 2.16 0.01 . 1 . . . . 68 . . . 6142 1 650 . 1 1 69 69 ARG H H 1 7.79 0.01 . 1 . . . . 69 . . . 6142 1 651 . 1 1 69 69 ARG N N 15 118.1 0.2 . 1 . . . . 69 . . . 6142 1 652 . 1 1 69 69 ARG CA C 13 57.5 0.3 . 1 . . . . 69 . . . 6142 1 653 . 1 1 69 69 ARG HA H 1 4.37 0.01 . 1 . . . . 69 . . . 6142 1 654 . 1 1 69 69 ARG CB C 13 30.5 0.3 . 1 . . . . 69 . . . 6142 1 655 . 1 1 69 69 ARG HB2 H 1 1.56 0.01 . 1 . . . . 69 . . . 6142 1 656 . 1 1 69 69 ARG HB3 H 1 1.38 0.01 . 1 . . . . 69 . . . 6142 1 657 . 1 1 69 69 ARG CG C 13 24.7 0.3 . 1 . . . . 69 . . . 6142 1 658 . 1 1 69 69 ARG HG2 H 1 1.16 0.01 . 1 . . . . 69 . . . 6142 1 659 . 1 1 69 69 ARG HG3 H 1 1.35 0.01 . 1 . . . . 69 . . . 6142 1 660 . 1 1 69 69 ARG CD C 13 42.9 0.3 . 1 . . . . 69 . . . 6142 1 661 . 1 1 69 69 ARG HD2 H 1 2.34 0.01 . 1 . . . . 69 . . . 6142 1 662 . 1 1 69 69 ARG HD3 H 1 2.08 0.01 . 1 . . . . 69 . . . 6142 1 663 . 1 1 70 70 LEU H H 1 9.53 0.01 . 1 . . . . 70 . . . 6142 1 664 . 1 1 70 70 LEU N N 15 124.6 0.2 . 1 . . . . 70 . . . 6142 1 665 . 1 1 70 70 LEU CA C 13 54.5 0.3 . 1 . . . . 70 . . . 6142 1 666 . 1 1 70 70 LEU HA H 1 4.71 0.01 . 1 . . . . 70 . . . 6142 1 667 . 1 1 70 70 LEU CB C 13 44.8 0.3 . 1 . . . . 70 . . . 6142 1 668 . 1 1 70 70 LEU HB2 H 1 1.66 0.01 . 1 . . . . 70 . . . 6142 1 669 . 1 1 70 70 LEU HB3 H 1 1.58 0.01 . 1 . . . . 70 . . . 6142 1 670 . 1 1 71 71 VAL H H 1 8.21 0.01 . 1 . . . . 71 . . . 6142 1 671 . 1 1 71 71 VAL N N 15 121.2 0.2 . 1 . . . . 71 . . . 6142 1 672 . 1 1 71 71 VAL CA C 13 61 0.3 . 1 . . . . 71 . . . 6142 1 673 . 1 1 71 71 VAL HA H 1 4.66 0.01 . 1 . . . . 71 . . . 6142 1 674 . 1 1 71 71 VAL CB C 13 33.8 0.3 . 1 . . . . 71 . . . 6142 1 675 . 1 1 71 71 VAL HB H 1 2.16 0.01 . 1 . . . . 71 . . . 6142 1 676 . 1 1 71 71 VAL CG1 C 13 26 0.3 . 1 . . . . 71 . . . 6142 1 677 . 1 1 71 71 VAL HG11 H 1 1.34 0.01 . 1 . . . . 71 . . . 6142 1 678 . 1 1 71 71 VAL HG12 H 1 1.34 0.01 . 1 . . . . 71 . . . 6142 1 679 . 1 1 71 71 VAL HG13 H 1 1.34 0.01 . 1 . . . . 71 . . . 6142 1 680 . 1 1 71 71 VAL CG2 C 13 23.2 0.3 . 1 . . . . 71 . . . 6142 1 681 . 1 1 71 71 VAL HG21 H 1 0.97 0.01 . 1 . . . . 71 . . . 6142 1 682 . 1 1 71 71 VAL HG22 H 1 0.97 0.01 . 1 . . . . 71 . . . 6142 1 683 . 1 1 71 71 VAL HG23 H 1 0.97 0.01 . 1 . . . . 71 . . . 6142 1 684 . 1 1 72 72 LEU H H 1 8.98 0.01 . 1 . . . . 72 . . . 6142 1 685 . 1 1 72 72 LEU N N 15 121.7 0.2 . 1 . . . . 72 . . . 6142 1 686 . 1 1 72 72 LEU CA C 13 53 0.3 . 1 . . . . 72 . . . 6142 1 687 . 1 1 72 72 LEU HA H 1 4.91 0.01 . 1 . . . . 72 . . . 6142 1 688 . 1 1 72 72 LEU CB C 13 43.7 0.3 . 1 . . . . 72 . . . 6142 1 689 . 1 1 72 72 LEU HB2 H 1 1.92 0.01 . 1 . . . . 72 . . . 6142 1 690 . 1 1 72 72 LEU HB3 H 1 1.03 0.01 . 1 . . . . 72 . . . 6142 1 691 . 1 1 72 72 LEU CG C 13 26.7 0.3 . 1 . . . . 72 . . . 6142 1 692 . 1 1 72 72 LEU CD1 C 13 27.9 0.3 . 1 . . . . 72 . . . 6142 1 693 . 1 1 72 72 LEU HD11 H 1 0.82 0.01 . 1 . . . . 72 . . . 6142 1 694 . 1 1 72 72 LEU HD12 H 1 0.82 0.01 . 1 . . . . 72 . . . 6142 1 695 . 1 1 72 72 LEU HD13 H 1 0.82 0.01 . 1 . . . . 72 . . . 6142 1 696 . 1 1 72 72 LEU CD2 C 13 27.9 0.3 . 1 . . . . 72 . . . 6142 1 697 . 1 1 72 72 LEU HD21 H 1 0.82 0.01 . 1 . . . . 72 . . . 6142 1 698 . 1 1 72 72 LEU HD22 H 1 0.82 0.01 . 1 . . . . 72 . . . 6142 1 699 . 1 1 72 72 LEU HD23 H 1 0.82 0.01 . 1 . . . . 72 . . . 6142 1 700 . 1 1 72 72 LEU HG H 1 1.6 0.01 . 1 . . . . 72 . . . 6142 1 701 . 1 1 73 73 ILE H H 1 9.24 0.01 . 1 . . . . 73 . . . 6142 1 702 . 1 1 73 73 ILE N N 15 122.3 0.2 . 1 . . . . 73 . . . 6142 1 703 . 1 1 73 73 ILE CA C 13 59.9 0.3 . 1 . . . . 73 . . . 6142 1 704 . 1 1 73 73 ILE HA H 1 4.81 0.01 . 1 . . . . 73 . . . 6142 1 705 . 1 1 73 73 ILE CB C 13 37.4 0.3 . 1 . . . . 73 . . . 6142 1 706 . 1 1 73 73 ILE HB H 1 1.83 0.01 . 1 . . . . 73 . . . 6142 1 707 . 1 1 73 73 ILE CG2 C 13 15.9 0.3 . 1 . . . . 73 . . . 6142 1 708 . 1 1 73 73 ILE HG21 H 1 0.72 0.01 . 1 . . . . 73 . . . 6142 1 709 . 1 1 73 73 ILE HG22 H 1 0.72 0.01 . 1 . . . . 73 . . . 6142 1 710 . 1 1 73 73 ILE HG23 H 1 0.72 0.01 . 1 . . . . 73 . . . 6142 1 711 . 1 1 73 73 ILE CG1 C 13 29.2 0.3 . 1 . . . . 73 . . . 6142 1 712 . 1 1 73 73 ILE HG12 H 1 0.77 0.01 . 1 . . . . 73 . . . 6142 1 713 . 1 1 73 73 ILE HG13 H 1 1.57 0.01 . 1 . . . . 73 . . . 6142 1 714 . 1 1 73 73 ILE CD1 C 13 15.6 0.3 . 1 . . . . 73 . . . 6142 1 715 . 1 1 73 73 ILE HD11 H 1 0.88 0.01 . 1 . . . . 73 . . . 6142 1 716 . 1 1 73 73 ILE HD12 H 1 0.88 0.01 . 1 . . . . 73 . . . 6142 1 717 . 1 1 73 73 ILE HD13 H 1 0.88 0.01 . 1 . . . . 73 . . . 6142 1 718 . 1 1 74 74 ASN H H 1 9.37 0.01 . 1 . . . . 74 . . . 6142 1 719 . 1 1 74 74 ASN N N 15 119.3 0.2 . 1 . . . . 74 . . . 6142 1 720 . 1 1 74 74 ASN CA C 13 53.9 0.3 . 1 . . . . 74 . . . 6142 1 721 . 1 1 74 74 ASN HA H 1 4.37 0.01 . 1 . . . . 74 . . . 6142 1 722 . 1 1 74 74 ASN CB C 13 35.9 0.3 . 1 . . . . 74 . . . 6142 1 723 . 1 1 74 74 ASN HB2 H 1 3.11 0.01 . 1 . . . . 74 . . . 6142 1 724 . 1 1 74 74 ASN HB3 H 1 3.11 0.01 . 1 . . . . 74 . . . 6142 1 725 . 1 1 75 75 PRO CA C 13 62 0.3 . 1 . . . . 75 . . . 6142 1 726 . 1 1 75 75 PRO HA H 1 5.16 0.01 . 1 . . . . 75 . . . 6142 1 727 . 1 1 75 75 PRO CB C 13 31.1 0.3 . 1 . . . . 75 . . . 6142 1 728 . 1 1 75 75 PRO HB2 H 1 2.23 0.01 . 1 . . . . 75 . . . 6142 1 729 . 1 1 75 75 PRO HB3 H 1 2.0 0.01 . 1 . . . . 75 . . . 6142 1 730 . 1 1 76 76 GLU H H 1 9.44 0.01 . 1 . . . . 76 . . . 6142 1 731 . 1 1 76 76 GLU N N 15 118.8 0.2 . 1 . . . . 76 . . . 6142 1 732 . 1 1 76 76 GLU CA C 13 54.6 0.3 . 1 . . . . 76 . . . 6142 1 733 . 1 1 76 76 GLU HA H 1 4.58 0.01 . 1 . . . . 76 . . . 6142 1 734 . 1 1 76 76 GLU CB C 13 32.9 0.3 . 1 . . . . 76 . . . 6142 1 735 . 1 1 76 76 GLU HB2 H 1 1.96 0.01 . 1 . . . . 76 . . . 6142 1 736 . 1 1 76 76 GLU HB3 H 1 1.84 0.01 . 1 . . . . 76 . . . 6142 1 737 . 1 1 76 76 GLU CG C 13 36.2 0.3 . 1 . . . . 76 . . . 6142 1 738 . 1 1 76 76 GLU HG2 H 1 2.1 0.01 . 1 . . . . 76 . . . 6142 1 739 . 1 1 76 76 GLU HG3 H 1 2.24 0.01 . 1 . . . . 76 . . . 6142 1 740 . 1 1 77 77 LEU H H 1 8.9 0.01 . 1 . . . . 77 . . . 6142 1 741 . 1 1 77 77 LEU N N 15 123.2 0.2 . 1 . . . . 77 . . . 6142 1 742 . 1 1 77 77 LEU CA C 13 55.2 0.3 . 1 . . . . 77 . . . 6142 1 743 . 1 1 77 77 LEU HA H 1 4.71 0.01 . 1 . . . . 77 . . . 6142 1 744 . 1 1 77 77 LEU CB C 13 42.3 0.3 . 1 . . . . 77 . . . 6142 1 745 . 1 1 77 77 LEU HB2 H 1 1.93 0.01 . 1 . . . . 77 . . . 6142 1 746 . 1 1 77 77 LEU HB3 H 1 1.29 0.01 . 1 . . . . 77 . . . 6142 1 747 . 1 1 77 77 LEU HD11 H 1 1.0 0.01 . 1 . . . . 77 . . . 6142 1 748 . 1 1 77 77 LEU HD12 H 1 1.0 0.01 . 1 . . . . 77 . . . 6142 1 749 . 1 1 77 77 LEU HD13 H 1 1.0 0.01 . 1 . . . . 77 . . . 6142 1 750 . 1 1 77 77 LEU HD21 H 1 1.0 0.01 . 1 . . . . 77 . . . 6142 1 751 . 1 1 77 77 LEU HD22 H 1 1.0 0.01 . 1 . . . . 77 . . . 6142 1 752 . 1 1 77 77 LEU HD23 H 1 1.0 0.01 . 1 . . . . 77 . . . 6142 1 753 . 1 1 77 77 LEU HG H 1 1.42 0.01 . 1 . . . . 77 . . . 6142 1 754 . 