data_7105 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7105 _Entry.Title ; 1H, 13C and 15N chemical shift assignments for SRY.B in complex with 16-mer DNA ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-05-09 _Entry.Accession_date 2006-05-09 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Katherine Stott . . . 7105 2 George Tang . S. . 7105 3 Keng-Boon Lee . . . 7105 4 Jean Thomas . O. . 7105 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7105 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 619 7105 '15N chemical shifts' 163 7105 '1H chemical shifts' 1493 7105 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2010-07-14 2006-05-09 update BMRB 'update DNA residue label to two-letter code' 7105 1 . . 2006-08-07 2006-05-09 original author 'original release' 7105 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7105 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16813837 _Citation.Full_citation . _Citation.Title 'Structure of a Complex of Tandem HMG Boxes and DNA' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 360 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 90 _Citation.Page_last 104 _Citation.Year 2006 _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 Katherine Stott . . . 7105 1 2 George Tang . S.F. . 7105 1 3 Keng-Boon Lee . . . 7105 1 4 Jean Thomas . O. . 7105 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7105 _Assembly.ID 1 _Assembly.Name 'SRY.B in complex with 16-mer DNA' _Assembly.BMRB_code . _Assembly.Number_of_components 3 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'SRY.B in complex with 16-mer DNA' 1 $SRY.B . . yes native no no . . . 7105 1 2 'SRY.B in complex with 16-mer DNA strand 1' 2 $16-mer_DNA_1 . . yes native no no . . . 7105 1 3 'SRY.B in complex with 16-mer DNA strand 2' 3 $16-mer_DNA_2 . . yes native no no . . . 7105 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_SRY.B _Entity.Sf_category entity _Entity.Sf_framecode SRY.B _Entity.Entry_ID 7105 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name SRY.B _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 ; VQDRVKRPMNAFIVWSRDQR RKMALENPRMRNSEISKQLG YQWKMLTEAEKWPFFQEAQK LQAMHREKYPNYKYRKGETK KKFKDPNAPKRPPSAFFLFC SEYRPKIKGEHPGLSIGDVA KKLGEMWNNTAADDKQPYEK KAAKLKEKYEKDIAAYRAK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 159 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _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 PDB 2GZK . "Structure Of A Complex Of Tandem Hmg Boxes And Dna" . . . . . 100.00 159 100.00 100.00 1.04e-111 . . . . 7105 1 2 no DBJ BAG51867 . "unnamed protein product [Homo sapiens]" . . . . . 52.83 176 100.00 100.00 4.09e-44 . . . . 7105 1 3 no GB EGW08959 . "TRAF family member-associated NF-kappa-B activator [Cricetulus griseus]" . . . . . 52.83 427 97.62 98.81 3.79e-48 . . . . 7105 1 4 no REF XP_004384214 . "PREDICTED: high mobility group protein B1 isoform 2 [Trichechus manatus latirostris]" . . . . . 52.83 176 100.00 100.00 5.25e-44 . . . . 7105 1 5 no REF XP_004435356 . "PREDICTED: high mobility group protein B1 isoform 3 [Ceratotherium simum simum]" . . . . . 52.83 176 100.00 100.00 3.23e-44 . . . . 7105 1 6 no REF XP_004680239 . "PREDICTED: high mobility group protein B1 isoform X3 [Condylura cristata]" . . . . . 52.83 176 100.00 100.00 3.37e-44 . . . . 7105 1 7 no REF XP_005902227 . "PREDICTED: high mobility group protein B1 isoform X3 [Bos mutus]" . . . . . 52.83 176 100.00 100.00 3.68e-44 . . . . 7105 1 8 no REF XP_007956028 . "PREDICTED: high mobility group protein B1 isoform X2 [Orycteropus afer afer]" . . . . . 52.83 176 100.00 100.00 9.19e-44 . . . . 7105 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 1 VAL . 7105 1 2 2 GLN . 7105 1 3 3 ASP . 7105 1 4 4 ARG . 7105 1 5 5 VAL . 7105 1 6 6 LYS . 7105 1 7 7 ARG . 7105 1 8 8 PRO . 7105 1 9 9 MET . 7105 1 10 10 ASN . 7105 1 11 11 ALA . 7105 1 12 12 PHE . 7105 1 13 13 ILE . 7105 1 14 14 VAL . 7105 1 15 15 TRP . 7105 1 16 16 SER . 7105 1 17 17 ARG . 7105 1 18 18 ASP . 7105 1 19 19 GLN . 7105 1 20 20 ARG . 7105 1 21 21 ARG . 7105 1 22 22 LYS . 7105 1 23 23 MET . 7105 1 24 24 ALA . 7105 1 25 25 LEU . 7105 1 26 26 GLU . 7105 1 27 27 ASN . 7105 1 28 28 PRO . 7105 1 29 29 ARG . 7105 1 30 30 MET . 7105 1 31 31 ARG . 7105 1 32 32 ASN . 7105 1 33 33 SER . 7105 1 34 34 GLU . 7105 1 35 35 ILE . 7105 1 36 36 SER . 7105 1 37 37 LYS . 7105 1 38 38 GLN . 7105 1 39 39 LEU . 7105 1 40 40 GLY . 7105 1 41 41 TYR . 7105 1 42 42 GLN . 7105 1 43 43 TRP . 7105 1 44 44 LYS . 7105 1 45 45 MET . 7105 1 46 46 LEU . 7105 1 47 47 THR . 7105 1 48 48 GLU . 7105 1 49 49 ALA . 7105 1 50 50 GLU . 7105 1 51 51 LYS . 7105 1 52 52 TRP . 7105 1 53 53 PRO . 7105 1 54 54 PHE . 7105 1 55 55 PHE . 7105 1 56 56 GLN . 7105 1 57 57 GLU . 7105 1 58 58 ALA . 7105 1 59 59 GLN . 7105 1 60 60 LYS . 7105 1 61 61 LEU . 7105 1 62 62 GLN . 7105 1 63 63 ALA . 7105 1 64 64 MET . 7105 1 65 65 HIS . 7105 1 66 66 ARG . 7105 1 67 67 GLU . 7105 1 68 68 LYS . 7105 1 69 69 TYR . 7105 1 70 70 PRO . 7105 1 71 71 ASN . 7105 1 72 72 TYR . 7105 1 73 73 LYS . 7105 1 74 74 TYR . 7105 1 75 75 ARG . 7105 1 76 76 LYS . 7105 1 77 77 GLY . 7105 1 78 78 GLU . 7105 1 79 79 THR . 7105 1 80 80 LYS . 7105 1 81 81 LYS . 7105 1 82 82 LYS . 7105 1 83 83 PHE . 7105 1 84 84 LYS . 