data_5324 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5324 _Entry.Title ; Letters to the Editor: 1H, 15N and 13C assignments of the regulatory domains of a calcium-dependent protein kinase (CDPK) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2002-03-17 _Entry.Accession_date 2002-03-18 _Entry.Last_release_date 2002-08-23 _Entry.Original_release_date 2002-08-23 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 John Christodoulou . . . 5324 2 Haitao Hu . . . 5324 3 John Chung . . . 5324 4 Mark Rance . . . 5324 5 Jeffrey Harper . F . 5324 6 Walter Chazin . J . 5324 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 5324 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 452 5324 '15N chemical shifts' 160 5324 '1H chemical shifts' 999 5324 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2002-08-23 2002-03-17 original author . 5324 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5324 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Letters to the Editor: 1H, 15N and 13C assignments of the regulatory domains of a calcium-dependent protein kinase (CDPK) ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 23 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 249 _Citation.Page_last 250 _Citation.Year 2002 _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 John Christodoulou . . . 5324 1 2 Haitao Hu . . . 5324 1 3 John Chung . . . 5324 1 4 Mark Rance . . . 5324 1 5 Jeffrey Harper . F . 5324 1 6 Walter Chazin . J . 5324 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'calcium-binding proteins' 5324 1 'calcium-dependent protein kinase' 5324 1 'NMR assignments' 5324 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_CDPK _Assembly.Sf_category assembly _Assembly.Sf_framecode system_CDPK _Assembly.Entry_ID 5324 _Assembly.ID 1 _Assembly.Name 'Calcium-Dependent Protein Kinase regulatory domains' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 5324 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 CDPK(428-594) 1 $J-CaM-LD . . . native . . . . . 5324 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'Calcium-Dependent Protein Kinase regulatory domains' system 5324 1 CDPK abbreviation 5324 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_J-CaM-LD _Entity.Sf_category entity _Entity.Sf_framecode J-CaM-LD _Entity.Entry_ID 5324 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CDPK(428-594) _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 ; GSHMKQFSAMNKFKKMALRV IAESLSEEEIAGLKEMFNMI DADKSGQITFEELKAGLKRV GANLKESEILDLMQAADVDN SGTIDYKEFIAATLHLNKIE REDHLFAAFTYFDKDGSGYI TPDELQQACEEFGVEDVRIE ELMRDVDQDNDGRIDYNEFV AMMQKGSITG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 170 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no DBJ BAB08991 . "calcium-dependent protein kinase [Arabidopsis thaliana]" . . . . . 99.41 610 99.41 99.41 1.54e-112 . . . . 5324 1 2 no DBJ BAC43300 . "putative calcium-dependent protein kinase [Arabidopsis thaliana]" . . . . . 99.41 610 99.41 99.41 1.54e-112 . . . . 5324 1 3 no EMBL CDX70192 . "BnaA10g25410D [Brassica napus]" . . . . . 99.41 572 98.22 99.41 8.21e-112 . . . . 5324 1 4 no EMBL CDX80925 . "BnaC03g01790D [Brassica napus]" . . . . . 99.41 573 97.63 98.22 3.34e-110 . . . . 5324 1 5 no EMBL CDX98791 . "BnaC09g50440D [Brassica napus]" . . . . . 99.41 573 97.63 98.82 5.00e-111 . . . . 5324 1 6 no EMBL CDY11313 . "BnaA03g01490D [Brassica napus]" . . . . . 99.41 588 98.22 99.41 2.25e-111 . . . . 5324 1 7 no GB AAA32761 . "calcium-dependent protein kinase [Arabidopsis thaliana]" . . . . . 99.41 610 99.41 99.41 1.54e-112 . . . . 5324 1 8 no GB AAO64867 . "At5g04870 [Arabidopsis thaliana]" . . . . . 99.41 610 99.41 99.41 1.54e-112 . . . . 5324 1 9 no GB ABE73345 . "putative calcium-dependent protein kinase 2 [Isatis tinctoria]" . . . . . 99.41 625 98.82 99.41 1.70e-112 . . . . 5324 1 10 no GB ABE73346 . "putative calcium-dependent protein kinase 2 [Isatis tinctoria]" . . . . . 99.41 625 98.82 99.41 1.70e-112 . . . . 5324 1 11 no GB AED90798 . "calcium dependent protein kinase 1 [Arabidopsis thaliana]" . . . . . 99.41 610 99.41 99.41 1.54e-112 . . . . 5324 1 12 no REF NP_196107 . "calcium dependent protein kinase 1 [Arabidopsis thaliana]" . . . . . 99.41 610 99.41 99.41 1.54e-112 . . . . 5324 1 13 no REF XP_002873173 . "calcium-dependent protein kinase isoform ak1 [Arabidopsis lyrata subsp. lyrata]" . . . . . 99.41 610 99.41 99.41 1.27e-112 . . . . 5324 1 14 no REF XP_006287286 . "hypothetical protein CARUB_v10000481mg [Capsella rubella]" . . . . . 99.41 618 99.41 99.41 1.40e-112 . . . . 5324 1 15 no REF XP_006398940 . "hypothetical protein EUTSA_v10012990mg [Eutrema salsugineum]" . . . . . 99.41 613 97.63 98.82 8.31e-111 . . . . 5324 1 16 no REF XP_009122558 . "PREDICTED: calcium-dependent protein kinase 1 [Brassica rapa]" . . . . . 99.41 591 98.22 99.41 7.31e-112 . . . . 5324 1 17 no SP Q06850 . "RecName: Full=Calcium-dependent protein kinase 1; Short=AtCDPK 1; Short=CDPK 1; AltName: Full=Calcium-dependent protein kinase " . . . . . 99.41 610 99.41 99.41 1.54e-112 . . . . 5324 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID CDPK(428-594) common 5324 1 J-CaM-LD abbreviation 5324 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 5324 1 2 . SER . 5324 1 3 . HIS . 5324 1 4 . MET . 5324 1 5 . LYS . 5324 1 6 . GLN . 5324 1 7 . PHE . 5324 1 8 . SER . 5324 1 9 . ALA . 5324 1 10 . MET . 5324 1 11 . ASN . 5324 1 12 . LYS . 5324 1 13 . PHE . 5324 1 14 . LYS . 5324 1 15 . LYS . 5324 1 16 . MET . 5324 1 17 . ALA . 5324 1 18 . LEU . 5324 1 19 . ARG . 5324 1 20 . VAL . 5324 1 21 . ILE . 5324 1 22 . ALA . 5324 1 23 . GLU . 5324 1 24 . SER . 5324 1 25 . LEU . 5324 1 26 . SER . 5324 1 27 . GLU . 5324 1 28 . GLU . 5324 1 29 . GLU . 5324 1 30 . ILE . 5324 1 31 . ALA . 5324 1 32 . GLY . 5324 1 33 . LEU . 5324 1 34 . LYS . 5324 1 35 . GLU . 5324 1 36 . MET . 5324 1 37 . PHE . 5324 1 38 . ASN . 5324 1 39 . MET . 5324 1 40 . ILE . 5324 1 41 . ASP . 5324 1 42 . ALA . 5324 1 43 . ASP . 5324 1 44 . LYS . 5324 1 45 . SER . 5324 1 46 . GLY . 5324 1 47 . GLN . 5324 1 48 . ILE . 5324 1 49 . THR . 5324 1 50 . PHE . 5324 1 51 . GLU . 5324 1 52 . GLU . 5324 1 53 . LEU . 5324 1 54 . LYS . 5324 1 55 . ALA . 5324 1 56 . GLY . 5324 1 57 . LEU . 5324 1 58 . LYS . 5324 1 59 . ARG . 5324 1 60 . VAL . 5324 1 61 . GLY . 5324 1 62 . ALA . 5324 1 63 . ASN . 5324 1 64 . LEU . 5324 1 65 . LYS . 5324 1 66 . GLU . 5324 1 67 . SER . 5324 1 68 . GLU . 5324 1 69 . ILE . 5324 1 70 . LEU . 5324 1 71 . ASP . 5324 1 72 . LEU . 5324 1 73 . MET . 5324 1 74 . GLN . 5324 1 75 . ALA . 5324 1 76 . ALA . 5324 1 77 . ASP . 5324 1 78 . VAL . 5324 1 79 . ASP . 5324 1 80 . ASN . 5324 1 81 . SER . 5324 1 82 . GLY . 5324 1 83 . THR . 5324 1 84 . ILE . 5324 1 85 . ASP . 5324 1 86 . TYR . 5324 1 87 . LYS . 5324 1 88 . GLU . 5324 1 89 . PHE . 5324 1 90 . ILE . 5324 1 91 . ALA . 5324 1 92 . ALA . 5324 1 93 . THR . 5324 1 94 . LEU . 5324 1 95 . HIS . 5324 1 96 . LEU . 5324 1 97 . ASN . 5324 1 98 . LYS . 5324 1 99 . ILE . 5324 1 100 . GLU . 5324 1 101 . ARG . 5324 1 102 . GLU . 5324 1 103 . ASP . 5324 1 104 . HIS . 5324 1 105 . LEU . 5324 1 106 . PHE . 5324 1 107 . ALA . 5324 1 108 . ALA . 5324 1 109 . PHE . 5324 1 110 . THR . 5324 1 111 . TYR . 5324 1 112 . PHE . 5324 1 113 . ASP . 5324 1 114 . LYS . 5324 1 115 . ASP . 5324 1 116 . GLY . 5324 1 117 . SER . 5324 1 118 . GLY . 5324 1 119 . TYR . 5324 1 120 . ILE . 5324 1 121 . THR . 5324 1 122 . PRO . 5324 1 123 . ASP . 5324 1 124 . GLU . 5324 1 125 . LEU . 5324 1 126 . GLN . 5324 1 127 . GLN . 5324 1 128 . ALA . 5324 1 129 . CYS . 5324 1 130 . GLU . 5324 1 131 . GLU . 5324 1 132 . PHE . 5324 1 133 . GLY . 5324 1 134 . VAL . 5324 1 135 . GLU . 5324 1 136 . ASP . 5324 1 137 . VAL . 5324 1 138 . ARG . 5324 1 139 . ILE . 5324 1 140 . GLU . 5324 1 141 . GLU . 5324 1 142 . LEU . 5324 1 143 . MET . 5324 1 144 . ARG . 5324 1 145 . ASP . 5324 1 146 . VAL . 5324 1 147 . ASP . 5324 1 148 . GLN . 5324 1 149 . ASP . 5324 1 150 . ASN . 5324 1 151 . ASP . 5324 1 152 . GLY . 5324 1 153 . ARG . 5324 1 154 . ILE . 5324 1 155 . ASP . 5324 1 156 . TYR . 5324 1 157 . ASN . 5324 1 158 . GLU . 5324 1 159 . PHE . 5324 1 160 . VAL . 5324 1 161 . ALA . 5324 1 162 . MET . 5324 1 163 . MET . 5324 1 164 . GLN . 5324 1 165 . LYS . 5324 1 166 . GLY . 5324 1 167 . SER . 5324 1 168 . ILE . 5324 1 169 . THR . 5324 1 170 . GLY . 5324 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 5324 1 . SER 2 2 5324 1 . HIS 3 3 5324 1 . MET 4 4 5324 1 . LYS 5 5 5324 1 . GLN 6 6 5324 1 . PHE 7 7 5324 1 . SER 8 8 5324 1 . ALA 9 9 5324 1 . MET 10 10 5324 1 . ASN 11 11 5324 1 . LYS 12 12 5324 1 . PHE 13 13 5324 1 . LYS 14 14 5324 1 . LYS 15 15 5324 1 . MET 16 16 5324 1 . ALA 17 17 5324 1 . LEU 18 18 5324 1 . ARG 19 19 5324 1 . VAL 20 20 5324 1 . ILE 21 21 5324 1 . ALA 22 22 5324 1 . GLU 23 23 5324 1 . SER 24 24 5324 1 . LEU 25 25 5324 1 . SER 26 26 5324 1 . GLU 27 27 5324 1 . GLU 28 28 5324 1 . GLU 29 29 5324 1 . ILE 30 30 5324 1 . ALA 31 31 5324 1 . GLY 32 32 5324 1 . LEU 33 33 5324 1 . LYS 34 34 5324 1 . GLU 35 35 5324 1 . MET 36 36 5324 1 . PHE 37 37 5324 1 . ASN 38 38 5324 1 . MET 39 39 5324 1 . ILE 40 40 5324 1 . ASP 41 41 5324 1 . ALA 42 42 5324 1 . ASP 43 43 5324 1 . LYS 44 44 5324 1 . SER 45 45 5324 1 . GLY 46 46 5324 1 . GLN 47 47 5324 1 . ILE 48 48 5324 1 . THR 49 49 5324 1 . PHE 50 50 5324 1 . GLU 51 51 5324 1 . GLU 52 52 5324 1 . LEU 53 53 5324 1 . LYS 54 54 5324 1 . ALA 55 55 5324 1 . GLY 56 56 5324 1 . LEU 57 57 5324 1 . LYS 58 58 5324 1 . ARG 59 59 5324 1 . VAL 60 60 5324 1 . GLY 61 61 5324 1 . ALA 62 62 5324 1 . ASN 63 63 5324 1 . LEU 64 64 5324 1 . LYS 65 65 5324 1 . GLU 66 66 5324 1 . SER 67 67 5324 1 . GLU 68 68 5324 1 . ILE 69 69 5324 1 . LEU 70 70 5324 1 . ASP 71 71 5324 1 . LEU 72 72 5324 1 . MET 73 73 5324 1 . GLN 74 74 5324 1 . ALA 75 75 5324 1 . ALA 76 76 5324 1 . ASP 77 77 5324 1 . VAL 78 78 5324 1 . ASP 79 79 5324 1 . ASN 80 80 5324 1 . SER 81 81 5324 1 . GLY 82 82 5324 1 . THR 83 83 5324 1 . ILE 84 84 5324 1 . ASP 85 85 5324 1 . TYR 86 86 5324 1 . LYS 87 87 5324 1 . GLU 88 88 5324 1 . PHE 89 89 5324 1 . ILE 90 90 5324 1 . ALA 91 91 5324 1 . ALA 92 92 5324 1 . THR 93 93 5324 1 . LEU 94 94 5324 1 . HIS 95 95 5324 1 . LEU 96 96 5324 1 . ASN 97 97 5324 1 . LYS 98 98 5324 1 . ILE 99 99 5324 1 . GLU 100 100 5324 1 . ARG 101 101 5324 1 . GLU 102 102 5324 1 . ASP 103 103 5324 1 . HIS 104 104 5324 1 . LEU 105 105 5324 1 . PHE 106 106 5324 1 . ALA 107 107 5324 1 . ALA 108 108 5324 1 . PHE 109 109 5324 1 . THR 110 110 5324 1 . TYR 111 111 5324 1 . PHE 112 112 5324 1 . ASP 113 113 5324 1 . LYS 114 114 5324 1 . ASP 115 115 5324 1 . GLY 116 116 5324 1 . SER 117 117 5324 1 . GLY 118 118 5324 1 . TYR 119 119 5324 1 . ILE 120 120 5324 1 . THR 121 121 5324 1 . PRO 122 122 5324 1 . ASP 123 123 5324 1 . GLU 124 124 5324 1 . LEU 125 125 5324 1 . GLN 126 126 5324 1 . GLN 127 127 5324 1 . ALA 128 128 5324 1 . CYS 129 129 5324 1 . GLU 130 130 5324 1 . GLU 131 131 5324 1 . PHE 132 132 5324 1 . GLY 133 133 5324 1 . VAL 134 134 5324 1 . GLU 135 135 5324 1 . ASP 136 136 5324 1 . VAL 137 137 5324 1 . ARG 138 138 5324 1 . ILE 139 139 5324 1 . GLU 140 140 5324 1 . GLU 141 141 5324 1 . LEU 142 142 5324 1 . MET 143 143 5324 1 . ARG 144 144 5324 1 . ASP 145 145 5324 1 . VAL 146 146 5324 1 . ASP 147 147 5324 1 . GLN 148 148 5324 1 . ASP 149 149 5324 1 . ASN 150 150 5324 1 . ASP 151 151 5324 1 . GLY 152 152 5324 1 . ARG 153 153 5324 1 . ILE 154 154 5324 1 . ASP 155 155 5324 1 . TYR 156 156 5324 1 . ASN 157 157 5324 1 . GLU 158 158 5324 1 . PHE 159 159 5324 1 . VAL 160 160 5324 1 . ALA 161 161 5324 1 . MET 162 162 5324 1 . MET 163 163 5324 1 . GLN 164 164 5324 1 . LYS 165 165 5324 1 . GLY 166 166 5324 1 . SER 167 167 5324 1 . ILE 168 168 5324 1 . THR 169 169 5324 1 . GLY 170 170 5324 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 5324 _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 $J-CaM-LD . 3702 . . 'Arabidopsis thaliana' 'Thale cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . . . . . . . . . . . . . 5324 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 5324 _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 $J-CaM-LD . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5324 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 5324 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CDPK(428-594) . . . 1 $J-CaM-LD . . . 0.5 1.0 mM . . . . 5324 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 5324 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CDPK(428-594) [U-15N] . . 1 $J-CaM-LD . . . 0.5 1.0 mM . . . . 5324 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 5324 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CDPK(428-594) '[U-13C; U-15N]' . . 1 $J-CaM-LD . . . 0.5 1.0 mM . . . . 5324 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 5324 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CDPK(428-594) '[U-13C; U-15N; U-2H]' . . 1 $J-CaM-LD . . . 0.5 1.0 mM . . . . 5324 4 stop_ save_ save_sample_5 _Sample.Sf_category sample _Sample.Sf_framecode sample_5 _Sample.Entry_ID 5324 _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CDPK(428-594) [U-15N]-Lys . . 1 $J-CaM-LD . . . 0.5 1.0 mM . . . . 5324 5 stop_ save_ save_sample_6 _Sample.Sf_category sample _Sample.Sf_framecode sample_6 _Sample.Entry_ID 5324 _Sample.ID 6 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CDPK(428-594) '[U-13C]; [U-15N]-Lys' . . 1 $J-CaM-LD . . . 0.5 1.0 mM . . . . 5324 6 stop_ save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond_1 _Sample_condition_list.Entry_ID 5324 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 0.1 n/a 5324 1 temperature 310 1 K 5324 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 5324 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 5324 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 5324 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_4 _NMR_spectrometer.Entry_ID 5324 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5324 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker DRX . 600 . . . 5324 1 2 NMR_spectrometer_2 Bruker AVANCE . 800 . . . 5324 1 3 NMR_spectrometer_3 Varian Inova . 600 . . . 5324 1 4 NMR_spectrometer_4 Varian Inova . 800 . . . 5324 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 5324 _Experiment_list.ID 1 _Experiment_list.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 5324 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 5324 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 5324 1 H 2 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.153506088 . . . . . . . . . 5324 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 5324 1 P 31 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.404808636 . . . . . . . . . 5324 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_CDPK_C _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode CDPK_C _Assigned_chem_shift_list.Entry_ID 5324 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 5324 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 3 3 HIS CB C 13 27.204 0.05 . 1 . . . . . . . . 5324 1 2 . 1 1 3 3 HIS HA H 1 4.251 0.02 . 1 . . . . . . . . 5324 1 3 . 1 1 3 3 HIS HB2 H 1 3.070 0.02 . 2 . . . . . . . . 5324 1 4 . 1 1 3 3 HIS HB3 H 1 3.109 0.02 . 2 . . . . . . . . 5324 1 5 . 1 1 3 3 HIS HD2 H 1 7.060 0.02 . 1 . . . . . . . . 5324 1 6 . 1 1 4 4 MET CA C 13 49.812 0.05 . 1 . . . . . . . . 5324 1 7 . 1 1 4 4 MET CB C 13 36.056 0.05 . 1 . . . . . . . . 5324 1 8 . 1 1 4 4 MET HA H 1 4.716 0.02 . 1 . . . . . . . . 5324 1 9 . 