1 1 78 78 LEU H H 1 9.21 0.01 . 1 . . . . 78 . . . 6142 1 755 . 1 1 78 78 LEU N N 15 125.4 0.2 . 1 . . . . 78 . . . 6142 1 756 . 1 1 78 78 LEU CA C 13 55.7 0.3 . 1 . . . . 78 . . . 6142 1 757 . 1 1 78 78 LEU HA H 1 4.49 0.01 . 1 . . . . 78 . . . 6142 1 758 . 1 1 78 78 LEU CB C 13 42 0.3 . 1 . . . . 78 . . . 6142 1 759 . 1 1 78 78 LEU HB2 H 1 1.49 0.01 . 1 . . . . 78 . . . 6142 1 760 . 1 1 78 78 LEU HB3 H 1 1.64 0.01 . 1 . . . . 78 . . . 6142 1 761 . 1 1 78 78 LEU CD1 C 13 27.3 0.3 . 1 . . . . 78 . . . 6142 1 762 . 1 1 78 78 LEU HD11 H 1 0.77 0.01 . 1 . . . . 78 . . . 6142 1 763 . 1 1 78 78 LEU HD12 H 1 0.77 0.01 . 1 . . . . 78 . . . 6142 1 764 . 1 1 78 78 LEU HD13 H 1 0.77 0.01 . 1 . . . . 78 . . . 6142 1 765 . 1 1 78 78 LEU CD2 C 13 27.3 0.3 . 1 . . . . 78 . . . 6142 1 766 . 1 1 78 78 LEU HD21 H 1 0.81 0.01 . 1 . . . . 78 . . . 6142 1 767 . 1 1 78 78 LEU HD22 H 1 0.81 0.01 . 1 . . . . 78 . . . 6142 1 768 . 1 1 78 78 LEU HD23 H 1 0.81 0.01 . 1 . . . . 78 . . . 6142 1 769 . 1 1 79 79 GLU H H 1 7.67 0.01 . 1 . . . . 79 . . . 6142 1 770 . 1 1 79 79 GLU N N 15 112.6 0.2 . 1 . . . . 79 . . . 6142 1 771 . 1 1 79 79 GLU CA C 13 55.1 0.3 . 1 . . . . 79 . . . 6142 1 772 . 1 1 79 79 GLU HA H 1 4.67 0.01 . 1 . . . . 79 . . . 6142 1 773 . 1 1 79 79 GLU CB C 13 33.6 0.3 . 1 . . . . 79 . . . 6142 1 774 . 1 1 79 79 GLU HB2 H 1 1.95 0.01 . 1 . . . . 79 . . . 6142 1 775 . 1 1 79 79 GLU HB3 H 1 2.07 0.01 . 1 . . . . 79 . . . 6142 1 776 . 1 1 79 79 GLU CG C 13 35.1 0.3 . 1 . . . . 79 . . . 6142 1 777 . 1 1 79 79 GLU HG2 H 1 2.17 0.01 . 1 . . . . 79 . . . 6142 1 778 . 1 1 79 79 GLU HG3 H 1 2.17 0.01 . 1 . . . . 79 . . . 6142 1 779 . 1 1 80 80 LYS H H 1 8.44 0.01 . 1 . . . . 80 . . . 6142 1 780 . 1 1 80 80 LYS N N 15 116.3 0.2 . 1 . . . . 80 . . . 6142 1 781 . 1 1 80 80 LYS CA C 13 55.6 0.3 . 1 . . . . 80 . . . 6142 1 782 . 1 1 80 80 LYS HA H 1 5.37 0.01 . 1 . . . . 80 . . . 6142 1 783 . 1 1 80 80 LYS CB C 13 33.6 0.3 . 1 . . . . 80 . . . 6142 1 784 . 1 1 80 80 LYS HB2 H 1 1.82 0.01 . 1 . . . . 80 . . . 6142 1 785 . 1 1 80 80 LYS HB3 H 1 1.82 0.01 . 1 . . . . 80 . . . 6142 1 786 . 1 1 80 80 LYS CG C 13 25.5 0.3 . 1 . . . . 80 . . . 6142 1 787 . 1 1 80 80 LYS HG2 H 1 1.41 0.01 . 1 . . . . 80 . . . 6142 1 788 . 1 1 80 80 LYS HG3 H 1 1.41 0.01 . 1 . . . . 80 . . . 6142 1 789 . 1 1 80 80 LYS CD C 13 24.7 0.3 . 1 . . . . 80 . . . 6142 1 790 . 1 1 80 80 LYS HD2 H 1 1.33 0.01 . 1 . . . . 80 . . . 6142 1 791 . 1 1 80 80 LYS HD3 H 1 1.33 0.01 . 1 . . . . 80 . . . 6142 1 792 . 1 1 80 80 LYS CE C 13 42 0.3 . 1 . . . . 80 . . . 6142 1 793 . 1 1 80 80 LYS HE2 H 1 2.99 0.01 . 1 . . . . 80 . . . 6142 1 794 . 1 1 80 80 LYS HE3 H 1 2.99 0.01 . 1 . . . . 80 . . . 6142 1 795 . 1 1 81 81 SER H H 1 8.85 0.01 . 1 . . . . 81 . . . 6142 1 796 . 1 1 81 81 SER N N 15 111.1 0.2 . 1 . . . . 81 . . . 6142 1 797 . 1 1 81 81 SER CA C 13 57.8 0.3 . 1 . . . . 81 . . . 6142 1 798 . 1 1 81 81 SER HA H 1 4.84 0.01 . 1 . . . . 81 . . . 6142 1 799 . 1 1 81 81 SER CB C 13 65.4 0.3 . 1 . . . . 81 . . . 6142 1 800 . 1 1 81 81 SER HB2 H 1 3.87 0.01 . 1 . . . . 81 . . . 6142 1 801 . 1 1 81 81 SER HB3 H 1 3.84 0.01 . 1 . . . . 81 . . . 6142 1 802 . 1 1 82 82 GLY H H 1 8.58 0.01 . 1 . . . . 82 . . . 6142 1 803 . 1 1 82 82 GLY N N 15 106.1 0.2 . 1 . . . . 82 . . . 6142 1 804 . 1 1 82 82 GLY CA C 13 44.7 0.3 . 1 . . . . 82 . . . 6142 1 805 . 1 1 82 82 GLY HA2 H 1 4.68 0.01 . 2 . . . . 82 . . . 6142 1 806 . 1 1 82 82 GLY HA3 H 1 4.04 0.01 . 2 . . . . 82 . . . 6142 1 807 . 1 1 83 83 GLU H H 1 8.55 0.01 . 1 . . . . 83 . . . 6142 1 808 . 1 1 83 83 GLU N N 15 115.7 0.2 . 1 . . . . 83 . . . 6142 1 809 . 1 1 83 83 GLU CA C 13 55.8 0.3 . 1 . . . . 83 . . . 6142 1 810 . 1 1 83 83 GLU HA H 1 5.12 0.01 . 1 . . . . 83 . . . 6142 1 811 . 1 1 83 83 GLU CB C 13 36.5 0.3 . 1 . . . . 83 . . . 6142 1 812 . 1 1 83 83 GLU HB2 H 1 2.02 0.01 . 1 . . . . 83 . . . 6142 1 813 . 1 1 83 83 GLU HB3 H 1 1.96 0.01 . 1 . . . . 83 . . . 6142 1 814 . 1 1 83 83 GLU CG C 13 36.5 0.3 . 1 . . . . 83 . . . 6142 1 815 . 1 1 83 83 GLU HG2 H 1 2.21 0.01 . 1 . . . . 83 . . . 6142 1 816 . 1 1 83 83 GLU HG3 H 1 2.21 0.01 . 1 . . . . 83 . . . 6142 1 817 . 1 1 84 84 THR H H 1 8.9 0.01 . 1 . . . . 84 . . . 6142 1 818 . 1 1 84 84 THR N N 15 116.8 0.2 . 1 . . . . 84 . . . 6142 1 819 . 1 1 84 84 THR CA C 13 58.9 0.3 . 1 . . . . 84 . . . 6142 1 820 . 1 1 84 84 THR HA H 1 4.69 0.01 . 1 . . . . 84 . . . 6142 1 821 . 1 1 84 84 THR CB C 13 68.9 0.3 . 1 . . . . 84 . . . 6142 1 822 . 1 1 84 84 THR HB H 1 3.87 0.01 . 1 . . . . 84 . . . 6142 1 823 . 1 1 85 85 GLY H H 1 7.79 0.01 . 1 . . . . 85 . . . 6142 1 824 . 1 1 85 85 GLY N N 15 107.1 0.2 . 1 . . . . 85 . . . 6142 1 825 . 1 1 85 85 GLY CA C 13 46.2 0.3 . 1 . . . . 85 . . . 6142 1 826 . 1 1 85 85 GLY HA2 H 1 4.3 0.01 . 1 . . . . 85 . . . 6142 1 827 . 1 1 85 85 GLY HA3 H 1 4.07 0.01 . 1 . . . . 85 . . . 6142 1 828 . 1 1 86 86 ILE H H 1 10.24 0.01 . 1 . . . . 86 . . . 6142 1 829 . 1 1 86 86 ILE N N 15 120.8 0.2 . 1 . . . . 86 . . . 6142 1 830 . 1 1 86 86 ILE CA C 13 59.4 0.3 . 1 . . . . 86 . . . 6142 1 831 . 1 1 86 86 ILE HA H 1 4.6 0.01 . 1 . . . . 86 . . . 6142 1 832 . 1 1 86 86 ILE CB C 13 41.6 0.3 . 1 . . . . 86 . . . 6142 1 833 . 1 1 86 86 ILE HB H 1 1.8 0.01 . 1 . . . . 86 . . . 6142 1 834 . 1 1 86 86 ILE CG2 C 13 20.7 0.3 . 1 . . . . 86 . . . 6142 1 835 . 1 1 86 86 ILE HG21 H 1 0.81 0.01 . 1 . . . . 86 . . . 6142 1 836 . 1 1 86 86 ILE HG22 H 1 0.81 0.01 . 1 . . . . 86 . . . 6142 1 837 . 1 1 86 86 ILE HG23 H 1 0.81 0.01 . 1 . . . . 86 . . . 6142 1 838 . 1 1 86 86 ILE CG1 C 13 28.1 0.3 . 1 . . . . 86 . . . 6142 1 839 . 1 1 86 86 ILE HG12 H 1 1.04 0.01 . 1 . . . . 86 . . . 6142 1 840 . 1 1 86 86 ILE HG13 H 1 0.99 0.01 . 1 . . . . 86 . . . 6142 1 841 . 1 1 86 86 ILE CD1 C 13 15.8 0.3 . 1 . . . . 86 . . . 6142 1 842 . 1 1 86 86 ILE HD11 H 1 0.74 0.01 . 1 . . . . 86 . . . 6142 1 843 . 1 1 86 86 ILE HD12 H 1 0.74 0.01 . 1 . . . . 86 . . . 6142 1 844 . 1 1 86 86 ILE HD13 H 1 0.74 0.01 . 1 . . . . 86 . . . 6142 1 845 . 1 1 87 87 GLU H H 1 8.03 0.01 . 1 . . . . 87 . . . 6142 1 846 . 1 1 87 87 GLU N N 15 116.1 0.2 . 1 . . . . 87 . . . 6142 1 847 . 1 1 87 87 GLU CA C 13 56.6 0.3 . 1 . . . . 87 . . . 6142 1 848 . 1 1 87 87 GLU HA H 1 4.02 0.01 . 1 . . . . 87 . . . 6142 1 849 . 1 1 87 87 GLU CB C 13 29 0.3 . 1 . . . . 87 . . . 6142 1 850 . 1 1 87 87 GLU HB2 H 1 1.86 0.01 . 1 . . . . 87 . . . 6142 1 851 . 1 1 87 87 GLU HB3 H 1 1.86 0.01 . 1 . . . . 87 . . . 6142 1 852 . 1 1 87 87 GLU CG C 13 38.1 0.3 . 1 . . . . 87 . . . 6142 1 853 . 1 1 87 87 GLU HG2 H 1 2.04 0.01 . 1 . . . . 87 . . . 6142 1 854 . 1 1 87 87 GLU HG3 H 1 2.04 0.01 . 1 . . . . 87 . . . 6142 1 855 . 1 1 88 88 GLU H H 1 8.44 0.01 . 1 . . . . 88 . . . 6142 1 856 . 1 1 88 88 GLU N N 15 127.2 0.2 . 1 . . . . 88 . . . 6142 1 857 . 1 1 88 88 GLU CA C 13 56.3 0.3 . 1 . . . . 88 . . . 6142 1 858 . 1 1 88 88 GLU HA H 1 4.36 0.01 . 1 . . . . 88 . . . 6142 1 859 . 1 1 88 88 GLU CB C 13 31.2 0.3 . 