7105 1 85 85 ASP . 7105 1 86 86 PRO . 7105 1 87 87 ASN . 7105 1 88 88 ALA . 7105 1 89 89 PRO . 7105 1 90 90 LYS . 7105 1 91 91 ARG . 7105 1 92 92 PRO . 7105 1 93 93 PRO . 7105 1 94 94 SER . 7105 1 95 95 ALA . 7105 1 96 96 PHE . 7105 1 97 97 PHE . 7105 1 98 98 LEU . 7105 1 99 99 PHE . 7105 1 100 100 CYS . 7105 1 101 101 SER . 7105 1 102 102 GLU . 7105 1 103 103 TYR . 7105 1 104 104 ARG . 7105 1 105 105 PRO . 7105 1 106 106 LYS . 7105 1 107 107 ILE . 7105 1 108 108 LYS . 7105 1 109 109 GLY . 7105 1 110 110 GLU . 7105 1 111 111 HIS . 7105 1 112 112 PRO . 7105 1 113 113 GLY . 7105 1 114 114 LEU . 7105 1 115 115 SER . 7105 1 116 116 ILE . 7105 1 117 117 GLY . 7105 1 118 118 ASP . 7105 1 119 119 VAL . 7105 1 120 120 ALA . 7105 1 121 121 LYS . 7105 1 122 122 LYS . 7105 1 123 123 LEU . 7105 1 124 124 GLY . 7105 1 125 125 GLU . 7105 1 126 126 MET . 7105 1 127 127 TRP . 7105 1 128 128 ASN . 7105 1 129 129 ASN . 7105 1 130 130 THR . 7105 1 131 131 ALA . 7105 1 132 132 ALA . 7105 1 133 133 ASP . 7105 1 134 134 ASP . 7105 1 135 135 LYS . 7105 1 136 136 GLN . 7105 1 137 137 PRO . 7105 1 138 138 TYR . 7105 1 139 139 GLU . 7105 1 140 140 LYS . 7105 1 141 141 LYS . 7105 1 142 142 ALA . 7105 1 143 143 ALA . 7105 1 144 144 LYS . 7105 1 145 145 LEU . 7105 1 146 146 LYS . 7105 1 147 147 GLU . 7105 1 148 148 LYS . 7105 1 149 149 TYR . 7105 1 150 150 GLU . 7105 1 151 151 LYS . 7105 1 152 152 ASP . 7105 1 153 153 ILE . 7105 1 154 154 ALA . 7105 1 155 155 ALA . 7105 1 156 156 TYR . 7105 1 157 157 ARG . 7105 1 158 158 ALA . 7105 1 159 159 LYS . 7105 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 . VAL 1 1 7105 1 . GLN 2 2 7105 1 . ASP 3 3 7105 1 . ARG 4 4 7105 1 . VAL 5 5 7105 1 . LYS 6 6 7105 1 . ARG 7 7 7105 1 . PRO 8 8 7105 1 . MET 9 9 7105 1 . ASN 10 10 7105 1 . ALA 11 11 7105 1 . PHE 12 12 7105 1 . ILE 13 13 7105 1 . VAL 14 14 7105 1 . TRP 15 15 7105 1 . SER 16 16 7105 1 . ARG 17 17 7105 1 . ASP 18 18 7105 1 . GLN 19 19 7105 1 . ARG 20 20 7105 1 . ARG 21 21 7105 1 . LYS 22 22 7105 1 . MET 23 23 7105 1 . ALA 24 24 7105 1 . LEU 25 25 7105 1 . GLU 26 26 7105 1 . ASN 27 27 7105 1 . PRO 28 28 7105 1 . ARG 29 29 7105 1 . MET 30 30 7105 1 . ARG 31 31 7105 1 . ASN 32 32 7105 1 . SER 33 33 7105 1 . GLU 34 34 7105 1 . ILE 35 35 7105 1 . SER 36 36 7105 1 . LYS 37 37 7105 1 . GLN 38 38 7105 1 . LEU 39 39 7105 1 . GLY 40 40 7105 1 . TYR 41 41 7105 1 . GLN 42 42 7105 1 . TRP 43 43 7105 1 . LYS 44 44 7105 1 . MET 45 45 7105 1 . LEU 46 46 7105 1 . THR 47 47 7105 1 . GLU 48 48 7105 1 . ALA 49 49 7105 1 . GLU 50 50 7105 1 . LYS 51 51 7105 1 . TRP 52 52 7105 1 . PRO 53 53 7105 1 . PHE 54 54 7105 1 . PHE 55 55 7105 1 . GLN 56 56 7105 1 . GLU 57 57 7105 1 . ALA 58 58 7105 1 . GLN 59 59 7105 1 . LYS 60 60 7105 1 . LEU 61 61 7105 1 . GLN 62 62 7105 1 . ALA 63 63 7105 1 . MET 64 64 7105 1 . HIS 65 65 7105 1 . ARG 66 66 7105 1 . GLU 67 67 7105 1 . LYS 68 68 7105 1 . TYR 69 69 7105 1 . PRO 70 70 7105 1 . ASN 71 71 7105 1 . TYR 72 72 7105 1 . LYS 73 73 7105 1 . TYR 74 74 7105 1 . ARG 75 75 7105 1 . LYS 76 76 7105 1 . GLY 77 77 7105 1 . GLU 78 78 7105 1 . THR 79 79 7105 1 . LYS 80 80 7105 1 . LYS 81 81 7105 1 . LYS 82 82 7105 1 . PHE 83 83 7105 1 . LYS 84 84 7105 1 . ASP 85 85 7105 1 . PRO 86 86 7105 1 . ASN 87 87 7105 1 . ALA 88 88 7105 1 . PRO 89 89 7105 1 . LYS 90 90 7105 1 . ARG 91 91 7105 1 . PRO 92 92 7105 1 . PRO 93 93 7105 1 . SER 94 94 7105 1 . ALA 95 95 7105 1 . PHE 96 96 7105 1 . PHE 97 97 7105 1 . LEU 98 98 7105 1 . PHE 99 99 7105 1 . CYS 100 100 7105 1 . SER 101 101 7105 1 . GLU 102 102 7105 1 . TYR 103 103 7105 1 . ARG 104 104 7105 1 . PRO 105 105 7105 1 . LYS 106 106 7105 1 . ILE 107 107 7105 1 . LYS 108 108 7105 1 . GLY 109 109 7105 1 . GLU 110 110 7105 1 . HIS 111 111 7105 1 . PRO 112 112 7105 1 . GLY 113 113 7105 1 . LEU 114 114 7105 1 . SER 115 115 7105 1 . ILE 116 116 7105 1 . GLY 117 117 7105 1 . ASP 118 118 7105 1 . VAL 119 119 7105 1 . ALA 120 120 7105 1 . LYS 121 121 7105 1 . LYS 122 122 7105 1 . LEU 123 123 7105 1 . GLY 124 124 7105 1 . GLU 125 125 7105 1 . MET 126 126 7105 1 . TRP 127 127 7105 1 . ASN 128 128 7105 1 . ASN 129 129 7105 1 . THR 130 130 7105 1 . ALA 131 131 7105 1 . ALA 132 132 7105 1 . ASP 133 133 7105 1 . ASP 134 134 7105 1 . LYS 135 135 7105 1 . GLN 136 136 7105 1 . PRO 137 137 7105 1 . TYR 138 138 7105 1 . GLU 139 139 7105 1 . LYS 140 140 7105 1 . LYS 141 141 7105 1 . ALA 142 142 7105 1 . ALA 143 143 7105 1 . LYS 144 144 7105 1 . LEU 145 145 7105 1 . LYS 146 146 7105 1 . GLU 147 147 7105 1 . LYS 148 148 7105 1 . TYR 149 149 7105 1 . GLU 150 150 7105 1 . LYS 151 151 7105 1 . ASP 152 152 7105 1 . ILE 153 153 7105 1 . ALA 154 154 7105 1 . ALA 155 155 7105 1 . TYR 156 156 7105 1 . ARG 157 157 7105 1 . ALA 158 158 7105 1 . LYS 159 159 7105 1 stop_ save_ save_16-mer_DNA_1 _Entity.Sf_category entity _Entity.Sf_framecode 16-mer_DNA_1 _Entity.Entry_ID 7105 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name '16-mer DNA trand 1' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code GGGATCTAAACAATGC _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 16 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _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 . 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 . DG . 7105 2 2 . DG . 7105 2 3 . DG . 