1 1 4 4 MET HB2 H 1 2.970 0.02 . 2 . . . . . . . . 5324 1 10 . 1 1 4 4 MET HB3 H 1 2.672 0.02 . 2 . . . . . . . . 5324 1 11 . 1 1 5 5 LYS CA C 13 51.654 0.05 . 1 . . . . . . . . 5324 1 12 . 1 1 5 5 LYS CB C 13 29.186 0.05 . 1 . . . . . . . . 5324 1 13 . 1 1 5 5 LYS H H 1 8.114 0.02 . 1 . . . . . . . . 5324 1 14 . 1 1 5 5 LYS HA H 1 4.157 0.02 . 1 . . . . . . . . 5324 1 15 . 1 1 5 5 LYS HB2 H 1 1.753 0.02 . 1 . . . . . . . . 5324 1 16 . 1 1 5 5 LYS HB3 H 1 1.753 0.02 . 1 . . . . . . . . 5324 1 17 . 1 1 5 5 LYS HG2 H 1 1.337 0.02 . 1 . . . . . . . . 5324 1 18 . 1 1 5 5 LYS HG3 H 1 1.337 0.02 . 1 . . . . . . . . 5324 1 19 . 1 1 5 5 LYS HE2 H 1 2.913 0.02 . 2 . . . . . . . . 5324 1 20 . 1 1 5 5 LYS N N 15 119.395 0.05 . 1 . . . . . . . . 5324 1 21 . 1 1 6 6 GLN HE21 H 1 7.314 0.02 . 1 . . . . . . . . 5324 1 22 . 1 1 6 6 GLN HE22 H 1 6.801 0.02 . 1 . . . . . . . . 5324 1 23 . 1 1 6 6 GLN NE2 N 15 110.448 0.05 . 1 . . . . . . . . 5324 1 24 . 1 1 11 11 ASN CA C 13 52.462 0.05 . 1 . . . . . . . . 5324 1 25 . 1 1 11 11 ASN CB C 13 35.090 0.05 . 1 . . . . . . . . 5324 1 26 . 1 1 11 11 ASN HA H 1 4.497 0.02 . 1 . . . . . . . . 5324 1 27 . 1 1 11 11 ASN HB2 H 1 2.816 0.02 . 2 . . . . . . . . 5324 1 28 . 1 1 11 11 ASN HB3 H 1 2.909 0.02 . 2 . . . . . . . . 5324 1 29 . 1 1 12 12 LYS CA C 13 54.934 0.05 . 1 . . . . . . . . 5324 1 30 . 1 1 12 12 LYS CB C 13 34.862 0.05 . 1 . . . . . . . . 5324 1 31 . 1 1 12 12 LYS H H 1 8.246 0.02 . 1 . . . . . . . . 5324 1 32 . 1 1 12 12 LYS HA H 1 4.412 0.02 . 1 . . . . . . . . 5324 1 33 . 1 1 12 12 LYS HB2 H 1 2.433 0.02 . 2 . . . . . . . . 5324 1 34 . 1 1 12 12 LYS HB3 H 1 1.380 0.02 . 2 . . . . . . . . 5324 1 35 . 1 1 12 12 LYS N N 15 120.617 0.05 . 1 . . . . . . . . 5324 1 36 . 1 1 13 13 PHE CA C 13 54.886 0.05 . 1 . . . . . . . . 5324 1 37 . 1 1 13 13 PHE CB C 13 35.455 0.05 . 1 . . . . . . . . 5324 1 38 . 1 1 13 13 PHE CD1 C 13 128.954 0.05 . 1 . . . . . . . . 5324 1 39 . 1 1 13 13 PHE CE1 C 13 127.881 0.05 . 1 . . . . . . . . 5324 1 40 . 1 1 13 13 PHE CZ C 13 131.853 0.05 . 1 . . . . . . . . 5324 1 41 . 1 1 13 13 PHE CE2 C 13 127.881 0.05 . 1 . . . . . . . . 5324 1 42 . 1 1 13 13 PHE CD2 C 13 128.954 0.05 . 1 . . . . . . . . 5324 1 43 . 1 1 13 13 PHE HA H 1 4.710 0.02 . 1 . . . . . . . . 5324 1 44 . 1 1 13 13 PHE HB2 H 1 3.348 0.02 . 2 . . . . . . . . 5324 1 45 . 1 1 13 13 PHE HB3 H 1 3.029 0.02 . 2 . . . . . . . . 5324 1 46 . 1 1 13 13 PHE HD1 H 1 7.192 0.02 . 1 . . . . . . . . 5324 1 47 . 1 1 13 13 PHE HE1 H 1 6.441 0.02 . 1 . . . . . . . . 5324 1 48 . 1 1 13 13 PHE HZ H 1 6.910 0.02 . 1 . . . . . . . . 5324 1 49 . 1 1 13 13 PHE HE2 H 1 6.441 0.02 . 1 . . . . . . . . 5324 1 50 . 1 1 13 13 PHE HD2 H 1 7.192 0.02 . 1 . . . . . . . . 5324 1 51 . 1 1 14 14 LYS CA C 13 57.161 0.05 . 1 . . . . . . . . 5324 1 52 . 1 1 14 14 LYS CB C 13 28.990 0.05 . 1 . . . . . . . . 5324 1 53 . 1 1 14 14 LYS H H 1 8.438 0.02 . 1 . . . . . . . . 5324 1 54 . 1 1 14 14 LYS HA H 1 3.570 0.02 . 1 . . . . . . . . 5324 1 55 . 1 1 14 14 LYS HB2 H 1 1.863 0.02 . 2 . . . . . . . . 5324 1 56 . 1 1 14 14 LYS HB3 H 1 1.739 0.02 . 2 . . . . . . . . 5324 1 57 . 1 1 14 14 LYS HG2 H 1 1.476 0.02 . 2 . . . . . . . . 5324 1 58 . 1 1 14 14 LYS HG3 H 1 1.205 0.02 . 2 . . . . . . . . 5324 1 59 . 1 1 14 14 LYS HD2 H 1 1.038 0.02 . 1 . . . . . . . . 5324 1 60 . 1 1 14 14 LYS HD3 H 1 1.038 0.02 . 1 . . . . . . . . 5324 1 61 . 1 1 14 14 LYS N N 15 120.216 0.05 . 1 . . . . . . . . 5324 1 62 . 1 1 15 15 LYS CA C 13 57.015 0.05 . 1 . . . . . . . . 5324 1 63 . 1 1 15 15 LYS CB C 13 28.806 0.05 . 1 . . . . . . . . 5324 1 64 . 1 1 15 15 LYS CD C 13 25.734 0.05 . 1 . . . . . . . . 5324 1 65 . 1 1 15 15 LYS H H 1 7.847 0.02 . 1 . . . . . . . . 5324 1 66 . 1 1 15 15 LYS HA H 1 3.832 0.02 . 1 . . . . . . . . 5324 1 67 . 1 1 15 15 LYS HB2 H 1 1.940 0.02 . 2 . . . . . . . . 5324 1 68 . 1 1 15 15 LYS HB3 H 1 1.615 0.02 . 2 . . . . . . . . 5324 1 69 . 1 1 15 15 LYS HG2 H 1 1.420 0.02 . 1 . . . . . . . . 5324 1 70 . 1 1 15 15 LYS HG3 H 1 1.420 0.02 . 1 . . . . . . . . 5324 1 71 . 1 1 15 15 LYS HD2 H 1 1.930 0.02 . 1 . . . . . . . . 5324 1 72 . 1 1 15 15 LYS HD3 H 1 1.930 0.02 . 1 . . . . . . . . 5324 1 73 . 1 1 15 15 LYS N N 15 116.495 0.05 . 1 . . . . . . . . 5324 1 74 . 1 1 16 16 MET CA C 13 56.337 0.05 . 1 . . . . . . . . 5324 1 75 . 1 1 16 16 MET H H 1 7.598 0.02 . 1 . . . . . . . . 5324 1 76 . 1 1 16 16 MET HA H 1 3.767 0.02 . 1 . . . . . . . . 5324 1 77 . 1 1 16 16 MET N N 15 118.980 0.05 . 1 . . . . . . . . 5324 1 78 . 1 1 17 17 ALA CA C 13 52.262 0.05 . 1 . . . . . . . . 5324 1 79 . 1 1 17 17 ALA CB C 13 15.278 0.05 . 1 . . . . . . . . 5324 1 80 . 1 1 17 17 ALA H H 1 8.246 0.02 . 1 . . . . . . . . 5324 1 81 . 1 1 17 17 ALA HA H 1 4.128 0.02 . 1 . . . . . . . . 5324 1 82 . 1 1 17 17 ALA HB1 H 1 1.429 0.02 . 1 . . . . . . . . 5324 1 83 . 1 1 17 17 ALA HB2 H 1 1.429 0.02 . 1 . . . . . . . . 5324 1 84 . 1 1 17 17 ALA HB3 H 1 1.429 0.02 . 1 . . . . . . . . 5324 1 85 . 1 1 17 17 ALA N N 15 120.565 0.05 . 1 . . . . . . . . 5324 1 86 . 1 1 18 18 LEU CA C 13 54.521 0.05 . 1 . . . . . . . . 5324 1 87 . 1 1 18 18 LEU CB C 13 37.165 0.05 . 1 . . . . . . . . 5324 1 88 . 1 1 18 18 LEU CD1 C 13 21.750 0.05 . 1 . . . . . . . . 5324 1 89 . 1 1 18 18 LEU CD2 C 13 19.571 0.05 . 1 . . . . . . . . 5324 1 90 . 1 1 18 18 LEU H H 1 8.404 0.02 . 1 . . . . . . . . 5324 1 91 . 1 1 18 18 LEU HA H 1 3.889 0.02 . 1 . . . . . . . . 5324 1 92 . 1 1 18 18 LEU HB2 H 1 1.853 0.02 . 2 . . . . . . . . 5324 1 93 . 1 1 18 18 LEU HB3 H 1 1.334 0.02 . 2 . . . . . . . . 5324 1 94 . 1 1 18 18 LEU HD11 H 1 0.660 0.02 . 2 . . . . . . . . 5324 1 95 . 1 1 18 18 LEU HD12 H 1 0.660 0.02 . 2 . . . . . . . . 5324 1 96 . 1 1 18 18 LEU HD13 H 1 0.660 0.02 . 2 . . . . . . . . 5324 1 97 . 1 1 18 18 LEU HD21 H 1 0.587 0.02 . 2 . . . . . . . . 5324 1 98 . 1 1 18 18 LEU HD22 H 1 0.587 0.02 . 2 . . . . . . . . 5324 1 99 . 1 1 18 18 LEU HD23 H 1 0.587 0.02 . 2 . . . . . . . . 5324 1 100 . 1 1 18 18 LEU N N 15 116.244 0.05 . 1 . . . . . . . . 5324 1 101 . 1 1 19 19 ARG CA C 13 55.986 0.05 . 1 . . . . . . . . 5324 1 102 . 1 1 19 19 ARG CB C 13 25.380 0.05 . 1 . . . . . . . . 5324 1 103 . 1 1 19 19 ARG CG C 13 23.578 0.05 . 1 . . . . . . . . 5324 1 104 . 1 1 19 19 ARG CD C 13 40.096 0.05 . 1 . . . . . . . . 5324 1 105 . 1 1 19 19 ARG H H 1 7.481 0.02 . 1 . . . . . . . . 5324 1 106 . 1 1 19 19 ARG HA H 1 3.938 0.02 . 1 . . . . . . . . 5324 1 107 . 1 1 19 19 ARG HB2 H 1 2.056 0.02 . 2 . . . . . . . . 5324 1 108 . 1 1 19 19 ARG HB3 H 1 1.910 0.02 . 2 . . . . . . . . 5324 1 109 . 1 1 19 19 ARG HG2 H 1 1.506 0.02 . 2 . . . . . . . . 5324 1 110 . 1 1 19 19 ARG HG3 H 1 1.741 0.02 . 2 . . . . . . . . 5324 1 111 . 1 1 19 19 ARG HD2 H 1 2.850 0.02 . 2 . . . . . . . . 5324 1 112 . 1 1 19 19 ARG HD3 H 1 3.138 0.02 . 2 . . . . . . . . 5324 1 113 . 1 1 19 19 ARG N N 15 120.124 0.05 . 1 . . . . . . . . 5324 1 114 . 1 1 20 20 VAL CA C 13 62.625 0.05 . 1 . . . . . . . . 5324 1 115 . 1 1 20 20 VAL CB C 13 27.832 0.05 . 1 . . . . . . . . 5324 1 116 . 1 1 20 20 VAL H H 1 7.465 0.02 . 1 . . . . . . . . 5324 1 117 . 1 1 20 20 VAL HA H 1 3.390 0.02 . 1 . . . . . . . . 5324 1 118 . 1 1 20 20 VAL HB H 1 2.089 0.02 . 1 . . . . . . . . 5324 1 119 . 1 1 20 20 VAL HG11 H 1 0.509 0.02 . 2 . . . . . . . . 5324 1 120 . 1 1 20 20 VAL HG12 H 1 0.509 0.02 . 2 . . . . . . . . 5324 1 121 . 1 1 20 20 VAL HG13 H 1 0.509 0.02 . 2 . . . . . . . . 5324 1 122 . 1 1 20 20 VAL HG21 H 1 0.513 0.02 . 2 . . . . . . . . 5324 1 123 . 1 1 20 20 VAL HG22 H 1 0.513 0.02 . 2 . . . . . . . . 5324 1 124 . 1 1 20 20 VAL HG23 H 1 0.513 0.02 . 2 . . . . . . . . 5324 1 125 . 1 1 20 20 VAL N N 15 118.961 0.05 . 1 . . . . . . . . 5324 1 126 . 1 1 21 21 ILE CA C 13 62.197 0.05 . 1 . . . . . . . . 5324 1 127 . 1 1 21 21 ILE CB C 13 33.946 0.05 . 1 . . . . . . . . 5324 1 128 . 1 1 21 21 ILE CG1 C 13 26.393 0.05 . 1 . . . . . . . . 5324 1 129 . 1 1 21 21 ILE CG2 C 13 13.886 0.05 . 1 . . . . . . . . 5324 1 130 . 1 1 21 21 ILE CD1 C 13 10.592 0.05 . 1 . . . . . . . . 5324 1 131 . 1 1 21 21 ILE H H 1 8.059 0.02 . 1 . . . . . . . . 5324 1 132 . 1 1 21 21 ILE HA H 1 3.467 0.02 . 1 . . . . . . . . 5324 1 133 . 1 1 21 21 ILE HB H 1 1.953 0.02 . 1 . . . . . . . . 5324 1 134 . 1 1 21 21 ILE HG12 H 1 1.743 0.02 . 1 . . . . . . . . 5324 1 135 . 1 1 21 21 ILE HG13 H 1 1.743 0.02 . 1 . . . . . . . . 5324 1 136 . 1 1 21 21 ILE HG21 H 1 0.753 0.02 . 1 . . . . . . . . 5324 1 137 . 1 1 21 21 ILE HG22 H 1 0.753 0.02 . 1 . . . . . . . . 5324 1 138 . 1 1 21 21 ILE HG23 H 1 0.753 0.02 . 1 . . . . . . . . 5324 1 139 . 1 1 21 21 ILE HD11 H 1 0.542 0.02 . 1 . . . . . . . . 5324 1 140 . 1 1 21 21 ILE HD12 H 1 0.542 0.02 . 1 . . . . . . . . 5324 1 141 . 1 1 21 21 ILE HD13 H 1 0.542 0.02 . 1 . . . . . . . . 5324 1 142 . 1 1 21 21 ILE N N 15 120.413 0.05 . 1 . . . . . . . . 5324 1 143 . 1 1 22 22 ALA CA C 13 51.929 0.05 . 1 . . . . . . . . 5324 1 144 . 1 1 22 22 ALA CB C 13 14.416 0.05 . 1 . . . . . . . . 5324 1 145 . 1 1 22 22 ALA H H 1 8.215 0.02 . 1 . . . . . . . . 5324 1 146 . 1 1 22 22 ALA HA H 1 3.716 0.02 . 1 . . . . . . . . 5324 1 147 . 1 1 22 22 ALA HB1 H 1 1.398 0.02 . 1 . . . . . . . . 5324 1 148 . 1 1 22 22 ALA HB2 H 1 1.398 0.02 . 1 . . . . . . . . 5324 1 149 . 1 1 22 22 ALA HB3 H 1 1.398 0.02 . 1 . . . . . . . . 5324 1 150 . 1 1 22 22 ALA N N 15 121.098 0.05 . 1 . . . . . . . . 5324 1 151 . 1 1 23 23 GLU CA C 13 54.236 0.05 . 1 . . . . . . . . 5324 1 152 . 1 1 23 23 GLU CB C 13 25.653 0.05 . 1 . . . . . . . . 5324 1 153 . 1 1 23 23 GLU CG C 13 33.188 0.05 . 1 . . . . . . . . 5324 1 154 . 1 1 23 23 GLU H H 1 7.573 0.02 . 1 . . . . . . . . 5324 1 155 . 1 1 23 23 GLU HA H 1 4.140 0.02 . 1 . . . . . . . . 5324 1 156 . 1 1 23 23 GLU HB2 H 1 2.176 0.02 . 2 . . . . . . . . 5324 1 157 . 1 1 23 23 GLU HB3 H 1 1.947 0.02 . 2 . . . . . . . . 5324 1 158 . 1 1 23 23 GLU HG2 H 1 2.462 0.02 . 2 . . . . . . . . 5324 1 159 . 1 1 23 23 GLU HG3 H 1 2.298 0.02 . 2 . . . . . . . . 5324 1 160 . 1 1 23 23 GLU N N 15 113.900 0.05 . 1 . . . . . . . . 5324 1 161 . 1 1 24 24 SER CA C 13 55.468 0.05 . 1 . . . . . . . . 5324 1 162 . 1 1 24 24 SER CB C 13 60.962 0.05 . 1 . . . . . . . . 5324 1 163 . 1 1 24 24 SER H H 1 7.755 0.02 . 1 . . . . . . . . 5324 1 164 . 1 1 24 24 SER HA H 1 4.521 0.02 . 1 . . . . . . . . 5324 1 165 . 1 1 24 24 SER HB2 H 1 3.940 0.02 . 1 . . . . . . . . 5324 1 166 . 1 1 24 24 SER HB3 H 1 3.940 0.02 . 1 . . . . . . . . 5324 1 167 . 1 1 24 24 SER N N 15 114.379 0.05 . 1 . . . . . . . . 5324 1 168 . 1 1 25 25 LEU CA C 13 51.923 0.05 . 1 . . . . . . . . 5324 1 169 . 1 1 25 25 LEU CB C 13 38.678 0.05 . 1 . . . . . . . . 5324 1 170 . 1 1 25 25 LEU CD1 C 13 22.973 0.05 . 1 . . . . . . . . 5324 1 171 . 1 1 25 25 LEU CD2 C 13 18.993 0.05 . 1 . . . . . . . . 5324 1 172 . 1 1 25 25 LEU H H 1 6.949 0.02 . 1 . . . . . . . . 5324 1 173 . 1 1 25 25 LEU HA H 1 4.244 0.02 . 1 . . . . . . . . 5324 1 174 . 1 1 25 25 LEU HB2 H 1 1.737 0.02 . 2 . . . . . . . . 5324 1 175 . 1 1 25 25 LEU HB3 H 1 1.413 0.02 . 2 . . . . . . . . 5324 1 176 . 1 1 25 25 LEU HG H 1 1.948 0.02 . 1 . . . . . . . . 5324 1 177 . 1 1 25 25 LEU HD11 H 1 0.705 0.02 . 2 . . . . . . . . 5324 1 178 . 1 1 25 25 LEU HD12 H 1 0.705 0.02 . 2 . . . . . . . . 5324 1 179 . 1 1 25 25 LEU HD13 H 1 0.705 0.02 . 2 . . . . . . . . 5324 1 180 . 1 1 25 25 LEU HD21 H 1 0.494 0.02 . 2 . . . . . . . . 5324 1 181 . 1 1 25 25 LEU HD22 H 1 0.494 0.02 . 2 . . . . . . . . 5324 1 182 . 1 1 25 25 LEU HD23 H 1 0.494 0.02 . 2 . . . . . . . . 5324 1 183 . 1 1 25 25 LEU N N 15 121.093 0.05 . 1 . . . . . . . . 5324 1 184 . 1 1 26 26 SER CA C 13 54.416 0.05 . 1 . . . . . . . . 5324 1 185 . 1 1 26 26 SER CB C 13 62.176 0.05 . 1 . . . . . . . . 5324 1 186 . 1 1 26 26 SER H H 1 9.091 0.02 . 1 . . . . . . . . 5324 1 187 . 1 1 26 26 SER HA H 1 4.424 0.02 . 1 . . . . . . . . 5324 1 188 . 1 1 26 26 SER HB2 H 1 4.149 0.02 . 1 . . . . . . . . 5324 1 189 . 1 1 26 26 SER HB3 H 1 4.149 0.02 . 1 . . . . . . . . 5324 1 190 . 1 1 26 26 SER N N 15 117.984 0.05 . 1 . . . . . . . . 5324 1 191 . 1 1 27 27 GLU CA C 13 56.570 0.05 . 1 . . . . . . . . 5324 1 192 . 1 1 27 27 GLU CB C 13 25.594 0.05 . 1 . . . . . . . . 5324 1 193 . 1 1 27 27 GLU CG C 13 33.205 0.05 . 1 . . . . . . . . 5324 1 194 . 1 1 27 27 GLU H H 1 8.865 0.02 . 1 . . . . . . . . 5324 1 195 . 1 1 27 27 GLU HA H 1 4.013 0.02 . 1 . . . . . . . . 5324 1 196 . 1 1 27 27 GLU HB2 H 1 2.079 0.02 . 2 . . . . . . . . 5324 1 197 . 1 1 27 27 GLU HB3 H 1 2.410 0.02 . 2 . . . . . . . . 5324 1 198 . 1 1 27 27 GLU HG2 H 1 2.347 0.02 . 2 . . . . . . . . 5324 1 199 . 1 1 27 27 GLU HG3 H 1 2.410 0.02 . 2 . . . . . . . . 5324 1 200 . 1 1 27 27 GLU N N 15 120.485 0.05 . 1 . . . . . . . . 5324 1 201 . 1 1 28 28 GLU CA C 13 56.161 0.05 . 1 . . . . . . . . 5324 1 202 . 1 1 28 28 GLU CB C 13 25.832 0.05 . 1 . . . . . . . . 5324 1 203 . 1 1 28 28 GLU CG C 13 33.293 0.05 . 1 . . . . . . . . 5324 1 204 . 1 1 28 28 GLU H H 1 8.700 0.02 . 1 . . . . . . . . 5324 1 205 . 1 1 28 28 GLU HA H 1 4.151 0.02 . 1 . . . . . . . . 5324 1 206 . 1 1 28 28 GLU HB2 H 1 2.047 0.02 . 1 . . . . . . . . 5324 1 207 . 1 1 28 28 GLU HB3 H 1 2.047 0.02 . 1 . . . . . . . . 5324 1 208 . 1 1 28 28 GLU HG2 H 1 2.365 0.02 . 1 . . . . . . . . 5324 1 209 . 1 1 28 28 GLU HG3 H 1 2.365 0.02 . 1 . . . . . . . . 5324 1 210 . 1 1 28 28 GLU N N 15 118.663 0.05 . 1 . . . . . . . . 5324 1 211 . 1 1 29 29 GLU CA C 13 55.627 0.05 . 1 . . . . . . . . 5324 1 212 . 1 1 29 29 GLU CB C 13 26.737 0.05 . 1 . . . . . . . . 5324 1 213 . 1 1 29 29 GLU H H 1 7.809 0.02 . 1 . . . . . . . . 5324 1 214 . 1 1 29 29 GLU HA H 1 4.109 0.02 . 1 . . . . . . . . 5324 1 215 . 1 1 29 29 GLU HB2 H 1 2.447 0.02 . 2 . . . . . . . . 5324 1 216 . 1 1 29 29 GLU HB3 H 1 2.332 0.02 . 2 . . . . . . . . 5324 1 217 . 1 1 29 29 GLU HG2 H 1 2.001 0.02 . 1 . . . . . . . . 5324 1 218 . 1 1 29 29 GLU HG3 H 1 2.001 0.02 . 1 . . . . . . . . 5324 1 219 . 1 1 29 29 GLU N N 15 120.743 0.05 . 1 . . . . . . . . 5324 1 220 . 1 1 30 30 ILE CA C 13 60.292 0.05 . 1 . . . . . . . . 5324 1 221 . 1 1 30 30 ILE CG1 C 13 25.451 0.05 . 1 . . . . . . . . 5324 1 222 . 1 1 30 30 ILE CG2 C 13 14.325 0.05 . 1 . . . . . . . . 5324 1 223 . 1 1 30 30 ILE CD1 C 13 9.463 0.05 . 1 . . . . . . . . 5324 1 224 . 1 1 30 30 ILE HA H 1 3.896 0.02 . 1 . . . . . . . . 5324 1 225 . 1 1 30 30 ILE HB H 1 1.649 0.02 . 1 . . . . . . . . 5324 1 226 . 1 1 30 30 ILE HG12 H 1 0.987 0.02 . 1 . . . . . . . . 5324 1 227 . 1 1 30 30 ILE HG13 H 1 0.987 0.02 . 1 . . . . . . . . 5324 1 228 . 1 1 31 31 ALA CA C 13 52.161 0.05 . 1 . . . . . . . . 5324 1 229 . 1 1 31 31 ALA CB C 13 13.964 0.05 . 1 . . . . . . . . 5324 1 230 . 1 1 31 31 ALA H H 1 8.059 0.02 . 1 . . . . . . . . 5324 1 231 . 1 1 31 31 ALA HA H 1 4.123 0.02 . 1 . . . . . . . . 5324 1 232 . 1 1 31 31 ALA HB1 H 1 1.534 0.02 . 1 . . . . . . . . 5324 1 233 . 1 1 31 31 ALA HB2 H 1 1.534 0.02 . 1 . . . . . . . . 5324 1 234 . 1 1 31 31 ALA HB3 H 1 1.534 0.02 . 1 . . . . . . . . 5324 1 235 . 1 1 31 31 ALA N N 15 122.994 0.05 . 1 . . . . . . . . 5324 1 236 . 1 1 32 32 GLY CA C 13 43.582 0.05 . 1 . . . . . . . . 5324 1 237 . 1 1 32 32 GLY H H 1 8.043 0.02 . 1 . . . . . . . . 5324 1 238 . 1 1 32 32 GLY HA2 H 1 4.029 0.02 . 1 . . . . . . . . 5324 1 239 . 1 1 32 32 GLY HA3 H 1 4.029 0.02 . 1 . . . . . . . . 5324 1 240 . 1 1 32 32 GLY N N 15 105.336 0.05 . 1 . . . . . . . . 5324 1 241 . 1 1 33 33 LEU CA C 13 54.771 0.05 . 1 . . . . . . . . 5324 1 242 . 1 1 33 33 LEU CB C 13 38.113 0.05 . 1 . . . . . . . . 5324 1 243 . 1 1 33 33 LEU CD1 C 13 22.995 0.05 . 1 . . . . . . . . 5324 1 244 . 