1 . . . . 88 . . . 6142 1 860 . 1 1 88 88 GLU HB2 H 1 2.53 0.01 . 1 . . . . 88 . . . 6142 1 861 . 1 1 88 88 GLU HB3 H 1 2.53 0.01 . 1 . . . . 88 . . . 6142 1 862 . 1 1 88 88 GLU CG C 13 42.5 0.3 . 1 . . . . 88 . . . 6142 1 863 . 1 1 88 88 GLU HG2 H 1 1.75 0.01 . 1 . . . . 88 . . . 6142 1 864 . 1 1 88 88 GLU HG3 H 1 1.38 0.01 . 1 . . . . 88 . . . 6142 1 865 . 1 1 89 89 GLY H H 1 7.74 0.01 . 1 . . . . 89 . . . 6142 1 866 . 1 1 89 89 GLY N N 15 100.8 0.2 . 1 . . . . 89 . . . 6142 1 867 . 1 1 89 89 GLY CA C 13 44 0.3 . 1 . . . . 89 . . . 6142 1 868 . 1 1 89 89 GLY HA2 H 1 4.68 0.01 . 2 . . . . 89 . . . 6142 1 869 . 1 1 89 89 GLY HA3 H 1 3.62 0.01 . 2 . . . . 89 . . . 6142 1 870 . 1 1 90 90 CYS H H 1 10.38 0.01 . 1 . . . . 90 . . . 6142 1 871 . 1 1 90 90 CYS N N 15 118.6 0.2 . 1 . . . . 90 . . . 6142 1 872 . 1 1 90 90 CYS CA C 13 56.9 0.3 . 1 . . . . 90 . . . 6142 1 873 . 1 1 90 90 CYS HA H 1 5.86 0.01 . 1 . . . . 90 . . . 6142 1 874 . 1 1 90 90 CYS CB C 13 32.6 0.3 . 1 . . . . 90 . . . 6142 1 875 . 1 1 90 90 CYS HB2 H 1 3.42 0.01 . 1 . . . . 90 . . . 6142 1 876 . 1 1 90 90 CYS HB3 H 1 3.11 0.01 . 1 . . . . 90 . . . 6142 1 877 . 1 1 91 91 LEU H H 1 10.07 0.01 . 1 . . . . 91 . . . 6142 1 878 . 1 1 91 91 LEU N N 15 128.0 0.2 . 1 . . . . 91 . . . 6142 1 879 . 1 1 91 91 LEU CA C 13 56.6 0.3 . 1 . . . . 91 . . . 6142 1 880 . 1 1 91 91 LEU HA H 1 4.36 0.01 . 1 . . . . 91 . . . 6142 1 881 . 1 1 91 91 LEU CB C 13 42.7 0.3 . 1 . . . . 91 . . . 6142 1 882 . 1 1 91 91 LEU HB2 H 1 2.83 0.01 . 1 . . . . 91 . . . 6142 1 883 . 1 1 91 91 LEU HB3 H 1 2.83 0.01 . 1 . . . . 91 . . . 6142 1 884 . 1 1 92 92 SER H H 1 9.38 0.01 . 1 . . . . 92 . . . 6142 1 885 . 1 1 92 92 SER N N 15 110.4 0.2 . 1 . . . . 92 . . . 6142 1 886 . 1 1 92 92 SER CA C 13 60.7 0.3 . 1 . . . . 92 . . . 6142 1 887 . 1 1 92 92 SER HA H 1 5.12 0.01 . 1 . . . . 92 . . . 6142 1 888 . 1 1 92 92 SER CB C 13 65.7 0.3 . 1 . . . . 92 . . . 6142 1 889 . 1 1 92 92 SER HB2 H 1 4.3 0.01 . 1 . . . . 92 . . . 6142 1 890 . 1 1 92 92 SER HB3 H 1 4.56 0.01 . 1 . . . . 92 . . . 6142 1 891 . 1 1 93 93 ILE H H 1 7.74 0.01 . 1 . . . . 93 . . . 6142 1 892 . 1 1 93 93 ILE N N 15 115.9 0.2 . 1 . . . . 93 . . . 6142 1 893 . 1 1 93 93 ILE CA C 13 59 0.3 . 1 . . . . 93 . . . 6142 1 894 . 1 1 93 93 ILE HA H 1 4.72 0.01 . 1 . . . . 93 . . . 6142 1 895 . 1 1 93 93 ILE CB C 13 34.5 0.3 . 1 . . . . 93 . . . 6142 1 896 . 1 1 93 93 ILE HB H 1 2.44 0.01 . 1 . . . . 93 . . . 6142 1 897 . 1 1 93 93 ILE CG2 C 13 23.5 0.3 . 1 . . . . 93 . . . 6142 1 898 . 1 1 93 93 ILE HG21 H 1 0.89 0.01 . 1 . . . . 93 . . . 6142 1 899 . 1 1 93 93 ILE HG22 H 1 0.89 0.01 . 1 . . . . 93 . . . 6142 1 900 . 1 1 93 93 ILE HG23 H 1 0.89 0.01 . 1 . . . . 93 . . . 6142 1 901 . 1 1 93 93 ILE CG1 C 13 31.3 0.3 . 1 . . . . 93 . . . 6142 1 902 . 1 1 93 93 ILE HG12 H 1 2.24 0.01 . 1 . . . . 93 . . . 6142 1 903 . 1 1 93 93 ILE HG13 H 1 1.97 0.01 . 1 . . . . 93 . . . 6142 1 904 . 1 1 94 94 PRO CA C 13 64.4 0.3 . 1 . . . . 94 . . . 6142 1 905 . 1 1 94 94 PRO CB C 13 31.3 . . 1 . . . . 94 . . . 6142 1 906 . 1 1 95 95 GLU H H 1 8.9 0.01 . 1 . . . . 95 . . . 6142 1 907 . 1 1 95 95 GLU N N 15 112.9 0.2 . 1 . . . . 95 . . . 6142 1 908 . 1 1 95 95 GLU CA C 13 59.3 0.3 . 1 . . . . 95 . . . 6142 1 909 . 1 1 95 95 GLU HA H 1 3.97 0.01 . 1 . . . . 95 . . . 6142 1 910 . 1 1 95 95 GLU CB C 13 27.5 0.3 . 1 . . . . 95 . . . 6142 1 911 . 1 1 95 95 GLU HB2 H 1 2.3 0.01 . 1 . . . . 95 . . . 6142 1 912 . 1 1 95 95 GLU HB3 H 1 2.3 0.01 . 1 . . . . 95 . . . 6142 1 913 . 1 1 96 96 GLN H H 1 7.71 0.01 . 1 . . . . 96 . . . 6142 1 914 . 1 1 96 96 GLN N N 15 115.8 0.2 . 1 . . . . 96 . . . 6142 1 915 . 1 1 96 96 GLN CA C 13 55.6 0.3 . 1 . . . . 96 . . . 6142 1 916 . 1 1 96 96 GLN HA H 1 4.75 0.01 . 1 . . . . 96 . . . 6142 1 917 . 1 1 96 96 GLN CB C 13 30.9 0.3 . 1 . . . . 96 . . . 6142 1 918 . 1 1 96 96 GLN HB2 H 1 2.43 0.01 . 1 . . . . 96 . . . 6142 1 919 . 1 1 96 96 GLN HB3 H 1 2.25 0.01 . 1 . . . . 96 . . . 6142 1 920 . 1 1 96 96 GLN CG C 13 29.2 0.3 . 1 . . . . 96 . . . 6142 1 921 . 1 1 96 96 GLN HG2 H 1 2.01 0.01 . 1 . . . . 96 . . . 6142 1 922 . 1 1 96 96 GLN HG3 H 1 2.01 0.01 . 1 . . . . 96 . . . 6142 1 923 . 1 1 97 97 ARG H H 1 8.45 0.01 . 1 . . . . 97 . . . 6142 1 924 . 1 1 97 97 ARG N N 15 120.0 0.2 . 1 . . . . 97 . . . 6142 1 925 . 1 1 97 97 ARG CA C 13 54.5 0.3 . 1 . . . . 97 . . . 6142 1 926 . 1 1 97 97 ARG HA H 1 5.52 0.01 . 1 . . . . 97 . . . 6142 1 927 . 1 1 97 97 ARG CB C 13 34.1 0.3 . 1 . . . . 97 . . . 6142 1 928 . 1 1 97 97 ARG HB2 H 1 1.60 0.01 . 1 . . . . 97 . . . 6142 1 929 . 1 1 97 97 ARG HB3 H 1 1.60 0.01 . 1 . . . . 97 . . . 6142 1 930 . 1 1 97 97 ARG CG C 13 29 0.3 . 1 . . . . 97 . . . 6142 1 931 . 1 1 97 97 ARG HG2 H 1 1.58 0.01 . 1 . . . . 97 . . . 6142 1 932 . 1 1 97 97 ARG HG3 H 1 1.58 0.01 . 1 . . . . 97 . . . 6142 1 933 . 1 1 97 97 ARG CD C 13 43.5 0.3 . 1 . . . . 97 . . . 6142 1 934 . 1 1 97 97 ARG HD2 H 1 3.14 0.01 . 1 . . . . 97 . . . 6142 1 935 . 1 1 97 97 ARG HD3 H 1 3.22 0.01 . 1 . . . . 97 . . . 6142 1 936 . 1 1 98 98 ALA H H 1 8.41 0.01 . 1 . . . . 98 . . . 6142 1 937 . 1 1 98 98 ALA N N 15 120.0 0.2 . 1 . . . . 98 . . . 6142 1 938 . 1 1 98 98 ALA CA C 13 52.5 0.3 . 1 . . . . 98 . . . 6142 1 939 . 1 1 98 98 ALA HA H 1 4.63 0.01 . 1 . . . . 98 . . . 6142 1 940 . 1 1 98 98 ALA CB C 13 22.7 0.3 . 1 . . . . 98 . . . 6142 1 941 . 1 1 98 98 ALA HB1 H 1 1.47 0.01 . 1 . . . . 98 . . . 6142 1 942 . 1 1 98 98 ALA HB2 H 1 1.47 0.01 . 1 . . . . 98 . . . 6142 1 943 . 1 1 98 98 ALA HB3 H 1 1.47 0.01 . 1 . . . . 98 . . . 6142 1 944 . 1 1 99 99 LEU H H 1 8.31 0.01 . 1 . . . . 99 . . . 6142 1 945 . 1 1 99 99 LEU N N 15 121.2 0.2 . 1 . . . . 99 . . . 6142 1 946 . 1 1 99 99 LEU CA C 13 54.8 0.3 . 1 . . . . 99 . . . 6142 1 947 . 1 1 99 99 LEU HA H 1 4.67 0.01 . 1 . . . . 99 . . . 6142 1 948 . 1 1 99 99 LEU CB C 13 42 0.3 . 1 . . . . 99 . . . 6142 1 949 . 1 1 99 99 LEU HB2 H 1 1.65 0.01 . 1 . . . . 99 . . . 6142 1 950 . 1 1 99 99 LEU HB3 H 1 1.65 0.01 . 1 . . . . 99 . . . 6142 1 951 . 1 1 99 99 LEU CG C 13 29.3 0.3 . 1 . . . . 99 . . . 6142 1 952 . 1 1 99 99 LEU CD1 C 13 27.7 0.3 . 1 . . . . 99 . . . 6142 1 953 . 1 1 99 99 LEU HD11 H 1 1.01 0.01 . 1 . . . . 99 . . . 6142 1 954 . 1 1 99 99 LEU HD12 H 1 1.01 0.01 . 1 . . . . 99 . . . 6142 1 955 . 1 1 99 99 LEU HD13 H 1 1.01 0.01 . 1 . . . . 99 . . . 6142 1 956 . 1 1 99 99 LEU CD2 C 13 27.7 0.3 . 1 . . . . 99 . . . 6142 1 957 . 1 1 99 99 LEU HD21 H 1 0.93 0.01 . 1 . . . . 99 . . . 6142 1 958 . 1 1 99 99 LEU HD22 H 1 0.93 0.01 . 1 . . . . 99 . . . 6142 1 959 . 1 1 99 99 LEU HD23 H 1 0.93 0.01 . 1 . . . . 99 . . . 6142 1 960 . 1 1 99 99 LEU HG H 1 1.40 0.01 . 1 . . . . 99 . . . 6142 1 961 . 1 1 100 100 VAL H H 1 7.25 0.01 . 1 . . . . 100 . . . 6142 1 962 . 1 1 100 100 VAL N N 15 122.3 0.2 . 1 . . . . 100 . . . 6142 1 963 . 1 1 100 100 VAL CA C 13 58.1 0.3 . 1 . . . . 100 . . . 6142 1 964 . 1 1 100 100 VAL HA H 1 4.6 0.01 . 