data_17034 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17034 _Entry.Title ; 1H and 15N Chemical Shift Assignments for the Syrian hamster prion protein shPrP(90-232) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-06-30 _Entry.Accession_date 2010-06-30 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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 Trent Bjorndahl . C. . 17034 2 Guo-Ping Zhou . . . 17034 3 Xue-Hui Lui . . . 17034 4 Rolando Perez-Pineiro . . . 17034 5 Valentyna Semenchenko . . . 17034 6 Adina Bujold . . . 17034 7 Constance Sobsey . A. . 17034 8 David Wishart . S. . 17034 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 4 17034 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 544 17034 '1H chemical shifts' 1791 17034 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 2 . . 2011-02-16 2010-06-30 update BMRB 'update entry citation' 17034 1 . . 2011-01-19 2010-06-30 original author 'original release' 17034 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17034 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21189021 _Citation.Full_citation . _Citation.Title 'Detailed Biophysical Characterization of the Acid-Induced PrP(c) to PrP() Conversion Process.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume 50 _Citation.Journal_issue 7 _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 1162 _Citation.Page_last 1173 _Citation.Year 2011 _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 Trent Bjorndahl . C. . 17034 1 2 Guo-Ping Zhou . . . 17034 1 3 Xuehui Liu . . . 17034 1 4 Rolando Perez-Pineiro . . . 17034 1 5 Valentyna Semenchenko . . . 17034 1 6 Fozia Saleem . . . 17034 1 7 Sandipta Acharya . . . 17034 1 8 Adina Bujold . . . 17034 1 9 Constance Sobsey . A. . 17034 1 10 David Wishart . S. . 17034 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID fibril 17034 1 oligomer 17034 1 prion 17034 1 protein 17034 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17034 _Assembly.ID 1 _Assembly.Name shPrP(90-232) _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 18710.7 _Assembly.Enzyme_commission_number . _Assembly.Details 'syrian hamster prion protein' _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . 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 shPrP(90-232) 1 $shPrP A . yes native no no . . . 17034 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 109 109 SG . 1 . 1 CYS 144 144 SG . . . . . . . . . . 17034 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID unknown 17034 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_shPrP _Entity.Sf_category entity _Entity.Sf_framecode shPrP _Entity.Entry_ID 17034 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name shPrP _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 ; MGSSHHHHHHSSGLVPRGSG QGGGTHNQWNKPSKPKTNMK HMAGAAAAGAVVGGLGGYML GSAMSRPMMHFGNDWEDRYY RENMNRYPNQVYYRPVDQYN NQNNFVHDCVNITIKQHTVT TTTKGENFTETDIKIMERVV EQMCTTQYQKESQAYYDGRR SS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq '71 MET ... 232 SER' _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 162 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'Syrian hamster prion protein' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18710.7 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details ; Intact 6x-His tag and thrombin cleavage site MGSSHHHHHHSSGLVPRGSHMLE ; _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 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 17834 . shPrP . . . . . 64.20 104 100.00 100.00 1.05e-71 . . . . 17034 1 2 no BMRB 4307 . "recombinant Syrian hamster prion protein" . . . . . 87.65 142 100.00 100.00 5.69e-102 . . . . 17034 1 3 no PDB 1B10 . "Solution Nmr Structure Of Recombinant Syrian Hamster Prion Protein Rprp(90-231) , 25 Structures" . . . . . 87.65 142 100.00 100.00 5.69e-102 . . . . 17034 1 4 no PDB 2LH8 . "Syrian Hamster Prion Protein With Thiamine" . . . . . 64.20 104 100.00 100.00 1.05e-71 . . . . 17034 1 5 no PDB 4YXL . "Crystal Structure Of Syrian Hamster Prion Protein Complexed With Pom1 Fab" . . . . . 102.47 166 97.59 97.59 1.48e-115 . . . . 17034 1 6 no GB AAA37090 . "scrapie prion, partial [Mesocricetus auratus]" . . . . . 89.51 243 99.31 99.31 7.39e-101 . . . . 17034 1 7 no GB AAA37091 . "PrP 33-35-C protein precursor, partial [Mesocricetus auratus]" . . . . . 89.51 254 99.31 99.31 6.32e-101 . . . . 17034 1 8 no GB AAA37092 . "prion protein [Mesocricetus auratus]" . . . . . 89.51 240 99.31 99.31 6.61e-101 . . . . 17034 1 9 no GB AAA37093 . "PrP 27-30 protein, partial [Mesocricetus auratus]" . . . . . 88.27 145 100.00 100.00 7.39e-103 . . . . 17034 1 10 no GB AAB25731 . "PrPSc=scrapie prion protein [hamsters, Syrian golden, brain, Peptide, 254 aa]" . . . . . 89.51 254 99.31 99.31 6.32e-101 . . . . 17034 1 11 no REF XP_005068717 . "PREDICTED: major prion protein [Mesocricetus auratus]" . . . . . 89.51 254 99.31 99.31 6.32e-101 . . . . 17034 1 12 no REF XP_012967855 . "PREDICTED: major prion protein [Mesocricetus auratus]" . . . . . 89.51 254 99.31 99.31 6.32e-101 . . . . 17034 1 13 no SP P04273 . "RecName: Full=Major prion protein; Short=PrP; AltName: Full=PrP27-30; AltName: Full=PrP33-35C; AltName: CD_antigen=CD230; Flags" . . . . . 89.51 254 99.31 99.31 6.32e-101 . . . . 17034 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID unknown 17034 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 -19 MET . 17034 1 2 -18 GLY . 17034 1 3 -17 SER . 17034 1 4 -16 SER . 17034 1 5 -15 HIS . 17034 1 6 -14 HIS . 17034 1 7 -13 HIS . 17034 1 8 -12 HIS . 17034 1 9 -11 HIS . 17034 1 10 -10 HIS . 17034 1 11 -9 SER . 17034 1 12 -8 SER . 17034 1 13 -7 GLY . 17034 1 14 -6 LEU . 17034 1 15 -5 VAL . 17034 1 16 -4 PRO . 17034 1 17 -3 ARG . 17034 1 18 -2 GLY . 17034 1 19 -1 SER . 17034 1 20 0 GLY . 17034 1 21 1 GLN . 17034 1 22 2 GLY . 17034 1 23 3 GLY . 17034 1 24 4 GLY . 17034 1 25 5 THR . 17034 1 26 6 HIS . 17034 1 27 7 ASN . 17034 1 28 8 GLN . 17034 1 29 9 TRP . 17034 1 30 10 ASN . 17034 1 31 11 LYS . 17034 1 32 12 PRO . 17034 1 33 13 SER . 17034 1 34 14 LYS . 17034 1 35 15 PRO . 17034 1 36 16 LYS . 17034 1 37 17 THR . 17034 1 38 18 ASN . 17034 1 39 19 MET . 17034 1 40 20 LYS . 17034 1 41 21 HIS . 17034 1 42 22 MET . 17034 1 43 23 ALA . 17034 1 44 24 GLY . 17034 1 45 25 ALA . 17034 1 46 26 ALA . 17034 1 47 27 ALA . 17034 1 48 28 ALA . 17034 1 49 29 GLY . 17034 1 50 30 ALA . 17034 1 51 31 VAL . 17034 1 52 32 VAL . 17034 1 53 33 GLY . 17034 1 54 34 GLY . 17034 1 55 35 LEU . 17034 1 56 36 GLY . 17034 1 57 37 GLY . 17034 1 58 38 TYR . 17034 1 59 39 MET . 17034 1 60 40 LEU . 17034 1 61 41 GLY . 17034 1 62 42 SER . 17034 1 63 43 ALA . 17034 1 64 44 MET . 17034 1 65 45 SER . 17034 1 66 46 ARG . 17034 1 67 47 PRO . 17034 1 68 48 MET . 17034 1 69 49 MET . 17034 1 70 50 HIS . 17034 1 71 51 PHE . 17034 1 72 52 GLY . 17034 1 73 53 ASN . 17034 1 74 54 ASP . 17034 1 75 55 TRP . 17034 1 76 56 GLU . 17034 1 77 57 ASP . 17034 1 78 58 ARG . 17034 1 79 59 TYR . 17034 1 80 60 TYR . 17034 1 81 61 ARG . 17034 1 82 62 GLU . 17034 1 83 63 ASN . 17034 1 84 64 MET . 17034 1 85 65 ASN . 17034 1 86 66 ARG . 17034 1 87 67 TYR . 17034 1 88 68 PRO . 17034 1 89 69 ASN . 17034 1 90 70 GLN . 17034 1 91 71 VAL . 17034 1 92 72 TYR . 17034 1 93 73 TYR . 17034 1 94 74 ARG . 17034 1 95 75 PRO . 17034 1 96 76 VAL . 17034 1 97 77 ASP . 17034 1 98 78 GLN . 17034 1 99 79 TYR . 17034 1 100 80 ASN . 17034 1 101 81 ASN . 17034 1 102 82 GLN . 17034 1 103 83 ASN . 17034 1 104 84 ASN . 17034 1 105 85 PHE . 17034 1 106 86 VAL . 17034 1 107 87 HIS . 17034 1 108 88 ASP . 17034 1 109 89 CYS . 17034 1 110 90 VAL . 17034 1 111 91 ASN . 17034 1 112 92 ILE . 17034 1 113 93 THR . 17034 1 114 94 ILE . 17034 1 115 95 LYS . 17034 1 116 96 GLN . 17034 1 117 97 HIS . 17034 1 118 98 THR . 17034 1 119 99 VAL . 17034 1 120 100 THR . 17034 1 121 101 THR . 17034 1 122 102 THR . 17034 1 123 103 THR . 17034 1 124 104 LYS . 17034 1 125 105 GLY . 17034 1 126 106 GLU . 17034 1 127 107 ASN . 17034 1 128 108 PHE . 17034 1 129 109 THR . 17034 1 130 110 GLU . 17034 1 131 111 THR . 17034 1 132 112 ASP . 17034 1 133 113 ILE . 17034 1 134 114 LYS . 17034 1 135 115 ILE . 17034 1 136 116 MET . 17034 1 137 117 GLU . 17034 1 138 118 ARG . 17034 1 139 119 VAL . 17034 1 140 120 VAL . 17034 1 141 121 GLU . 17034 1 142 122 GLN . 17034 1 143 123 MET . 17034 1 144 124 CYS . 17034 1 145 125 THR . 17034 1 146 126 THR . 17034 1 147 127 GLN . 17034 1 148 128 TYR . 17034 1 149 129 GLN . 17034 1 150 130 LYS . 17034 1 151 131 GLU . 17034 1 152 132 SER . 17034 1 153 133 GLN . 17034 1 154 134 ALA . 17034 1 155 135 TYR . 17034 1 156 136 TYR . 17034 1 157 137 ASP . 17034 1 158 138 GLY . 17034 1 159 139 ARG . 17034 1 160 140 ARG . 17034 1 161 141 SER . 17034 1 162 142 SER . 17034 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 17034 1 . GLY 2 2 17034 1 . SER 3 3 17034 1 . SER 4 4 17034 1 . HIS 5 5 17034 1 . HIS 6 6 17034 1 . HIS 7 7 17034 1 . HIS 8 8 17034 1 . HIS 9 9 17034 1 . HIS 10 10 17034 1 . SER 11 11 17034 1 . SER 12 12 17034 1 . GLY 13 13 17034 1 . LEU 14 14 17034 1 . VAL 15 15 17034 1 . PRO 16 16 17034 1 . ARG 17 17 17034 1 . GLY 18 18 17034 1 . SER 19 19 17034 1 . GLY 20 20 17034 1 . GLN 21 21 17034 1 . GLY 22 22 17034 1 . GLY 23 23 17034 1 . GLY 24 24 17034 1 . THR 25 25 17034 1 . HIS 26 26 17034 1 . ASN 27 27 17034 1 . GLN 28 28 17034 1 . TRP 29 29 17034 1 . ASN 30 30 17034 1 . LYS 31 31 17034 1 . PRO 32 32 17034 1 . SER 33 33 17034 1 . LYS 34 34 17034 1 . PRO 35 35 17034 1 . LYS 36 36 17034 1 . THR 37 37 17034 1 . ASN 38 38 17034 1 . MET 39 39 17034 1 . LYS 40 40 17034 1 . HIS 41 41 17034 1 . MET 42 42 17034 1 . ALA 43 43 17034 1 . GLY 44 44 17034 1 . ALA 45 45 17034 1 . ALA 46 46 17034 1 . ALA 47 47 17034 1 . ALA 48 48 17034 1 . GLY 49 49 17034 1 . ALA 50 50 17034 1 . VAL 51 51 17034 1 . VAL 52 52 17034 1 . GLY 53 53 17034 1 . GLY 54 54 17034 1 . LEU 55 55 17034 1 . GLY 56 56 17034 1 . GLY 57 57 17034 1 . TYR 58 58 17034 1 . MET 59 59 17034 1 . LEU 60 60 17034 1 . GLY 61 61 17034 1 . SER 62 62 17034 1 . ALA 63 63 17034 1 . MET 64 64 17034 1 . SER 65 65 17034 1 . ARG 66 66 17034 1 . PRO 67 67 17034 1 . MET 68 68 17034 1 . MET 69 69 17034 1 . HIS 70 70 17034 1 . PHE 71 71 17034 1 . GLY 72 72 17034 1 . ASN 73 73 17034 1 . ASP 74 74 17034 1 . TRP 75 75 17034 1 . GLU 76 76 17034 1 . ASP 77 77 17034 1 . ARG 78 78 17034 1 . TYR 79 79 17034 1 . TYR 80 80 17034 1 . ARG 81 81 17034 1 . GLU 82 82 17034 1 . ASN 83 83 17034 1 . MET 84 84 17034 1 . ASN 85 85 17034 1 . ARG 86 86 17034 1 . TYR 87 87 17034 1 . PRO 88 88 17034 1 . ASN 89 89 17034 1 . GLN 90 90 17034 1 . VAL 91 91 17034 1 . TYR 92 92 17034 1 . TYR 93 93 17034 1 . ARG 94 94 17034 1 . PRO 95 95 17034 1 . VAL 96 96 17034 1 . ASP 97 97 17034 1 . GLN 98 98 17034 1 . TYR 99 99 17034 1 . ASN 100 100 17034 1 . ASN 101 101 17034 1 . GLN 102 102 17034 1 . ASN 103 103 17034 1 . ASN 104 104 17034 1 . PHE 105 105 17034 1 . VAL 106 106 17034 1 . HIS 107 107 17034 1 . ASP 108 108 17034 1 . CYS 109 109 17034 1 . VAL 110 110 17034 1 . ASN 111 111 17034 1 . ILE 112 112 17034 1 . THR 113 113 17034 1 . ILE 114 114 17034 1 . LYS 115 115 17034 1 . GLN 116 116 17034 1 . HIS 117 117 17034 1 . THR 118 118 17034 1 . VAL 119 119 17034 1 . THR 120 120 17034 1 . THR 121 121 17034 1 . THR 122 122 17034 1 . THR 123 123 17034 1 . LYS 124 124 17034 1 . GLY 125 125 17034 1 . GLU 126 126 17034 1 . ASN 127 127 17034 1 . PHE 128 128 17034 1 . THR 129 129 17034 1 . GLU 130 130 17034 1 . THR 131 131 17034 1 . ASP 132 132 17034 1 . ILE 133 133 17034 1 . LYS 134 134 17034 1 . ILE 135 135 17034 1 . MET 136 136 17034 1 . GLU 137 137 17034 1 . ARG 138 138 17034 1 . VAL 139 139 17034 1 . VAL 140 140 17034 1 . GLU 141 141 17034 1 . GLN 142 142 17034 1 . MET 143 143 17034 1 . CYS 144 144 17034 1 . THR 145 145 17034 1 . THR 146 146 17034 1 . GLN 147 147 17034 1 . TYR 148 148 17034 1 . GLN 149 149 17034 1 . LYS 150 150 17034 1 . GLU 151 151 17034 1 . SER 152 152 17034 1 . GLN 153 153 17034 1 . ALA 154 154 17034 1 . TYR 155 155 17034 1 . TYR 156 156 17034 1 . ASP 157 157 17034 1 . GLY 158 158 17034 1 . ARG 159 159 17034 1 . ARG 160 160 17034 1 . SER 161 161 17034 1 . SER 162 162 17034 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 17034 _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 $shPrP . 10036 organism . 'Mesocricetus auratus' 'Golden hamster' . . Eukaryota Metazoa Mesocricetus auratus . . . . . . . . . . . . . . . . . . . . . 17034 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 17034 _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 $shPrP . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pET15b . . . . . . 17034 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17034 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'pH 5.2' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _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 shPrP '[U-100% 15N]' . . 1 $shPrP . . . 0.5 1.0 mM . . . . 17034 1 2 'sodium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 17034 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17034 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17034 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 17034 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'pH 3.5' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _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 shPrP '[U-100% 15N]' . . 1 $shPrP . . . 0.5 1.0 mM . . . . 17034 2 2 'sodium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 17034 2 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17034 2 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17034 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 17034 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'pH 3.2' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _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 shPrP '[U-100% 15N]' . . 1 $shPrP . . . 0.5 1.0 mM . . . . 17034 3 2 'sodium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 17034 3 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17034 3 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17034 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 17034 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'pH 3.0' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _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 shPrP '[U-100% 15N]' . . 1 $shPrP . . . 0.5 1.0 mM . . . . 17034 4 2 'Formic Acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 17034 4 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17034 4 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17034 4 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17034 _Sample_condition_list.ID 1 _Sample_condition_list.Details 'Buffer: Sodium Acetate' 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 'ionic strength' 0.02 . M 17034 1 pH 5.2 0.2 pH 17034 1 pressure 1 . atm 17034 1 temperature 303 0.1 K 17034 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 17034 _Sample_condition_list.ID 2 _Sample_condition_list.Details 'Buffer: Sodium Acetate' 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 'ionic strength' 0.02 . M 17034 2 pH 3.5 0.2 pH 17034 2 pressure 1 . atm 17034 2 temperature 303 0.1 K 17034 2 stop_ save_ save_sample_conditions_3 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_3 _Sample_condition_list.Entry_ID 17034 _Sample_condition_list.ID 3 _Sample_condition_list.Details 'Buffer: Sodium Acetate' 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 'ionic strength' 0.02 . M 17034 3 pH 3.2 0.2 pH 17034 3 pressure 1 . atm 17034 3 temperature 303 0.1 K 17034 3 stop_ save_ save_sample_conditions_4 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_4 _Sample_condition_list.Entry_ID 17034 _Sample_condition_list.ID 4 _Sample_condition_list.Details 'Buffer: Formic Acetate' 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 'ionic strength' 0.02 . M 17034 4 pH 3.0 0.2 pH 17034 4 pressure 1 . atm 17034 4 temperature 303 0.1 K 17034 4 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 17034 _Software.ID 1 _Software.Name NMRView _Software.Version 'NMRViewJ v. 8.0.a21' _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 17034 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17034 1 'peak picking' 17034 1 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 17034 _Software.ID 2 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17034 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17034 2 stop_ save_ save_VNMRJ _Software.Sf_category software _Software.Sf_framecode VNMRJ _Software.Entry_ID 17034 _Software.ID 3 _Software.Name VNMRJ _Software.Version 2.1b _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 17034 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17034 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17034 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17034 _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 spectrometer_1 Varian INOVA . 500 . . . 17034 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 17034 _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 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 2 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 3 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 4 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 5 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 6 '3D HNHA' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 7 '3D 1H-15N TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 9 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 3 $sample_conditions_3 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 10 '3D HNHA' no . . . . . . . . . . 3 $sample_3 isotropic . . 3 $sample_conditions_3 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 11 '3D 1H-15N TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 3 $sample_conditions_3 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 12 '3D 1H-15N NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 3 $sample_conditions_3 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 13 '2D 1H-15N HSQC' no . . . . . . . . . . 4 $sample_4 isotropic . . 4 $sample_conditions_4 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 14 '3D HNHA' no . . . . . . . . . . 4 $sample_4 isotropic . . 4 $sample_conditions_4 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 15 '3D 1H-15N TOCSY' no . . . . . . . . . . 4 $sample_4 isotropic . . 4 $sample_conditions_4 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 16 '3D 1H-15N NOESY' no . . . . . . . . . . 4 $sample_4 isotropic . . 4 $sample_conditions_4 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17034 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17034 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1.0 'separate tube (no insert) similar to the experimental sample tube' . . . . . . . . 17034 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.101340679 'separate tube (no insert) similar to the experimental sample tube' . . . . . . . . 17034 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17034 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 '2D 1H-15N HSQC' . . . 17034 1 2 '3D HNHA' . . . 17034 1 3 '3D 1H-15N TOCSY' . . . 17034 1 4 '3D 1H-15N NOESY' . . . 17034 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $NMRView . . 17034 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 21 21 GLN HA H 1 4.35 0.02 . 1 . . . . 1 GLN HA . 17034 1 2 . 1 1 21 21 GLN N N 15 119.6 0.2 . 1 . . . . 1 GLN N . 17034 1 3 . 1 1 22 22 GLY H H 1 8.59 0.02 . 1 . . . . 2 GLY HN . 17034 1 4 . 1 1 22 22 GLY N N 15 110.9 0.2 . 1 . . . . 2 GLY N . 17034 1 5 . 1 1 23 23 GLY H H 1 8.35 0.02 . 1 . . . . 3 GLY HN . 17034 1 6 . 1 1 23 23 GLY N N 15 108.4 0.2 . 1 . . . . 3 GLY N . 17034 1 7 . 1 1 24 24 GLY H H 1 8.3 0.02 . 1 . . . . 4 GLY HN . 17034 1 8 . 1 1 24 24 GLY HA2 H 1 4.01 0.02 . 2 . . . . 4 GLY HA2 . 17034 1 9 . 1 1 24 24 GLY N N 15 108.7 0.2 . 1 . . . . 4 GLY N . 17034 1 10 . 1 1 25 25 THR H H 1 8.064 0.02 . 1 . . . . 5 THR HN . 17034 1 11 . 1 1 25 25 THR HA H 1 4.28 0.02 . 1 . . . . 5 THR HA . 17034 1 12 . 1 1 25 25 THR N N 15 113.164 0.2 . 1 . . . . 5 THR N . 17034 1 13 . 1 1 26 26 HIS H H 1 8.53 0.02 . 1 . . . . 6 HIS HN . 17034 1 14 . 1 1 26 26 HIS N N 15 120.6 0.2 . 1 . . . . 6 HIS N . 17034 1 15 . 1 1 27 27 ASN H H 1 8.419 0.02 . 1 . . . . 7 ASN HN . 17034 1 16 . 1 1 27 27 ASN N N 15 119.928 0.2 . 1 . . . . 7 ASN N . 17034 1 17 . 1 1 28 28 GLN H H 1 8.334 0.02 . 1 . . . . 8 GLN HN . 17034 1 18 . 1 1 28 28 GLN HA H 1 4.21 0.02 . 1 . . . . 8 GLN HA . 17034 1 19 . 1 1 28 28 GLN N N 15 120.415 0.2 . 1 . . . . 8 GLN N . 17034 1 20 . 1 1 29 29 TRP H H 1 8.07 0.02 . 1 . . . . 9 TRP HN . 17034 1 21 . 1 1 29 29 TRP HA H 1 4.68 0.02 . 1 . . . . 9 TRP HA . 17034 1 22 . 1 1 29 29 TRP N N 15 121.347 0.2 . 1 . . . . 9 TRP N . 17034 1 23 . 1 1 30 30 ASN H H 1 8.083 0.02 . 1 . . . . 10 ASN HN . 17034 1 24 . 1 1 30 30 ASN HA H 1 4.63 0.02 . 1 . . . . 10 ASN HA . 17034 1 25 . 1 1 30 30 ASN N N 15 120.217 0.2 . 1 . . . . 10 ASN N . 17034 1 26 . 1 1 31 31 LYS H H 1 7.977 0.02 . 1 . . . . 11 LYS HN . 17034 1 27 . 1 1 31 31 LYS HA H 1 4.48 0.02 . 1 . . . . 11 LYS HA . 17034 1 28 . 1 1 31 31 LYS N N 15 122.552 0.2 . 1 . . . . 11 LYS N . 17034 1 29 . 1 1 33 33 SER H H 1 8.386 0.02 . 1 . . . . 13 SER HN . 17034 1 30 . 1 1 33 33 SER HA H 1 4.41 0.02 . 1 . . . . 13 SER HA . 17034 1 31 . 1 1 33 33 SER N N 15 116.779 0.2 . 1 . . . . 13 SER N . 17034 1 32 . 1 1 34 34 LYS H H 1 8.284 0.02 . 1 . . . . 14 LYS HN . 17034 1 33 . 1 1 34 34 LYS HA H 1 4.62 0.02 . 1 . . . . 14 LYS HA . 17034 1 34 . 1 1 34 34 LYS N N 15 124.083 0.2 . 1 . . . . 14 LYS N . 17034 1 35 . 1 1 36 36 LYS H H 1 8.438 0.02 . 1 . . . . 16 LYS HN . 17034 1 36 . 1 1 36 36 LYS HA H 1 4.3 0.02 . 1 . . . . 16 LYS HA . 17034 1 37 . 1 1 36 36 LYS N N 15 121.932 0.2 . 1 . . . . 16 LYS N . 17034 1 38 . 1 1 37 37 THR H H 1 8.1 0.02 . 1 . . . . 17 THR HN . 17034 1 39 . 1 1 37 37 THR HA H 1 4.34 0.02 . 1 . . . . 17 THR HA . 17034 1 40 . 1 1 37 37 THR N N 15 115.139 0.2 . 1 . . . . 17 THR N . 17034 1 41 . 1 1 38 38 ASN H H 1 8.508 0.02 . 1 . . . . 18 ASN HN . 17034 1 42 . 1 1 38 38 ASN HA H 1 4.72 0.02 . 1 . . . . 18 ASN HA . 17034 1 43 . 1 1 38 38 ASN N N 15 121.269 0.2 . 1 . . . . 18 ASN N . 17034 1 44 . 1 1 39 39 MET H H 1 8.304 0.02 . 1 . . . . 19 MET HN . 17034 1 45 . 1 1 39 39 MET HA H 1 4.43 0.02 . 1 . . . . 19 MET HA . 17034 1 46 . 1 1 39 39 MET N N 15 121.251 0.2 . 1 . . . . 19 MET N . 17034 1 47 . 1 1 40 40 LYS H H 1 8.272 0.02 . 1 . . . . 20 LYS HN . 17034 1 48 . 1 1 40 40 LYS HA H 1 4.23 0.02 . 1 . . . . 20 LYS HA . 17034 1 49 . 1 1 40 40 LYS N N 15 122.166 0.2 . 1 . . . . 20 LYS N . 17034 1 50 . 1 1 41 41 HIS H H 1 8.45 0.02 . 1 . . . . 21 HIS HN . 17034 1 51 . 1 1 41 41 HIS N N 15 119.3 0.2 . 1 . . . . 21 HIS N . 17034 1 52 . 1 1 42 42 MET H H 1 8.338 0.02 . 1 . . . . 22 MET HN . 17034 1 53 . 1 1 42 42 MET N N 15 122.489 0.2 . 1 . . . . 22 MET N . 17034 1 54 . 1 1 43 43 ALA H H 1 8.368 0.02 . 1 . . . . 23 ALA HN . 17034 1 55 . 1 1 43 43 ALA HA H 1 4.32 0.02 . 1 . . . . 23 ALA HA . 17034 1 56 . 1 1 43 43 ALA N N 15 125.658 0.2 . 1 . . . . 23 ALA N . 17034 1 57 . 1 1 44 44 GLY H H 1 8.348 0.02 . 1 . . . . 24 GLY HN . 17034 1 58 . 1 1 44 44 GLY HA2 H 1 3.96 0.02 . 2 . . . . 24 GLY HA2 . 17034 1 59 . 1 1 44 44 GLY N N 15 108.45 0.2 . 1 . . . . 24 GLY N . 17034 1 60 . 1 1 45 45 ALA H H 1 8.116 0.02 . 1 . . . . 