1 1 33 33 LEU CD2 C 13 20.352 0.05 . 1 . . . . . . . . 5324 1 245 . 1 1 33 33 LEU H H 1 7.980 0.02 . 1 . . . . . . . . 5324 1 246 . 1 1 33 33 LEU HA H 1 4.399 0.02 . 1 . . . . . . . . 5324 1 247 . 1 1 33 33 LEU HB2 H 1 1.641 0.02 . 2 . . . . . . . . 5324 1 248 . 1 1 33 33 LEU HB3 H 1 2.195 0.02 . 2 . . . . . . . . 5324 1 249 . 1 1 33 33 LEU HG H 1 1.883 0.02 . 1 . . . . . . . . 5324 1 250 . 1 1 33 33 LEU HD11 H 1 0.914 0.02 . 1 . . . . . . . . 5324 1 251 . 1 1 33 33 LEU HD12 H 1 0.914 0.02 . 1 . . . . . . . . 5324 1 252 . 1 1 33 33 LEU HD13 H 1 0.914 0.02 . 1 . . . . . . . . 5324 1 253 . 1 1 33 33 LEU HD21 H 1 0.914 0.02 . 1 . . . . . . . . 5324 1 254 . 1 1 33 33 LEU HD22 H 1 0.914 0.02 . 1 . . . . . . . . 5324 1 255 . 1 1 33 33 LEU HD23 H 1 0.914 0.02 . 1 . . . . . . . . 5324 1 256 . 1 1 33 33 LEU N N 15 123.759 0.05 . 1 . . . . . . . . 5324 1 257 . 1 1 34 34 LYS CA C 13 56.747 0.05 . 1 . . . . . . . . 5324 1 258 . 1 1 34 34 LYS CB C 13 28.025 0.05 . 1 . . . . . . . . 5324 1 259 . 1 1 34 34 LYS CG C 13 22.004 0.05 . 1 . . . . . . . . 5324 1 260 . 1 1 34 34 LYS CD C 13 25.780 0.05 . 1 . . . . . . . . 5324 1 261 . 1 1 34 34 LYS CE C 13 38.247 0.05 . 1 . . . . . . . . 5324 1 262 . 1 1 34 34 LYS H H 1 8.708 0.02 . 1 . . . . . . . . 5324 1 263 . 1 1 34 34 LYS HA H 1 4.022 0.02 . 1 . . . . . . . . 5324 1 264 . 1 1 34 34 LYS HB2 H 1 1.919 0.02 . 1 . . . . . . . . 5324 1 265 . 1 1 34 34 LYS HB3 H 1 1.919 0.02 . 1 . . . . . . . . 5324 1 266 . 1 1 34 34 LYS HG2 H 1 1.260 0.02 . 1 . . . . . . . . 5324 1 267 . 1 1 34 34 LYS HG3 H 1 1.260 0.02 . 1 . . . . . . . . 5324 1 268 . 1 1 34 34 LYS HD2 H 1 1.454 0.02 . 1 . . . . . . . . 5324 1 269 . 1 1 34 34 LYS HD3 H 1 1.454 0.02 . 1 . . . . . . . . 5324 1 270 . 1 1 34 34 LYS HE2 H 1 2.674 0.02 . 1 . . . . . . . . 5324 1 271 . 1 1 34 34 LYS HE3 H 1 2.674 0.02 . 1 . . . . . . . . 5324 1 272 . 1 1 34 34 LYS N N 15 121.114 0.05 . 1 . . . . . . . . 5324 1 273 . 1 1 35 35 GLU CA C 13 56.069 0.05 . 1 . . . . . . . . 5324 1 274 . 1 1 35 35 GLU CB C 13 25.506 0.05 . 1 . . . . . . . . 5324 1 275 . 1 1 35 35 GLU CG C 13 32.908 0.05 . 1 . . . . . . . . 5324 1 276 . 1 1 35 35 GLU H H 1 7.872 0.02 . 1 . . . . . . . . 5324 1 277 . 1 1 35 35 GLU HA H 1 4.121 0.02 . 1 . . . . . . . . 5324 1 278 . 1 1 35 35 GLU HB2 H 1 2.169 0.02 . 2 . . . . . . . . 5324 1 279 . 1 1 35 35 GLU HB3 H 1 2.359 0.02 . 2 . . . . . . . . 5324 1 280 . 1 1 35 35 GLU HG2 H 1 2.355 0.02 . 1 . . . . . . . . 5324 1 281 . 1 1 35 35 GLU HG3 H 1 2.355 0.02 . 1 . . . . . . . . 5324 1 282 . 1 1 35 35 GLU N N 15 118.181 0.05 . 1 . . . . . . . . 5324 1 283 . 1 1 36 36 MET CA C 13 55.996 0.05 . 1 . . . . . . . . 5324 1 284 . 1 1 36 36 MET CB C 13 29.759 0.05 . 1 . . . . . . . . 5324 1 285 . 1 1 36 36 MET H H 1 7.848 0.02 . 1 . . . . . . . . 5324 1 286 . 1 1 36 36 MET HA H 1 4.128 0.02 . 1 . . . . . . . . 5324 1 287 . 1 1 36 36 MET HB2 H 1 2.277 0.02 . 2 . . . . . . . . 5324 1 288 . 1 1 36 36 MET HB3 H 1 2.508 0.02 . 2 . . . . . . . . 5324 1 289 . 1 1 36 36 MET N N 15 119.440 0.05 . 1 . . . . . . . . 5324 1 290 . 1 1 37 37 PHE CA C 13 58.651 0.05 . 1 . . . . . . . . 5324 1 291 . 1 1 37 37 PHE CB C 13 35.202 0.05 . 1 . . . . . . . . 5324 1 292 . 1 1 37 37 PHE CD1 C 13 129.745 0.05 . 1 . . . . . . . . 5324 1 293 . 1 1 37 37 PHE CD2 C 13 129.745 0.05 . 1 . . . . . . . . 5324 1 294 . 1 1 37 37 PHE H H 1 8.669 0.02 . 1 . . . . . . . . 5324 1 295 . 1 1 37 37 PHE HB2 H 1 3.144 0.02 . 2 . . . . . . . . 5324 1 296 . 1 1 37 37 PHE HB3 H 1 2.787 0.02 . 2 . . . . . . . . 5324 1 297 . 1 1 37 37 PHE HD1 H 1 6.781 0.02 . 1 . . . . . . . . 5324 1 298 . 1 1 37 37 PHE HE1 H 1 7.104 0.02 . 1 . . . . . . . . 5324 1 299 . 1 1 37 37 PHE HZ H 1 7.155 0.02 . 1 . . . . . . . . 5324 1 300 . 1 1 37 37 PHE HE2 H 1 7.104 0.02 . 1 . . . . . . . . 5324 1 301 . 1 1 37 37 PHE HD2 H 1 6.781 0.02 . 1 . . . . . . . . 5324 1 302 . 1 1 37 37 PHE N N 15 120.232 0.05 . 1 . . . . . . . . 5324 1 303 . 1 1 38 38 ASN CA C 13 52.193 0.05 . 1 . . . . . . . . 5324 1 304 . 1 1 38 38 ASN CB C 13 34.606 0.05 . 1 . . . . . . . . 5324 1 305 . 1 1 38 38 ASN H H 1 8.239 0.02 . 1 . . . . . . . . 5324 1 306 . 1 1 38 38 ASN HA H 1 4.219 0.02 . 1 . . . . . . . . 5324 1 307 . 1 1 38 38 ASN HB2 H 1 2.874 0.02 . 2 . . . . . . . . 5324 1 308 . 1 1 38 38 ASN HB3 H 1 2.725 0.02 . 2 . . . . . . . . 5324 1 309 . 1 1 38 38 ASN HD21 H 1 7.501 0.02 . 1 . . . . . . . . 5324 1 310 . 1 1 38 38 ASN HD22 H 1 6.729 0.02 . 1 . . . . . . . . 5324 1 311 . 1 1 38 38 ASN N N 15 115.323 0.05 . 1 . . . . . . . . 5324 1 312 . 1 1 38 38 ASN ND2 N 15 110.911 0.05 . 1 . . . . . . . . 5324 1 313 . 1 1 39 39 MET CA C 13 54.681 0.05 . 1 . . . . . . . . 5324 1 314 . 1 1 39 39 MET CB C 13 28.611 0.05 . 1 . . . . . . . . 5324 1 315 . 1 1 39 39 MET H H 1 7.622 0.02 . 1 . . . . . . . . 5324 1 316 . 1 1 39 39 MET HB2 H 1 2.450 0.02 . 2 . . . . . . . . 5324 1 317 . 1 1 39 39 MET HB3 H 1 2.667 0.02 . 2 . . . . . . . . 5324 1 318 . 1 1 39 39 MET HE1 H 1 2.192 0.02 . 1 . . . . . . . . 5324 1 319 . 1 1 39 39 MET HE2 H 1 2.192 0.02 . 1 . . . . . . . . 5324 1 320 . 1 1 39 39 MET HE3 H 1 2.192 0.02 . 1 . . . . . . . . 5324 1 321 . 1 1 39 39 MET N N 15 117.722 0.05 . 1 . . . . . . . . 5324 1 322 . 1 1 40 40 ILE CA C 13 60.535 0.05 . 1 . . . . . . . . 5324 1 323 . 1 1 40 40 ILE CB C 13 33.921 0.05 . 1 . . . . . . . . 5324 1 324 . 1 1 40 40 ILE CG2 C 13 15.659 0.05 . 1 . . . . . . . . 5324 1 325 . 1 1 40 40 ILE CD1 C 13 9.934 0.05 . 1 . . . . . . . . 5324 1 326 . 1 1 40 40 ILE H H 1 7.503 0.02 . 1 . . . . . . . . 5324 1 327 . 1 1 40 40 ILE HA H 1 3.605 0.02 . 1 . . . . . . . . 5324 1 328 . 1 1 40 40 ILE HB H 1 1.930 0.02 . 1 . . . . . . . . 5324 1 329 . 1 1 40 40 ILE HG12 H 1 1.379 0.02 . 2 . . . . . . . . 5324 1 330 . 1 1 40 40 ILE HG13 H 1 0.776 0.02 . 2 . . . . . . . . 5324 1 331 . 1 1 40 40 ILE HG21 H 1 0.643 0.02 . 1 . . . . . . . . 5324 1 332 . 1 1 40 40 ILE HG22 H 1 0.643 0.02 . 1 . . . . . . . . 5324 1 333 . 1 1 40 40 ILE HG23 H 1 0.643 0.02 . 1 . . . . . . . . 5324 1 334 . 1 1 40 40 ILE HD11 H 1 0.196 0.02 . 1 . . . . . . . . 5324 1 335 . 1 1 40 40 ILE HD12 H 1 0.196 0.02 . 1 . . . . . . . . 5324 1 336 . 1 1 40 40 ILE HD13 H 1 0.196 0.02 . 1 . . . . . . . . 5324 1 337 . 1 1 40 40 ILE N N 15 118.331 0.05 . 1 . . . . . . . . 5324 1 338 . 1 1 41 41 ASP CA C 13 49.419 0.05 . 1 . . . . . . . . 5324 1 339 . 1 1 41 41 ASP CB C 13 34.862 0.05 . 1 . . . . . . . . 5324 1 340 . 1 1 41 41 ASP H H 1 8.068 0.02 . 1 . . . . . . . . 5324 1 341 . 1 1 41 41 ASP HB2 H 1 2.365 0.02 . 2 . . . . . . . . 5324 1 342 . 1 1 41 41 ASP HB3 H 1 1.312 0.02 . 2 . . . . . . . . 5324 1 343 . 1 1 41 41 ASP N N 15 120.338 0.05 . 1 . . . . . . . . 5324 1 344 . 1 1 42 42 ALA CA C 13 51.680 0.05 . 1 . . . . . . . . 5324 1 345 . 1 1 42 42 ALA CB C 13 15.478 0.05 . 1 . . . . . . . . 5324 1 346 . 1 1 42 42 ALA H H 1 7.714 0.02 . 1 . . . . . . . . 5324 1 347 . 1 1 42 42 ALA HA H 1 3.991 0.02 . 1 . . . . . . . . 5324 1 348 . 1 1 42 42 ALA HB1 H 1 1.454 0.02 . 1 . . . . . . . . 5324 1 349 . 1 1 42 42 ALA HB2 H 1 1.454 0.02 . 1 . . . . . . . . 5324 1 350 . 1 1 42 42 ALA HB3 H 1 1.454 0.02 . 1 . . . . . . . . 5324 1 351 . 1 1 42 42 ALA N N 15 128.876 0.05 . 1 . . . . . . . . 5324 1 352 . 1 1 43 43 ASP CA C 13 49.156 0.05 . 1 . . . . . . . . 5324 1 353 . 1 1 43 43 ASP CB C 13 35.881 0.05 . 1 . . . . . . . . 5324 1 354 . 1 1 43 43 ASP H H 1 7.724 0.02 . 1 . . . . . . . . 5324 1 355 . 1 1 43 43 ASP HA H 1 4.559 0.02 . 1 . . . . . . . . 5324 1 356 . 1 1 43 43 ASP HB2 H 1 3.076 0.02 . 2 . . . . . . . . 5324 1 357 . 1 1 43 43 ASP HB3 H 1 2.620 0.02 . 2 . . . . . . . . 5324 1 358 . 1 1 43 43 ASP N N 15 113.002 0.05 . 1 . . . . . . . . 5324 1 359 . 1 1 44 44 LYS CA C 13 53.323 0.05 . 1 . . . . . . . . 5324 1 360 . 1 1 44 44 LYS CB C 13 24.840 0.05 . 1 . . . . . . . . 5324 1 361 . 1 1 44 44 LYS CG C 13 21.373 0.05 . 1 . . . . . . . . 5324 1 362 . 1 1 44 44 LYS CE C 13 39.339 0.05 . 1 . . . . . . . . 5324 1 363 . 1 1 44 44 LYS H H 1 8.122 0.02 . 1 . . . . . . . . 5324 1 364 . 1 1 44 44 LYS HA H 1 3.901 0.02 . 1 . . . . . . . . 5324 1 365 . 1 1 44 44 LYS HB2 H 1 1.951 0.02 . 1 . . . . . . . . 5324 1 366 . 1 1 44 44 LYS HB3 H 1 1.951 0.02 . 1 . . . . . . . . 5324 1 367 . 1 1 44 44 LYS HG2 H 1 1.364 0.02 . 1 . . . . . . . . 5324 1 368 . 1 1 44 44 LYS HG3 H 1 1.364 0.02 . 1 . . . . . . . . 5324 1 369 . 1 1 44 44 LYS HD2 H 1 1.636 0.02 . 2 . . . . . . . . 5324 1 370 . 1 1 44 44 LYS HD3 H 1 1.736 0.02 . 2 . . . . . . . . 5324 1 371 . 1 1 44 44 LYS HE2 H 1 2.976 0.02 . 1 . . . . . . . . 5324 1 372 . 1 1 44 44 LYS HE3 H 1 2.976 0.02 . 1 . . . . . . . . 5324 1 373 . 1 1 44 44 LYS N N 15 115.049 0.05 . 1 . . . . . . . . 5324 1 374 . 1 1 45 45 SER CA C 13 56.315 0.05 . 1 . . . . . . . . 5324 1 375 . 1 1 45 45 SER CB C 13 61.514 0.05 . 1 . . . . . . . . 5324 1 376 . 1 1 45 45 SER H H 1 8.269 0.02 . 1 . . . . . . . . 5324 1 377 . 1 1 45 45 SER HA H 1 4.247 0.02 . 1 . . . . . . . . 5324 1 378 . 1 1 45 45 SER HB2 H 1 3.900 0.02 . 1 . . . . . . . . 5324 1 379 . 1 1 45 45 SER HB3 H 1 3.900 0.02 . 1 . . . . . . . . 5324 1 380 . 1 1 45 45 SER N N 15 114.855 0.05 . 1 . . . . . . . . 5324 1 381 . 1 1 46 46 GLY H H 1 10.960 0.02 . 1 . . . . . . . . 5324 1 382 . 1 1 46 46 GLY HA2 H 1 4.520 0.02 . 2 . . . . . . . . 5324 1 383 . 1 1 46 46 GLY HA3 H 1 3.681 0.02 . 2 . . . . . . . . 5324 1 384 . 1 1 46 46 GLY N N 15 116.112 0.05 . 1 . . . . . . . . 5324 1 385 . 1 1 47 47 GLN CA C 13 50.531 0.05 . 1 . . . . . . . . 5324 1 386 . 1 1 47 47 GLN CB C 13 27.866 0.05 . 1 . . . . . . . . 5324 1 387 . 1 1 47 47 GLN CG C 13 29.471 0.05 . 1 . . . . . . . . 5324 1 388 . 1 1 47 47 GLN H H 1 7.621 0.02 . 1 . . . . . . . . 5324 1 389 . 1 1 47 47 GLN HA H 1 4.830 0.02 . 1 . . . . . . . . 5324 1 390 . 1 1 47 47 GLN HB2 H 1 1.916 0.02 . 2 . . . . . . . . 5324 1 391 . 1 1 47 47 GLN HB3 H 1 1.709 0.02 . 2 . . . . . . . . 5324 1 392 . 1 1 47 47 GLN HG2 H 1 2.375 0.02 . 2 . . . . . . . . 5324 1 393 . 1 1 47 47 GLN HG3 H 1 2.181 0.02 . 2 . . . . . . . . 5324 1 394 . 1 1 47 47 GLN HE21 H 1 7.561 0.02 . 1 . . . . . . . . 5324 1 395 . 1 1 47 47 GLN HE22 H 1 6.963 0.02 . 1 . . . . . . . . 5324 1 396 . 1 1 47 47 GLN N N 15 114.500 0.05 . 1 . . . . . . . . 5324 1 397 . 1 1 47 47 GLN NE2 N 15 113.036 0.05 . 1 . . . . . . . . 5324 1 398 . 1 1 48 48 ILE CA C 13 57.197 0.05 . 1 . . . . . . . . 5324 1 399 . 1 1 48 48 ILE CB C 13 35.721 0.05 . 1 . . . . . . . . 5324 1 400 . 1 1 48 48 ILE CG1 C 13 24.827 0.05 . 1 . . . . . . . . 5324 1 401 . 1 1 48 48 ILE CG2 C 13 15.216 0.05 . 1 . . . . . . . . 5324 1 402 . 1 1 48 48 ILE CD1 C 13 11.703 0.05 . 1 . . . . . . . . 5324 1 403 . 1 1 48 48 ILE H H 1 9.819 0.02 . 1 . . . . . . . . 5324 1 404 . 1 1 48 48 ILE HA H 1 4.861 0.02 . 1 . . . . . . . . 5324 1 405 . 1 1 48 48 ILE HB H 1 1.878 0.02 . 1 . . . . . . . . 5324 1 406 . 1 1 48 48 ILE HG12 H 1 1.083 0.02 . 1 . . . . . . . . 5324 1 407 . 1 1 48 48 ILE HG13 H 1 1.083 0.02 . 1 . . . . . . . . 5324 1 408 . 1 1 48 48 ILE HG21 H 1 0.871 0.02 . 1 . . . . . . . . 5324 1 409 . 1 1 48 48 ILE HG22 H 1 0.871 0.02 . 1 . . . . . . . . 5324 1 410 . 1 1 48 48 ILE HG23 H 1 0.871 0.02 . 1 . . . . . . . . 5324 1 411 . 1 1 48 48 ILE HD11 H 1 0.191 0.02 . 1 . . . . . . . . 5324 1 412 . 1 1 48 48 ILE HD12 H 1 0.191 0.02 . 1 . . . . . . . . 5324 1 413 . 1 1 48 48 ILE HD13 H 1 0.191 0.02 . 1 . . . . . . . . 5324 1 414 . 1 1 48 48 ILE N N 15 128.574 0.05 . 1 . . . . . . . . 5324 1 415 . 1 1 49 49 THR CA C 13 56.774 0.05 . 1 . . . . . . . . 5324 1 416 . 1 1 49 49 THR CB C 13 67.833 0.05 . 1 . . . . . . . . 5324 1 417 . 1 1 49 49 THR CG2 C 13 18.874 0.05 . 1 . . . . . . . . 5324 1 418 . 1 1 49 49 THR H H 1 8.803 0.02 . 1 . . . . . . . . 5324 1 419 . 1 1 49 49 THR HA H 1 4.600 0.02 . 1 . . . . . . . . 5324 1 420 . 1 1 49 49 THR HB H 1 4.890 0.02 . 1 . . . . . . . . 5324 1 421 . 1 1 49 49 THR HG21 H 1 1.266 0.02 . 1 . . . . . . . . 5324 1 422 . 1 1 49 49 THR HG22 H 1 1.266 0.02 . 1 . . . . . . . . 5324 1 423 . 1 1 49 49 THR HG23 H 1 1.266 0.02 . 1 . . . . . . . . 5324 1 424 . 1 1 49 49 THR N N 15 119.055 0.05 . 1 . . . . . . . . 5324 1 425 . 1 1 50 50 PHE CA C 13 58.471 0.05 . 1 . . . . . . . . 5324 1 426 . 1 1 50 50 PHE CB C 13 35.224 0.05 . 1 . . . . . . . . 5324 1 427 . 1 1 50 50 PHE H H 1 9.435 0.02 . 1 . . . . . . . . 5324 1 428 . 1 1 50 50 PHE HA H 1 4.362 0.02 . 1 . . . . . . . . 5324 1 429 . 1 1 50 50 PHE HB2 H 1 3.045 0.02 . 2 . . . . . . . . 5324 1 430 . 1 1 50 50 PHE HB3 H 1 3.351 0.02 . 2 . . . . . . . . 5324 1 431 . 1 1 50 50 PHE HD1 H 1 7.202 0.02 . 1 . . . . . . . . 5324 1 432 . 1 1 50 50 PHE HD2 H 1 7.202 0.02 . 1 . . . . . . . . 5324 1 433 . 1 1 50 50 PHE N N 15 122.028 0.05 . 1 . . . . . . . . 5324 1 434 . 1 1 51 51 GLU CA C 13 56.817 0.05 . 1 . . . . . . . . 5324 1 435 . 1 1 51 51 GLU CB C 13 25.130 0.05 . 1 . . . . . . . . 5324 1 436 . 1 1 51 51 GLU CG C 13 33.536 0.05 . 1 . . . . . . . . 5324 1 437 . 1 1 51 51 GLU H H 1 8.777 0.02 . 1 . . . . . . . . 5324 1 438 . 1 1 51 51 GLU HA H 1 3.676 0.02 . 1 . . . . . . . . 5324 1 439 . 1 1 51 51 GLU HB2 H 1 2.000 0.02 . 2 . . . . . . . . 5324 1 440 . 1 1 51 51 GLU HB3 H 1 1.945 0.02 . 2 . . . . . . . . 5324 1 441 . 1 1 51 51 GLU HG2 H 1 2.449 0.02 . 1 . . . . . . . . 5324 1 442 . 1 1 51 51 GLU HG3 H 1 2.449 0.02 . 1 . . . . . . . . 5324 1 443 . 1 1 51 51 GLU N N 15 116.322 0.05 . 1 . . . . . . . . 5324 1 444 . 1 1 52 52 GLU CA C 13 55.544 0.05 . 1 . . . . . . . . 5324 1 445 . 1 1 52 52 GLU CB C 13 26.168 0.05 . 1 . . . . . . . . 5324 1 446 . 1 1 52 52 GLU CG C 13 33.909 0.05 . 1 . . . . . . . . 5324 1 447 . 1 1 52 52 GLU H H 1 7.636 0.02 . 1 . . . . . . . . 5324 1 448 . 1 1 52 52 GLU HA H 1 4.098 0.02 . 1 . . . . . . . . 5324 1 449 . 1 1 52 52 GLU HB2 H 1 2.324 0.02 . 2 . . . . . . . . 5324 1 450 . 1 1 52 52 GLU HB3 H 1 2.258 0.02 . 2 . . . . . . . . 5324 1 451 . 1 1 52 52 GLU HG2 H 1 2.646 0.02 . 2 . . . . . . . . 5324 1 452 . 1 1 52 52 GLU HG3 H 1 2.486 0.02 . 2 . . . . . . . . 5324 1 453 . 1 1 52 52 GLU N N 15 118.748 0.05 . 1 . . . . . . . . 5324 1 454 . 1 1 53 53 LEU CA C 13 54.765 0.05 . 1 . . . . . . . . 5324 1 455 . 1 1 53 53 LEU CB C 13 37.561 0.05 . 1 . . . . . . . . 5324 1 456 . 1 1 53 53 LEU CG C 13 22.959 0.05 . 1 . . . . . . . . 5324 1 457 . 1 1 53 53 LEU CD1 C 13 19.262 0.05 . 1 . . . . . . . . 5324 1 458 . 1 1 53 53 LEU H H 1 8.747 0.02 . 1 . . . . . . . . 5324 1 459 . 1 1 53 53 LEU HA H 1 3.806 0.02 . 1 . . . . . . . . 5324 1 460 . 1 1 53 53 LEU HB2 H 1 1.934 0.02 . 2 . . . . . . . . 5324 1 461 . 1 1 53 53 LEU HB3 H 1 1.438 0.02 . 2 . . . . . . . . 5324 1 462 . 1 1 53 53 LEU HD11 H 1 0.880 0.02 . 1 . . . . . . . . 5324 1 463 . 1 1 53 53 LEU HD12 H 1 0.880 0.02 . 1 . . . . . . . . 5324 1 464 . 1 1 53 53 LEU HD13 H 1 0.880 0.02 . 1 . . . . . . . . 5324 1 465 . 1 1 53 53 LEU HD21 H 1 0.880 0.02 . 1 . . . . . . . . 5324 1 466 . 1 1 53 53 LEU HD22 H 1 0.880 0.02 . 1 . . . . . . . . 5324 1 467 . 1 1 53 53 LEU HD23 H 1 0.880 0.02 . 1 . . . . . . . . 5324 1 468 . 1 1 53 53 LEU N N 15 123.245 0.05 . 1 . . . . . . . . 5324 1 469 . 1 1 54 54 LYS CA C 13 56.760 0.05 . 1 . . . . . . . . 5324 1 470 . 1 1 54 54 LYS CB C 13 28.360 0.05 . 1 . . . . . . . . 5324 1 471 . 1 1 54 54 LYS CG C 13 21.413 0.05 . 1 . . . . . . . . 5324 1 472 . 1 1 54 54 LYS CD C 13 26.385 0.05 . 1 . . . . . . . . 5324 1 473 . 1 1 54 54 LYS CE C 13 38.031 0.05 . 1 . . . . . . . . 5324 1 474 . 1 1 54 54 LYS H H 1 8.293 0.02 . 1 . . . . . . . . 5324 1 475 . 1 1 54 54 LYS HA H 1 3.704 0.02 . 1 . . . . . . . . 5324 1 476 . 1 1 54 54 LYS HB2 H 1 1.548 0.02 . 1 . . . . . . . . 5324 1 477 . 