7105 2 4 . DA . 7105 2 5 . DT . 7105 2 6 . DC . 7105 2 7 . DT . 7105 2 8 . DA . 7105 2 9 . DA . 7105 2 10 . DA . 7105 2 11 . DC . 7105 2 12 . DA . 7105 2 13 . DA . 7105 2 14 . DT . 7105 2 15 . DG . 7105 2 16 . DC . 7105 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . DG 1 1 7105 2 . DG 2 2 7105 2 . DG 3 3 7105 2 . DA 4 4 7105 2 . DT 5 5 7105 2 . DC 6 6 7105 2 . DT 7 7 7105 2 . DA 8 8 7105 2 . DA 9 9 7105 2 . DA 10 10 7105 2 . DC 11 11 7105 2 . DA 12 12 7105 2 . DA 13 13 7105 2 . DT 14 14 7105 2 . DG 15 15 7105 2 . DC 16 16 7105 2 stop_ save_ save_16-mer_DNA_2 _Entity.Sf_category entity _Entity.Sf_framecode 16-mer_DNA_2 _Entity.Entry_ID 7105 _Entity.ID 3 _Entity.BMRB_code . _Entity.Name '16-mer DNA strand 2' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code GCATTGTTTAGATCCC _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 16 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _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 . 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 . DG . 7105 3 2 . DC . 7105 3 3 . DA . 7105 3 4 . DT . 7105 3 5 . DT . 7105 3 6 . DG . 7105 3 7 . DT . 7105 3 8 . DT . 7105 3 9 . DT . 7105 3 10 . DA . 7105 3 11 . DG . 7105 3 12 . DA . 7105 3 13 . DT . 7105 3 14 . DC . 7105 3 15 . DC . 7105 3 16 . DC . 7105 3 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 . DG 1 1 7105 3 . DC 2 2 7105 3 . DA 3 3 7105 3 . DT 4 4 7105 3 . DT 5 5 7105 3 . DG 6 6 7105 3 . DT 7 7 7105 3 . DT 8 8 7105 3 . DT 9 9 7105 3 . DA 10 10 7105 3 . DG 11 11 7105 3 . DA 12 12 7105 3 . DT 13 13 7105 3 . DC 14 14 7105 3 . DC 15 15 7105 3 . DC 16 16 7105 3 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 7105 _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 $SRY.B . 9606 . no . Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 7105 1 2 2 $16-mer_DNA_1 . . . no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7105 1 3 3 $16-mer_DNA_2 . . . no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7105 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 7105 _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 $SRY.B . 'recombinant technology' . 'E. coli' . . . . . . . . . . . . . . . . . . . . . . . . . . . 7105 1 2 2 $16-mer_DNA_1 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7105 1 3 3 $16-mer_DNA_2 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7105 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7105 _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 SRY.B '[U-99% 13C; U-99% 15N]' . . . . . . 1 . . mM . . . . 7105 1 2 'Sodium phosphate' . . . . . . . 10 . . mM . . . . 7105 1 3 EDTA . . . . . . . 1 . . mM . . . . 7105 1 4 DTT '[U-98% 2H]' . . . . . . 2 . . mM . . . . 7105 1 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 7105 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.8 0.1 pH 7105 1 temperature 310 . K 7105 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_500MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 500MHz_spectrometer _NMR_spectrometer.Entry_ID 7105 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_800MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800MHz_spectrometer _NMR_spectrometer.Entry_ID 7105 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 7105 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 2 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 3 '3D HNCA' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 6 '3D HNCO' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 7 3D(H)CC(CO)NH-TOCSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 8 '3D TOCSY-15N-HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 9 '3D NOESY-15N-HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 10 '3D HC(C)H-TOCSY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 11 '3D NOESY-13C-HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 12 '3D HNHA' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 13 '2D TOCSY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 14 '2D DQF-COSY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 15 '2D NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 16 '2D [F1]-13C/15N-filtered TOCSY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 17 '2D [F1]-13C/15N-filtered DQF COSY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 18 '2D [F1]-13C/15N-filtered NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 19 '3D [F1]-13C/15N-filtered NOESY-13C-HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 20 '2D [F1,F2]-13C/15N-filtered NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7105 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 7105 _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 . . . . . . . . . 7105 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1.0 . . . . . . . . . 7105 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 7105 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7105 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _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 isotropic 7105 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 VAL H H 1 7.989 0.006 . 1 . . . . 1 VAL H . 7105 1 2 . 1 1 1 1 VAL HA H 1 4.176 0.007 . 1 . . . . 1 VAL HA . 7105 1 3 . 1 1 1 1 VAL HB H 1 2.096 0.002 . 1 . . . . 1 VAL HB . 7105 1 4 . 1 1 1 1 VAL HG11 H 1 0.983 0.000 . 