25 ALA HN . 17034 1 61 . 1 1 45 45 ALA HA H 1 4.31 0.02 . 1 . . . . 25 ALA HA . 17034 1 62 . 1 1 45 45 ALA N N 15 123.834 0.2 . 1 . . . . 25 ALA N . 17034 1 63 . 1 1 46 46 ALA H H 1 8.168 0.02 . 1 . . . . 26 ALA HN . 17034 1 64 . 1 1 46 46 ALA HA H 1 4.31 0.02 . 1 . . . . 26 ALA HA . 17034 1 65 . 1 1 46 46 ALA N N 15 123.204 0.2 . 1 . . . . 26 ALA N . 17034 1 66 . 1 1 47 47 ALA H H 1 8.15 0.02 . 1 . . . . 27 ALA HN . 17034 1 67 . 1 1 47 47 ALA HA H 1 4.29 0.02 . 1 . . . . 27 ALA HA . 17034 1 68 . 1 1 47 47 ALA N N 15 123.1 0.2 . 1 . . . . 27 ALA N . 17034 1 69 . 1 1 48 48 ALA H H 1 8.254 0.02 . 1 . . . . 28 ALA HN . 17034 1 70 . 1 1 48 48 ALA HA H 1 4.33 0.02 . 1 . . . . 28 ALA HA . 17034 1 71 . 1 1 48 48 ALA N N 15 123.055 0.2 . 1 . . . . 28 ALA N . 17034 1 72 . 1 1 49 49 GLY H H 1 8.235 0.02 . 1 . . . . 29 GLY HN . 17034 1 73 . 1 1 49 49 GLY HA2 H 1 3.95 0.02 . 2 . . . . 29 GLY HA2 . 17034 1 74 . 1 1 49 49 GLY N N 15 107.839 0.2 . 1 . . . . 29 GLY N . 17034 1 75 . 1 1 50 50 ALA H H 1 8.042 0.02 . 1 . . . . 30 ALA HN . 17034 1 76 . 1 1 50 50 ALA HA H 1 4.367 0.02 . 1 . . . . 30 ALA HA . 17034 1 77 . 1 1 50 50 ALA N N 15 123.518 0.2 . 1 . . . . 30 ALA N . 17034 1 78 . 1 1 51 51 VAL H H 1 8.086 0.02 . 1 . . . . 31 VAL HN . 17034 1 79 . 1 1 51 51 VAL HA H 1 4.15 0.02 . 1 . . . . 31 VAL HA . 17034 1 80 . 1 1 51 51 VAL N N 15 119.514 0.2 . 1 . . . . 31 VAL N . 17034 1 81 . 1 1 52 52 VAL H H 1 8.219 0.02 . 1 . . . . 32 VAL HN . 17034 1 82 . 1 1 52 52 VAL HA H 1 4.11 0.02 . 1 . . . . 32 VAL HA . 17034 1 83 . 1 1 52 52 VAL N N 15 124.443 0.2 . 1 . . . . 32 VAL N . 17034 1 84 . 1 1 53 53 GLY H H 1 8.517 0.02 . 1 . . . . 33 GLY HN . 17034 1 85 . 1 1 53 53 GLY HA2 H 1 3.96 0.02 . 2 . . . . 33 GLY HA2 . 17034 1 86 . 1 1 53 53 GLY N N 15 113.191 0.2 . 1 . . . . 33 GLY N . 17034 1 87 . 1 1 54 54 GLY H H 1 8.231 0.02 . 1 . . . . 34 GLY HN . 17034 1 88 . 1 1 54 54 GLY HA2 H 1 3.95 0.02 . 2 . . . . 34 GLY HA2 . 17034 1 89 . 1 1 54 54 GLY N N 15 108.419 0.2 . 1 . . . . 34 GLY N . 17034 1 90 . 1 1 55 55 LEU H H 1 8.178 0.02 . 1 . . . . 35 LEU HN . 17034 1 91 . 1 1 55 55 LEU HA H 1 4.39 0.02 . 1 . . . . 35 LEU HA . 17034 1 92 . 1 1 55 55 LEU N N 15 121.742 0.2 . 1 . . . . 35 LEU N . 17034 1 93 . 1 1 56 56 GLY H H 1 8.491 0.02 . 1 . . . . 36 GLY HN . 17034 1 94 . 1 1 56 56 GLY HA2 H 1 3.98 0.02 . 2 . . . . 36 GLY HA2 . 17034 1 95 . 1 1 56 56 GLY N N 15 109.792 0.2 . 1 . . . . 36 GLY N . 17034 1 96 . 1 1 57 57 GLY H H 1 8.303 0.02 . 1 . . . . 37 GLY HN . 17034 1 97 . 1 1 57 57 GLY N N 15 108.758 0.2 . 1 . . . . 37 GLY N . 17034 1 98 . 1 1 58 58 TYR H H 1 7.776 0.02 . 1 . . . . 38 TYR HN . 17034 1 99 . 1 1 58 58 TYR HA H 1 4.44 0.02 . 1 . . . . 38 TYR HA . 17034 1 100 . 1 1 58 58 TYR N N 15 117.991 0.2 . 1 . . . . 38 TYR N . 17034 1 101 . 1 1 59 59 MET H H 1 9.046 0.02 . 1 . . . . 39 MET HN . 17034 1 102 . 1 1 59 59 MET HA H 1 4.49 0.02 . 1 . . . . 39 MET HA . 17034 1 103 . 1 1 59 59 MET N N 15 121.348 0.2 . 1 . . . . 39 MET N . 17034 1 104 . 1 1 60 60 LEU H H 1 8.03 0.02 . 1 . . . . 40 LEU HN . 17034 1 105 . 1 1 60 60 LEU N N 15 121.3 0.2 . 1 . . . . 40 LEU N . 17034 1 106 . 1 1 61 61 GLY H H 1 9.23 0.02 . 1 . . . . 41 GLY HN . 17034 1 107 . 1 1 61 61 GLY HA2 H 1 3.97 0.02 . 2 . . . . 41 GLY HA2 . 17034 1 108 . 1 1 61 61 GLY N N 15 114.3 0.2 . 1 . . . . 41 GLY N . 17034 1 109 . 1 1 62 62 SER H H 1 8.268 0.02 . 1 . . . . 42 SER HN . 17034 1 110 . 1 1 62 62 SER HA H 1 4.4 0.02 . 1 . . . . 42 SER HA . 17034 1 111 . 1 1 62 62 SER N N 15 113.856 0.2 . 1 . . . . 42 SER N . 17034 1 112 . 1 1 63 63 ALA H H 1 8.665 0.02 . 1 . . . . 43 ALA HN . 17034 1 113 . 1 1 63 63 ALA N N 15 125.68 0.2 . 1 . . . . 43 ALA N . 17034 1 114 . 1 1 64 64 MET H H 1 8.696 0.02 . 1 . . . . 44 MET HN . 17034 1 115 . 1 1 64 64 MET HA H 1 4.71 0.02 . 1 . . . . 44 MET HA . 17034 1 116 . 1 1 64 64 MET N N 15 121.229 0.2 . 1 . . . . 44 MET N . 17034 1 117 . 1 1 65 65 SER H H 1 8.351 0.02 . 1 . . . . 45 SER HN . 17034 1 118 . 1 1 65 65 SER HA H 1 4.33 0.02 . 1 . . . . 45 SER HA . 17034 1 119 . 1 1 65 65 SER N N 15 116.24 0.2 . 1 . . . . 45 SER N . 17034 1 120 . 1 1 66 66 ARG H H 1 8.595 0.02 . 1 . . . . 46 ARG HN . 17034 1 121 . 1 1 66 66 ARG HA H 1 4.4 0.02 . 1 . . . . 46 ARG HA . 17034 1 122 . 1 1 66 66 ARG N N 15 126.003 0.2 . 1 . . . . 46 ARG N . 17034 1 123 . 1 1 68 68 MET H H 1 8.659 0.02 . 1 . . . . 48 MET HN . 17034 1 124 . 1 1 68 68 MET HA H 1 4.72 0.02 . 1 . . . . 48 MET HA . 17034 1 125 . 1 1 68 68 MET N N 15 122.544 0.2 . 1 . . . . 48 MET N . 17034 1 126 . 1 1 69 69 MET H H 1 7.399 0.02 . 1 . . . . 49 MET HN . 17034 1 127 . 1 1 69 69 MET HA H 1 4.37 0.02 . 1 . . . . 49 MET HA . 17034 1 128 . 1 1 69 69 MET N N 15 121.945 0.2 . 1 . . . . 49 MET N . 17034 1 129 . 1 1 70 70 HIS H H 1 8.164 0.02 . 1 . . . . 50 HIS HN . 17034 1 130 . 1 1 70 70 HIS HA H 1 4.89 0.02 . 1 . . . . 50 HIS HA . 17034 1 131 . 1 1 70 70 HIS N N 15 118.704 0.2 . 1 . . . . 50 HIS N . 17034 1 132 . 1 1 71 71 PHE H H 1 10.292 0.02 . 1 . . . . 51 PHE HN . 17034 1 133 . 1 1 71 71 PHE HA H 1 4.34 0.02 . 1 . . . . 51 PHE HA . 17034 1 134 . 1 1 71 71 PHE N N 15 124.143 0.2 . 1 . . . . 51 PHE N . 17034 1 135 . 1 1 72 72 GLY H H 1 9.003 0.02 . 1 . . . . 52 GLY HN . 17034 1 136 . 1 1 72 72 GLY HA2 H 1 4.12 0.02 . 2 . . . . 52 GLY HA2 . 17034 1 137 . 1 1 72 72 GLY N N 15 109.144 0.2 . 1 . . . . 52 GLY N . 17034 1 138 . 1 1 73 73 ASN H H 1 7.242 0.02 . 1 . . . . 53 ASN HN . 17034 1 139 . 1 1 73 73 ASN HA H 1 4.88 0.02 . 1 . . . . 53 ASN HA . 17034 1 140 . 1 1 73 73 ASN N N 15 114.607 0.2 . 1 . . . . 53 ASN N . 17034 1 141 . 1 1 74 74 ASP H H 1 8.98 0.02 . 1 . . . . 54 ASP HN . 17034 1 142 . 1 1 74 74 ASP N N 15 123.388 0.2 . 1 . . . . 54 ASP N . 17034 1 143 . 1 1 75 75 TRP H H 1 8.433 0.02 . 1 . . . . 55 TRP HN . 17034 1 144 . 1 1 75 75 TRP HA H 1 4.26 0.02 . 1 . . . . 55 TRP HA . 17034 1 145 . 1 1 75 75 TRP N N 15 120.46 0.2 . 1 . . . . 55 TRP N . 17034 1 146 . 1 1 76 76 GLU H H 1 8.064 0.02 . 1 . . . . 56 GLU HN . 17034 1 147 . 1 1 76 76 GLU N N 15 121.012 0.2 . 1 . . . . 56 GLU N . 17034 1 148 . 1 1 77 77 ASP H H 1 7.84 0.02 . 1 . . . . 57 ASP HN . 17034 1 149 . 1 1 77 77 ASP HA H 1 4.59 0.02 . 1 . . . . 57 ASP HA . 17034 1 150 . 1 1 77 77 ASP N N 15 119.3 0.2 . 1 . . . . 57 ASP N . 17034 1 151 . 1 1 78 78 ARG H H 1 7.997 0.02 . 1 . . . . 58 ARG HN . 17034 1 152 . 1 1 78 78 ARG HA H 1 3.97 0.02 . 1 . . . . 58 ARG HA . 17034 1 153 . 1 1 78 78 ARG N N 15 120.147 0.2 . 1 . . . . 58 ARG N . 17034 1 154 . 1 1 79 79 TYR H H 1 8.33 0.02 . 1 . . . . 59 TYR HN . 17034 1 155 . 1 1 79 79 TYR N N 15 121.3 0.2 . 1 . . . . 59 TYR N . 17034 1 156 . 1 1 80 80 TYR H H 1 8.864 0.02 . 1 . . . . 60 TYR HN . 17034 1 157 . 1 1 80 80 TYR N N 15 119.635 0.2 . 1 . . . . 60 TYR N . 17034 1 158 . 1 1 81 81 ARG H H 1 7.719 0.02 . 1 . . . . 61 ARG HN . 17034 1 159 . 1 1 81 81 ARG HA H 1 3.66 0.02 . 1 . . . . 61 ARG HA . 17034 1 160 . 1 1 81 81 ARG N N 15 117.056 0.2 . 1 . . . . 61 ARG N . 17034 1 161 . 1 1 82 82 GLU H H 1 7.88 0.02 . 1 . . . . 62 GLU HN . 17034 1 162 . 1 1 82 82 GLU HA H 1 4.02 0.02 . 1 . . . . 62 GLU HA . 17034 1 163 . 1 1 82 82 GLU N N 15 115.683 0.2 . 1 . . . . 62 GLU N . 17034 1 164 . 1 1 83 83 ASN H H 1 7.478 0.02 . 1 . . . . 63 ASN HN . 17034 1 165 . 1 1 83 83 ASN HA H 1 4.54 0.02 . 1 . . . . 63 ASN HA . 17034 1 166 . 1 1 83 83 ASN N N 15 115.778 0.2 . 1 . . . . 63 ASN N . 17034 1 167 . 1 1 84 84 MET H H 1 7.505 0.02 . 1 . . . . 64 MET HN . 17034 1 168 . 1 1 84 84 MET N N 15 118.282 0.2 . 1 . . . . 64 MET N . 17034 1 169 . 1 1 85 85 ASN H H 1 8.173 0.02 . 1 . . . . 65 ASN HN . 17034 1 170 . 1 1 85 85 ASN HA H 1 4.42 0.02 . 1 . . . . 65 ASN HA . 17034 1 171 . 1 1 85 85 ASN N N 15 115.422 0.2 . 1 . . . . 65 ASN N . 17034 1 172 . 1 1 86 86 ARG H H 1 8.029 0.02 . 1 . . . . 66 ARG HN . 17034 1 173 . 1 1 86 86 ARG HA H 1 4.27 0.02 . 1 . . . . 66 ARG HA . 17034 1 174 . 1 1 86 86 ARG N N 15 117.779 0.2 . 1 . . . . 66 ARG N . 17034 1 175 . 1 1 87 87 TYR H H 1 7.374 0.02 . 1 . . . . 67 TYR HN . 17034 1 176 . 1 1 87 87 TYR HA H 1 5.0 0.02 . 1 . . . . 67 TYR HA . 17034 1 177 . 1 1 87 87 TYR N N 15 120.429 0.2 . 1 . . . . 67 TYR N . 17034 1 178 . 1 1 89 89 ASN H H 1 8.65 0.02 . 1 . . . . 69 ASN HN . 17034 1 179 . 1 1 89 89 ASN HA H 1 4.72 0.02 . 1 . . . . 69 ASN HA . 17034 1 180 . 1 1 89 89 ASN N N 15 116.6 0.2 . 1 . . . . 69 ASN N . 17034 1 181 . 1 1 90 90 GLN H H 1 7.279 0.02 . 1 . . . . 70 GLN HN . 17034 1 182 . 1 1 90 90 GLN HA H 1 4.55 0.02 . 1 . . . . 70 GLN HA . 17034 1 183 . 1 1 90 90 GLN N N 15 114.946 0.2 . 1 . . . . 70 GLN N . 17034 1 184 . 1 1 91 91 VAL H H 1 8.377 0.02 . 1 . . . . 71 VAL HN . 17034 1 185 . 1 1 91 91 VAL HA H 1 4.91 0.02 . 1 . . . . 71 VAL HA . 17034 1 186 . 1 1 91 91 VAL N N 15 112.624 0.2 . 1 . . . . 71 VAL N . 17034 1 187 . 1 1 92 92 TYR H H 1 8.428 0.02 . 1 . . . . 72 TYR HN . 17034 1 188 . 1 1 92 92 TYR HA H 1 5.53 0.02 . 1 . . . . 72 TYR HA . 17034 1 189 . 1 1 92 92 TYR N N 15 121.325 0.2 . 1 . . . . 72 TYR N . 17034 1 190 . 1 1 93 93 TYR H H 1 8.453 0.02 . 1 . . . . 73 TYR HN . 17034 1 191 . 1 1 93 93 TYR HA H 1 4.83 0.02 . 1 . . . . 73 TYR HA . 17034 1 192 . 1 1 93 93 TYR N N 15 111.396 0.2 . 1 . . . . 73 TYR N . 17034 1 193 . 1 1 94 94 ARG H H 1 7.94 0.02 . 1 . . . . 74 ARG HN . 17034 1 194 . 1 1 94 94 ARG HA H 1 4.65 0.02 . 1 . . . . 74 ARG HA . 17034 1 195 . 1 1 94 94 ARG N N 15 120.4 0.2 . 1 . . . . 74 ARG N . 17034 1 196 . 1 1 96 96 VAL H H 1 8.599 0.02 . 1 . . . . 76 VAL HN . 17034 1 197 . 1 1 96 96 VAL N N 15 119.197 0.2 . 1 . . . . 76 VAL N . 17034 1 198 . 1 1 97 97 ASP H H 1 8.2 0.02 . 1 . . . . 77 ASP HN . 17034 1 199 . 1 1 97 97 ASP HA H 1 4.4 0.02 . 1 . . . . 77 ASP HA . 17034 1 200 . 1 1 97 97 ASP N N 15 117.5 0.2 . 1 . . . . 77 ASP N . 17034 1 201 . 1 1 98 98 GLN H H 1 8.19 0.02 . 1 . . . . 78 GLN HN . 17034 1 202 . 1 1 98 98 GLN HA H 1 4.1 0.02 . 1 . . . . 78 GLN HA . 17034 1 203 . 1 1 98 98 GLN N N 15 117.5 0.2 . 1 . . . . 78 GLN N . 17034 1 204 . 1 1 99 99 TYR H H 1 7.812 0.02 . 1 . . . . 79 TYR HN . 17034 1 205 . 1 1 99 99 TYR HA H 1 4.86 0.02 . 1 . . . . 79 TYR HA . 17034 1 206 . 1 1 99 99 TYR N N 15 116.897 0.2 . 1 . . . . 79 TYR N . 17034 1 207 . 1 1 100 100 ASN H H 1 8.978 0.02 . 1 . . . . 80 ASN HN . 17034 1 208 . 1 1 100 100 ASN HA H 1 4.76 0.02 . 1 . . . . 80 ASN HA . 17034 1 209 . 1 1 100 100 ASN N N 15 117.398 0.2 . 1 . . . . 80 ASN N . 17034 1 210 . 1 1 101 101 ASN H H 1 7.574 0.02 . 1 . . . . 81 ASN HN . 17034 1 211 . 1 1 101 101 ASN HA H 1 4.74 0.02 . 1 . . . . 81 ASN HA . 17034 1 212 . 1 1 101 101 ASN N N 15 113.157 0.2 . 1 . . . . 81 ASN N . 17034 1 213 . 1 1 102 102 GLN H H 1 8.634 0.02 . 1 . . . . 82 GLN HN . 17034 1 214 . 1 1 102 102 GLN N N 15 120.995 0.2 . 1 . . . . 82 GLN N . 17034 1 215 . 1 1 103 103 ASN H H 1 8.357 0.02 . 1 . . . . 83 ASN HN . 17034 1 216 . 1 1 103 103 ASN HA H 1 4.29 0.02 . 1 . . . . 83 ASN HA . 17034 1 217 . 1 1 103 103 ASN N N 15 117.45 0.2 . 1 . . . . 83 ASN N . 17034 1 218 . 1 1 104 104 ASN H H 1 8.459 0.02 . 1 . . . . 84 ASN HN . 17034 1 219 . 1 1 104 104 ASN HA H 1 4.55 0.02 . 1 . . . . 84 ASN HA . 17034 1 220 . 1 1 104 104 ASN N N 15 118.219 0.2 . 1 . . . . 84 ASN N . 17034 1 221 . 1 1 105 105 PHE H H 1 7.202 0.02 . 1 . . . . 85 PHE HN . 17034 1 222 . 1 1 105 105 PHE N N 15 121.346 0.2 . 1 . . . . 85 PHE N . 17034 1 223 . 1 1 106 106 VAL H H 1 8.754 0.02 . 1 . . . . 86 VAL HN . 17034 1 224 . 1 1 106 106 VAL N N 15 120.062 0.2 . 1 . . . . 86 VAL N . 17034 1 225 . 1 1 107 107 HIS H H 1 8.42 0.02 . 1 . . . . 87 HIS HN . 17034 1 226 . 1 1 107 107 HIS HA H 1 4.32 0.02 . 1 . . . . 87 HIS HA . 17034 1 227 . 1 1 107 107 HIS N N 15 116.9 0.2 . 1 . . . . 87 HIS N . 17034 1 228 . 1 1 108 108 ASP H H 1 7.61 0.02 . 1 . . . . 88 ASP HN . 17034 1 229 . 1 1 108 108 ASP HA H 1 4.59 0.02 . 1 . . . . 88 ASP HA . 17034 1 230 . 1 1 108 108 ASP N N 15 118.861 0.2 . 1 . . . . 88 ASP N . 17034 1 231 . 1 1 109 109 CYS H H 1 8.103 0.02 . 1 . . . . 89 CYS HN . 17034 1 232 . 1 1 109 109 CYS N N 15 119.152 0.2 . 1 . . . . 89 CYS N . 17034 1 233 . 1 1 110 110 VAL H H 1 9.117 0.02 . 1 . . . . 90 VAL HN . 17034 1 234 . 1 1 110 110 VAL HA H 1 3.61 0.02 . 1 . . . . 90 VAL HA . 17034 1 235 . 1 1 110 110 VAL N N 15 125.198 0.2 . 1 . . . . 90 VAL N . 17034 1 236 . 1 1 111 111 ASN H H 1 7.632 0.02 . 1 . . . . 91 ASN HN . 17034 1 237 . 1 1 111 111 ASN HA H 1 4.33 0.02 . 1 . . . . 91 ASN HA . 17034 1 238 . 1 1 111 111 ASN N N 15 116.641 0.2 . 1 . . . . 91 ASN N . 17034 1 239 . 1 1 112 112 ILE H H 1 8.78 0.02 . 1 . . . . 92 ILE HN . 17034 1 240 . 1 1 112 112 ILE HA H 1 3.72 0.02 . 1 . . . . 92 ILE HA . 17034 1 241 . 1 1 112 112 ILE N N 15 119.022 0.2 . 1 . . . . 92 ILE N . 17034 1 242 . 1 1 113 113 THR H H 1 8.286 0.02 . 1 . . . . 93 THR HN . 17034 1 243 . 1 1 113 113 THR HA H 1 4.1 0.02 . 1 . . . . 93 THR HA . 17034 1 244 . 1 1 113 113 THR N N 15 117.969 0.2 . 1 . . . . 93 THR N . 17034 1 245 . 1 1 114 114 ILE H H 1 8.513 0.02 . 1 . . . . 94 ILE HN . 17034 1 246 . 1 1 114 114 ILE HA H 1 3.68 0.02 . 1 . . . . 94 ILE HA . 17034 1 247 . 1 1 114 114 ILE N N 15 120.722 0.2 . 1 . . . . 94 ILE N . 17034 1 248 . 1 1 115 115 LYS H H 1 8.08 0.02 . 1 . . . . 95 LYS HN . 17034 1 249 . 1 1 115 115 LYS N N 15 122.9 0.2 . 1 . . . . 95 LYS N . 17034 1 250 . 1 1 116 116 GLN H H 1 8.49 0.02 . 1 . . . . 96 GLN HN . 17034 1 251 . 1 1 116 116 GLN HA H 1 4.03 0.02 . 1 . . . . 96 GLN HA . 17034 1 252 . 1 1 116 116 GLN N N 15 116.9 0.2 . 1 . . . . 96 GLN N . 17034 1 253 . 1 1 117 117 HIS H H 1 8.384 0.02 . 1 . . . . 97 HIS HN . 17034 1 254 . 1 1 117 117 HIS N N 15 119.021 0.2 . 1 . . . . 97 HIS N . 17034 1 255 . 1 1 118 118 THR H H 1 8.44 0.02 . 1 . . . . 98 THR HN . 17034 1 256 . 1 1 118 118 THR HA H 1 4.11 0.02 . 1 . . . . 98 THR HA . 17034 1 257 . 1 1 118 118 THR N N 15 113.6 0.2 . 1 . . . . 98 THR N . 17034 1 258 . 1 1 119 119 VAL H H 1 8.02 0.02 . 1 . . . . 99 VAL HN . 17034 1 259 . 1 1 119 119 VAL HA H 1 3.9 0.02 . 1 . . . . 99 VAL HA . 17034 1 260 . 1 1 119 119 VAL N N 15 123.0 0.2 . 1 . . . . 99 VAL N . 17034 1 261 . 1 1 120 120 THR H H 1 8.12 0.02 . 1 . . . . 100 THR HN . 17034 1 262 . 1 1 120 120 THR HA H 1 4.16 0.02 . 1 . . . . 100 THR HA . 17034 1 263 . 1 1 120 120 THR N N 15 115.1 0.2 . 1 . . . . 100 THR N . 17034 1 264 . 1 1 121 121 THR H H 1 7.989 0.02 . 1 . . . . 101 THR HN . 17034 1 265 . 1 1 121 121 THR HA H 1 4.08 0.02 . 1 . . . . 101 THR HA . 17034 1 266 . 1 1 121 121 THR N N 15 114.739 0.2 . 1 . . . . 101 THR N . 17034 1 267 . 1 1 122 122 THR H H 1 8.188 0.02 . 1 . . . . 102 THR HN . 17034 1 268 . 1 1 122 122 THR HA H 1 4.39 0.02 . 1 . . . . 102 THR HA . 17034 1 269 . 1 1 122 122 THR N N 15 117.254 0.2 . 1 . . . . 102 THR N . 17034 1 270 . 1 1 123 123 THR H H 1 7.859 0.02 . 1 . . . . 103 THR HN . 17034 1 271 . 1 1 123 123 THR HA H 1 4.2 0.02 . 1 . . . . 103 THR HA . 17034 1 272 . 1 1 123 123 THR N N 15 116.149 0.2 . 1 . . . . 103 THR N . 17034 1 273 . 1 1 124 124 LYS H H 1 7.563 0.02 . 1 . . . . 104 LYS HN . 17034 1 274 . 1 1 124 124 LYS HA H 1 4.39 0.02 . 1 . . . . 104 LYS HA . 17034 1 275 . 1 1 124 124 LYS N N 15 120.105 0.2 . 1 . . . . 104 LYS N . 17034 1 276 . 1 1 125 125 GLY H H 1 7.94 0.02 . 1 . . . . 105 GLY HN . 17034 1 277 . 1 1 125 125 GLY HA2 H 1 3.79 0.02 . 2 . . . . 105 GLY HA2 . 17034 1 278 . 1 1 125 125 GLY N N 15 108.0 0.2 . 1 . . . . 105 GLY N . 17034 1 279 . 1 1 126 126 GLU H H 1 7.49 0.02 . 1 . . . . 106 GLU HN . 17034 1 280 . 1 1 126 126 GLU HA H 1 4.26 0.02 . 1 . . . . 106 GLU HA . 17034 1 281 . 1 1 126 126 GLU N N 15 120.1 0.2 . 1 . . . . 106 GLU N . 17034 1 282 . 1 1 127 127 ASN H H 1 8.437 0.02 . 1 . . . . 107 ASN HN . 17034 1 283 . 1 1 127 127 ASN HA H 1 4.67 0.02 . 1 . . . . 107 ASN HA . 17034 1 284 . 1 1 127 127 ASN N N 15 119.453 0.2 . 1 . . . . 107 ASN N . 17034 1 285 . 1 1 128 128 PHE H H 1 8.611 0.02 . 1 . . . . 108 PHE HN . 17034 1 286 . 1 1 128 128 PHE HA H 1 5.3 0.02 . 1 . . . . 108 PHE HA . 17034 1 287 . 1 1 128 128 PHE N N 15 121.345 0.2 . 1 . . . . 108 PHE N . 17034 1 288 . 1 1 129 129 THR H H 1 9.562 0.02 . 1 . . . . 109 THR HN . 17034 1 289 . 1 1 129 129 THR HA H 1 4.63 0.02 . 1 . . . . 109 THR HA . 17034 1 290 . 1 1 129 129 THR N N 15 115.606 0.2 . 1 . . . . 109 THR N . 17034 1 291 . 1 1 130 130 GLU H H 1 9.104 0.02 . 1 . . . . 110 GLU HN . 17034 1 292 . 1 1 130 130 GLU HA H 1 4.03 0.02 . 1 . . . . 110 GLU HA . 17034 1 293 . 1 1 130 130 GLU N N 15 119.873 0.2 . 1 . . . . 110 GLU N . 17034 1 294 . 1 1 131 131 THR H H 1 7.89 0.02 . 1 . . . . 111 THR HN . 17034 1 295 . 1 1 131 131 THR HA H 1 3.81 0.02 . 1 . . . . 111 THR HA . 17034 1 296 . 1 1 131 131 THR N N 15 116.1 0.2 . 1 . . . . 111 THR N . 17034 1 297 . 1 1 132 132 ASP H H 1 7.535 0.02 . 1 . . . . 112 ASP HN . 17034 1 298 . 1 1 132 132 ASP HA H 1 4.61 0.02 . 1 . . . . 112 ASP HA . 17034 1 299 . 1 1 132 132 ASP N N 15 119.35 0.2 . 1 . . . . 112 ASP N . 17034 1 300 . 1 1 133 133 ILE H H 1 8.13 0.02 . 1 . . . . 113 ILE HN . 17034 1 301 . 1 1 133 133 ILE HA H 1 3.49 0.02 . 1 . . . . 113 ILE HA . 17034 1 302 . 1 1 133 133 ILE N N 15 119.0 0.2 . 1 . . . . 113 ILE N . 17034 1 303 . 1 1 134 134 LYS H H 1 7.84 0.02 . 1 . . . . 114 LYS HN . 17034 1 304 . 1 1 134 134 LYS HA H 1 4.03 0.02 . 1 . . . . 114 LYS HA . 17034 1 305 . 1 1 134 134 LYS N N 15 119.2 0.2 . 1 . . . . 114 LYS N . 17034 1 306 . 1 1 135 135 ILE H H 1 7.95 0.02 . 1 . . . . 115 ILE HN . 17034 1 307 . 1 1 135 135 ILE HA H 1 3.59 0.02 . 1 . . . . 115 ILE HA . 17034 1 308 . 1 1 135 135 ILE N N 15 119.7 0.2 . 1 . . . . 115 ILE N . 17034 1 309 . 1 1 136 136 MET H H 1 8.829 0.02 . 1 . . . . 116 MET HN . 17034 1 310 . 1 1 136 136 MET HA H 1 3.52 0.02 . 1 . . . . 116 MET HA . 17034 1 311 . 1 1 136 136 MET N N 15 119.27 0.2 . 1 . . . . 116 MET N . 17034 1 312 . 1 1 137 137 GLU H H 1 8.655 0.02 . 1 . . . . 117 GLU HN . 17034 1 313 . 1 1 137 137 GLU N N 15 118.12 0.2 . 1 . . . . 117 GLU N . 17034 1 314 . 1 1 138 138 ARG H H 1 7.134 0.02 . 1 . . . . 118 ARG HN . 17034 1 315 . 1 1 138 138 ARG HA H 1 4.18 0.02 . 1 . . . . 118 ARG HA . 17034 1 316 . 1 1 138 138 ARG N N 15 117.015 0.2 . 1 . . . . 118 ARG N . 17034 1 317 . 1 1 139 139 VAL H H 1 8.366 0.02 . 1 . . . . 119 VAL HN . 17034 1 318 . 1 1 139 139 VAL HA H 1 3.76 0.02 . 1 . . . . 119 VAL HA . 17034 1 319 . 1 1 139 139 VAL N N 15 120.7 0.2 . 1 . . . . 119 VAL N . 17034 1 320 . 1 1 140 140 VAL H H 1 9.286 0.02 . 1 . . . . 120 VAL HN . 17034 1 321 . 1 1 140 140 VAL HA H 1 3.68 0.02 . 1 . . . . 120 VAL HA . 17034 1 322 . 1 1 140 140 VAL N N 15 120.177 0.2 . 1 . . . . 120 VAL N . 17034 1 323 . 1 1 141 141 GLU H H 1 8.062 0.02 . 1 . . . . 121 GLU HN . 17034 1 324 . 1 1 141 141 GLU N N 15 121.773 0.2 . 1 . . . . 121 GLU N . 17034 1 325 . 1 1 142 142 GLN H H 1 7.408 0.02 . 1 . . . . 122 GLN HN . 17034 1 326 . 1 1 142 142 GLN HA H 1 4.063 0.02 . 1 . . . . 122 GLN HA . 17034 1 327 . 1 1 142 142 GLN N N 15 120.219 0.2 . 1 . . . . 122 GLN N . 17034 1 328 . 1 1 143 143 MET H H 1 8.225 0.02 . 1 . . . . 123 MET HN . 17034 1 329 . 1 1 143 143 MET HA H 1 4.11 0.02 . 1 . . . . 123 MET HA . 17034 1 330 . 1 1 143 143 MET N N 15 120.452 0.2 . 1 . . . . 123 MET N . 17034 1 331 . 1 1 144 144 CYS H H 1 9.473 0.02 . 1 . . . . 124 CYS HN . 17034 1 332 . 1 1 144 144 CYS N N 15 118.187 0.2 . 1 . . . . 124 CYS N . 17034 1 333 . 1 1 145 145 THR H H 1 8.194 0.02 . 1 . . . . 125 THR HN . 17034 1 334 . 1 1 145 145 THR HA H 1 3.77 0.02 . 1 . . . . 125 THR HA . 17034 1 335 . 1 1 145 145 THR N N 15 120.155 0.2 . 1 . . . . 125 THR N . 17034 1 336 . 1 1 146 146 THR H H 1 8.28 0.02 . 1 . . . . 126 THR HN . 17034 1 337 . 1 1 146 146 THR HA H 1 3.93 0.02 . 1 . . . . 126 THR HA . 17034 1 338 . 1 1 146 146 THR N N 15 121.1 0.2 . 1 . . . . 126 THR N . 17034 1 339 . 1 1 147 147 GLN H H 1 8.512 0.02 . 1 . . . . 127 GLN HN . 17034 1 340 . 1 1 147 147 GLN HA H 1 3.66 0.02 . 1 . . . . 127 GLN HA . 17034 1 341 . 1 1 147 147 GLN N N 15 122.177 0.2 . 1 . . . . 127 GLN N . 17034 1 342 . 1 1 148 148 TYR H H 1 8.348 0.02 . 1 . . . . 128 TYR HN . 17034 1 343 . 1 1 148 148 TYR N N 15 119.607 0.2 . 1 . . . . 128 TYR N . 17034 1 344 . 1 1 149 149 GLN H H 1 7.96 0.02 . 1 . . . . 129 GLN HN . 17034 1 345 . 1 1 149 149 GLN HA H 1 3.68 0.02 . 1 . . . . 129 GLN HA . 17034 1 346 . 1 1 149 149 GLN N N 15 119.6 0.2 . 1 . . . . 129 GLN N . 17034 1 347 . 1 1 150 150 LYS H H 1 7.871 0.02 . 1 . . . . 130 LYS HN . 17034 1 348 . 1 1 150 150 LYS HA H 1 3.97 0.02 . 1 . . . . 130 LYS HA . 17034 1 349 . 1 1 150 150 LYS N N 15 119.258 0.2 . 1 . . . . 130 LYS N . 17034 1 350 . 1 1 151 151 GLU H H 1 8.32 0.02 . 1 . . . . 131 GLU HN . 17034 1 351 . 1 1 151 151 GLU HA H 1 4.02 0.02 . 1 . . . . 131 GLU HA . 17034 1 352 . 1 1 151 151 GLU N N 15 118.0 0.2 . 1 . . . . 131 GLU N . 17034 1 353 . 1 1 152 152 SER H H 1 8.274 0.02 . 1 . . . . 132 SER HN . 17034 1 354 . 1 1 152 152 SER HA H 1 3.98 0.02 . 1 . . . . 132 SER HA . 17034 1 355 . 1 1 152 152 SER N N 15 114.789 0.2 . 1 . . . . 132 SER N . 17034 1 356 . 1 1 153 153 GLN H H 1 7.583 0.02 . 1 . . . . 133 GLN HN . 17034 1 357 . 1 1 153 153 GLN HA H 1 4.16 0.02 . 1 . . . . 133 GLN HA . 17034 1 358 . 1 1 153 153 GLN N N 15 120.631 0.2 . 1 . . . . 133 GLN N . 17034 1 359 . 1 1 154 154 ALA H H 1 7.584 0.02 . 1 . . . . 134 ALA HN . 17034 1 360 . 1 1 154 154 ALA HA H 1 4.18 0.02 . 1 . . . . 134 ALA HA . 17034 1 361 . 1 1 154 154 ALA N N 15 120.919 0.2 . 1 . . . . 134 ALA N . 17034 1 362 . 1 1 155 155 TYR H H 1 7.882 0.02 . 1 . . . . 135 TYR HN . 17034 1 363 . 1 1 155 155 TYR HA H 1 4.29 0.02 . 1 . . . . 135 TYR HA . 17034 1 364 . 1 1 155 155 TYR N N 15 118.752 0.2 . 1 . . . . 135 TYR N . 17034 1 365 . 1 1 156 156 TYR H H 1 7.992 0.02 . 1 . . . . 136 TYR HN . 17034 1 366 . 1 1 156 156 TYR HA H 1 4.34 0.02 . 1 . . . . 136 TYR HA . 17034 1 367 . 1 1 156 156 TYR N N 15 119.766 0.2 . 1 . . . . 136 TYR N . 17034 1 368 . 1 1 157 157 ASP H H 1 8.161 0.02 . 1 . . . . 137 ASP HN . 17034 1 369 . 1 1 157 157 ASP HA H 1 4.5 0.02 . 1 . . . . 137 ASP HA . 17034 1 370 . 1 1 157 157 ASP N N 15 121.177 0.2 . 1 . . . . 137 ASP N . 17034 1 371 . 1 1 158 158 GLY H H 1 7.867 0.02 . 1 . . . . 138 GLY HN . 17034 1 372 . 1 1 158 158 GLY HA2 H 1 3.9 0.02 . 2 . . . . 138 GLY HA2 . 17034 1 373 . 1 1 158 158 GLY N N 15 108.121 0.2 . 1 . . . . 138 GLY N . 17034 1 374 . 1 1 159 159 ARG H H 1 7.866 0.02 . 1 . . . . 139 ARG HN . 17034 1 375 . 1 1 159 159 ARG HA H 1 4.31 0.02 . 1 . . . . 139 ARG HA . 17034 1 376 . 1 1 159 159 ARG N N 15 119.948 0.2 . 1 . . . . 139 ARG N . 17034 1 377 . 1 1 160 160 ARG H H 1 8.38 0.02 . 1 . . . . 140 ARG HN . 17034 1 378 . 1 1 160 160 ARG HA H 1 4.43 0.02 . 1 . . . . 140 ARG HA . 17034 1 379 . 1 1 160 160 ARG N N 15 122.7 0.2 . 1 . . . . 140 ARG N . 17034 1 380 . 1 1 161 161 SER H H 1 7.957 0.02 . 1 . . . . 141 SER HN . 17034 1 381 . 1 1 161 161 SER HA H 1 4.28 0.02 . 1 . . . . 141 SER HA . 17034 1 382 . 1 1 161 161 SER N N 15 122.898 0.2 . 1 . . . . 141 SER N . 17034 1 stop_ save_ save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 17034 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 5 '2D 1H-15N HSQC' . . . 17034 2 6 '3D HNHA' . . . 17034 2 7 '3D 1H-15N TOCSY' . . . 17034 2 8 '3D 1H-15N NOESY' . . . 17034 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 21 21 GLN H H 1 8.25 0.02 . 1 . . . . 1 GLN HN . 17034 2 2 . 1 1 21 21 GLN HA H 1 4.37 0.02 . 1 . . . . 1 GLN HA . 17034 2 3 . 1 1 21 21 GLN HB2 H 1 1.98 0.02 . 2 . . . . 1 GLN HB1 . 17034 2 4 . 1 1 21 21 GLN HB3 H 1 2.04 0.02 . 2 . . . . 1 GLN HB2 . 17034 2 5 . 