1 . . . . 100 . . . 6142 1 965 . 1 1 100 100 VAL CB C 13 34.2 0.3 . 1 . . . . 100 . . . 6142 1 966 . 1 1 100 100 VAL HB H 1 1.99 0.01 . 1 . . . . 100 . . . 6142 1 967 . 1 1 100 100 VAL CG1 C 13 23.6 0.3 . 1 . . . . 100 . . . 6142 1 968 . 1 1 100 100 VAL HG11 H 1 0.92 0.01 . 1 . . . . 100 . . . 6142 1 969 . 1 1 100 100 VAL HG12 H 1 0.92 0.01 . 1 . . . . 100 . . . 6142 1 970 . 1 1 100 100 VAL HG13 H 1 0.92 0.01 . 1 . . . . 100 . . . 6142 1 971 . 1 1 100 100 VAL CG2 C 13 22.5 0.3 . 1 . . . . 100 . . . 6142 1 972 . 1 1 100 100 VAL HG21 H 1 0.62 0.01 . 1 . . . . 100 . . . 6142 1 973 . 1 1 100 100 VAL HG22 H 1 0.62 0.01 . 1 . . . . 100 . . . 6142 1 974 . 1 1 100 100 VAL HG23 H 1 0.62 0.01 . 1 . . . . 100 . . . 6142 1 975 . 1 1 101 101 PRO CA C 13 62.7 0.3 . 1 . . . . 101 . . . 6142 1 976 . 1 1 101 101 PRO HA H 1 4.72 0.01 . 1 . . . . 101 . . . 6142 1 977 . 1 1 101 101 PRO CB C 13 30.7 0.3 . 1 . . . . 101 . . . 6142 1 978 . 1 1 102 102 ARG H H 1 8.4 0.01 . 1 . . . . 102 . . . 6142 1 979 . 1 1 102 102 ARG N N 15 120.3 0.2 . 1 . . . . 102 . . . 6142 1 980 . 1 1 102 102 ARG CA C 13 52.9 0.3 . 1 . . . . 102 . . . 6142 1 981 . 1 1 102 102 ARG HA H 1 4.52 0.01 . 1 . . . . 102 . . . 6142 1 982 . 1 1 102 102 ARG CB C 13 34.7 0.3 . 1 . . . . 102 . . . 6142 1 983 . 1 1 102 102 ARG HB2 H 1 1.65 0.01 . 1 . . . . 102 . . . 6142 1 984 . 1 1 102 102 ARG HB3 H 1 1.41 0.01 . 1 . . . . 102 . . . 6142 1 985 . 1 1 102 102 ARG CG C 13 28.3 0.3 . 1 . . . . 102 . . . 6142 1 986 . 1 1 102 102 ARG HG2 H 1 1.57 0.01 . 1 . . . . 102 . . . 6142 1 987 . 1 1 102 102 ARG HG3 H 1 1.82 0.01 . 1 . . . . 102 . . . 6142 1 988 . 1 1 102 102 ARG CD C 13 43.6 0.3 . 1 . . . . 102 . . . 6142 1 989 . 1 1 102 102 ARG HD2 H 1 2.7 0.01 . 1 . . . . 102 . . . 6142 1 990 . 1 1 102 102 ARG HD3 H 1 3.18 0.01 . 1 . . . . 102 . . . 6142 1 991 . 1 1 103 103 ALA H H 1 8.71 0.01 . 1 . . . . 103 . . . 6142 1 992 . 1 1 103 103 ALA N N 15 119.9 0.2 . 1 . . . . 103 . . . 6142 1 993 . 1 1 103 103 ALA CA C 13 51.2 0.3 . 1 . . . . 103 . . . 6142 1 994 . 1 1 103 103 ALA HA H 1 4.7 0.01 . 1 . . . . 103 . . . 6142 1 995 . 1 1 103 103 ALA CB C 13 17.9 0.3 . 1 . . . . 103 . . . 6142 1 996 . 1 1 103 103 ALA HB1 H 1 1.27 0.01 . 1 . . . . 103 . . . 6142 1 997 . 1 1 103 103 ALA HB2 H 1 1.27 0.01 . 1 . . . . 103 . . . 6142 1 998 . 1 1 103 103 ALA HB3 H 1 1.27 0.01 . 1 . . . . 103 . . . 6142 1 999 . 1 1 104 104 GLU H H 1 7.1 0.01 . 1 . . . . 104 . . . 6142 1 1000 . 1 1 104 104 GLU N N 15 118.3 0.2 . 1 . . . . 104 . . . 6142 1 1001 . 1 1 104 104 GLU CA C 13 57 0.3 . 1 . . . . 104 . . . 6142 1 1002 . 1 1 104 104 GLU HA H 1 4.07 0.01 . 1 . . . . 104 . . . 6142 1 1003 . 1 1 104 104 GLU CB C 13 30.8 0.3 . 1 . . . . 104 . . . 6142 1 1004 . 1 1 104 104 GLU HB2 H 1 1.76 0.01 . 1 . . . . 104 . . . 6142 1 1005 . 1 1 104 104 GLU HB3 H 1 2.19 0.01 . 1 . . . . 104 . . . 6142 1 1006 . 1 1 104 104 GLU CG C 13 36.6 0.3 . 1 . . . . 104 . . . 6142 1 1007 . 1 1 104 104 GLU HG2 H 1 2.33 0.01 . 1 . . . . 104 . . . 6142 1 1008 . 1 1 104 104 GLU HG3 H 1 2.33 0.01 . 1 . . . . 104 . . . 6142 1 1009 . 1 1 105 105 LYS H H 1 8.19 0.01 . 1 . . . . 105 . . . 6142 1 1010 . 1 1 105 105 LYS N N 15 112.6 0.2 . 1 . . . . 105 . . . 6142 1 1011 . 1 1 105 105 LYS CA C 13 53.9 0.3 . 1 . . . . 105 . . . 6142 1 1012 . 1 1 105 105 LYS HA H 1 5.26 0.01 . 1 . . . . 105 . . . 6142 1 1013 . 1 1 105 105 LYS CB C 13 35 0.3 . 1 . . . . 105 . . . 6142 1 1014 . 1 1 105 105 LYS HB2 H 1 1.62 0.01 . 1 . . . . 105 . . . 6142 1 1015 . 1 1 105 105 LYS HB3 H 1 1.76 0.01 . 1 . . . . 105 . . . 6142 1 1016 . 1 1 105 105 LYS HG2 H 1 1.58 0.01 . 1 . . . . 105 . . . 6142 1 1017 . 1 1 105 105 LYS HG3 H 1 1.58 0.01 . 1 . . . . 105 . . . 6142 1 1018 . 1 1 105 105 LYS CD C 13 27.1 0.3 . 1 . . . . 105 . . . 6142 1 1019 . 1 1 105 105 LYS HD2 H 1 1.35 0.01 . 1 . . . . 105 . . . 6142 1 1020 . 1 1 105 105 LYS HD3 H 1 1.35 0.01 . 1 . . . . 105 . . . 6142 1 1021 . 1 1 105 105 LYS CE C 13 41.3 0.3 . 1 . . . . 105 . . . 6142 1 1022 . 1 1 105 105 LYS HE2 H 1 2.91 0.01 . 1 . . . . 105 . . . 6142 1 1023 . 1 1 105 105 LYS HE3 H 1 2.91 0.01 . 1 . . . . 105 . . . 6142 1 1024 . 1 1 106 106 VAL H H 1 8.52 0.01 . 1 . . . . 106 . . . 6142 1 1025 . 1 1 106 106 VAL N N 15 109.2 0.2 . 1 . . . . 106 . . . 6142 1 1026 . 1 1 106 106 VAL CA C 13 58.2 0.3 . 1 . . . . 106 . . . 6142 1 1027 . 1 1 106 106 VAL HA H 1 5.22 0.01 . 1 . . . . 106 . . . 6142 1 1028 . 1 1 106 106 VAL CB C 13 35 0.3 . 1 . . . . 106 . . . 6142 1 1029 . 1 1 106 106 VAL HB H 1 2.04 0.01 . 1 . . . . 106 . . . 6142 1 1030 . 1 1 106 106 VAL CG1 C 13 21.3 0.3 . 1 . . . . 106 . . . 6142 1 1031 . 1 1 106 106 VAL HG11 H 1 0.79 0.01 . 1 . . . . 106 . . . 6142 1 1032 . 1 1 106 106 VAL HG12 H 1 0.79 0.01 . 1 . . . . 106 . . . 6142 1 1033 . 1 1 106 106 VAL HG13 H 1 0.79 0.01 . 1 . . . . 106 . . . 6142 1 1034 . 1 1 106 106 VAL CG2 C 13 24.6 0.3 . 1 . . . . 106 . . . 6142 1 1035 . 1 1 106 106 VAL HG21 H 1 0.83 0.01 . 1 . . . . 106 . . . 6142 1 1036 . 1 1 106 106 VAL HG22 H 1 0.83 0.01 . 1 . . . . 106 . . . 6142 1 1037 . 1 1 106 106 VAL HG23 H 1 0.83 0.01 . 1 . . . . 106 . . . 6142 1 1038 . 1 1 107 107 LYS H H 1 8.61 0.01 . 1 . . . . 107 . . . 6142 1 1039 . 1 1 107 107 LYS N N 15 120.7 0.2 . 1 . . . . 107 . . . 6142 1 1040 . 1 1 107 107 LYS CA C 13 54.8 0.3 . 1 . . . . 107 . . . 6142 1 1041 . 1 1 107 107 LYS HA H 1 5.57 0.01 . 1 . . . . 107 . . . 6142 1 1042 . 1 1 107 107 LYS CB C 13 35.2 0.3 . 1 . . . . 107 . . . 6142 1 1043 . 1 1 107 107 LYS HB2 H 1 1.84 0.01 . 1 . . . . 107 . . . 6142 1 1044 . 1 1 107 107 LYS HB3 H 1 1.84 0.01 . 1 . . . . 107 . . . 6142 1 1045 . 1 1 107 107 LYS CG C 13 27.8 0.3 . 1 . . . . 107 . . . 6142 1 1046 . 1 1 107 107 LYS HG2 H 1 1.32 0.01 . 1 . . . . 107 . . . 6142 1 1047 . 1 1 107 107 LYS HG3 H 1 1.32 0.01 . 1 . . . . 107 . . . 6142 1 1048 . 1 1 107 107 LYS HD2 H 1 1.43 0.01 . 1 . . . . 107 . . . 6142 1 1049 . 1 1 107 107 LYS HD3 H 1 1.43 0.01 . 1 . . . . 107 . . . 6142 1 1050 . 1 1 107 107 LYS CE C 13 41.8 0.3 . 1 . . . . 107 . . . 6142 1 1051 . 1 1 107 107 LYS HE2 H 1 2.90 0.01 . 1 . . . . 107 . . . 6142 1 1052 . 1 1 107 107 LYS HE3 H 1 2.97 0.01 . 1 . . . . 107 . . . 6142 1 1053 . 1 1 108 108 ILE H H 1 9.17 0.01 . 1 . . . . 108 . . . 6142 1 1054 . 1 1 108 108 ILE N N 15 119.4 0.2 . 1 . . . . 108 . . . 6142 1 1055 . 1 1 108 108 ILE CA C 13 57.1 0.3 . 1 . . . . 108 . . . 6142 1 1056 . 1 1 108 108 ILE HA H 1 5.43 0.01 . 1 . . . . 108 . . . 6142 1 1057 . 1 1 108 108 ILE CB C 13 41.7 0.3 . 1 . . . . 108 . . . 6142 1 1058 . 1 1 108 108 ILE HB H 1 1.86 0.01 . 1 . . . . 108 . . . 6142 1 1059 . 1 1 108 108 ILE CG2 C 13 20.7 0.3 . 1 . . . . 108 . . . 6142 1 1060 . 1 1 108 108 ILE HG21 H 1 0.85 0.01 . 1 . . . . 108 . . . 6142 1 1061 . 1 1 108 108 ILE HG22 H 1 0.85 0.01 . 1 . . . . 108 . . . 6142 1 1062 . 1 1 108 108 ILE HG23 H 1 0.85 0.01 . 1 . . . . 108 . . . 6142 1 1063 . 1 1 108 108 ILE CG1 C 13 25.3 0.3 . 1 . . . . 108 . . . 