1 . . . . 1 VAL HG1 . 7105 1 5 . 1 1 1 1 VAL HG12 H 1 0.983 0.000 . 1 . . . . 1 VAL HG1 . 7105 1 6 . 1 1 1 1 VAL HG13 H 1 0.983 0.000 . 1 . . . . 1 VAL HG1 . 7105 1 7 . 1 1 1 1 VAL HG21 H 1 0.983 0.000 . 1 . . . . 1 VAL HG2 . 7105 1 8 . 1 1 1 1 VAL HG22 H 1 0.983 0.000 . 1 . . . . 1 VAL HG2 . 7105 1 9 . 1 1 1 1 VAL HG23 H 1 0.983 0.000 . 1 . . . . 1 VAL HG2 . 7105 1 10 . 1 1 1 1 VAL CA C 13 62.706 0.020 . 1 . . . . 1 VAL CA . 7105 1 11 . 1 1 1 1 VAL CB C 13 32.947 0.000 . 1 . . . . 1 VAL CB . 7105 1 12 . 1 1 1 1 VAL CG1 C 13 20.842 0.000 . 1 . . . . 1 VAL CG1 . 7105 1 13 . 1 1 1 1 VAL CG2 C 13 20.842 0.000 . 1 . . . . 1 VAL CG2 . 7105 1 14 . 1 1 1 1 VAL N N 15 120.323 0.000 . 1 . . . . 1 VAL N . 7105 1 15 . 1 1 2 2 GLN H H 1 8.529 0.004 . 1 . . . . 2 GLN H . 7105 1 16 . 1 1 2 2 GLN HA H 1 4.403 0.013 . 1 . . . . 2 GLN HA . 7105 1 17 . 1 1 2 2 GLN HB2 H 1 2.125 0.008 . 2 . . . . 2 GLN HB2 . 7105 1 18 . 1 1 2 2 GLN HB3 H 1 2.024 0.001 . 2 . . . . 2 GLN HB3 . 7105 1 19 . 1 1 2 2 GLN HG2 H 1 2.398 0.003 . 1 . . . . 2 GLN HG2 . 7105 1 20 . 1 1 2 2 GLN HE21 H 1 6.853 0.003 . 1 . . . . 2 GLN HE21 . 7105 1 21 . 1 1 2 2 GLN HE22 H 1 7.598 0.004 . 1 . . . . 2 GLN HE22 . 7105 1 22 . 1 1 2 2 GLN CA C 13 55.988 0.001 . 1 . . . . 2 GLN CA . 7105 1 23 . 1 1 2 2 GLN CB C 13 29.821 0.066 . 1 . . . . 2 GLN CB . 7105 1 24 . 1 1 2 2 GLN CG C 13 33.770 0.000 . 1 . . . . 2 GLN CG . 7105 1 25 . 1 1 2 2 GLN N N 15 124.040 0.000 . 1 . . . . 2 GLN N . 7105 1 26 . 1 1 2 2 GLN NE2 N 15 111.519 0.055 . 1 . . . . 2 GLN NE2 . 7105 1 27 . 1 1 3 3 ASP H H 1 8.457 0.002 . 1 . . . . 3 ASP H . 7105 1 28 . 1 1 3 3 ASP HA H 1 4.606 0.008 . 1 . . . . 3 ASP HA . 7105 1 29 . 1 1 3 3 ASP HB2 H 1 2.680 0.000 . 2 . . . . 3 ASP HB2 . 7105 1 30 . 1 1 3 3 ASP HB3 H 1 2.608 0.001 . 2 . . . . 3 ASP HB3 . 7105 1 31 . 1 1 3 3 ASP CA C 13 54.575 0.019 . 1 . . . . 3 ASP CA . 7105 1 32 . 1 1 3 3 ASP CB C 13 41.380 0.000 . 1 . . . . 3 ASP CB . 7105 1 33 . 1 1 3 3 ASP N N 15 122.374 0.064 . 1 . . . . 3 ASP N . 7105 1 34 . 1 1 4 4 ARG H H 1 8.148 0.002 . 1 . . . . 4 ARG H . 7105 1 35 . 1 1 4 4 ARG HA H 1 4.389 0.007 . 1 . . . . 4 ARG HA . 7105 1 36 . 1 1 4 4 ARG HB2 H 1 1.797 0.005 . 1 . . . . 4 ARG HB2 . 7105 1 37 . 1 1 4 4 ARG HB3 H 1 1.797 0.005 . 1 . . . . 4 ARG HB3 . 7105 1 38 . 1 1 4 4 ARG HG2 H 1 1.567 0.006 . 1 . . . . 4 ARG HG2 . 7105 1 39 . 1 1 4 4 ARG HG3 H 1 1.567 0.006 . 1 . . . . 4 ARG HG3 . 7105 1 40 . 1 1 4 4 ARG HD2 H 1 3.228 0.001 . 1 . . . . 4 ARG HD2 . 7105 1 41 . 1 1 4 4 ARG HD3 H 1 3.228 0.001 . 1 . . . . 4 ARG HD3 . 7105 1 42 . 1 1 4 4 ARG CA C 13 55.995 0.000 . 1 . . . . 4 ARG CA . 7105 1 43 . 1 1 4 4 ARG CB C 13 31.552 0.001 . 1 . . . . 4 ARG CB . 7105 1 44 . 1 1 4 4 ARG CG C 13 27.304 0.000 . 1 . . . . 4 ARG CG . 7105 1 45 . 1 1 4 4 ARG CD C 13 43.455 0.000 . 1 . . . . 4 ARG CD . 7105 1 46 . 1 1 4 4 ARG N N 15 121.101 0.047 . 1 . . . . 4 ARG N . 7105 1 47 . 1 1 5 5 VAL H H 1 8.348 0.004 . 1 . . . . 5 VAL H . 7105 1 48 . 1 1 5 5 VAL HA H 1 3.792 0.010 . 1 . . . . 5 VAL HA . 7105 1 49 . 1 1 5 5 VAL HB H 1 1.788 0.003 . 1 . . . . 5 VAL HB . 7105 1 50 . 1 1 5 5 VAL HG11 H 1 0.105 0.010 . 2 . . . . 5 VAL HG1 . 7105 1 51 . 1 1 5 5 VAL HG12 H 1 0.105 0.010 . 2 . . . . 5 VAL HG1 . 7105 1 52 . 1 1 5 5 VAL HG13 H 1 0.105 0.010 . 2 . . . . 5 VAL HG1 . 7105 1 53 . 1 1 5 5 VAL HG21 H 1 0.603 0.006 . 2 . . . . 5 VAL HG2 . 7105 1 54 . 1 1 5 5 VAL HG22 H 1 0.603 0.006 . 2 . . . . 5 VAL HG2 . 7105 1 55 . 1 1 5 5 VAL HG23 H 1 0.603 0.006 . 2 . . . . 5 VAL HG2 . 7105 1 56 . 1 1 5 5 VAL CA C 13 62.771 0.000 . 1 . . . . 5 VAL CA . 7105 1 57 . 1 1 5 5 VAL CB C 13 32.227 0.078 . 1 . . . . 5 VAL CB . 7105 1 58 . 1 1 5 5 VAL CG1 C 13 21.292 0.059 . 2 . . . . 5 VAL CG1 . 7105 1 59 . 1 1 5 5 VAL CG2 C 13 21.351 0.012 . 2 . . . . 5 VAL CG2 . 7105 1 60 . 1 1 5 5 VAL N N 15 125.592 0.024 . 1 . . . . 5 VAL N . 7105 1 61 . 1 1 6 6 LYS H H 1 8.265 0.002 . 1 . . . . 6 LYS H . 7105 1 62 . 1 1 6 6 LYS HA H 1 4.396 0.003 . 1 . . . . 6 LYS HA . 7105 1 63 . 1 1 6 6 LYS HB2 H 1 1.761 0.009 . 1 . . . . 6 LYS HB2 . 7105 1 64 . 1 1 6 6 LYS HB3 H 1 1.761 0.009 . 1 . . . . 6 LYS HB3 . 7105 1 65 . 1 1 6 6 LYS HG2 H 1 1.503 0.002 . 1 . . . . 6 LYS HG2 . 7105 1 66 . 1 1 6 6 LYS HG3 H 1 1.503 0.002 . 1 . . . . 6 LYS HG3 . 7105 1 67 . 1 1 6 6 LYS HD2 H 1 1.607 0.004 . 1 . . . . 6 LYS HD2 . 7105 1 68 . 1 1 6 6 LYS HD3 H 1 1.607 0.004 . 1 . . . . 6 LYS HD3 . 7105 1 69 . 1 1 6 6 LYS HE2 H 1 3.083 0.000 . 1 . . . . 6 LYS HE2 . 7105 1 70 . 1 1 6 6 LYS HE3 H 1 3.083 0.000 . 1 . . . . 6 LYS HE3 . 7105 1 71 . 1 1 6 6 LYS CA C 13 56.415 0.000 . 1 . . . . 6 LYS CA . 7105 1 72 . 1 1 6 6 LYS CB C 13 34.730 0.002 . 1 . . . . 6 LYS CB . 7105 1 73 . 1 1 6 6 LYS CG C 13 25.581 0.000 . 1 . . . . 6 LYS CG . 7105 1 74 . 1 1 6 6 LYS CD C 13 27.803 0.000 . 1 . . . . 6 LYS CD . 7105 1 75 . 1 1 6 6 LYS CE C 13 42.466 0.000 . 1 . . . . 6 LYS CE . 7105 1 76 . 1 1 6 6 LYS N N 15 127.469 0.000 . 1 . . . . 6 LYS N . 7105 1 77 . 1 1 7 7 ARG HA H 1 4.062 0.001 . 1 . . . . 7 ARG HA . 7105 1 78 . 1 1 7 7 ARG HB2 H 1 1.804 0.000 . 1 . . . . 7 ARG HB2 . 7105 1 79 . 1 1 7 7 ARG HB3 H 1 1.804 0.000 . 1 . . . . 7 ARG HB3 . 7105 1 80 . 1 1 7 7 ARG HG2 H 1 1.743 0.026 . 2 . . . . 7 ARG HG2 . 7105 1 81 . 1 1 7 7 ARG HG3 H 1 1.551 0.001 . 2 . . . . 7 ARG HG3 . 