1 1 21 21 GLN HG2 H 1 2.34 0.02 . 2 . . . . 1 GLN HG1 . 17034 2 6 . 1 1 21 21 GLN HG3 H 1 2.13 0.02 . 2 . . . . 1 GLN HG2 . 17034 2 7 . 1 1 21 21 GLN N N 15 119.662 0.20 . 1 . . . . 1 GLN N . 17034 2 8 . 1 1 22 22 GLY H H 1 8.596 0.02 . 1 . . . . 2 GLY HN . 17034 2 9 . 1 1 22 22 GLY HA2 H 1 4.01 0.02 . 2 . . . . 2 GLY HA2 . 17034 2 10 . 1 1 22 22 GLY N N 15 110.78 0.20 . 1 . . . . 2 GLY N . 17034 2 11 . 1 1 23 23 GLY H H 1 8.33 0.02 . 1 . . . . 3 GLY HN . 17034 2 12 . 1 1 23 23 GLY HA2 H 1 3.93 0.02 . 2 . . . . 3 GLY HA2 . 17034 2 13 . 1 1 23 23 GLY N N 15 108.496 0.20 . 1 . . . . 3 GLY N . 17034 2 14 . 1 1 24 24 GLY H H 1 8.257 0.02 . 1 . . . . 4 GLY HN . 17034 2 15 . 1 1 24 24 GLY HA2 H 1 3.85 0.02 . 2 . . . . 4 GLY HA2 . 17034 2 16 . 1 1 24 24 GLY N N 15 108.817 0.20 . 1 . . . . 4 GLY N . 17034 2 17 . 1 1 25 25 THR H H 1 8.042 0.02 . 1 . . . . 5 THR HN . 17034 2 18 . 1 1 25 25 THR HA H 1 4.25 0.02 . 1 . . . . 5 THR HA . 17034 2 19 . 1 1 25 25 THR HB H 1 4.11 0.02 . 1 . . . . 5 THR HB . 17034 2 20 . 1 1 25 25 THR HG21 H 1 1.12 0.02 . 1 . . . . 5 THR HG21 . 17034 2 21 . 1 1 25 25 THR HG22 H 1 1.12 0.02 . 1 . . . . 5 THR HG21 . 17034 2 22 . 1 1 25 25 THR HG23 H 1 1.12 0.02 . 1 . . . . 5 THR HG21 . 17034 2 23 . 1 1 25 25 THR N N 15 113.136 0.20 . 1 . . . . 5 THR N . 17034 2 24 . 1 1 26 26 HIS H H 1 8.577 0.02 . 1 . . . . 6 HIS HN . 17034 2 25 . 1 1 26 26 HIS HA H 1 4.71 0.02 . 1 . . . . 6 HIS HA . 17034 2 26 . 1 1 26 26 HIS HB2 H 1 3.2 0.02 . 2 . . . . 6 HIS HB2 . 17034 2 27 . 1 1 26 26 HIS N N 15 120.332 0.20 . 1 . . . . 6 HIS N . 17034 2 28 . 1 1 27 27 ASN H H 1 8.37 0.02 . 1 . . . . 7 ASN HN . 17034 2 29 . 1 1 27 27 ASN HA H 1 4.6 0.02 . 1 . . . . 7 ASN HA . 17034 2 30 . 1 1 27 27 ASN HB2 H 1 2.63 0.02 . 2 . . . . 7 ASN HB2 . 17034 2 31 . 1 1 27 27 ASN N N 15 119.749 0.20 . 1 . . . . 7 ASN N . 17034 2 32 . 1 1 28 28 GLN H H 1 8.331 0.02 . 1 . . . . 8 GLN HN . 17034 2 33 . 1 1 28 28 GLN HA H 1 4.21 0.02 . 1 . . . . 8 GLN HA . 17034 2 34 . 1 1 28 28 GLN HB2 H 1 2.0 0.02 . 2 . . . . 8 GLN HB1 . 17034 2 35 . 1 1 28 28 GLN HB3 H 1 1.81 0.02 . 2 . . . . 8 GLN HB2 . 17034 2 36 . 1 1 28 28 GLN HG2 H 1 2.17 0.02 . 2 . . . . 8 GLN HG2 . 17034 2 37 . 1 1 28 28 GLN N N 15 120.587 0.20 . 1 . . . . 8 GLN N . 17034 2 38 . 1 1 29 29 TRP H H 1 8.08 0.02 . 1 . . . . 9 TRP HN . 17034 2 39 . 1 1 29 29 TRP HA H 1 4.66 0.02 . 1 . . . . 9 TRP HA . 17034 2 40 . 1 1 29 29 TRP HB2 H 1 3.25 0.02 . 2 . . . . 9 TRP HB2 . 17034 2 41 . 1 1 29 29 TRP N N 15 121.845 0.20 . 1 . . . . 9 TRP N . 17034 2 42 . 1 1 30 30 ASN H H 1 8.091 0.02 . 1 . . . . 10 ASN HN . 17034 2 43 . 1 1 30 30 ASN HA H 1 4.66 0.02 . 1 . . . . 10 ASN HA . 17034 2 44 . 1 1 30 30 ASN HB2 H 1 2.6 0.02 . 2 . . . . 10 ASN HB2 . 17034 2 45 . 1 1 30 30 ASN N N 15 120.624 0.20 . 1 . . . . 10 ASN N . 17034 2 46 . 1 1 31 31 LYS H H 1 8.019 0.02 . 1 . . . . 11 LYS HN . 17034 2 47 . 1 1 31 31 LYS HA H 1 4.46 0.02 . 1 . . . . 11 LYS HA . 17034 2 48 . 1 1 31 31 LYS HB2 H 1 1.65 0.02 . 2 . . . . 11 LYS HB1 . 17034 2 49 . 1 1 31 31 LYS HB3 H 1 1.81 0.02 . 2 . . . . 11 LYS HB2 . 17034 2 50 . 1 1 31 31 LYS HG2 H 1 1.34 0.02 . 2 . . . . 11 LYS HG1 . 17034 2 51 . 1 1 31 31 LYS HG3 H 1 1.5 0.02 . 2 . . . . 11 LYS HG2 . 17034 2 52 . 1 1 31 31 LYS N N 15 122.917 0.20 . 1 . . . . 11 LYS N . 17034 2 53 . 1 1 33 33 SER H H 1 8.335 0.02 . 1 . . . . 13 SER HN . 17034 2 54 . 1 1 33 33 SER HA H 1 4.48 0.02 . 1 . . . . 13 SER HA . 17034 2 55 . 1 1 33 33 SER HB2 H 1 3.87 0.02 . 2 . . . . 13 SER HB2 . 17034 2 56 . 1 1 33 33 SER N N 15 117.421 0.20 . 1 . . . . 13 SER N . 17034 2 57 . 1 1 34 34 LYS H H 1 8.293 0.02 . 1 . . . . 14 LYS HN . 17034 2 58 . 1 1 34 34 LYS HA H 1 4.6 0.02 . 1 . . . . 14 LYS HA . 17034 2 59 . 1 1 34 34 LYS HB2 H 1 1.72 0.02 . 2 . . . . 14 LYS HB1 . 17034 2 60 . 1 1 34 34 LYS HB3 H 1 1.84 0.02 . 2 . . . . 14 LYS HB2 . 17034 2 61 . 1 1 34 34 LYS HG2 H 1 1.44 0.02 . 2 . . . . 14 LYS HG2 . 17034 2 62 . 1 1 34 34 LYS N N 15 124.181 0.20 . 1 . . . . 14 LYS N . 17034 2 63 . 1 1 36 36 LYS H H 1 8.449 0.02 . 1 . . . . 16 LYS HN . 17034 2 64 . 1 1 36 36 LYS HA H 1 4.3 0.02 . 1 . . . . 16 LYS HA . 17034 2 65 . 1 1 36 36 LYS HB2 H 1 1.78 0.02 . 2 . . . . 16 LYS HB2 . 17034 2 66 . 1 1 36 36 LYS HG2 H 1 1.5 0.02 . 2 . . . . 16 LYS HG2 . 17034 2 67 . 1 1 36 36 LYS N N 15 122.025 0.20 . 1 . . . . 16 LYS N . 17034 2 68 . 1 1 37 37 THR H H 1 8.082 0.02 . 1 . . . . 17 THR HN . 17034 2 69 . 1 1 37 37 THR HA H 1 4.35 0.02 . 1 . . . . 17 THR HA . 17034 2 70 . 1 1 37 37 THR HB H 1 4.17 0.02 . 1 . . . . 17 THR HB . 17034 2 71 . 1 1 37 37 THR HG21 H 1 1.16 0.02 . 1 . . . . 17 THR HG21 . 17034 2 72 . 1 1 37 37 THR HG22 H 1 1.16 0.02 . 1 . . . . 17 THR HG21 . 17034 2 73 . 1 1 37 37 THR HG23 H 1 1.16 0.02 . 1 . . . . 17 THR HG21 . 17034 2 74 . 1 1 37 37 THR N N 15 115.155 0.20 . 1 . . . . 17 THR N . 17034 2 75 . 1 1 38 38 ASN H H 1 8.507 0.02 . 1 . . . . 18 ASN HN . 17034 2 76 . 1 1 38 38 ASN HA H 1 4.71 0.02 . 1 . . . . 18 ASN HA . 17034 2 77 . 1 1 38 38 ASN HB2 H 1 2.77 0.02 . 2 . . . . 18 ASN HB2 . 17034 2 78 . 1 1 38 38 ASN N N 15 121.499 0.20 . 1 . . . . 18 ASN N . 17034 2 79 . 1 1 39 39 MET H H 1 8.322 0.02 . 1 . . . . 19 MET HN . 17034 2 80 . 1 1 39 39 MET HA H 1 4.39 0.02 . 1 . . . . 19 MET HA . 17034 2 81 . 1 1 39 39 MET HB2 H 1 1.98 0.02 . 2 . . . . 19 MET HB2 . 17034 2 82 . 1 1 39 39 MET HG2 H 1 2.6 0.02 . 2 . . . . 19 MET HG1 . 17034 2 83 . 1 1 39 39 MET HG3 H 1 2.43 0.02 . 2 . . . . 19 MET HG2 . 17034 2 84 . 1 1 39 39 MET N N 15 121.502 0.20 . 1 . . . . 19 MET N . 17034 2 85 . 1 1 40 40 LYS H H 1 8.25 0.02 . 1 . . . . 20 LYS HN . 17034 2 86 . 1 1 40 40 LYS HA H 1 4.22 0.02 . 1 . . . . 20 LYS HA . 17034 2 87 . 1 1 40 40 LYS HB2 H 1 1.78 0.02 . 2 . . . . 20 LYS HB2 . 17034 2 88 . 1 1 40 40 LYS HD2 H 1 1.41 0.02 . 2 . . . . 20 LYS HD2 . 17034 2 89 . 1 1 40 40 LYS HG2 H 1 1.71 0.02 . 2 . . . . 20 LYS HG2 . 17034 2 90 . 1 1 40 40 LYS N N 15 122.375 0.20 . 1 . . . . 20 LYS N . 17034 2 91 . 1 1 41 41 HIS H H 1 8.5 0.02 . 1 . . . . 21 HIS HN . 17034 2 92 . 1 1 41 41 HIS HA H 1 4.67 0.02 . 1 . . . . 21 HIS HA . 17034 2 93 . 1 1 41 41 HIS HB2 H 1 3.17 0.02 . 2 . . . . 21 HIS HB2 . 17034 2 94 . 1 1 41 41 HIS N N 15 119.947 0.20 . 1 . . . . 21 HIS N . 17034 2 95 . 1 1 42 42 MET H H 1 8.411 0.02 . 1 . . . . 22 MET HN . 17034 2 96 . 1 1 42 42 MET HA H 1 4.47 0.02 . 1 . . . . 22 MET HA . 17034 2 97 . 1 1 42 42 MET HB2 H 1 1.99 0.02 . 2 . . . . 22 MET HB2 . 17034 2 98 . 1 1 42 42 MET HG2 H 1 2.52 0.02 . 2 . . . . 22 MET HG2 . 17034 2 99 . 1 1 42 42 MET N N 15 122.9 0.20 . 1 . . . . 22 MET N . 17034 2 100 . 1 1 43 43 ALA H H 1 8.391 0.02 . 1 . . . . 23 ALA HN . 17034 2 101 . 1 1 43 43 ALA HA H 1 4.31 0.02 . 1 . . . . 23 ALA HA . 17034 2 102 . 1 1 43 43 ALA HB1 H 1 1.39 0.02 . 1 . . . . 23 ALA HB1 . 17034 2 103 . 1 1 43 43 ALA HB2 H 1 1.39 0.02 . 1 . . . . 23 ALA HB1 . 17034 2 104 . 1 1 43 43 ALA HB3 H 1 1.39 0.02 . 1 . . . . 23 ALA HB1 . 17034 2 105 . 1 1 43 43 ALA N N 15 125.94 0.20 . 1 . . . . 23 ALA N . 17034 2 106 . 1 1 44 44 GLY H H 1 8.359 0.02 . 1 . . . . 24 GLY HN . 17034 2 107 . 1 1 44 44 GLY HA2 H 1 3.94 0.02 . 2 . . . . 24 GLY HA2 . 17034 2 108 . 1 1 44 44 GLY N N 15 108.893 0.20 . 1 . . . . 24 GLY N . 17034 2 109 . 1 1 45 45 ALA H H 1 8.122 0.02 . 1 . . . . 25 ALA HN . 17034 2 110 . 1 1 45 45 ALA HA H 1 4.28 0.02 . 1 . . . . 25 ALA HA . 17034 2 111 . 1 1 45 45 ALA HB1 H 1 1.36 0.02 . 1 . . . . 25 ALA HB1 . 17034 2 112 . 1 1 45 45 ALA HB2 H 1 1.36 0.02 . 1 . . . . 25 ALA HB1 . 17034 2 113 . 1 1 45 45 ALA HB3 H 1 1.36 0.02 . 1 . . . . 25 ALA HB1 . 17034 2 114 . 1 1 45 45 ALA N N 15 123.905 0.20 . 1 . . . . 25 ALA N . 17034 2 115 . 1 1 46 46 ALA H H 1 8.18 0.02 . 1 . . . . 26 ALA HN . 17034 2 116 . 1 1 46 46 ALA HA H 1 4.4 0.02 . 1 . . . . 26 ALA HA . 17034 2 117 . 1 1 46 46 ALA HB1 H 1 1.39 0.02 . 1 . . . . 26 ALA HB1 . 17034 2 118 . 1 1 46 46 ALA HB2 H 1 1.39 0.02 . 1 . . . . 26 ALA HB1 . 17034 2 119 . 1 1 46 46 ALA HB3 H 1 1.39 0.02 . 1 . . . . 26 ALA HB1 . 17034 2 120 . 1 1 46 46 ALA N N 15 123.6 0.20 . 1 . . . . 26 ALA N . 17034 2 121 . 1 1 47 47 ALA H H 1 8.181 0.02 . 1 . . . . 27 ALA HN . 17034 2 122 . 1 1 47 47 ALA HA H 1 4.29 0.02 . 1 . . . . 27 ALA HA . 17034 2 123 . 1 1 47 47 ALA HB1 H 1 1.37 0.02 . 1 . . . . 27 ALA HB1 . 17034 2 124 . 1 1 47 47 ALA HB2 H 1 1.37 0.02 . 1 . . . . 27 ALA HB1 . 17034 2 125 . 1 1 47 47 ALA HB3 H 1 1.37 0.02 . 1 . . . . 27 ALA HB1 . 17034 2 126 . 1 1 47 47 ALA N N 15 123.388 0.20 . 1 . . . . 27 ALA N . 17034 2 127 . 1 1 48 48 ALA H H 1 8.31 0.02 . 1 . . . . 28 ALA HN . 17034 2 128 . 1 1 48 48 ALA HA H 1 4.33 0.02 . 1 . . . . 28 ALA HA . 17034 2 129 . 1 1 48 48 ALA HB1 H 1 1.59 0.02 . 1 . . . . 28 ALA HB1 . 17034 2 130 . 1 1 48 48 ALA HB2 H 1 1.59 0.02 . 1 . . . . 28 ALA HB1 . 17034 2 131 . 1 1 48 48 ALA HB3 H 1 1.59 0.02 . 1 . . . . 28 ALA HB1 . 17034 2 132 . 1 1 48 48 ALA N N 15 123.467 0.20 . 1 . . . . 28 ALA N . 17034 2 133 . 1 1 49 49 GLY H H 1 8.233 0.02 . 1 . . . . 29 GLY HN . 17034 2 134 . 1 1 49 49 GLY HA2 H 1 3.9 0.02 . 2 . . . . 29 GLY HA2 . 17034 2 135 . 1 1 49 49 GLY N N 15 107.938 0.20 . 1 . . . . 29 GLY N . 17034 2 136 . 1 1 50 50 ALA H H 1 8.016 0.02 . 1 . . . . 30 ALA HN . 17034 2 137 . 1 1 50 50 ALA HA H 1 4.34 0.02 . 1 . . . . 30 ALA HA . 17034 2 138 . 1 1 50 50 ALA HB1 H 1 1.35 0.02 . 1 . . . . 30 ALA HB1 . 17034 2 139 . 1 1 50 50 ALA HB2 H 1 1.35 0.02 . 1 . . . . 30 ALA HB1 . 17034 2 140 . 1 1 50 50 ALA HB3 H 1 1.35 0.02 . 1 . . . . 30 ALA HB1 . 17034 2 141 . 1 1 50 50 ALA N N 15 123.78 0.20 . 1 . . . . 30 ALA N . 17034 2 142 . 1 1 51 51 VAL H H 1 8.087 0.02 . 1 . . . . 31 VAL HN . 17034 2 143 . 1 1 51 51 VAL HA H 1 4.11 0.02 . 1 . . . . 31 VAL HA . 17034 2 144 . 1 1 51 51 VAL HB H 1 2.01 0.02 . 1 . . . . 31 VAL HB . 17034 2 145 . 1 1 51 51 VAL HG21 H 1 0.88 0.02 . 2 . . . . 31 VAL HG21 . 17034 2 146 . 1 1 51 51 VAL HG22 H 1 0.88 0.02 . 2 . . . . 31 VAL HG21 . 17034 2 147 . 1 1 51 51 VAL HG23 H 1 0.88 0.02 . 2 . . . . 31 VAL HG21 . 17034 2 148 . 1 1 51 51 VAL N N 15 119.761 0.20 . 1 . . . . 31 VAL N . 17034 2 149 . 1 1 52 52 VAL H H 1 8.216 0.02 . 1 . . . . 32 VAL HN . 17034 2 150 . 1 1 52 52 VAL HA H 1 4.09 0.02 . 1 . . . . 32 VAL HA . 17034 2 151 . 1 1 52 52 VAL HB H 1 2.02 0.02 . 1 . . . . 32 VAL HB . 17034 2 152 . 1 1 52 52 VAL HG21 H 1 0.9 0.02 . 2 . . . . 32 VAL HG21 . 17034 2 153 . 1 1 52 52 VAL HG22 H 1 0.9 0.02 . 2 . . . . 32 VAL HG21 . 17034 2 154 . 1 1 52 52 VAL HG23 H 1 0.9 0.02 . 2 . . . . 32 VAL HG21 . 17034 2 155 . 1 1 52 52 VAL N N 15 124.681 0.20 . 1 . . . . 32 VAL N . 17034 2 156 . 1 1 53 53 GLY H H 1 8.486 0.02 . 1 . . . . 33 GLY HN . 17034 2 157 . 1 1 53 53 GLY HA2 H 1 3.93 0.02 . 2 . . . . 33 GLY HA2 . 17034 2 158 . 1 1 53 53 GLY N N 15 113.088 0.20 . 1 . . . . 33 GLY N . 17034 2 159 . 1 1 54 54 GLY H H 1 8.214 0.02 . 1 . . . . 34 GLY HN . 17034 2 160 . 1 1 54 54 GLY HA2 H 1 3.94 0.02 . 2 . . . . 34 GLY HA2 . 17034 2 161 . 1 1 54 54 GLY N N 15 108.44 0.20 . 1 . . . . 34 GLY N . 17034 2 162 . 1 1 55 55 LEU H H 1 8.207 0.02 . 1 . . . . 35 LEU HN . 17034 2 163 . 1 1 55 55 LEU HA H 1 4.36 0.02 . 1 . . . . 35 LEU HA . 17034 2 164 . 1 1 55 55 LEU HB2 H 1 1.58 0.02 . 2 . . . . 35 LEU HB2 . 17034 2 165 . 1 1 55 55 LEU HG H 1 1.44 0.02 . 1 . . . . 35 LEU HG . 17034 2 166 . 1 1 55 55 LEU N N 15 121.741 0.20 . 1 . . . . 35 LEU N . 17034 2 167 . 1 1 56 56 GLY H H 1 8.49 0.02 . 1 . . . . 36 GLY HN . 17034 2 168 . 1 1 56 56 GLY HA2 H 1 3.97 0.02 . 2 . . . . 36 GLY HA2 . 17034 2 169 . 1 1 56 56 GLY N N 15 110.024 0.20 . 1 . . . . 36 GLY N . 17034 2 170 . 1 1 57 57 GLY H H 1 8.297 0.02 . 1 . . . . 37 GLY HN . 17034 2 171 . 1 1 57 57 GLY HA2 H 1 3.98 0.02 . 2 . . . . 37 GLY HA2 . 17034 2 172 . 1 1 57 57 GLY N N 15 108.734 0.20 . 1 . . . . 37 GLY N . 17034 2 173 . 1 1 58 58 TYR H H 1 7.727 0.02 . 1 . . . . 38 TYR HN . 17034 2 174 . 1 1 58 58 TYR HA H 1 4.44 0.02 . 1 . . . . 38 TYR HA . 17034 2 175 . 1 1 58 58 TYR HB2 H 1 2.86 0.02 . 2 . . . . 38 TYR HB2 . 17034 2 176 . 1 1 58 58 TYR N N 15 117.885 0.20 . 1 . . . . 38 TYR N . 17034 2 177 . 1 1 59 59 MET H H 1 8.98 0.02 . 1 . . . . 39 MET HN . 17034 2 178 . 1 1 59 59 MET HA H 1 4.52 0.02 . 1 . . . . 39 MET HA . 17034 2 179 . 1 1 59 59 MET HB2 H 1 1.6 0.02 . 2 . . . . 39 MET HB1 . 17034 2 180 . 1 1 59 59 MET HB3 H 1 1.26 0.02 . 2 . . . . 39 MET HB2 . 17034 2 181 . 1 1 59 59 MET HG2 H 1 2.48 0.02 . 2 . . . . 39 MET HG1 . 17034 2 182 . 1 1 59 59 MET HG3 H 1 2.05 0.02 . 2 . . . . 39 MET HG2 . 17034 2 183 . 1 1 59 59 MET N N 15 121.171 0.20 . 1 . . . . 39 MET N . 17034 2 184 . 1 1 60 60 LEU H H 1 8.077 0.02 . 1 . . . . 40 LEU HN . 17034 2 185 . 1 1 60 60 LEU HA H 1 4.67 0.02 . 1 . . . . 40 LEU HA . 17034 2 186 . 1 1 60 60 LEU HB2 H 1 1.06 0.02 . 2 . . . . 40 LEU HB1 . 17034 2 187 . 1 1 60 60 LEU HB3 H 1 1.58 0.02 . 2 . . . . 40 LEU HB2 . 17034 2 188 . 1 1 60 60 LEU HD11 H 1 0.64 0.02 . 2 . . . . 40 LEU HD11 . 17034 2 189 . 1 1 60 60 LEU HD12 H 1 0.64 0.02 . 2 . . . . 40 LEU HD11 . 17034 2 190 . 1 1 60 60 LEU HD13 H 1 0.64 0.02 . 2 . . . . 40 LEU HD11 . 17034 2 191 . 1 1 60 60 LEU HD21 H 1 0.064 0.02 . 2 . . . . 40 LEU HD21 . 17034 2 192 . 1 1 60 60 LEU HD22 H 1 0.064 0.02 . 2 . . . . 40 LEU HD21 . 17034 2 193 . 1 1 60 60 LEU HD23 H 1 0.064 0.02 . 2 . . . . 40 LEU HD21 . 17034 2 194 . 1 1 60 60 LEU N N 15 121.413 0.20 . 1 . . . . 40 LEU N . 17034 2 195 . 1 1 61 61 GLY H H 1 9.183 0.02 . 1 . . . . 41 GLY HN . 17034 2 196 . 1 1 61 61 GLY HA2 H 1 4.34 0.02 . 2 . . . . 41 GLY HA1 . 17034 2 197 . 1 1 61 61 GLY HA3 H 1 3.93 0.02 . 2 . . . . 41 GLY HA2 . 17034 2 198 . 1 1 61 61 GLY N N 15 114.337 0.20 . 1 . . . . 41 GLY N . 17034 2 199 . 1 1 62 62 SER H H 1 8.24 0.02 . 1 . . . . 42 SER HN . 17034 2 200 . 1 1 62 62 SER HA H 1 4.4 0.02 . 1 . . . . 42 SER HA . 17034 2 201 . 1 1 62 62 SER HB2 H 1 3.92 0.02 . 2 . . . . 42 SER HB2 . 17034 2 202 . 1 1 62 62 SER N N 15 113.842 0.20 . 1 . . . . 42 SER N . 17034 2 203 . 1 1 63 63 ALA H H 1 8.661 0.02 . 1 . . . . 43 ALA HN . 17034 2 204 . 1 1 63 63 ALA HA H 1 4.36 0.02 . 1 . . . . 43 ALA HA . 17034 2 205 . 1 1 63 63 ALA HB1 H 1 1.25 0.02 . 1 . . . . 43 ALA HB1 . 17034 2 206 . 1 1 63 63 ALA HB2 H 1 1.25 0.02 . 1 . . . . 43 ALA HB1 . 17034 2 207 . 1 1 63 63 ALA HB3 H 1 1.25 0.02 . 1 . . . . 43 ALA HB1 . 17034 2 208 . 1 1 63 63 ALA N N 15 125.557 0.20 . 1 . . . . 43 ALA N . 17034 2 209 . 1 1 64 64 MET H H 1 8.689 0.02 . 1 . . . . 44 MET HN . 17034 2 210 . 1 1 64 64 MET HA H 1 4.65 0.02 . 1 . . . . 44 MET HA . 17034 2 211 . 1 1 64 64 MET HB2 H 1 1.99 0.02 . 2 . . . . 44 MET HB2 . 17034 2 212 . 1 1 64 64 MET N N 15 121.433 0.20 . 1 . . . . 44 MET N . 17034 2 213 . 1 1 65 65 SER H H 1 8.332 0.02 . 1 . . . . 45 SER HN . 17034 2 214 . 1 1 65 65 SER HA H 1 4.37 0.02 . 1 . . . . 45 SER HA . 17034 2 215 . 1 1 65 65 SER HB2 H 1 3.8 0.02 . 2 . . . . 45 SER HB2 . 17034 2 216 . 1 1 65 65 SER N N 15 116.132 0.20 . 1 . . . . 45 SER N . 17034 2 217 . 1 1 66 66 ARG H H 1 8.574 0.02 . 1 . . . . 46 ARG HN . 17034 2 218 . 1 1 66 66 ARG HA H 1 4.42 0.02 . 1 . . . . 46 ARG HA . 17034 2 219 . 1 1 66 66 ARG HB2 H 1 1.8 0.02 . 2 . . . . 46 ARG HB1 . 17034 2 220 . 1 1 66 66 ARG HD2 H 1 3.15 0.02 . 2 . . . . 46 ARG HD2 . 17034 2 221 . 1 1 66 66 ARG HG2 H 1 1.64 0.02 . 2 . . . . 46 ARG HG2 . 17034 2 222 . 1 1 66 66 ARG N N 15 125.826 0.20 . 1 . . . . 46 ARG N . 17034 2 223 . 1 1 68 68 MET H H 1 8.649 0.02 . 1 . . . . 48 MET HN . 17034 2 224 . 1 1 68 68 MET HA H 1 4.7 0.02 . 1 . . . . 48 MET HA . 17034 2 225 . 1 1 68 68 MET HB2 H 1 1.98 0.02 . 2 . . . . 48 MET HB2 . 17034 2 226 . 1 1 68 68 MET HG2 H 1 2.61 0.02 . 2 . . . . 48 MET HG2 . 17034 2 227 . 1 1 68 68 MET N N 15 122.459 0.20 . 1 . . . . 48 MET N . 17034 2 228 . 1 1 69 69 MET H H 1 7.34 0.02 . 1 . . . . 49 MET HN . 17034 2 229 . 1 1 69 69 MET HA H 1 4.32 0.02 . 1 . . . . 49 MET HA . 17034 2 230 . 1 1 69 69 MET HB2 H 1 1.08 0.02 . 2 . . . . 49 MET HB2 . 17034 2 231 . 1 1 69 69 MET HG2 H 1 1.93 0.02 . 2 . . . . 49 MET HG1 . 17034 2 232 . 1 1 69 69 MET HG3 H 1 1.75 0.02 . 2 . . . . 49 MET HG2 . 17034 2 233 . 1 1 69 69 MET N N 15 121.818 0.20 . 1 . . . . 49 MET N . 17034 2 234 . 1 1 70 70 HIS H H 1 8.128 0.02 . 1 . . . . 50 HIS HN . 17034 2 235 . 1 1 70 70 HIS HA H 1 4.88 0.02 . 1 . . . . 50 HIS HA . 17034 2 236 . 1 1 70 70 HIS HB2 H 1 3.2 0.02 . 2 . . . . 50 HIS HB1 . 17034 2 237 . 1 1 70 70 HIS HB3 H 1 2.91 0.02 . 2 . . . . 50 HIS HB2 . 17034 2 238 . 1 1 70 70 HIS N N 15 118.418 0.20 . 1 . . . . 50 HIS N . 17034 2 239 . 1 1 71 71 PHE H H 1 10.273 0.02 . 1 . . . . 51 PHE HN . 17034 2 240 . 1 1 71 71 PHE HA H 1 4.36 0.02 . 1 . . . . 51 PHE HA . 17034 2 241 . 1 1 71 71 PHE HB2 H 1 2.8 0.02 . 2 . . . . 51 PHE HB1 . 17034 2 242 . 1 1 71 71 PHE HB3 H 1 2.68 0.02 . 2 . . . . 51 PHE HB2 . 17034 2 243 . 1 1 71 71 PHE N N 15 123.198 0.20 . 1 . . . . 51 PHE N . 17034 2 244 . 1 1 72 72 GLY H H 1 8.961 0.02 . 1 . . . . 52 GLY HN . 17034 2 245 . 1 1 72 72 GLY HA2 H 1 3.74 0.02 . 2 . . . . 52 GLY HA1 . 17034 2 246 . 1 1 72 72 GLY HA3 H 1 4.11 0.02 . 2 . . . . 52 GLY HA2 . 17034 2 247 . 1 1 72 72 GLY N N 15 109.466 0.20 . 1 . . . . 52 GLY N . 17034 2 248 . 1 1 73 73 ASN H H 1 7.16 0.02 . 1 . . . . 53 ASN HN . 17034 2 249 . 1 1 73 73 ASN HA H 1 4.87 0.02 . 1 . . . . 53 ASN HA . 17034 2 250 . 1 1 73 73 ASN HB2 H 1 2.75 0.02 . 2 . . . . 53 ASN HB2 . 17034 2 251 . 1 1 73 73 ASN N N 15 114.961 0.20 . 1 . . . . 53 ASN N . 17034 2 252 . 1 1 74 74 ASP H H 1 9.006 0.02 . 1 . . . . 54 ASP HN . 17034 2 253 . 1 1 74 74 ASP HA H 1 4.48 0.02 . 1 . . . . 54 ASP HA . 17034 2 254 . 1 1 74 74 ASP HB2 H 1 2.8 0.02 . 2 . . . . 54 ASP HB2 . 17034 2 255 . 1 1 74 74 ASP N N 15 123.463 0.20 . 1 . . . . 54 ASP N . 17034 2 256 . 1 1 75 75 TRP H H 1 8.406 0.02 . 1 . . . . 55 TRP HN . 17034 2 257 . 1 1 75 75 TRP HA H 1 4.28 0.02 . 1 . . . . 55 TRP HA . 17034 2 258 . 1 1 75 75 TRP HB2 H 1 2.81 0.02 . 2 . . . . 55 TRP HB1 . 17034 2 259 . 1 1 75 75 TRP HB3 H 1 3.42 0.02 . 2 . . . . 55 TRP HB2 . 17034 2 260 . 1 1 75 75 TRP N N 15 120.33 0.20 . 1 . . . . 55 TRP N . 17034 2 261 . 1 1 76 76 GLU H H 1 8.137 0.02 . 1 . . . . 56 GLU HN . 17034 2 262 . 1 1 76 76 GLU HA H 1 3.38 0.02 . 1 . . . . 56 GLU HA . 17034 2 263 . 1 1 76 76 GLU N N 15 121.664 0.20 . 1 . . . . 56 GLU N . 17034 2 264 . 1 1 77 77 ASP H H 1 7.97 0.02 . 1 . . . . 57 ASP HN . 17034 2 265 . 1 1 77 77 ASP HA H 1 4.53 0.02 . 1 . . . . 57 ASP HA . 17034 2 266 . 1 1 77 77 ASP HB2 H 1 2.96 0.02 . 2 . . . . 57 ASP HB2 . 17034 2 267 . 1 1 77 77 ASP N N 15 120.0 0.20 . 1 . . . . 57 ASP N . 17034 2 268 . 1 1 78 78 ARG H H 1 7.98 0.02 . 1 . . . . 58 ARG HN . 17034 2 269 . 1 1 78 78 ARG HA H 1 3.94 0.02 . 1 . . . . 58 ARG HA . 17034 2 270 . 1 1 78 78 ARG N N 15 120.253 0.20 . 1 . . . . 58 ARG N . 17034 2 271 . 1 1 79 79 TYR H H 1 8.289 0.02 . 1 . . . . 59 TYR HN . 17034 2 272 . 1 1 79 79 TYR N N 15 121.246 0.20 . 1 . . . . 59 TYR N . 17034 2 273 . 1 1 80 80 TYR H H 1 8.835 0.02 . 1 . . . . 60 TYR HN . 17034 2 274 . 1 1 80 80 TYR N N 15 119.715 0.20 . 1 . . . . 60 TYR N . 17034 2 275 . 1 1 81 81 ARG H H 1 7.728 0.02 . 1 . . . . 61 ARG HN . 17034 2 276 . 1 1 81 81 ARG HA H 1 3.7 0.02 . 1 . . . . 61 ARG HA . 17034 2 277 . 1 1 81 81 ARG HB2 H 1 1.91 0.02 . 2 . . . . 61 ARG HB2 . 17034 2 278 . 1 1 81 81 ARG HG2 H 1 1.71 0.02 . 2 . . . . 61 ARG HG2 . 17034 2 279 . 1 1 81 81 ARG N N 15 116.853 0.20 . 1 . . . . 61 ARG N . 17034 2 280 . 1 1 82 82 GLU H H 1 7.832 0.02 . 1 . . . . 62 GLU HN . 17034 2 281 . 1 1 82 82 GLU HA H 1 4.04 0.02 . 1 . . . . 62 GLU HA . 17034 2 282 . 1 1 82 82 GLU HB2 H 1 1.88 0.02 . 2 . . . . 62 GLU HB1 . 17034 2 283 . 1 1 82 82 GLU HB3 H 1 1.71 0.02 . 2 . . . . 62 GLU HB2 . 17034 2 284 . 1 1 82 82 GLU HG2 H 1 2.4 0.02 . 2 . . . . 62 GLU HG1 . 17034 2 285 . 1 1 82 82 GLU HG3 H 1 2.19 0.02 . 2 . . . . 62 GLU HG2 . 17034 2 286 . 1 1 82 82 GLU N N 15 115.345 0.20 . 1 . . . . 62 GLU N . 17034 2 287 . 1 1 83 83 ASN H H 1 7.48 0.02 . 1 . . . . 63 ASN HN . 17034 2 288 . 1 1 83 83 ASN HA H 1 4.6 0.02 . 1 . . . . 63 ASN HA . 17034 2 289 . 1 1 83 83 ASN HB2 H 1 2.42 0.02 . 2 . . . . 63 ASN HB1 . 17034 2 290 . 1 1 83 83 ASN HB3 H 1 2.17 0.02 . 2 . . . . 63 ASN HB2 . 17034 2 291 . 1 1 83 83 ASN N N 15 116.002 0.20 . 1 . . . . 63 ASN N . 17034 2 292 . 1 1 84 84 MET H H 1 7.452 0.02 . 1 . . . . 64 MET HN . 17034 2 293 . 1 1 84 84 MET HA H 1 3.66 0.02 . 1 . . . . 64 MET HA . 17034 2 294 . 1 1 84 84 MET HB2 H 1 1.77 0.02 . 2 . . . . 64 MET HB1 . 17034 2 295 . 1 1 84 84 MET HB3 H 1 1.53 0.02 . 2 . . . . 64 MET HB2 . 17034 2 296 . 1 1 84 84 MET HG2 H 1 2.2 0.02 . 2 . . . . 64 MET HG2 . 17034 2 297 . 1 1 84 84 MET N N 15 118.707 0.20 . 1 . . . . 64 MET N . 17034 2 298 . 1 1 85 85 ASN H H 1 8.152 0.02 . 1 . . . . 65 ASN HN . 17034 2 299 . 1 1 85 85 ASN HA H 1 4.401 0.02 . 1 . . . . 65 ASN HA . 17034 2 300 . 1 1 85 85 ASN N N 15 114.561 0.20 . 1 . . . . 65 ASN N . 17034 2 301 . 1 1 86 86 ARG H H 1 7.98 0.02 . 1 . . . . 66 ARG HN . 17034 2 302 . 1 1 86 86 ARG HA H 1 4.2 0.02 . 1 . . . . 66 ARG HA . 17034 2 303 . 1 1 86 86 ARG HB2 H 1 1.47 0.02 . 2 . . . . 66 ARG HB2 . 17034 2 304 . 1 1 86 86 ARG N N 15 117.652 0.20 . 1 . . . . 66 ARG N . 17034 2 305 . 1 1 87 87 TYR H H 1 7.289 0.02 . 1 . . . . 67 TYR HN . 17034 2 306 . 1 1 87 87 TYR HA H 1 4.96 0.02 . 1 . . . . 67 TYR HA . 17034 2 307 . 1 1 87 87 TYR HB2 H 1 3.12 0.02 . 2 . . . . 67 TYR HB1 . 17034 2 308 . 1 1 87 87 TYR HB3 H 1 2.98 0.02 . 2 . . . . 67 TYR HB2 . 17034 2 309 . 1 1 87 87 TYR N N 15 119.454 0.20 . 1 . . . . 67 TYR N . 17034 2 310 . 1 1 89 89 ASN H H 1 8.42 0.02 . 1 . . . . 69 ASN HN . 17034 2 311 . 1 1 89 89 ASN HA H 1 4.72 0.02 . 1 . . . . 69 ASN HA . 17034 2 312 . 1 1 89 89 ASN HB2 H 1 2.4 0.02 . 2 . . . . 69 ASN HB2 . 17034 2 313 . 1 1 89 89 ASN N N 15 116.11 0.20 . 1 . . . . 69 ASN N . 17034 2 314 . 1 1 90 90 GLN H H 1 7.216 0.02 . 1 . . . . 70 GLN HN . 17034 2 315 . 1 1 90 90 GLN HA H 1 4.6 0.02 . 1 . . . . 70 GLN HA . 17034 2 316 . 1 1 90 90 GLN HB2 H 1 1.7 0.02 . 2 . . . . 70 GLN HB1 . 17034 2 317 . 1 1 90 90 GLN HB3 H 1 2.04 0.02 . 2 . . . . 70 GLN HB2 . 17034 2 318 . 1 1 90 90 GLN HG2 H 1 2.09 0.02 . 2 . . . . 70 GLN HG2 . 17034 2 319 . 1 1 90 90 GLN N N 15 114.58 0.20 . 1 . . . . 70 GLN N . 17034 2 320 . 1 1 91 91 VAL H H 1 8.496 0.02 . 1 . . . . 71 VAL HN . 17034 2 321 . 1 1 91 91 VAL HA H 1 4.83 0.02 . 1 . . . . 71 VAL HA . 17034 2 322 . 1 1 91 91 VAL N N 15 111.639 0.20 . 1 . . . . 71 VAL N . 17034 2 323 . 1 1 92 92 TYR H H 1 8.32 0.02 . 1 . . . . 72 TYR HN . 17034 2 324 . 1 1 92 92 TYR HA H 1 5.48 0.02 . 1 . . . . 72 TYR HA . 17034 2 325 . 1 1 92 92 TYR HB2 H 1 2.55 0.02 . 2 . . . . 72 TYR HB1 . 17034 2 326 . 1 1 92 92 TYR HB3 H 1 2.48 0.02 . 2 . . . . 72 TYR HB2 . 17034 2 327 . 1 1 92 92 TYR N N 15 120.893 0.20 . 1 . . . . 72 TYR N . 17034 2 328 . 1 1 93 93 TYR H H 1 8.5 0.02 . 1 . . . . 73 TYR HN . 17034 2 329 . 1 1 93 93 TYR HA H 1 4.83 0.02 . 1 . . . . 73 TYR HA . 17034 2 330 . 1 1 93 93 TYR HB2 H 1 2.85 0.02 . 2 . . . . 73 TYR HB1 . 17034 2 331 . 1 1 93 93 TYR HB3 H 1 2.58 0.02 . 2 . . . . 73 TYR HB2 . 17034 2 332 . 1 1 93 93 TYR N N 15 111.6 0.20 . 1 . . . . 73 TYR N . 17034 2 333 . 1 1 94 94 ARG H H 1 7.952 0.02 . 1 . . . . 74 ARG HN . 17034 2 334 . 1 1 94 94 ARG HA H 1 4.64 0.02 . 1 . . . . 74 ARG HA . 17034 2 335 . 1 1 94 94 ARG HB2 H 1 1.83 0.02 . 2 . . . . 74 ARG HB2 . 17034 2 336 . 1 1 94 94 ARG N N 15 120.497 0.20 . 1 . . . . 74 ARG N . 17034 2 337 . 1 1 96 96 VAL H H 1 8.488 0.02 . 1 . . . . 76 VAL HN . 17034 2 338 . 1 1 96 96 VAL HA H 1 4.45 0.02 . 1 . . . . 76 VAL HA . 17034 2 339 . 1 1 96 96 VAL HG21 H 1 0.96 0.02 . 