1 1 54 54 LYS HB3 H 1 1.548 0.02 . 1 . . . . . . . . 5324 1 478 . 1 1 54 54 LYS HG2 H 1 1.355 0.02 . 1 . . . . . . . . 5324 1 479 . 1 1 54 54 LYS HG3 H 1 1.355 0.02 . 1 . . . . . . . . 5324 1 480 . 1 1 54 54 LYS HD2 H 1 1.140 0.02 . 1 . . . . . . . . 5324 1 481 . 1 1 54 54 LYS HD3 H 1 1.140 0.02 . 1 . . . . . . . . 5324 1 482 . 1 1 54 54 LYS HE2 H 1 2.980 0.02 . 1 . . . . . . . . 5324 1 483 . 1 1 54 54 LYS HE3 H 1 2.980 0.02 . 1 . . . . . . . . 5324 1 484 . 1 1 54 54 LYS N N 15 117.262 0.05 . 1 . . . . . . . . 5324 1 485 . 1 1 55 55 ALA CA C 13 51.141 0.05 . 1 . . . . . . . . 5324 1 486 . 1 1 55 55 ALA CB C 13 14.871 0.05 . 1 . . . . . . . . 5324 1 487 . 1 1 55 55 ALA H H 1 7.393 0.02 . 1 . . . . . . . . 5324 1 488 . 1 1 55 55 ALA HA H 1 4.150 0.02 . 1 . . . . . . . . 5324 1 489 . 1 1 55 55 ALA HB1 H 1 1.443 0.02 . 1 . . . . . . . . 5324 1 490 . 1 1 55 55 ALA HB2 H 1 1.443 0.02 . 1 . . . . . . . . 5324 1 491 . 1 1 55 55 ALA HB3 H 1 1.443 0.02 . 1 . . . . . . . . 5324 1 492 . 1 1 55 55 ALA N N 15 118.705 0.05 . 1 . . . . . . . . 5324 1 493 . 1 1 56 56 GLY CA C 13 43.786 0.05 . 1 . . . . . . . . 5324 1 494 . 1 1 56 56 GLY H H 1 8.630 0.02 . 1 . . . . . . . . 5324 1 495 . 1 1 56 56 GLY HA2 H 1 3.957 0.02 . 2 . . . . . . . . 5324 1 496 . 1 1 56 56 GLY HA3 H 1 3.656 0.02 . 2 . . . . . . . . 5324 1 497 . 1 1 56 56 GLY N N 15 106.420 0.05 . 1 . . . . . . . . 5324 1 498 . 1 1 57 57 LEU CA C 13 54.240 0.05 . 1 . . . . . . . . 5324 1 499 . 1 1 57 57 LEU CB C 13 36.143 0.05 . 1 . . . . . . . . 5324 1 500 . 1 1 57 57 LEU CD1 C 13 18.640 0.05 . 1 . . . . . . . . 5324 1 501 . 1 1 57 57 LEU CD2 C 13 23.364 0.05 . 1 . . . . . . . . 5324 1 502 . 1 1 57 57 LEU H H 1 8.443 0.02 . 1 . . . . . . . . 5324 1 503 . 1 1 57 57 LEU HA H 1 4.158 0.02 . 1 . . . . . . . . 5324 1 504 . 1 1 57 57 LEU HB2 H 1 1.853 0.02 . 2 . . . . . . . . 5324 1 505 . 1 1 57 57 LEU HB3 H 1 1.520 0.02 . 2 . . . . . . . . 5324 1 506 . 1 1 57 57 LEU HG H 1 1.229 0.02 . 1 . . . . . . . . 5324 1 507 . 1 1 57 57 LEU HD11 H 1 0.753 0.02 . 2 . . . . . . . . 5324 1 508 . 1 1 57 57 LEU HD12 H 1 0.753 0.02 . 2 . . . . . . . . 5324 1 509 . 1 1 57 57 LEU HD13 H 1 0.753 0.02 . 2 . . . . . . . . 5324 1 510 . 1 1 57 57 LEU HD21 H 1 0.687 0.02 . 2 . . . . . . . . 5324 1 511 . 1 1 57 57 LEU HD22 H 1 0.687 0.02 . 2 . . . . . . . . 5324 1 512 . 1 1 57 57 LEU HD23 H 1 0.687 0.02 . 2 . . . . . . . . 5324 1 513 . 1 1 57 57 LEU N N 15 120.551 0.05 . 1 . . . . . . . . 5324 1 514 . 1 1 58 58 LYS CA C 13 55.645 0.05 . 1 . . . . . . . . 5324 1 515 . 1 1 58 58 LYS CB C 13 27.975 0.05 . 1 . . . . . . . . 5324 1 516 . 1 1 58 58 LYS CG C 13 21.451 0.05 . 1 . . . . . . . . 5324 1 517 . 1 1 58 58 LYS CD C 13 25.734 0.05 . 1 . . . . . . . . 5324 1 518 . 1 1 58 58 LYS H H 1 7.400 0.02 . 1 . . . . . . . . 5324 1 519 . 1 1 58 58 LYS HA H 1 4.162 0.02 . 1 . . . . . . . . 5324 1 520 . 1 1 58 58 LYS HB2 H 1 1.912 0.02 . 2 . . . . . . . . 5324 1 521 . 1 1 58 58 LYS HB3 H 1 1.719 0.02 . 2 . . . . . . . . 5324 1 522 . 1 1 58 58 LYS HG2 H 1 1.501 0.02 . 1 . . . . . . . . 5324 1 523 . 1 1 58 58 LYS HG3 H 1 1.501 0.02 . 1 . . . . . . . . 5324 1 524 . 1 1 58 58 LYS HE2 H 1 2.920 0.02 . 1 . . . . . . . . 5324 1 525 . 1 1 58 58 LYS HE3 H 1 2.920 0.02 . 1 . . . . . . . . 5324 1 526 . 1 1 58 58 LYS N N 15 117.534 0.05 . 1 . . . . . . . . 5324 1 527 . 1 1 59 59 ARG CA C 13 55.577 0.05 . 1 . . . . . . . . 5324 1 528 . 1 1 59 59 ARG CB C 13 26.929 0.05 . 1 . . . . . . . . 5324 1 529 . 1 1 59 59 ARG CG C 13 24.257 0.05 . 1 . . . . . . . . 5324 1 530 . 1 1 59 59 ARG CD C 13 40.170 0.05 . 1 . . . . . . . . 5324 1 531 . 1 1 59 59 ARG H H 1 7.613 0.02 . 1 . . . . . . . . 5324 1 532 . 1 1 59 59 ARG HA H 1 4.146 0.02 . 1 . . . . . . . . 5324 1 533 . 1 1 59 59 ARG HB2 H 1 2.042 0.02 . 1 . . . . . . . . 5324 1 534 . 1 1 59 59 ARG HB3 H 1 2.042 0.02 . 1 . . . . . . . . 5324 1 535 . 1 1 59 59 ARG HG2 H 1 1.829 0.02 . 2 . . . . . . . . 5324 1 536 . 1 1 59 59 ARG HG3 H 1 1.669 0.02 . 2 . . . . . . . . 5324 1 537 . 1 1 59 59 ARG HD2 H 1 3.233 0.02 . 1 . . . . . . . . 5324 1 538 . 1 1 59 59 ARG HD3 H 1 3.233 0.02 . 1 . . . . . . . . 5324 1 539 . 1 1 59 59 ARG N N 15 118.921 0.05 . 1 . . . . . . . . 5324 1 540 . 1 1 60 60 VAL CA C 13 58.119 0.05 . 1 . . . . . . . . 5324 1 541 . 1 1 60 60 VAL CB C 13 27.554 0.05 . 1 . . . . . . . . 5324 1 542 . 1 1 60 60 VAL CG1 C 13 17.917 0.05 . 1 . . . . . . . . 5324 1 543 . 1 1 60 60 VAL CG2 C 13 16.380 0.05 . 1 . . . . . . . . 5324 1 544 . 1 1 60 60 VAL H H 1 7.511 0.02 . 1 . . . . . . . . 5324 1 545 . 1 1 60 60 VAL HA H 1 4.430 0.02 . 1 . . . . . . . . 5324 1 546 . 1 1 60 60 VAL HB H 1 2.524 0.02 . 1 . . . . . . . . 5324 1 547 . 1 1 60 60 VAL HG11 H 1 1.059 0.02 . 2 . . . . . . . . 5324 1 548 . 1 1 60 60 VAL HG12 H 1 1.059 0.02 . 2 . . . . . . . . 5324 1 549 . 1 1 60 60 VAL HG13 H 1 1.059 0.02 . 2 . . . . . . . . 5324 1 550 . 1 1 60 60 VAL HG21 H 1 0.985 0.02 . 2 . . . . . . . . 5324 1 551 . 1 1 60 60 VAL HG22 H 1 0.985 0.02 . 2 . . . . . . . . 5324 1 552 . 1 1 60 60 VAL HG23 H 1 0.985 0.02 . 2 . . . . . . . . 5324 1 553 . 1 1 60 60 VAL N N 15 110.406 0.05 . 1 . . . . . . . . 5324 1 554 . 1 1 61 61 GLY CA C 13 42.641 0.05 . 1 . . . . . . . . 5324 1 555 . 1 1 61 61 GLY H H 1 7.590 0.02 . 1 . . . . . . . . 5324 1 556 . 1 1 61 61 GLY HA2 H 1 4.127 0.02 . 2 . . . . . . . . 5324 1 557 . 1 1 61 61 GLY HA3 H 1 3.753 0.02 . 2 . . . . . . . . 5324 1 558 . 1 1 61 61 GLY N N 15 108.244 0.05 . 1 . . . . . . . . 5324 1 559 . 1 1 62 62 ALA CA C 13 48.469 0.05 . 1 . . . . . . . . 5324 1 560 . 1 1 62 62 ALA CB C 13 15.768 0.05 . 1 . . . . . . . . 5324 1 561 . 1 1 62 62 ALA H H 1 7.785 0.02 . 1 . . . . . . . . 5324 1 562 . 1 1 62 62 ALA HA H 1 4.387 0.02 . 1 . . . . . . . . 5324 1 563 . 1 1 62 62 ALA HB1 H 1 1.220 0.02 . 1 . . . . . . . . 5324 1 564 . 1 1 62 62 ALA HB2 H 1 1.220 0.02 . 1 . . . . . . . . 5324 1 565 . 1 1 62 62 ALA HB3 H 1 1.220 0.02 . 1 . . . . . . . . 5324 1 566 . 1 1 62 62 ALA N N 15 122.662 0.05 . 1 . . . . . . . . 5324 1 567 . 1 1 63 63 ASN CA C 13 49.213 0.05 . 1 . . . . . . . . 5324 1 568 . 1 1 63 63 ASN CB C 13 34.809 0.05 . 1 . . . . . . . . 5324 1 569 . 1 1 63 63 ASN H H 1 8.661 0.02 . 1 . . . . . . . . 5324 1 570 . 1 1 63 63 ASN HA H 1 4.755 0.02 . 1 . . . . . . . . 5324 1 571 . 1 1 63 63 ASN HB2 H 1 2.855 0.02 . 2 . . . . . . . . 5324 1 572 . 1 1 63 63 ASN HB3 H 1 2.646 0.02 . 2 . . . . . . . . 5324 1 573 . 1 1 63 63 ASN HD21 H 1 7.490 0.02 . 1 . . . . . . . . 5324 1 574 . 1 1 63 63 ASN N N 15 120.853 0.05 . 1 . . . . . . . . 5324 1 575 . 1 1 63 63 ASN ND2 N 15 112.460 0.05 . 1 . . . . . . . . 5324 1 576 . 1 1 64 64 LEU CA C 13 51.119 0.05 . 1 . . . . . . . . 5324 1 577 . 1 1 64 64 LEU CB C 13 40.459 0.05 . 1 . . . . . . . . 5324 1 578 . 1 1 64 64 LEU CG C 13 24.785 0.05 . 1 . . . . . . . . 5324 1 579 . 1 1 64 64 LEU CD1 C 13 22.559 0.05 . 1 . . . . . . . . 5324 1 580 . 1 1 64 64 LEU CD2 C 13 20.416 0.05 . 1 . . . . . . . . 5324 1 581 . 1 1 64 64 LEU H H 1 7.667 0.02 . 1 . . . . . . . . 5324 1 582 . 1 1 64 64 LEU HA H 1 4.540 0.02 . 1 . . . . . . . . 5324 1 583 . 1 1 64 64 LEU HB2 H 1 1.360 0.02 . 1 . . . . . . . . 5324 1 584 . 1 1 64 64 LEU HB3 H 1 1.360 0.02 . 1 . . . . . . . . 5324 1 585 . 1 1 64 64 LEU HD11 H 1 0.741 0.02 . 2 . . . . . . . . 5324 1 586 . 1 1 64 64 LEU HD12 H 1 0.741 0.02 . 2 . . . . . . . . 5324 1 587 . 1 1 64 64 LEU HD13 H 1 0.741 0.02 . 2 . . . . . . . . 5324 1 588 . 1 1 64 64 LEU HD21 H 1 1.586 0.02 . 2 . . . . . . . . 5324 1 589 . 1 1 64 64 LEU HD22 H 1 1.586 0.02 . 2 . . . . . . . . 5324 1 590 . 1 1 64 64 LEU HD23 H 1 1.586 0.02 . 2 . . . . . . . . 5324 1 591 . 1 1 64 64 LEU N N 15 121.962 0.05 . 1 . . . . . . . . 5324 1 592 . 1 1 65 65 LYS CA C 13 52.270 0.05 . 1 . . . . . . . . 5324 1 593 . 1 1 65 65 LYS CB C 13 29.699 0.05 . 1 . . . . . . . . 5324 1 594 . 1 1 65 65 LYS H H 1 9.115 0.02 . 1 . . . . . . . . 5324 1 595 . 1 1 65 65 LYS HA H 1 4.398 0.02 . 1 . . . . . . . . 5324 1 596 . 1 1 65 65 LYS HB2 H 1 1.676 0.02 . 1 . . . . . . . . 5324 1 597 . 1 1 65 65 LYS HB3 H 1 1.676 0.02 . 1 . . . . . . . . 5324 1 598 . 1 1 65 65 LYS HG2 H 1 2.121 0.02 . 1 . . . . . . . . 5324 1 599 . 1 1 65 65 LYS HG3 H 1 2.121 0.02 . 1 . . . . . . . . 5324 1 600 . 1 1 65 65 LYS HE2 H 1 2.519 0.02 . 1 . . . . . . . . 5324 1 601 . 1 1 65 65 LYS HE3 H 1 2.519 0.02 . 1 . . . . . . . . 5324 1 602 . 1 1 65 65 LYS N N 15 121.327 0.05 . 1 . . . . . . . . 5324 1 603 . 1 1 66 66 GLU CA C 13 58.124 0.05 . 1 . . . . . . . . 5324 1 604 . 1 1 66 66 GLU CB C 13 25.837 0.05 . 1 . . . . . . . . 5324 1 605 . 1 1 66 66 GLU CG C 13 33.801 0.05 . 1 . . . . . . . . 5324 1 606 . 1 1 66 66 GLU H H 1 9.014 0.02 . 1 . . . . . . . . 5324 1 607 . 1 1 66 66 GLU HA H 1 3.868 0.02 . 1 . . . . . . . . 5324 1 608 . 1 1 66 66 GLU HB2 H 1 2.175 0.02 . 2 . . . . . . . . 5324 1 609 . 1 1 66 66 GLU HB3 H 1 2.361 0.02 . 2 . . . . . . . . 5324 1 610 . 1 1 66 66 GLU HG2 H 1 2.377 0.02 . 1 . . . . . . . . 5324 1 611 . 1 1 66 66 GLU HG3 H 1 2.377 0.02 . 1 . . . . . . . . 5324 1 612 . 1 1 66 66 GLU N N 15 123.152 0.05 . 1 . . . . . . . . 5324 1 613 . 1 1 67 67 SER CA C 13 58.161 0.05 . 1 . . . . . . . . 5324 1 614 . 1 1 67 67 SER H H 1 8.560 0.02 . 1 . . . . . . . . 5324 1 615 . 1 1 67 67 SER HA H 1 4.605 0.02 . 1 . . . . . . . . 5324 1 616 . 1 1 67 67 SER HB2 H 1 4.094 0.02 . 1 . . . . . . . . 5324 1 617 . 1 1 67 67 SER HB3 H 1 4.094 0.02 . 1 . . . . . . . . 5324 1 618 . 1 1 67 67 SER N N 15 111.693 0.05 . 1 . . . . . . . . 5324 1 619 . 1 1 68 68 GLU CA C 13 55.017 0.05 . 1 . . . . . . . . 5324 1 620 . 1 1 68 68 GLU CB C 13 26.532 0.05 . 1 . . . . . . . . 5324 1 621 . 1 1 68 68 GLU CG C 13 34.206 0.05 . 1 . . . . . . . . 5324 1 622 . 1 1 68 68 GLU H H 1 6.987 0.02 . 1 . . . . . . . . 5324 1 623 . 1 1 68 68 GLU HA H 1 4.285 0.02 . 1 . . . . . . . . 5324 1 624 . 1 1 68 68 GLU HB2 H 1 2.610 0.02 . 1 . . . . . . . . 5324 1 625 . 1 1 68 68 GLU HB3 H 1 2.610 0.02 . 1 . . . . . . . . 5324 1 626 . 1 1 68 68 GLU HG2 H 1 2.369 0.02 . 1 . . . . . . . . 5324 1 627 . 1 1 68 68 GLU HG3 H 1 2.369 0.02 . 1 . . . . . . . . 5324 1 628 . 1 1 68 68 GLU N N 15 122.030 0.05 . 1 . . . . . . . . 5324 1 629 . 1 1 69 69 ILE CA C 13 62.261 0.05 . 1 . . . . . . . . 5324 1 630 . 1 1 69 69 ILE CB C 13 33.431 0.05 . 1 . . . . . . . . 5324 1 631 . 1 1 69 69 ILE CG1 C 13 26.296 0.05 . 1 . . . . . . . . 5324 1 632 . 1 1 69 69 ILE CG2 C 13 14.915 0.05 . 1 . . . . . . . . 5324 1 633 . 1 1 69 69 ILE CD1 C 13 10.417 0.05 . 1 . . . . . . . . 5324 1 634 . 1 1 69 69 ILE H H 1 8.028 0.02 . 1 . . . . . . . . 5324 1 635 . 1 1 69 69 ILE HA H 1 3.554 0.02 . 1 . . . . . . . . 5324 1 636 . 1 1 69 69 ILE HB H 1 2.056 0.02 . 1 . . . . . . . . 5324 1 637 . 1 1 69 69 ILE HG12 H 1 1.835 0.02 . 1 . . . . . . . . 5324 1 638 . 1 1 69 69 ILE HG13 H 1 1.835 0.02 . 1 . . . . . . . . 5324 1 639 . 1 1 69 69 ILE HG21 H 1 0.776 0.02 . 1 . . . . . . . . 5324 1 640 . 1 1 69 69 ILE HG22 H 1 0.776 0.02 . 1 . . . . . . . . 5324 1 641 . 1 1 69 69 ILE HG23 H 1 0.776 0.02 . 1 . . . . . . . . 5324 1 642 . 1 1 69 69 ILE HD11 H 1 0.766 0.02 . 1 . . . . . . . . 5324 1 643 . 1 1 69 69 ILE HD12 H 1 0.766 0.02 . 1 . . . . . . . . 5324 1 644 . 1 1 69 69 ILE HD13 H 1 0.766 0.02 . 1 . . . . . . . . 5324 1 645 . 1 1 69 69 ILE N N 15 121.324 0.05 . 1 . . . . . . . . 5324 1 646 . 1 1 70 70 LEU CA C 13 55.125 0.05 . 1 . . . . . . . . 5324 1 647 . 1 1 70 70 LEU CB C 13 37.847 0.05 . 1 . . . . . . . . 5324 1 648 . 1 1 70 70 LEU CD1 C 13 20.781 0.05 . 1 . . . . . . . . 5324 1 649 . 1 1 70 70 LEU CD2 C 13 23.760 0.05 . 1 . . . . . . . . 5324 1 650 . 1 1 70 70 LEU H H 1 8.107 0.02 . 1 . . . . . . . . 5324 1 651 . 1 1 70 70 LEU HA H 1 4.050 0.02 . 1 . . . . . . . . 5324 1 652 . 1 1 70 70 LEU HB2 H 1 1.692 0.02 . 1 . . . . . . . . 5324 1 653 . 1 1 70 70 LEU HB3 H 1 1.692 0.02 . 1 . . . . . . . . 5324 1 654 . 1 1 70 70 LEU HG H 1 1.576 0.02 . 1 . . . . . . . . 5324 1 655 . 1 1 70 70 LEU HD11 H 1 0.658 0.02 . 1 . . . . . . . . 5324 1 656 . 1 1 70 70 LEU HD12 H 1 0.658 0.02 . 1 . . . . . . . . 5324 1 657 . 1 1 70 70 LEU HD13 H 1 0.658 0.02 . 1 . . . . . . . . 5324 1 658 . 1 1 70 70 LEU HD21 H 1 0.658 0.02 . 1 . . . . . . . . 5324 1 659 . 1 1 70 70 LEU HD22 H 1 0.658 0.02 . 1 . . . . . . . . 5324 1 660 . 1 1 70 70 LEU HD23 H 1 0.658 0.02 . 1 . . . . . . . . 5324 1 661 . 1 1 70 70 LEU N N 15 121.034 0.05 . 1 . . . . . . . . 5324 1 662 . 1 1 71 71 ASP CA C 13 54.326 0.05 . 1 . . . . . . . . 5324 1 663 . 1 1 71 71 ASP CB C 13 37.420 0.05 . 1 . . . . . . . . 5324 1 664 . 1 1 71 71 ASP H H 1 7.684 0.02 . 1 . . . . . . . . 5324 1 665 . 1 1 71 71 ASP HB2 H 1 2.809 0.02 . 2 . . . . . . . . 5324 1 666 . 1 1 71 71 ASP HB3 H 1 2.681 0.02 . 2 . . . . . . . . 5324 1 667 . 1 1 71 71 ASP N N 15 118.947 0.05 . 1 . . . . . . . . 5324 1 668 . 1 1 72 72 LEU CA C 13 54.695 0.05 . 1 . . . . . . . . 5324 1 669 . 1 1 72 72 LEU CB C 13 37.770 0.05 . 1 . . . . . . . . 5324 1 670 . 1 1 72 72 LEU CG C 13 23.641 0.05 . 1 . . . . . . . . 5324 1 671 . 1 1 72 72 LEU CD1 C 13 22.373 0.05 . 1 . . . . . . . . 5324 1 672 . 1 1 72 72 LEU CD2 C 13 20.715 0.05 . 1 . . . . . . . . 5324 1 673 . 1 1 72 72 LEU H H 1 7.910 0.02 . 1 . . . . . . . . 5324 1 674 . 1 1 72 72 LEU HA H 1 3.799 0.02 . 1 . . . . . . . . 5324 1 675 . 1 1 72 72 LEU HB2 H 1 1.901 0.02 . 2 . . . . . . . . 5324 1 676 . 1 1 72 72 LEU HB3 H 1 1.496 0.02 . 2 . . . . . . . . 5324 1 677 . 1 1 72 72 LEU HG H 1 1.163 0.02 . 1 . . . . . . . . 5324 1 678 . 1 1 72 72 LEU HD11 H 1 0.732 0.02 . 2 . . . . . . . . 5324 1 679 . 1 1 72 72 LEU HD12 H 1 0.732 0.02 . 2 . . . . . . . . 5324 1 680 . 1 1 72 72 LEU HD13 H 1 0.732 0.02 . 2 . . . . . . . . 5324 1 681 . 1 1 72 72 LEU HD21 H 1 0.856 0.02 . 2 . . . . . . . . 5324 1 682 . 1 1 72 72 LEU HD22 H 1 0.856 0.02 . 2 . . . . . . . . 5324 1 683 . 1 1 72 72 LEU HD23 H 1 0.856 0.02 . 2 . . . . . . . . 5324 1 684 . 1 1 72 72 LEU N N 15 121.602 0.05 . 1 . . . . . . . . 5324 1 685 . 1 1 73 73 MET CA C 13 55.532 0.05 . 1 . . . . . . . . 5324 1 686 . 1 1 73 73 MET CB C 13 28.109 0.05 . 1 . . . . . . . . 5324 1 687 . 1 1 73 73 MET H H 1 8.348 0.02 . 1 . . . . . . . . 5324 1 688 . 1 1 73 73 MET HA H 1 3.909 0.02 . 1 . . . . . . . . 5324 1 689 . 1 1 73 73 MET HB2 H 1 2.605 0.02 . 2 . . . . . . . . 5324 1 690 . 1 1 73 73 MET HB3 H 1 2.530 0.02 . 2 . . . . . . . . 5324 1 691 . 1 1 73 73 MET N N 15 117.676 0.05 . 1 . . . . . . . . 5324 1 692 . 1 1 74 74 GLN CA C 13 55.190 0.05 . 1 . . . . . . . . 5324 1 693 . 1 1 74 74 GLN CB C 13 24.840 0.05 . 1 . . . . . . . . 5324 1 694 . 1 1 74 74 GLN CG C 13 31.007 0.05 . 1 . . . . . . . . 5324 1 695 . 1 1 74 74 GLN H H 1 8.121 0.02 . 1 . . . . . . . . 5324 1 696 . 1 1 74 74 GLN HA H 1 4.035 0.02 . 1 . . . . . . . . 5324 1 697 . 1 1 74 74 GLN HB2 H 1 2.167 0.02 . 2 . . . . . . . . 5324 1 698 . 1 1 74 74 GLN HB3 H 1 2.059 0.02 . 2 . . . . . . . . 5324 1 699 . 1 1 74 74 GLN HG2 H 1 2.533 0.02 . 2 . . . . . . . . 5324 1 700 . 1 1 74 74 GLN HG3 H 1 2.353 0.02 . 2 . . . . . . . . 5324 1 701 . 1 1 74 74 GLN HE21 H 1 7.268 0.02 . 1 . . . . . . . . 5324 1 702 . 1 1 74 74 GLN HE22 H 1 6.729 0.02 . 1 . . . . . . . . 5324 1 703 . 1 1 74 74 GLN N N 15 115.088 0.05 . 1 . . . . . . . . 5324 1 704 . 1 1 74 74 GLN NE2 N 15 110.873 0.05 . 1 . . . . . . . . 5324 1 705 . 1 1 75 75 ALA H H 1 7.871 0.02 . 1 . . . . . . . . 5324 1 706 . 1 1 75 75 ALA HA H 1 3.961 0.02 . 1 . . . . . . . . 5324 1 707 . 1 1 75 75 ALA HB1 H 1 1.202 0.02 . 1 . . . . . . . . 5324 1 708 . 1 1 75 75 ALA HB2 H 1 1.202 0.02 . 1 . . . . . . . . 5324 1 709 . 1 1 75 75 ALA HB3 H 1 1.202 0.02 . 1 . . . . . . . . 5324 1 710 . 