6142 1 1064 . 1 1 108 108 ILE HG12 H 1 1.42 0.01 . 1 . . . . 108 . . . 6142 1 1065 . 1 1 108 108 ILE HG13 H 1 1.16 0.01 . 1 . . . . 108 . . . 6142 1 1066 . 1 1 108 108 ILE CD1 C 13 16.8 0.3 . 1 . . . . 108 . . . 6142 1 1067 . 1 1 108 108 ILE HD11 H 1 0.75 0.01 . 1 . . . . 108 . . . 6142 1 1068 . 1 1 108 108 ILE HD12 H 1 0.75 0.01 . 1 . . . . 108 . . . 6142 1 1069 . 1 1 108 108 ILE HD13 H 1 0.75 0.01 . 1 . . . . 108 . . . 6142 1 1070 . 1 1 109 109 ARG H H 1 8.59 0.01 . 1 . . . . 109 . . . 6142 1 1071 . 1 1 109 109 ARG N N 15 118.6 0.2 . 1 . . . . 109 . . . 6142 1 1072 . 1 1 109 109 ARG CA C 13 53.8 0.3 . 1 . . . . 109 . . . 6142 1 1073 . 1 1 109 109 ARG HA H 1 5.28 0.01 . 1 . . . . 109 . . . 6142 1 1074 . 1 1 109 109 ARG CB C 13 32.9 0.3 . 1 . . . . 109 . . . 6142 1 1075 . 1 1 109 109 ARG HB2 H 1 1.65 0.01 . 1 . . . . 109 . . . 6142 1 1076 . 1 1 109 109 ARG HB3 H 1 1.58 0.01 . 1 . . . . 109 . . . 6142 1 1077 . 1 1 109 109 ARG CG C 13 29.3 0.3 . 1 . . . . 109 . . . 6142 1 1078 . 1 1 109 109 ARG HG2 H 1 1.71 0.01 . 1 . . . . 109 . . . 6142 1 1079 . 1 1 109 109 ARG HG3 H 1 1.82 0.01 . 1 . . . . 109 . . . 6142 1 1080 . 1 1 109 109 ARG CD C 13 43.2 0.3 . 1 . . . . 109 . . . 6142 1 1081 . 1 1 109 109 ARG HD2 H 1 3.23 0.01 . 1 . . . . 109 . . . 6142 1 1082 . 1 1 109 109 ARG HD3 H 1 3.23 0.01 . 1 . . . . 109 . . . 6142 1 1083 . 1 1 110 110 ALA H H 1 8.43 0.01 . 1 . . . . 110 . . . 6142 1 1084 . 1 1 110 110 ALA N N 15 122.5 0.2 . 1 . . . . 110 . . . 6142 1 1085 . 1 1 110 110 ALA CA C 13 50.6 0.3 . 1 . . . . 110 . . . 6142 1 1086 . 1 1 110 110 ALA HA H 1 4.52 0.01 . 1 . . . . 110 . . . 6142 1 1087 . 1 1 110 110 ALA CB C 13 21.4 0.3 . 1 . . . . 110 . . . 6142 1 1088 . 1 1 110 110 ALA HB1 H 1 1.01 0.01 . 1 . . . . 110 . . . 6142 1 1089 . 1 1 110 110 ALA HB2 H 1 1.01 0.01 . 1 . . . . 110 . . . 6142 1 1090 . 1 1 110 110 ALA HB3 H 1 1.01 0.01 . 1 . . . . 110 . . . 6142 1 1091 . 1 1 111 111 LEU H H 1 9.19 0.01 . 1 . . . . 111 . . . 6142 1 1092 . 1 1 111 111 LEU N N 15 114.1 0.2 . 1 . . . . 111 . . . 6142 1 1093 . 1 1 111 111 LEU CA C 13 52.9 0.3 . 1 . . . . 111 . . . 6142 1 1094 . 1 1 111 111 LEU HA H 1 5.18 0.01 . 1 . . . . 111 . . . 6142 1 1095 . 1 1 111 111 LEU CB C 13 43.2 0.3 . 1 . . . . 111 . . . 6142 1 1096 . 1 1 111 111 LEU HB2 H 1 1.73 0.01 . 1 . . . . 111 . . . 6142 1 1097 . 1 1 111 111 LEU HB3 H 1 1.18 0.01 . 1 . . . . 111 . . . 6142 1 1098 . 1 1 111 111 LEU CG C 13 29 0.3 . 1 . . . . 111 . . . 6142 1 1099 . 1 1 111 111 LEU CD1 C 13 24 0.3 . 1 . . . . 111 . . . 6142 1 1100 . 1 1 111 111 LEU HD11 H 1 0.86 0.01 . 1 . . . . 111 . . . 6142 1 1101 . 1 1 111 111 LEU HD12 H 1 0.86 0.01 . 1 . . . . 111 . . . 6142 1 1102 . 1 1 111 111 LEU HD13 H 1 0.86 0.01 . 1 . . . . 111 . . . 6142 1 1103 . 1 1 111 111 LEU CD2 C 13 27.3 0.3 . 1 . . . . 111 . . . 6142 1 1104 . 1 1 111 111 LEU HD21 H 1 0.75 0.01 . 1 . . . . 111 . . . 6142 1 1105 . 1 1 111 111 LEU HD22 H 1 0.75 0.01 . 1 . . . . 111 . . . 6142 1 1106 . 1 1 111 111 LEU HD23 H 1 0.75 0.01 . 1 . . . . 111 . . . 6142 1 1107 . 1 1 111 111 LEU HG H 1 1.67 0.01 . 1 . . . . 111 . . . 6142 1 1108 . 1 1 112 112 ASP H H 1 8.57 0.01 . 1 . . . . 112 . . . 6142 1 1109 . 1 1 112 112 ASP N N 15 117.1 0.2 . 1 . . . . 112 . . . 6142 1 1110 . 1 1 112 112 ASP CA C 13 51.5 0.3 . 1 . . . . 112 . . . 6142 1 1111 . 1 1 112 112 ASP HA H 1 4.91 0.01 . 1 . . . . 112 . . . 6142 1 1112 . 1 1 112 112 ASP CB C 13 40.4 0.3 . 1 . . . . 112 . . . 6142 1 1113 . 1 1 112 112 ASP HB2 H 1 2.8 0.01 . 1 . . . . 112 . . . 6142 1 1114 . 1 1 112 112 ASP HB3 H 1 3.45 0.01 . 1 . . . . 112 . . . 6142 1 1115 . 1 1 113 113 ARG H H 1 8.14 0.01 . 1 . . . . 113 . . . 6142 1 1116 . 1 1 113 113 ARG N N 15 111.4 0.2 . 1 . . . . 113 . . . 6142 1 1117 . 1 1 113 113 ARG CA C 13 58.7 0.3 . 1 . . . . 113 . . . 6142 1 1118 . 1 1 113 113 ARG HA H 1 3.92 0.01 . 1 . . . . 113 . . . 6142 1 1119 . 1 1 113 113 ARG CB C 13 29.2 0.3 . 1 . . . . 113 . . . 6142 1 1120 . 1 1 113 113 ARG HB2 H 1 2.91 0.01 . 1 . . . . 113 . . . 6142 1 1121 . 1 1 113 113 ARG HB3 H 1 2.80 0.01 . 1 . . . . 113 . . . 6142 1 1122 . 1 1 113 113 ARG CG C 13 29.5 0.3 . 1 . . . . 113 . . . 6142 1 1123 . 1 1 113 113 ARG HG2 H 1 2.18 0.01 . 1 . . . . 113 . . . 6142 1 1124 . 1 1 113 113 ARG HG3 H 1 2.16 0.01 . 1 . . . . 113 . . . 6142 1 1125 . 1 1 113 113 ARG CD C 13 42.3 0.3 . 1 . . . . 113 . . . 6142 1 1126 . 1 1 113 113 ARG HD2 H 1 3.31 0.01 . 1 . . . . 113 . . . 6142 1 1127 . 1 1 113 113 ARG HD3 H 1 3.31 0.01 . 1 . . . . 113 . . . 6142 1 1128 . 1 1 114 114 ASP H H 1 8.15 0.01 . 1 . . . . 114 . . . 6142 1 1129 . 1 1 114 114 ASP N N 15 112.1 0.2 . 1 . . . . 114 . . . 6142 1 1130 . 1 1 114 114 ASP CA C 13 54.2 0.3 . 1 . . . . 114 . . . 6142 1 1131 . 1 1 114 114 ASP HA H 1 4.76 0.01 . 1 . . . . 114 . . . 6142 1 1132 . 1 1 114 114 ASP CB C 13 41.4 0.3 . 1 . . . . 114 . . . 6142 1 1133 . 1 1 114 114 ASP HB2 H 1 2.8 0.01 . 1 . . . . 114 . . . 6142 1 1134 . 1 1 114 114 ASP HB3 H 1 2.9 0.01 . 1 . . . . 114 . . . 6142 1 1135 . 1 1 115 115 GLY H H 1 8.72 0.01 . 1 . . . . 115 . . . 6142 1 1136 . 1 1 115 115 GLY N N 15 107.1 0.2 . 1 . . . . 115 . . . 6142 1 1137 . 1 1 115 115 GLY CA C 13 45.3 0.3 . 1 . . . . 115 . . . 6142 1 1138 . 1 1 115 115 GLY HA2 H 1 4.28 0.01 . 2 . . . . 115 . . . 6142 1 1139 . 1 1 115 115 GLY HA3 H 1 3.57 0.01 . 2 . . . . 115 . . . 6142 1 1140 . 1 1 116 116 LYS H H 1 8.71 0.01 . 1 . . . . 116 . . . 6142 1 1141 . 1 1 116 116 LYS N N 15 120.6 0.2 . 1 . . . . 116 . . . 6142 1 1142 . 1 1 116 116 LYS CA C 13 53.1 0.3 . 1 . . . . 116 . . . 6142 1 1143 . 1 1 116 116 LYS HA H 1 4.89 0.01 . 1 . . . . 116 . . . 6142 1 1144 . 1 1 116 116 LYS CB C 13 31.3 0.3 . 1 . . . . 116 . . . 6142 1 1145 . 1 1 116 116 LYS HB2 H 1 2.15 0.01 . 1 . . . . 116 . . . 6142 1 1146 . 1 1 116 116 LYS HB3 H 1 2.15 0.01 . 1 . . . . 116 . . . 6142 1 1147 . 1 1 116 116 LYS CG C 13 26.8 0.3 . 1 . . . . 116 . . . 6142 1 1148 . 1 1 116 116 LYS HG2 H 1 1.59 0.01 . 1 . . . . 116 . . . 6142 1 1149 . 1 1 116 116 LYS HG3 H 1 1.50 0.01 . 1 . . . . 116 . . . 6142 1 1150 . 1 1 116 116 LYS CD C 13 30.8 0.3 . 1 . . . . 116 . . . 6142 1 1151 . 1 1 116 116 LYS HD2 H 1 1.79 0.01 . 1 . . . . 116 . . . 6142 1 1152 . 1 1 116 116 LYS HD3 H 1 1.81 0.01 . 1 . . . . 116 . . . 6142 1 1153 . 1 1 116 116 LYS CE C 13 43.2 0.3 . 1 . . . . 116 . . . 6142 1 1154 . 1 1 116 116 LYS HE2 H 1 3.07 0.01 . 1 . . . . 116 . . . 6142 1 1155 . 1 1 116 116 LYS HE3 H 1 3.16 0.01 . 1 . . . . 116 . . . 6142 1 1156 . 1 1 117 117 PRO CA C 13 62.3 0.3 . 1 . . . . 117 . . . 6142 1 1157 . 1 1 117 117 PRO HA H 1 5.43 0.01 . 1 . . . . 117 . . . 6142 1 1158 . 1 1 117 117 PRO CB C 13 31.9 0.3 . 1 . . . . 117 . . . 6142 1 1159 . 1 1 117 117 PRO HB2 H 1 2.2 0.01 . 1 . . . . 117 . . . 6142 1 1160 . 1 1 117 117 PRO HB3 H 1 1.99 0.01 . 1 . . . . 117 . . . 6142 1 1161 . 1 1 117 117 PRO HG2 H 1 2.03 0.01 . 1 . . . . 117 . . . 6142 1 1162 . 1 1 117 117 PRO HG3 H 1 2.08 0.01 . 1 . . . . 