2 . . . . 76 VAL HG21 . 17034 2 340 . 1 1 96 96 VAL HG22 H 1 0.96 0.02 . 2 . . . . 76 VAL HG21 . 17034 2 341 . 1 1 96 96 VAL HG23 H 1 0.96 0.02 . 2 . . . . 76 VAL HG21 . 17034 2 342 . 1 1 96 96 VAL N N 15 119.147 0.20 . 1 . . . . 76 VAL N . 17034 2 343 . 1 1 97 97 ASP H H 1 8.181 0.02 . 1 . . . . 77 ASP HN . 17034 2 344 . 1 1 97 97 ASP HA H 1 4.48 0.02 . 1 . . . . 77 ASP HA . 17034 2 345 . 1 1 97 97 ASP HB2 H 1 2.98 0.02 . 2 . . . . 77 ASP HB1 . 17034 2 346 . 1 1 97 97 ASP HB3 H 1 2.5 0.02 . 2 . . . . 77 ASP HB2 . 17034 2 347 . 1 1 97 97 ASP N N 15 117.121 0.20 . 1 . . . . 77 ASP N . 17034 2 348 . 1 1 98 98 GLN H H 1 8.169 0.02 . 1 . . . . 78 GLN HN . 17034 2 349 . 1 1 98 98 GLN HA H 1 4.12 0.02 . 1 . . . . 78 GLN HA . 17034 2 350 . 1 1 98 98 GLN HB2 H 1 1.75 0.02 . 2 . . . . 78 GLN HB2 . 17034 2 351 . 1 1 98 98 GLN N N 15 117.981 0.20 . 1 . . . . 78 GLN N . 17034 2 352 . 1 1 99 99 TYR H H 1 7.856 0.02 . 1 . . . . 79 TYR HN . 17034 2 353 . 1 1 99 99 TYR HA H 1 4.81 0.02 . 1 . . . . 79 TYR HA . 17034 2 354 . 1 1 99 99 TYR HB2 H 1 3.25 0.02 . 2 . . . . 79 TYR HB1 . 17034 2 355 . 1 1 99 99 TYR HB3 H 1 3.0 0.02 . 2 . . . . 79 TYR HB2 . 17034 2 356 . 1 1 99 99 TYR N N 15 117.001 0.20 . 1 . . . . 79 TYR N . 17034 2 357 . 1 1 100 100 ASN H H 1 8.872 0.02 . 1 . . . . 80 ASN HN . 17034 2 358 . 1 1 100 100 ASN HA H 1 4.84 0.02 . 1 . . . . 80 ASN HA . 17034 2 359 . 1 1 100 100 ASN HB2 H 1 2.94 0.02 . 2 . . . . 80 ASN HB2 . 17034 2 360 . 1 1 100 100 ASN N N 15 117.491 0.20 . 1 . . . . 80 ASN N . 17034 2 361 . 1 1 101 101 ASN H H 1 7.609 0.02 . 1 . . . . 81 ASN HN . 17034 2 362 . 1 1 101 101 ASN HA H 1 4.75 0.02 . 1 . . . . 81 ASN HA . 17034 2 363 . 1 1 101 101 ASN HB2 H 1 3.23 0.02 . 2 . . . . 81 ASN HB1 . 17034 2 364 . 1 1 101 101 ASN HB3 H 1 3.06 0.02 . 2 . . . . 81 ASN HB2 . 17034 2 365 . 1 1 101 101 ASN N N 15 113.672 0.20 . 1 . . . . 81 ASN N . 17034 2 366 . 1 1 102 102 GLN H H 1 8.631 0.02 . 1 . . . . 82 GLN HN . 17034 2 367 . 1 1 102 102 GLN HA H 1 2.98 0.02 . 1 . . . . 82 GLN HA . 17034 2 368 . 1 1 102 102 GLN N N 15 121.317 0.20 . 1 . . . . 82 GLN N . 17034 2 369 . 1 1 103 103 ASN H H 1 8.369 0.02 . 1 . . . . 83 ASN HN . 17034 2 370 . 1 1 103 103 ASN HA H 1 4.36 0.02 . 1 . . . . 83 ASN HA . 17034 2 371 . 1 1 103 103 ASN HB2 H 1 2.9 0.02 . 2 . . . . 83 ASN HB1 . 17034 2 372 . 1 1 103 103 ASN HB3 H 1 2.7 0.02 . 2 . . . . 83 ASN HB2 . 17034 2 373 . 1 1 103 103 ASN N N 15 117.516 0.20 . 1 . . . . 83 ASN N . 17034 2 374 . 1 1 104 104 ASN H H 1 8.455 0.02 . 1 . . . . 84 ASN HN . 17034 2 375 . 1 1 104 104 ASN HA H 1 4.54 0.02 . 1 . . . . 84 ASN HA . 17034 2 376 . 1 1 104 104 ASN HB2 H 1 3.15 0.02 . 2 . . . . 84 ASN HB1 . 17034 2 377 . 1 1 104 104 ASN HB3 H 1 2.95 0.02 . 2 . . . . 84 ASN HB2 . 17034 2 378 . 1 1 104 104 ASN N N 15 118.478 0.20 . 1 . . . . 84 ASN N . 17034 2 379 . 1 1 105 105 PHE H H 1 7.26 0.02 . 1 . . . . 85 PHE HN . 17034 2 380 . 1 1 105 105 PHE HA H 1 2.96 0.02 . 1 . . . . 85 PHE HA . 17034 2 381 . 1 1 105 105 PHE HB2 H 1 2.51 0.02 . 2 . . . . 85 PHE HB2 . 17034 2 382 . 1 1 105 105 PHE N N 15 121.305 0.20 . 1 . . . . 85 PHE N . 17034 2 383 . 1 1 106 106 VAL H H 1 8.778 0.02 . 1 . . . . 86 VAL HN . 17034 2 384 . 1 1 106 106 VAL HA H 1 3.34 0.02 . 1 . . . . 86 VAL HA . 17034 2 385 . 1 1 106 106 VAL HB H 1 2.21 0.02 . 1 . . . . 86 VAL HB . 17034 2 386 . 1 1 106 106 VAL HG21 H 1 1.04 0.02 . 2 . . . . 86 VAL HG21 . 17034 2 387 . 1 1 106 106 VAL HG22 H 1 1.04 0.02 . 2 . . . . 86 VAL HG21 . 17034 2 388 . 1 1 106 106 VAL HG23 H 1 1.04 0.02 . 2 . . . . 86 VAL HG21 . 17034 2 389 . 1 1 106 106 VAL N N 15 120.153 0.20 . 1 . . . . 86 VAL N . 17034 2 390 . 1 1 107 107 HIS H H 1 8.35 0.02 . 1 . . . . 87 HIS HN . 17034 2 391 . 1 1 107 107 HIS HA H 1 4.42 0.02 . 1 . . . . 87 HIS HA . 17034 2 392 . 1 1 107 107 HIS HB2 H 1 3.81 0.02 . 2 . . . . 87 HIS HB2 . 17034 2 393 . 1 1 107 107 HIS N N 15 116.834 0.20 . 1 . . . . 87 HIS N . 17034 2 394 . 1 1 108 108 ASP H H 1 7.65 0.02 . 1 . . . . 88 ASP HN . 17034 2 395 . 1 1 108 108 ASP HA H 1 4.58 0.02 . 1 . . . . 88 ASP HA . 17034 2 396 . 1 1 108 108 ASP HB2 H 1 2.95 0.02 . 2 . . . . 88 ASP HB1 . 17034 2 397 . 1 1 108 108 ASP HB3 H 1 3.38 0.02 . 2 . . . . 88 ASP HB2 . 17034 2 398 . 1 1 108 108 ASP N N 15 118.8 0.20 . 1 . . . . 88 ASP N . 17034 2 399 . 1 1 109 109 CYS H H 1 8.105 0.02 . 1 . . . . 89 CYS HN . 17034 2 400 . 1 1 109 109 CYS HA H 1 4.65 0.02 . 1 . . . . 89 CYS HA . 17034 2 401 . 1 1 109 109 CYS HB2 H 1 3.3 0.02 . 2 . . . . 89 CYS HB1 . 17034 2 402 . 1 1 109 109 CYS HB3 H 1 2.89 0.02 . 2 . . . . 89 CYS HB2 . 17034 2 403 . 1 1 109 109 CYS N N 15 119.439 0.20 . 1 . . . . 89 CYS N . 17034 2 404 . 1 1 110 110 VAL H H 1 9.108 0.02 . 1 . . . . 90 VAL HN . 17034 2 405 . 1 1 110 110 VAL HA H 1 3.63 0.02 . 1 . . . . 90 VAL HA . 17034 2 406 . 1 1 110 110 VAL HB H 1 2.16 0.02 . 1 . . . . 90 VAL HB . 17034 2 407 . 1 1 110 110 VAL HG11 H 1 1.01 0.02 . 2 . . . . 90 VAL HG11 . 17034 2 408 . 1 1 110 110 VAL HG12 H 1 1.01 0.02 . 2 . . . . 90 VAL HG11 . 17034 2 409 . 1 1 110 110 VAL HG13 H 1 1.01 0.02 . 2 . . . . 90 VAL HG11 . 17034 2 410 . 1 1 110 110 VAL HG21 H 1 1.12 0.02 . 2 . . . . 90 VAL HG21 . 17034 2 411 . 1 1 110 110 VAL HG22 H 1 1.12 0.02 . 2 . . . . 90 VAL HG21 . 17034 2 412 . 1 1 110 110 VAL HG23 H 1 1.12 0.02 . 2 . . . . 90 VAL HG21 . 17034 2 413 . 1 1 110 110 VAL N N 15 125.0 0.20 . 1 . . . . 90 VAL N . 17034 2 414 . 1 1 111 111 ASN H H 1 7.688 0.02 . 1 . . . . 91 ASN HN . 17034 2 415 . 1 1 111 111 ASN HA H 1 4.33 0.02 . 1 . . . . 91 ASN HA . 17034 2 416 . 1 1 111 111 ASN HB2 H 1 2.81 0.02 . 2 . . . . 91 ASN HB2 . 17034 2 417 . 1 1 111 111 ASN N N 15 116.806 0.20 . 1 . . . . 91 ASN N . 17034 2 418 . 1 1 112 112 ILE H H 1 8.727 0.02 . 1 . . . . 92 ILE HN . 17034 2 419 . 1 1 112 112 ILE HA H 1 3.69 0.02 . 1 . . . . 92 ILE HA . 17034 2 420 . 1 1 112 112 ILE HB H 1 1.57 0.02 . 1 . . . . 92 ILE HB . 17034 2 421 . 1 1 112 112 ILE N N 15 118.927 0.20 . 1 . . . . 92 ILE N . 17034 2 422 . 1 1 113 113 THR H H 1 8.18 0.02 . 1 . . . . 93 THR HN . 17034 2 423 . 1 1 113 113 THR HA H 1 4.11 0.02 . 1 . . . . 93 THR HA . 17034 2 424 . 1 1 113 113 THR HB H 1 4.45 0.02 . 1 . . . . 93 THR HB . 17034 2 425 . 1 1 113 113 THR HG21 H 1 1.5 0.02 . 1 . . . . 93 THR HG21 . 17034 2 426 . 1 1 113 113 THR HG22 H 1 1.5 0.02 . 1 . . . . 93 THR HG21 . 17034 2 427 . 1 1 113 113 THR HG23 H 1 1.5 0.02 . 1 . . . . 93 THR HG21 . 17034 2 428 . 1 1 113 113 THR N N 15 118.197 0.20 . 1 . . . . 93 THR N . 17034 2 429 . 1 1 114 114 ILE H H 1 8.55 0.02 . 1 . . . . 94 ILE HN . 17034 2 430 . 1 1 114 114 ILE HA H 1 3.7 0.02 . 1 . . . . 94 ILE HA . 17034 2 431 . 1 1 114 114 ILE HB H 1 2.09 0.02 . 1 . . . . 94 ILE HB . 17034 2 432 . 1 1 114 114 ILE HD11 H 1 0.81 0.02 . 1 . . . . 94 ILE HD11 . 17034 2 433 . 1 1 114 114 ILE HD12 H 1 0.81 0.02 . 1 . . . . 94 ILE HD11 . 17034 2 434 . 1 1 114 114 ILE HD13 H 1 0.81 0.02 . 1 . . . . 94 ILE HD11 . 17034 2 435 . 1 1 114 114 ILE HG12 H 1 1.21 0.02 . 1 . . . . 94 ILE HG11 . 17034 2 436 . 1 1 114 114 ILE HG13 H 1 1.84 0.02 . 1 . . . . 94 ILE HG12 . 17034 2 437 . 1 1 114 114 ILE HG21 H 1 0.93 0.02 . 2 . . . . 94 ILE HG21 . 17034 2 438 . 1 1 114 114 ILE HG22 H 1 0.83 0.02 . 2 . . . . 94 ILE HG21 . 17034 2 439 . 1 1 114 114 ILE HG23 H 1 0.83 0.02 . 2 . . . . 94 ILE HG21 . 17034 2 440 . 1 1 114 114 ILE N N 15 120.461 0.20 . 1 . . . . 94 ILE N . 17034 2 441 . 1 1 115 115 LYS H H 1 8.052 0.02 . 1 . . . . 95 LYS HN . 17034 2 442 . 1 1 115 115 LYS HA H 1 4.0 0.02 . 1 . . . . 95 LYS HA . 17034 2 443 . 1 1 115 115 LYS HB2 H 1 2.03 0.02 . 2 . . . . 95 LYS HB1 . 17034 2 444 . 1 1 115 115 LYS HB3 H 1 1.88 0.02 . 2 . . . . 95 LYS HB2 . 17034 2 445 . 1 1 115 115 LYS HG2 H 1 1.52 0.02 . 2 . . . . 95 LYS HG2 . 17034 2 446 . 1 1 115 115 LYS N N 15 122.335 0.20 . 1 . . . . 95 LYS N . 17034 2 447 . 1 1 116 116 GLN H H 1 8.195 0.02 . 1 . . . . 96 GLN HN . 17034 2 448 . 1 1 116 116 GLN HA H 1 4.01 0.02 . 1 . . . . 96 GLN HA . 17034 2 449 . 1 1 116 116 GLN HB2 H 1 1.99 0.02 . 2 . . . . 96 GLN HB1 . 17034 2 450 . 1 1 116 116 GLN HB3 H 1 1.87 0.02 . 2 . . . . 96 GLN HB2 . 17034 2 451 . 1 1 116 116 GLN HG2 H 1 2.07 0.02 . 2 . . . . 96 GLN HG1 . 17034 2 452 . 1 1 116 116 GLN HG3 H 1 1.48 0.02 . 2 . . . . 96 GLN HG2 . 17034 2 453 . 1 1 116 116 GLN N N 15 115.887 0.20 . 1 . . . . 96 GLN N . 17034 2 454 . 1 1 117 117 HIS H H 1 7.918 0.02 . 1 . . . . 97 HIS HN . 17034 2 455 . 1 1 117 117 HIS HA H 1 4.65 0.02 . 1 . . . . 97 HIS HA . 17034 2 456 . 1 1 117 117 HIS HB2 H 1 3.44 0.02 . 2 . . . . 97 HIS HB1 . 17034 2 457 . 1 1 117 117 HIS HB3 H 1 3.25 0.02 . 2 . . . . 97 HIS HB2 . 17034 2 458 . 1 1 117 117 HIS N N 15 115.978 0.20 . 1 . . . . 97 HIS N . 17034 2 459 . 1 1 118 118 THR H H 1 8.018 0.02 . 1 . . . . 98 THR HN . 17034 2 460 . 1 1 118 118 THR HA H 1 4.36 0.02 . 1 . . . . 98 THR HA . 17034 2 461 . 1 1 118 118 THR HB H 1 4.7 0.02 . 1 . . . . 98 THR HB . 17034 2 462 . 1 1 118 118 THR HG21 H 1 1.2 0.02 . 1 . . . . 98 THR HG21 . 17034 2 463 . 1 1 118 118 THR HG22 H 1 1.2 0.02 . 1 . . . . 98 THR HG21 . 17034 2 464 . 1 1 118 118 THR HG23 H 1 1.2 0.02 . 1 . . . . 98 THR HG21 . 17034 2 465 . 1 1 118 118 THR N N 15 112.559 0.20 . 1 . . . . 98 THR N . 17034 2 466 . 1 1 119 119 VAL H H 1 7.911 0.02 . 1 . . . . 99 VAL HN . 17034 2 467 . 1 1 119 119 VAL HA H 1 4.14 0.02 . 1 . . . . 99 VAL HA . 17034 2 468 . 1 1 119 119 VAL HB H 1 2.18 0.02 . 1 . . . . 99 VAL HB . 17034 2 469 . 1 1 119 119 VAL HG11 H 1 0.95 0.02 . 2 . . . . 99 VAL HG11 . 17034 2 470 . 1 1 119 119 VAL HG12 H 1 0.95 0.02 . 2 . . . . 99 VAL HG11 . 17034 2 471 . 1 1 119 119 VAL HG13 H 1 0.95 0.02 . 2 . . . . 99 VAL HG11 . 17034 2 472 . 1 1 119 119 VAL HG21 H 1 0.95 0.02 . 2 . . . . 99 VAL HG21 . 17034 2 473 . 1 1 119 119 VAL HG22 H 1 0.95 0.02 . 2 . . . . 99 VAL HG21 . 17034 2 474 . 1 1 119 119 VAL HG23 H 1 0.95 0.02 . 2 . . . . 99 VAL HG21 . 17034 2 475 . 1 1 119 119 VAL N N 15 121.555 0.20 . 1 . . . . 99 VAL N . 17034 2 476 . 1 1 120 120 THR H H 1 8.009 0.02 . 1 . . . . 100 THR HN . 17034 2 477 . 1 1 120 120 THR HA H 1 4.33 0.02 . 1 . . . . 100 THR HA . 17034 2 478 . 1 1 120 120 THR HG21 H 1 1.2 0.02 . 1 . . . . 100 THR HG21 . 17034 2 479 . 1 1 120 120 THR HG22 H 1 1.2 0.02 . 1 . . . . 100 THR HG21 . 17034 2 480 . 1 1 120 120 THR HG23 H 1 1.2 0.02 . 1 . . . . 100 THR HG21 . 17034 2 481 . 1 1 120 120 THR N N 15 115.505 0.20 . 1 . . . . 100 THR N . 17034 2 482 . 1 1 121 121 THR H H 1 7.974 0.02 . 1 . . . . 101 THR HN . 17034 2 483 . 1 1 121 121 THR HA H 1 4.28 0.02 . 1 . . . . 101 THR HA . 17034 2 484 . 1 1 121 121 THR HG21 H 1 1.15 0.02 . 1 . . . . 101 THR HG21 . 17034 2 485 . 1 1 121 121 THR HG22 H 1 1.15 0.02 . 1 . . . . 101 THR HG21 . 17034 2 486 . 1 1 121 121 THR HG23 H 1 1.15 0.02 . 1 . . . . 101 THR HG21 . 17034 2 487 . 1 1 121 121 THR N N 15 115.089 0.20 . 1 . . . . 101 THR N . 17034 2 488 . 1 1 122 122 THR H H 1 8.101 0.02 . 1 . . . . 102 THR HN . 17034 2 489 . 1 1 122 122 THR HA H 1 4.32 0.02 . 1 . . . . 102 THR HA . 17034 2 490 . 1 1 122 122 THR HG21 H 1 1.18 0.02 . 1 . . . . 102 THR HG21 . 17034 2 491 . 1 1 122 122 THR HG22 H 1 1.18 0.02 . 1 . . . . 102 THR HG21 . 17034 2 492 . 1 1 122 122 THR HG23 H 1 1.18 0.02 . 1 . . . . 102 THR HG21 . 17034 2 493 . 1 1 122 122 THR N N 15 115.372 0.20 . 1 . . . . 102 THR N . 17034 2 494 . 1 1 123 123 THR H H 1 7.991 0.02 . 1 . . . . 103 THR HN . 17034 2 495 . 1 1 123 123 THR HA H 1 4.27 0.02 . 1 . . . . 103 THR HA . 17034 2 496 . 1 1 123 123 THR HB H 1 4.37 0.02 . 1 . . . . 103 THR HB . 17034 2 497 . 1 1 123 123 THR HG21 H 1 1.22 0.02 . 1 . . . . 103 THR HG21 . 17034 2 498 . 1 1 123 123 THR HG22 H 1 1.22 0.02 . 1 . . . . 103 THR HG21 . 17034 2 499 . 1 1 123 123 THR HG23 H 1 1.22 0.02 . 1 . . . . 103 THR HG21 . 17034 2 500 . 1 1 123 123 THR N N 15 115.642 0.20 . 1 . . . . 103 THR N . 17034 2 501 . 1 1 124 124 LYS H H 1 8.088 0.02 . 1 . . . . 104 LYS HN . 17034 2 502 . 1 1 124 124 LYS HA H 1 4.36 0.02 . 1 . . . . 104 LYS HA . 17034 2 503 . 1 1 124 124 LYS HB2 H 1 1.86 0.02 . 2 . . . . 104 LYS HB2 . 17034 2 504 . 1 1 124 124 LYS HE2 H 1 3.38 0.02 . 2 . . . . 104 LYS HE2 . 17034 2 505 . 1 1 124 124 LYS HG2 H 1 1.54 0.02 . 2 . . . . 104 LYS HG2 . 17034 2 506 . 1 1 124 124 LYS N N 15 121.976 0.20 . 1 . . . . 104 LYS N . 17034 2 507 . 1 1 125 125 GLY H H 1 8.229 0.02 . 1 . . . . 105 GLY HN . 17034 2 508 . 1 1 125 125 GLY HA2 H 1 4.3 0.02 . 2 . . . . 105 GLY HA1 . 17034 2 509 . 1 1 125 125 GLY HA3 H 1 3.9 0.02 . 2 . . . . 105 GLY HA2 . 17034 2 510 . 1 1 125 125 GLY N N 15 109.631 0.20 . 1 . . . . 105 GLY N . 17034 2 511 . 1 1 126 126 GLU H H 1 7.899 0.02 . 1 . . . . 106 GLU HN . 17034 2 512 . 1 1 126 126 GLU HA H 1 4.3 0.02 . 1 . . . . 106 GLU HA . 17034 2 513 . 1 1 126 126 GLU HB2 H 1 1.8 0.02 . 2 . . . . 106 GLU HB2 . 17034 2 514 . 1 1 126 126 GLU HG2 H 1 2.35 0.02 . 2 . . . . 106 GLU HG1 . 17034 2 515 . 1 1 126 126 GLU HG3 H 1 2.21 0.02 . 2 . . . . 106 GLU HG2 . 17034 2 516 . 1 1 126 126 GLU N N 15 119.666 0.20 . 1 . . . . 106 GLU N . 17034 2 517 . 1 1 127 127 ASN H H 1 8.42 0.02 . 1 . . . . 107 ASN HN . 17034 2 518 . 1 1 127 127 ASN HA H 1 4.66 0.02 . 1 . . . . 107 ASN HA . 17034 2 519 . 1 1 127 127 ASN HB2 H 1 2.75 0.02 . 2 . . . . 107 ASN HB2 . 17034 2 520 . 1 1 127 127 ASN N N 15 119.6 0.20 . 1 . . . . 107 ASN N . 17034 2 521 . 1 1 128 128 PHE H H 1 8.43 0.02 . 1 . . . . 108 PHE HN . 17034 2 522 . 1 1 128 128 PHE HA H 1 5.14 0.02 . 1 . . . . 108 PHE HA . 17034 2 523 . 1 1 128 128 PHE HB2 H 1 3.0 0.02 . 2 . . . . 108 PHE HB2 . 17034 2 524 . 1 1 128 128 PHE N N 15 121.1 0.20 . 1 . . . . 108 PHE N . 17034 2 525 . 1 1 129 129 THR H H 1 9.385 0.02 . 1 . . . . 109 THR HN . 17034 2 526 . 1 1 129 129 THR HA H 1 4.61 0.02 . 1 . . . . 109 THR HA . 17034 2 527 . 1 1 129 129 THR HG21 H 1 1.4 0.02 . 1 . . . . 109 THR HG21 . 17034 2 528 . 1 1 129 129 THR HG22 H 1 1.4 0.02 . 1 . . . . 109 THR HG21 . 17034 2 529 . 1 1 129 129 THR HG23 H 1 1.4 0.02 . 1 . . . . 109 THR HG21 . 17034 2 530 . 1 1 129 129 THR N N 15 115.639 0.20 . 1 . . . . 109 THR N . 17034 2 531 . 1 1 130 130 GLU H H 1 9.006 0.02 . 1 . . . . 110 GLU HN . 17034 2 532 . 1 1 130 130 GLU HA H 1 4.1 0.02 . 1 . . . . 110 GLU HA . 17034 2 533 . 1 1 130 130 GLU HB2 H 1 2.13 0.02 . 2 . . . . 110 GLU HB1 . 17034 2 534 . 1 1 130 130 GLU HB3 H 1 1.99 0.02 . 2 . . . . 110 GLU HB2 . 17034 2 535 . 1 1 130 130 GLU HG2 H 1 2.42 0.02 . 2 . . . . 110 GLU HG2 . 17034 2 536 . 1 1 130 130 GLU N N 15 119.892 0.20 . 1 . . . . 110 GLU N . 17034 2 537 . 1 1 131 131 THR H H 1 7.908 0.02 . 1 . . . . 111 THR HN . 17034 2 538 . 1 1 131 131 THR HA H 1 3.8 0.02 . 1 . . . . 111 THR HA . 17034 2 539 . 1 1 131 131 THR HB H 1 3.8 0.02 . 1 . . . . 111 THR HB . 17034 2 540 . 1 1 131 131 THR HG21 H 1 0.8 0.02 . 1 . . . . 111 THR HG21 . 17034 2 541 . 1 1 131 131 THR HG22 H 1 0.8 0.02 . 1 . . . . 111 THR HG21 . 17034 2 542 . 1 1 131 131 THR HG23 H 1 0.8 0.02 . 1 . . . . 111 THR HG21 . 17034 2 543 . 1 1 131 131 THR N N 15 116.11 0.20 . 1 . . . . 111 THR N . 17034 2 544 . 1 1 132 132 ASP H H 1 7.537 0.02 . 1 . . . . 112 ASP HN . 17034 2 545 . 1 1 132 132 ASP HA H 1 4.53 0.02 . 1 . . . . 112 ASP HA . 17034 2 546 . 1 1 132 132 ASP HB2 H 1 2.58 0.02 . 2 . . . . 112 ASP HB1 . 17034 2 547 . 1 1 132 132 ASP HB3 H 1 3.27 0.02 . 2 . . . . 112 ASP HB2 . 17034 2 548 . 1 1 132 132 ASP N N 15 119.592 0.20 . 1 . . . . 112 ASP N . 17034 2 549 . 1 1 133 133 ILE H H 1 8.13 0.02 . 1 . . . . 113 ILE HN . 17034 2 550 . 1 1 133 133 ILE N N 15 119.8 0.20 . 1 . . . . 113 ILE N . 17034 2 551 . 1 1 134 134 LYS H H 1 7.887 0.02 . 1 . . . . 114 LYS HN . 17034 2 552 . 1 1 134 134 LYS HA H 1 4.04 0.02 . 1 . . . . 114 LYS HA . 17034 2 553 . 1 1 134 134 LYS HB2 H 1 2.25 0.02 . 2 . . . . 114 LYS HB2 . 17034 2 554 . 1 1 134 134 LYS HD2 H 1 1.81 0.02 . 2 . . . . 114 LYS HD2 . 17034 2 555 . 1 1 134 134 LYS HG2 H 1 1.6 0.02 . 2 . . . . 114 LYS HG2 . 17034 2 556 . 1 1 134 134 LYS N N 15 119.708 0.20 . 1 . . . . 114 LYS N . 17034 2 557 . 1 1 135 135 ILE H H 1 7.968 0.02 . 1 . . . . 115 ILE HN . 17034 2 558 . 1 1 135 135 ILE N N 15 120.044 0.20 . 1 . . . . 115 ILE N . 17034 2 559 . 1 1 136 136 MET H H 1 8.809 0.02 . 1 . . . . 116 MET HN . 17034 2 560 . 1 1 136 136 MET HA H 1 3.57 0.02 . 1 . . . . 116 MET HA . 17034 2 561 . 1 1 136 136 MET HB2 H 1 2.15 0.02 . 2 . . . . 116 MET HB1 . 17034 2 562 . 1 1 136 136 MET HB3 H 1 1.9 0.02 . 2 . . . . 116 MET HB2 . 17034 2 563 . 1 1 136 136 MET N N 15 119.3 0.20 . 1 . . . . 116 MET N . 17034 2 564 . 1 1 137 137 GLU H H 1 8.521 0.02 . 1 . . . . 117 GLU HN . 17034 2 565 . 1 1 137 137 GLU N N 15 117.5 0.20 . 1 . . . . 117 GLU N . 17034 2 566 . 1 1 138 138 ARG H H 1 7.238 0.02 . 1 . . . . 118 ARG HN . 17034 2 567 . 1 1 138 138 ARG HA H 1 4.15 0.02 . 1 . . . . 118 ARG HA . 17034 2 568 . 1 1 138 138 ARG HB2 H 1 2.09 0.02 . 2 . . . . 118 ARG HB2 . 17034 2 569 . 1 1 138 138 ARG N N 15 117.461 0.20 . 1 . . . . 118 ARG N . 17034 2 570 . 1 1 139 139 VAL H H 1 8.444 0.02 . 1 . . . . 119 VAL HN . 17034 2 571 . 1 1 139 139 VAL N N 15 120.706 0.20 . 1 . . . . 119 VAL N . 17034 2 572 . 1 1 140 140 VAL H H 1 9.098 0.02 . 1 . . . . 120 VAL HN . 17034 2 573 . 1 1 140 140 VAL HA H 1 3.67 0.02 . 1 . . . . 120 VAL HA . 17034 2 574 . 1 1 140 140 VAL HB H 1 2.15 0.02 . 1 . . . . 120 VAL HB . 17034 2 575 . 1 1 140 140 VAL HG21 H 1 1.02 0.02 . 2 . . . . 120 VAL HG21 . 17034 2 576 . 1 1 140 140 VAL HG22 H 1 1.02 0.02 . 2 . . . . 120 VAL HG21 . 17034 2 577 . 1 1 140 140 VAL HG23 H 1 1.02 0.02 . 2 . . . . 120 VAL HG21 . 17034 2 578 . 1 1 140 140 VAL N N 15 119.78 0.20 . 1 . . . . 120 VAL N . 17034 2 579 . 1 1 141 141 GLU H H 1 8.087 0.02 . 1 . . . . 121 GLU HN . 17034 2 580 . 1 1 141 141 GLU HA H 1 3.63 0.02 . 1 . . . . 121 GLU HA . 17034 2 581 . 1 1 141 141 GLU HB2 H 1 2.31 0.02 . 2 . . . . 121 GLU HB1 . 17034 2 582 . 1 1 141 141 GLU HG2 H 1 2.11 0.02 . 2 . . . . 121 GLU HG2 . 17034 2 583 . 1 1 141 141 GLU N N 15 121.667 0.20 . 1 . . . . 121 GLU N . 17034 2 584 . 1 1 142 142 GLN H H 1 7.55 0.02 . 1 . . . . 122 GLN HN . 17034 2 585 . 1 1 142 142 GLN N N 15 120.378 0.20 . 1 . . . . 122 GLN N . 17034 2 586 . 1 1 143 143 MET H H 1 8.365 0.02 . 1 . . . . 123 MET HN . 17034 2 587 . 1 1 143 143 MET N N 15 120.425 0.20 . 1 . . . . 123 MET N . 17034 2 588 . 1 1 144 144 CYS H H 1 9.406 0.02 . 1 . . . . 124 CYS HN . 17034 2 589 . 1 1 144 144 CYS N N 15 118.098 0.20 . 1 . . . . 124 CYS N . 17034 2 590 . 1 1 145 145 THR H H 1 8.134 0.02 . 1 . . . . 125 THR HN . 17034 2 591 . 1 1 145 145 THR HA H 1 3.85 0.02 . 1 . . . . 125 THR HA . 17034 2 592 . 1 1 145 145 THR HB H 1 4.53 0.02 . 1 . . . . 125 THR HB . 17034 2 593 . 1 1 145 145 THR HG21 H 1 1.25 0.02 . 1 . . . . 125 THR HG21 . 17034 2 594 . 1 1 145 145 THR HG22 H 1 1.25 0.02 . 1 . . . . 125 THR HG21 . 17034 2 595 . 1 1 145 145 THR HG23 H 1 1.25 0.02 . 1 . . . . 125 THR HG21 . 17034 2 596 . 1 1 145 145 THR N N 15 119.777 0.20 . 1 . . . . 125 THR N . 17034 2 597 . 1 1 146 146 THR H H 1 8.255 0.02 . 1 . . . . 126 THR HN . 17034 2 598 . 1 1 146 146 THR N N 15 120.972 0.20 . 1 . . . . 126 THR N . 17034 2 599 . 1 1 147 147 GLN H H 1 8.625 0.02 . 1 . . . . 127 GLN HN . 17034 2 600 . 1 1 147 147 GLN N N 15 122.265 0.20 . 1 . . . . 127 GLN N . 17034 2 601 . 1 1 148 148 TYR H H 1 8.37 0.02 . 1 . . . . 128 TYR HN . 17034 2 602 . 1 1 148 148 TYR HA H 1 2.96 0.02 . 1 . . . . 128 TYR HA . 17034 2 603 . 1 1 148 148 TYR HB2 H 1 3.02 0.02 . 2 . . . . 128 TYR HB1 . 17034 2 604 . 1 1 148 148 TYR HB3 H 1 2.85 0.02 . 2 . . . . 128 TYR HB2 . 17034 2 605 . 1 1 148 148 TYR N N 15 119.171 0.20 . 1 . . . . 128 TYR N . 17034 2 606 . 1 1 149 149 GLN H H 1 7.926 0.02 . 1 . . . . 129 GLN HN . 17034 2 607 . 1 1 149 149 GLN N N 15 119.602 0.20 . 1 . . . . 129 GLN N . 17034 2 608 . 1 1 150 150 LYS H H 1 7.964 0.02 . 1 . . . . 130 LYS HN . 17034 2 609 . 1 1 150 150 LYS N N 15 118.69 0.20 . 1 . . . . 130 LYS N . 17034 2 610 . 1 1 151 151 GLU H H 1 8.114 0.02 . 1 . . . . 131 GLU HN . 17034 2 611 . 1 1 151 151 GLU N N 15 117.0 0.20 . 1 . . . . 131 GLU N . 17034 2 612 . 1 1 152 152 SER H H 1 8.196 0.02 . 1 . . . . 132 SER HN . 17034 2 613 . 1 1 152 152 SER N N 15 115.142 0.20 . 1 . . . . 132 SER N . 17034 2 614 . 1 1 153 153 GLN H H 1 7.624 0.02 . 1 . . . . 133 GLN HN . 17034 2 615 . 1 1 153 153 GLN N N 15 120.664 0.20 . 1 . . . . 133 GLN N . 17034 2 616 . 1 1 154 154 ALA H H 1 7.599 0.02 . 1 . . . . 134 ALA HN . 17034 2 617 . 1 1 154 154 ALA N N 15 121.264 0.20 . 1 . . . . 134 ALA N . 17034 2 618 . 1 1 155 155 TYR H H 1 7.861 0.02 . 1 . . . . 135 TYR HN . 17034 2 619 . 1 1 155 155 TYR N N 15 118.511 0.20 . 1 . . . . 135 TYR N . 17034 2 620 . 1 1 156 156 TYR H H 1 8.042 0.02 . 1 . . . . 136 TYR HN . 17034 2 621 . 1 1 156 156 TYR HA H 1 4.32 0.02 . 1 . . . . 136 TYR HA . 17034 2 622 . 1 1 156 156 TYR N N 15 119.492 0.20 . 1 . . . . 136 TYR N . 17034 2 623 . 1 1 157 157 ASP H H 1 8.142 0.02 . 1 . . . . 137 ASP HN . 17034 2 624 . 1 1 157 157 ASP N N 15 120.213 0.20 . 1 . . . . 137 ASP N . 17034 2 625 . 1 1 158 158 GLY H H 1 7.832 0.02 . 1 . . . . 138 GLY HN . 17034 2 626 . 1 1 158 158 GLY N N 15 108.049 0.20 . 1 . . . . 138 GLY N . 17034 2 627 . 1 1 159 159 ARG H H 1 7.849 0.02 . 1 . . . . 139 ARG HN . 17034 2 628 . 1 1 159 159 ARG HA H 1 4.3 0.02 . 1 . . . . 139 ARG HA . 17034 2 629 . 1 1 159 159 ARG N N 15 120.018 0.20 . 1 . . . . 139 ARG N . 17034 2 630 . 1 1 160 160 ARG H H 1 8.383 0.02 . 1 . . . . 140 ARG HN . 17034 2 631 . 1 1 160 160 ARG N N 15 122.723 0.20 . 1 . . . . 140 ARG N . 17034 2 632 . 1 1 161 161 SER H H 1 7.951 0.02 . 1 . . . . 141 SER HN . 17034 2 633 . 1 1 161 161 SER N N 15 122.225 0.20 . 1 . . . . 141 SER N . 17034 2 stop_ save_ save_assigned_chem_shift_list_3 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_3 _Assigned_chem_shift_list.Entry_ID 17034 _Assigned_chem_shift_list.ID 3 _Assigned_chem_shift_list.Sample_condition_list_ID 3 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_3 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 9 '2D 1H-15N HSQC' . . . 17034 3 10 '3D HNHA' . . . 17034 3 11 '3D 1H-15N TOCSY' . . . 17034 3 12 '3D 1H-15N NOESY' . . . 17034 3 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 21 21 GLN HA H 1 4.37 0.02 . 1 . . . . 1 GLN HA . 17034 3 2 . 1 1 21 21 GLN HB2 H 1 1.98 0.02 . 2 . . . . 1 GLN HB1 . 17034 3 3 . 1 1 21 21 GLN HB3 H 1 2.04 0.02 . 2 . . . . 1 GLN HB2 . 17034 3 4 . 1 1 21 21 GLN HG2 H 1 2.34 0.02 . 2 . . . . 1 GLN HG1 . 17034 3 5 . 1 1 21 21 GLN HG3 H 1 2.13 0.02 . 2 . . . . 1 GLN HG2 . 17034 3 6 . 1 1 21 21 GLN N N 15 119.662 0.20 . 1 . . . . 1 GLN N . 17034 3 7 . 1 1 22 22 GLY H H 1 8.597 0.02 . 1 . . . . 2 GLY HN . 17034 3 8 . 1 1 22 22 GLY HA2 H 1 4.01 0.02 . 2 . . . . 2 GLY HA2 . 17034 3 9 . 1 1 22 22 GLY N N 15 110.788 0.20 . 1 . . . . 2 GLY N . 17034 3 10 . 1 1 23 23 GLY H H 1 8.329 0.02 . 1 . . . . 3 GLY HN . 17034 3 11 . 1 1 23 23 GLY HA2 H 1 3.93 0.02 . 2 . . . . 3 GLY HA2 . 17034 3 12 . 1 1 23 23 GLY N N 15 108.498 0.20 . 1 . . . . 3 GLY N . 17034 3 13 . 1 1 24 24 GLY H H 1 8.257 0.02 . 1 . . . . 4 GLY HN . 17034 3 14 . 1 1 24 24 GLY HA2 H 1 3.85 0.02 . 2 . . . . 4 GLY HA2 . 17034 3 15 . 1 1 24 24 GLY N N 15 108.838 0.20 . 1 . . . . 4 GLY N . 17034 3 16 . 1 1 25 25 THR H H 1 8.041 0.02 . 1 . . . . 5 THR HN . 17034 3 17 . 1 1 25 25 THR HA H 1 4.25 0.02 . 1 . . . . 5 THR HA . 17034 3 18 . 1 1 25 25 THR HB H 1 4.11 0.02 . 1 . . . . 5 THR HB . 17034 3 19 . 1 1 25 25 THR HG21 H 1 1.12 0.02 . 1 . . . . 5 THR HG21 . 17034 3 20 . 1 1 25 25 THR HG22 H 1 1.12 0.02 . 1 . . . . 