1 1 75 75 ALA N N 15 119.508 0.05 . 1 . . . . . . . . 5324 1 711 . 1 1 76 76 ALA CA C 13 49.152 0.05 . 1 . . . . . . . . 5324 1 712 . 1 1 76 76 ALA CB C 13 16.225 0.05 . 1 . . . . . . . . 5324 1 713 . 1 1 76 76 ALA H H 1 7.848 0.02 . 1 . . . . . . . . 5324 1 714 . 1 1 76 76 ALA HA H 1 4.280 0.02 . 1 . . . . . . . . 5324 1 715 . 1 1 76 76 ALA HB1 H 1 1.307 0.02 . 1 . . . . . . . . 5324 1 716 . 1 1 76 76 ALA HB2 H 1 1.307 0.02 . 1 . . . . . . . . 5324 1 717 . 1 1 76 76 ALA HB3 H 1 1.307 0.02 . 1 . . . . . . . . 5324 1 718 . 1 1 76 76 ALA N N 15 116.640 0.05 . 1 . . . . . . . . 5324 1 719 . 1 1 77 77 ASP CA C 13 49.688 0.05 . 1 . . . . . . . . 5324 1 720 . 1 1 77 77 ASP CB C 13 35.626 0.05 . 1 . . . . . . . . 5324 1 721 . 1 1 77 77 ASP H H 1 7.793 0.02 . 1 . . . . . . . . 5324 1 722 . 1 1 77 77 ASP HA H 1 4.780 0.02 . 1 . . . . . . . . 5324 1 723 . 1 1 77 77 ASP HB2 H 1 3.041 0.02 . 2 . . . . . . . . 5324 1 724 . 1 1 77 77 ASP HB3 H 1 2.487 0.02 . 2 . . . . . . . . 5324 1 725 . 1 1 77 77 ASP N N 15 117.108 0.05 . 1 . . . . . . . . 5324 1 726 . 1 1 78 78 VAL CA C 13 60.979 0.05 . 1 . . . . . . . . 5324 1 727 . 1 1 78 78 VAL CB C 13 28.190 0.05 . 1 . . . . . . . . 5324 1 728 . 1 1 78 78 VAL CG1 C 13 17.368 0.05 . 1 . . . . . . . . 5324 1 729 . 1 1 78 78 VAL CG2 C 13 18.516 0.05 . 1 . . . . . . . . 5324 1 730 . 1 1 78 78 VAL H H 1 8.098 0.02 . 1 . . . . . . . . 5324 1 731 . 1 1 78 78 VAL HA H 1 3.954 0.02 . 1 . . . . . . . . 5324 1 732 . 1 1 78 78 VAL HB H 1 2.320 0.02 . 1 . . . . . . . . 5324 1 733 . 1 1 78 78 VAL HG11 H 1 1.060 0.02 . 2 . . . . . . . . 5324 1 734 . 1 1 78 78 VAL HG12 H 1 1.060 0.02 . 2 . . . . . . . . 5324 1 735 . 1 1 78 78 VAL HG13 H 1 1.060 0.02 . 2 . . . . . . . . 5324 1 736 . 1 1 78 78 VAL HG21 H 1 1.119 0.02 . 2 . . . . . . . . 5324 1 737 . 1 1 78 78 VAL HG22 H 1 1.119 0.02 . 2 . . . . . . . . 5324 1 738 . 1 1 78 78 VAL HG23 H 1 1.119 0.02 . 2 . . . . . . . . 5324 1 739 . 1 1 78 78 VAL N N 15 123.157 0.05 . 1 . . . . . . . . 5324 1 740 . 1 1 79 79 ASP CA C 13 49.070 0.05 . 1 . . . . . . . . 5324 1 741 . 1 1 79 79 ASP CB C 13 36.420 0.05 . 1 . . . . . . . . 5324 1 742 . 1 1 79 79 ASP H H 1 7.894 0.02 . 1 . . . . . . . . 5324 1 743 . 1 1 79 79 ASP HA H 1 4.694 0.02 . 1 . . . . . . . . 5324 1 744 . 1 1 79 79 ASP HB2 H 1 3.115 0.02 . 2 . . . . . . . . 5324 1 745 . 1 1 79 79 ASP HB3 H 1 2.583 0.02 . 2 . . . . . . . . 5324 1 746 . 1 1 79 79 ASP N N 15 116.297 0.05 . 1 . . . . . . . . 5324 1 747 . 1 1 80 80 ASN CA C 13 51.568 0.05 . 1 . . . . . . . . 5324 1 748 . 1 1 80 80 ASN CB C 13 34.049 0.05 . 1 . . . . . . . . 5324 1 749 . 1 1 80 80 ASN H H 1 7.902 0.02 . 1 . . . . . . . . 5324 1 750 . 1 1 80 80 ASN HA H 1 4.339 0.02 . 1 . . . . . . . . 5324 1 751 . 1 1 80 80 ASN HB2 H 1 3.036 0.02 . 2 . . . . . . . . 5324 1 752 . 1 1 80 80 ASN HB3 H 1 2.689 0.02 . 2 . . . . . . . . 5324 1 753 . 1 1 80 80 ASN HD21 H 1 7.413 0.02 . 1 . . . . . . . . 5324 1 754 . 1 1 80 80 ASN HD22 H 1 6.676 0.02 . 1 . . . . . . . . 5324 1 755 . 1 1 80 80 ASN N N 15 115.315 0.05 . 1 . . . . . . . . 5324 1 756 . 1 1 80 80 ASN ND2 N 15 111.903 0.05 . 1 . . . . . . . . 5324 1 757 . 1 1 81 81 SER CA C 13 56.601 0.05 . 1 . . . . . . . . 5324 1 758 . 1 1 81 81 SER CB C 13 62.076 0.05 . 1 . . . . . . . . 5324 1 759 . 1 1 81 81 SER H H 1 8.888 0.02 . 1 . . . . . . . . 5324 1 760 . 1 1 81 81 SER HA H 1 4.312 0.02 . 1 . . . . . . . . 5324 1 761 . 1 1 81 81 SER HB2 H 1 4.025 0.02 . 1 . . . . . . . . 5324 1 762 . 1 1 81 81 SER HB3 H 1 4.025 0.02 . 1 . . . . . . . . 5324 1 763 . 1 1 81 81 SER N N 15 114.557 0.05 . 1 . . . . . . . . 5324 1 764 . 1 1 82 82 GLY H H 1 10.774 0.02 . 1 . . . . . . . . 5324 1 765 . 1 1 82 82 GLY HA2 H 1 4.271 0.02 . 2 . . . . . . . . 5324 1 766 . 1 1 82 82 GLY HA3 H 1 3.576 0.02 . 2 . . . . . . . . 5324 1 767 . 1 1 82 82 GLY N N 15 116.652 0.05 . 1 . . . . . . . . 5324 1 768 . 1 1 83 83 THR CA C 13 55.174 0.05 . 1 . . . . . . . . 5324 1 769 . 1 1 83 83 THR CB C 13 70.446 0.05 . 1 . . . . . . . . 5324 1 770 . 1 1 83 83 THR CG2 C 13 19.075 0.05 . 1 . . . . . . . . 5324 1 771 . 1 1 83 83 THR H H 1 7.606 0.02 . 1 . . . . . . . . 5324 1 772 . 1 1 83 83 THR HA H 1 4.843 0.02 . 1 . . . . . . . . 5324 1 773 . 1 1 83 83 THR HB H 1 3.938 0.02 . 1 . . . . . . . . 5324 1 774 . 1 1 83 83 THR HG21 H 1 1.011 0.02 . 1 . . . . . . . . 5324 1 775 . 1 1 83 83 THR HG22 H 1 1.011 0.02 . 1 . . . . . . . . 5324 1 776 . 1 1 83 83 THR HG23 H 1 1.011 0.02 . 1 . . . . . . . . 5324 1 777 . 1 1 83 83 THR N N 15 106.437 0.05 . 1 . . . . . . . . 5324 1 778 . 1 1 84 84 ILE CA C 13 55.255 0.05 . 1 . . . . . . . . 5324 1 779 . 1 1 84 84 ILE CB C 13 35.509 0.05 . 1 . . . . . . . . 5324 1 780 . 1 1 84 84 ILE CG1 C 13 24.190 0.05 . 1 . . . . . . . . 5324 1 781 . 1 1 84 84 ILE CG2 C 13 14.500 0.05 . 1 . . . . . . . . 5324 1 782 . 1 1 84 84 ILE CD1 C 13 9.603 0.05 . 1 . . . . . . . . 5324 1 783 . 1 1 84 84 ILE H H 1 9.616 0.02 . 1 . . . . . . . . 5324 1 784 . 1 1 84 84 ILE HA H 1 5.316 0.02 . 1 . . . . . . . . 5324 1 785 . 1 1 84 84 ILE HB H 1 1.980 0.02 . 1 . . . . . . . . 5324 1 786 . 1 1 84 84 ILE HG12 H 1 1.180 0.02 . 2 . . . . . . . . 5324 1 787 . 1 1 84 84 ILE HG13 H 1 1.500 0.02 . 2 . . . . . . . . 5324 1 788 . 1 1 84 84 ILE HD11 H 1 0.850 0.02 . 1 . . . . . . . . 5324 1 789 . 1 1 84 84 ILE HD12 H 1 0.850 0.02 . 1 . . . . . . . . 5324 1 790 . 1 1 84 84 ILE HD13 H 1 0.850 0.02 . 1 . . . . . . . . 5324 1 791 . 1 1 84 84 ILE N N 15 125.688 0.05 . 1 . . . . . . . . 5324 1 792 . 1 1 85 85 ASP CA C 13 49.145 0.05 . 1 . . . . . . . . 5324 1 793 . 1 1 85 85 ASP CB C 13 37.863 0.05 . 1 . . . . . . . . 5324 1 794 . 1 1 85 85 ASP H H 1 8.912 0.02 . 1 . . . . . . . . 5324 1 795 . 1 1 85 85 ASP HA H 1 5.260 0.02 . 1 . . . . . . . . 5324 1 796 . 1 1 85 85 ASP HB2 H 1 2.723 0.02 . 2 . . . . . . . . 5324 1 797 . 1 1 85 85 ASP HB3 H 1 3.327 0.02 . 2 . . . . . . . . 5324 1 798 . 1 1 85 85 ASP N N 15 129.139 0.05 . 1 . . . . . . . . 5324 1 799 . 1 1 86 86 TYR CA C 13 58.496 0.05 . 1 . . . . . . . . 5324 1 800 . 1 1 86 86 TYR CB C 13 34.058 0.05 . 1 . . . . . . . . 5324 1 801 . 1 1 86 86 TYR CD1 C 13 130.426 0.05 . 1 . . . . . . . . 5324 1 802 . 1 1 86 86 TYR CE1 C 13 115.500 0.05 . 1 . . . . . . . . 5324 1 803 . 1 1 86 86 TYR CE2 C 13 115.500 0.05 . 1 . . . . . . . . 5324 1 804 . 1 1 86 86 TYR CD2 C 13 130.426 0.05 . 1 . . . . . . . . 5324 1 805 . 1 1 86 86 TYR H H 1 8.411 0.02 . 1 . . . . . . . . 5324 1 806 . 1 1 86 86 TYR HA H 1 3.561 0.02 . 1 . . . . . . . . 5324 1 807 . 1 1 86 86 TYR HB2 H 1 2.434 0.02 . 2 . . . . . . . . 5324 1 808 . 1 1 86 86 TYR HB3 H 1 2.156 0.02 . 2 . . . . . . . . 5324 1 809 . 1 1 86 86 TYR HD1 H 1 6.550 0.02 . 1 . . . . . . . . 5324 1 810 . 1 1 86 86 TYR HE1 H 1 6.601 0.02 . 1 . . . . . . . . 5324 1 811 . 1 1 86 86 TYR HE2 H 1 6.601 0.02 . 1 . . . . . . . . 5324 1 812 . 1 1 86 86 TYR HD2 H 1 6.550 0.02 . 1 . . . . . . . . 5324 1 813 . 1 1 86 86 TYR N N 15 118.004 0.05 . 1 . . . . . . . . 5324 1 814 . 1 1 87 87 LYS CA C 13 56.160 0.05 . 1 . . . . . . . . 5324 1 815 . 1 1 87 87 LYS CB C 13 27.587 0.05 . 1 . . . . . . . . 5324 1 816 . 1 1 87 87 LYS CG C 13 22.063 0.05 . 1 . . . . . . . . 5324 1 817 . 1 1 87 87 LYS CD C 13 25.693 0.05 . 1 . . . . . . . . 5324 1 818 . 1 1 87 87 LYS CE C 13 38.560 0.05 . 1 . . . . . . . . 5324 1 819 . 1 1 87 87 LYS H H 1 7.684 0.02 . 1 . . . . . . . . 5324 1 820 . 1 1 87 87 LYS HA H 1 3.656 0.02 . 1 . . . . . . . . 5324 1 821 . 1 1 87 87 LYS HB2 H 1 1.901 0.02 . 2 . . . . . . . . 5324 1 822 . 1 1 87 87 LYS HB3 H 1 1.676 0.02 . 2 . . . . . . . . 5324 1 823 . 1 1 87 87 LYS HG2 H 1 1.352 0.02 . 1 . . . . . . . . 5324 1 824 . 1 1 87 87 LYS HG3 H 1 1.352 0.02 . 1 . . . . . . . . 5324 1 825 . 1 1 87 87 LYS HD2 H 1 1.514 0.02 . 1 . . . . . . . . 5324 1 826 . 1 1 87 87 LYS HD3 H 1 1.514 0.02 . 1 . . . . . . . . 5324 1 827 . 1 1 87 87 LYS N N 15 117.239 0.05 . 1 . . . . . . . . 5324 1 828 . 1 1 88 88 GLU CA C 13 54.972 0.05 . 1 . . . . . . . . 5324 1 829 . 1 1 88 88 GLU CB C 13 26.997 0.05 . 1 . . . . . . . . 5324 1 830 . 1 1 88 88 GLU CG C 13 33.599 0.05 . 1 . . . . . . . . 5324 1 831 . 1 1 88 88 GLU H H 1 8.482 0.02 . 1 . . . . . . . . 5324 1 832 . 1 1 88 88 GLU HA H 1 4.122 0.02 . 1 . . . . . . . . 5324 1 833 . 1 1 88 88 GLU HB2 H 1 2.460 0.02 . 2 . . . . . . . . 5324 1 834 . 1 1 88 88 GLU HB3 H 1 2.181 0.02 . 2 . . . . . . . . 5324 1 835 . 1 1 88 88 GLU HG2 H 1 2.964 0.02 . 1 . . . . . . . . 5324 1 836 . 1 1 88 88 GLU HG3 H 1 2.964 0.02 . 1 . . . . . . . . 5324 1 837 . 1 1 88 88 GLU N N 15 119.672 0.05 . 1 . . . . . . . . 5324 1 838 . 1 1 89 89 PHE CA C 13 58.133 0.05 . 1 . . . . . . . . 5324 1 839 . 1 1 89 89 PHE CB C 13 35.954 0.05 . 1 . . . . . . . . 5324 1 840 . 1 1 89 89 PHE H H 1 8.951 0.02 . 1 . . . . . . . . 5324 1 841 . 1 1 89 89 PHE HA H 1 3.939 0.02 . 1 . . . . . . . . 5324 1 842 . 1 1 89 89 PHE N N 15 121.300 0.05 . 1 . . . . . . . . 5324 1 843 . 1 1 90 90 ILE CA C 13 61.857 0.05 . 1 . . . . . . . . 5324 1 844 . 1 1 90 90 ILE CB C 13 33.825 0.05 . 1 . . . . . . . . 5324 1 845 . 1 1 90 90 ILE CG1 C 13 24.372 0.05 . 1 . . . . . . . . 5324 1 846 . 1 1 90 90 ILE CG2 C 13 14.161 0.05 . 1 . . . . . . . . 5324 1 847 . 1 1 90 90 ILE CD1 C 13 9.482 0.05 . 1 . . . . . . . . 5324 1 848 . 1 1 90 90 ILE HA H 1 3.352 0.02 . 1 . . . . . . . . 5324 1 849 . 1 1 90 90 ILE HB H 1 1.848 0.02 . 1 . . . . . . . . 5324 1 850 . 1 1 90 90 ILE HG21 H 1 0.699 0.02 . 1 . . . . . . . . 5324 1 851 . 1 1 90 90 ILE HG22 H 1 0.699 0.02 . 1 . . . . . . . . 5324 1 852 . 1 1 90 90 ILE HG23 H 1 0.699 0.02 . 1 . . . . . . . . 5324 1 853 . 1 1 91 91 ALA CA C 13 51.831 0.05 . 1 . . . . . . . . 5324 1 854 . 1 1 91 91 ALA CB C 13 14.370 0.05 . 1 . . . . . . . . 5324 1 855 . 1 1 91 91 ALA H H 1 7.137 0.02 . 1 . . . . . . . . 5324 1 856 . 1 1 91 91 ALA HA H 1 3.872 0.02 . 1 . . . . . . . . 5324 1 857 . 1 1 91 91 ALA N N 15 119.536 0.05 . 1 . . . . . . . . 5324 1 858 . 1 1 92 92 ALA CA C 13 51.238 0.05 . 1 . . . . . . . . 5324 1 859 . 1 1 92 92 ALA CB C 13 13.972 0.05 . 1 . . . . . . . . 5324 1 860 . 1 1 92 92 ALA H H 1 7.852 0.02 . 1 . . . . . . . . 5324 1 861 . 1 1 92 92 ALA HA H 1 3.965 0.02 . 1 . . . . . . . . 5324 1 862 . 1 1 92 92 ALA HB1 H 1 1.477 0.02 . 1 . . . . . . . . 5324 1 863 . 1 1 92 92 ALA HB2 H 1 1.477 0.02 . 1 . . . . . . . . 5324 1 864 . 1 1 92 92 ALA HB3 H 1 1.477 0.02 . 1 . . . . . . . . 5324 1 865 . 1 1 92 92 ALA N N 15 119.164 0.05 . 1 . . . . . . . . 5324 1 866 . 1 1 93 93 THR CA C 13 62.503 0.05 . 1 . . . . . . . . 5324 1 867 . 1 1 93 93 THR CB C 13 65.149 0.05 . 1 . . . . . . . . 5324 1 868 . 1 1 93 93 THR CG2 C 13 18.479 0.05 . 1 . . . . . . . . 5324 1 869 . 1 1 93 93 THR H H 1 7.824 0.02 . 1 . . . . . . . . 5324 1 870 . 1 1 93 93 THR HA H 1 3.713 0.02 . 1 . . . . . . . . 5324 1 871 . 1 1 93 93 THR HB H 1 3.942 0.02 . 1 . . . . . . . . 5324 1 872 . 1 1 93 93 THR HG21 H 1 0.710 0.02 . 1 . . . . . . . . 5324 1 873 . 1 1 93 93 THR HG22 H 1 0.710 0.02 . 1 . . . . . . . . 5324 1 874 . 1 1 93 93 THR HG23 H 1 0.710 0.02 . 1 . . . . . . . . 5324 1 875 . 1 1 93 93 THR N N 15 108.441 0.05 . 1 . . . . . . . . 5324 1 876 . 1 1 94 94 LEU CA C 13 53.658 0.05 . 1 . . . . . . . . 5324 1 877 . 1 1 94 94 LEU CB C 13 37.654 0.05 . 1 . . . . . . . . 5324 1 878 . 1 1 94 94 LEU H H 1 7.515 0.02 . 1 . . . . . . . . 5324 1 879 . 1 1 94 94 LEU HA H 1 4.089 0.02 . 1 . . . . . . . . 5324 1 880 . 1 1 94 94 LEU HB2 H 1 1.781 0.02 . 2 . . . . . . . . 5324 1 881 . 1 1 94 94 LEU HB3 H 1 1.358 0.02 . 2 . . . . . . . . 5324 1 882 . 1 1 94 94 LEU HG H 1 1.548 0.02 . 1 . . . . . . . . 5324 1 883 . 1 1 94 94 LEU HD11 H 1 0.736 0.02 . 1 . . . . . . . . 5324 1 884 . 1 1 94 94 LEU HD12 H 1 0.736 0.02 . 1 . . . . . . . . 5324 1 885 . 1 1 94 94 LEU HD13 H 1 0.736 0.02 . 1 . . . . . . . . 5324 1 886 . 1 1 94 94 LEU HD21 H 1 0.736 0.02 . 1 . . . . . . . . 5324 1 887 . 1 1 94 94 LEU HD22 H 1 0.736 0.02 . 1 . . . . . . . . 5324 1 888 . 1 1 94 94 LEU HD23 H 1 0.736 0.02 . 1 . . . . . . . . 5324 1 889 . 1 1 94 94 LEU N N 15 121.646 0.05 . 1 . . . . . . . . 5324 1 890 . 1 1 97 97 ASN CA C 13 52.320 0.05 . 1 . . . . . . . . 5324 1 891 . 1 1 97 97 ASN CB C 13 28.644 0.05 . 1 . . . . . . . . 5324 1 892 . 1 1 97 97 ASN HA H 1 4.384 0.02 . 1 . . . . . . . . 5324 1 893 . 1 1 97 97 ASN HB2 H 1 1.984 0.02 . 1 . . . . . . . . 5324 1 894 . 1 1 97 97 ASN HB3 H 1 1.984 0.02 . 1 . . . . . . . . 5324 1 895 . 1 1 98 98 LYS CA C 13 53.301 0.05 . 1 . . . . . . . . 5324 1 896 . 1 1 98 98 LYS CB C 13 28.879 0.05 . 1 . . . . . . . . 5324 1 897 . 1 1 98 98 LYS H H 1 8.259 0.02 . 1 . . . . . . . . 5324 1 898 . 1 1 98 98 LYS HA H 1 4.528 0.02 . 1 . . . . . . . . 5324 1 899 . 1 1 98 98 LYS HB2 H 1 3.708 0.02 . 2 . . . . . . . . 5324 1 900 . 1 1 98 98 LYS HB3 H 1 3.548 0.02 . 2 . . . . . . . . 5324 1 901 . 1 1 98 98 LYS HE2 H 1 3.396 0.02 . 1 . . . . . . . . 5324 1 902 . 1 1 98 98 LYS HE3 H 1 3.396 0.02 . 1 . . . . . . . . 5324 1 903 . 1 1 98 98 LYS N N 15 122.120 0.05 . 1 . . . . . . . . 5324 1 904 . 1 1 99 99 ILE CA C 13 57.697 0.05 . 1 . . . . . . . . 5324 1 905 . 1 1 99 99 ILE CB C 13 34.203 0.05 . 1 . . . . . . . . 5324 1 906 . 1 1 99 99 ILE CG1 C 13 23.628 0.05 . 1 . . . . . . . . 5324 1 907 . 1 1 99 99 ILE CG2 C 13 14.495 0.05 . 1 . . . . . . . . 5324 1 908 . 1 1 99 99 ILE HA H 1 4.143 0.02 . 1 . . . . . . . . 5324 1 909 . 1 1 99 99 ILE HB H 1 1.828 0.02 . 1 . . . . . . . . 5324 1 910 . 1 1 99 99 ILE HG12 H 1 0.889 0.02 . 2 . . . . . . . . 5324 1 911 . 1 1 99 99 ILE HG13 H 1 1.200 0.02 . 2 . . . . . . . . 5324 1 912 . 1 1 99 99 ILE HG21 H 1 1.399 0.02 . 1 . . . . . . . . 5324 1 913 . 1 1 99 99 ILE HG22 H 1 1.399 0.02 . 1 . . . . . . . . 5324 1 914 . 1 1 99 99 ILE HG23 H 1 1.399 0.02 . 1 . . . . . . . . 5324 1 915 . 1 1 99 99 ILE HD11 H 1 0.744 0.02 . 1 . . . . . . . . 5324 1 916 . 1 1 99 99 ILE HD12 H 1 0.744 0.02 . 1 . . . . . . . . 5324 1 917 . 1 1 99 99 ILE HD13 H 1 0.744 0.02 . 1 . . . . . . . . 5324 1 918 . 1 1 100 100 GLU CA C 13 53.316 0.05 . 1 . . . . . . . . 5324 1 919 . 1 1 100 100 GLU CB C 13 27.236 0.05 . 1 . . . . . . . . 5324 1 920 . 1 1 100 100 GLU H H 1 8.434 0.02 . 1 . . . . . . . . 5324 1 921 . 1 1 100 100 GLU HA H 1 4.146 0.02 . 1 . . . . . . . . 5324 1 922 . 1 1 100 100 GLU HB2 H 1 2.088 0.02 . 1 . . . . . . . . 5324 1 923 . 1 1 100 100 GLU HB3 H 1 2.088 0.02 . 1 . . . . . . . . 5324 1 924 . 1 1 100 100 GLU N N 15 123.443 0.05 . 1 . . . . . . . . 5324 1 925 . 1 1 102 102 GLU CA C 13 52.866 0.05 . 1 . . . . . . . . 5324 1 926 . 1 1 102 102 GLU CB C 13 25.762 0.05 . 1 . . . . . . . . 5324 1 927 . 1 1 102 102 GLU CG C 13 30.144 0.05 . 1 . . . . . . . . 5324 1 928 . 1 1 102 102 GLU HA H 1 4.171 0.02 . 1 . . . . . . . . 5324 1 929 . 1 1 102 102 GLU HB2 H 1 2.103 0.02 . 1 . . . . . . . . 5324 1 930 . 1 1 102 102 GLU HB3 H 1 2.103 0.02 . 1 . . . . . . . . 5324 1 931 . 1 1 103 103 ASP CA C 13 54.208 0.05 . 1 . . . . . . . . 5324 1 932 . 1 1 103 103 ASP CB C 13 35.480 0.05 . 1 . . . . . . . . 5324 1 933 . 1 1 103 103 ASP H H 1 8.262 0.02 . 1 . . . . . . . . 5324 1 934 . 1 1 103 103 ASP HB2 H 1 2.925 0.02 . 2 . . . . . . . . 5324 1 935 . 1 1 103 103 ASP HB3 H 1 3.167 0.02 . 2 . . . . . . . . 5324 1 936 . 1 1 103 103 ASP N N 15 119.917 0.05 . 1 . . . . . . . . 5324 1 937 . 1 1 105 105 LEU CA C 13 55.301 0.05 . 1 . . . . . . . . 5324 1 938 . 1 1 105 105 LEU CB C 13 38.187 0.05 . 1 . . . . . . . . 5324 1 939 . 1 1 105 105 LEU CG C 13 22.463 0.05 . 1 . . . . . . . . 5324 1 940 . 1 1 105 105 LEU CD1 C 13 20.359 0.05 . 1 . . . . . . . . 5324 1 941 . 1 1 105 105 LEU CD2 C 13 20.359 0.05 . 1 . . . . . . . . 5324 1 942 . 1 1 105 105 LEU HA H 1 4.235 0.02 . 