117 . . . 6142 1 1163 . 1 1 117 117 PRO CD C 13 50.8 0.3 . 1 . . . . 117 . . . 6142 1 1164 . 1 1 117 117 PRO HD2 H 1 3.85 0.01 . 1 . . . . 117 . . . 6142 1 1165 . 1 1 117 117 PRO HD3 H 1 4.06 0.01 . 1 . . . . 117 . . . 6142 1 1166 . 1 1 118 118 PHE H H 1 9.3 0.01 . 1 . . . . 118 . . . 6142 1 1167 . 1 1 118 118 PHE N N 15 116.6 0.2 . 1 . . . . 118 . . . 6142 1 1168 . 1 1 118 118 PHE CA C 13 56.1 0.3 . 1 . . . . 118 . . . 6142 1 1169 . 1 1 118 118 PHE HA H 1 5.01 0.01 . 1 . . . . 118 . . . 6142 1 1170 . 1 1 118 118 PHE CB C 13 40.6 0.3 . 1 . . . . 118 . . . 6142 1 1171 . 1 1 118 118 PHE HB2 H 1 3.14 0.01 . 1 . . . . 118 . . . 6142 1 1172 . 1 1 118 118 PHE HB3 H 1 3.36 0.01 . 1 . . . . 118 . . . 6142 1 1173 . 1 1 119 119 GLU H H 1 8.39 0.01 . 1 . . . . 119 . . . 6142 1 1174 . 1 1 119 119 GLU N N 15 115.3 0.2 . 1 . . . . 119 . . . 6142 1 1175 . 1 1 119 119 GLU CA C 13 54.1 0.3 . 1 . . . . 119 . . . 6142 1 1176 . 1 1 119 119 GLU HA H 1 5.27 0.01 . 1 . . . . 119 . . . 6142 1 1177 . 1 1 119 119 GLU CB C 13 32.9 0.3 . 1 . . . . 119 . . . 6142 1 1178 . 1 1 119 119 GLU HB2 H 1 1.92 0.01 . 1 . . . . 119 . . . 6142 1 1179 . 1 1 119 119 GLU HB3 H 1 2.3 0.01 . 1 . . . . 119 . . . 6142 1 1180 . 1 1 119 119 GLU CG C 13 37.2 0.3 . 1 . . . . 119 . . . 6142 1 1181 . 1 1 119 119 GLU HG2 H 1 2.1 0.01 . 1 . . . . 119 . . . 6142 1 1182 . 1 1 119 119 GLU HG3 H 1 2.26 0.01 . 1 . . . . 119 . . . 6142 1 1183 . 1 1 120 120 LEU H H 1 8.91 0.01 . 1 . . . . 120 . . . 6142 1 1184 . 1 1 120 120 LEU N N 15 121.6 0.2 . 1 . . . . 120 . . . 6142 1 1185 . 1 1 120 120 LEU CA C 13 54 0.3 . 1 . . . . 120 . . . 6142 1 1186 . 1 1 120 120 LEU HA H 1 4.86 0.01 . 1 . . . . 120 . . . 6142 1 1187 . 1 1 120 120 LEU CB C 13 46.7 0.3 . 1 . . . . 120 . . . 6142 1 1188 . 1 1 120 120 LEU HB2 H 1 1.63 0.01 . 1 . . . . 120 . . . 6142 1 1189 . 1 1 120 120 LEU HB3 H 1 1.68 0.01 . 1 . . . . 120 . . . 6142 1 1190 . 1 1 120 120 LEU CG C 13 29 0.3 . 1 . . . . 120 . . . 6142 1 1191 . 1 1 120 120 LEU CD1 C 13 27.4 0.3 . 1 . . . . 120 . . . 6142 1 1192 . 1 1 120 120 LEU HD11 H 1 0.93 0.01 . 1 . . . . 120 . . . 6142 1 1193 . 1 1 120 120 LEU HD12 H 1 0.93 0.01 . 1 . . . . 120 . . . 6142 1 1194 . 1 1 120 120 LEU HD13 H 1 0.93 0.01 . 1 . . . . 120 . . . 6142 1 1195 . 1 1 120 120 LEU CD2 C 13 26.4 0.3 . 1 . . . . 120 . . . 6142 1 1196 . 1 1 120 120 LEU HD21 H 1 1.07 0.01 . 1 . . . . 120 . . . 6142 1 1197 . 1 1 120 120 LEU HD22 H 1 1.07 0.01 . 1 . . . . 120 . . . 6142 1 1198 . 1 1 120 120 LEU HD23 H 1 1.07 0.01 . 1 . . . . 120 . . . 6142 1 1199 . 1 1 120 120 LEU HG H 1 1.51 0.01 . 1 . . . . 120 . . . 6142 1 1200 . 1 1 121 121 GLU H H 1 8.75 0.01 . 1 . . . . 121 . . . 6142 1 1201 . 1 1 121 121 GLU N N 15 124.5 0.2 . 1 . . . . 121 . . . 6142 1 1202 . 1 1 121 121 GLU CA C 13 55.1 0.3 . 1 . . . . 121 . . . 6142 1 1203 . 1 1 121 121 GLU HA H 1 5.15 0.01 . 1 . . . . 121 . . . 6142 1 1204 . 1 1 121 121 GLU CB C 13 30.9 0.3 . 1 . . . . 121 . . . 6142 1 1205 . 1 1 121 121 GLU HB2 H 1 2.08 0.01 . 1 . . . . 121 . . . 6142 1 1206 . 1 1 121 121 GLU HB3 H 1 1.92 0.01 . 1 . . . . 121 . . . 6142 1 1207 . 1 1 121 121 GLU CG C 13 37.2 0.3 . 1 . . . . 121 . . . 6142 1 1208 . 1 1 121 121 GLU HG2 H 1 2.22 0.01 . 1 . . . . 121 . . . 6142 1 1209 . 1 1 121 121 GLU HG3 H 1 2.22 0.01 . 1 . . . . 121 . . . 6142 1 1210 . 1 1 122 122 ALA H H 1 9.1 0.01 . 1 . . . . 122 . . . 6142 1 1211 . 1 1 122 122 ALA N N 15 123.8 0.2 . 1 . . . . 122 . . . 6142 1 1212 . 1 1 122 122 ALA CA C 13 50.2 0.3 . 1 . . . . 122 . . . 6142 1 1213 . 1 1 122 122 ALA HA H 1 4.98 0.01 . 1 . . . . 122 . . . 6142 1 1214 . 1 1 122 122 ALA CB C 13 22.5 0.3 . 1 . . . . 122 . . . 6142 1 1215 . 1 1 122 122 ALA HB1 H 1 1.2 0.01 . 1 . . . . 122 . . . 6142 1 1216 . 1 1 122 122 ALA HB2 H 1 1.2 0.01 . 1 . . . . 122 . . . 6142 1 1217 . 1 1 122 122 ALA HB3 H 1 1.2 0.01 . 1 . . . . 122 . . . 6142 1 1218 . 1 1 123 123 ASP H H 1 8.34 0.01 . 1 . . . . 123 . . . 6142 1 1219 . 1 1 123 123 ASP N N 15 117.2 0.2 . 1 . . . . 123 . . . 6142 1 1220 . 1 1 123 123 ASP CA C 13 51.6 0.3 . 1 . . . . 123 . . . 6142 1 1221 . 1 1 123 123 ASP HA H 1 4.81 0.01 . 1 . . . . 123 . . . 6142 1 1222 . 1 1 123 123 ASP CB C 13 43.1 0.3 . 1 . . . . 123 . . . 6142 1 1223 . 1 1 123 123 ASP HB2 H 1 3.02 0.01 . 1 . . . . 123 . . . 6142 1 1224 . 1 1 123 123 ASP HB3 H 1 2.68 0.01 . 1 . . . . 123 . . . 6142 1 1225 . 1 1 124 124 GLY H H 1 8.32 0.01 . 1 . . . . 124 . . . 6142 1 1226 . 1 1 124 124 GLY N N 15 104.3 0.2 . 1 . . . . 124 . . . 6142 1 1227 . 1 1 124 124 GLY CA C 13 46.1 0.3 . 1 . . . . 124 . . . 6142 1 1228 . 1 1 124 124 GLY HA2 H 1 4.01 0.01 . 2 . . . . 124 . . . 6142 1 1229 . 1 1 124 124 GLY HA3 H 1 3.95 0.01 . 2 . . . . 124 . . . 6142 1 1230 . 1 1 125 125 LEU CA C 13 57.8 0.3 . 1 . . . . 125 . . . 6142 1 1231 . 1 1 125 125 LEU CB C 13 41.8 0.3 . 1 . . . . 125 . . . 6142 1 1232 . 1 1 126 126 LEU H H 1 8.76 0.01 . 1 . . . . 126 . . . 6142 1 1233 . 1 1 126 126 LEU N N 15 116.1 0.2 . 1 . . . . 126 . . . 6142 1 1234 . 1 1 126 126 LEU CA C 13 58 0.3 . 1 . . . . 126 . . . 6142 1 1235 . 1 1 126 126 LEU HA H 1 4.1 0.01 . 1 . . . . 126 . . . 6142 1 1236 . 1 1 126 126 LEU CB C 13 40.3 0.3 . 1 . . . . 126 . . . 6142 1 1237 . 1 1 126 126 LEU HB2 H 1 2.2 0.01 . 1 . . . . 126 . . . 6142 1 1238 . 1 1 126 126 LEU HB3 H 1 1.8 0.01 . 1 . . . . 126 . . . 6142 1 1239 . 1 1 126 126 LEU CG C 13 26.9 0.3 . 1 . . . . 126 . . . 6142 1 1240 . 1 1 126 126 LEU CD1 C 13 25.5 0.3 . 1 . . . . 126 . . . 6142 1 1241 . 1 1 126 126 LEU HD11 H 1 1.08 0.01 . 1 . . . . 126 . . . 6142 1 1242 . 1 1 126 126 LEU HD12 H 1 1.08 0.01 . 1 . . . . 126 . . . 6142 1 1243 . 1 1 126 126 LEU HD13 H 1 1.08 0.01 . 1 . . . . 126 . . . 6142 1 1244 . 1 1 126 126 LEU CD2 C 13 24 0.3 . 1 . . . . 126 . . . 6142 1 1245 . 1 1 126 126 LEU HD21 H 1 0.93 0.01 . 1 . . . . 126 . . . 6142 1 1246 . 1 1 126 126 LEU HD22 H 1 0.93 0.01 . 1 . . . . 126 . . . 6142 1 1247 . 1 1 126 126 LEU HD23 H 1 0.93 0.01 . 1 . . . . 126 . . . 6142 1 1248 . 1 1 126 126 LEU HG H 1 1.52 0.01 . 1 . . . . 126 . . . 6142 1 1249 . 1 1 127 127 ALA H H 1 7.24 0.01 . 1 . . . . 127 . . . 6142 1 1250 . 1 1 127 127 ALA N N 15 116.3 0.2 . 1 . . . . 127 . . . 6142 1 1251 . 1 1 127 127 ALA CA C 13 55 0.3 . 1 . . . . 127 . . . 6142 1 1252 . 1 1 127 127 ALA HA H 1 3.72 0.01 . 1 . . . . 127 . . . 6142 1 1253 . 1 1 127 127 ALA CB C 13 17.4 0.3 . 1 . . . . 127 . . . 6142 1 1254 . 1 1 127 127 ALA HB1 H 1 1.27 0.01 . 1 . . . . 127 . . . 6142 1 1255 . 1 1 127 127 ALA HB2 H 1 1.27 0.01 . 1 . . . . 127 . . . 6142 1 1256 . 1 1 127 127 ALA HB3 H 1 1.27 0.01 . 1 . . . . 127 . . . 6142 1 1257 . 1 1 128 128 ILE H H 1 7.76 0.01 . 1 . . . . 128 . . . 6142 1 1258 . 1 1 128 128 ILE N N 15 119.2 0.2 . 1 . . . . 128 . . . 6142 1 1259 . 1 1 128 128 ILE CA C 13 65.9 0.3 . 1 . . . . 128 . . . 6142 1 1260 . 1 1 128 128 ILE HA H 1 3.4 0.01 . 1 . . . . 128 . . . 6142 1 1261 . 1 1 128 128 ILE CB C 13 37.4 0.3 . 1 . . . . 128 . . . 6142 1 1262 . 