5 THR HG21 . 17034 3 21 . 1 1 25 25 THR HG23 H 1 1.12 0.02 . 1 . . . . 5 THR HG21 . 17034 3 22 . 1 1 25 25 THR N N 15 113.136 0.20 . 1 . . . . 5 THR N . 17034 3 23 . 1 1 26 26 HIS H H 1 8.577 0.02 . 1 . . . . 6 HIS HN . 17034 3 24 . 1 1 26 26 HIS HA H 1 4.71 0.02 . 1 . . . . 6 HIS HA . 17034 3 25 . 1 1 26 26 HIS HB2 H 1 3.2 0.02 . 2 . . . . 6 HIS HB2 . 17034 3 26 . 1 1 26 26 HIS N N 15 120.332 0.20 . 1 . . . . 6 HIS N . 17034 3 27 . 1 1 27 27 ASN H H 1 8.372 0.02 . 1 . . . . 7 ASN HN . 17034 3 28 . 1 1 27 27 ASN HA H 1 4.6 0.02 . 1 . . . . 7 ASN HA . 17034 3 29 . 1 1 27 27 ASN HB2 H 1 2.63 0.02 . 2 . . . . 7 ASN HB2 . 17034 3 30 . 1 1 27 27 ASN N N 15 119.847 0.20 . 1 . . . . 7 ASN N . 17034 3 31 . 1 1 28 28 GLN H H 1 8.331 0.02 . 1 . . . . 8 GLN HN . 17034 3 32 . 1 1 28 28 GLN HA H 1 4.21 0.02 . 1 . . . . 8 GLN HA . 17034 3 33 . 1 1 28 28 GLN HB2 H 1 2.0 0.02 . 2 . . . . 8 GLN HB1 . 17034 3 34 . 1 1 28 28 GLN HB3 H 1 1.81 0.02 . 2 . . . . 8 GLN HB2 . 17034 3 35 . 1 1 28 28 GLN HG2 H 1 2.17 0.02 . 2 . . . . 8 GLN HG2 . 17034 3 36 . 1 1 28 28 GLN N N 15 120.587 0.20 . 1 . . . . 8 GLN N . 17034 3 37 . 1 1 29 29 TRP H H 1 8.088 0.02 . 1 . . . . 9 TRP HN . 17034 3 38 . 1 1 29 29 TRP HA H 1 4.66 0.02 . 1 . . . . 9 TRP HA . 17034 3 39 . 1 1 29 29 TRP HB2 H 1 3.25 0.02 . 2 . . . . 9 TRP HB2 . 17034 3 40 . 1 1 29 29 TRP N N 15 121.821 0.20 . 1 . . . . 9 TRP N . 17034 3 41 . 1 1 30 30 ASN H H 1 8.089 0.02 . 1 . . . . 10 ASN HN . 17034 3 42 . 1 1 30 30 ASN HA H 1 4.66 0.02 . 1 . . . . 10 ASN HA . 17034 3 43 . 1 1 30 30 ASN HB2 H 1 2.6 0.02 . 2 . . . . 10 ASN HB2 . 17034 3 44 . 1 1 30 30 ASN N N 15 120.486 0.20 . 1 . . . . 10 ASN N . 17034 3 45 . 1 1 31 31 LYS H H 1 7.995 0.02 . 1 . . . . 11 LYS HN . 17034 3 46 . 1 1 31 31 LYS HA H 1 4.46 0.02 . 1 . . . . 11 LYS HA . 17034 3 47 . 1 1 31 31 LYS HB2 H 1 1.65 0.02 . 2 . . . . 11 LYS HB1 . 17034 3 48 . 1 1 31 31 LYS HB3 H 1 1.81 0.02 . 2 . . . . 11 LYS HB2 . 17034 3 49 . 1 1 31 31 LYS HG2 H 1 1.34 0.02 . 2 . . . . 11 LYS HG1 . 17034 3 50 . 1 1 31 31 LYS HG3 H 1 1.5 0.02 . 2 . . . . 11 LYS HG2 . 17034 3 51 . 1 1 31 31 LYS N N 15 122.76 0.20 . 1 . . . . 11 LYS N . 17034 3 52 . 1 1 33 33 SER H H 1 8.335 0.02 . 1 . . . . 13 SER HN . 17034 3 53 . 1 1 33 33 SER HA H 1 4.48 0.02 . 1 . . . . 13 SER HA . 17034 3 54 . 1 1 33 33 SER HB2 H 1 3.87 0.02 . 2 . . . . 13 SER HB2 . 17034 3 55 . 1 1 33 33 SER N N 15 117.421 0.20 . 1 . . . . 13 SER N . 17034 3 56 . 1 1 34 34 LYS H H 1 8.293 0.02 . 1 . . . . 14 LYS HN . 17034 3 57 . 1 1 34 34 LYS HA H 1 4.6 0.02 . 1 . . . . 14 LYS HA . 17034 3 58 . 1 1 34 34 LYS HB2 H 1 1.72 0.02 . 2 . . . . 14 LYS HB1 . 17034 3 59 . 1 1 34 34 LYS HB3 H 1 1.84 0.02 . 2 . . . . 14 LYS HB2 . 17034 3 60 . 1 1 34 34 LYS HG2 H 1 1.44 0.02 . 2 . . . . 14 LYS HG2 . 17034 3 61 . 1 1 34 34 LYS N N 15 124.181 0.20 . 1 . . . . 14 LYS N . 17034 3 62 . 1 1 36 36 LYS H H 1 8.426 0.02 . 1 . . . . 16 LYS HN . 17034 3 63 . 1 1 36 36 LYS HA H 1 4.3 0.02 . 1 . . . . 16 LYS HA . 17034 3 64 . 1 1 36 36 LYS HB2 H 1 1.78 0.02 . 2 . . . . 16 LYS HB2 . 17034 3 65 . 1 1 36 36 LYS HG2 H 1 1.5 0.02 . 2 . . . . 16 LYS HG2 . 17034 3 66 . 1 1 36 36 LYS N N 15 121.973 0.20 . 1 . . . . 16 LYS N . 17034 3 67 . 1 1 37 37 THR H H 1 8.082 0.02 . 1 . . . . 17 THR HN . 17034 3 68 . 1 1 37 37 THR HA H 1 4.35 0.02 . 1 . . . . 17 THR HA . 17034 3 69 . 1 1 37 37 THR HB H 1 4.17 0.02 . 1 . . . . 17 THR HB . 17034 3 70 . 1 1 37 37 THR HG21 H 1 1.16 0.02 . 1 . . . . 17 THR HG21 . 17034 3 71 . 1 1 37 37 THR HG22 H 1 1.16 0.02 . 1 . . . . 17 THR HG21 . 17034 3 72 . 1 1 37 37 THR HG23 H 1 1.16 0.02 . 1 . . . . 17 THR HG21 . 17034 3 73 . 1 1 37 37 THR N N 15 115.155 0.20 . 1 . . . . 17 THR N . 17034 3 74 . 1 1 38 38 ASN H H 1 8.507 0.02 . 1 . . . . 18 ASN HN . 17034 3 75 . 1 1 38 38 ASN HA H 1 4.71 0.02 . 1 . . . . 18 ASN HA . 17034 3 76 . 1 1 38 38 ASN HB2 H 1 2.77 0.02 . 2 . . . . 18 ASN HB2 . 17034 3 77 . 1 1 38 38 ASN N N 15 121.499 0.20 . 1 . . . . 18 ASN N . 17034 3 78 . 1 1 39 39 MET H H 1 8.322 0.02 . 1 . . . . 19 MET HN . 17034 3 79 . 1 1 39 39 MET HA H 1 4.39 0.02 . 1 . . . . 19 MET HA . 17034 3 80 . 1 1 39 39 MET HB2 H 1 1.98 0.02 . 2 . . . . 19 MET HB2 . 17034 3 81 . 1 1 39 39 MET HG2 H 1 2.6 0.02 . 2 . . . . 19 MET HG1 . 17034 3 82 . 1 1 39 39 MET HG3 H 1 2.43 0.02 . 2 . . . . 19 MET HG2 . 17034 3 83 . 1 1 39 39 MET N N 15 121.502 0.20 . 1 . . . . 19 MET N . 17034 3 84 . 1 1 40 40 LYS H H 1 8.257 0.02 . 1 . . . . 20 LYS HN . 17034 3 85 . 1 1 40 40 LYS HA H 1 4.28 0.02 . 1 . . . . 20 LYS HA . 17034 3 86 . 1 1 40 40 LYS HB2 H 1 1.78 0.02 . 2 . . . . 20 LYS HB2 . 17034 3 87 . 1 1 40 40 LYS HD2 H 1 1.41 0.02 . 2 . . . . 20 LYS HD2 . 17034 3 88 . 1 1 40 40 LYS HG2 H 1 1.71 0.02 . 2 . . . . 20 LYS HG2 . 17034 3 89 . 1 1 40 40 LYS N N 15 122.357 0.20 . 1 . . . . 20 LYS N . 17034 3 90 . 1 1 41 41 HIS H H 1 8.521 0.02 . 1 . . . . 21 HIS HN . 17034 3 91 . 1 1 41 41 HIS HA H 1 4.67 0.02 . 1 . . . . 21 HIS HA . 17034 3 92 . 1 1 41 41 HIS HB2 H 1 3.17 0.02 . 2 . . . . 21 HIS HB2 . 17034 3 93 . 1 1 41 41 HIS N N 15 120.104 0.20 . 1 . . . . 21 HIS N . 17034 3 94 . 1 1 42 42 MET H H 1 8.411 0.02 . 1 . . . . 22 MET HN . 17034 3 95 . 1 1 42 42 MET HA H 1 4.47 0.02 . 1 . . . . 22 MET HA . 17034 3 96 . 1 1 42 42 MET HB2 H 1 1.99 0.02 . 2 . . . . 22 MET HB2 . 17034 3 97 . 1 1 42 42 MET HG2 H 1 2.52 0.02 . 2 . . . . 22 MET HG2 . 17034 3 98 . 1 1 42 42 MET N N 15 122.9 0.20 . 1 . . . . 22 MET N . 17034 3 99 . 1 1 43 43 ALA H H 1 8.389 0.02 . 1 . . . . 23 ALA HN . 17034 3 100 . 1 1 43 43 ALA HA H 1 4.31 0.02 . 1 . . . . 23 ALA HA . 17034 3 101 . 1 1 43 43 ALA HB1 H 1 1.39 0.02 . 1 . . . . 23 ALA HB1 . 17034 3 102 . 1 1 43 43 ALA HB2 H 1 1.39 0.02 . 1 . . . . 23 ALA HB1 . 17034 3 103 . 1 1 43 43 ALA HB3 H 1 1.39 0.02 . 1 . . . . 23 ALA HB1 . 17034 3 104 . 1 1 43 43 ALA N N 15 125.946 0.20 . 1 . . . . 23 ALA N . 17034 3 105 . 1 1 44 44 GLY H H 1 8.359 0.02 . 1 . . . . 24 GLY HN . 17034 3 106 . 1 1 44 44 GLY HA2 H 1 3.94 0.02 . 2 . . . . 24 GLY HA2 . 17034 3 107 . 1 1 44 44 GLY N N 15 108.893 0.20 . 1 . . . . 24 GLY N . 17034 3 108 . 1 1 45 45 ALA H H 1 8.122 0.02 . 1 . . . . 25 ALA HN . 17034 3 109 . 1 1 45 45 ALA HA H 1 4.28 0.02 . 1 . . . . 25 ALA HA . 17034 3 110 . 1 1 45 45 ALA HB1 H 1 1.36 0.02 . 1 . . . . 25 ALA HB1 . 17034 3 111 . 1 1 45 45 ALA HB2 H 1 1.36 0.02 . 1 . . . . 25 ALA HB1 . 17034 3 112 . 1 1 45 45 ALA HB3 H 1 1.36 0.02 . 1 . . . . 25 ALA HB1 . 17034 3 113 . 1 1 45 45 ALA N N 15 123.905 0.20 . 1 . . . . 25 ALA N . 17034 3 114 . 1 1 46 46 ALA H H 1 8.244 0.02 . 1 . . . . 26 ALA HN . 17034 3 115 . 1 1 46 46 ALA HA H 1 4.4 0.02 . 1 . . . . 26 ALA HA . 17034 3 116 . 1 1 46 46 ALA HB1 H 1 1.39 0.02 . 1 . . . . 26 ALA HB1 . 17034 3 117 . 1 1 46 46 ALA HB2 H 1 1.39 0.02 . 1 . . . . 26 ALA HB1 . 17034 3 118 . 1 1 46 46 ALA HB3 H 1 1.39 0.02 . 1 . . . . 26 ALA HB1 . 17034 3 119 . 1 1 46 46 ALA N N 15 123.355 0.20 . 1 . . . . 26 ALA N . 17034 3 120 . 1 1 47 47 ALA H H 1 8.185 0.02 . 1 . . . . 27 ALA HN . 17034 3 121 . 1 1 47 47 ALA HA H 1 4.29 0.02 . 1 . . . . 27 ALA HA . 17034 3 122 . 1 1 47 47 ALA HB1 H 1 1.37 0.02 . 1 . . . . 27 ALA HB1 . 17034 3 123 . 1 1 47 47 ALA HB2 H 1 1.37 0.02 . 1 . . . . 27 ALA HB1 . 17034 3 124 . 1 1 47 47 ALA HB3 H 1 1.37 0.02 . 1 . . . . 27 ALA HB1 . 17034 3 125 . 1 1 47 47 ALA N N 15 123.382 0.20 . 1 . . . . 27 ALA N . 17034 3 126 . 1 1 48 48 ALA H H 1 8.288 0.02 . 1 . . . . 28 ALA HN . 17034 3 127 . 1 1 48 48 ALA HA H 1 4.33 0.02 . 1 . . . . 28 ALA HA . 17034 3 128 . 1 1 48 48 ALA HB1 H 1 1.59 0.02 . 1 . . . . 28 ALA HB1 . 17034 3 129 . 1 1 48 48 ALA HB2 H 1 1.59 0.02 . 1 . . . . 28 ALA HB1 . 17034 3 130 . 1 1 48 48 ALA HB3 H 1 1.59 0.02 . 1 . . . . 28 ALA HB1 . 17034 3 131 . 1 1 48 48 ALA N N 15 123.467 0.20 . 1 . . . . 28 ALA N . 17034 3 132 . 1 1 49 49 GLY H H 1 8.233 0.02 . 1 . . . . 29 GLY HN . 17034 3 133 . 1 1 49 49 GLY HA2 H 1 3.9 0.02 . 2 . . . . 29 GLY HA2 . 17034 3 134 . 1 1 49 49 GLY N N 15 107.938 0.20 . 1 . . . . 29 GLY N . 17034 3 135 . 1 1 50 50 ALA H H 1 8.025 0.02 . 1 . . . . 30 ALA HN . 17034 3 136 . 1 1 50 50 ALA HA H 1 4.34 0.02 . 1 . . . . 30 ALA HA . 17034 3 137 . 1 1 50 50 ALA HB1 H 1 1.35 0.02 . 1 . . . . 30 ALA HB1 . 17034 3 138 . 1 1 50 50 ALA HB2 H 1 1.35 0.02 . 1 . . . . 30 ALA HB1 . 17034 3 139 . 1 1 50 50 ALA HB3 H 1 1.35 0.02 . 1 . . . . 30 ALA HB1 . 17034 3 140 . 1 1 50 50 ALA N N 15 123.608 0.20 . 1 . . . . 30 ALA N . 17034 3 141 . 1 1 51 51 VAL H H 1 8.087 0.02 . 1 . . . . 31 VAL HN . 17034 3 142 . 1 1 51 51 VAL HA H 1 4.11 0.02 . 1 . . . . 31 VAL HA . 17034 3 143 . 1 1 51 51 VAL HB H 1 2.01 0.02 . 1 . . . . 31 VAL HB . 17034 3 144 . 1 1 51 51 VAL HG21 H 1 0.88 0.02 . 2 . . . . 31 VAL HG21 . 17034 3 145 . 1 1 51 51 VAL HG22 H 1 0.88 0.02 . 2 . . . . 31 VAL HG21 . 17034 3 146 . 1 1 51 51 VAL HG23 H 1 0.88 0.02 . 2 . . . . 31 VAL HG21 . 17034 3 147 . 1 1 51 51 VAL N N 15 119.761 0.20 . 1 . . . . 31 VAL N . 17034 3 148 . 1 1 52 52 VAL H H 1 8.216 0.02 . 1 . . . . 32 VAL HN . 17034 3 149 . 1 1 52 52 VAL HA H 1 4.09 0.02 . 1 . . . . 32 VAL HA . 17034 3 150 . 1 1 52 52 VAL HB H 1 2.02 0.02 . 1 . . . . 32 VAL HB . 17034 3 151 . 1 1 52 52 VAL HG21 H 1 0.9 0.02 . 2 . . . . 32 VAL HG21 . 17034 3 152 . 1 1 52 52 VAL HG22 H 1 0.9 0.02 . 2 . . . . 32 VAL HG21 . 17034 3 153 . 1 1 52 52 VAL HG23 H 1 0.9 0.02 . 2 . . . . 32 VAL HG21 . 17034 3 154 . 1 1 52 52 VAL N N 15 124.681 0.20 . 1 . . . . 32 VAL N . 17034 3 155 . 1 1 53 53 GLY H H 1 8.486 0.02 . 1 . . . . 33 GLY HN . 17034 3 156 . 1 1 53 53 GLY HA2 H 1 3.93 0.02 . 2 . . . . 33 GLY HA2 . 17034 3 157 . 1 1 53 53 GLY N N 15 113.088 0.20 . 1 . . . . 33 GLY N . 17034 3 158 . 1 1 54 54 GLY H H 1 8.214 0.02 . 1 . . . . 34 GLY HN . 17034 3 159 . 1 1 54 54 GLY HA2 H 1 3.94 0.02 . 2 . . . . 34 GLY HA2 . 17034 3 160 . 1 1 54 54 GLY N N 15 108.44 0.20 . 1 . . . . 34 GLY N . 17034 3 161 . 1 1 55 55 LEU H H 1 8.207 0.02 . 1 . . . . 35 LEU HN . 17034 3 162 . 1 1 55 55 LEU HA H 1 4.36 0.02 . 1 . . . . 35 LEU HA . 17034 3 163 . 1 1 55 55 LEU HB2 H 1 1.58 0.02 . 2 . . . . 35 LEU HB2 . 17034 3 164 . 1 1 55 55 LEU HG H 1 1.44 0.02 . 1 . . . . 35 LEU HG . 17034 3 165 . 1 1 55 55 LEU N N 15 121.741 0.20 . 1 . . . . 35 LEU N . 17034 3 166 . 1 1 56 56 GLY H H 1 8.491 0.02 . 1 . . . . 36 GLY HN . 17034 3 167 . 1 1 56 56 GLY HA2 H 1 3.97 0.02 . 2 . . . . 36 GLY HA2 . 17034 3 168 . 1 1 56 56 GLY N N 15 110.005 0.20 . 1 . . . . 36 GLY N . 17034 3 169 . 1 1 57 57 GLY H H 1 8.297 0.02 . 1 . . . . 37 GLY HN . 17034 3 170 . 1 1 57 57 GLY HA2 H 1 3.98 0.02 . 2 . . . . 37 GLY HA2 . 17034 3 171 . 1 1 57 57 GLY N N 15 108.734 0.20 . 1 . . . . 37 GLY N . 17034 3 172 . 1 1 58 58 TYR H H 1 7.727 0.02 . 1 . . . . 38 TYR HN . 17034 3 173 . 1 1 58 58 TYR HA H 1 4.44 0.02 . 1 . . . . 38 TYR HA . 17034 3 174 . 1 1 58 58 TYR HB2 H 1 2.86 0.02 . 2 . . . . 38 TYR HB2 . 17034 3 175 . 1 1 58 58 TYR N N 15 117.885 0.20 . 1 . . . . 38 TYR N . 17034 3 176 . 1 1 59 59 MET H H 1 8.974 0.02 . 1 . . . . 39 MET HN . 17034 3 177 . 1 1 59 59 MET HA H 1 4.52 0.02 . 1 . . . . 39 MET HA . 17034 3 178 . 1 1 59 59 MET HB2 H 1 1.6 0.02 . 2 . . . . 39 MET HB1 . 17034 3 179 . 1 1 59 59 MET HB3 H 1 1.26 0.02 . 2 . . . . 39 MET HB2 . 17034 3 180 . 1 1 59 59 MET HG2 H 1 2.48 0.02 . 2 . . . . 39 MET HG1 . 17034 3 181 . 1 1 59 59 MET HG3 H 1 2.05 0.02 . 2 . . . . 39 MET HG2 . 17034 3 182 . 1 1 59 59 MET N N 15 121.171 0.20 . 1 . . . . 39 MET N . 17034 3 183 . 1 1 60 60 LEU H H 1 8.077 0.02 . 1 . . . . 40 LEU HN . 17034 3 184 . 1 1 60 60 LEU HA H 1 4.67 0.02 . 1 . . . . 40 LEU HA . 17034 3 185 . 1 1 60 60 LEU HB2 H 1 1.06 0.02 . 2 . . . . 40 LEU HB1 . 17034 3 186 . 1 1 60 60 LEU HB3 H 1 1.58 0.02 . 2 . . . . 40 LEU HB2 . 17034 3 187 . 1 1 60 60 LEU HD11 H 1 0.64 0.02 . 2 . . . . 40 LEU HD11 . 17034 3 188 . 1 1 60 60 LEU HD12 H 1 0.64 0.02 . 2 . . . . 40 LEU HD11 . 17034 3 189 . 1 1 60 60 LEU HD13 H 1 0.64 0.02 . 2 . . . . 40 LEU HD11 . 17034 3 190 . 1 1 60 60 LEU HD21 H 1 0.064 0.02 . 2 . . . . 40 LEU HD21 . 17034 3 191 . 1 1 60 60 LEU HD22 H 1 0.064 0.02 . 2 . . . . 40 LEU HD21 . 17034 3 192 . 1 1 60 60 LEU HD23 H 1 0.064 0.02 . 2 . . . . 40 LEU HD21 . 17034 3 193 . 1 1 60 60 LEU N N 15 121.413 0.20 . 1 . . . . 40 LEU N . 17034 3 194 . 1 1 61 61 GLY H H 1 9.181 0.02 . 1 . . . . 41 GLY HN . 17034 3 195 . 1 1 61 61 GLY HA2 H 1 4.34 0.02 . 2 . . . . 41 GLY HA1 . 17034 3 196 . 1 1 61 61 GLY HA3 H 1 3.93 0.02 . 2 . . . . 41 GLY HA2 . 17034 3 197 . 1 1 61 61 GLY N N 15 114.343 0.20 . 1 . . . . 41 GLY N . 17034 3 198 . 1 1 62 62 SER H H 1 8.24 0.02 . 1 . . . . 42 SER HN . 17034 3 199 . 1 1 62 62 SER HA H 1 4.4 0.02 . 1 . . . . 42 SER HA . 17034 3 200 . 1 1 62 62 SER HB2 H 1 3.92 0.02 . 2 . . . . 42 SER HB2 . 17034 3 201 . 1 1 62 62 SER N N 15 113.842 0.20 . 1 . . . . 42 SER N . 17034 3 202 . 1 1 63 63 ALA H H 1 8.661 0.02 . 1 . . . . 43 ALA HN . 17034 3 203 . 1 1 63 63 ALA HA H 1 4.33 0.02 . 1 . . . . 43 ALA HA . 17034 3 204 . 1 1 63 63 ALA HB1 H 1 1.25 0.02 . 1 . . . . 43 ALA HB1 . 17034 3 205 . 1 1 63 63 ALA HB2 H 1 1.25 0.02 . 1 . . . . 43 ALA HB1 . 17034 3 206 . 1 1 63 63 ALA HB3 H 1 1.25 0.02 . 1 . . . . 43 ALA HB1 . 17034 3 207 . 1 1 63 63 ALA N N 15 125.557 0.20 . 1 . . . . 43 ALA N . 17034 3 208 . 1 1 64 64 MET H H 1 8.689 0.02 . 1 . . . . 44 MET HN . 17034 3 209 . 1 1 64 64 MET HA H 1 4.65 0.02 . 1 . . . . 44 MET HA . 17034 3 210 . 1 1 64 64 MET HB2 H 1 1.99 0.02 . 2 . . . . 44 MET HB2 . 17034 3 211 . 1 1 64 64 MET N N 15 121.433 0.20 . 1 . . . . 44 MET N . 17034 3 212 . 1 1 65 65 SER H H 1 8.332 0.02 . 1 . . . . 45 SER HN . 17034 3 213 . 1 1 65 65 SER HA H 1 4.31 0.02 . 1 . . . . 45 SER HA . 17034 3 214 . 1 1 65 65 SER HB2 H 1 3.8 0.02 . 2 . . . . 45 SER HB2 . 17034 3 215 . 1 1 65 65 SER N N 15 116.132 0.20 . 1 . . . . 45 SER N . 17034 3 216 . 1 1 66 66 ARG H H 1 8.574 0.02 . 1 . . . . 46 ARG HN . 17034 3 217 . 1 1 66 66 ARG HA H 1 4.42 0.02 . 1 . . . . 46 ARG HA . 17034 3 218 . 1 1 66 66 ARG HB2 H 1 1.8 0.02 . 2 . . . . 46 ARG HB1 . 17034 3 219 . 1 1 66 66 ARG HD2 H 1 3.15 0.02 . 2 . . . . 46 ARG HD2 . 17034 3 220 . 1 1 66 66 ARG HG2 H 1 1.64 0.02 . 2 . . . . 46 ARG HG2 . 17034 3 221 . 1 1 66 66 ARG N N 15 125.826 0.20 . 1 . . . . 46 ARG N . 17034 3 222 . 1 1 68 68 MET H H 1 8.649 0.02 . 1 . . . . 48 MET HN . 17034 3 223 . 1 1 68 68 MET HA H 1 4.7 0.02 . 1 . . . . 48 MET HA . 17034 3 224 . 1 1 68 68 MET HB2 H 1 1.98 0.02 . 2 . . . . 48 MET HB2 . 17034 3 225 . 1 1 68 68 MET HG2 H 1 2.61 0.02 . 2 . . . . 48 MET HG2 . 17034 3 226 . 1 1 68 68 MET N N 15 122.459 0.20 . 1 . . . . 48 MET N . 17034 3 227 . 1 1 69 69 MET H H 1 7.34 0.02 . 1 . . . . 49 MET HN . 17034 3 228 . 1 1 69 69 MET HA H 1 4.32 0.02 . 1 . . . . 49 MET HA . 17034 3 229 . 1 1 69 69 MET HB2 H 1 1.08 0.02 . 2 . . . . 49 MET HB2 . 17034 3 230 . 1 1 69 69 MET HG2 H 1 1.93 0.02 . 2 . . . . 49 MET HG1 . 17034 3 231 . 1 1 69 69 MET HG3 H 1 1.75 0.02 . 2 . . . . 49 MET HG2 . 17034 3 232 . 1 1 69 69 MET N N 15 121.818 0.20 . 1 . . . . 49 MET N . 17034 3 233 . 1 1 70 70 HIS H H 1 8.128 0.02 . 1 . . . . 50 HIS HN . 17034 3 234 . 1 1 70 70 HIS HA H 1 4.9 0.02 . 1 . . . . 50 HIS HA . 17034 3 235 . 1 1 70 70 HIS HB2 H 1 3.2 0.02 . 2 . . . . 50 HIS HB1 . 17034 3 236 . 1 1 70 70 HIS HB3 H 1 2.91 0.02 . 2 . . . . 50 HIS HB2 . 17034 3 237 . 1 1 70 70 HIS N N 15 118.418 0.20 . 1 . . . . 50 HIS N . 17034 3 238 . 1 1 71 71 PHE H H 1 10.273 0.02 . 1 . . . . 51 PHE HN . 17034 3 239 . 1 1 71 71 PHE HA H 1 4.36 0.02 . 1 . . . . 51 PHE HA . 17034 3 240 . 1 1 71 71 PHE HB2 H 1 2.8 0.02 . 2 . . . . 51 PHE HB1 . 17034 3 241 . 1 1 71 71 PHE HB3 H 1 2.68 0.02 . 2 . . . . 51 PHE HB2 . 17034 3 242 . 1 1 71 71 PHE N N 15 123.198 0.20 . 1 . . . . 51 PHE N . 17034 3 243 . 1 1 72 72 GLY H H 1 8.961 0.02 . 1 . . . . 52 GLY HN . 17034 3 244 . 1 1 72 72 GLY HA2 H 1 4.11 0.02 . 2 . . . . 52 GLY HA1 . 17034 3 245 . 1 1 72 72 GLY HA3 H 1 3.74 0.02 . 2 . . . . 52 GLY HA2 . 17034 3 246 . 1 1 72 72 GLY N N 15 109.466 0.20 . 1 . . . . 52 GLY N . 17034 3 247 . 1 1 73 73 ASN H H 1 7.16 0.02 . 1 . . . . 53 ASN HN . 17034 3 248 . 1 1 73 73 ASN HA H 1 4.86 0.02 . 1 . . . . 53 ASN HA . 17034 3 249 . 1 1 73 73 ASN HB2 H 1 2.75 0.02 . 2 . . . . 53 ASN HB2 . 17034 3 250 . 1 1 73 73 ASN N N 15 114.961 0.20 . 1 . . . . 53 ASN N . 17034 3 251 . 1 1 74 74 ASP H H 1 9.006 0.02 . 1 . . . . 54 ASP HN . 17034 3 252 . 1 1 74 74 ASP HA H 1 4.48 0.02 . 1 . . . . 54 ASP HA . 17034 3 253 . 1 1 74 74 ASP HB2 H 1 2.8 0.02 . 2 . . . . 54 ASP HB2 . 17034 3 254 . 1 1 74 74 ASP N N 15 123.463 0.20 . 1 . . . . 54 ASP N . 17034 3 255 . 1 1 75 75 TRP H H 1 8.406 0.02 . 1 . . . . 55 TRP HN . 17034 3 256 . 1 1 75 75 TRP HA H 1 4.28 0.02 . 1 . . . . 55 TRP HA . 17034 3 257 . 1 1 75 75 TRP HB2 H 1 2.81 0.02 . 2 . . . . 55 TRP HB1 . 17034 3 258 . 1 1 75 75 TRP HB3 H 1 3.42 0.02 . 2 . . . . 55 TRP HB2 . 17034 3 259 . 1 1 75 75 TRP N N 15 120.33 0.20 . 1 . . . . 55 TRP N . 17034 3 260 . 1 1 76 76 GLU H H 1 8.143 0.02 . 1 . . . . 56 GLU HN . 17034 3 261 . 1 1 76 76 GLU HA H 1 3.38 0.02 . 1 . . . . 56 GLU HA . 17034 3 262 . 1 1 76 76 GLU N N 15 121.845 0.20 . 1 . . . . 56 GLU N . 17034 3 263 . 1 1 77 77 ASP H H 1 7.968 0.02 . 1 . . . . 57 ASP HN . 17034 3 264 . 1 1 77 77 ASP HA H 1 4.55 0.02 . 1 . . . . 57 ASP HA . 17034 3 265 . 1 1 77 77 ASP HB2 H 1 2.96 0.02 . 2 . . . . 57 ASP HB2 . 17034 3 266 . 1 1 77 77 ASP N N 15 120.044 0.20 . 1 . . . . 57 ASP N . 17034 3 267 . 1 1 78 78 ARG H H 1 7.967 0.02 . 1 . . . . 58 ARG HN . 17034 3 268 . 1 1 78 78 ARG HA H 1 3.94 0.02 . 1 . . . . 58 ARG HA . 17034 3 269 . 1 1 78 78 ARG N N 15 120.229 0.20 . 1 . . . . 58 ARG N . 17034 3 270 . 1 1 79 79 TYR H H 1 8.289 0.02 . 1 . . . . 59 TYR HN . 17034 3 271 . 1 1 79 79 TYR HA H 1 3.83 0.02 . 1 . . . . 59 TYR HA . 17034 3 272 . 1 1 79 79 TYR N N 15 121.246 0.20 . 1 . . . . 59 TYR N . 17034 3 273 . 1 1 80 80 TYR H H 1 8.835 0.02 . 1 . . . . 60 TYR HN . 17034 3 274 . 1 1 80 80 TYR HA H 1 4.17 0.02 . 1 . . . . 60 TYR HA . 17034 3 275 . 1 1 80 80 TYR HB2 H 1 2.6 0.02 . 2 . . . . 60 TYR HB1 . 17034 3 276 . 1 1 80 80 TYR HB3 H 1 2.69 0.02 . 2 . . . . 60 TYR HB2 . 17034 3 277 . 1 1 80 80 TYR N N 15 119.715 0.20 . 1 . . . . 60 TYR N . 17034 3 278 . 1 1 81 81 ARG H H 1 7.728 0.02 . 1 . . . . 61 ARG HN . 17034 3 279 . 1 1 81 81 ARG HA H 1 3.7 0.02 . 1 . . . . 61 ARG HA . 17034 3 280 . 1 1 81 81 ARG HB2 H 1 1.91 0.02 . 2 . . . . 61 ARG HB2 . 17034 3 281 . 1 1 81 81 ARG HG2 H 1 1.71 0.02 . 2 . . . . 61 ARG HG2 . 17034 3 282 . 1 1 81 81 ARG N N 15 116.853 0.20 . 1 . . . . 61 ARG N . 17034 3 283 . 1 1 82 82 GLU H H 1 7.832 0.02 . 1 . . . . 62 GLU HN . 17034 3 284 . 1 1 82 82 GLU HA H 1 4.04 0.02 . 1 . . . . 62 GLU HA . 17034 3 285 . 1 1 82 82 GLU HB2 H 1 1.88 0.02 . 2 . . . . 62 GLU HB1 . 17034 3 286 . 1 1 82 82 GLU HB3 H 1 1.71 0.02 . 2 . . . . 62 GLU HB2 . 17034 3 287 . 1 1 82 82 GLU HG2 H 1 2.4 0.02 . 2 . . . . 62 GLU HG1 . 17034 3 288 . 1 1 82 82 GLU HG3 H 1 2.19 0.02 . 2 . . . . 62 GLU HG2 . 17034 3 289 . 1 1 82 82 GLU N N 15 115.345 0.20 . 1 . . . . 62 GLU N . 17034 3 290 . 1 1 83 83 ASN H H 1 7.486 0.02 . 1 . . . . 63 ASN HN . 17034 3 291 . 1 1 83 83 ASN HA H 1 4.6 0.02 . 1 . . . . 63 ASN HA . 17034 3 292 . 1 1 83 83 ASN HB2 H 1 2.2 0.02 . 2 . . . . 63 ASN HB1 . 17034 3 293 . 1 1 83 83 ASN HB3 H 1 2.44 0.02 . 2 . . . . 63 ASN HB2 . 17034 3 294 . 1 1 83 83 ASN N N 15 116.007 0.20 . 1 . . . . 63 ASN N . 17034 3 295 . 1 1 84 84 MET H H 1 7.48 0.02 . 1 . . . . 64 MET HN . 17034 3 296 . 1 1 84 84 MET HA H 1 3.8 0.02 . 1 . . . . 64 MET HA . 17034 3 297 . 1 1 84 84 MET HB2 H 1 1.77 0.02 . 2 . . . . 64 MET HB1 . 17034 3 298 . 1 1 84 84 MET HB3 H 1 1.53 0.02 . 2 . . . . 64 MET HB2 . 17034 3 299 . 1 1 84 84 MET HG2 H 1 2.45 0.02 . 2 . . . . 64 MET HG1 . 17034 3 300 . 1 1 84 84 MET HG3 H 1 2.2 0.02 . 2 . . . . 64 MET HG2 . 17034 3 301 . 1 1 84 84 MET N N 15 118.9 0.20 . 1 . . . . 64 MET N . 17034 3 302 . 1 1 85 85 ASN H H 1 8.152 0.02 . 1 . . . . 65 ASN HN . 17034 3 303 . 1 1 85 85 ASN HA H 1 4.401 0.02 . 1 . . . . 65 ASN HA . 17034 3 304 . 1 1 85 85 ASN HB2 H 1 3.81 0.02 . 2 . . . . 65 ASN HB2 . 17034 3 305 . 1 1 85 85 ASN N N 15 115.4 0.20 . 1 . . . . 65 ASN N . 17034 3 306 . 1 1 86 86 ARG H H 1 7.98 0.02 . 1 . . . . 66 ARG HN . 17034 3 307 . 1 1 86 86 ARG HA H 1 4.16 0.02 . 1 . . . . 66 ARG HA . 17034 3 308 . 1 1 86 86 ARG HB2 H 1 1.47 0.02 . 2 . . . . 66 ARG HB2 . 17034 3 309 . 1 1 86 86 ARG N N 15 117.652 0.20 . 1 . . . . 66 ARG N . 17034 3 310 . 1 1 87 87 TYR H H 1 7.289 0.02 . 1 . . . . 67 TYR HN . 17034 3 311 . 1 1 87 87 TYR HA H 1 4.96 0.02 . 1 . . . . 67 TYR HA . 17034 3 312 . 1 1 87 87 TYR HB2 H 1 3.06 0.02 . 2 . . . . 67 TYR HB1 . 17034 3 313 . 1 1 87 87 TYR HB3 H 1 2.98 0.02 . 2 . . . . 67 TYR HB2 . 17034 3 314 . 1 1 87 87 TYR N N 15 119.454 0.20 . 1 . . . . 67 TYR N . 17034 3 315 . 1 1 89 89 ASN H H 1 8.42 0.02 . 1 . . . . 69 ASN HN . 17034 3 316 . 1 1 89 89 ASN HA H 1 4.72 0.02 . 1 . . . . 69 ASN HA . 17034 3 317 . 1 1 89 89 ASN HB2 H 1 2.4 0.02 . 2 . . . . 69 ASN HB2 . 17034 3 318 . 1 1 89 89 ASN N N 15 116.11 0.20 . 1 . . . . 69 ASN N . 17034 3 319 . 1 1 90 90 GLN H H 1 7.216 0.02 . 1 . . . . 70 GLN HN . 17034 3 320 . 1 1 90 90 GLN HA H 1 4.6 0.02 . 1 . . . . 70 GLN HA . 17034 3 321 . 1 1 90 90 GLN HB2 H 1 1.7 0.02 . 2 . . . . 70 GLN HB1 . 17034 3 322 . 1 1 90 90 GLN HB3 H 1 2.04 0.02 . 2 . . . . 70 GLN HB2 . 17034 3 323 . 1 1 90 90 GLN HG2 H 1 2.09 0.02 . 2 . . . . 70 GLN HG2 . 17034 3 324 . 1 1 90 90 GLN N N 15 114.58 0.20 . 1 . . . . 70 GLN N . 17034 3 325 . 1 1 91 91 VAL H H 1 8.411 0.02 . 1 . . . . 71 VAL HN . 17034 3 326 . 1 1 91 91 VAL HA H 1 4.83 0.02 . 1 . . . . 71 VAL HA . 17034 3 327 . 1 1 91 91 VAL N N 15 113.397 0.20 . 1 . . . . 71 VAL N . 17034 3 328 . 1 1 92 92 TYR H H 1 8.32 0.02 . 1 . . . . 72 TYR HN . 17034 3 329 . 1 1 92 92 TYR HA H 1 5.48 0.02 . 1 . . . . 72 TYR HA . 17034 3 330 . 1 1 92 92 TYR HB2 H 1 2.55 0.02 . 2 . . . . 72 TYR HB1 . 17034 3 331 . 1 1 92 92 TYR HB3 H 1 2.46 0.02 . 2 . . . . 72 TYR HB2 . 17034 3 332 . 1 1 92 92 TYR N N 15 120.893 0.20 . 1 . . . . 72 TYR N . 17034 3 333 . 1 1 93 93 TYR H H 1 8.499 0.02 . 1 . . . . 73 TYR HN . 17034 3 334 . 1 1 93 93 TYR HA H 1 4.81 0.02 . 1 . . . . 73 TYR HA . 17034 3 335 . 1 1 93 93 TYR HB2 H 1 2.85 0.02 . 2 . . . . 73 TYR HB1 . 17034 3 336 . 1 1 93 93 TYR HB3 H 1 2.58 0.02 . 2 . . . . 73 TYR HB2 . 17034 3 337 . 1 1 93 93 TYR N N 15 111.632 0.20 . 1 . . . . 73 TYR N . 17034 3 338 . 1 1 94 94 ARG H H 1 7.952 0.02 . 1 . . . . 74 ARG HN . 17034 3 339 . 1 1 94 94 ARG HA H 1 4.64 0.02 . 1 . . . . 74 ARG HA . 17034 3 340 . 1 1 94 94 ARG HB2 H 1 1.83 0.02 . 2 . . . . 74 ARG HB2 . 17034 3 341 . 1 1 94 94 ARG N N 15 120.497 0.20 . 1 . . . . 74 ARG N . 17034 3 342 . 1 1 96 96 VAL H H 1 8.5 0.02 . 1 . . . . 76 VAL HN . 17034 3 343 . 1 1 96 96 VAL HA H 1 4.45 0.02 . 1 . . . . 76 VAL HA . 17034 3 344 . 1 1 96 96 VAL HG21 H 1 0.96 0.02 . 2 . . . . 76 VAL HG21 . 17034 3 345 . 1 1 96 96 VAL HG22 H 1 0.96 0.02 . 2 . . . . 76 VAL HG21 . 17034 3 346 . 1 1 96 96 VAL HG23 H 1 0.96 0.02 . 2 . . . . 76 VAL HG21 . 17034 3 347 . 1 1 96 96 VAL N N 15 119.072 0.20 . 1 . . . . 76 VAL N . 17034 3 348 . 1 1 97 97 ASP H H 1 8.181 0.02 . 1 . . . . 77 ASP HN . 17034 3 349 . 1 1 97 97 ASP HA H 1 4.48 0.02 . 1 . . . . 77 ASP HA . 17034 3 350 . 1 1 97 97 ASP HB2 H 1 2.98 0.02 . 2 . . . . 77 ASP HB1 . 17034 3 351 . 1 1 97 97 ASP HB3 H 1 2.5 0.02 . 2 . . . . 77 ASP HB2 . 17034 3 352 . 1 1 97 97 ASP N N 15 117.121 0.20 . 1 . . . . 77 ASP N . 17034 3 353 . 1 1 98 98 GLN H H 1 8.155 0.02 . 1 . . . . 78 GLN HN . 17034 3 354 . 