7105 1 82 . 1 1 7 7 ARG CA C 13 55.156 0.000 . 1 . . . . 7 ARG CA . 7105 1 83 . 1 1 7 7 ARG CB C 13 29.991 0.000 . 1 . . . . 7 ARG CB . 7105 1 84 . 1 1 7 7 ARG CG C 13 26.298 0.100 . 1 . . . . 7 ARG CG . 7105 1 85 . 1 1 8 8 PRO HA H 1 4.377 0.003 . 1 . . . . 8 PRO HA . 7105 1 86 . 1 1 8 8 PRO HB2 H 1 1.717 0.000 . 1 . . . . 8 PRO HB2 . 7105 1 87 . 1 1 8 8 PRO HB3 H 1 1.717 0.000 . 1 . . . . 8 PRO HB3 . 7105 1 88 . 1 1 8 8 PRO HG2 H 1 1.724 0.000 . 2 . . . . 8 PRO HG2 . 7105 1 89 . 1 1 8 8 PRO HG3 H 1 1.302 0.012 . 2 . . . . 8 PRO HG3 . 7105 1 90 . 1 1 8 8 PRO HD2 H 1 3.337 0.001 . 2 . . . . 8 PRO HD2 . 7105 1 91 . 1 1 8 8 PRO HD3 H 1 2.341 0.000 . 2 . . . . 8 PRO HD3 . 7105 1 92 . 1 1 8 8 PRO CA C 13 61.798 0.000 . 1 . . . . 8 PRO CA . 7105 1 93 . 1 1 8 8 PRO CB C 13 31.465 0.085 . 1 . . . . 8 PRO CB . 7105 1 94 . 1 1 8 8 PRO CG C 13 26.928 0.005 . 1 . . . . 8 PRO CG . 7105 1 95 . 1 1 8 8 PRO CD C 13 49.190 0.000 . 1 . . . . 8 PRO CD . 7105 1 96 . 1 1 9 9 MET H H 1 7.904 0.007 . 1 . . . . 9 MET H . 7105 1 97 . 1 1 9 9 MET HA H 1 4.127 0.002 . 1 . . . . 9 MET HA . 7105 1 98 . 1 1 9 9 MET HB2 H 1 1.894 0.010 . 2 . . . . 9 MET HB2 . 7105 1 99 . 1 1 9 9 MET HB3 H 1 1.622 0.005 . 2 . . . . 9 MET HB3 . 7105 1 100 . 1 1 9 9 MET HG2 H 1 2.650 0.000 . 2 . . . . 9 MET HG2 . 7105 1 101 . 1 1 9 9 MET HG3 H 1 2.656 0.008 . 2 . . . . 9 MET HG3 . 7105 1 102 . 1 1 9 9 MET HE1 H 1 2.041 0.008 . 1 . . . . 9 MET HE . 7105 1 103 . 1 1 9 9 MET HE2 H 1 2.041 0.008 . 1 . . . . 9 MET HE . 7105 1 104 . 1 1 9 9 MET HE3 H 1 2.041 0.008 . 1 . . . . 9 MET HE . 7105 1 105 . 1 1 9 9 MET CA C 13 56.705 0.000 . 1 . . . . 9 MET CA . 7105 1 106 . 1 1 9 9 MET CB C 13 36.622 0.100 . 1 . . . . 9 MET CB . 7105 1 107 . 1 1 9 9 MET CG C 13 33.197 0.129 . 1 . . . . 9 MET CG . 7105 1 108 . 1 1 9 9 MET CE C 13 17.400 0.026 . 1 . . . . 9 MET CE . 7105 1 109 . 1 1 9 9 MET N N 15 119.904 0.031 . 1 . . . . 9 MET N . 7105 1 110 . 1 1 10 10 ASN H H 1 8.301 0.004 . 1 . . . . 10 ASN H . 7105 1 111 . 1 1 10 10 ASN HA H 1 4.592 0.022 . 1 . . . . 10 ASN HA . 7105 1 112 . 1 1 10 10 ASN HB2 H 1 3.155 0.010 . 2 . . . . 10 ASN HB2 . 7105 1 113 . 1 1 10 10 ASN HB3 H 1 3.165 0.000 . 2 . . . . 10 ASN HB3 . 7105 1 114 . 1 1 10 10 ASN CA C 13 51.460 0.016 . 1 . . . . 10 ASN CA . 7105 1 115 . 1 1 10 10 ASN CB C 13 38.358 0.085 . 1 . . . . 10 ASN CB . 7105 1 116 . 1 1 10 10 ASN N N 15 119.147 0.035 . 1 . . . . 10 ASN N . 7105 1 117 . 1 1 11 11 ALA H H 1 8.605 0.010 . 1 . . . . 11 ALA H . 7105 1 118 . 1 1 11 11 ALA HA H 1 3.523 0.007 . 1 . . . . 11 ALA HA . 7105 1 119 . 1 1 11 11 ALA HB1 H 1 0.612 0.011 . 1 . . . . 11 ALA HB . 7105 1 120 . 1 1 11 11 ALA HB2 H 1 0.612 0.011 . 1 . . . . 11 ALA HB . 7105 1 121 . 1 1 11 11 ALA HB3 H 1 0.612 0.011 . 1 . . . . 11 ALA HB . 7105 1 122 . 1 1 11 11 ALA C C 13 177.445 0.000 . 1 . . . . 11 ALA C . 7105 1 123 . 1 1 11 11 ALA CA C 13 56.158 0.031 . 1 . . . . 11 ALA CA . 7105 1 124 . 1 1 11 11 ALA CB C 13 19.507 0.050 . 1 . . . . 11 ALA CB . 7105 1 125 . 1 1 11 11 ALA N N 15 117.218 0.051 . 1 . . . . 11 ALA N . 7105 1 126 . 1 1 12 12 PHE H H 1 7.152 0.006 . 1 . . . . 12 PHE H . 7105 1 127 . 1 1 12 12 PHE HA H 1 2.641 0.000 . 1 . . . . 12 PHE HA . 7105 1 128 . 1 1 12 12 PHE HB2 H 1 2.407 0.012 . 1 . . . . 12 PHE HB2 . 7105 1 129 . 1 1 12 12 PHE HB3 H 1 2.407 0.012 . 1 . . . . 12 PHE HB3 . 7105 1 130 . 1 1 12 12 PHE HD1 H 1 7.530 0.000 . 1 . . . . 12 PHE HD . 7105 1 131 . 1 1 12 12 PHE HD2 H 1 7.530 0.000 . 1 . . . . 12 PHE HD . 7105 1 132 . 1 1 12 12 PHE HE1 H 1 7.687 0.015 . 1 . . . . 12 PHE HE . 7105 1 133 . 1 1 12 12 PHE HE2 H 1 7.687 0.015 . 1 . . . . 12 PHE HE . 7105 1 134 . 1 1 12 12 PHE HZ H 1 7.100 0.000 . 1 . . . . 12 PHE HZ . 7105 1 135 . 1 1 12 12 PHE CA C 13 59.777 0.039 . 1 . . . . 12 PHE CA . 7105 1 136 . 1 1 12 12 PHE CB C 13 38.168 0.002 . 1 . . . . 12 PHE CB . 7105 1 137 . 1 1 12 12 PHE CD1 C 13 131.717 0.000 . 1 . . . . 12 PHE CD . 7105 1 138 . 1 1 12 12 PHE CD2 C 13 131.717 0.000 . 1 . . . . 12 PHE CD . 7105 1 139 . 1 1 12 12 PHE CE1 C 13 129.902 0.064 . 1 . . . . 12 PHE CE . 7105 1 140 . 1 1 12 12 PHE CE2 C 13 129.902 0.064 . 1 . . . . 12 PHE CE . 7105 1 141 . 1 1 12 12 PHE CZ C 13 132.458 0.000 . 1 . . . . 12 PHE CZ . 7105 1 142 . 1 1 12 12 PHE N N 15 113.321 0.059 . 1 . . . . 12 PHE N . 7105 1 143 . 1 1 13 13 ILE H H 1 7.665 0.001 . 1 . . . . 13 ILE H . 7105 1 144 . 1 1 13 13 ILE HA H 1 2.804 0.005 . 1 . . . . 13 ILE HA . 7105 1 145 . 1 1 13 13 ILE HB H 1 1.686 0.009 . 1 . . . . 13 ILE HB . 7105 1 146 . 1 1 13 13 ILE HG12 H 1 1.110 0.016 . 2 . . . . 13 ILE HG12 . 7105 1 147 . 1 1 13 13 ILE HG13 H 1 0.598 0.009 . 2 . . . . 13 ILE HG13 . 7105 1 148 . 1 1 13 13 ILE HG21 H 1 0.176 0.006 . 1 . . . . 13 ILE HG2 . 7105 1 149 . 1 1 13 13 ILE HG22 H 1 0.176 0.006 . 1 . . . . 13 ILE HG2 . 7105 1 150 . 1 1 13 13 ILE HG23 H 1 0.176 0.006 . 1 . . . . 13 ILE HG2 . 7105 1 151 . 1 1 13 13 ILE HD11 H 1 -1.080 0.007 . 1 . . . . 13 ILE HD1 . 7105 1 152 . 1 1 13 13 ILE HD12 H 1 -1.080 0.007 . 1 . . . . 13 ILE HD1 . 7105 1 153 . 1 1 13 13 ILE HD13 H 1 -1.080 0.007 . 1 . . . . 13 ILE HD1 . 7105 1 154 . 1 1 13 13 ILE CA C 13 61.199 0.002 . 1 . . . . 13 ILE CA . 7105 1 155 . 1 1 13 13 ILE CB C 13 34.299 0.055 . 1 . . . . 13 ILE CB . 7105 1 156 . 1 1 13 13 ILE CG1 C 13 25.606 0.187 . 1 . . . . 