1 1 128 128 ILE HB H 1 1.9 0.01 . 1 . . . . 128 . . . 6142 1 1263 . 1 1 128 128 ILE CG2 C 13 19.7 0.3 . 1 . . . . 128 . . . 6142 1 1264 . 1 1 128 128 ILE HG21 H 1 0.92 0.01 . 1 . . . . 128 . . . 6142 1 1265 . 1 1 128 128 ILE HG22 H 1 0.92 0.01 . 1 . . . . 128 . . . 6142 1 1266 . 1 1 128 128 ILE HG23 H 1 0.92 0.01 . 1 . . . . 128 . . . 6142 1 1267 . 1 1 128 128 ILE HG12 H 1 1.79 0.01 . 1 . . . . 128 . . . 6142 1 1268 . 1 1 128 128 ILE HG13 H 1 1.79 0.01 . 1 . . . . 128 . . . 6142 1 1269 . 1 1 128 128 ILE CD1 C 13 19.3 0.3 . 1 . . . . 128 . . . 6142 1 1270 . 1 1 128 128 ILE HD11 H 1 0.84 0.01 . 1 . . . . 128 . . . 6142 1 1271 . 1 1 128 128 ILE HD12 H 1 0.84 0.01 . 1 . . . . 128 . . . 6142 1 1272 . 1 1 128 128 ILE HD13 H 1 0.84 0.01 . 1 . . . . 128 . . . 6142 1 1273 . 1 1 129 129 CYS H H 1 8.9 0.01 . 1 . . . . 129 . . . 6142 1 1274 . 1 1 129 129 CYS N N 15 117.5 0.2 . 1 . . . . 129 . . . 6142 1 1275 . 1 1 129 129 CYS CA C 13 61.9 0.3 . 1 . . . . 129 . . . 6142 1 1276 . 1 1 129 129 CYS HA H 1 4.67 0.01 . 1 . . . . 129 . . . 6142 1 1277 . 1 1 129 129 CYS CB C 13 26 0.3 . 1 . . . . 129 . . . 6142 1 1278 . 1 1 129 129 CYS HB2 H 1 3.86 0.01 . 1 . . . . 129 . . . 6142 1 1279 . 1 1 129 129 CYS HB3 H 1 3.86 0.01 . 1 . . . . 129 . . . 6142 1 1280 . 1 1 130 130 ILE H H 1 8.83 0.01 . 1 . . . . 130 . . . 6142 1 1281 . 1 1 130 130 ILE N N 15 115.2 0.2 . 1 . . . . 130 . . . 6142 1 1282 . 1 1 130 130 ILE CA C 13 67.5 0.3 . 1 . . . . 130 . . . 6142 1 1283 . 1 1 130 130 ILE HA H 1 3.36 0.01 . 1 . . . . 130 . . . 6142 1 1284 . 1 1 130 130 ILE CB C 13 37.4 0.3 . 1 . . . . 130 . . . 6142 1 1285 . 1 1 130 130 ILE HB H 1 1.80 0.01 . 1 . . . . 130 . . . 6142 1 1286 . 1 1 131 131 GLN H H 1 7.5 0.01 . 1 . . . . 131 . . . 6142 1 1287 . 1 1 131 131 GLN N N 15 115.0 0.2 . 1 . . . . 131 . . . 6142 1 1288 . 1 1 131 131 GLN CA C 13 59.5 0.3 . 1 . . . . 131 . . . 6142 1 1289 . 1 1 131 131 GLN HA H 1 3.96 0.01 . 1 . . . . 131 . . . 6142 1 1290 . 1 1 131 131 GLN CB C 13 30.4 0.3 . 1 . . . . 131 . . . 6142 1 1291 . 1 1 131 131 GLN HB2 H 1 2.16 0.01 . 1 . . . . 131 . . . 6142 1 1292 . 1 1 131 131 GLN HB3 H 1 2.22 0.01 . 1 . . . . 131 . . . 6142 1 1293 . 1 1 131 131 GLN CG C 13 36.5 0.3 . 1 . . . . 131 . . . 6142 1 1294 . 1 1 131 131 GLN HG2 H 1 2.49 0.01 . 1 . . . . 131 . . . 6142 1 1295 . 1 1 131 131 GLN HG3 H 1 2.49 0.01 . 1 . . . . 131 . . . 6142 1 1296 . 1 1 131 131 GLN HE21 H 1 6.68 0.01 . 1 . . . . 131 . . . 6142 1 1297 . 1 1 131 131 GLN HE22 H 1 7.25 0.01 . 1 . . . . 131 . . . 6142 1 1298 . 1 1 132 132 HIS H H 1 8.48 0.01 . 1 . . . . 132 . . . 6142 1 1299 . 1 1 132 132 HIS N N 15 117.2 0.2 . 1 . . . . 132 . . . 6142 1 1300 . 1 1 132 132 HIS CA C 13 59.7 0.3 . 1 . . . . 132 . . . 6142 1 1301 . 1 1 132 132 HIS HA H 1 4.14 0.01 . 1 . . . . 132 . . . 6142 1 1302 . 1 1 132 132 HIS CB C 13 27.7 0.3 . 1 . . . . 132 . . . 6142 1 1303 . 1 1 132 132 HIS HB2 H 1 3.43 0.01 . 1 . . . . 132 . . . 6142 1 1304 . 1 1 132 132 HIS HB3 H 1 3.14 0.01 . 1 . . . . 132 . . . 6142 1 1305 . 1 1 133 133 GLU H H 1 9.02 0.01 . 1 . . . . 133 . . . 6142 1 1306 . 1 1 133 133 GLU N N 15 113.7 0.2 . 1 . . . . 133 . . . 6142 1 1307 . 1 1 133 133 GLU CA C 13 57.4 0.3 . 1 . . . . 133 . . . 6142 1 1308 . 1 1 133 133 GLU HA H 1 5.22 0.01 . 1 . . . . 133 . . . 6142 1 1309 . 1 1 133 133 GLU CB C 13 27.6 0.3 . 1 . . . . 133 . . . 6142 1 1310 . 1 1 133 133 GLU HB2 H 1 2.05 0.01 . 1 . . . . 133 . . . 6142 1 1311 . 1 1 133 133 GLU HB3 H 1 2.3 0.01 . 1 . . . . 133 . . . 6142 1 1312 . 1 1 134 134 MET H H 1 9.23 0.01 . 1 . . . . 134 . . . 6142 1 1313 . 1 1 134 134 MET N N 15 116.4 0.2 . 1 . . . . 134 . . . 6142 1 1314 . 1 1 134 134 MET CA C 13 60.6 0.3 . 1 . . . . 134 . . . 6142 1 1315 . 1 1 134 134 MET HA H 1 4.7 0.01 . 1 . . . . 134 . . . 6142 1 1316 . 1 1 134 134 MET CB C 13 30.9 0.3 . 1 . . . . 134 . . . 6142 1 1317 . 1 1 134 134 MET HB2 H 1 2.19 0.01 . 1 . . . . 134 . . . 6142 1 1318 . 1 1 134 134 MET HB3 H 1 2.1 0.01 . 1 . . . . 134 . . . 6142 1 1319 . 1 1 134 134 MET HG2 H 1 2.86 0.01 . 1 . . . . 134 . . . 6142 1 1320 . 1 1 134 134 MET HG3 H 1 2.86 0.01 . 1 . . . . 134 . . . 6142 1 1321 . 1 1 134 134 MET HE1 H 1 2.36 0.01 . 1 . . . . 134 . . . 6142 1 1322 . 1 1 134 134 MET HE2 H 1 2.36 0.01 . 1 . . . . 134 . . . 6142 1 1323 . 1 1 134 134 MET HE3 H 1 2.36 0.01 . 1 . . . . 134 . . . 6142 1 1324 . 1 1 135 135 ASP H H 1 8.23 0.01 . 1 . . . . 135 . . . 6142 1 1325 . 1 1 135 135 ASP N N 15 118.1 0.2 . 1 . . . . 135 . . . 6142 1 1326 . 1 1 135 135 ASP CA C 13 56.2 0.3 . 1 . . . . 135 . . . 6142 1 1327 . 1 1 135 135 ASP HA H 1 4.5 0.01 . 1 . . . . 135 . . . 6142 1 1328 . 1 1 135 135 ASP CB C 13 38.1 0.3 . 1 . . . . 135 . . . 6142 1 1329 . 1 1 135 135 ASP HB2 H 1 2.47 0.01 . 1 . . . . 135 . . . 6142 1 1330 . 1 1 135 135 ASP HB3 H 1 2.94 0.01 . 1 . . . . 135 . . . 6142 1 1331 . 1 1 136 136 HIS H H 1 7.38 0.01 . 1 . . . . 136 . . . 6142 1 1332 . 1 1 136 136 HIS N N 15 114.9 0.2 . 1 . . . . 136 . . . 6142 1 1333 . 1 1 136 136 HIS CA C 13 59.8 0.3 . 1 . . . . 136 . . . 6142 1 1334 . 1 1 136 136 HIS HA H 1 4.7 0.01 . 1 . . . . 136 . . . 6142 1 1335 . 1 1 136 136 HIS CB C 13 29.0 0.3 . 1 . . . . 136 . . . 6142 1 1336 . 1 1 136 136 HIS HB2 H 1 3.92 0.01 . 1 . . . . 136 . . . 6142 1 1337 . 1 1 136 136 HIS HB3 H 1 2.76 0.01 . 1 . . . . 136 . . . 6142 1 1338 . 1 1 137 137 LEU H H 1 7.29 0.01 . 1 . . . . 137 . . . 6142 1 1339 . 1 1 137 137 LEU N N 15 109.3 0.2 . 1 . . . . 137 . . . 6142 1 1340 . 1 1 137 137 LEU CA C 13 56 0.3 . 1 . . . . 137 . . . 6142 1 1341 . 1 1 137 137 LEU HA H 1 4.85 0.01 . 1 . . . . 137 . . . 6142 1 1342 . 1 1 137 137 LEU CB C 13 42.8 0.3 . 1 . . . . 137 . . . 6142 1 1343 . 1 1 137 137 LEU HB2 H 1 2.32 0.01 . 1 . . . . 137 . . . 6142 1 1344 . 1 1 137 137 LEU HB3 H 1 1.67 0.01 . 1 . . . . 137 . . . 6142 1 1345 . 1 1 137 137 LEU CD1 C 13 24.5 0.3 . 1 . . . . 137 . . . 6142 1 1346 . 1 1 137 137 LEU HD11 H 1 1.36 0.01 . 1 . . . . 137 . . . 6142 1 1347 . 1 1 137 137 LEU HD12 H 1 1.36 0.01 . 1 . . . . 137 . . . 6142 1 1348 . 1 1 137 137 LEU HD13 H 1 1.36 0.01 . 1 . . . . 137 . . . 6142 1 1349 . 1 1 137 137 LEU CD2 C 13 27.7 0.3 . 1 . . . . 137 . . . 6142 1 1350 . 1 1 137 137 LEU HD21 H 1 1.36 0.01 . 1 . . . . 137 . . . 6142 1 1351 . 1 1 137 137 LEU HD22 H 1 1.36 0.01 . 1 . . . . 137 . . . 6142 1 1352 . 1 1 137 137 LEU HD23 H 1 1.36 0.01 . 1 . . . . 137 . . . 6142 1 1353 . 1 1 138 138 VAL H H 1 7.68 0.01 . 1 . . . . 138 . . . 6142 1 1354 . 1 1 138 138 VAL N N 15 109.2 0.2 . 1 . . . . 138 . . . 6142 1 1355 . 1 1 138 138 VAL CA C 13 60.2 0.3 . 1 . . . . 138 . . . 6142 1 1356 . 1 1 138 138 VAL HA H 1 4.77 0.01 . 1 . . . . 138 . . . 6142 1 1357 . 1 1 138 138 VAL CB C 13 29.3 0.3 . 1 . . . . 138 . . . 6142 1 1358 . 1 1 138 138 VAL HB H 1 2.65 0.01 . 1 . . . . 138 . . . 6142 1 1359 . 1 1 138 138 VAL CG1 C 13 23.5 0.3 . 1 . . . . 138 . . . 6142 1 1360 . 1 1 138 138 VAL HG11 H 1 1.1 0.01 . 1 . . . . 138 . . . 6142 1 1361 . 