1 1 98 98 GLN HA H 1 4.12 0.02 . 1 . . . . 78 GLN HA . 17034 3 355 . 1 1 98 98 GLN HB2 H 1 1.75 0.02 . 2 . . . . 78 GLN HB2 . 17034 3 356 . 1 1 98 98 GLN N N 15 117.861 0.20 . 1 . . . . 78 GLN N . 17034 3 357 . 1 1 99 99 TYR H H 1 7.856 0.02 . 1 . . . . 79 TYR HN . 17034 3 358 . 1 1 99 99 TYR HA H 1 4.81 0.02 . 1 . . . . 79 TYR HA . 17034 3 359 . 1 1 99 99 TYR HB2 H 1 3.25 0.02 . 2 . . . . 79 TYR HB1 . 17034 3 360 . 1 1 99 99 TYR HB3 H 1 3.0 0.02 . 2 . . . . 79 TYR HB2 . 17034 3 361 . 1 1 99 99 TYR N N 15 117.001 0.20 . 1 . . . . 79 TYR N . 17034 3 362 . 1 1 100 100 ASN H H 1 8.872 0.02 . 1 . . . . 80 ASN HN . 17034 3 363 . 1 1 100 100 ASN HA H 1 4.83 0.02 . 1 . . . . 80 ASN HA . 17034 3 364 . 1 1 100 100 ASN HB2 H 1 2.94 0.02 . 2 . . . . 80 ASN HB2 . 17034 3 365 . 1 1 100 100 ASN N N 15 117.491 0.20 . 1 . . . . 80 ASN N . 17034 3 366 . 1 1 101 101 ASN H H 1 7.609 0.02 . 1 . . . . 81 ASN HN . 17034 3 367 . 1 1 101 101 ASN HA H 1 4.75 0.02 . 1 . . . . 81 ASN HA . 17034 3 368 . 1 1 101 101 ASN HB2 H 1 3.23 0.02 . 2 . . . . 81 ASN HB1 . 17034 3 369 . 1 1 101 101 ASN HB3 H 1 3.06 0.02 . 2 . . . . 81 ASN HB2 . 17034 3 370 . 1 1 101 101 ASN N N 15 113.672 0.20 . 1 . . . . 81 ASN N . 17034 3 371 . 1 1 102 102 GLN H H 1 8.7 0.02 . 1 . . . . 82 GLN HN . 17034 3 372 . 1 1 102 102 GLN HA H 1 3.2 0.02 . 1 . . . . 82 GLN HA . 17034 3 373 . 1 1 102 102 GLN HB2 H 1 1.976 0.02 . 2 . . . . 82 GLN HB2 . 17034 3 374 . 1 1 102 102 GLN N N 15 121.5 0.20 . 1 . . . . 82 GLN N . 17034 3 375 . 1 1 103 103 ASN H H 1 8.378 0.02 . 1 . . . . 83 ASN HN . 17034 3 376 . 1 1 103 103 ASN HA H 1 4.42 0.02 . 1 . . . . 83 ASN HA . 17034 3 377 . 1 1 103 103 ASN HB2 H 1 2.9 0.02 . 2 . . . . 83 ASN HB1 . 17034 3 378 . 1 1 103 103 ASN HB3 H 1 2.77 0.02 . 2 . . . . 83 ASN HB2 . 17034 3 379 . 1 1 103 103 ASN N N 15 117.407 0.20 . 1 . . . . 83 ASN N . 17034 3 380 . 1 1 104 104 ASN H H 1 8.457 0.02 . 1 . . . . 84 ASN HN . 17034 3 381 . 1 1 104 104 ASN HA H 1 4.54 0.02 . 1 . . . . 84 ASN HA . 17034 3 382 . 1 1 104 104 ASN HB2 H 1 3.15 0.02 . 2 . . . . 84 ASN HB1 . 17034 3 383 . 1 1 104 104 ASN HB3 H 1 2.95 0.02 . 2 . . . . 84 ASN HB2 . 17034 3 384 . 1 1 104 104 ASN N N 15 118.489 0.20 . 1 . . . . 84 ASN N . 17034 3 385 . 1 1 105 105 PHE H H 1 7.26 0.02 . 1 . . . . 85 PHE HN . 17034 3 386 . 1 1 105 105 PHE HA H 1 2.96 0.02 . 1 . . . . 85 PHE HA . 17034 3 387 . 1 1 105 105 PHE HB2 H 1 2.51 0.02 . 2 . . . . 85 PHE HB2 . 17034 3 388 . 1 1 105 105 PHE N N 15 121.305 0.20 . 1 . . . . 85 PHE N . 17034 3 389 . 1 1 106 106 VAL H H 1 8.778 0.02 . 1 . . . . 86 VAL HN . 17034 3 390 . 1 1 106 106 VAL HA H 1 3.34 0.02 . 1 . . . . 86 VAL HA . 17034 3 391 . 1 1 106 106 VAL HB H 1 2.09 0.02 . 1 . . . . 86 VAL HB . 17034 3 392 . 1 1 106 106 VAL HG21 H 1 0.08 0.02 . 2 . . . . 86 VAL HG21 . 17034 3 393 . 1 1 106 106 VAL HG22 H 1 0.08 0.02 . 2 . . . . 86 VAL HG21 . 17034 3 394 . 1 1 106 106 VAL HG23 H 1 0.08 0.02 . 2 . . . . 86 VAL HG21 . 17034 3 395 . 1 1 106 106 VAL N N 15 120.153 0.20 . 1 . . . . 86 VAL N . 17034 3 396 . 1 1 107 107 HIS H H 1 8.429 0.02 . 1 . . . . 87 HIS HN . 17034 3 397 . 1 1 107 107 HIS HA H 1 4.42 0.02 . 1 . . . . 87 HIS HA . 17034 3 398 . 1 1 107 107 HIS HB2 H 1 3.21 0.02 . 2 . . . . 87 HIS HB2 . 17034 3 399 . 1 1 107 107 HIS N N 15 116.834 0.20 . 1 . . . . 87 HIS N . 17034 3 400 . 1 1 108 108 ASP H H 1 7.646 0.02 . 1 . . . . 88 ASP HN . 17034 3 401 . 1 1 108 108 ASP HA H 1 4.57 0.02 . 1 . . . . 88 ASP HA . 17034 3 402 . 1 1 108 108 ASP HB2 H 1 2.95 0.02 . 2 . . . . 88 ASP HB1 . 17034 3 403 . 1 1 108 108 ASP HB3 H 1 3.38 0.02 . 2 . . . . 88 ASP HB2 . 17034 3 404 . 1 1 108 108 ASP N N 15 118.885 0.20 . 1 . . . . 88 ASP N . 17034 3 405 . 1 1 109 109 CYS H H 1 8.01 0.02 . 1 . . . . 89 CYS HN . 17034 3 406 . 1 1 109 109 CYS HA H 1 4.38 0.02 . 1 . . . . 89 CYS HA . 17034 3 407 . 1 1 109 109 CYS HB2 H 1 2.95 0.02 . 2 . . . . 89 CYS HB1 . 17034 3 408 . 1 1 109 109 CYS HB3 H 1 2.95 0.02 . 2 . . . . 89 CYS HB2 . 17034 3 409 . 1 1 109 109 CYS N N 15 119.439 0.20 . 1 . . . . 89 CYS N . 17034 3 410 . 1 1 110 110 VAL H H 1 9.108 0.02 . 1 . . . . 90 VAL HN . 17034 3 411 . 1 1 110 110 VAL HA H 1 3.63 0.02 . 1 . . . . 90 VAL HA . 17034 3 412 . 1 1 110 110 VAL HB H 1 2.16 0.02 . 1 . . . . 90 VAL HB . 17034 3 413 . 1 1 110 110 VAL HG11 H 1 1.01 0.02 . 2 . . . . 90 VAL HG11 . 17034 3 414 . 1 1 110 110 VAL HG12 H 1 1.01 0.02 . 2 . . . . 90 VAL HG11 . 17034 3 415 . 1 1 110 110 VAL HG13 H 1 1.01 0.02 . 2 . . . . 90 VAL HG11 . 17034 3 416 . 1 1 110 110 VAL HG21 H 1 1.12 0.02 . 2 . . . . 90 VAL HG21 . 17034 3 417 . 1 1 110 110 VAL HG22 H 1 1.12 0.02 . 2 . . . . 90 VAL HG21 . 17034 3 418 . 1 1 110 110 VAL HG23 H 1 1.12 0.02 . 2 . . . . 90 VAL HG21 . 17034 3 419 . 1 1 110 110 VAL N N 15 125.0 0.20 . 1 . . . . 90 VAL N . 17034 3 420 . 1 1 111 111 ASN H H 1 7.69 0.02 . 1 . . . . 91 ASN HN . 17034 3 421 . 1 1 111 111 ASN HA H 1 4.29 0.02 . 1 . . . . 91 ASN HA . 17034 3 422 . 1 1 111 111 ASN HB2 H 1 2.87 0.02 . 2 . . . . 91 ASN HB2 . 17034 3 423 . 1 1 111 111 ASN N N 15 116.806 0.20 . 1 . . . . 91 ASN N . 17034 3 424 . 1 1 112 112 ILE H H 1 8.722 0.02 . 1 . . . . 92 ILE HN . 17034 3 425 . 1 1 112 112 ILE HA H 1 3.71 0.02 . 1 . . . . 92 ILE HA . 17034 3 426 . 1 1 112 112 ILE HB H 1 1.57 0.02 . 1 . . . . 92 ILE HB . 17034 3 427 . 1 1 112 112 ILE N N 15 118.924 0.20 . 1 . . . . 92 ILE N . 17034 3 428 . 1 1 113 113 THR H H 1 8.184 0.02 . 1 . . . . 93 THR HN . 17034 3 429 . 1 1 113 113 THR HA H 1 4.14 0.02 . 1 . . . . 93 THR HA . 17034 3 430 . 1 1 113 113 THR HB H 1 4.45 0.02 . 1 . . . . 93 THR HB . 17034 3 431 . 1 1 113 113 THR HG21 H 1 1.5 0.02 . 1 . . . . 93 THR HG21 . 17034 3 432 . 1 1 113 113 THR HG22 H 1 1.5 0.02 . 1 . . . . 93 THR HG21 . 17034 3 433 . 1 1 113 113 THR HG23 H 1 1.5 0.02 . 1 . . . . 93 THR HG21 . 17034 3 434 . 1 1 113 113 THR N N 15 118.1 0.20 . 1 . . . . 93 THR N . 17034 3 435 . 1 1 114 114 ILE H H 1 8.539 0.02 . 1 . . . . 94 ILE HN . 17034 3 436 . 1 1 114 114 ILE HA H 1 3.74 0.02 . 1 . . . . 94 ILE HA . 17034 3 437 . 1 1 114 114 ILE HB H 1 2.09 0.02 . 1 . . . . 94 ILE HB . 17034 3 438 . 1 1 114 114 ILE HD11 H 1 0.81 0.02 . 1 . . . . 94 ILE HD11 . 17034 3 439 . 1 1 114 114 ILE HD12 H 1 0.81 0.02 . 1 . . . . 94 ILE HD11 . 17034 3 440 . 1 1 114 114 ILE HD13 H 1 0.81 0.02 . 1 . . . . 94 ILE HD11 . 17034 3 441 . 1 1 114 114 ILE HG12 H 1 1.21 0.02 . 1 . . . . 94 ILE HG11 . 17034 3 442 . 1 1 114 114 ILE HG13 H 1 1.84 0.02 . 1 . . . . 94 ILE HG12 . 17034 3 443 . 1 1 114 114 ILE HG21 H 1 0.93 0.02 . 2 . . . . 94 ILE HG21 . 17034 3 444 . 1 1 114 114 ILE HG22 H 1 0.91 0.02 . 2 . . . . 94 ILE HG21 . 17034 3 445 . 1 1 114 114 ILE HG23 H 1 0.91 0.02 . 2 . . . . 94 ILE HG21 . 17034 3 446 . 1 1 114 114 ILE N N 15 120.461 0.20 . 1 . . . . 94 ILE N . 17034 3 447 . 1 1 115 115 LYS H H 1 8.0 0.02 . 1 . . . . 95 LYS HN . 17034 3 448 . 1 1 115 115 LYS HA H 1 4.0 0.02 . 1 . . . . 95 LYS HA . 17034 3 449 . 1 1 115 115 LYS HB2 H 1 2.03 0.02 . 2 . . . . 95 LYS HB1 . 17034 3 450 . 1 1 115 115 LYS HB3 H 1 1.88 0.02 . 2 . . . . 95 LYS HB2 . 17034 3 451 . 1 1 115 115 LYS HG2 H 1 1.52 0.02 . 2 . . . . 95 LYS HG2 . 17034 3 452 . 1 1 115 115 LYS N N 15 122.335 0.20 . 1 . . . . 95 LYS N . 17034 3 453 . 1 1 116 116 GLN H H 1 8.195 0.02 . 1 . . . . 96 GLN HN . 17034 3 454 . 1 1 116 116 GLN HA H 1 4.01 0.02 . 1 . . . . 96 GLN HA . 17034 3 455 . 1 1 116 116 GLN HB2 H 1 1.99 0.02 . 2 . . . . 96 GLN HB1 . 17034 3 456 . 1 1 116 116 GLN HB3 H 1 1.87 0.02 . 2 . . . . 96 GLN HB2 . 17034 3 457 . 1 1 116 116 GLN HG2 H 1 2.07 0.02 . 2 . . . . 96 GLN HG1 . 17034 3 458 . 1 1 116 116 GLN HG3 H 1 1.48 0.02 . 2 . . . . 96 GLN HG2 . 17034 3 459 . 1 1 116 116 GLN N N 15 115.887 0.20 . 1 . . . . 96 GLN N . 17034 3 460 . 1 1 117 117 HIS H H 1 7.918 0.02 . 1 . . . . 97 HIS HN . 17034 3 461 . 1 1 117 117 HIS HA H 1 4.65 0.02 . 1 . . . . 97 HIS HA . 17034 3 462 . 1 1 117 117 HIS HB2 H 1 3.44 0.02 . 2 . . . . 97 HIS HB1 . 17034 3 463 . 1 1 117 117 HIS HB3 H 1 3.25 0.02 . 2 . . . . 97 HIS HB2 . 17034 3 464 . 1 1 117 117 HIS N N 15 115.978 0.20 . 1 . . . . 97 HIS N . 17034 3 465 . 1 1 118 118 THR H H 1 8.021 0.02 . 1 . . . . 98 THR HN . 17034 3 466 . 1 1 118 118 THR HA H 1 4.36 0.02 . 1 . . . . 98 THR HA . 17034 3 467 . 1 1 118 118 THR HB H 1 4.7 0.02 . 1 . . . . 98 THR HB . 17034 3 468 . 1 1 118 118 THR HG21 H 1 1.2 0.02 . 1 . . . . 98 THR HG21 . 17034 3 469 . 1 1 118 118 THR HG22 H 1 1.2 0.02 . 1 . . . . 98 THR HG21 . 17034 3 470 . 1 1 118 118 THR HG23 H 1 1.2 0.02 . 1 . . . . 98 THR HG21 . 17034 3 471 . 1 1 118 118 THR N N 15 112.573 0.20 . 1 . . . . 98 THR N . 17034 3 472 . 1 1 119 119 VAL H H 1 7.911 0.02 . 1 . . . . 99 VAL HN . 17034 3 473 . 1 1 119 119 VAL HA H 1 4.14 0.02 . 1 . . . . 99 VAL HA . 17034 3 474 . 1 1 119 119 VAL HB H 1 2.18 0.02 . 1 . . . . 99 VAL HB . 17034 3 475 . 1 1 119 119 VAL HG11 H 1 0.95 0.02 . 2 . . . . 99 VAL HG11 . 17034 3 476 . 1 1 119 119 VAL HG12 H 1 0.95 0.02 . 2 . . . . 99 VAL HG11 . 17034 3 477 . 1 1 119 119 VAL HG13 H 1 0.95 0.02 . 2 . . . . 99 VAL HG11 . 17034 3 478 . 1 1 119 119 VAL HG21 H 1 0.95 0.02 . 2 . . . . 99 VAL HG21 . 17034 3 479 . 1 1 119 119 VAL HG22 H 1 0.95 0.02 . 2 . . . . 99 VAL HG21 . 17034 3 480 . 1 1 119 119 VAL HG23 H 1 0.95 0.02 . 2 . . . . 99 VAL HG21 . 17034 3 481 . 1 1 119 119 VAL N N 15 121.555 0.20 . 1 . . . . 99 VAL N . 17034 3 482 . 1 1 120 120 THR H H 1 8.02 0.02 . 1 . . . . 100 THR HN . 17034 3 483 . 1 1 120 120 THR HA H 1 4.36 0.02 . 1 . . . . 100 THR HA . 17034 3 484 . 1 1 120 120 THR HG21 H 1 1.2 0.02 . 1 . . . . 100 THR HG21 . 17034 3 485 . 1 1 120 120 THR HG22 H 1 1.2 0.02 . 1 . . . . 100 THR HG21 . 17034 3 486 . 1 1 120 120 THR HG23 H 1 1.2 0.02 . 1 . . . . 100 THR HG21 . 17034 3 487 . 1 1 120 120 THR N N 15 115.372 0.20 . 1 . . . . 100 THR N . 17034 3 488 . 1 1 121 121 THR H H 1 7.974 0.02 . 1 . . . . 101 THR HN . 17034 3 489 . 1 1 121 121 THR HA H 1 4.32 0.02 . 1 . . . . 101 THR HA . 17034 3 490 . 1 1 121 121 THR HB H 1 4.12 0.02 . 1 . . . . 101 THR HB . 17034 3 491 . 1 1 121 121 THR HG21 H 1 1.14 0.02 . 1 . . . . 101 THR HG21 . 17034 3 492 . 1 1 121 121 THR HG22 H 1 1.14 0.02 . 1 . . . . 101 THR HG21 . 17034 3 493 . 1 1 121 121 THR HG23 H 1 1.14 0.02 . 1 . . . . 101 THR HG21 . 17034 3 494 . 1 1 121 121 THR N N 15 115.089 0.20 . 1 . . . . 101 THR N . 17034 3 495 . 1 1 122 122 THR H H 1 8.08 0.02 . 1 . . . . 102 THR HN . 17034 3 496 . 1 1 122 122 THR HA H 1 4.48 0.02 . 1 . . . . 102 THR HA . 17034 3 497 . 1 1 122 122 THR HG21 H 1 1.18 0.02 . 1 . . . . 102 THR HG21 . 17034 3 498 . 1 1 122 122 THR HG22 H 1 1.18 0.02 . 1 . . . . 102 THR HG21 . 17034 3 499 . 1 1 122 122 THR HG23 H 1 1.18 0.02 . 1 . . . . 102 THR HG21 . 17034 3 500 . 1 1 122 122 THR N N 15 117.4 0.20 . 1 . . . . 102 THR N . 17034 3 501 . 1 1 123 123 THR H H 1 7.974 0.02 . 1 . . . . 103 THR HN . 17034 3 502 . 1 1 123 123 THR HA H 1 4.36 0.02 . 1 . . . . 103 THR HA . 17034 3 503 . 1 1 123 123 THR HB H 1 4.37 0.02 . 1 . . . . 103 THR HB . 17034 3 504 . 1 1 123 123 THR HG21 H 1 1.22 0.02 . 1 . . . . 103 THR HG21 . 17034 3 505 . 1 1 123 123 THR HG22 H 1 1.22 0.02 . 1 . . . . 103 THR HG21 . 17034 3 506 . 1 1 123 123 THR HG23 H 1 1.22 0.02 . 1 . . . . 103 THR HG21 . 17034 3 507 . 1 1 123 123 THR N N 15 115.779 0.20 . 1 . . . . 103 THR N . 17034 3 508 . 1 1 124 124 LYS H H 1 8.088 0.02 . 1 . . . . 104 LYS HN . 17034 3 509 . 1 1 124 124 LYS HA H 1 4.36 0.02 . 1 . . . . 104 LYS HA . 17034 3 510 . 1 1 124 124 LYS HB2 H 1 1.86 0.02 . 2 . . . . 104 LYS HB2 . 17034 3 511 . 1 1 124 124 LYS HE2 H 1 3.38 0.02 . 2 . . . . 104 LYS HE2 . 17034 3 512 . 1 1 124 124 LYS HG2 H 1 1.54 0.02 . 2 . . . . 104 LYS HG2 . 17034 3 513 . 1 1 124 124 LYS N N 15 121.976 0.20 . 1 . . . . 104 LYS N . 17034 3 514 . 1 1 125 125 GLY H H 1 8.14 0.02 . 1 . . . . 105 GLY HN . 17034 3 515 . 1 1 125 125 GLY HA2 H 1 3.97 0.02 . 2 . . . . 105 GLY HA2 . 17034 3 516 . 1 1 125 125 GLY N N 15 108.4 0.20 . 1 . . . . 105 GLY N . 17034 3 517 . 1 1 126 126 GLU H H 1 7.85 0.02 . 1 . . . . 106 GLU HN . 17034 3 518 . 1 1 126 126 GLU HA H 1 4.32 0.02 . 1 . . . . 106 GLU HA . 17034 3 519 . 1 1 126 126 GLU HB2 H 1 1.6 0.02 . 2 . . . . 106 GLU HB1 . 17034 3 520 . 1 1 126 126 GLU HB3 H 1 1.75 0.02 . 2 . . . . 106 GLU HB2 . 17034 3 521 . 1 1 126 126 GLU HG2 H 1 2.35 0.02 . 2 . . . . 106 GLU HG1 . 17034 3 522 . 1 1 126 126 GLU HG3 H 1 2.21 0.02 . 2 . . . . 106 GLU HG2 . 17034 3 523 . 1 1 126 126 GLU N N 15 119.653 0.20 . 1 . . . . 106 GLU N . 17034 3 524 . 1 1 127 127 ASN H H 1 8.36 0.02 . 1 . . . . 107 ASN HN . 17034 3 525 . 1 1 127 127 ASN HA H 1 4.62 0.02 . 1 . . . . 107 ASN HA . 17034 3 526 . 1 1 127 127 ASN HB2 H 1 2.6 0.02 . 2 . . . . 107 ASN HB1 . 17034 3 527 . 1 1 127 127 ASN HB3 H 1 2.73 0.02 . 2 . . . . 107 ASN HB2 . 17034 3 528 . 1 1 127 127 ASN N N 15 120.058 0.20 . 1 . . . . 107 ASN N . 17034 3 529 . 1 1 128 128 PHE H H 1 8.432 0.02 . 1 . . . . 108 PHE HN . 17034 3 530 . 1 1 128 128 PHE HA H 1 5.14 0.02 . 1 . . . . 108 PHE HA . 17034 3 531 . 1 1 128 128 PHE HB2 H 1 3.16 0.02 . 2 . . . . 108 PHE HB1 . 17034 3 532 . 1 1 128 128 PHE HB3 H 1 3.0 0.02 . 2 . . . . 108 PHE HB2 . 17034 3 533 . 1 1 128 128 PHE N N 15 121.296 0.20 . 1 . . . . 108 PHE N . 17034 3 534 . 1 1 129 129 THR H H 1 9.385 0.02 . 1 . . . . 109 THR HN . 17034 3 535 . 1 1 129 129 THR HA H 1 4.61 0.02 . 1 . . . . 109 THR HA . 17034 3 536 . 1 1 129 129 THR HG21 H 1 1.4 0.02 . 1 . . . . 109 THR HG21 . 17034 3 537 . 1 1 129 129 THR HG22 H 1 1.4 0.02 . 1 . . . . 109 THR HG21 . 17034 3 538 . 1 1 129 129 THR HG23 H 1 1.4 0.02 . 1 . . . . 109 THR HG21 . 17034 3 539 . 1 1 129 129 THR N N 15 115.639 0.20 . 1 . . . . 109 THR N . 17034 3 540 . 1 1 130 130 GLU H H 1 9.006 0.02 . 1 . . . . 110 GLU HN . 17034 3 541 . 1 1 130 130 GLU HA H 1 4.14 0.02 . 1 . . . . 110 GLU HA . 17034 3 542 . 1 1 130 130 GLU HB2 H 1 2.13 0.02 . 2 . . . . 110 GLU HB1 . 17034 3 543 . 1 1 130 130 GLU HB3 H 1 1.99 0.02 . 2 . . . . 110 GLU HB2 . 17034 3 544 . 1 1 130 130 GLU HG2 H 1 2.42 0.02 . 2 . . . . 110 GLU HG2 . 17034 3 545 . 1 1 130 130 GLU N N 15 119.892 0.20 . 1 . . . . 110 GLU N . 17034 3 546 . 1 1 131 131 THR H H 1 7.908 0.02 . 1 . . . . 111 THR HN . 17034 3 547 . 1 1 131 131 THR HA H 1 3.8 0.02 . 1 . . . . 111 THR HA . 17034 3 548 . 1 1 131 131 THR HB H 1 3.35 0.02 . 1 . . . . 111 THR HB . 17034 3 549 . 1 1 131 131 THR HG21 H 1 0.8 0.02 . 1 . . . . 111 THR HG21 . 17034 3 550 . 1 1 131 131 THR HG22 H 1 0.8 0.02 . 1 . . . . 111 THR HG21 . 17034 3 551 . 1 1 131 131 THR HG23 H 1 0.8 0.02 . 1 . . . . 111 THR HG21 . 17034 3 552 . 1 1 131 131 THR N N 15 116.11 0.20 . 1 . . . . 111 THR N . 17034 3 553 . 1 1 132 132 ASP H H 1 7.57 0.02 . 1 . . . . 112 ASP HN . 17034 3 554 . 1 1 132 132 ASP HA H 1 4.53 0.02 . 1 . . . . 112 ASP HA . 17034 3 555 . 1 1 132 132 ASP HB2 H 1 2.58 0.02 . 2 . . . . 112 ASP HB1 . 17034 3 556 . 1 1 132 132 ASP HB3 H 1 3.27 0.02 . 2 . . . . 112 ASP HB2 . 17034 3 557 . 1 1 132 132 ASP N N 15 119.592 0.20 . 1 . . . . 112 ASP N . 17034 3 558 . 1 1 133 133 ILE H H 1 8.13 0.02 . 1 . . . . 113 ILE HN . 17034 3 559 . 1 1 133 133 ILE HA H 1 3.56 0.02 . 1 . . . . 113 ILE HA . 17034 3 560 . 1 1 133 133 ILE HB H 1 2.06 0.02 . 1 . . . . 113 ILE HB . 17034 3 561 . 1 1 133 133 ILE HD11 H 1 0.7 0.02 . 1 . . . . 113 ILE HD11 . 17034 3 562 . 1 1 133 133 ILE HD12 H 1 0.7 0.02 . 1 . . . . 113 ILE HD11 . 17034 3 563 . 1 1 133 133 ILE HD13 H 1 0.7 0.02 . 1 . . . . 113 ILE HD11 . 17034 3 564 . 1 1 133 133 ILE HG12 H 1 1.26 0.02 . 1 . . . . 113 ILE HG11 . 17034 3 565 . 1 1 133 133 ILE HG13 H 1 1.62 0.02 . 1 . . . . 113 ILE HG12 . 17034 3 566 . 1 1 133 133 ILE HG21 H 1 0.8 0.02 . 2 . . . . 113 ILE HG21 . 17034 3 567 . 1 1 133 133 ILE HG22 H 1 0.8 0.02 . 2 . . . . 113 ILE HG21 . 17034 3 568 . 1 1 133 133 ILE HG23 H 1 0.8 0.02 . 2 . . . . 113 ILE HG21 . 17034 3 569 . 1 1 133 133 ILE N N 15 119.8 0.20 . 1 . . . . 113 ILE N . 17034 3 570 . 1 1 134 134 LYS H H 1 7.876 0.02 . 1 . . . . 114 LYS HN . 17034 3 571 . 1 1 134 134 LYS HA H 1 4.05 0.02 . 1 . . . . 114 LYS HA . 17034 3 572 . 1 1 134 134 LYS HB2 H 1 1.88 0.02 . 2 . . . . 114 LYS HB2 . 17034 3 573 . 1 1 134 134 LYS HD2 H 1 1.76 0.02 . 2 . . . . 114 LYS HD2 . 17034 3 574 . 1 1 134 134 LYS HE2 H 1 2.95 0.02 . 2 . . . . 114 LYS HE2 . 17034 3 575 . 1 1 134 134 LYS N N 15 119.762 0.20 . 1 . . . . 114 LYS N . 17034 3 576 . 1 1 135 135 ILE H H 1 8.1 0.02 . 1 . . . . 115 ILE HN . 17034 3 577 . 1 1 135 135 ILE HA H 1 3.77 0.02 . 1 . . . . 115 ILE HA . 17034 3 578 . 1 1 135 135 ILE HD11 H 1 0.7 0.02 . 1 . . . . 115 ILE HD11 . 17034 3 579 . 1 1 135 135 ILE HD12 H 1 0.7 0.02 . 1 . . . . 115 ILE HD11 . 17034 3 580 . 1 1 135 135 ILE HD13 H 1 0.7 0.02 . 1 . . . . 115 ILE HD11 . 17034 3 581 . 1 1 135 135 ILE HG12 H 1 1.58 0.02 . 1 . . . . 115 ILE HG12 . 17034 3 582 . 1 1 135 135 ILE N N 15 120.04 0.20 . 1 . . . . 115 ILE N . 17034 3 583 . 1 1 136 136 MET H H 1 8.803 0.02 . 1 . . . . 116 MET HN . 17034 3 584 . 1 1 136 136 MET HA H 1 3.57 0.02 . 1 . . . . 116 MET HA . 17034 3 585 . 1 1 136 136 MET HB2 H 1 2.15 0.02 . 2 . . . . 116 MET HB1 . 17034 3 586 . 1 1 136 136 MET HB3 H 1 1.9 0.02 . 2 . . . . 116 MET HB2 . 17034 3 587 . 1 1 136 136 MET N N 15 119.32 0.20 . 1 . . . . 116 MET N . 17034 3 588 . 1 1 137 137 GLU H H 1 8.52 0.02 . 1 . . . . 117 GLU HN . 17034 3 589 . 1 1 137 137 GLU HA H 1 3.66 0.02 . 1 . . . . 117 GLU HA . 17034 3 590 . 1 1 137 137 GLU HB2 H 1 2.0 0.02 . 2 . . . . 117 GLU HB2 . 17034 3 591 . 1 1 137 137 GLU HG2 H 1 2.6 0.02 . 2 . . . . 117 GLU HG1 . 17034 3 592 . 1 1 137 137 GLU HG3 H 1 2.25 0.02 . 2 . . . . 117 GLU HG2 . 17034 3 593 . 1 1 137 137 GLU N N 15 117.52 0.20 . 1 . . . . 117 GLU N . 17034 3 594 . 1 1 138 138 ARG H H 1 7.238 0.02 . 1 . . . . 118 ARG HN . 17034 3 595 . 1 1 138 138 ARG HA H 1 4.15 0.02 . 1 . . . . 118 ARG HA . 17034 3 596 . 1 1 138 138 ARG HB2 H 1 1.99 0.02 . 2 . . . . 118 ARG HB1 . 17034 3 597 . 1 1 138 138 ARG HB3 H 1 2.09 0.02 . 2 . . . . 118 ARG HB2 . 17034 3 598 . 1 1 138 138 ARG HG2 H 1 1.85 0.02 . 2 . . . . 118 ARG HG2 . 17034 3 599 . 1 1 138 138 ARG N N 15 117.461 0.20 . 1 . . . . 118 ARG N . 17034 3 600 . 1 1 139 139 VAL H H 1 8.444 0.02 . 1 . . . . 119 VAL HN . 17034 3 601 . 1 1 139 139 VAL HA H 1 3.72 0.02 . 1 . . . . 119 VAL HA . 17034 3 602 . 1 1 139 139 VAL HB H 1 2.12 0.02 . 1 . . . . 119 VAL HB . 17034 3 603 . 1 1 139 139 VAL HG11 H 1 0.9 0.02 . 2 . . . . 119 VAL HG11 . 17034 3 604 . 1 1 139 139 VAL HG12 H 1 0.9 0.02 . 2 . . . . 119 VAL HG11 . 17034 3 605 . 1 1 139 139 VAL HG13 H 1 0.9 0.02 . 2 . . . . 119 VAL HG11 . 17034 3 606 . 1 1 139 139 VAL HG21 H 1 1.08 0.02 . 2 . . . . 119 VAL HG21 . 17034 3 607 . 1 1 139 139 VAL HG22 H 1 1.08 0.02 . 2 . . . . 119 VAL HG21 . 17034 3 608 . 1 1 139 139 VAL HG23 H 1 1.08 0.02 . 2 . . . . 119 VAL HG21 . 17034 3 609 . 1 1 139 139 VAL N N 15 120.706 0.20 . 1 . . . . 119 VAL N . 17034 3 610 . 1 1 140 140 VAL H H 1 9.096 0.02 . 1 . . . . 120 VAL HN . 17034 3 611 . 1 1 140 140 VAL HA H 1 3.65 0.02 . 1 . . . . 120 VAL HA . 17034 3 612 . 1 1 140 140 VAL HB H 1 2.24 0.02 . 1 . . . . 120 VAL HB . 17034 3 613 . 1 1 140 140 VAL HG21 H 1 1.02 0.02 . 2 . . . . 120 VAL HG21 . 17034 3 614 . 1 1 140 140 VAL HG22 H 1 1.02 0.02 . 2 . . . . 120 VAL HG21 . 17034 3 615 . 1 1 140 140 VAL HG23 H 1 1.02 0.02 . 2 . . . . 120 VAL HG21 . 17034 3 616 . 1 1 140 140 VAL N N 15 119.783 0.20 . 1 . . . . 120 VAL N . 17034 3 617 . 1 1 141 141 GLU H H 1 8.137 0.02 . 1 . . . . 121 GLU HN . 17034 3 618 . 1 1 141 141 GLU N N 15 121.664 0.20 . 1 . . . . 121 GLU N . 17034 3 619 . 1 1 142 142 GLN H H 1 7.55 0.02 . 1 . . . . 122 GLN HN . 17034 3 620 . 1 1 142 142 GLN HA H 1 4.1 0.02 . 1 . . . . 122 GLN HA . 17034 3 621 . 1 1 142 142 GLN N N 15 120.378 0.20 . 1 . . . . 122 GLN N . 17034 3 622 . 1 1 143 143 MET H H 1 8.33 0.02 . 1 . . . . 123 MET HN . 17034 3 623 . 1 1 143 143 MET N N 15 120.425 0.20 . 1 . . . . 123 MET N . 17034 3 624 . 1 1 144 144 CYS H H 1 9.406 0.02 . 1 . . . . 124 CYS HN . 17034 3 625 . 1 1 144 144 CYS HA H 1 4.34 0.02 . 1 . . . . 124 CYS HA . 17034 3 626 . 1 1 144 144 CYS HB2 H 1 3.37 0.02 . 2 . . . . 124 CYS HB1 . 17034 3 627 . 1 1 144 144 CYS HB3 H 1 2.83 0.02 . 2 . . . . 124 CYS HB2 . 17034 3 628 . 1 1 144 144 CYS N N 15 118.098 0.20 . 1 . . . . 124 CYS N . 17034 3 629 . 1 1 145 145 THR H H 1 8.172 0.02 . 1 . . . . 125 THR HN . 17034 3 630 . 1 1 145 145 THR N N 15 119.737 0.20 . 1 . . . . 125 THR N . 17034 3 631 . 1 1 146 146 THR H H 1 8.271 0.02 . 1 . . . . 126 THR HN . 17034 3 632 . 1 1 146 146 THR HA H 1 3.9 0.02 . 1 . . . . 126 THR HA . 17034 3 633 . 1 1 146 146 THR HB H 1 4.26 0.02 . 1 . . . . 126 THR HB . 17034 3 634 . 1 1 146 146 THR HG21 H 1 1.2 0.02 . 1 . . . . 126 THR HG21 . 17034 3 635 . 1 1 146 146 THR HG22 H 1 1.2 0.02 . 1 . . . . 126 THR HG21 . 17034 3 636 . 1 1 146 146 THR HG23 H 1 1.2 0.02 . 1 . . . . 126 THR HG21 . 17034 3 637 . 1 1 146 146 THR N N 15 120.932 0.20 . 1 . . . . 126 THR N . 17034 3 638 . 1 1 147 147 GLN H H 1 8.625 0.02 . 1 . . . . 127 GLN HN . 17034 3 639 . 1 1 147 147 GLN N N 15 122.265 0.20 . 1 . . . . 127 GLN N . 17034 3 640 . 1 1 148 148 TYR H H 1 8.37 0.02 . 1 . . . . 128 TYR HN . 17034 3 641 . 1 1 148 148 TYR HA H 1 2.96 0.02 . 1 . . . . 128 TYR HA . 17034 3 642 . 1 1 148 148 TYR N N 15 119.171 0.20 . 1 . . . . 128 TYR N . 17034 3 643 . 1 1 149 149 GLN H H 1 7.926 0.02 . 1 . . . . 129 GLN HN . 17034 3 644 . 1 1 149 149 GLN HA H 1 3.7 0.02 . 1 . . . . 129 GLN HA . 17034 3 645 . 1 1 149 149 GLN HB2 H 1 2.28 0.02 . 2 . . . . 129 GLN HB2 . 17034 3 646 . 1 1 149 149 GLN N N 15 119.652 0.20 . 1 . . . . 129 GLN N . 17034 3 647 . 1 1 150 150 LYS H H 1 7.964 0.02 . 1 . . . . 130 LYS HN . 17034 3 648 . 1 1 150 150 LYS HA H 1 4.0 0.02 . 1 . . . . 130 LYS HA . 17034 3 649 . 1 1 150 150 LYS HB2 H 1 1.81 0.02 . 2 . . . . 130 LYS HB2 . 17034 3 650 . 1 1 150 150 LYS HG2 H 1 1.38 0.02 . 2 . . . . 130 LYS HG1 . 17034 3 651 . 1 1 150 150 LYS HG3 H 1 1.58 0.02 . 2 . . . . 130 LYS HG2 . 17034 3 652 . 1 1 150 150 LYS N N 15 118.69 0.20 . 1 . . . . 130 LYS N . 17034 3 653 . 1 1 151 151 GLU H H 1 8.114 0.02 . 1 . . . . 131 GLU HN . 17034 3 654 . 1 1 151 151 GLU HA H 1 4.1 0.02 . 1 . . . . 131 GLU HA . 17034 3 655 . 1 1 151 151 GLU HB2 H 1 1.76 0.02 . 2 . . . . 131 GLU HB1 . 17034 3 656 . 1 1 151 151 GLU HB3 H 1 2.2 0.02 . 2 . . . . 131 GLU HB2 . 17034 3 657 . 1 1 151 151 GLU HG2 H 1 2.43 0.02 . 2 . . . . 131 GLU HG2 . 17034 3 658 . 1 1 151 151 GLU N N 15 117.0 0.20 . 1 . . . . 131 GLU N . 17034 3 659 . 1 1 152 152 SER H H 1 8.25 0.02 . 1 . . . . 132 SER HN . 17034 3 660 . 1 1 152 152 SER HA H 1 3.99 0.02 . 1 . . . . 132 SER HA . 17034 3 661 . 1 1 152 152 SER HB2 H 1 3.59 0.02 . 2 . . . . 132 SER HB1 . 17034 3 662 . 1 1 152 152 SER HB3 H 1 3.35 0.02 . 2 . . . . 132 SER HB2 . 17034 3 663 . 1 1 152 152 SER N N 15 115.153 0.20 . 1 . . . . 132 SER N . 17034 3 664 . 1 1 153 153 GLN H H 1 7.64 0.02 . 1 . . . . 133 GLN HN . 17034 3 665 . 1 1 153 153 GLN HA H 1 4.1 0.02 . 1 . . . . 133 GLN HA . 17034 3 666 . 1 1 153 153 GLN HB2 H 1 2.1 0.02 . 2 . . . . 133 GLN HB2 . 17034 3 667 . 1 1 153 153 GLN HG2 H 1 2.38 0.02 . 2 . . . . 133 GLN HG2 . 17034 3 668 . 1 1 153 153 GLN N N 15 120.664 0.20 . 1 . . . . 133 GLN N . 17034 3 669 . 1 1 154 154 ALA H H 1 7.599 0.02 . 1 . . . . 134 ALA HN . 17034 3 670 . 1 1 154 154 ALA HA H 1 4.16 0.02 . 1 . . . . 134 ALA HA . 17034 3 671 . 1 1 154 154 ALA HB1 H 1 1.36 0.02 . 1 . . . . 134 ALA HB1 . 17034 3 672 . 1 1 154 154 ALA HB2 H 1 1.36 0.02 . 1 . . . . 134 ALA HB1 . 17034 3 673 . 1 1 154 154 ALA HB3 H 1 1.36 0.02 . 