13 ILE CG1 . 7105 1 157 . 1 1 13 13 ILE CG2 C 13 17.803 0.058 . 1 . . . . 13 ILE CG2 . 7105 1 158 . 1 1 13 13 ILE CD1 C 13 4.937 0.047 . 1 . . . . 13 ILE CD1 . 7105 1 159 . 1 1 13 13 ILE N N 15 123.232 0.000 . 1 . . . . 13 ILE N . 7105 1 160 . 1 1 14 14 VAL H H 1 8.418 0.008 . 1 . . . . 14 VAL H . 7105 1 161 . 1 1 14 14 VAL HA H 1 3.380 0.006 . 1 . . . . 14 VAL HA . 7105 1 162 . 1 1 14 14 VAL HB H 1 2.149 0.009 . 1 . . . . 14 VAL HB . 7105 1 163 . 1 1 14 14 VAL HG11 H 1 0.896 0.008 . 2 . . . . 14 VAL HG1 . 7105 1 164 . 1 1 14 14 VAL HG12 H 1 0.896 0.008 . 2 . . . . 14 VAL HG1 . 7105 1 165 . 1 1 14 14 VAL HG13 H 1 0.896 0.008 . 2 . . . . 14 VAL HG1 . 7105 1 166 . 1 1 14 14 VAL HG21 H 1 1.119 0.007 . 2 . . . . 14 VAL HG2 . 7105 1 167 . 1 1 14 14 VAL HG22 H 1 1.119 0.007 . 2 . . . . 14 VAL HG2 . 7105 1 168 . 1 1 14 14 VAL HG23 H 1 1.119 0.007 . 2 . . . . 14 VAL HG2 . 7105 1 169 . 1 1 14 14 VAL CA C 13 66.953 0.001 . 1 . . . . 14 VAL CA . 7105 1 170 . 1 1 14 14 VAL CB C 13 32.110 0.076 . 1 . . . . 14 VAL CB . 7105 1 171 . 1 1 14 14 VAL CG1 C 13 23.829 0.006 . 2 . . . . 14 VAL CG1 . 7105 1 172 . 1 1 14 14 VAL CG2 C 13 22.306 0.037 . 2 . . . . 14 VAL CG2 . 7105 1 173 . 1 1 14 14 VAL N N 15 118.454 0.067 . 1 . . . . 14 VAL N . 7105 1 174 . 1 1 15 15 TRP H H 1 7.674 0.000 . 1 . . . . 15 TRP H . 7105 1 175 . 1 1 15 15 TRP HA H 1 3.643 0.007 . 1 . . . . 15 TRP HA . 7105 1 176 . 1 1 15 15 TRP HB2 H 1 2.765 0.005 . 2 . . . . 15 TRP HB2 . 7105 1 177 . 1 1 15 15 TRP HB3 H 1 2.403 0.000 . 2 . . . . 15 TRP HB3 . 7105 1 178 . 1 1 15 15 TRP HD1 H 1 5.758 0.008 . 1 . . . . 15 TRP HD1 . 7105 1 179 . 1 1 15 15 TRP HE1 H 1 10.219 0.003 . 1 . . . . 15 TRP HE1 . 7105 1 180 . 1 1 15 15 TRP HE3 H 1 6.800 0.000 . 1 . . . . 15 TRP HE3 . 7105 1 181 . 1 1 15 15 TRP HZ2 H 1 7.372 0.010 . 1 . . . . 15 TRP HZ2 . 7105 1 182 . 1 1 15 15 TRP HZ3 H 1 7.366 0.004 . 1 . . . . 15 TRP HZ3 . 7105 1 183 . 1 1 15 15 TRP HH2 H 1 7.032 0.000 . 1 . . . . 15 TRP HH2 . 7105 1 184 . 1 1 15 15 TRP C C 13 176.402 0.000 . 1 . . . . 15 TRP C . 7105 1 185 . 1 1 15 15 TRP CA C 13 60.894 0.022 . 1 . . . . 15 TRP CA . 7105 1 186 . 1 1 15 15 TRP CB C 13 29.321 0.045 . 1 . . . . 15 TRP CB . 7105 1 187 . 1 1 15 15 TRP CD1 C 13 128.171 0.105 . 1 . . . . 15 TRP CD1 . 7105 1 188 . 1 1 15 15 TRP CE3 C 13 120.464 0.060 . 1 . . . . 15 TRP CE3 . 7105 1 189 . 1 1 15 15 TRP CZ2 C 13 113.802 0.043 . 1 . . . . 15 TRP CZ2 . 7105 1 190 . 1 1 15 15 TRP CZ3 C 13 124.251 0.006 . 1 . . . . 15 TRP CZ3 . 7105 1 191 . 1 1 15 15 TRP CH2 C 13 122.262 0.000 . 1 . . . . 15 TRP CH2 . 7105 1 192 . 1 1 15 15 TRP N N 15 120.354 0.084 . 1 . . . . 15 TRP N . 7105 1 193 . 1 1 15 15 TRP NE1 N 15 130.069 0.026 . 1 . . . . 15 TRP NE1 . 7105 1 194 . 1 1 16 16 SER H H 1 8.414 0.003 . 1 . . . . 16 SER H . 7105 1 195 . 1 1 16 16 SER HA H 1 2.824 0.009 . 1 . . . . 16 SER HA . 7105 1 196 . 1 1 16 16 SER HB2 H 1 3.205 0.002 . 2 . . . . 16 SER HB2 . 7105 1 197 . 1 1 16 16 SER HB3 H 1 2.958 0.000 . 2 . . . . 16 SER HB3 . 7105 1 198 . 1 1 16 16 SER HG H 1 4.379 0.021 . 1 . . . . 16 SER HG . 7105 1 199 . 1 1 16 16 SER CA C 13 61.215 0.016 . 1 . . . . 16 SER CA . 7105 1 200 . 1 1 16 16 SER CB C 13 63.065 0.133 . 1 . . . . 16 SER CB . 7105 1 201 . 1 1 16 16 SER N N 15 111.022 0.051 . 1 . . . . 16 SER N . 7105 1 202 . 1 1 17 17 ARG H H 1 7.205 0.002 . 1 . . . . 17 ARG H . 7105 1 203 . 1 1 17 17 ARG HA H 1 3.741 0.008 . 1 . . . . 17 ARG HA . 7105 1 204 . 1 1 17 17 ARG HB2 H 1 1.818 0.009 . 1 . . . . 17 ARG HB2 . 7105 1 205 . 1 1 17 17 ARG HB3 H 1 1.818 0.009 . 1 . . . . 17 ARG HB3 . 7105 1 206 . 1 1 17 17 ARG HG2 H 1 1.853 0.007 . 2 . . . . 17 ARG HG2 . 7105 1 207 . 1 1 17 17 ARG HG3 H 1 1.564 0.009 . 2 . . . . 17 ARG HG3 . 7105 1 208 . 1 1 17 17 ARG HD2 H 1 3.116 0.007 . 2 . . . . 17 ARG HD2 . 7105 1 209 . 1 1 17 17 ARG HD3 H 1 3.117 0.009 . 2 . . . . 17 ARG HD3 . 7105 1 210 . 1 1 17 17 ARG CA C 13 60.707 0.025 . 1 . . . . 17 ARG CA . 7105 1 211 . 1 1 17 17 ARG CB C 13 29.811 0.040 . 1 . . . . 17 ARG CB . 7105 1 212 . 1 1 17 17 ARG CG C 13 26.814 0.052 . 1 . . . . 17 ARG CG . 7105 1 213 . 1 1 17 17 ARG CD C 13 44.240 0.056 . 1 . . . . 17 ARG CD . 7105 1 214 . 1 1 17 17 ARG N N 15 121.971 0.001 . 1 . . . . 17 ARG N . 7105 1 215 . 1 1 18 18 ASP H H 1 7.707 0.005 . 1 . . . . 18 ASP H . 7105 1 216 . 1 1 18 18 ASP HA H 1 4.496 0.006 . 1 . . . . 18 ASP HA . 7105 1 217 . 1 1 18 18 ASP HB2 H 1 2.565 0.021 . 1 . . . . 18 ASP HB2 . 7105 1 218 . 1 1 18 18 ASP HB3 H 1 2.565 0.021 . 1 . . . . 18 ASP HB3 . 7105 1 219 . 1 1 18 18 ASP CA C 13 56.283 0.052 . 1 . . . . 18 ASP CA . 7105 1 220 . 1 1 18 18 ASP CB C 13 41.011 0.001 . 1 . . . . 18 ASP CB . 7105 1 221 . 1 1 18 18 ASP N N 15 116.016 0.001 . 1 . . . . 18 ASP N . 7105 1 222 . 1 1 19 19 GLN H H 1 6.605 0.003 . 1 . . . . 19 GLN H . 7105 1 223 . 1 1 19 19 GLN HA H 1 3.713 0.006 . 1 . . . . 19 GLN HA . 7105 1 224 . 1 1 19 19 GLN HB2 H 1 1.317 0.003 . 2 . . . . 19 GLN HB2 . 7105 1 225 . 1 1 19 19 GLN HB3 H 1 0.692 0.000 . 2 . . . . 19 GLN HB3 . 7105 1 226 . 1 1 19 19 GLN HG2 H 1 1.480 0.007 . 2 . . . . 19 GLN HG2 . 7105 1 227 . 1 1 19 19 GLN HG3 H 1 0.929 0.002 . 2 . . . . 19 GLN HG3 . 7105 1 228 . 1 1 19 19 GLN HE21 H 1 6.650 0.000 . 1 . . . . 19 GLN HE21 . 7105 1 229 . 1 1 19 19 GLN HE22 H 1 7.089 0.000 . 1 . . . . 