1 . . . . . . . . 5324 1 943 . 1 1 105 105 LEU HB2 H 1 2.407 0.02 . 2 . . . . . . . . 5324 1 944 . 1 1 105 105 LEU HB3 H 1 1.663 0.02 . 2 . . . . . . . . 5324 1 945 . 1 1 105 105 LEU HG H 1 1.806 0.02 . 1 . . . . . . . . 5324 1 946 . 1 1 105 105 LEU HD11 H 1 0.892 0.02 . 2 . . . . . . . . 5324 1 947 . 1 1 105 105 LEU HD12 H 1 0.892 0.02 . 2 . . . . . . . . 5324 1 948 . 1 1 105 105 LEU HD13 H 1 0.892 0.02 . 2 . . . . . . . . 5324 1 949 . 1 1 105 105 LEU HD21 H 1 0.830 0.02 . 2 . . . . . . . . 5324 1 950 . 1 1 105 105 LEU HD22 H 1 0.830 0.02 . 2 . . . . . . . . 5324 1 951 . 1 1 105 105 LEU HD23 H 1 0.830 0.02 . 2 . . . . . . . . 5324 1 952 . 1 1 106 106 PHE CA C 13 58.656 0.05 . 1 . . . . . . . . 5324 1 953 . 1 1 106 106 PHE CB C 13 35.071 0.05 . 1 . . . . . . . . 5324 1 954 . 1 1 106 106 PHE CD1 C 13 129.132 0.05 . 1 . . . . . . . . 5324 1 955 . 1 1 106 106 PHE CZ C 13 126.914 0.05 . 1 . . . . . . . . 5324 1 956 . 1 1 106 106 PHE CD2 C 13 129.132 0.05 . 1 . . . . . . . . 5324 1 957 . 1 1 106 106 PHE H H 1 8.841 0.02 . 1 . . . . . . . . 5324 1 958 . 1 1 106 106 PHE HA H 1 4.418 0.02 . 1 . . . . . . . . 5324 1 959 . 1 1 106 106 PHE HB2 H 1 3.259 0.02 . 2 . . . . . . . . 5324 1 960 . 1 1 106 106 PHE HB3 H 1 3.026 0.02 . 2 . . . . . . . . 5324 1 961 . 1 1 106 106 PHE HD1 H 1 6.920 0.02 . 1 . . . . . . . . 5324 1 962 . 1 1 106 106 PHE HE1 H 1 7.174 0.02 . 1 . . . . . . . . 5324 1 963 . 1 1 106 106 PHE HZ H 1 7.224 0.02 . 1 . . . . . . . . 5324 1 964 . 1 1 106 106 PHE HE2 H 1 7.174 0.02 . 1 . . . . . . . . 5324 1 965 . 1 1 106 106 PHE HD2 H 1 6.920 0.02 . 1 . . . . . . . . 5324 1 966 . 1 1 106 106 PHE N N 15 120.147 0.05 . 1 . . . . . . . . 5324 1 967 . 1 1 107 107 ALA CA C 13 51.852 0.05 . 1 . . . . . . . . 5324 1 968 . 1 1 107 107 ALA CB C 13 13.964 0.05 . 1 . . . . . . . . 5324 1 969 . 1 1 107 107 ALA H H 1 8.082 0.02 . 1 . . . . . . . . 5324 1 970 . 1 1 107 107 ALA HA H 1 3.940 0.02 . 1 . . . . . . . . 5324 1 971 . 1 1 107 107 ALA HB1 H 1 1.069 0.02 . 1 . . . . . . . . 5324 1 972 . 1 1 107 107 ALA HB2 H 1 1.069 0.02 . 1 . . . . . . . . 5324 1 973 . 1 1 107 107 ALA HB3 H 1 1.069 0.02 . 1 . . . . . . . . 5324 1 974 . 1 1 107 107 ALA N N 15 122.516 0.05 . 1 . . . . . . . . 5324 1 975 . 1 1 108 108 ALA CA C 13 51.427 0.05 . 1 . . . . . . . . 5324 1 976 . 1 1 108 108 ALA CB C 13 14.307 0.05 . 1 . . . . . . . . 5324 1 977 . 1 1 108 108 ALA H H 1 7.833 0.02 . 1 . . . . . . . . 5324 1 978 . 1 1 108 108 ALA HA H 1 3.965 0.02 . 1 . . . . . . . . 5324 1 979 . 1 1 108 108 ALA HB1 H 1 1.251 0.02 . 1 . . . . . . . . 5324 1 980 . 1 1 108 108 ALA HB2 H 1 1.251 0.02 . 1 . . . . . . . . 5324 1 981 . 1 1 108 108 ALA HB3 H 1 1.251 0.02 . 1 . . . . . . . . 5324 1 982 . 1 1 108 108 ALA N N 15 119.120 0.05 . 1 . . . . . . . . 5324 1 983 . 1 1 109 109 PHE CA C 13 59.272 0.05 . 1 . . . . . . . . 5324 1 984 . 1 1 109 109 PHE CB C 13 36.126 0.05 . 1 . . . . . . . . 5324 1 985 . 1 1 109 109 PHE CD1 C 13 129.368 0.05 . 1 . . . . . . . . 5324 1 986 . 1 1 109 109 PHE CE1 C 13 129.399 0.05 . 1 . . . . . . . . 5324 1 987 . 1 1 109 109 PHE CZ C 13 127.395 0.05 . 1 . . . . . . . . 5324 1 988 . 1 1 109 109 PHE CE2 C 13 129.399 0.05 . 1 . . . . . . . . 5324 1 989 . 1 1 109 109 PHE CD2 C 13 129.368 0.05 . 1 . . . . . . . . 5324 1 990 . 1 1 109 109 PHE H H 1 8.355 0.02 . 1 . . . . . . . . 5324 1 991 . 1 1 109 109 PHE HB2 H 1 2.859 0.02 . 2 . . . . . . . . 5324 1 992 . 1 1 109 109 PHE HB3 H 1 3.144 0.02 . 2 . . . . . . . . 5324 1 993 . 1 1 109 109 PHE HD1 H 1 6.663 0.02 . 1 . . . . . . . . 5324 1 994 . 1 1 109 109 PHE HE1 H 1 7.114 0.02 . 1 . . . . . . . . 5324 1 995 . 1 1 109 109 PHE HZ H 1 7.291 0.02 . 1 . . . . . . . . 5324 1 996 . 1 1 109 109 PHE HE2 H 1 7.114 0.02 . 1 . . . . . . . . 5324 1 997 . 1 1 109 109 PHE HD2 H 1 6.663 0.02 . 1 . . . . . . . . 5324 1 998 . 1 1 109 109 PHE N N 15 117.980 0.05 . 1 . . . . . . . . 5324 1 999 . 1 1 110 110 THR CA C 13 62.109 0.05 . 1 . . . . . . . . 5324 1 1000 . 1 1 110 110 THR CB C 13 65.777 0.05 . 1 . . . . . . . . 5324 1 1001 . 1 1 110 110 THR CG2 C 13 17.878 0.05 . 1 . . . . . . . . 5324 1 1002 . 1 1 110 110 THR H H 1 8.214 0.02 . 1 . . . . . . . . 5324 1 1003 . 1 1 110 110 THR HA H 1 3.918 0.02 . 1 . . . . . . . . 5324 1 1004 . 1 1 110 110 THR HB H 1 3.543 0.02 . 1 . . . . . . . . 5324 1 1005 . 1 1 110 110 THR HG21 H 1 0.992 0.02 . 1 . . . . . . . . 5324 1 1006 . 1 1 110 110 THR HG22 H 1 0.992 0.02 . 1 . . . . . . . . 5324 1 1007 . 1 1 110 110 THR HG23 H 1 0.992 0.02 . 1 . . . . . . . . 5324 1 1008 . 1 1 110 110 THR N N 15 110.190 0.05 . 1 . . . . . . . . 5324 1 1009 . 1 1 111 111 TYR CA C 13 58.065 0.05 . 1 . . . . . . . . 5324 1 1010 . 1 1 111 111 TYR CB C 13 34.712 0.05 . 1 . . . . . . . . 5324 1 1011 . 1 1 111 111 TYR CD1 C 13 131.119 0.05 . 1 . . . . . . . . 5324 1 1012 . 1 1 111 111 TYR CE1 C 13 116.106 0.05 . 1 . . . . . . . . 5324 1 1013 . 1 1 111 111 TYR CE2 C 13 116.106 0.05 . 1 . . . . . . . . 5324 1 1014 . 1 1 111 111 TYR CD2 C 13 131.119 0.05 . 1 . . . . . . . . 5324 1 1015 . 1 1 111 111 TYR H H 1 7.215 0.02 . 1 . . . . . . . . 5324 1 1016 . 1 1 111 111 TYR HA H 1 3.719 0.02 . 1 . . . . . . . . 5324 1 1017 . 1 1 111 111 TYR HB2 H 1 2.880 0.02 . 2 . . . . . . . . 5324 1 1018 . 1 1 111 111 TYR HB3 H 1 2.833 0.02 . 2 . . . . . . . . 5324 1 1019 . 1 1 111 111 TYR HD1 H 1 6.326 0.02 . 1 . . . . . . . . 5324 1 1020 . 1 1 111 111 TYR HE1 H 1 6.644 0.02 . 1 . . . . . . . . 5324 1 1021 . 1 1 111 111 TYR HE2 H 1 6.644 0.02 . 1 . . . . . . . . 5324 1 1022 . 1 1 111 111 TYR HD2 H 1 6.326 0.02 . 1 . . . . . . . . 5324 1 1023 . 1 1 111 111 TYR N N 15 120.932 0.05 . 1 . . . . . . . . 5324 1 1024 . 1 1 112 112 PHE CA C 13 56.518 0.05 . 1 . . . . . . . . 5324 1 1025 . 1 1 112 112 PHE CB C 13 36.472 0.05 . 1 . . . . . . . . 5324 1 1026 . 1 1 112 112 PHE CD1 C 13 130.665 0.05 . 1 . . . . . . . . 5324 1 1027 . 1 1 112 112 PHE CD2 C 13 130.665 0.05 . 1 . . . . . . . . 5324 1 1028 . 1 1 112 112 PHE H H 1 7.004 0.02 . 1 . . . . . . . . 5324 1 1029 . 1 1 112 112 PHE HA H 1 4.196 0.02 . 1 . . . . . . . . 5324 1 1030 . 1 1 112 112 PHE HB2 H 1 2.930 0.02 . 2 . . . . . . . . 5324 1 1031 . 1 1 112 112 PHE HB3 H 1 2.635 0.02 . 2 . . . . . . . . 5324 1 1032 . 1 1 112 112 PHE HD1 H 1 7.550 0.02 . 1 . . . . . . . . 5324 1 1033 . 1 1 112 112 PHE HE1 H 1 7.317 0.02 . 1 . . . . . . . . 5324 1 1034 . 1 1 112 112 PHE HZ H 1 7.031 0.02 . 1 . . . . . . . . 5324 1 1035 . 1 1 112 112 PHE HE2 H 1 7.317 0.02 . 1 . . . . . . . . 5324 1 1036 . 1 1 112 112 PHE HD2 H 1 7.550 0.02 . 1 . . . . . . . . 5324 1 1037 . 1 1 112 112 PHE N N 15 113.243 0.05 . 1 . . . . . . . . 5324 1 1038 . 1 1 113 113 ASP CA C 13 48.806 0.05 . 1 . . . . . . . . 5324 1 1039 . 1 1 113 113 ASP CB C 13 34.972 0.05 . 1 . . . . . . . . 5324 1 1040 . 1 1 113 113 ASP H H 1 7.606 0.02 . 1 . . . . . . . . 5324 1 1041 . 1 1 113 113 ASP HA H 1 4.498 0.02 . 1 . . . . . . . . 5324 1 1042 . 1 1 113 113 ASP HB2 H 1 2.314 0.02 . 2 . . . . . . . . 5324 1 1043 . 1 1 113 113 ASP HB3 H 1 1.353 0.02 . 2 . . . . . . . . 5324 1 1044 . 1 1 113 113 ASP N N 15 118.892 0.05 . 1 . . . . . . . . 5324 1 1045 . 1 1 114 114 LYS CA C 13 55.128 0.05 . 1 . . . . . . . . 5324 1 1046 . 1 1 114 114 LYS CB C 13 29.272 0.05 . 1 . . . . . . . . 5324 1 1047 . 1 1 114 114 LYS CG C 13 21.132 0.05 . 1 . . . . . . . . 5324 1 1048 . 1 1 114 114 LYS CD C 13 25.083 0.05 . 1 . . . . . . . . 5324 1 1049 . 1 1 114 114 LYS CE C 13 38.849 0.05 . 1 . . . . . . . . 5324 1 1050 . 1 1 114 114 LYS H H 1 7.410 0.02 . 1 . . . . . . . . 5324 1 1051 . 1 1 114 114 LYS HA H 1 3.852 0.02 . 1 . . . . . . . . 5324 1 1052 . 1 1 114 114 LYS HB2 H 1 1.848 0.02 . 2 . . . . . . . . 5324 1 1053 . 1 1 114 114 LYS HB3 H 1 1.806 0.02 . 2 . . . . . . . . 5324 1 1054 . 1 1 114 114 LYS HG2 H 1 1.522 0.02 . 1 . . . . . . . . 5324 1 1055 . 1 1 114 114 LYS HG3 H 1 1.522 0.02 . 1 . . . . . . . . 5324 1 1056 . 1 1 114 114 LYS HD2 H 1 1.620 0.02 . 2 . . . . . . . . 5324 1 1057 . 1 1 114 114 LYS HD3 H 1 1.387 0.02 . 2 . . . . . . . . 5324 1 1058 . 1 1 114 114 LYS HE2 H 1 2.842 0.02 . 1 . . . . . . . . 5324 1 1059 . 1 1 114 114 LYS HE3 H 1 2.842 0.02 . 1 . . . . . . . . 5324 1 1060 . 1 1 114 114 LYS N N 15 123.856 0.05 . 1 . . . . . . . . 5324 1 1061 . 1 1 115 115 ASP CA C 13 49.418 0.05 . 1 . . . . . . . . 5324 1 1062 . 1 1 115 115 ASP CB C 13 36.412 0.05 . 1 . . . . . . . . 5324 1 1063 . 1 1 115 115 ASP H H 1 8.208 0.02 . 1 . . . . . . . . 5324 1 1064 . 1 1 115 115 ASP HA H 1 4.564 0.02 . 1 . . . . . . . . 5324 1 1065 . 1 1 115 115 ASP HB2 H 1 3.077 0.02 . 2 . . . . . . . . 5324 1 1066 . 1 1 115 115 ASP HB3 H 1 2.692 0.02 . 2 . . . . . . . . 5324 1 1067 . 1 1 115 115 ASP N N 15 113.761 0.05 . 1 . . . . . . . . 5324 1 1068 . 1 1 116 116 GLY CA C 13 43.539 0.05 . 1 . . . . . . . . 5324 1 1069 . 1 1 116 116 GLY H H 1 7.863 0.02 . 1 . . . . . . . . 5324 1 1070 . 1 1 116 116 GLY N N 15 109.185 0.05 . 1 . . . . . . . . 5324 1 1071 . 1 1 117 117 SER CA C 13 56.241 0.05 . 1 . . . . . . . . 5324 1 1072 . 1 1 117 117 SER CB C 13 61.938 0.05 . 1 . . . . . . . . 5324 1 1073 . 1 1 117 117 SER H H 1 8.497 0.02 . 1 . . . . . . . . 5324 1 1074 . 1 1 117 117 SER HA H 1 4.210 0.02 . 1 . . . . . . . . 5324 1 1075 . 1 1 117 117 SER HB2 H 1 4.093 0.02 . 1 . . . . . . . . 5324 1 1076 . 1 1 117 117 SER HB3 H 1 4.093 0.02 . 1 . . . . . . . . 5324 1 1077 . 1 1 117 117 SER N N 15 116.262 0.05 . 1 . . . . . . . . 5324 1 1078 . 1 1 118 118 GLY H H 1 10.672 0.02 . 1 . . . . . . . . 5324 1 1079 . 1 1 118 118 GLY HA2 H 1 3.562 0.02 . 2 . . . . . . . . 5324 1 1080 . 1 1 118 118 GLY HA3 H 1 4.296 0.02 . 2 . . . . . . . . 5324 1 1081 . 1 1 118 118 GLY N N 15 114.810 0.05 . 1 . . . . . . . . 5324 1 1082 . 1 1 119 119 TYR CA C 13 52.618 0.05 . 1 . . . . . . . . 5324 1 1083 . 1 1 119 119 TYR CB C 13 38.213 0.05 . 1 . . . . . . . . 5324 1 1084 . 1 1 119 119 TYR CE1 C 13 115.981 0.05 . 1 . . . . . . . . 5324 1 1085 . 1 1 119 119 TYR CE2 C 13 115.981 0.05 . 1 . . . . . . . . 5324 1 1086 . 1 1 119 119 TYR H H 1 7.559 0.02 . 1 . . . . . . . . 5324 1 1087 . 1 1 119 119 TYR HA H 1 5.203 0.02 . 1 . . . . . . . . 5324 1 1088 . 1 1 119 119 TYR HB2 H 1 2.801 0.02 . 2 . . . . . . . . 5324 1 1089 . 1 1 119 119 TYR HB3 H 1 2.665 0.02 . 2 . . . . . . . . 5324 1 1090 . 1 1 119 119 TYR HD1 H 1 6.890 0.02 . 1 . . . . . . . . 5324 1 1091 . 1 1 119 119 TYR HE1 H 1 6.963 0.02 . 1 . . . . . . . . 5324 1 1092 . 1 1 119 119 TYR HE2 H 1 6.963 0.02 . 1 . . . . . . . . 5324 1 1093 . 1 1 119 119 TYR HD2 H 1 6.890 0.02 . 1 . . . . . . . . 5324 1 1094 . 1 1 119 119 TYR N N 15 113.015 0.05 . 1 . . . . . . . . 5324 1 1095 . 1 1 120 120 ILE CA C 13 57.266 0.05 . 1 . . . . . . . . 5324 1 1096 . 1 1 120 120 ILE CB C 13 35.344 0.05 . 1 . . . . . . . . 5324 1 1097 . 1 1 120 120 ILE CG1 C 13 23.525 0.05 . 1 . . . . . . . . 5324 1 1098 . 1 1 120 120 ILE CG2 C 13 14.219 0.05 . 1 . . . . . . . . 5324 1 1099 . 1 1 120 120 ILE CD1 C 13 12.280 0.05 . 1 . . . . . . . . 5324 1 1100 . 1 1 120 120 ILE H H 1 10.133 0.02 . 1 . . . . . . . . 5324 1 1101 . 1 1 120 120 ILE HA H 1 4.946 0.02 . 1 . . . . . . . . 5324 1 1102 . 1 1 120 120 ILE HB H 1 1.838 0.02 . 1 . . . . . . . . 5324 1 1103 . 1 1 120 120 ILE HG12 H 1 1.275 0.02 . 1 . . . . . . . . 5324 1 1104 . 1 1 120 120 ILE HG13 H 1 1.275 0.02 . 1 . . . . . . . . 5324 1 1105 . 1 1 120 120 ILE HG21 H 1 0.829 0.02 . 1 . . . . . . . . 5324 1 1106 . 1 1 120 120 ILE HG22 H 1 0.829 0.02 . 1 . . . . . . . . 5324 1 1107 . 1 1 120 120 ILE HG23 H 1 0.829 0.02 . 1 . . . . . . . . 5324 1 1108 . 1 1 120 120 ILE HD11 H 1 0.635 0.02 . 1 . . . . . . . . 5324 1 1109 . 1 1 120 120 ILE HD12 H 1 0.635 0.02 . 1 . . . . . . . . 5324 1 1110 . 1 1 120 120 ILE HD13 H 1 0.635 0.02 . 1 . . . . . . . . 5324 1 1111 . 1 1 120 120 ILE N N 15 128.574 0.05 . 1 . . . . . . . . 5324 1 1112 . 1 1 121 121 THR CA C 13 55.996 0.05 . 1 . . . . . . . . 5324 1 1113 . 1 1 121 121 THR CB C 13 64.412 0.05 . 1 . . . . . . . . 5324 1 1114 . 1 1 121 121 THR H H 1 8.903 0.02 . 1 . . . . . . . . 5324 1 1115 . 1 1 121 121 THR HA H 1 4.906 0.02 . 1 . . . . . . . . 5324 1 1116 . 1 1 121 121 THR HB H 1 4.688 0.02 . 1 . . . . . . . . 5324 1 1117 . 1 1 121 121 THR HG21 H 1 1.273 0.02 . 1 . . . . . . . . 5324 1 1118 . 1 1 121 121 THR HG22 H 1 1.273 0.02 . 1 . . . . . . . . 5324 1 1119 . 1 1 121 121 THR HG23 H 1 1.273 0.02 . 1 . . . . . . . . 5324 1 1120 . 1 1 121 121 THR N N 15 118.721 0.05 . 1 . . . . . . . . 5324 1 1121 . 1 1 122 122 PRO CA C 13 63.589 0.05 . 1 . . . . . . . . 5324 1 1122 . 1 1 122 122 PRO CB C 13 28.626 0.05 . 1 . . . . . . . . 5324 1 1123 . 1 1 122 122 PRO CG C 13 24.810 0.05 . 1 . . . . . . . . 5324 1 1124 . 1 1 122 122 PRO CD C 13 51.410 0.05 . 1 . . . . . . . . 5324 1 1125 . 1 1 122 122 PRO HA H 1 4.033 0.02 . 1 . . . . . . . . 5324 1 1126 . 1 1 122 122 PRO HB2 H 1 2.363 0.02 . 1 . . . . . . . . 5324 1 1127 . 1 1 122 122 PRO HB3 H 1 2.363 0.02 . 1 . . . . . . . . 5324 1 1128 . 1 1 122 122 PRO HG2 H 1 2.091 0.02 . 2 . . . . . . . . 5324 1 1129 . 1 1 122 122 PRO HG3 H 1 1.947 0.02 . 2 . . . . . . . . 5324 1 1130 . 1 1 122 122 PRO HD2 H 1 3.050 0.02 . 1 . . . . . . . . 5324 1 1131 . 1 1 122 122 PRO HD3 H 1 3.050 0.02 . 1 . . . . . . . . 5324 1 1132 . 1 1 123 123 ASP CA C 13 53.304 0.05 . 1 . . . . . . . . 5324 1 1133 . 1 1 123 123 ASP CB C 13 35.681 0.05 . 1 . . . . . . . . 5324 1 1134 . 1 1 123 123 ASP H H 1 8.879 0.02 . 1 . . . . . . . . 5324 1 1135 . 1 1 123 123 ASP HA H 1 4.325 0.02 . 1 . . . . . . . . 5324 1 1136 . 1 1 123 123 ASP HB2 H 1 2.765 0.02 . 2 . . . . . . . . 5324 1 1137 . 1 1 123 123 ASP HB3 H 1 2.576 0.02 . 2 . . . . . . . . 5324 1 1138 . 1 1 123 123 ASP N N 15 114.247 0.05 . 1 . . . . . . . . 5324 1 1139 . 1 1 124 124 GLU CA C 13 55.566 0.05 . 1 . . . . . . . . 5324 1 1140 . 1 1 124 124 GLU CB C 13 25.290 0.05 . 1 . . . . . . . . 5324 1 1141 . 1 1 124 124 GLU CG C 13 34.447 0.05 . 1 . . . . . . . . 5324 1 1142 . 1 1 124 124 GLU H H 1 7.450 0.02 . 1 . . . . . . . . 5324 1 1143 . 1 1 124 124 GLU HA H 1 4.080 0.02 . 1 . . . . . . . . 5324 1 1144 . 1 1 124 124 GLU HB2 H 1 2.711 0.02 . 2 . . . . . . . . 5324 1 1145 . 1 1 124 124 GLU HB3 H 1 2.438 0.02 . 2 . . . . . . . . 5324 1 1146 . 1 1 124 124 GLU HG2 H 1 2.560 0.02 . 2 . . . . . . . . 5324 1 1147 . 1 1 124 124 GLU HG3 H 1 2.267 0.02 . 2 . . . . . . . . 5324 1 1148 . 1 1 124 124 GLU N N 15 121.848 0.05 . 1 . . . . . . . . 5324 1 1149 . 1 1 125 125 LEU CA C 13 54.518 0.05 . 1 . . . . . . . . 5324 1 1150 . 1 1 125 125 LEU CB C 13 37.843 0.05 . 1 . . . . . . . . 5324 1 1151 . 1 1 125 125 LEU CD1 C 13 19.801 0.05 . 1 . . . . . . . . 5324 1 1152 . 1 1 125 125 LEU CD2 C 13 22.063 0.05 . 1 . . . . . . . . 5324 1 1153 . 1 1 125 125 LEU H H 1 7.857 0.02 . 1 . . . . . . . . 5324 1 1154 . 1 1 125 125 LEU HA H 1 4.000 0.02 . 1 . . . . . . . . 5324 1 1155 . 1 1 125 125 LEU HB2 H 1 1.751 0.02 . 2 . . . . . . . . 5324 1 1156 . 1 1 125 125 LEU HB3 H 1 1.176 0.02 . 2 . . . . . . . . 5324 1 1157 . 1 1 125 125 LEU HD11 H 1 0.070 0.02 . 2 . . . . . . . . 5324 1 1158 . 1 1 125 125 LEU HD12 H 1 0.070 0.02 . 2 . . . . . . . . 5324 1 1159 . 1 1 125 125 LEU HD13 H 1 0.070 0.02 . 2 . . . . . . . . 5324 1 1160 . 1 1 125 125 LEU HD21 H 1 0.375 0.02 . 2 . . . . . . . . 5324 1 1161 . 1 1 125 125 LEU HD22 H 1 0.375 0.02 . 2 . . . . . . . . 5324 1 1162 . 1 1 125 125 LEU HD23 H 1 0.375 0.02 . 2 . . . . . . . . 5324 1 1163 . 1 1 125 125 LEU N N 15 121.433 0.05 . 1 . . . . . . . . 5324 1 1164 . 1 1 126 126 GLN CA C 13 56.238 0.05 . 1 . . . . . . . . 5324 1 1165 . 1 1 126 126 GLN CB C 13 24.543 0.05 . 1 . . . . . . . . 5324 1 1166 . 