1 . . . . 134 ALA HB1 . 17034 3 674 . 1 1 154 154 ALA N N 15 121.264 0.20 . 1 . . . . 134 ALA N . 17034 3 675 . 1 1 155 155 TYR H H 1 7.861 0.02 . 1 . . . . 135 TYR HN . 17034 3 676 . 1 1 155 155 TYR HA H 1 4.3 0.02 . 1 . . . . 135 TYR HA . 17034 3 677 . 1 1 155 155 TYR HB2 H 1 2.96 0.02 . 2 . . . . 135 TYR HB1 . 17034 3 678 . 1 1 155 155 TYR HB3 H 1 2.86 0.02 . 2 . . . . 135 TYR HB2 . 17034 3 679 . 1 1 155 155 TYR N N 15 118.511 0.20 . 1 . . . . 135 TYR N . 17034 3 680 . 1 1 156 156 TYR H H 1 8.022 0.02 . 1 . . . . 136 TYR HN . 17034 3 681 . 1 1 156 156 TYR HA H 1 4.32 0.02 . 1 . . . . 136 TYR HA . 17034 3 682 . 1 1 156 156 TYR HB2 H 1 2.9 0.02 . 2 . . . . 136 TYR HB2 . 17034 3 683 . 1 1 156 156 TYR N N 15 119.534 0.20 . 1 . . . . 136 TYR N . 17034 3 684 . 1 1 157 157 ASP H H 1 8.142 0.02 . 1 . . . . 137 ASP HN . 17034 3 685 . 1 1 157 157 ASP HA H 1 4.55 0.02 . 1 . . . . 137 ASP HA . 17034 3 686 . 1 1 157 157 ASP HB2 H 1 2.81 0.02 . 2 . . . . 137 ASP HB2 . 17034 3 687 . 1 1 157 157 ASP N N 15 120.213 0.20 . 1 . . . . 137 ASP N . 17034 3 688 . 1 1 158 158 GLY H H 1 7.832 0.02 . 1 . . . . 138 GLY HN . 17034 3 689 . 1 1 158 158 GLY HA2 H 1 3.88 0.02 . 2 . . . . 138 GLY HA2 . 17034 3 690 . 1 1 158 158 GLY N N 15 108.07 0.20 . 1 . . . . 138 GLY N . 17034 3 691 . 1 1 159 159 ARG H H 1 7.849 0.02 . 1 . . . . 139 ARG HN . 17034 3 692 . 1 1 159 159 ARG HA H 1 4.3 0.02 . 1 . . . . 139 ARG HA . 17034 3 693 . 1 1 159 159 ARG HB2 H 1 1.99 0.02 . 2 . . . . 139 ARG HB2 . 17034 3 694 . 1 1 159 159 ARG N N 15 120.018 0.20 . 1 . . . . 139 ARG N . 17034 3 695 . 1 1 160 160 ARG H H 1 8.383 0.02 . 1 . . . . 140 ARG HN . 17034 3 696 . 1 1 160 160 ARG HA H 1 4.4 0.02 . 1 . . . . 140 ARG HA . 17034 3 697 . 1 1 160 160 ARG N N 15 122.723 0.20 . 1 . . . . 140 ARG N . 17034 3 698 . 1 1 161 161 SER H H 1 7.999 0.02 . 1 . . . . 141 SER HN . 17034 3 699 . 1 1 161 161 SER HA H 1 4.29 0.02 . 1 . . . . 141 SER HA . 17034 3 700 . 1 1 161 161 SER HB2 H 1 3.85 0.02 . 2 . . . . 141 SER HB2 . 17034 3 701 . 1 1 161 161 SER N N 15 121.847 0.20 . 1 . . . . 141 SER N . 17034 3 stop_ save_ save_assigned_chem_shift_list_4 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_4 _Assigned_chem_shift_list.Entry_ID 17034 _Assigned_chem_shift_list.ID 4 _Assigned_chem_shift_list.Sample_condition_list_ID 4 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_4 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 13 '2D 1H-15N HSQC' . . . 17034 4 14 '3D HNHA' . . . 17034 4 15 '3D 1H-15N TOCSY' . . . 17034 4 16 '3D 1H-15N NOESY' . . . 17034 4 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 21 21 GLN H H 1 8.25 0.02 . 1 . . . . 1 GLN HN . 17034 4 2 . 1 1 21 21 GLN HA H 1 4.37 0.02 . 1 . . . . 1 GLN HA . 17034 4 3 . 1 1 21 21 GLN HB2 H 1 1.98 0.02 . 2 . . . . 1 GLN HB1 . 17034 4 4 . 1 1 21 21 GLN HB3 H 1 2.04 0.02 . 2 . . . . 1 GLN HB2 . 17034 4 5 . 1 1 21 21 GLN HG2 H 1 2.34 0.02 . 2 . . . . 1 GLN HG1 . 17034 4 6 . 1 1 21 21 GLN HG3 H 1 2.13 0.02 . 2 . . . . 1 GLN HG2 . 17034 4 7 . 1 1 21 21 GLN N N 15 119.662 0.20 . 1 . . . . 1 GLN N . 17034 4 8 . 1 1 22 22 GLY H H 1 8.634 0.02 . 1 . . . . 2 GLY HN . 17034 4 9 . 1 1 22 22 GLY HA2 H 1 4.01 0.02 . 2 . . . . 2 GLY HA2 . 17034 4 10 . 1 1 22 22 GLY N N 15 110.849 0.20 . 1 . . . . 2 GLY N . 17034 4 11 . 1 1 23 23 GLY H H 1 8.336 0.02 . 1 . . . . 3 GLY HN . 17034 4 12 . 1 1 23 23 GLY HA2 H 1 3.93 0.02 . 2 . . . . 3 GLY HA2 . 17034 4 13 . 1 1 23 23 GLY N N 15 108.52 0.20 . 1 . . . . 3 GLY N . 17034 4 14 . 1 1 24 24 GLY H H 1 8.272 0.02 . 1 . . . . 4 GLY HN . 17034 4 15 . 1 1 24 24 GLY HA2 H 1 3.85 0.02 . 2 . . . . 4 GLY HA2 . 17034 4 16 . 1 1 24 24 GLY N N 15 108.874 0.20 . 1 . . . . 4 GLY N . 17034 4 17 . 1 1 25 25 THR H H 1 8.053 0.02 . 1 . . . . 5 THR HN . 17034 4 18 . 1 1 25 25 THR HA H 1 4.25 0.02 . 1 . . . . 5 THR HA . 17034 4 19 . 1 1 25 25 THR HB H 1 4.11 0.02 . 1 . . . . 5 THR HB . 17034 4 20 . 1 1 25 25 THR HG21 H 1 1.12 0.02 . 1 . . . . 5 THR HG21 . 17034 4 21 . 1 1 25 25 THR HG22 H 1 1.12 0.02 . 1 . . . . 5 THR HG21 . 17034 4 22 . 1 1 25 25 THR HG23 H 1 1.12 0.02 . 1 . . . . 5 THR HG21 . 17034 4 23 . 1 1 25 25 THR N N 15 113.144 0.20 . 1 . . . . 5 THR N . 17034 4 24 . 1 1 26 26 HIS H H 1 8.59 0.02 . 1 . . . . 6 HIS HN . 17034 4 25 . 1 1 26 26 HIS HA H 1 4.71 0.02 . 1 . . . . 6 HIS HA . 17034 4 26 . 1 1 26 26 HIS HB2 H 1 3.2 0.02 . 2 . . . . 6 HIS HB2 . 17034 4 27 . 1 1 26 26 HIS N N 15 120.353 0.20 . 1 . . . . 6 HIS N . 17034 4 28 . 1 1 27 27 ASN H H 1 8.378 0.02 . 1 . . . . 7 ASN HN . 17034 4 29 . 1 1 27 27 ASN HA H 1 4.6 0.02 . 1 . . . . 7 ASN HA . 17034 4 30 . 1 1 27 27 ASN HB2 H 1 2.63 0.02 . 2 . . . . 7 ASN HB2 . 17034 4 31 . 1 1 27 27 ASN N N 15 119.868 0.20 . 1 . . . . 7 ASN N . 17034 4 32 . 1 1 28 28 GLN H H 1 8.343 0.02 . 1 . . . . 8 GLN HN . 17034 4 33 . 1 1 28 28 GLN HA H 1 4.21 0.02 . 1 . . . . 8 GLN HA . 17034 4 34 . 1 1 28 28 GLN HB2 H 1 2.0 0.02 . 2 . . . . 8 GLN HB1 . 17034 4 35 . 1 1 28 28 GLN HB3 H 1 1.81 0.02 . 2 . . . . 8 GLN HB2 . 17034 4 36 . 1 1 28 28 GLN HG2 H 1 2.17 0.02 . 2 . . . . 8 GLN HG2 . 17034 4 37 . 1 1 28 28 GLN N N 15 120.619 0.20 . 1 . . . . 8 GLN N . 17034 4 38 . 1 1 29 29 TRP H H 1 8.148 0.02 . 1 . . . . 9 TRP HN . 17034 4 39 . 1 1 29 29 TRP HA H 1 4.66 0.02 . 1 . . . . 9 TRP HA . 17034 4 40 . 1 1 29 29 TRP HB2 H 1 3.25 0.02 . 2 . . . . 9 TRP HB2 . 17034 4 41 . 1 1 29 29 TRP N N 15 121.82 0.20 . 1 . . . . 9 TRP N . 17034 4 42 . 1 1 30 30 ASN H H 1 8.098 0.02 . 1 . . . . 10 ASN HN . 17034 4 43 . 1 1 30 30 ASN HA H 1 4.66 0.02 . 1 . . . . 10 ASN HA . 17034 4 44 . 1 1 30 30 ASN HB2 H 1 2.6 0.02 . 2 . . . . 10 ASN HB2 . 17034 4 45 . 1 1 30 30 ASN N N 15 120.64 0.20 . 1 . . . . 10 ASN N . 17034 4 46 . 1 1 31 31 LYS H H 1 8.033 0.02 . 1 . . . . 11 LYS HN . 17034 4 47 . 1 1 31 31 LYS HA H 1 4.46 0.02 . 1 . . . . 11 LYS HA . 17034 4 48 . 1 1 31 31 LYS HB2 H 1 1.65 0.02 . 2 . . . . 11 LYS HB1 . 17034 4 49 . 1 1 31 31 LYS HB3 H 1 1.81 0.02 . 2 . . . . 11 LYS HB2 . 17034 4 50 . 1 1 31 31 LYS HG2 H 1 1.34 0.02 . 2 . . . . 11 LYS HG1 . 17034 4 51 . 1 1 31 31 LYS HG3 H 1 1.5 0.02 . 2 . . . . 11 LYS HG2 . 17034 4 52 . 1 1 31 31 LYS N N 15 122.914 0.20 . 1 . . . . 11 LYS N . 17034 4 53 . 1 1 33 33 SER H H 1 8.346 0.02 . 1 . . . . 13 SER HN . 17034 4 54 . 1 1 33 33 SER HA H 1 4.48 0.02 . 1 . . . . 13 SER HA . 17034 4 55 . 1 1 33 33 SER HB2 H 1 3.87 0.02 . 2 . . . . 13 SER HB2 . 17034 4 56 . 1 1 33 33 SER N N 15 117.46 0.20 . 1 . . . . 13 SER N . 17034 4 57 . 1 1 34 34 LYS H H 1 8.304 0.02 . 1 . . . . 14 LYS HN . 17034 4 58 . 1 1 34 34 LYS HA H 1 4.6 0.02 . 1 . . . . 14 LYS HA . 17034 4 59 . 1 1 34 34 LYS HB2 H 1 1.72 0.02 . 2 . . . . 14 LYS HB1 . 17034 4 60 . 1 1 34 34 LYS HB3 H 1 1.84 0.02 . 2 . . . . 14 LYS HB2 . 17034 4 61 . 1 1 34 34 LYS HG2 H 1 1.44 0.02 . 2 . . . . 14 LYS HG2 . 17034 4 62 . 1 1 34 34 LYS N N 15 124.197 0.20 . 1 . . . . 14 LYS N . 17034 4 63 . 1 1 36 36 LYS H H 1 8.484 0.02 . 1 . . . . 16 LYS HN . 17034 4 64 . 1 1 36 36 LYS HA H 1 4.3 0.02 . 1 . . . . 16 LYS HA . 17034 4 65 . 1 1 36 36 LYS HB2 H 1 1.78 0.02 . 2 . . . . 16 LYS HB2 . 17034 4 66 . 1 1 36 36 LYS HG2 H 1 1.5 0.02 . 2 . . . . 16 LYS HG2 . 17034 4 67 . 1 1 36 36 LYS N N 15 122.118 0.20 . 1 . . . . 16 LYS N . 17034 4 68 . 1 1 37 37 THR H H 1 8.103 0.02 . 1 . . . . 17 THR HN . 17034 4 69 . 1 1 37 37 THR HA H 1 4.35 0.02 . 1 . . . . 17 THR HA . 17034 4 70 . 1 1 37 37 THR HB H 1 4.17 0.02 . 1 . . . . 17 THR HB . 17034 4 71 . 1 1 37 37 THR HG21 H 1 1.16 0.02 . 1 . . . . 17 THR HG21 . 17034 4 72 . 1 1 37 37 THR HG22 H 1 1.16 0.02 . 1 . . . . 17 THR HG21 . 17034 4 73 . 1 1 37 37 THR HG23 H 1 1.16 0.02 . 1 . . . . 17 THR HG21 . 17034 4 74 . 1 1 37 37 THR N N 15 115.149 0.20 . 1 . . . . 17 THR N . 17034 4 75 . 1 1 38 38 ASN H H 1 8.516 0.02 . 1 . . . . 18 ASN HN . 17034 4 76 . 1 1 38 38 ASN HA H 1 4.71 0.02 . 1 . . . . 18 ASN HA . 17034 4 77 . 1 1 38 38 ASN HB2 H 1 2.77 0.02 . 2 . . . . 18 ASN HB2 . 17034 4 78 . 1 1 38 38 ASN N N 15 121.499 0.20 . 1 . . . . 18 ASN N . 17034 4 79 . 1 1 39 39 MET H H 1 8.336 0.02 . 1 . . . . 19 MET HN . 17034 4 80 . 1 1 39 39 MET HA H 1 4.39 0.02 . 1 . . . . 19 MET HA . 17034 4 81 . 1 1 39 39 MET HB2 H 1 1.98 0.02 . 2 . . . . 19 MET HB2 . 17034 4 82 . 1 1 39 39 MET HG2 H 1 2.6 0.02 . 2 . . . . 19 MET HG1 . 17034 4 83 . 1 1 39 39 MET HG3 H 1 2.43 0.02 . 2 . . . . 19 MET HG2 . 17034 4 84 . 1 1 39 39 MET N N 15 121.494 0.20 . 1 . . . . 19 MET N . 17034 4 85 . 1 1 40 40 LYS H H 1 8.304 0.02 . 1 . . . . 20 LYS HN . 17034 4 86 . 1 1 40 40 LYS HA H 1 4.22 0.02 . 1 . . . . 20 LYS HA . 17034 4 87 . 1 1 40 40 LYS HB2 H 1 1.78 0.02 . 2 . . . . 20 LYS HB2 . 17034 4 88 . 1 1 40 40 LYS HD2 H 1 1.41 0.02 . 2 . . . . 20 LYS HD2 . 17034 4 89 . 1 1 40 40 LYS HG2 H 1 1.71 0.02 . 2 . . . . 20 LYS HG2 . 17034 4 90 . 1 1 40 40 LYS N N 15 122.335 0.20 . 1 . . . . 20 LYS N . 17034 4 91 . 1 1 41 41 HIS H H 1 8.514 0.02 . 1 . . . . 21 HIS HN . 17034 4 92 . 1 1 41 41 HIS HA H 1 4.67 0.02 . 1 . . . . 21 HIS HA . 17034 4 93 . 1 1 41 41 HIS HB2 H 1 3.17 0.02 . 2 . . . . 21 HIS HB2 . 17034 4 94 . 1 1 41 41 HIS N N 15 119.931 0.20 . 1 . . . . 21 HIS N . 17034 4 95 . 1 1 42 42 MET H H 1 8.421 0.02 . 1 . . . . 22 MET HN . 17034 4 96 . 1 1 42 42 MET HA H 1 4.47 0.02 . 1 . . . . 22 MET HA . 17034 4 97 . 1 1 42 42 MET HB2 H 1 1.99 0.02 . 2 . . . . 22 MET HB2 . 17034 4 98 . 1 1 42 42 MET HG2 H 1 2.52 0.02 . 2 . . . . 22 MET HG2 . 17034 4 99 . 1 1 42 42 MET N N 15 122.921 0.20 . 1 . . . . 22 MET N . 17034 4 100 . 1 1 43 43 ALA H H 1 8.403 0.02 . 1 . . . . 23 ALA HN . 17034 4 101 . 1 1 43 43 ALA HA H 1 4.31 0.02 . 1 . . . . 23 ALA HA . 17034 4 102 . 1 1 43 43 ALA HB1 H 1 1.39 0.02 . 1 . . . . 23 ALA HB1 . 17034 4 103 . 1 1 43 43 ALA HB2 H 1 1.39 0.02 . 1 . . . . 23 ALA HB1 . 17034 4 104 . 1 1 43 43 ALA HB3 H 1 1.39 0.02 . 1 . . . . 23 ALA HB1 . 17034 4 105 . 1 1 43 43 ALA N N 15 125.972 0.20 . 1 . . . . 23 ALA N . 17034 4 106 . 1 1 44 44 GLY H H 1 8.359 0.02 . 1 . . . . 24 GLY HN . 17034 4 107 . 1 1 44 44 GLY HA2 H 1 3.94 0.02 . 2 . . . . 24 GLY HA2 . 17034 4 108 . 1 1 44 44 GLY N N 15 108.893 0.20 . 1 . . . . 24 GLY N . 17034 4 109 . 1 1 45 45 ALA H H 1 8.131 0.02 . 1 . . . . 25 ALA HN . 17034 4 110 . 1 1 45 45 ALA HA H 1 4.28 0.02 . 1 . . . . 25 ALA HA . 17034 4 111 . 1 1 45 45 ALA HB1 H 1 1.36 0.02 . 1 . . . . 25 ALA HB1 . 17034 4 112 . 1 1 45 45 ALA HB2 H 1 1.36 0.02 . 1 . . . . 25 ALA HB1 . 17034 4 113 . 1 1 45 45 ALA HB3 H 1 1.36 0.02 . 1 . . . . 25 ALA HB1 . 17034 4 114 . 1 1 45 45 ALA N N 15 123.913 0.20 . 1 . . . . 25 ALA N . 17034 4 115 . 1 1 46 46 ALA H H 1 8.224 0.02 . 1 . . . . 26 ALA HN . 17034 4 116 . 1 1 46 46 ALA HA H 1 4.4 0.02 . 1 . . . . 26 ALA HA . 17034 4 117 . 1 1 46 46 ALA HB1 H 1 1.39 0.02 . 1 . . . . 26 ALA HB1 . 17034 4 118 . 1 1 46 46 ALA HB2 H 1 1.39 0.02 . 1 . . . . 26 ALA HB1 . 17034 4 119 . 1 1 46 46 ALA HB3 H 1 1.39 0.02 . 1 . . . . 26 ALA HB1 . 17034 4 120 . 1 1 46 46 ALA N N 15 123.895 0.20 . 1 . . . . 26 ALA N . 17034 4 121 . 1 1 47 47 ALA H H 1 8.192 0.02 . 1 . . . . 27 ALA HN . 17034 4 122 . 1 1 47 47 ALA HA H 1 4.29 0.02 . 1 . . . . 27 ALA HA . 17034 4 123 . 1 1 47 47 ALA HB1 H 1 1.37 0.02 . 1 . . . . 27 ALA HB1 . 17034 4 124 . 1 1 47 47 ALA HB2 H 1 1.37 0.02 . 1 . . . . 27 ALA HB1 . 17034 4 125 . 1 1 47 47 ALA HB3 H 1 1.37 0.02 . 1 . . . . 27 ALA HB1 . 17034 4 126 . 1 1 47 47 ALA N N 15 123.436 0.20 . 1 . . . . 27 ALA N . 17034 4 127 . 1 1 48 48 ALA H H 1 8.302 0.02 . 1 . . . . 28 ALA HN . 17034 4 128 . 1 1 48 48 ALA HA H 1 4.33 0.02 . 1 . . . . 28 ALA HA . 17034 4 129 . 1 1 48 48 ALA HB1 H 1 1.59 0.02 . 1 . . . . 28 ALA HB1 . 17034 4 130 . 1 1 48 48 ALA HB2 H 1 1.59 0.02 . 1 . . . . 28 ALA HB1 . 17034 4 131 . 1 1 48 48 ALA HB3 H 1 1.59 0.02 . 1 . . . . 28 ALA HB1 . 17034 4 132 . 1 1 48 48 ALA N N 15 123.543 0.20 . 1 . . . . 28 ALA N . 17034 4 133 . 1 1 49 49 GLY H H 1 8.252 0.02 . 1 . . . . 29 GLY HN . 17034 4 134 . 1 1 49 49 GLY HA2 H 1 3.9 0.02 . 2 . . . . 29 GLY HA2 . 17034 4 135 . 1 1 49 49 GLY N N 15 107.973 0.20 . 1 . . . . 29 GLY N . 17034 4 136 . 1 1 50 50 ALA H H 1 8.025 0.02 . 1 . . . . 30 ALA HN . 17034 4 137 . 1 1 50 50 ALA HA H 1 4.34 0.02 . 1 . . . . 30 ALA HA . 17034 4 138 . 1 1 50 50 ALA HB1 H 1 1.35 0.02 . 1 . . . . 30 ALA HB1 . 17034 4 139 . 1 1 50 50 ALA HB2 H 1 1.35 0.02 . 1 . . . . 30 ALA HB1 . 17034 4 140 . 1 1 50 50 ALA HB3 H 1 1.35 0.02 . 1 . . . . 30 ALA HB1 . 17034 4 141 . 1 1 50 50 ALA N N 15 123.608 0.20 . 1 . . . . 30 ALA N . 17034 4 142 . 1 1 51 51 VAL H H 1 8.105 0.02 . 1 . . . . 31 VAL HN . 17034 4 143 . 1 1 51 51 VAL HA H 1 4.11 0.02 . 1 . . . . 31 VAL HA . 17034 4 144 . 1 1 51 51 VAL HB H 1 2.01 0.02 . 1 . . . . 31 VAL HB . 17034 4 145 . 1 1 51 51 VAL HG21 H 1 0.88 0.02 . 2 . . . . 31 VAL HG21 . 17034 4 146 . 1 1 51 51 VAL HG22 H 1 0.88 0.02 . 2 . . . . 31 VAL HG21 . 17034 4 147 . 1 1 51 51 VAL HG23 H 1 0.88 0.02 . 2 . . . . 31 VAL HG21 . 17034 4 148 . 1 1 51 51 VAL N N 15 119.779 0.20 . 1 . . . . 31 VAL N . 17034 4 149 . 1 1 52 52 VAL H H 1 8.229 0.02 . 1 . . . . 32 VAL HN . 17034 4 150 . 1 1 52 52 VAL HA H 1 4.09 0.02 . 1 . . . . 32 VAL HA . 17034 4 151 . 1 1 52 52 VAL HB H 1 2.02 0.02 . 1 . . . . 32 VAL HB . 17034 4 152 . 1 1 52 52 VAL HG21 H 1 0.9 0.02 . 2 . . . . 32 VAL HG21 . 17034 4 153 . 1 1 52 52 VAL HG22 H 1 0.9 0.02 . 2 . . . . 32 VAL HG21 . 17034 4 154 . 1 1 52 52 VAL HG23 H 1 0.9 0.02 . 2 . . . . 32 VAL HG21 . 17034 4 155 . 1 1 52 52 VAL N N 15 124.736 0.20 . 1 . . . . 32 VAL N . 17034 4 156 . 1 1 53 53 GLY H H 1 8.501 0.02 . 1 . . . . 33 GLY HN . 17034 4 157 . 1 1 53 53 GLY HA2 H 1 3.93 0.02 . 2 . . . . 33 GLY HA2 . 17034 4 158 . 1 1 53 53 GLY N N 15 113.115 0.20 . 1 . . . . 33 GLY N . 17034 4 159 . 1 1 54 54 GLY H H 1 8.23 0.02 . 1 . . . . 34 GLY HN . 17034 4 160 . 1 1 54 54 GLY HA2 H 1 3.94 0.02 . 2 . . . . 34 GLY HA2 . 17034 4 161 . 1 1 54 54 GLY N N 15 108.472 0.20 . 1 . . . . 34 GLY N . 17034 4 162 . 1 1 55 55 LEU H H 1 8.221 0.02 . 1 . . . . 35 LEU HN . 17034 4 163 . 1 1 55 55 LEU HA H 1 4.36 0.02 . 1 . . . . 35 LEU HA . 17034 4 164 . 1 1 55 55 LEU HB2 H 1 1.58 0.02 . 2 . . . . 35 LEU HB2 . 17034 4 165 . 1 1 55 55 LEU HG H 1 1.44 0.02 . 1 . . . . 35 LEU HG . 17034 4 166 . 1 1 55 55 LEU N N 15 121.71 0.20 . 1 . . . . 35 LEU N . 17034 4 167 . 1 1 56 56 GLY H H 1 8.507 0.02 . 1 . . . . 36 GLY HN . 17034 4 168 . 1 1 56 56 GLY HA2 H 1 3.97 0.02 . 2 . . . . 36 GLY HA2 . 17034 4 169 . 1 1 56 56 GLY N N 15 110.048 0.20 . 1 . . . . 36 GLY N . 17034 4 170 . 1 1 57 57 GLY H H 1 8.308 0.02 . 1 . . . . 37 GLY HN . 17034 4 171 . 1 1 57 57 GLY HA2 H 1 3.98 0.02 . 2 . . . . 37 GLY HA2 . 17034 4 172 . 1 1 57 57 GLY N N 15 108.734 0.20 . 1 . . . . 37 GLY N . 17034 4 173 . 1 1 58 58 TYR H H 1 7.739 0.02 . 1 . . . . 38 TYR HN . 17034 4 174 . 1 1 58 58 TYR HA H 1 4.44 0.02 . 1 . . . . 38 TYR HA . 17034 4 175 . 1 1 58 58 TYR HB2 H 1 2.86 0.02 . 2 . . . . 38 TYR HB2 . 17034 4 176 . 1 1 58 58 TYR N N 15 117.87 0.20 . 1 . . . . 38 TYR N . 17034 4 177 . 1 1 59 59 MET H H 1 8.98 0.02 . 1 . . . . 39 MET HN . 17034 4 178 . 1 1 59 59 MET HA H 1 4.52 0.02 . 1 . . . . 39 MET HA . 17034 4 179 . 1 1 59 59 MET HB2 H 1 1.6 0.02 . 2 . . . . 39 MET HB1 . 17034 4 180 . 1 1 59 59 MET HB3 H 1 1.26 0.02 . 2 . . . . 39 MET HB2 . 17034 4 181 . 1 1 59 59 MET HG2 H 1 2.48 0.02 . 2 . . . . 39 MET HG1 . 17034 4 182 . 1 1 59 59 MET HG3 H 1 2.05 0.02 . 2 . . . . 39 MET HG2 . 17034 4 183 . 1 1 59 59 MET N N 15 121.171 0.20 . 1 . . . . 39 MET N . 17034 4 184 . 1 1 60 60 LEU H H 1 8.1 0.02 . 1 . . . . 40 LEU HN . 17034 4 185 . 1 1 60 60 LEU HA H 1 4.67 0.02 . 1 . . . . 40 LEU HA . 17034 4 186 . 1 1 60 60 LEU HB2 H 1 1.01 0.02 . 2 . . . . 40 LEU HB1 . 17034 4 187 . 1 1 60 60 LEU HB3 H 1 1.58 0.02 . 2 . . . . 40 LEU HB2 . 17034 4 188 . 1 1 60 60 LEU HD11 H 1 0.62 0.02 . 2 . . . . 40 LEU HD11 . 17034 4 189 . 1 1 60 60 LEU HD12 H 1 0.62 0.02 . 2 . . . . 40 LEU HD11 . 17034 4 190 . 1 1 60 60 LEU HD13 H 1 0.62 0.02 . 2 . . . . 40 LEU HD11 . 17034 4 191 . 1 1 60 60 LEU HD21 H 1 0.089 0.02 . 2 . . . . 40 LEU HD21 . 17034 4 192 . 1 1 60 60 LEU HD22 H 1 0.089 0.02 . 2 . . . . 40 LEU HD21 . 17034 4 193 . 1 1 60 60 LEU HD23 H 1 0.089 0.02 . 2 . . . . 40 LEU HD21 . 17034 4 194 . 1 1 60 60 LEU N N 15 122.024 0.20 . 1 . . . . 40 LEU N . 17034 4 195 . 1 1 61 61 GLY H H 1 9.183 0.02 . 1 . . . . 41 GLY HN . 17034 4 196 . 1 1 61 61 GLY HA2 H 1 4.34 0.02 . 2 . . . . 41 GLY HA1 . 17034 4 197 . 1 1 61 61 GLY HA3 H 1 3.93 0.02 . 2 . . . . 41 GLY HA2 . 17034 4 198 . 1 1 61 61 GLY N N 15 114.337 0.20 . 1 . . . . 41 GLY N . 17034 4 199 . 1 1 62 62 SER H H 1 8.253 0.02 . 1 . . . . 42 SER HN . 17034 4 200 . 1 1 62 62 SER HA H 1 4.4 0.02 . 1 . . . . 42 SER HA . 17034 4 201 . 1 1 62 62 SER HB2 H 1 3.92 0.02 . 2 . . . . 42 SER HB2 . 17034 4 202 . 1 1 62 62 SER N N 15 113.857 0.20 . 1 . . . . 42 SER N . 17034 4 203 . 1 1 63 63 ALA H H 1 8.677 0.02 . 1 . . . . 43 ALA HN . 17034 4 204 . 1 1 63 63 ALA HA H 1 4.36 0.02 . 1 . . . . 43 ALA HA . 17034 4 205 . 1 1 63 63 ALA HB1 H 1 1.25 0.02 . 1 . . . . 43 ALA HB1 . 17034 4 206 . 1 1 63 63 ALA HB2 H 1 1.25 0.02 . 1 . . . . 43 ALA HB1 . 17034 4 207 . 1 1 63 63 ALA HB3 H 1 1.25 0.02 . 1 . . . . 43 ALA HB1 . 17034 4 208 . 1 1 63 63 ALA N N 15 125.567 0.20 . 1 . . . . 43 ALA N . 17034 4 209 . 1 1 64 64 MET H H 1 8.711 0.02 . 1 . . . . 44 MET HN . 17034 4 210 . 1 1 64 64 MET HA H 1 4.65 0.02 . 1 . . . . 44 MET HA . 17034 4 211 . 1 1 64 64 MET HB2 H 1 2.09 0.02 . 2 . . . . 44 MET HB1 . 17034 4 212 . 1 1 64 64 MET HE1 H 1 1.95 0.02 . 1 . . . . 44 MET HE1 . 17034 4 213 . 1 1 64 64 MET HE2 H 1 1.95 0.02 . 1 . . . . 44 MET HE1 . 17034 4 214 . 1 1 64 64 MET HE3 H 1 1.95 0.02 . 1 . . . . 44 MET HE1 . 17034 4 215 . 1 1 64 64 MET HG2 H 1 2.57 0.02 . 2 . . . . 44 MET HG1 . 17034 4 216 . 1 1 64 64 MET HG3 H 1 2.44 0.02 . 2 . . . . 44 MET HG2 . 17034 4 217 . 1 1 64 64 MET N N 15 121.501 0.20 . 1 . . . . 44 MET N . 17034 4 218 . 1 1 65 65 SER H H 1 8.342 0.02 . 1 . . . . 45 SER HN . 17034 4 219 . 1 1 65 65 SER HA H 1 4.37 0.02 . 1 . . . . 45 SER HA . 17034 4 220 . 1 1 65 65 SER HB2 H 1 3.8 0.02 . 2 . . . . 45 SER HB2 . 17034 4 221 . 1 1 65 65 SER N N 15 116.159 0.20 . 1 . . . . 45 SER N . 17034 4 222 . 1 1 66 66 ARG H H 1 8.591 0.02 . 1 . . . . 46 ARG HN . 17034 4 223 . 1 1 66 66 ARG HA H 1 4.42 0.02 . 1 . . . . 46 ARG HA . 17034 4 224 . 1 1 66 66 ARG HB2 H 1 1.8 0.02 . 2 . . . . 46 ARG HB1 . 17034 4 225 . 1 1 66 66 ARG HD2 H 1 3.15 0.02 . 2 . . . . 46 ARG HD2 . 17034 4 226 . 1 1 66 66 ARG HG2 H 1 1.64 0.02 . 2 . . . . 46 ARG HG2 . 17034 4 227 . 1 1 66 66 ARG N N 15 125.873 0.20 . 1 . . . . 46 ARG N . 17034 4 228 . 1 1 68 68 MET H H 1 8.664 0.02 . 1 . . . . 48 MET HN . 17034 4 229 . 1 1 68 68 MET HA H 1 4.7 0.02 . 1 . . . . 48 MET HA . 17034 4 230 . 1 1 68 68 MET HB2 H 1 1.99 0.02 . 2 . . . . 48 MET HB2 . 17034 4 231 . 1 1 68 68 MET HG2 H 1 2.61 0.02 . 2 . . . . 48 MET HG2 . 17034 4 232 . 1 1 68 68 MET N N 15 122.431 0.20 . 1 . . . . 48 MET N . 17034 4 233 . 1 1 69 69 MET H H 1 7.357 0.02 . 1 . . . . 49 MET HN . 17034 4 234 . 1 1 69 69 MET HA H 1 4.32 0.02 . 1 . . . . 49 MET HA . 17034 4 235 . 1 1 69 69 MET HB2 H 1 1.08 0.02 . 2 . . . . 49 MET HB2 . 17034 4 236 . 1 1 69 69 MET HG2 H 1 1.93 0.02 . 2 . . . . 49 MET HG1 . 17034 4 237 . 1 1 69 69 MET HG3 H 1 1.75 0.02 . 2 . . . . 49 MET HG2 . 17034 4 238 . 1 1 69 69 MET N N 15 121.88 0.20 . 1 . . . . 49 MET N . 17034 4 239 . 1 1 70 70 HIS H H 1 8.143 0.02 . 1 . . . . 50 HIS HN . 17034 4 240 . 1 1 70 70 HIS HA H 1 4.88 0.02 . 1 . . . . 50 HIS HA . 17034 4 241 . 1 1 70 70 HIS HB2 H 1 3.25 0.02 . 2 . . . . 50 HIS HB1 . 17034 4 242 . 1 1 70 70 HIS HB3 H 1 2.91 0.02 . 2 . . . . 50 HIS HB2 . 17034 4 243 . 1 1 70 70 HIS N N 15 118.393 0.20 . 1 . . . . 50 HIS N . 17034 4 244 . 1 1 71 71 PHE H H 1 10.273 0.02 . 1 . . . . 51 PHE HN . 17034 4 245 . 1 1 71 71 PHE HA H 1 4.36 0.02 . 1 . . . . 51 PHE HA . 17034 4 246 . 1 1 71 71 PHE HB2 H 1 2.8 0.02 . 2 . . . . 51 PHE HB1 . 17034 4 247 . 1 1 71 71 PHE HB3 H 1 2.68 0.02 . 2 . . . . 51 PHE HB2 . 17034 4 248 . 1 1 71 71 PHE N N 15 123.198 0.20 . 1 . . . . 51 PHE N . 17034 4 249 . 1 1 72 72 GLY H H 1 8.973 0.02 . 1 . . . . 52 GLY HN . 17034 4 250 . 1 1 72 72 GLY HA2 H 1 3.74 0.02 . 2 . . . . 52 GLY HA1 . 17034 4 251 . 1 1 72 72 GLY HA3 H 1 4.11 0.02 . 2 . . . . 52 GLY HA2 . 17034 4 252 . 1 1 72 72 GLY N N 15 109.515 0.20 . 1 . . . . 52 GLY N . 17034 4 253 . 1 1 73 73 ASN H H 1 7.16 0.02 . 1 . . . . 53 ASN HN . 17034 4 254 . 1 1 73 73 ASN HA H 1 4.87 0.02 . 1 . . . . 53 ASN HA . 17034 4 255 . 1 1 73 73 ASN HB2 H 1 2.75 0.02 . 2 . . . . 53 ASN HB2 . 17034 4 256 . 1 1 73 73 ASN N N 15 114.961 0.20 . 1 . . . . 53 ASN N . 17034 4 257 . 1 1 74 74 ASP H H 1 9.006 0.02 . 1 . . . . 54 ASP HN . 17034 4 258 . 1 1 74 74 ASP HA H 1 4.48 0.02 . 1 . . . . 54 ASP HA . 17034 4 259 . 1 1 74 74 ASP HB2 H 1 2.8 0.02 . 2 . . . . 54 ASP HB2 . 17034 4 260 . 1 1 74 74 ASP N N 15 123.463 0.20 . 1 . . . . 54 ASP N . 17034 4 261 . 1 1 75 75 TRP H H 1 8.42 0.02 . 1 . . . . 55 TRP HN . 17034 4 262 . 1 1 75 75 TRP HA H 1 4.28 0.02 . 1 . . . . 55 TRP HA . 17034 4 263 . 1 1 75 75 TRP HB2 H 1 2.81 0.02 . 2 . . . . 55 TRP HB1 . 17034 4 264 . 1 1 75 75 TRP HB3 H 1 3.42 0.02 . 2 . . . . 55 TRP HB2 . 17034 4 265 . 1 1 75 75 TRP N N 15 120.342 0.20 . 1 . . . . 55 TRP N . 17034 4 266 . 1 1 76 76 GLU H H 1 8.138 0.02 . 1 . . . . 56 GLU HN . 17034 4 267 . 1 1 76 76 GLU HA H 1 3.38 0.02 . 1 . . . . 56 GLU HA . 17034 4 268 . 1 1 76 76 GLU N N 15 121.546 0.20 . 1 . . . . 56 GLU N . 17034 4 269 . 1 1 77 77 ASP H H 1 7.97 0.02 . 1 . . . . 57 ASP HN . 17034 4 270 . 1 1 77 77 ASP HA H 1 4.53 0.02 . 1 . . . . 57 ASP HA . 17034 4 271 . 1 1 77 77 ASP HB2 H 1 2.96 0.02 . 2 . . . . 57 ASP HB2 . 17034 4 272 . 1 1 77 77 ASP N N 15 120.0 0.20 . 1 . . . . 57 ASP N . 17034 4 273 . 1 1 78 78 ARG H H 1 7.957 0.02 . 1 . . . . 58 ARG HN . 17034 4 274 . 1 1 78 78 ARG HA H 1 3.94 0.02 . 1 . . . . 58 ARG HA . 17034 4 275 . 1 1 78 78 ARG N N 15 120.311 0.20 . 1 . . . . 58 ARG N . 17034 4 276 . 1 1 79 79 TYR H H 1 8.313 0.02 . 1 . . . . 59 TYR HN . 17034 4 277 . 1 1 79 79 TYR N N 15 121.404 0.20 . 1 . . . . 59 TYR N . 17034 4 278 . 1 1 80 80 TYR H H 1 8.842 0.02 . 1 . . . . 60 TYR HN . 17034 4 279 . 1 1 80 80 TYR N N 15 119.71 0.20 . 1 . . . . 60 TYR N . 17034 4 280 . 1 1 81 81 ARG H H 1 7.736 0.02 . 1 . . . . 61 ARG HN . 17034 4 281 . 1 1 81 81 ARG HA H 1 3.7 0.02 . 1 . . . . 61 ARG HA . 17034 4 282 . 1 1 81 81 ARG HB2 H 1 1.91 0.02 . 2 . . . . 61 ARG HB2 . 17034 4 283 . 1 1 81 81 ARG HG2 H 1 1.71 0.02 . 2 . . . . 61 ARG HG2 . 17034 4 284 . 1 1 81 81 ARG N N 15 116.834 0.20 . 1 . . . . 61 ARG N . 17034 4 285 . 1 1 82 82 GLU H H 1 7.852 0.02 . 1 . . . . 62 GLU HN . 17034 4 286 . 1 1 82 82 GLU HA H 1 4.04 0.02 . 1 . . . . 62 GLU HA . 17034 4 287 . 1 1 82 82 GLU HB2 H 1 1.88 0.02 . 2 . . . . 62 GLU HB1 . 17034 4 288 . 1 1 82 82 GLU HB3 H 1 1.71 0.02 . 2 . . . . 62 GLU HB2 . 17034 4 289 . 1 1 82 82 GLU HG2 H 1 2.4 0.02 . 2 . . . . 62 GLU HG1 . 17034 4 290 . 1 1 82 82 GLU HG3 H 1 2.19 0.02 . 2 . . . . 62 GLU HG2 . 17034 4 291 . 1 1 82 82 GLU N N 15 115.488 0.20 . 1 . . . . 62 GLU N . 17034 4 292 . 1 1 83 83 ASN H H 1 7.486 0.02 . 1 . . . . 63 ASN HN . 17034 4 293 . 1 1 83 83 ASN HA H 1 4.6 0.02 . 1 . . . . 63 ASN HA . 17034 4 294 . 1 1 83 83 ASN HB2 H 1 2.42 0.02 . 2 . . . . 63 ASN HB1 . 17034 4 295 . 1 1 83 83 ASN HB3 H 1 2.17 0.02 . 2 . . . . 63 ASN HB2 . 17034 4 296 . 1 1 83 83 ASN N N 15 116.035 0.20 . 1 . . . . 63 ASN N . 17034 4 297 . 1 1 84 84 MET H H 1 7.461 0.02 . 1 . . . . 