1 1 138 138 VAL HG12 H 1 1.1 0.01 . 1 . . . . 138 . . . 6142 1 1362 . 1 1 138 138 VAL HG13 H 1 1.1 0.01 . 1 . . . . 138 . . . 6142 1 1363 . 1 1 138 138 VAL CG2 C 13 23.5 0.3 . 1 . . . . 138 . . . 6142 1 1364 . 1 1 138 138 VAL HG21 H 1 1.1 0.01 . 1 . . . . 138 . . . 6142 1 1365 . 1 1 138 138 VAL HG22 H 1 1.1 0.01 . 1 . . . . 138 . . . 6142 1 1366 . 1 1 138 138 VAL HG23 H 1 1.1 0.01 . 1 . . . . 138 . . . 6142 1 1367 . 1 1 139 139 GLY H H 1 8.03 0.01 . 1 . . . . 139 . . . 6142 1 1368 . 1 1 139 139 GLY N N 15 107.7 0.2 . 1 . . . . 139 . . . 6142 1 1369 . 1 1 139 139 GLY CA C 13 45.7 0.3 . 1 . . . . 139 . . . 6142 1 1370 . 1 1 139 139 GLY HA2 H 1 4.19 0.01 . 1 . . . . 139 . . . 6142 1 1371 . 1 1 139 139 GLY HA3 H 1 3.75 0.01 . 1 . . . . 139 . . . 6142 1 1372 . 1 1 140 140 LYS H H 1 8.12 0.01 . 1 . . . . 140 . . . 6142 1 1373 . 1 1 140 140 LYS N N 15 117.7 0.2 . 1 . . . . 140 . . . 6142 1 1374 . 1 1 140 140 LYS CA C 13 55.1 0.3 . 1 . . . . 140 . . . 6142 1 1375 . 1 1 140 140 LYS HA H 1 4.36 0.01 . 1 . . . . 140 . . . 6142 1 1376 . 1 1 140 140 LYS CB C 13 33.7 0.3 . 1 . . . . 140 . . . 6142 1 1377 . 1 1 140 140 LYS HB2 H 1 1.54 0.01 . 1 . . . . 140 . . . 6142 1 1378 . 1 1 140 140 LYS HB3 H 1 1.40 0.01 . 1 . . . . 140 . . . 6142 1 1379 . 1 1 140 140 LYS CG C 13 23.9 0.3 . 1 . . . . 140 . . . 6142 1 1380 . 1 1 140 140 LYS HG2 H 1 1.15 0.01 . 1 . . . . 140 . . . 6142 1 1381 . 1 1 140 140 LYS HG3 H 1 1.22 0.01 . 1 . . . . 140 . . . 6142 1 1382 . 1 1 140 140 LYS CD C 13 24.2 0.3 . 1 . . . . 140 . . . 6142 1 1383 . 1 1 140 140 LYS HD2 H 1 0.95 0.01 . 1 . . . . 140 . . . 6142 1 1384 . 1 1 140 140 LYS HD3 H 1 0.95 0.01 . 1 . . . . 140 . . . 6142 1 1385 . 1 1 140 140 LYS CE C 13 40.8 0.3 . 1 . . . . 140 . . . 6142 1 1386 . 1 1 140 140 LYS HE2 H 1 2.51 0.01 . 1 . . . . 140 . . . 6142 1 1387 . 1 1 140 140 LYS HE3 H 1 2.63 0.01 . 1 . . . . 140 . . . 6142 1 1388 . 1 1 141 141 LEU H H 1 8.04 0.01 . 1 . . . . 141 . . . 6142 1 1389 . 1 1 141 141 LEU N N 15 122.2 0.2 . 1 . . . . 141 . . . 6142 1 1390 . 1 1 141 141 LEU CA C 13 51.8 0.3 . 1 . . . . 141 . . . 6142 1 1391 . 1 1 141 141 LEU HA H 1 4.51 0.01 . 1 . . . . 141 . . . 6142 1 1392 . 1 1 141 141 LEU CB C 13 44.3 0.3 . 1 . . . . 141 . . . 6142 1 1393 . 1 1 141 141 LEU HB2 H 1 1.47 0.01 . 1 . . . . 141 . . . 6142 1 1394 . 1 1 141 141 LEU HB3 H 1 1.42 0.01 . 1 . . . . 141 . . . 6142 1 1395 . 1 1 141 141 LEU CG C 13 29.4 0.3 . 1 . . . . 141 . . . 6142 1 1396 . 1 1 141 141 LEU CD1 C 13 24.5 0.3 . 1 . . . . 141 . . . 6142 1 1397 . 1 1 141 141 LEU HD11 H 1 0.88 0.01 . 1 . . . . 141 . . . 6142 1 1398 . 1 1 141 141 LEU HD12 H 1 0.88 0.01 . 1 . . . . 141 . . . 6142 1 1399 . 1 1 141 141 LEU HD13 H 1 0.88 0.01 . 1 . . . . 141 . . . 6142 1 1400 . 1 1 141 141 LEU CD2 C 13 24.5 0.3 . 1 . . . . 141 . . . 6142 1 1401 . 1 1 141 141 LEU HD21 H 1 0.83 0.01 . 1 . . . . 141 . . . 6142 1 1402 . 1 1 141 141 LEU HD22 H 1 0.83 0.01 . 1 . . . . 141 . . . 6142 1 1403 . 1 1 141 141 LEU HD23 H 1 0.83 0.01 . 1 . . . . 141 . . . 6142 1 1404 . 1 1 141 141 LEU HG H 1 1.59 0.01 . 1 . . . . 141 . . . 6142 1 1405 . 1 1 142 142 PHE H H 1 9.3 0.01 . 1 . . . . 142 . . . 6142 1 1406 . 1 1 142 142 PHE N N 15 118.0 0.2 . 1 . . . . 142 . . . 6142 1 1407 . 1 1 142 142 PHE CA C 13 60.7 0.3 . 1 . . . . 142 . . . 6142 1 1408 . 1 1 142 142 PHE HA H 1 5.02 0.01 . 1 . . . . 142 . . . 6142 1 1409 . 1 1 142 142 PHE CB C 13 36.2 0.3 . 1 . . . . 142 . . . 6142 1 1410 . 1 1 142 142 PHE HB2 H 1 4.56 0.01 . 1 . . . . 142 . . . 6142 1 1411 . 1 1 142 142 PHE HB3 H 1 4.29 0.01 . 1 . . . . 142 . . . 6142 1 1412 . 1 1 143 143 MET H H 1 5.5 0.01 . 1 . . . . 143 . . . 6142 1 1413 . 1 1 143 143 MET N N 15 112.4 0.2 . 1 . . . . 143 . . . 6142 1 1414 . 1 1 143 143 MET CA C 13 55.5 0.3 . 1 . . . . 143 . . . 6142 1 1415 . 1 1 143 143 MET HA H 1 4.1 0.01 . 1 . . . . 143 . . . 6142 1 1416 . 1 1 143 143 MET CB C 13 44.9 0.3 . 1 . . . . 143 . . . 6142 1 1417 . 1 1 143 143 MET HB2 H 1 1.64 0.01 . 1 . . . . 143 . . . 6142 1 1418 . 1 1 143 143 MET HB3 H 1 1.80 0.01 . 1 . . . . 143 . . . 6142 1 1419 . 1 1 143 143 MET CG C 13 31.4 0.3 . 1 . . . . 143 . . . 6142 1 1420 . 1 1 143 143 MET HG2 H 1 2.19 0.01 . 1 . . . . 143 . . . 6142 1 1421 . 1 1 143 143 MET HG3 H 1 2.19 0.01 . 1 . . . . 143 . . . 6142 1 1422 . 1 1 144 144 ASP H H 1 8.2 0.01 . 1 . . . . 144 . . . 6142 1 1423 . 1 1 144 144 ASP N N 15 119.0 0.2 . 1 . . . . 144 . . . 6142 1 1424 . 1 1 144 144 ASP CA C 13 54.3 0.3 . 1 . . . . 144 . . . 6142 1 1425 . 1 1 144 144 ASP HA H 1 4.32 0.01 . 1 . . . . 144 . . . 6142 1 1426 . 1 1 144 144 ASP CB C 13 40.9 0.3 . 1 . . . . 144 . . . 6142 1 1427 . 1 1 144 144 ASP HB2 H 1 2.60 0.01 . 1 . . . . 144 . . . 6142 1 1428 . 1 1 144 144 ASP HB3 H 1 2.60 0.01 . 1 . . . . 144 . . . 6142 1 1429 . 1 1 145 145 TYR H H 1 7.42 0.01 . 1 . . . . 145 . . . 6142 1 1430 . 1 1 145 145 TYR N N 15 112.5 0.2 . 1 . . . . 145 . . . 6142 1 1431 . 1 1 145 145 TYR CA C 13 60 0.3 . 1 . . . . 145 . . . 6142 1 1432 . 1 1 145 145 TYR HA H 1 4.42 0.01 . 1 . . . . 145 . . . 6142 1 1433 . 1 1 145 145 TYR CB C 13 38 0.3 . 1 . . . . 145 . . . 6142 1 1434 . 1 1 145 145 TYR HB2 H 1 3.34 0.01 . 1 . . . . 145 . . . 6142 1 1435 . 1 1 145 145 TYR HB3 H 1 3.04 0.01 . 1 . . . . 145 . . . 6142 1 1436 . 1 1 146 146 LEU H H 1 7.44 0.01 . 1 . . . . 146 . . . 6142 1 1437 . 1 1 146 146 LEU N N 15 117.3 0.2 . 1 . . . . 146 . . . 6142 1 1438 . 1 1 146 146 LEU CA C 13 54.8 0.3 . 1 . . . . 146 . . . 6142 1 1439 . 1 1 146 146 LEU HA H 1 4.58 0.01 . 1 . . . . 146 . . . 6142 1 1440 . 1 1 146 146 LEU CB C 13 41 0.3 . 1 . . . . 146 . . . 6142 1 1441 . 1 1 146 146 LEU HB2 H 1 1.83 0.01 . 1 . . . . 146 . . . 6142 1 1442 . 1 1 146 146 LEU HB3 H 1 1.83 0.01 . 1 . . . . 146 . . . 6142 1 1443 . 1 1 146 146 LEU CG C 13 33 0.3 . 1 . . . . 146 . . . 6142 1 1444 . 1 1 146 146 LEU CD1 C 13 27.5 0.3 . 1 . . . . 146 . . . 6142 1 1445 . 1 1 146 146 LEU HD11 H 1 1.02 0.01 . 1 . . . . 146 . . . 6142 1 1446 . 1 1 146 146 LEU HD12 H 1 1.02 0.01 . 1 . . . . 146 . . . 6142 1 1447 . 1 1 146 146 LEU HD13 H 1 1.02 0.01 . 1 . . . . 146 . . . 6142 1 1448 . 1 1 146 146 LEU CD2 C 13 25 0.3 . 1 . . . . 146 . . . 6142 1 1449 . 1 1 146 146 LEU HD21 H 1 0.98 0.01 . 1 . . . . 146 . . . 6142 1 1450 . 1 1 146 146 LEU HD22 H 1 0.98 0.01 . 1 . . . . 146 . . . 6142 1 1451 . 1 1 146 146 LEU HD23 H 1 0.98 0.01 . 1 . . . . 146 . . . 6142 1 1452 . 1 1 146 146 LEU HG H 1 1.83 0.01 . 1 . . . . 146 . . . 6142 1 1453 . 1 1 147 147 SER H H 1 7.6 0.01 . 1 . . . . 147 . . . 6142 1 1454 . 1 1 147 147 SER N N 15 118.2 0.2 . 1 . . . . 147 . . . 6142 1 1455 . 1 1 147 147 SER CA C 13 59.8 0.3 . 1 . . . . 147 . . . 6142 1 1456 . 1 1 147 147 SER HA H 1 4.34 0.01 . 1 . . . . 147 . . . 6142 1 1457 . 1 1 147 147 SER CB C 13 64.5 0.3 . 1 . . . . 147 . . . 6142 1 1458 . 1 1 147 147 SER HB2 H 1 3.9 0.01 . 1 . . . . 147 . . . 6142 1 1459 . 1 1 147 147 SER HB3 H 1 3.9 0.01 . 1 . . . . 147 . . . 6142 1 stop_ save_