1 1 126 126 GLN CG C 13 30.126 0.05 . 1 . . . . . . . . 5324 1 1167 . 1 1 126 126 GLN H H 1 8.466 0.02 . 1 . . . . . . . . 5324 1 1168 . 1 1 126 126 GLN HA H 1 3.939 0.02 . 1 . . . . . . . . 5324 1 1169 . 1 1 126 126 GLN HB2 H 1 2.405 0.02 . 2 . . . . . . . . 5324 1 1170 . 1 1 126 126 GLN HB3 H 1 2.252 0.02 . 2 . . . . . . . . 5324 1 1171 . 1 1 126 126 GLN HE21 H 1 7.588 0.02 . 1 . . . . . . . . 5324 1 1172 . 1 1 126 126 GLN HE22 H 1 6.793 0.02 . 1 . . . . . . . . 5324 1 1173 . 1 1 126 126 GLN N N 15 119.899 0.05 . 1 . . . . . . . . 5324 1 1174 . 1 1 126 126 GLN NE2 N 15 112.048 0.05 . 1 . . . . . . . . 5324 1 1175 . 1 1 127 127 GLN CA C 13 55.800 0.05 . 1 . . . . . . . . 5324 1 1176 . 1 1 127 127 GLN CB C 13 24.506 0.05 . 1 . . . . . . . . 5324 1 1177 . 1 1 127 127 GLN CG C 13 30.698 0.05 . 1 . . . . . . . . 5324 1 1178 . 1 1 127 127 GLN H H 1 7.761 0.02 . 1 . . . . . . . . 5324 1 1179 . 1 1 127 127 GLN HA H 1 4.078 0.02 . 1 . . . . . . . . 5324 1 1180 . 1 1 127 127 GLN HB2 H 1 2.133 0.02 . 2 . . . . . . . . 5324 1 1181 . 1 1 127 127 GLN HB3 H 1 2.225 0.02 . 2 . . . . . . . . 5324 1 1182 . 1 1 127 127 GLN HG2 H 1 2.368 0.02 . 2 . . . . . . . . 5324 1 1183 . 1 1 127 127 GLN HG3 H 1 2.554 0.02 . 2 . . . . . . . . 5324 1 1184 . 1 1 127 127 GLN HE21 H 1 7.378 0.02 . 1 . . . . . . . . 5324 1 1185 . 1 1 127 127 GLN HE22 H 1 6.770 0.02 . 1 . . . . . . . . 5324 1 1186 . 1 1 127 127 GLN N N 15 117.936 0.05 . 1 . . . . . . . . 5324 1 1187 . 1 1 127 127 GLN NE2 N 15 110.875 0.05 . 1 . . . . . . . . 5324 1 1188 . 1 1 128 128 ALA CA C 13 51.733 0.05 . 1 . . . . . . . . 5324 1 1189 . 1 1 128 128 ALA CB C 13 14.391 0.05 . 1 . . . . . . . . 5324 1 1190 . 1 1 128 128 ALA H H 1 7.870 0.02 . 1 . . . . . . . . 5324 1 1191 . 1 1 128 128 ALA HA H 1 4.515 0.02 . 1 . . . . . . . . 5324 1 1192 . 1 1 128 128 ALA HB1 H 1 1.840 0.02 . 1 . . . . . . . . 5324 1 1193 . 1 1 128 128 ALA HB2 H 1 1.840 0.02 . 1 . . . . . . . . 5324 1 1194 . 1 1 128 128 ALA HB3 H 1 1.840 0.02 . 1 . . . . . . . . 5324 1 1195 . 1 1 128 128 ALA N N 15 121.188 0.05 . 1 . . . . . . . . 5324 1 1196 . 1 1 129 129 CYS CA C 13 61.410 0.05 . 1 . . . . . . . . 5324 1 1197 . 1 1 129 129 CYS CB C 13 22.771 0.05 . 1 . . . . . . . . 5324 1 1198 . 1 1 129 129 CYS H H 1 8.278 0.02 . 1 . . . . . . . . 5324 1 1199 . 1 1 129 129 CYS HA H 1 4.189 0.02 . 1 . . . . . . . . 5324 1 1200 . 1 1 129 129 CYS HB2 H 1 3.279 0.02 . 2 . . . . . . . . 5324 1 1201 . 1 1 129 129 CYS HB3 H 1 3.138 0.02 . 2 . . . . . . . . 5324 1 1202 . 1 1 129 129 CYS N N 15 115.503 0.05 . 1 . . . . . . . . 5324 1 1203 . 1 1 130 130 GLU CA C 13 55.979 0.05 . 1 . . . . . . . . 5324 1 1204 . 1 1 130 130 GLU CB C 13 25.446 0.05 . 1 . . . . . . . . 5324 1 1205 . 1 1 130 130 GLU CG C 13 33.006 0.05 . 1 . . . . . . . . 5324 1 1206 . 1 1 130 130 GLU H H 1 7.919 0.02 . 1 . . . . . . . . 5324 1 1207 . 1 1 130 130 GLU HA H 1 4.128 0.02 . 1 . . . . . . . . 5324 1 1208 . 1 1 130 130 GLU HB2 H 1 2.281 0.02 . 2 . . . . . . . . 5324 1 1209 . 1 1 130 130 GLU HB3 H 1 2.139 0.02 . 2 . . . . . . . . 5324 1 1210 . 1 1 130 130 GLU HG2 H 1 2.479 0.02 . 1 . . . . . . . . 5324 1 1211 . 1 1 130 130 GLU HG3 H 1 2.479 0.02 . 1 . . . . . . . . 5324 1 1212 . 1 1 130 130 GLU N N 15 118.983 0.05 . 1 . . . . . . . . 5324 1 1213 . 1 1 131 131 GLU CA C 13 55.900 0.05 . 1 . . . . . . . . 5324 1 1214 . 1 1 131 131 GLU CB C 13 25.333 0.05 . 1 . . . . . . . . 5324 1 1215 . 1 1 131 131 GLU CG C 13 32.824 0.05 . 1 . . . . . . . . 5324 1 1216 . 1 1 131 131 GLU H H 1 8.295 0.02 . 1 . . . . . . . . 5324 1 1217 . 1 1 131 131 GLU HA H 1 3.981 0.02 . 1 . . . . . . . . 5324 1 1218 . 1 1 131 131 GLU HB2 H 1 2.225 0.02 . 2 . . . . . . . . 5324 1 1219 . 1 1 131 131 GLU HB3 H 1 1.933 0.02 . 2 . . . . . . . . 5324 1 1220 . 1 1 131 131 GLU HG2 H 1 2.115 0.02 . 1 . . . . . . . . 5324 1 1221 . 1 1 131 131 GLU HG3 H 1 2.115 0.02 . 1 . . . . . . . . 5324 1 1222 . 1 1 131 131 GLU N N 15 121.037 0.05 . 1 . . . . . . . . 5324 1 1223 . 1 1 132 132 PHE CA C 13 55.113 0.05 . 1 . . . . . . . . 5324 1 1224 . 1 1 132 132 PHE CB C 13 35.766 0.05 . 1 . . . . . . . . 5324 1 1225 . 1 1 132 132 PHE CD1 C 13 129.081 0.05 . 1 . . . . . . . . 5324 1 1226 . 1 1 132 132 PHE CD2 C 13 129.081 0.05 . 1 . . . . . . . . 5324 1 1227 . 1 1 132 132 PHE H H 1 8.207 0.02 . 1 . . . . . . . . 5324 1 1228 . 1 1 132 132 PHE HA H 1 4.600 0.02 . 1 . . . . . . . . 5324 1 1229 . 1 1 132 132 PHE HB2 H 1 3.382 0.02 . 2 . . . . . . . . 5324 1 1230 . 1 1 132 132 PHE HB3 H 1 3.105 0.02 . 2 . . . . . . . . 5324 1 1231 . 1 1 132 132 PHE HD1 H 1 7.587 0.02 . 1 . . . . . . . . 5324 1 1232 . 1 1 132 132 PHE HE1 H 1 7.327 0.02 . 1 . . . . . . . . 5324 1 1233 . 1 1 132 132 PHE HZ H 1 6.943 0.02 . 1 . . . . . . . . 5324 1 1234 . 1 1 132 132 PHE HE2 H 1 7.327 0.02 . 1 . . . . . . . . 5324 1 1235 . 1 1 132 132 PHE HD2 H 1 7.587 0.02 . 1 . . . . . . . . 5324 1 1236 . 1 1 132 132 PHE N N 15 115.059 0.05 . 1 . . . . . . . . 5324 1 1237 . 1 1 133 133 GLY CA C 13 43.621 0.05 . 1 . . . . . . . . 5324 1 1238 . 1 1 133 133 GLY H H 1 7.878 0.02 . 1 . . . . . . . . 5324 1 1239 . 1 1 133 133 GLY HA2 H 1 3.982 0.02 . 1 . . . . . . . . 5324 1 1240 . 1 1 133 133 GLY HA3 H 1 3.982 0.02 . 1 . . . . . . . . 5324 1 1241 . 1 1 133 133 GLY N N 15 110.427 0.05 . 1 . . . . . . . . 5324 1 1242 . 1 1 134 134 VAL CA C 13 58.749 0.05 . 1 . . . . . . . . 5324 1 1243 . 1 1 134 134 VAL CB C 13 28.977 0.05 . 1 . . . . . . . . 5324 1 1244 . 1 1 134 134 VAL H H 1 8.363 0.02 . 1 . . . . . . . . 5324 1 1245 . 1 1 134 134 VAL HA H 1 4.107 0.02 . 1 . . . . . . . . 5324 1 1246 . 1 1 134 134 VAL HB H 1 2.021 0.02 . 1 . . . . . . . . 5324 1 1247 . 1 1 134 134 VAL N N 15 120.575 0.05 . 1 . . . . . . . . 5324 1 1248 . 1 1 135 135 GLU CA C 13 52.770 0.05 . 1 . . . . . . . . 5324 1 1249 . 1 1 135 135 GLU CB C 13 27.667 0.05 . 1 . . . . . . . . 5324 1 1250 . 1 1 135 135 GLU CG C 13 32.929 0.05 . 1 . . . . . . . . 5324 1 1251 . 1 1 135 135 GLU H H 1 8.536 0.02 . 1 . . . . . . . . 5324 1 1252 . 1 1 135 135 GLU HA H 1 4.450 0.02 . 1 . . . . . . . . 5324 1 1253 . 1 1 135 135 GLU HB2 H 1 2.138 0.02 . 2 . . . . . . . . 5324 1 1254 . 1 1 135 135 GLU HB3 H 1 1.922 0.02 . 2 . . . . . . . . 5324 1 1255 . 1 1 135 135 GLU HG2 H 1 2.253 0.02 . 1 . . . . . . . . 5324 1 1256 . 1 1 135 135 GLU HG3 H 1 2.253 0.02 . 1 . . . . . . . . 5324 1 1257 . 1 1 135 135 GLU N N 15 125.133 0.05 . 1 . . . . . . . . 5324 1 1258 . 1 1 136 136 ASP CA C 13 50.965 0.05 . 1 . . . . . . . . 5324 1 1259 . 1 1 136 136 ASP CB C 13 36.363 0.05 . 1 . . . . . . . . 5324 1 1260 . 1 1 136 136 ASP H H 1 8.543 0.02 . 1 . . . . . . . . 5324 1 1261 . 1 1 136 136 ASP HA H 1 4.457 0.02 . 1 . . . . . . . . 5324 1 1262 . 1 1 136 136 ASP HB2 H 1 2.701 0.02 . 1 . . . . . . . . 5324 1 1263 . 1 1 136 136 ASP HB3 H 1 2.701 0.02 . 1 . . . . . . . . 5324 1 1264 . 1 1 136 136 ASP N N 15 117.759 0.05 . 1 . . . . . . . . 5324 1 1265 . 1 1 137 137 VAL CA C 13 58.495 0.05 . 1 . . . . . . . . 5324 1 1266 . 1 1 137 137 VAL CB C 13 29.693 0.05 . 1 . . . . . . . . 5324 1 1267 . 1 1 137 137 VAL CG1 C 13 19.247 0.05 . 1 . . . . . . . . 5324 1 1268 . 1 1 137 137 VAL CG2 C 13 17.798 0.05 . 1 . . . . . . . . 5324 1 1269 . 1 1 137 137 VAL H H 1 7.934 0.02 . 1 . . . . . . . . 5324 1 1270 . 1 1 137 137 VAL HA H 1 4.032 0.02 . 1 . . . . . . . . 5324 1 1271 . 1 1 137 137 VAL HB H 1 2.024 0.02 . 1 . . . . . . . . 5324 1 1272 . 1 1 137 137 VAL HG11 H 1 0.869 0.02 . 2 . . . . . . . . 5324 1 1273 . 1 1 137 137 VAL HG12 H 1 0.869 0.02 . 2 . . . . . . . . 5324 1 1274 . 1 1 137 137 VAL HG13 H 1 0.869 0.02 . 2 . . . . . . . . 5324 1 1275 . 1 1 137 137 VAL HG21 H 1 0.710 0.02 . 2 . . . . . . . . 5324 1 1276 . 1 1 137 137 VAL HG22 H 1 0.710 0.02 . 2 . . . . . . . . 5324 1 1277 . 1 1 137 137 VAL HG23 H 1 0.710 0.02 . 2 . . . . . . . . 5324 1 1278 . 1 1 137 137 VAL N N 15 119.114 0.05 . 1 . . . . . . . . 5324 1 1279 . 1 1 138 138 ARG CA C 13 51.464 0.05 . 1 . . . . . . . . 5324 1 1280 . 1 1 138 138 ARG CB C 13 25.513 0.05 . 1 . . . . . . . . 5324 1 1281 . 1 1 138 138 ARG CG C 13 23.815 0.05 . 1 . . . . . . . . 5324 1 1282 . 1 1 138 138 ARG CD C 13 39.797 0.05 . 1 . . . . . . . . 5324 1 1283 . 1 1 138 138 ARG H H 1 8.433 0.02 . 1 . . . . . . . . 5324 1 1284 . 1 1 138 138 ARG HA H 1 4.554 0.02 . 1 . . . . . . . . 5324 1 1285 . 1 1 138 138 ARG HB2 H 1 1.903 0.02 . 2 . . . . . . . . 5324 1 1286 . 1 1 138 138 ARG HB3 H 1 1.758 0.02 . 2 . . . . . . . . 5324 1 1287 . 1 1 138 138 ARG HG2 H 1 1.615 0.02 . 2 . . . . . . . . 5324 1 1288 . 1 1 138 138 ARG HG3 H 1 1.758 0.02 . 2 . . . . . . . . 5324 1 1289 . 1 1 138 138 ARG HD2 H 1 3.235 0.02 . 1 . . . . . . . . 5324 1 1290 . 1 1 138 138 ARG HD3 H 1 3.235 0.02 . 1 . . . . . . . . 5324 1 1291 . 1 1 138 138 ARG N N 15 126.935 0.05 . 1 . . . . . . . . 5324 1 1292 . 1 1 139 139 ILE CA C 13 60.208 0.05 . 1 . . . . . . . . 5324 1 1293 . 1 1 139 139 ILE CB C 13 32.723 0.05 . 1 . . . . . . . . 5324 1 1294 . 1 1 139 139 ILE CG1 C 13 25.352 0.05 . 1 . . . . . . . . 5324 1 1295 . 1 1 139 139 ILE CG2 C 13 14.851 0.05 . 1 . . . . . . . . 5324 1 1296 . 1 1 139 139 ILE CD1 C 13 8.243 0.05 . 1 . . . . . . . . 5324 1 1297 . 1 1 139 139 ILE H H 1 8.708 0.02 . 1 . . . . . . . . 5324 1 1298 . 1 1 139 139 ILE HA H 1 3.496 0.02 . 1 . . . . . . . . 5324 1 1299 . 1 1 139 139 ILE HB H 1 2.010 0.02 . 1 . . . . . . . . 5324 1 1300 . 1 1 139 139 ILE HG12 H 1 1.441 0.02 . 2 . . . . . . . . 5324 1 1301 . 1 1 139 139 ILE HG13 H 1 1.505 0.02 . 2 . . . . . . . . 5324 1 1302 . 1 1 139 139 ILE HG21 H 1 0.895 0.02 . 1 . . . . . . . . 5324 1 1303 . 1 1 139 139 ILE HG22 H 1 0.895 0.02 . 1 . . . . . . . . 5324 1 1304 . 1 1 139 139 ILE HG23 H 1 0.895 0.02 . 1 . . . . . . . . 5324 1 1305 . 1 1 139 139 ILE HD11 H 1 0.754 0.02 . 1 . . . . . . . . 5324 1 1306 . 1 1 139 139 ILE HD12 H 1 0.754 0.02 . 1 . . . . . . . . 5324 1 1307 . 1 1 139 139 ILE HD13 H 1 0.754 0.02 . 1 . . . . . . . . 5324 1 1308 . 1 1 139 139 ILE N N 15 127.823 0.05 . 1 . . . . . . . . 5324 1 1309 . 1 1 140 140 GLU CA C 13 56.495 0.05 . 1 . . . . . . . . 5324 1 1310 . 1 1 140 140 GLU CB C 13 24.639 0.05 . 1 . . . . . . . . 5324 1 1311 . 1 1 140 140 GLU CG C 13 32.946 0.05 . 1 . . . . . . . . 5324 1 1312 . 1 1 140 140 GLU H H 1 9.482 0.02 . 1 . . . . . . . . 5324 1 1313 . 1 1 140 140 GLU HA H 1 4.045 0.02 . 1 . . . . . . . . 5324 1 1314 . 1 1 140 140 GLU HB2 H 1 2.043 0.02 . 1 . . . . . . . . 5324 1 1315 . 1 1 140 140 GLU HB3 H 1 2.043 0.02 . 1 . . . . . . . . 5324 1 1316 . 1 1 140 140 GLU HG2 H 1 2.366 0.02 . 1 . . . . . . . . 5324 1 1317 . 1 1 140 140 GLU HG3 H 1 2.366 0.02 . 1 . . . . . . . . 5324 1 1318 . 1 1 140 140 GLU N N 15 118.896 0.05 . 1 . . . . . . . . 5324 1 1319 . 1 1 141 141 GLU CA C 13 55.310 0.05 . 1 . . . . . . . . 5324 1 1320 . 1 1 141 141 GLU CB C 13 25.863 0.05 . 1 . . . . . . . . 5324 1 1321 . 1 1 141 141 GLU CG C 13 33.488 0.05 . 1 . . . . . . . . 5324 1 1322 . 1 1 141 141 GLU H H 1 7.033 0.02 . 1 . . . . . . . . 5324 1 1323 . 1 1 141 141 GLU HA H 1 3.934 0.02 . 1 . . . . . . . . 5324 1 1324 . 1 1 141 141 GLU HB2 H 1 2.107 0.02 . 1 . . . . . . . . 5324 1 1325 . 1 1 141 141 GLU HB3 H 1 2.107 0.02 . 1 . . . . . . . . 5324 1 1326 . 1 1 141 141 GLU HG2 H 1 2.269 0.02 . 1 . . . . . . . . 5324 1 1327 . 1 1 141 141 GLU HG3 H 1 2.269 0.02 . 1 . . . . . . . . 5324 1 1328 . 1 1 141 141 GLU N N 15 118.739 0.05 . 1 . . . . . . . . 5324 1 1329 . 1 1 142 142 LEU CA C 13 54.859 0.05 . 1 . . . . . . . . 5324 1 1330 . 1 1 142 142 LEU CB C 13 38.368 0.05 . 1 . . . . . . . . 5324 1 1331 . 1 1 142 142 LEU CD1 C 13 21.623 0.05 . 1 . . . . . . . . 5324 1 1332 . 1 1 142 142 LEU CD2 C 13 21.623 0.05 . 1 . . . . . . . . 5324 1 1333 . 1 1 142 142 LEU H H 1 7.418 0.02 . 1 . . . . . . . . 5324 1 1334 . 1 1 142 142 LEU HA H 1 3.949 0.02 . 1 . . . . . . . . 5324 1 1335 . 1 1 142 142 LEU HB2 H 1 1.661 0.02 . 2 . . . . . . . . 5324 1 1336 . 1 1 142 142 LEU HB3 H 1 1.443 0.02 . 2 . . . . . . . . 5324 1 1337 . 1 1 142 142 LEU HD11 H 1 0.676 0.02 . 2 . . . . . . . . 5324 1 1338 . 1 1 142 142 LEU HD12 H 1 0.676 0.02 . 2 . . . . . . . . 5324 1 1339 . 1 1 142 142 LEU HD13 H 1 0.676 0.02 . 2 . . . . . . . . 5324 1 1340 . 1 1 142 142 LEU HD21 H 1 0.548 0.02 . 2 . . . . . . . . 5324 1 1341 . 1 1 142 142 LEU HD22 H 1 0.548 0.02 . 2 . . . . . . . . 5324 1 1342 . 1 1 142 142 LEU HD23 H 1 0.548 0.02 . 2 . . . . . . . . 5324 1 1343 . 1 1 142 142 LEU N N 15 119.482 0.05 . 1 . . . . . . . . 5324 1 1344 . 1 1 143 143 MET CA C 13 53.406 0.05 . 1 . . . . . . . . 5324 1 1345 . 1 1 143 143 MET CB C 13 26.826 0.05 . 1 . . . . . . . . 5324 1 1346 . 1 1 143 143 MET H H 1 8.294 0.02 . 1 . . . . . . . . 5324 1 1347 . 1 1 143 143 MET HA H 1 4.151 0.02 . 1 . . . . . . . . 5324 1 1348 . 1 1 143 143 MET HB2 H 1 2.049 0.02 . 2 . . . . . . . . 5324 1 1349 . 1 1 143 143 MET HB3 H 1 2.496 0.02 . 2 . . . . . . . . 5324 1 1350 . 1 1 143 143 MET N N 15 114.464 0.05 . 1 . . . . . . . . 5324 1 1351 . 1 1 144 144 ARG CA C 13 55.729 0.05 . 1 . . . . . . . . 5324 1 1352 . 1 1 144 144 ARG CB C 13 25.887 0.05 . 1 . . . . . . . . 5324 1 1353 . 1 1 144 144 ARG CG C 13 23.355 0.05 . 1 . . . . . . . . 5324 1 1354 . 1 1 144 144 ARG CD C 13 40.104 0.05 . 1 . . . . . . . . 5324 1 1355 . 1 1 144 144 ARG H H 1 7.464 0.02 . 1 . . . . . . . . 5324 1 1356 . 1 1 144 144 ARG HA H 1 4.077 0.02 . 1 . . . . . . . . 5324 1 1357 . 1 1 144 144 ARG HB2 H 1 1.998 0.02 . 2 . . . . . . . . 5324 1 1358 . 1 1 144 144 ARG HB3 H 1 1.808 0.02 . 2 . . . . . . . . 5324 1 1359 . 1 1 144 144 ARG HG2 H 1 1.626 0.02 . 2 . . . . . . . . 5324 1 1360 . 1 1 144 144 ARG HG3 H 1 1.808 0.02 . 2 . . . . . . . . 5324 1 1361 . 1 1 144 144 ARG HD2 H 1 3.215 0.02 . 2 . . . . . . . . 5324 1 1362 . 1 1 144 144 ARG HD3 H 1 3.219 0.02 . 2 . . . . . . . . 5324 1 1363 . 1 1 144 144 ARG N N 15 118.750 0.05 . 1 . . . . . . . . 5324 1 1364 . 1 1 145 145 ASP CA C 13 52.958 0.05 . 1 . . . . . . . . 5324 1 1365 . 1 1 145 145 ASP CB C 13 38.489 0.05 . 1 . . . . . . . . 5324 1 1366 . 1 1 145 145 ASP H H 1 7.512 0.02 . 1 . . . . . . . . 5324 1 1367 . 1 1 145 145 ASP HA H 1 4.671 0.02 . 1 . . . . . . . . 5324 1 1368 . 1 1 145 145 ASP HB2 H 1 2.848 0.02 . 2 . . . . . . . . 5324 1 1369 . 1 1 145 145 ASP HB3 H 1 2.720 0.02 . 2 . . . . . . . . 5324 1 1370 . 1 1 145 145 ASP N N 15 115.562 0.05 . 1 . . . . . . . . 5324 1 1371 . 1 1 146 146 VAL CA C 13 59.850 0.05 . 1 . . . . . . . . 5324 1 1372 . 1 1 146 146 VAL CB C 13 30.514 0.05 . 1 . . . . . . . . 5324 1 1373 . 1 1 146 146 VAL CG1 C 13 19.801 0.05 . 1 . . . . . . . . 5324 1 1374 . 1 1 146 146 VAL CG2 C 13 19.801 0.05 . 1 . . . . . . . . 5324 1 1375 . 1 1 146 146 VAL H H 1 7.832 0.02 . 1 . . . . . . . . 5324 1 1376 . 1 1 146 146 VAL HB H 1 1.931 0.02 . 1 . . . . . . . . 5324 1 1377 . 1 1 146 146 VAL HG11 H 1 1.039 0.02 . 1 . . . . . . . . 5324 1 1378 . 1 1 146 146 VAL HG12 H 1 1.039 0.02 . 1 . . . . . . . . 5324 1 1379 . 1 1 146 146 VAL HG13 H 1 1.039 0.02 . 1 . . . . . . . . 5324 1 1380 . 1 1 146 146 VAL HG21 H 1 1.039 0.02 . 1 . . . . . . . . 5324 1 1381 . 1 1 146 146 VAL HG22 H 1 1.039 0.02 . 1 . . . . . . . . 5324 1 1382 . 1 1 146 146 VAL HG23 H 1 1.039 0.02 . 1 . . . . . . . . 5324 1 1383 . 1 1 146 146 VAL N N 15 115.975 0.05 . 1 . . . . . . . . 5324 1 1384 . 1 1 147 147 ASP CA C 13 50.382 0.05 . 1 . . . . . . . . 5324 1 1385 . 1 1 147 147 ASP CB C 13 36.337 0.05 . 1 . . . . . . . . 5324 1 1386 . 1 1 147 147 ASP H H 1 8.467 0.02 . 1 . . . . . . . . 5324 1 1387 . 1 1 147 147 ASP HA H 1 4.625 0.02 . 1 . . . . . . . . 5324 1 1388 . 1 1 147 147 ASP HB2 H 1 3.190 0.02 . 2 . . . . . . . . 5324 1 1389 . 