64 MET HN . 17034 4 298 . 1 1 84 84 MET HA H 1 3.66 0.02 . 1 . . . . 64 MET HA . 17034 4 299 . 1 1 84 84 MET HB2 H 1 1.77 0.02 . 2 . . . . 64 MET HB1 . 17034 4 300 . 1 1 84 84 MET HB3 H 1 1.53 0.02 . 2 . . . . 64 MET HB2 . 17034 4 301 . 1 1 84 84 MET HG2 H 1 2.2 0.02 . 2 . . . . 64 MET HG2 . 17034 4 302 . 1 1 84 84 MET N N 15 118.751 0.20 . 1 . . . . 64 MET N . 17034 4 303 . 1 1 85 85 ASN H H 1 8.162 0.02 . 1 . . . . 65 ASN HN . 17034 4 304 . 1 1 85 85 ASN HA H 1 4.401 0.02 . 1 . . . . 65 ASN HA . 17034 4 305 . 1 1 85 85 ASN N N 15 114.529 0.20 . 1 . . . . 65 ASN N . 17034 4 306 . 1 1 86 86 ARG H H 1 7.986 0.02 . 1 . . . . 66 ARG HN . 17034 4 307 . 1 1 86 86 ARG HA H 1 4.2 0.02 . 1 . . . . 66 ARG HA . 17034 4 308 . 1 1 86 86 ARG HB2 H 1 1.47 0.02 . 2 . . . . 66 ARG HB2 . 17034 4 309 . 1 1 86 86 ARG N N 15 117.669 0.20 . 1 . . . . 66 ARG N . 17034 4 310 . 1 1 87 87 TYR H H 1 7.299 0.02 . 1 . . . . 67 TYR HN . 17034 4 311 . 1 1 87 87 TYR HA H 1 4.96 0.02 . 1 . . . . 67 TYR HA . 17034 4 312 . 1 1 87 87 TYR HB2 H 1 3.12 0.02 . 2 . . . . 67 TYR HB1 . 17034 4 313 . 1 1 87 87 TYR HB3 H 1 2.98 0.02 . 2 . . . . 67 TYR HB2 . 17034 4 314 . 1 1 87 87 TYR N N 15 119.432 0.20 . 1 . . . . 67 TYR N . 17034 4 315 . 1 1 89 89 ASN H H 1 8.422 0.02 . 1 . . . . 69 ASN HN . 17034 4 316 . 1 1 89 89 ASN HA H 1 4.72 0.02 . 1 . . . . 69 ASN HA . 17034 4 317 . 1 1 89 89 ASN HB2 H 1 2.4 0.02 . 2 . . . . 69 ASN HB2 . 17034 4 318 . 1 1 89 89 ASN N N 15 116.079 0.20 . 1 . . . . 69 ASN N . 17034 4 319 . 1 1 90 90 GLN H H 1 7.216 0.02 . 1 . . . . 70 GLN HN . 17034 4 320 . 1 1 90 90 GLN HA H 1 4.6 0.02 . 1 . . . . 70 GLN HA . 17034 4 321 . 1 1 90 90 GLN HB2 H 1 1.7 0.02 . 2 . . . . 70 GLN HB1 . 17034 4 322 . 1 1 90 90 GLN HB3 H 1 2.04 0.02 . 2 . . . . 70 GLN HB2 . 17034 4 323 . 1 1 90 90 GLN HG2 H 1 2.09 0.02 . 2 . . . . 70 GLN HG2 . 17034 4 324 . 1 1 90 90 GLN N N 15 114.58 0.20 . 1 . . . . 70 GLN N . 17034 4 325 . 1 1 91 91 VAL H H 1 8.496 0.02 . 1 . . . . 71 VAL HN . 17034 4 326 . 1 1 91 91 VAL HA H 1 4.83 0.02 . 1 . . . . 71 VAL HA . 17034 4 327 . 1 1 91 91 VAL N N 15 111.639 0.20 . 1 . . . . 71 VAL N . 17034 4 328 . 1 1 92 92 TYR H H 1 8.298 0.02 . 1 . . . . 72 TYR HN . 17034 4 329 . 1 1 92 92 TYR HA H 1 5.48 0.02 . 1 . . . . 72 TYR HA . 17034 4 330 . 1 1 92 92 TYR HB2 H 1 2.55 0.02 . 2 . . . . 72 TYR HB1 . 17034 4 331 . 1 1 92 92 TYR HB3 H 1 2.48 0.02 . 2 . . . . 72 TYR HB2 . 17034 4 332 . 1 1 92 92 TYR N N 15 120.889 0.20 . 1 . . . . 72 TYR N . 17034 4 333 . 1 1 93 93 TYR H H 1 8.5 0.02 . 1 . . . . 73 TYR HN . 17034 4 334 . 1 1 93 93 TYR HA H 1 4.83 0.02 . 1 . . . . 73 TYR HA . 17034 4 335 . 1 1 93 93 TYR HB2 H 1 2.85 0.02 . 2 . . . . 73 TYR HB1 . 17034 4 336 . 1 1 93 93 TYR HB3 H 1 2.58 0.02 . 2 . . . . 73 TYR HB2 . 17034 4 337 . 1 1 93 93 TYR N N 15 111.6 0.20 . 1 . . . . 73 TYR N . 17034 4 338 . 1 1 94 94 ARG H H 1 7.96 0.02 . 1 . . . . 74 ARG HN . 17034 4 339 . 1 1 94 94 ARG HA H 1 4.69 0.02 . 1 . . . . 74 ARG HA . 17034 4 340 . 1 1 94 94 ARG HB2 H 1 1.83 0.02 . 2 . . . . 74 ARG HB2 . 17034 4 341 . 1 1 94 94 ARG N N 15 120.554 0.20 . 1 . . . . 74 ARG N . 17034 4 342 . 1 1 96 96 VAL H H 1 8.486 0.02 . 1 . . . . 76 VAL HN . 17034 4 343 . 1 1 96 96 VAL HA H 1 4.45 0.02 . 1 . . . . 76 VAL HA . 17034 4 344 . 1 1 96 96 VAL HG21 H 1 0.96 0.02 . 2 . . . . 76 VAL HG21 . 17034 4 345 . 1 1 96 96 VAL HG22 H 1 0.96 0.02 . 2 . . . . 76 VAL HG21 . 17034 4 346 . 1 1 96 96 VAL HG23 H 1 0.96 0.02 . 2 . . . . 76 VAL HG21 . 17034 4 347 . 1 1 96 96 VAL N N 15 119.125 0.20 . 1 . . . . 76 VAL N . 17034 4 348 . 1 1 97 97 ASP H H 1 8.2 0.02 . 1 . . . . 77 ASP HN . 17034 4 349 . 1 1 97 97 ASP HA H 1 4.48 0.02 . 1 . . . . 77 ASP HA . 17034 4 350 . 1 1 97 97 ASP HB2 H 1 2.98 0.02 . 2 . . . . 77 ASP HB1 . 17034 4 351 . 1 1 97 97 ASP HB3 H 1 2.5 0.02 . 2 . . . . 77 ASP HB2 . 17034 4 352 . 1 1 97 97 ASP N N 15 117.105 0.20 . 1 . . . . 77 ASP N . 17034 4 353 . 1 1 98 98 GLN H H 1 8.169 0.02 . 1 . . . . 78 GLN HN . 17034 4 354 . 1 1 98 98 GLN HA H 1 4.12 0.02 . 1 . . . . 78 GLN HA . 17034 4 355 . 1 1 98 98 GLN HB2 H 1 1.75 0.02 . 2 . . . . 78 GLN HB2 . 17034 4 356 . 1 1 98 98 GLN N N 15 117.95 0.20 . 1 . . . . 78 GLN N . 17034 4 357 . 1 1 99 99 TYR H H 1 7.868 0.02 . 1 . . . . 79 TYR HN . 17034 4 358 . 1 1 99 99 TYR HA H 1 4.81 0.02 . 1 . . . . 79 TYR HA . 17034 4 359 . 1 1 99 99 TYR HB2 H 1 3.25 0.02 . 2 . . . . 79 TYR HB1 . 17034 4 360 . 1 1 99 99 TYR HB3 H 1 3.0 0.02 . 2 . . . . 79 TYR HB2 . 17034 4 361 . 1 1 99 99 TYR N N 15 117.047 0.20 . 1 . . . . 79 TYR N . 17034 4 362 . 1 1 100 100 ASN H H 1 8.874 0.02 . 1 . . . . 80 ASN HN . 17034 4 363 . 1 1 100 100 ASN HA H 1 4.84 0.02 . 1 . . . . 80 ASN HA . 17034 4 364 . 1 1 100 100 ASN HB2 H 1 2.94 0.02 . 2 . . . . 80 ASN HB2 . 17034 4 365 . 1 1 100 100 ASN N N 15 117.531 0.20 . 1 . . . . 80 ASN N . 17034 4 366 . 1 1 101 101 ASN H H 1 7.63 0.02 . 1 . . . . 81 ASN HN . 17034 4 367 . 1 1 101 101 ASN HA H 1 4.75 0.02 . 1 . . . . 81 ASN HA . 17034 4 368 . 1 1 101 101 ASN HB2 H 1 3.23 0.02 . 2 . . . . 81 ASN HB1 . 17034 4 369 . 1 1 101 101 ASN HB3 H 1 3.06 0.02 . 2 . . . . 81 ASN HB2 . 17034 4 370 . 1 1 101 101 ASN N N 15 113.842 0.20 . 1 . . . . 81 ASN N . 17034 4 371 . 1 1 102 102 GLN H H 1 8.641 0.02 . 1 . . . . 82 GLN HN . 17034 4 372 . 1 1 102 102 GLN HA H 1 2.98 0.02 . 1 . . . . 82 GLN HA . 17034 4 373 . 1 1 102 102 GLN N N 15 121.364 0.20 . 1 . . . . 82 GLN N . 17034 4 374 . 1 1 103 103 ASN H H 1 8.385 0.02 . 1 . . . . 83 ASN HN . 17034 4 375 . 1 1 103 103 ASN HA H 1 4.36 0.02 . 1 . . . . 83 ASN HA . 17034 4 376 . 1 1 103 103 ASN HB2 H 1 2.9 0.02 . 2 . . . . 83 ASN HB1 . 17034 4 377 . 1 1 103 103 ASN HB3 H 1 2.7 0.02 . 2 . . . . 83 ASN HB2 . 17034 4 378 . 1 1 103 103 ASN N N 15 117.573 0.20 . 1 . . . . 83 ASN N . 17034 4 379 . 1 1 104 104 ASN H H 1 8.468 0.02 . 1 . . . . 84 ASN HN . 17034 4 380 . 1 1 104 104 ASN HA H 1 4.54 0.02 . 1 . . . . 84 ASN HA . 17034 4 381 . 1 1 104 104 ASN HB2 H 1 3.15 0.02 . 2 . . . . 84 ASN HB1 . 17034 4 382 . 1 1 104 104 ASN HB3 H 1 2.95 0.02 . 2 . . . . 84 ASN HB2 . 17034 4 383 . 1 1 104 104 ASN N N 15 118.502 0.20 . 1 . . . . 84 ASN N . 17034 4 384 . 1 1 105 105 PHE H H 1 7.26 0.02 . 1 . . . . 85 PHE HN . 17034 4 385 . 1 1 105 105 PHE HA H 1 2.96 0.02 . 1 . . . . 85 PHE HA . 17034 4 386 . 1 1 105 105 PHE HB2 H 1 2.51 0.02 . 2 . . . . 85 PHE HB2 . 17034 4 387 . 1 1 105 105 PHE N N 15 121.305 0.20 . 1 . . . . 85 PHE N . 17034 4 388 . 1 1 106 106 VAL H H 1 8.792 0.02 . 1 . . . . 86 VAL HN . 17034 4 389 . 1 1 106 106 VAL HA H 1 3.34 0.02 . 1 . . . . 86 VAL HA . 17034 4 390 . 1 1 106 106 VAL HB H 1 2.21 0.02 . 1 . . . . 86 VAL HB . 17034 4 391 . 1 1 106 106 VAL HG21 H 1 1.04 0.02 . 2 . . . . 86 VAL HG21 . 17034 4 392 . 1 1 106 106 VAL HG22 H 1 1.04 0.02 . 2 . . . . 86 VAL HG21 . 17034 4 393 . 1 1 106 106 VAL HG23 H 1 1.04 0.02 . 2 . . . . 86 VAL HG21 . 17034 4 394 . 1 1 106 106 VAL N N 15 120.199 0.20 . 1 . . . . 86 VAL N . 17034 4 395 . 1 1 107 107 HIS H H 1 8.435 0.02 . 1 . . . . 87 HIS HN . 17034 4 396 . 1 1 107 107 HIS HA H 1 4.42 0.02 . 1 . . . . 87 HIS HA . 17034 4 397 . 1 1 107 107 HIS HB2 H 1 3.81 0.02 . 2 . . . . 87 HIS HB2 . 17034 4 398 . 1 1 107 107 HIS N N 15 116.875 0.20 . 1 . . . . 87 HIS N . 17034 4 399 . 1 1 108 108 ASP H H 1 7.692 0.02 . 1 . . . . 88 ASP HN . 17034 4 400 . 1 1 108 108 ASP HA H 1 4.58 0.02 . 1 . . . . 88 ASP HA . 17034 4 401 . 1 1 108 108 ASP HB2 H 1 2.95 0.02 . 2 . . . . 88 ASP HB1 . 17034 4 402 . 1 1 108 108 ASP HB3 H 1 3.38 0.02 . 2 . . . . 88 ASP HB2 . 17034 4 403 . 1 1 108 108 ASP N N 15 118.82 0.20 . 1 . . . . 88 ASP N . 17034 4 404 . 1 1 109 109 CYS H H 1 8.104 0.02 . 1 . . . . 89 CYS HN . 17034 4 405 . 1 1 109 109 CYS HA H 1 4.65 0.02 . 1 . . . . 89 CYS HA . 17034 4 406 . 1 1 109 109 CYS HB2 H 1 3.3 0.02 . 2 . . . . 89 CYS HB1 . 17034 4 407 . 1 1 109 109 CYS HB3 H 1 2.89 0.02 . 2 . . . . 89 CYS HB2 . 17034 4 408 . 1 1 109 109 CYS N N 15 119.433 0.20 . 1 . . . . 89 CYS N . 17034 4 409 . 1 1 110 110 VAL H H 1 9.118 0.02 . 1 . . . . 90 VAL HN . 17034 4 410 . 1 1 110 110 VAL HA H 1 3.63 0.02 . 1 . . . . 90 VAL HA . 17034 4 411 . 1 1 110 110 VAL HB H 1 2.16 0.02 . 1 . . . . 90 VAL HB . 17034 4 412 . 1 1 110 110 VAL HG11 H 1 1.01 0.02 . 2 . . . . 90 VAL HG11 . 17034 4 413 . 1 1 110 110 VAL HG12 H 1 1.01 0.02 . 2 . . . . 90 VAL HG11 . 17034 4 414 . 1 1 110 110 VAL HG13 H 1 1.01 0.02 . 2 . . . . 90 VAL HG11 . 17034 4 415 . 1 1 110 110 VAL HG21 H 1 1.12 0.02 . 2 . . . . 90 VAL HG21 . 17034 4 416 . 1 1 110 110 VAL HG22 H 1 1.12 0.02 . 2 . . . . 90 VAL HG21 . 17034 4 417 . 1 1 110 110 VAL HG23 H 1 1.12 0.02 . 2 . . . . 90 VAL HG21 . 17034 4 418 . 1 1 110 110 VAL N N 15 125.018 0.20 . 1 . . . . 90 VAL N . 17034 4 419 . 1 1 111 111 ASN H H 1 7.701 0.02 . 1 . . . . 91 ASN HN . 17034 4 420 . 1 1 111 111 ASN HA H 1 4.33 0.02 . 1 . . . . 91 ASN HA . 17034 4 421 . 1 1 111 111 ASN HB2 H 1 2.81 0.02 . 2 . . . . 91 ASN HB2 . 17034 4 422 . 1 1 111 111 ASN N N 15 116.802 0.20 . 1 . . . . 91 ASN N . 17034 4 423 . 1 1 112 112 ILE H H 1 8.717 0.02 . 1 . . . . 92 ILE HN . 17034 4 424 . 1 1 112 112 ILE HA H 1 3.69 0.02 . 1 . . . . 92 ILE HA . 17034 4 425 . 1 1 112 112 ILE HB H 1 1.57 0.02 . 1 . . . . 92 ILE HB . 17034 4 426 . 1 1 112 112 ILE N N 15 118.941 0.20 . 1 . . . . 92 ILE N . 17034 4 427 . 1 1 113 113 THR H H 1 8.166 0.02 . 1 . . . . 93 THR HN . 17034 4 428 . 1 1 113 113 THR HA H 1 4.11 0.02 . 1 . . . . 93 THR HA . 17034 4 429 . 1 1 113 113 THR HB H 1 4.45 0.02 . 1 . . . . 93 THR HB . 17034 4 430 . 1 1 113 113 THR HG21 H 1 1.5 0.02 . 1 . . . . 93 THR HG21 . 17034 4 431 . 1 1 113 113 THR HG22 H 1 1.5 0.02 . 1 . . . . 93 THR HG21 . 17034 4 432 . 1 1 113 113 THR HG23 H 1 1.5 0.02 . 1 . . . . 93 THR HG21 . 17034 4 433 . 1 1 113 113 THR N N 15 118.096 0.20 . 1 . . . . 93 THR N . 17034 4 434 . 1 1 114 114 ILE H H 1 8.552 0.02 . 1 . . . . 94 ILE HN . 17034 4 435 . 1 1 114 114 ILE N N 15 120.485 0.20 . 1 . . . . 94 ILE N . 17034 4 436 . 1 1 115 115 LYS H H 1 8.067 0.02 . 1 . . . . 95 LYS HN . 17034 4 437 . 1 1 115 115 LYS HA H 1 4.13 0.02 . 1 . . . . 95 LYS HA . 17034 4 438 . 1 1 115 115 LYS HG2 H 1 1.56 0.02 . 2 . . . . 95 LYS HG2 . 17034 4 439 . 1 1 115 115 LYS N N 15 122.399 0.20 . 1 . . . . 95 LYS N . 17034 4 440 . 1 1 116 116 GLN H H 1 8.194 0.02 . 1 . . . . 96 GLN HN . 17034 4 441 . 1 1 116 116 GLN HA H 1 4.01 0.02 . 1 . . . . 96 GLN HA . 17034 4 442 . 1 1 116 116 GLN HB2 H 1 1.88 0.02 . 2 . . . . 96 GLN HB1 . 17034 4 443 . 1 1 116 116 GLN HB3 H 1 1.81 0.02 . 2 . . . . 96 GLN HB2 . 17034 4 444 . 1 1 116 116 GLN HG2 H 1 2.07 0.02 . 2 . . . . 96 GLN HG1 . 17034 4 445 . 1 1 116 116 GLN HG3 H 1 1.51 0.02 . 2 . . . . 96 GLN HG2 . 17034 4 446 . 1 1 116 116 GLN N N 15 115.849 0.20 . 1 . . . . 96 GLN N . 17034 4 447 . 1 1 117 117 HIS H H 1 7.937 0.02 . 1 . . . . 97 HIS HN . 17034 4 448 . 1 1 117 117 HIS HA H 1 4.65 0.02 . 1 . . . . 97 HIS HA . 17034 4 449 . 1 1 117 117 HIS HB2 H 1 3.44 0.02 . 2 . . . . 97 HIS HB1 . 17034 4 450 . 1 1 117 117 HIS HB3 H 1 3.25 0.02 . 2 . . . . 97 HIS HB2 . 17034 4 451 . 1 1 117 117 HIS N N 15 116.011 0.20 . 1 . . . . 97 HIS N . 17034 4 452 . 1 1 118 118 THR H H 1 8.013 0.02 . 1 . . . . 98 THR HN . 17034 4 453 . 1 1 118 118 THR HA H 1 4.24 0.02 . 1 . . . . 98 THR HA . 17034 4 454 . 1 1 118 118 THR HB H 1 4.66 0.02 . 1 . . . . 98 THR HB . 17034 4 455 . 1 1 118 118 THR HG21 H 1 1.1 0.02 . 1 . . . . 98 THR HG21 . 17034 4 456 . 1 1 118 118 THR HG22 H 1 1.1 0.02 . 1 . . . . 98 THR HG21 . 17034 4 457 . 1 1 118 118 THR HG23 H 1 1.1 0.02 . 1 . . . . 98 THR HG21 . 17034 4 458 . 1 1 118 118 THR N N 15 112.565 0.20 . 1 . . . . 98 THR N . 17034 4 459 . 1 1 119 119 VAL H H 1 7.921 0.02 . 1 . . . . 99 VAL HN . 17034 4 460 . 1 1 119 119 VAL HA H 1 4.02 0.02 . 1 . . . . 99 VAL HA . 17034 4 461 . 1 1 119 119 VAL HB H 1 2.12 0.02 . 1 . . . . 99 VAL HB . 17034 4 462 . 1 1 119 119 VAL HG11 H 1 0.98 0.02 . 2 . . . . 99 VAL HG11 . 17034 4 463 . 1 1 119 119 VAL HG12 H 1 0.98 0.02 . 2 . . . . 99 VAL HG11 . 17034 4 464 . 1 1 119 119 VAL HG13 H 1 0.98 0.02 . 2 . . . . 99 VAL HG11 . 17034 4 465 . 1 1 119 119 VAL HG21 H 1 1.17 0.02 . 2 . . . . 99 VAL HG21 . 17034 4 466 . 1 1 119 119 VAL HG22 H 1 1.17 0.02 . 2 . . . . 99 VAL HG21 . 17034 4 467 . 1 1 119 119 VAL HG23 H 1 1.17 0.02 . 2 . . . . 99 VAL HG21 . 17034 4 468 . 1 1 119 119 VAL N N 15 121.534 0.20 . 1 . . . . 99 VAL N . 17034 4 469 . 1 1 120 120 THR H H 1 8.023 0.02 . 1 . . . . 100 THR HN . 17034 4 470 . 1 1 120 120 THR N N 15 115.608 0.20 . 1 . . . . 100 THR N . 17034 4 471 . 1 1 121 121 THR H H 1 7.989 0.02 . 1 . . . . 101 THR HN . 17034 4 472 . 1 1 121 121 THR N N 15 115.128 0.20 . 1 . . . . 101 THR N . 17034 4 473 . 1 1 122 122 THR H H 1 8.111 0.02 . 1 . . . . 102 THR HN . 17034 4 474 . 1 1 122 122 THR N N 15 115.361 0.20 . 1 . . . . 102 THR N . 17034 4 475 . 1 1 123 123 THR H H 1 8.009 0.02 . 1 . . . . 103 THR HN . 17034 4 476 . 1 1 123 123 THR N N 15 115.677 0.20 . 1 . . . . 103 THR N . 17034 4 477 . 1 1 124 124 LYS H H 1 8.088 0.02 . 1 . . . . 104 LYS HN . 17034 4 478 . 1 1 124 124 LYS HA H 1 4.36 0.02 . 1 . . . . 104 LYS HA . 17034 4 479 . 1 1 124 124 LYS HB2 H 1 1.54 0.02 . 2 . . . . 104 LYS HB2 . 17034 4 480 . 1 1 124 124 LYS HE2 H 1 3.38 0.02 . 2 . . . . 104 LYS HE2 . 17034 4 481 . 1 1 124 124 LYS N N 15 121.976 0.20 . 1 . . . . 104 LYS N . 17034 4 482 . 1 1 125 125 GLY H H 1 8.253 0.02 . 1 . . . . 105 GLY HN . 17034 4 483 . 1 1 125 125 GLY HA2 H 1 4.0 0.02 . 2 . . . . 105 GLY HA1 . 17034 4 484 . 1 1 125 125 GLY HA3 H 1 3.83 0.02 . 2 . . . . 105 GLY HA2 . 17034 4 485 . 1 1 125 125 GLY N N 15 109.705 0.20 . 1 . . . . 105 GLY N . 17034 4 486 . 1 1 126 126 GLU H H 1 7.899 0.02 . 1 . . . . 106 GLU HN . 17034 4 487 . 1 1 126 126 GLU HA H 1 3.67 0.02 . 1 . . . . 106 GLU HA . 17034 4 488 . 1 1 126 126 GLU HB2 H 1 1.8 0.02 . 2 . . . . 106 GLU HB2 . 17034 4 489 . 1 1 126 126 GLU HG2 H 1 2.35 0.02 . 2 . . . . 106 GLU HG1 . 17034 4 490 . 1 1 126 126 GLU HG3 H 1 2.21 0.02 . 2 . . . . 106 GLU HG2 . 17034 4 491 . 1 1 126 126 GLU N N 15 119.666 0.20 . 1 . . . . 106 GLU N . 17034 4 492 . 1 1 127 127 ASN H H 1 8.39 0.02 . 1 . . . . 107 ASN HN . 17034 4 493 . 1 1 127 127 ASN HA H 1 4.6 0.02 . 1 . . . . 107 ASN HA . 17034 4 494 . 1 1 127 127 ASN HB2 H 1 2.66 0.02 . 2 . . . . 107 ASN HB1 . 17034 4 495 . 1 1 127 127 ASN HB3 H 1 2.79 0.02 . 2 . . . . 107 ASN HB2 . 17034 4 496 . 1 1 127 127 ASN N N 15 119.965 0.20 . 1 . . . . 107 ASN N . 17034 4 497 . 1 1 128 128 PHE H H 1 8.439 0.02 . 1 . . . . 108 PHE HN . 17034 4 498 . 1 1 128 128 PHE HA H 1 5.14 0.02 . 1 . . . . 108 PHE HA . 17034 4 499 . 1 1 128 128 PHE HB2 H 1 3.0 0.02 . 2 . . . . 108 PHE HB2 . 17034 4 500 . 1 1 128 128 PHE N N 15 121.683 0.20 . 1 . . . . 108 PHE N . 17034 4 501 . 1 1 129 129 THR H H 1 9.385 0.02 . 1 . . . . 109 THR HN . 17034 4 502 . 1 1 129 129 THR HA H 1 4.61 0.02 . 1 . . . . 109 THR HA . 17034 4 503 . 1 1 129 129 THR HG21 H 1 1.4 0.02 . 1 . . . . 109 THR HG21 . 17034 4 504 . 1 1 129 129 THR HG22 H 1 1.4 0.02 . 1 . . . . 109 THR HG21 . 17034 4 505 . 1 1 129 129 THR HG23 H 1 1.4 0.02 . 1 . . . . 109 THR HG21 . 17034 4 506 . 1 1 129 129 THR N N 15 115.639 0.20 . 1 . . . . 109 THR N . 17034 4 507 . 1 1 130 130 GLU H H 1 9.014 0.02 . 1 . . . . 110 GLU HN . 17034 4 508 . 1 1 130 130 GLU HA H 1 4.1 0.02 . 1 . . . . 110 GLU HA . 17034 4 509 . 1 1 130 130 GLU HB2 H 1 2.13 0.02 . 2 . . . . 110 GLU HB1 . 17034 4 510 . 1 1 130 130 GLU HB3 H 1 1.99 0.02 . 2 . . . . 110 GLU HB2 . 17034 4 511 . 1 1 130 130 GLU HG2 H 1 2.42 0.02 . 2 . . . . 110 GLU HG2 . 17034 4 512 . 1 1 130 130 GLU N N 15 119.874 0.20 . 1 . . . . 110 GLU N . 17034 4 513 . 1 1 131 131 THR H H 1 7.896 0.02 . 1 . . . . 111 THR HN . 17034 4 514 . 1 1 131 131 THR HA H 1 3.8 0.02 . 1 . . . . 111 THR HA . 17034 4 515 . 1 1 131 131 THR HB H 1 3.8 0.02 . 1 . . . . 111 THR HB . 17034 4 516 . 1 1 131 131 THR HG21 H 1 0.8 0.02 . 1 . . . . 111 THR HG21 . 17034 4 517 . 1 1 131 131 THR HG22 H 1 0.8 0.02 . 1 . . . . 111 THR HG21 . 17034 4 518 . 1 1 131 131 THR HG23 H 1 0.8 0.02 . 1 . . . . 111 THR HG21 . 17034 4 519 . 1 1 131 131 THR N N 15 115.99 0.20 . 1 . . . . 111 THR N . 17034 4 520 . 1 1 132 132 ASP H H 1 7.545 0.02 . 1 . . . . 112 ASP HN . 17034 4 521 . 1 1 132 132 ASP HA H 1 4.53 0.02 . 1 . . . . 112 ASP HA . 17034 4 522 . 1 1 132 132 ASP HB2 H 1 2.58 0.02 . 2 . . . . 112 ASP HB1 . 17034 4 523 . 1 1 132 132 ASP HB3 H 1 3.27 0.02 . 2 . . . . 112 ASP HB2 . 17034 4 524 . 1 1 132 132 ASP N N 15 119.639 0.20 . 1 . . . . 112 ASP N . 17034 4 525 . 1 1 133 133 ILE H H 1 8.13 0.02 . 1 . . . . 113 ILE HN . 17034 4 526 . 1 1 133 133 ILE N N 15 119.8 0.20 . 1 . . . . 113 ILE N . 17034 4 527 . 1 1 134 134 LYS H H 1 7.915 0.02 . 1 . . . . 114 LYS HN . 17034 4 528 . 1 1 134 134 LYS HA H 1 4.04 0.02 . 1 . . . . 114 LYS HA . 17034 4 529 . 1 1 134 134 LYS HB2 H 1 2.25 0.02 . 2 . . . . 114 LYS HB2 . 17034 4 530 . 1 1 134 134 LYS HD2 H 1 1.81 0.02 . 2 . . . . 114 LYS HD2 . 17034 4 531 . 1 1 134 134 LYS HG2 H 1 1.6 0.02 . 2 . . . . 114 LYS HG2 . 17034 4 532 . 1 1 134 134 LYS N N 15 119.985 0.20 . 1 . . . . 114 LYS N . 17034 4 533 . 1 1 135 135 ILE H H 1 7.977 0.02 . 1 . . . . 115 ILE HN . 17034 4 534 . 1 1 135 135 ILE N N 15 120.1 0.20 . 1 . . . . 115 ILE N . 17034 4 535 . 1 1 136 136 MET H H 1 8.818 0.02 . 1 . . . . 116 MET HN . 17034 4 536 . 1 1 136 136 MET HA H 1 3.57 0.02 . 1 . . . . 116 MET HA . 17034 4 537 . 1 1 136 136 MET HB2 H 1 2.15 0.02 . 2 . . . . 116 MET HB1 . 17034 4 538 . 1 1 136 136 MET HB3 H 1 1.9 0.02 . 2 . . . . 116 MET HB2 . 17034 4 539 . 1 1 136 136 MET N N 15 119.331 0.20 . 1 . . . . 116 MET N . 17034 4 540 . 1 1 137 137 GLU H H 1 8.522 0.02 . 1 . . . . 117 GLU HN . 17034 4 541 . 1 1 137 137 GLU N N 15 117.494 0.20 . 1 . . . . 117 GLU N . 17034 4 542 . 1 1 138 138 ARG H H 1 7.251 0.02 . 1 . . . . 118 ARG HN . 17034 4 543 . 1 1 138 138 ARG HA H 1 4.15 0.02 . 1 . . . . 118 ARG HA . 17034 4 544 . 1 1 138 138 ARG HB2 H 1 2.09 0.02 . 2 . . . . 118 ARG HB2 . 17034 4 545 . 1 1 138 138 ARG N N 15 117.54 0.20 . 1 . . . . 118 ARG N . 17034 4 546 . 1 1 139 139 VAL H H 1 8.466 0.02 . 1 . . . . 119 VAL HN . 17034 4 547 . 1 1 139 139 VAL N N 15 120.695 0.20 . 1 . . . . 119 VAL N . 17034 4 548 . 1 1 140 140 VAL H H 1 9.098 0.02 . 1 . . . . 120 VAL HN . 17034 4 549 . 1 1 140 140 VAL HA H 1 3.67 0.02 . 1 . . . . 120 VAL HA . 17034 4 550 . 1 1 140 140 VAL HB H 1 2.15 0.02 . 1 . . . . 120 VAL HB . 17034 4 551 . 1 1 140 140 VAL HG21 H 1 1.02 0.02 . 2 . . . . 120 VAL HG21 . 17034 4 552 . 1 1 140 140 VAL HG22 H 1 1.02 0.02 . 2 . . . . 120 VAL HG21 . 17034 4 553 . 1 1 140 140 VAL HG23 H 1 1.02 0.02 . 2 . . . . 120 VAL HG21 . 17034 4 554 . 1 1 140 140 VAL N N 15 119.78 0.20 . 1 . . . . 120 VAL N . 17034 4 555 . 1 1 141 141 GLU H H 1 8.099 0.02 . 1 . . . . 121 GLU HN . 17034 4 556 . 1 1 141 141 GLU HA H 1 3.63 0.02 . 1 . . . . 121 GLU HA . 17034 4 557 . 1 1 141 141 GLU HB2 H 1 2.31 0.02 . 2 . . . . 121 GLU HB1 . 17034 4 558 . 1 1 141 141 GLU HG2 H 1 2.11 0.02 . 2 . . . . 121 GLU HG2 . 17034 4 559 . 1 1 141 141 GLU N N 15 121.682 0.20 . 1 . . . . 121 GLU N . 17034 4 560 . 1 1 142 142 GLN H H 1 7.55 0.02 . 1 . . . . 122 GLN HN . 17034 4 561 . 1 1 142 142 GLN N N 15 120.378 0.20 . 1 . . . . 122 GLN N . 17034 4 562 . 1 1 143 143 MET H H 1 8.38 0.02 . 1 . . . . 123 MET HN . 17034 4 563 . 1 1 143 143 MET N N 15 120.42 0.20 . 1 . . . . 123 MET N . 17034 4 564 . 1 1 144 144 CYS H H 1 9.414 0.02 . 1 . . . . 124 CYS HN . 17034 4 565 . 1 1 144 144 CYS N N 15 118.127 0.20 . 1 . . . . 124 CYS N . 17034 4 566 . 1 1 145 145 THR H H 1 8.184 0.02 . 1 . . . . 125 THR HN . 17034 4 567 . 1 1 145 145 THR HA H 1 3.85 0.02 . 1 . . . . 125 THR HA . 17034 4 568 . 1 1 145 145 THR HB H 1 4.53 0.02 . 1 . . . . 125 THR HB . 17034 4 569 . 1 1 145 145 THR HG21 H 1 1.25 0.02 . 1 . . . . 125 THR HG21 . 17034 4 570 . 1 1 145 145 THR HG22 H 1 1.25 0.02 . 1 . . . . 125 THR HG21 . 17034 4 571 . 1 1 145 145 THR HG23 H 1 1.25 0.02 . 1 . . . . 125 THR HG21 . 17034 4 572 . 1 1 145 145 THR N N 15 119.777 0.20 . 1 . . . . 125 THR N . 17034 4 573 . 1 1 146 146 THR H H 1 8.261 0.02 . 1 . . . . 126 THR HN . 17034 4 574 . 1 1 146 146 THR N N 15 121.244 0.20 . 1 . . . . 126 THR N . 17034 4 575 . 1 1 147 147 GLN H H 1 8.645 0.02 . 1 . . . . 127 GLN HN . 17034 4 576 . 1 1 147 147 GLN HA H 1 3.68 0.02 . 1 . . . . 127 GLN HA . 17034 4 577 . 1 1 147 147 GLN HB2 H 1 2.02 0.02 . 2 . . . . 127 GLN HB1 . 17034 4 578 . 1 1 147 147 GLN HB3 H 1 2.33 0.02 . 2 . . . . 127 GLN HB2 . 17034 4 579 . 1 1 147 147 GLN HG2 H 1 1.8 0.02 . 2 . . . . 127 GLN HG1 . 17034 4 580 . 1 1 147 147 GLN HG3 H 1 1.98 0.02 . 2 . . . . 127 GLN HG2 . 17034 4 581 . 1 1 147 147 GLN N N 15 122.289 0.20 . 1 . . . . 127 GLN N . 17034 4 582 . 1 1 148 148 TYR H H 1 8.393 0.02 . 1 . . . . 128 TYR HN . 17034 4 583 . 1 1 148 148 TYR HA H 1 2.96 0.02 . 1 . . . . 128 TYR HA . 17034 4 584 . 1 1 148 148 TYR HB2 H 1 3.02 0.02 . 2 . . . . 128 TYR HB1 . 17034 4 585 . 1 1 148 148 TYR HB3 H 1 2.85 0.02 . 2 . . . . 128 TYR HB2 . 17034 4 586 . 1 1 148 148 TYR N N 15 119.047 0.20 . 1 . . . . 128 TYR N . 17034 4 587 . 1 1 149 149 GLN H H 1 7.918 0.02 . 1 . . . . 129 GLN HN . 17034 4 588 . 1 1 149 149 GLN N N 15 119.65 0.20 . 1 . . . . 129 GLN N . 17034 4 589 . 1 1 150 150 LYS H H 1 7.973 0.02 . 1 . . . . 130 LYS HN . 17034 4 590 . 1 1 150 150 LYS N N 15 118.626 0.20 . 1 . . . . 130 LYS N . 17034 4 591 . 1 1 151 151 GLU H H 1 8.1 0.02 . 1 . . . . 131 GLU HN . 17034 4 592 . 1 1 151 151 GLU N N 15 116.887 0.20 . 1 . . . . 131 GLU N . 17034 4 593 . 1 1 152 152 SER H H 1 8.203 0.02 . 1 . . . . 132 SER HN . 17034 4 594 . 1 1 152 152 SER N N 15 115.207 0.20 . 1 . . . . 132 SER N . 17034 4 595 . 1 1 153 153 GLN H H 1 7.641 0.02 . 1 . . . . 133 GLN HN . 17034 4 596 . 1 1 153 153 GLN N N 15 120.674 0.20 . 1 . . . . 133 GLN N . 17034 4 597 . 1 1 154 154 ALA H H 1 7.617 0.02 . 1 . . . . 134 ALA HN . 17034 4 598 . 1 1 154 154 ALA N N 15 121.352 0.20 . 1 . . . . 134 ALA N . 17034 4 599 . 1 1 155 155 TYR H H 1 7.872 0.02 . 1 . . . . 135 TYR HN . 17034 4 600 . 1 1 155 155 TYR N N 15 118.514 0.20 . 1 . . . . 135 TYR N . 17034 4 601 . 1 1 156 156 TYR H H 1 8.042 0.02 . 1 . . . . 136 TYR HN . 17034 4 602 . 1 1 156 156 TYR HA H 1 4.32 0.02 . 1 . . . . 136 TYR HA . 17034 4 603 . 1 1 156 156 TYR N N 15 119.492 0.20 . 1 . . . . 136 TYR N . 17034 4 604 . 1 1 157 157 ASP H H 1 8.154 0.02 . 1 . . . . 137 ASP HN . 17034 4 605 . 1 1 157 157 ASP N N 15 120.206 0.20 . 1 . . . . 137 ASP N . 17034 4 606 . 1 1 158 158 GLY H H 1 7.844 0.02 . 1 . . . . 138 GLY HN . 17034 4 607 . 1 1 158 158 GLY N N 15 108.071 0.20 . 1 . . . . 138 GLY N . 17034 4 608 . 1 1 159 159 ARG H H 1 7.862 0.02 . 1 . . . . 139 ARG HN . 17034 4 609 . 1 1 159 159 ARG HA H 1 4.3 0.02 . 1 . . . . 139 ARG HA . 17034 4 610 . 1 1 159 159 ARG N N 15 120.065 0.20 . 1 . . . . 139 ARG N . 17034 4 611 . 1 1 160 160 ARG H H 1 8.38 0.02 . 1 . . . . 140 ARG HN . 17034 4 612 . 1 1 160 160 ARG HA H 1 4.42 0.02 . 1 . . . . 140 ARG HA . 17034 4 613 . 1 1 160 160 ARG HB2 H 1 1.84 0.02 . 2 . . . . 140 ARG HB1 . 17034 4 614 . 1 1 160 160 ARG HB3 H 1 1.94 0.02 . 2 . . . . 140 ARG HB2 . 17034 4 615 . 1 1 160 160 ARG HD2 H 1 2.84 0.02 . 2 . . . . 140 ARG HD2 . 17034 4 616 . 1 1 160 160 ARG HG2 H 1 1.71 0.02 . 2 . . . . 140 ARG HG2 . 17034 4 617 . 1 1 160 160 ARG N N 15 122.82 0.20 . 1 . . . . 140 ARG N . 17034 4 618 . 1 1 161 161 SER H H 1 7.951 0.02 . 1 . . . . 141 SER HN . 17034 4 619 . 1 1 161 161 SER N N 15 122.225 0.20 . 1 . . . . 141 SER N . 17034 4 stop_ save_