19 GLN HE22 . 7105 1 230 . 1 1 19 19 GLN CA C 13 57.360 0.024 . 1 . . . . 19 GLN CA . 7105 1 231 . 1 1 19 19 GLN CB C 13 28.049 0.050 . 1 . . . . 19 GLN CB . 7105 1 232 . 1 1 19 19 GLN CG C 13 31.293 0.017 . 1 . . . . 19 GLN CG . 7105 1 233 . 1 1 19 19 GLN N N 15 117.653 0.104 . 1 . . . . 19 GLN N . 7105 1 234 . 1 1 19 19 GLN NE2 N 15 111.344 0.000 . 1 . . . . 19 GLN NE2 . 7105 1 235 . 1 1 20 20 ARG H H 1 8.707 0.006 . 1 . . . . 20 ARG H . 7105 1 236 . 1 1 20 20 ARG HA H 1 3.545 0.005 . 1 . . . . 20 ARG HA . 7105 1 237 . 1 1 20 20 ARG HB2 H 1 1.841 0.000 . 2 . . . . 20 ARG HB2 . 7105 1 238 . 1 1 20 20 ARG HB3 H 1 1.662 0.000 . 2 . . . . 20 ARG HB3 . 7105 1 239 . 1 1 20 20 ARG HG2 H 1 1.567 0.000 . 2 . . . . 20 ARG HG2 . 7105 1 240 . 1 1 20 20 ARG HG3 H 1 1.424 0.000 . 2 . . . . 20 ARG HG3 . 7105 1 241 . 1 1 20 20 ARG CA C 13 59.979 0.028 . 1 . . . . 20 ARG CA . 7105 1 242 . 1 1 20 20 ARG CB C 13 30.629 0.198 . 1 . . . . 20 ARG CB . 7105 1 243 . 1 1 20 20 ARG CG C 13 26.394 0.025 . 1 . . . . 20 ARG CG . 7105 1 244 . 1 1 20 20 ARG N N 15 120.531 0.078 . 1 . . . . 20 ARG N . 7105 1 245 . 1 1 21 21 ARG H H 1 6.911 0.003 . 1 . . . . 21 ARG H . 7105 1 246 . 1 1 21 21 ARG HA H 1 3.998 0.007 . 1 . . . . 21 ARG HA . 7105 1 247 . 1 1 21 21 ARG HB2 H 1 1.824 0.010 . 1 . . . . 21 ARG HB2 . 7105 1 248 . 1 1 21 21 ARG HB3 H 1 1.824 0.010 . 1 . . . . 21 ARG HB3 . 7105 1 249 . 1 1 21 21 ARG HG3 H 1 1.586 0.002 . 1 . . . . 21 ARG HG3 . 7105 1 250 . 1 1 21 21 ARG HD2 H 1 3.195 0.003 . 1 . . . . 21 ARG HD2 . 7105 1 251 . 1 1 21 21 ARG HD3 H 1 3.195 0.003 . 1 . . . . 21 ARG HD3 . 7105 1 252 . 1 1 21 21 ARG CA C 13 59.120 0.000 . 1 . . . . 21 ARG CA . 7105 1 253 . 1 1 21 21 ARG CB C 13 29.819 0.046 . 1 . . . . 21 ARG CB . 7105 1 254 . 1 1 21 21 ARG CG C 13 27.774 0.048 . 1 . . . . 21 ARG CG . 7105 1 255 . 1 1 21 21 ARG CD C 13 43.236 0.036 . 1 . . . . 21 ARG CD . 7105 1 256 . 1 1 21 21 ARG N N 15 116.413 0.017 . 1 . . . . 21 ARG N . 7105 1 257 . 1 1 22 22 LYS H H 1 7.329 0.008 . 1 . . . . 22 LYS H . 7105 1 258 . 1 1 22 22 LYS HA H 1 3.917 0.004 . 1 . . . . 22 LYS HA . 7105 1 259 . 1 1 22 22 LYS HB2 H 1 1.749 0.002 . 1 . . . . 22 LYS HB2 . 7105 1 260 . 1 1 22 22 LYS HB3 H 1 1.749 0.002 . 1 . . . . 22 LYS HB3 . 7105 1 261 . 1 1 22 22 LYS HG2 H 1 1.440 0.005 . 2 . . . . 22 LYS HG2 . 7105 1 262 . 1 1 22 22 LYS HG3 H 1 1.258 0.002 . 2 . . . . 22 LYS HG3 . 7105 1 263 . 1 1 22 22 LYS HD2 H 1 1.579 0.000 . 1 . . . . 22 LYS HD2 . 7105 1 264 . 1 1 22 22 LYS HD3 H 1 1.579 0.000 . 1 . . . . 22 LYS HD3 . 7105 1 265 . 1 1 22 22 LYS HE2 H 1 2.931 0.001 . 1 . . . . 22 LYS HE2 . 7105 1 266 . 1 1 22 22 LYS HE3 H 1 2.931 0.001 . 1 . . . . 22 LYS HE3 . 7105 1 267 . 1 1 22 22 LYS CA C 13 59.704 0.032 . 1 . . . . 22 LYS CA . 7105 1 268 . 1 1 22 22 LYS CB C 13 32.756 0.040 . 1 . . . . 22 LYS CB . 7105 1 269 . 1 1 22 22 LYS CG C 13 24.850 0.095 . 1 . . . . 22 LYS CG . 7105 1 270 . 1 1 22 22 LYS CD C 13 29.790 0.004 . 1 . . . . 22 LYS CD . 7105 1 271 . 1 1 22 22 LYS CE C 13 42.222 0.000 . 1 . . . . 22 LYS CE . 7105 1 272 . 1 1 22 22 LYS N N 15 118.335 0.003 . 1 . . . . 22 LYS N . 7105 1 273 . 1 1 23 23 MET H H 1 8.139 0.001 . 1 . . . . 23 MET H . 7105 1 274 . 1 1 23 23 MET HA H 1 4.071 0.005 . 1 . . . . 23 MET HA . 7105 1 275 . 1 1 23 23 MET HB2 H 1 2.166 0.010 . 2 . . . . 23 MET HB2 . 7105 1 276 . 1 1 23 23 MET HB3 H 1 1.878 0.001 . 2 . . . . 23 MET HB3 . 7105 1 277 . 1 1 23 23 MET HG2 H 1 2.637 0.006 . 2 . . . . 23 MET HG2 . 7105 1 278 . 1 1 23 23 MET HG3 H 1 2.501 0.005 . 2 . . . . 23 MET HG3 . 7105 1 279 . 1 1 23 23 MET HE1 H 1 2.014 0.007 . 1 . . . . 23 MET HE . 7105 1 280 . 1 1 23 23 MET HE2 H 1 2.014 0.007 . 1 . . . . 23 MET HE . 7105 1 281 . 1 1 23 23 MET HE3 H 1 2.014 0.007 . 1 . . . . 23 MET HE . 7105 1 282 . 1 1 23 23 MET CA C 13 59.128 0.000 . 1 . . . . 23 MET CA . 7105 1 283 . 1 1 23 23 MET CB C 13 32.921 0.088 . 1 . . . . 23 MET CB . 7105 1 284 . 1 1 23 23 MET CG C 13 33.260 0.041 . 1 . . . . 23 MET CG . 7105 1 285 . 1 1 23 23 MET CE C 13 17.356 0.007 . 1 . . . . 23 MET CE . 7105 1 286 . 1 1 23 23 MET N N 15 117.475 0.021 . 1 . . . . 23 MET N . 7105 1 287 . 1 1 24 24 ALA H H 1 8.295 0.002 . 1 . . . . 24 ALA H . 7105 1 288 . 1 1 24 24 ALA HA H 1 4.041 0.014 . 1 . . . . 24 ALA HA . 7105 1 289 . 1 1 24 24 ALA HB1 H 1 1.403 0.010 . 1 . . . . 24 ALA HB . 7105 1 290 . 1 1 24 24 ALA HB2 H 1 1.403 0.010 . 1 . . . . 24 ALA HB . 7105 1 291 . 1 1 24 24 ALA HB3 H 1 1.403 0.010 . 1 . . . . 24 ALA HB . 7105 1 292 . 1 1 24 24 ALA CA C 13 54.853 0.011 . 1 . . . . 24 ALA CA . 7105 1 293 . 1 1 24 24 ALA CB C 13 18.553 0.058 . 1 . . . . 24 ALA CB . 7105 1 294 . 1 1 24 24 ALA N N 15 121.787 0.020 . 1 . . . . 24 ALA N . 7105 1 295 . 1 1 25 25 LEU H H 1 7.607 0.010 . 1 . . . . 25 LEU H . 7105 1 296 . 1 1 25 25 LEU HA H 1 4.073 0.006 . 1 . . . . 25 LEU HA . 7105 1 297 . 1 1 25 25 LEU HB2 H 1 1.797 0.016 . 2 . . . . 25 LEU HB2 . 7105 1 298 . 1 1 25 25 LEU HB3 H 1 1.587 0.004 . 2 . . . . 25 LEU HB3 . 7105 1 299 . 1 1 25 25 LEU HG H 1 1.754 0.000 . 1 . . . . 25 LEU HG . 7105 1 300 . 1 1 25 25 LEU HD11 H 1 0.865 0.003 . 2 . . . . 25 LEU HD1 . 7105 1 301 . 1 1 25 25 LEU HD12 H 1 0.865 0.003 . 2 . . . . 25 LEU HD1 . 7105 1 302 . 1 1 25 25 LEU HD13 H 1 0.865 0.003 . 2 . . . . 25 LEU HD1 . 7105 1 303 . 1 1 25 25 LEU HD21 H 1 0.864 0.004 . 