1 1 147 147 ASP HB3 H 1 2.340 0.02 . 2 . . . . . . . . 5324 1 1390 . 1 1 147 147 ASP N N 15 120.141 0.05 . 1 . . . . . . . . 5324 1 1391 . 1 1 148 148 GLN CA C 13 54.900 0.05 . 1 . . . . . . . . 5324 1 1392 . 1 1 148 148 GLN CB C 13 25.923 0.05 . 1 . . . . . . . . 5324 1 1393 . 1 1 148 148 GLN CG C 13 30.807 0.05 . 1 . . . . . . . . 5324 1 1394 . 1 1 148 148 GLN H H 1 8.013 0.02 . 1 . . . . . . . . 5324 1 1395 . 1 1 148 148 GLN HA H 1 4.109 0.02 . 1 . . . . . . . . 5324 1 1396 . 1 1 148 148 GLN HB2 H 1 2.057 0.02 . 2 . . . . . . . . 5324 1 1397 . 1 1 148 148 GLN HB3 H 1 2.246 0.02 . 2 . . . . . . . . 5324 1 1398 . 1 1 148 148 GLN HG2 H 1 2.364 0.02 . 2 . . . . . . . . 5324 1 1399 . 1 1 148 148 GLN HG3 H 1 2.506 0.02 . 2 . . . . . . . . 5324 1 1400 . 1 1 148 148 GLN HE21 H 1 7.487 0.02 . 1 . . . . . . . . 5324 1 1401 . 1 1 148 148 GLN HE22 H 1 6.678 0.02 . 1 . . . . . . . . 5324 1 1402 . 1 1 148 148 GLN N N 15 126.464 0.05 . 1 . . . . . . . . 5324 1 1403 . 1 1 148 148 GLN NE2 N 15 111.444 0.05 . 1 . . . . . . . . 5324 1 1404 . 1 1 149 149 ASP CA C 13 49.418 0.05 . 1 . . . . . . . . 5324 1 1405 . 1 1 149 149 ASP CB C 13 36.131 0.05 . 1 . . . . . . . . 5324 1 1406 . 1 1 149 149 ASP H H 1 8.152 0.02 . 1 . . . . . . . . 5324 1 1407 . 1 1 149 149 ASP HA H 1 4.645 0.02 . 1 . . . . . . . . 5324 1 1408 . 1 1 149 149 ASP HB2 H 1 3.047 0.02 . 2 . . . . . . . . 5324 1 1409 . 1 1 149 149 ASP HB3 H 1 2.576 0.02 . 2 . . . . . . . . 5324 1 1410 . 1 1 149 149 ASP N N 15 114.778 0.05 . 1 . . . . . . . . 5324 1 1411 . 1 1 150 150 ASN CA C 13 51.659 0.05 . 1 . . . . . . . . 5324 1 1412 . 1 1 150 150 ASN CB C 13 34.161 0.05 . 1 . . . . . . . . 5324 1 1413 . 1 1 150 150 ASN H H 1 7.637 0.02 . 1 . . . . . . . . 5324 1 1414 . 1 1 150 150 ASN HA H 1 4.349 0.02 . 1 . . . . . . . . 5324 1 1415 . 1 1 150 150 ASN HB2 H 1 3.050 0.02 . 2 . . . . . . . . 5324 1 1416 . 1 1 150 150 ASN HB3 H 1 2.612 0.02 . 2 . . . . . . . . 5324 1 1417 . 1 1 150 150 ASN HD21 H 1 7.369 0.02 . 1 . . . . . . . . 5324 1 1418 . 1 1 150 150 ASN HD22 H 1 6.648 0.02 . 1 . . . . . . . . 5324 1 1419 . 1 1 150 150 ASN N N 15 114.783 0.05 . 1 . . . . . . . . 5324 1 1420 . 1 1 150 150 ASN ND2 N 15 111.820 0.05 . 1 . . . . . . . . 5324 1 1421 . 1 1 151 151 ASP CA C 13 50.036 0.05 . 1 . . . . . . . . 5324 1 1422 . 1 1 151 151 ASP CB C 13 37.499 0.05 . 1 . . . . . . . . 5324 1 1423 . 1 1 151 151 ASP H H 1 8.534 0.02 . 1 . . . . . . . . 5324 1 1424 . 1 1 151 151 ASP HA H 1 4.589 0.02 . 1 . . . . . . . . 5324 1 1425 . 1 1 151 151 ASP HB2 H 1 2.889 0.02 . 2 . . . . . . . . 5324 1 1426 . 1 1 151 151 ASP HB3 H 1 2.415 0.02 . 2 . . . . . . . . 5324 1 1427 . 1 1 151 151 ASP N N 15 118.020 0.05 . 1 . . . . . . . . 5324 1 1428 . 1 1 152 152 GLY H H 1 10.148 0.02 . 1 . . . . . . . . 5324 1 1429 . 1 1 152 152 GLY HA2 H 1 3.457 0.02 . 2 . . . . . . . . 5324 1 1430 . 1 1 152 152 GLY HA3 H 1 4.031 0.02 . 2 . . . . . . . . 5324 1 1431 . 1 1 152 152 GLY N N 15 112.430 0.05 . 1 . . . . . . . . 5324 1 1432 . 1 1 153 153 ARG CA C 13 50.381 0.05 . 1 . . . . . . . . 5324 1 1433 . 1 1 153 153 ARG CB C 13 29.923 0.05 . 1 . . . . . . . . 5324 1 1434 . 1 1 153 153 ARG CG C 13 22.320 0.05 . 1 . . . . . . . . 5324 1 1435 . 1 1 153 153 ARG CD C 13 39.524 0.05 . 1 . . . . . . . . 5324 1 1436 . 1 1 153 153 ARG H H 1 7.842 0.02 . 1 . . . . . . . . 5324 1 1437 . 1 1 153 153 ARG HA H 1 4.802 0.02 . 1 . . . . . . . . 5324 1 1438 . 1 1 153 153 ARG HB2 H 1 1.528 0.02 . 2 . . . . . . . . 5324 1 1439 . 1 1 153 153 ARG HB3 H 1 1.761 0.02 . 2 . . . . . . . . 5324 1 1440 . 1 1 153 153 ARG HG2 H 1 1.596 0.02 . 2 . . . . . . . . 5324 1 1441 . 1 1 153 153 ARG HG3 H 1 1.344 0.02 . 2 . . . . . . . . 5324 1 1442 . 1 1 153 153 ARG HD2 H 1 2.671 0.02 . 2 . . . . . . . . 5324 1 1443 . 1 1 153 153 ARG HD3 H 1 2.790 0.02 . 2 . . . . . . . . 5324 1 1444 . 1 1 153 153 ARG N N 15 115.956 0.05 . 1 . . . . . . . . 5324 1 1445 . 1 1 154 154 ILE CA C 13 56.678 0.05 . 1 . . . . . . . . 5324 1 1446 . 1 1 154 154 ILE CB C 13 36.070 0.05 . 1 . . . . . . . . 5324 1 1447 . 1 1 154 154 ILE CG1 C 13 24.119 0.05 . 1 . . . . . . . . 5324 1 1448 . 1 1 154 154 ILE CG2 C 13 14.298 0.05 . 1 . . . . . . . . 5324 1 1449 . 1 1 154 154 ILE H H 1 9.333 0.02 . 1 . . . . . . . . 5324 1 1450 . 1 1 154 154 ILE HA H 1 5.276 0.02 . 1 . . . . . . . . 5324 1 1451 . 1 1 154 154 ILE HB H 1 2.125 0.02 . 1 . . . . . . . . 5324 1 1452 . 1 1 154 154 ILE HG12 H 1 1.281 0.02 . 2 . . . . . . . . 5324 1 1453 . 1 1 154 154 ILE HG13 H 1 1.466 0.02 . 2 . . . . . . . . 5324 1 1454 . 1 1 154 154 ILE HG21 H 1 0.913 0.02 . 1 . . . . . . . . 5324 1 1455 . 1 1 154 154 ILE HG22 H 1 0.913 0.02 . 1 . . . . . . . . 5324 1 1456 . 1 1 154 154 ILE HG23 H 1 0.913 0.02 . 1 . . . . . . . . 5324 1 1457 . 1 1 154 154 ILE HD11 H 1 0.804 0.02 . 1 . . . . . . . . 5324 1 1458 . 1 1 154 154 ILE HD12 H 1 0.804 0.02 . 1 . . . . . . . . 5324 1 1459 . 1 1 154 154 ILE HD13 H 1 0.804 0.02 . 1 . . . . . . . . 5324 1 1460 . 1 1 154 154 ILE N N 15 124.409 0.05 . 1 . . . . . . . . 5324 1 1461 . 1 1 155 155 ASP CA C 13 49.004 0.05 . 1 . . . . . . . . 5324 1 1462 . 1 1 155 155 ASP CB C 13 38.327 0.05 . 1 . . . . . . . . 5324 1 1463 . 1 1 155 155 ASP H H 1 9.434 0.02 . 1 . . . . . . . . 5324 1 1464 . 1 1 155 155 ASP HA H 1 5.264 0.02 . 1 . . . . . . . . 5324 1 1465 . 1 1 155 155 ASP HB2 H 1 2.926 0.02 . 2 . . . . . . . . 5324 1 1466 . 1 1 155 155 ASP HB3 H 1 3.274 0.02 . 2 . . . . . . . . 5324 1 1467 . 1 1 155 155 ASP N N 15 129.297 0.05 . 1 . . . . . . . . 5324 1 1468 . 1 1 156 156 TYR CA C 13 58.409 0.05 . 1 . . . . . . . . 5324 1 1469 . 1 1 156 156 TYR CB C 13 34.337 0.05 . 1 . . . . . . . . 5324 1 1470 . 1 1 156 156 TYR CD1 C 13 130.426 0.05 . 1 . . . . . . . . 5324 1 1471 . 1 1 156 156 TYR CD2 C 13 130.426 0.05 . 1 . . . . . . . . 5324 1 1472 . 1 1 156 156 TYR H H 1 8.575 0.02 . 1 . . . . . . . . 5324 1 1473 . 1 1 156 156 TYR HA H 1 5.244 0.02 . 1 . . . . . . . . 5324 1 1474 . 1 1 156 156 TYR HB2 H 1 2.147 0.02 . 2 . . . . . . . . 5324 1 1475 . 1 1 156 156 TYR HB3 H 1 2.416 0.02 . 2 . . . . . . . . 5324 1 1476 . 1 1 156 156 TYR HD1 H 1 6.550 0.02 . 1 . . . . . . . . 5324 1 1477 . 1 1 156 156 TYR HE1 H 1 6.601 0.02 . 1 . . . . . . . . 5324 1 1478 . 1 1 156 156 TYR HE2 H 1 6.601 0.02 . 1 . . . . . . . . 5324 1 1479 . 1 1 156 156 TYR HD2 H 1 6.550 0.02 . 1 . . . . . . . . 5324 1 1480 . 1 1 156 156 TYR N N 15 118.884 0.05 . 1 . . . . . . . . 5324 1 1481 . 1 1 157 157 ASN CA C 13 53.231 0.05 . 1 . . . . . . . . 5324 1 1482 . 1 1 157 157 ASN CB C 13 34.249 0.05 . 1 . . . . . . . . 5324 1 1483 . 1 1 157 157 ASN H H 1 7.901 0.02 . 1 . . . . . . . . 5324 1 1484 . 1 1 157 157 ASN HA H 1 4.101 0.02 . 1 . . . . . . . . 5324 1 1485 . 1 1 157 157 ASN HB2 H 1 2.953 0.02 . 2 . . . . . . . . 5324 1 1486 . 1 1 157 157 ASN HB3 H 1 2.715 0.02 . 2 . . . . . . . . 5324 1 1487 . 1 1 157 157 ASN HD21 H 1 7.740 0.02 . 1 . . . . . . . . 5324 1 1488 . 1 1 157 157 ASN HD22 H 1 6.891 0.02 . 1 . . . . . . . . 5324 1 1489 . 1 1 157 157 ASN N N 15 116.286 0.05 . 1 . . . . . . . . 5324 1 1490 . 1 1 157 157 ASN ND2 N 15 113.311 0.05 . 1 . . . . . . . . 5324 1 1491 . 1 1 158 158 GLU CA C 13 55.485 0.05 . 1 . . . . . . . . 5324 1 1492 . 1 1 158 158 GLU CB C 13 25.889 0.05 . 1 . . . . . . . . 5324 1 1493 . 1 1 158 158 GLU CG C 13 34.394 0.05 . 1 . . . . . . . . 5324 1 1494 . 1 1 158 158 GLU H H 1 8.966 0.02 . 1 . . . . . . . . 5324 1 1495 . 1 1 158 158 GLU HA H 1 4.004 0.02 . 1 . . . . . . . . 5324 1 1496 . 1 1 158 158 GLU HB2 H 1 2.299 0.02 . 2 . . . . . . . . 5324 1 1497 . 1 1 158 158 GLU HB3 H 1 2.180 0.02 . 2 . . . . . . . . 5324 1 1498 . 1 1 158 158 GLU HG2 H 1 3.003 0.02 . 2 . . . . . . . . 5324 1 1499 . 1 1 158 158 GLU HG3 H 1 2.669 0.02 . 2 . . . . . . . . 5324 1 1500 . 1 1 158 158 GLU N N 15 122.338 0.05 . 1 . . . . . . . . 5324 1 1501 . 1 1 159 159 PHE CA C 13 58.479 0.05 . 1 . . . . . . . . 5324 1 1502 . 1 1 159 159 PHE CB C 13 36.613 0.05 . 1 . . . . . . . . 5324 1 1503 . 1 1 159 159 PHE H H 1 8.637 0.02 . 1 . . . . . . . . 5324 1 1504 . 1 1 159 159 PHE HA H 1 3.955 0.02 . 1 . . . . . . . . 5324 1 1505 . 1 1 159 159 PHE HB2 H 1 3.508 0.02 . 2 . . . . . . . . 5324 1 1506 . 1 1 159 159 PHE HB3 H 1 3.189 0.02 . 2 . . . . . . . . 5324 1 1507 . 1 1 159 159 PHE HD1 H 1 7.009 0.02 . 1 . . . . . . . . 5324 1 1508 . 1 1 159 159 PHE HE1 H 1 6.582 0.02 . 1 . . . . . . . . 5324 1 1509 . 1 1 159 159 PHE HE2 H 1 6.582 0.02 . 1 . . . . . . . . 5324 1 1510 . 1 1 159 159 PHE HD2 H 1 7.009 0.02 . 1 . . . . . . . . 5324 1 1511 . 1 1 159 159 PHE N N 15 122.902 0.05 . 1 . . . . . . . . 5324 1 1512 . 1 1 160 160 VAL CA C 13 64.094 0.05 . 1 . . . . . . . . 5324 1 1513 . 1 1 160 160 VAL CB C 13 27.826 0.05 . 1 . . . . . . . . 5324 1 1514 . 1 1 160 160 VAL CG1 C 13 19.883 0.05 . 1 . . . . . . . . 5324 1 1515 . 1 1 160 160 VAL CG2 C 13 17.937 0.05 . 1 . . . . . . . . 5324 1 1516 . 1 1 160 160 VAL H H 1 8.677 0.02 . 1 . . . . . . . . 5324 1 1517 . 1 1 160 160 VAL HA H 1 3.024 0.02 . 1 . . . . . . . . 5324 1 1518 . 1 1 160 160 VAL HB H 1 1.806 0.02 . 1 . . . . . . . . 5324 1 1519 . 1 1 160 160 VAL HG11 H 1 0.704 0.02 . 2 . . . . . . . . 5324 1 1520 . 1 1 160 160 VAL HG12 H 1 0.704 0.02 . 2 . . . . . . . . 5324 1 1521 . 1 1 160 160 VAL HG13 H 1 0.704 0.02 . 2 . . . . . . . . 5324 1 1522 . 1 1 160 160 VAL HG21 H 1 0.515 0.02 . 2 . . . . . . . . 5324 1 1523 . 1 1 160 160 VAL HG22 H 1 0.515 0.02 . 2 . . . . . . . . 5324 1 1524 . 1 1 160 160 VAL HG23 H 1 0.515 0.02 . 2 . . . . . . . . 5324 1 1525 . 1 1 160 160 VAL N N 15 120.218 0.05 . 1 . . . . . . . . 5324 1 1526 . 1 1 161 161 ALA CA C 13 51.576 0.05 . 1 . . . . . . . . 5324 1 1527 . 1 1 161 161 ALA CB C 13 14.036 0.05 . 1 . . . . . . . . 5324 1 1528 . 1 1 161 161 ALA H H 1 7.793 0.02 . 1 . . . . . . . . 5324 1 1529 . 1 1 161 161 ALA HA H 1 3.974 0.02 . 1 . . . . . . . . 5324 1 1530 . 1 1 161 161 ALA HB1 H 1 1.392 0.02 . 1 . . . . . . . . 5324 1 1531 . 1 1 161 161 ALA HB2 H 1 1.392 0.02 . 1 . . . . . . . . 5324 1 1532 . 1 1 161 161 ALA HB3 H 1 1.392 0.02 . 1 . . . . . . . . 5324 1 1533 . 1 1 161 161 ALA N N 15 119.934 0.05 . 1 . . . . . . . . 5324 1 1534 . 1 1 162 162 MET CA C 13 55.190 0.05 . 1 . . . . . . . . 5324 1 1535 . 1 1 162 162 MET CB C 13 27.975 0.05 . 1 . . . . . . . . 5324 1 1536 . 1 1 162 162 MET H H 1 7.379 0.02 . 1 . . . . . . . . 5324 1 1537 . 1 1 162 162 MET HA H 1 3.914 0.02 . 1 . . . . . . . . 5324 1 1538 . 1 1 162 162 MET HB2 H 1 2.506 0.02 . 2 . . . . . . . . 5324 1 1539 . 1 1 162 162 MET HB3 H 1 2.092 0.02 . 2 . . . . . . . . 5324 1 1540 . 1 1 162 162 MET HG2 H 1 2.257 0.02 . 1 . . . . . . . . 5324 1 1541 . 1 1 162 162 MET HG3 H 1 2.257 0.02 . 1 . . . . . . . . 5324 1 1542 . 1 1 162 162 MET N N 15 117.158 0.05 . 1 . . . . . . . . 5324 1 1543 . 1 1 163 163 MET CA C 13 52.245 0.05 . 1 . . . . . . . . 5324 1 1544 . 1 1 163 163 MET H H 1 7.566 0.02 . 1 . . . . . . . . 5324 1 1545 . 1 1 163 163 MET N N 15 116.185 0.05 . 1 . . . . . . . . 5324 1 1546 . 1 1 164 164 GLN CA C 13 52.955 0.05 . 1 . . . . . . . . 5324 1 1547 . 1 1 164 164 GLN CB C 13 25.253 0.05 . 1 . . . . . . . . 5324 1 1548 . 1 1 164 164 GLN CG C 13 30.716 0.05 . 1 . . . . . . . . 5324 1 1549 . 1 1 164 164 GLN H H 1 7.832 0.02 . 1 . . . . . . . . 5324 1 1550 . 1 1 164 164 GLN HA H 1 4.192 0.02 . 1 . . . . . . . . 5324 1 1551 . 1 1 164 164 GLN HB2 H 1 2.021 0.02 . 2 . . . . . . . . 5324 1 1552 . 1 1 164 164 GLN HB3 H 1 1.929 0.02 . 2 . . . . . . . . 5324 1 1553 . 1 1 164 164 GLN HG2 H 1 2.384 0.02 . 2 . . . . . . . . 5324 1 1554 . 1 1 164 164 GLN HG3 H 1 2.182 0.02 . 2 . . . . . . . . 5324 1 1555 . 1 1 164 164 GLN HE21 H 1 7.307 0.02 . 1 . . . . . . . . 5324 1 1556 . 1 1 164 164 GLN HE22 H 1 6.755 0.02 . 1 . . . . . . . . 5324 1 1557 . 1 1 164 164 GLN N N 15 115.701 0.05 . 1 . . . . . . . . 5324 1 1558 . 1 1 164 164 GLN NE2 N 15 112.021 0.05 . 1 . . . . . . . . 5324 1 1559 . 1 1 165 165 LYS CA C 13 53.713 0.05 . 1 . . . . . . . . 5324 1 1560 . 1 1 165 165 LYS CB C 13 29.162 0.05 . 1 . . . . . . . . 5324 1 1561 . 1 1 165 165 LYS H H 1 7.388 0.02 . 1 . . . . . . . . 5324 1 1562 . 1 1 165 165 LYS HA H 1 4.203 0.02 . 1 . . . . . . . . 5324 1 1563 . 1 1 165 165 LYS HB2 H 1 1.809 0.02 . 1 . . . . . . . . 5324 1 1564 . 1 1 165 165 LYS HB3 H 1 1.809 0.02 . 1 . . . . . . . . 5324 1 1565 . 1 1 165 165 LYS HE2 H 1 2.439 0.02 . 1 . . . . . . . . 5324 1 1566 . 1 1 165 165 LYS HE3 H 1 2.439 0.02 . 1 . . . . . . . . 5324 1 1567 . 1 1 165 165 LYS N N 15 121.075 0.05 . 1 . . . . . . . . 5324 1 1568 . 1 1 166 166 GLY CA C 13 41.857 0.05 . 1 . . . . . . . . 5324 1 1569 . 1 1 166 166 GLY H H 1 8.387 0.02 . 1 . . . . . . . . 5324 1 1570 . 1 1 166 166 GLY HA2 H 1 3.899 0.02 . 2 . . . . . . . . 5324 1 1571 . 1 1 166 166 GLY HA3 H 1 4.606 0.02 . 2 . . . . . . . . 5324 1 1572 . 1 1 166 166 GLY N N 15 110.252 0.05 . 1 . . . . . . . . 5324 1 1573 . 1 1 167 167 SER CA C 13 54.924 0.05 . 1 . . . . . . . . 5324 1 1574 . 1 1 167 167 SER CB C 13 60.900 0.05 . 1 . . . . . . . . 5324 1 1575 . 1 1 167 167 SER H H 1 8.044 0.02 . 1 . . . . . . . . 5324 1 1576 . 1 1 167 167 SER HA H 1 3.787 0.02 . 1 . . . . . . . . 5324 1 1577 . 1 1 167 167 SER HB2 H 1 4.460 0.02 . 2 . . . . . . . . 5324 1 1578 . 1 1 167 167 SER HB3 H 1 4.609 0.02 . 2 . . . . . . . . 5324 1 1579 . 1 1 167 167 SER N N 15 115.497 0.05 . 1 . . . . . . . . 5324 1 1580 . 1 1 168 168 ILE CA C 13 58.411 0.05 . 1 . . . . . . . . 5324 1 1581 . 1 1 168 168 ILE CB C 13 34.566 0.05 . 1 . . . . . . . . 5324 1 1582 . 1 1 168 168 ILE CG1 C 13 24.129 0.05 . 1 . . . . . . . . 5324 1 1583 . 1 1 168 168 ILE CG2 C 13 14.467 0.05 . 1 . . . . . . . . 5324 1 1584 . 1 1 168 168 ILE CD1 C 13 9.625 0.05 . 1 . . . . . . . . 5324 1 1585 . 1 1 168 168 ILE H H 1 8.223 0.02 . 1 . . . . . . . . 5324 1 1586 . 1 1 168 168 ILE HA H 1 4.190 0.02 . 1 . . . . . . . . 5324 1 1587 . 1 1 168 168 ILE HB H 1 1.901 0.02 . 1 . . . . . . . . 5324 1 1588 . 1 1 168 168 ILE HG12 H 1 1.428 0.02 . 1 . . . . . . . . 5324 1 1589 . 1 1 168 168 ILE HG13 H 1 1.428 0.02 . 1 . . . . . . . . 5324 1 1590 . 1 1 168 168 ILE HG21 H 1 0.872 0.02 . 1 . . . . . . . . 5324 1 1591 . 1 1 168 168 ILE HG22 H 1 0.872 0.02 . 1 . . . . . . . . 5324 1 1592 . 1 1 168 168 ILE HG23 H 1 0.872 0.02 . 1 . . . . . . . . 5324 1 1593 . 1 1 168 168 ILE HD11 H 1 0.779 0.02 . 1 . . . . . . . . 5324 1 1594 . 1 1 168 168 ILE HD12 H 1 0.779 0.02 . 1 . . . . . . . . 5324 1 1595 . 1 1 168 168 ILE HD13 H 1 0.779 0.02 . 1 . . . . . . . . 5324 1 1596 . 1 1 168 168 ILE N N 15 121.583 0.05 . 1 . . . . . . . . 5324 1 1597 . 1 1 169 169 THR CA C 13 58.224 0.05 . 1 . . . . . . . . 5324 1 1598 . 1 1 169 169 THR CB C 13 66.656 0.05 . 1 . . . . . . . . 5324 1 1599 . 1 1 169 169 THR CG2 C 13 18.224 0.05 . 1 . . . . . . . . 5324 1 1600 . 1 1 169 169 THR H H 1 7.966 0.02 . 1 . . . . . . . . 5324 1 1601 . 1 1 169 169 THR HA H 1 4.355 0.02 . 1 . . . . . . . . 5324 1 1602 . 1 1 169 169 THR HB H 1 4.261 0.02 . 1 . . . . . . . . 5324 1 1603 . 1 1 169 169 THR HG21 H 1 1.139 0.02 . 1 . . . . . . . . 5324 1 1604 . 1 1 169 169 THR HG22 H 1 1.139 0.02 . 1 . . . . . . . . 5324 1 1605 . 1 1 169 169 THR HG23 H 1 1.139 0.02 . 1 . . . . . . . . 5324 1 1606 . 1 1 169 169 THR N N 15 114.704 0.05 . 1 . . . . . . . . 5324 1 1607 . 1 1 170 170 GLY CA C 13 42.331 0.05 . 1 . . . . . . . . 5324 1 1608 . 1 1 170 170 GLY H H 1 7.815 0.02 . 1 . . . . . . . . 5324 1 1609 . 1 1 170 170 GLY HA2 H 1 3.743 0.02 . 1 . . . . . . . . 5324 1 1610 . 1 1 170 170 GLY HA3 H 1 3.743 0.02 . 1 . . . . . . . . 5324 1 1611 . 1 1 170 170 GLY N N 15 116.625 0.05 . 1 . . . . . . . . 5324 1 stop_ save_