2 . . . . 25 LEU HD2 . 7105 1 304 . 1 1 25 25 LEU HD22 H 1 0.864 0.004 . 2 . . . . 25 LEU HD2 . 7105 1 305 . 1 1 25 25 LEU HD23 H 1 0.864 0.004 . 2 . . . . 25 LEU HD2 . 7105 1 306 . 1 1 25 25 LEU CA C 13 57.263 0.000 . 1 . . . . 25 LEU CA . 7105 1 307 . 1 1 25 25 LEU CB C 13 42.227 0.014 . 1 . . . . 25 LEU CB . 7105 1 308 . 1 1 25 25 LEU CG C 13 26.878 0.000 . 1 . . . . 25 LEU CG . 7105 1 309 . 1 1 25 25 LEU CD1 C 13 23.869 0.062 . 2 . . . . 25 LEU CD1 . 7105 1 310 . 1 1 25 25 LEU CD2 C 13 24.830 0.021 . 2 . . . . 25 LEU CD2 . 7105 1 311 . 1 1 25 25 LEU N N 15 117.025 0.044 . 1 . . . . 25 LEU N . 7105 1 312 . 1 1 26 26 GLU H H 1 7.608 0.001 . 1 . . . . 26 GLU H . 7105 1 313 . 1 1 26 26 GLU HA H 1 4.117 0.002 . 1 . . . . 26 GLU HA . 7105 1 314 . 1 1 26 26 GLU HB2 H 1 2.044 0.001 . 2 . . . . 26 GLU HB2 . 7105 1 315 . 1 1 26 26 GLU HB3 H 1 1.977 0.008 . 2 . . . . 26 GLU HB3 . 7105 1 316 . 1 1 26 26 GLU HG2 H 1 2.479 0.001 . 2 . . . . 26 GLU HG2 . 7105 1 317 . 1 1 26 26 GLU HG3 H 1 2.262 0.000 . 2 . . . . 26 GLU HG3 . 7105 1 318 . 1 1 26 26 GLU CA C 13 57.769 0.000 . 1 . . . . 26 GLU CA . 7105 1 319 . 1 1 26 26 GLU CB C 13 30.791 0.000 . 1 . . . . 26 GLU CB . 7105 1 320 . 1 1 26 26 GLU CG C 13 36.754 0.000 . 1 . . . . 26 GLU CG . 7105 1 321 . 1 1 26 26 GLU N N 15 115.923 0.036 . 1 . . . . 26 GLU N . 7105 1 322 . 1 1 27 27 ASN H H 1 7.615 0.002 . 1 . . . . 27 ASN H . 7105 1 323 . 1 1 27 27 ASN HA H 1 5.185 0.009 . 1 . . . . 27 ASN HA . 7105 1 324 . 1 1 27 27 ASN HB2 H 1 2.907 0.012 . 2 . . . . 27 ASN HB2 . 7105 1 325 . 1 1 27 27 ASN HB3 H 1 2.553 0.001 . 2 . . . . 27 ASN HB3 . 7105 1 326 . 1 1 27 27 ASN HD21 H 1 7.353 0.000 . 1 . . . . 27 ASN HD21 . 7105 1 327 . 1 1 27 27 ASN HD22 H 1 7.741 0.000 . 1 . . . . 27 ASN HD22 . 7105 1 328 . 1 1 27 27 ASN CA C 13 51.001 0.039 . 1 . . . . 27 ASN CA . 7105 1 329 . 1 1 27 27 ASN CB C 13 40.570 0.001 . 1 . . . . 27 ASN CB . 7105 1 330 . 1 1 27 27 ASN N N 15 115.068 0.066 . 1 . . . . 27 ASN N . 7105 1 331 . 1 1 27 27 ASN ND2 N 15 115.836 0.000 . 1 . . . . 27 ASN ND2 . 7105 1 332 . 1 1 28 28 PRO HA H 1 4.624 0.000 . 1 . . . . 28 PRO HA . 7105 1 333 . 1 1 28 28 PRO HB2 H 1 2.404 0.001 . 2 . . . . 28 PRO HB2 . 7105 1 334 . 1 1 28 28 PRO HB3 H 1 1.957 0.001 . 2 . . . . 28 PRO HB3 . 7105 1 335 . 1 1 28 28 PRO HG2 H 1 2.041 0.000 . 2 . . . . 28 PRO HG2 . 7105 1 336 . 1 1 28 28 PRO HG3 H 1 1.926 0.002 . 2 . . . . 28 PRO HG3 . 7105 1 337 . 1 1 28 28 PRO HD2 H 1 3.629 0.004 . 2 . . . . 28 PRO HD2 . 7105 1 338 . 1 1 28 28 PRO HD3 H 1 3.423 0.003 . 2 . . . . 28 PRO HD3 . 7105 1 339 . 1 1 28 28 PRO CA C 13 64.662 0.000 . 1 . . . . 28 PRO CA . 7105 1 340 . 1 1 28 28 PRO CB C 13 32.742 0.074 . 1 . . . . 28 PRO CB . 7105 1 341 . 1 1 28 28 PRO CG C 13 27.317 0.109 . 1 . . . . 28 PRO CG . 7105 1 342 . 1 1 28 28 PRO CD C 13 50.677 0.002 . 1 . . . . 28 PRO CD . 7105 1 343 . 1 1 29 29 ARG H H 1 8.271 0.003 . 1 . . . . 29 ARG H . 7105 1 344 . 1 1 29 29 ARG HA H 1 4.337 0.010 . 1 . . . . 29 ARG HA . 7105 1 345 . 1 1 29 29 ARG HB2 H 1 2.008 0.000 . 2 . . . . 29 ARG HB2 . 7105 1 346 . 1 1 29 29 ARG HB3 H 1 1.793 0.003 . 2 . . . . 29 ARG HB3 . 7105 1 347 . 1 1 29 29 ARG HG2 H 1 1.659 0.014 . 1 . . . . 29 ARG HG2 . 7105 1 348 . 1 1 29 29 ARG HG3 H 1 1.659 0.014 . 1 . . . . 29 ARG HG3 . 7105 1 349 . 1 1 29 29 ARG HD2 H 1 3.205 0.003 . 1 . . . . 29 ARG HD2 . 7105 1 350 . 1 1 29 29 ARG HD3 H 1 3.205 0.003 . 1 . . . . 29 ARG HD3 . 7105 1 351 . 1 1 29 29 ARG CA C 13 55.967 0.000 . 1 . . . . 29 ARG CA . 7105 1 352 . 1 1 29 29 ARG CB C 13 29.855 0.062 . 1 . . . . 29 ARG CB . 7105 1 353 . 1 1 29 29 ARG CG C 13 27.795 0.000 . 1 . . . . 29 ARG CG . 7105 1 354 . 1 1 29 29 ARG CD C 13 43.214 0.000 . 1 . . . . 29 ARG CD . 7105 1 355 . 1 1 29 29 ARG N N 15 114.870 0.038 . 1 . . . . 29 ARG N . 7105 1 356 . 1 1 30 30 MET H H 1 7.659 0.003 . 1 . . . . 30 MET H . 7105 1 357 . 1 1 30 30 MET HA H 1 4.277 0.016 . 1 . . . . 30 MET HA . 7105 1 358 . 1 1 30 30 MET HB2 H 1 1.998 0.008 . 2 . . . . 30 MET HB2 . 7105 1 359 . 1 1 30 30 MET HB3 H 1 1.999 0.007 . 2 . . . . 30 MET HB3 . 7105 1 360 . 1 1 30 30 MET HG2 H 1 2.553 0.004 . 1 . . . . 30 MET HG2 . 7105 1 361 . 1 1 30 30 MET HG3 H 1 2.553 0.004 . 1 . . . . 30 MET HG3 . 7105 1 362 . 1 1 30 30 MET HE1 H 1 1.987 0.000 . 1 . . . . 30 MET HE . 7105 1 363 . 1 1 30 30 MET HE2 H 1 1.987 0.000 . 1 . . . . 30 MET HE . 7105 1 364 . 1 1 30 30 MET HE3 H 1 1.987 0.000 . 1 . . . . 30 MET HE . 7105 1 365 . 1 1 30 30 MET CA C 13 56.657 0.000 . 1 . . . . 30 MET CA . 7105 1 366 . 1 1 30 30 MET CB C 13 34.717 0.040 . 1 . . . . 30 MET CB . 7105 1 367 . 1 1 30 30 MET CG C 13 33.272 0.000 . 1 . . . . 30 MET CG . 7105 1 368 . 1 1 30 30 MET CE C 13 17.373 0.000 . 1 . . . . 30 MET CE . 7105 1 369 . 1 1 30 30 MET N N 15 121.061 0.032 . 1 . . . . 30 MET N . 7105 1 370 . 1 1 31 31 ARG H H 1 8.854 0.001 . 1 . . . . 31 ARG H . 7105 1 371 . 1 1 31 31 ARG HA H 1 4.452 0.001 . 1 . . . . 31 ARG HA . 7105 1 372 . 1 1 31 31 ARG HB2 H 1 2.130 0.005 . 2 . . . . 31 ARG HB2 . 7105 1 373 . 1 1 31 31 ARG HB3 H 1 1.759 0.001 . 2 . . . . 31 ARG HB3 . 7105 1 374 . 1 1 31 31 ARG HG2 H 1 1.833 0.001 . 1 . . . . 31 ARG HG2 . 7105 1 375 . 1 1 31 31 ARG HG3 H 1 1.833 0.001 . 1 . . . . 31 ARG HG3 . 7105 1 376 . 1 1 31 31 ARG HD2 H 1 3.254 0.002 . 1 . . . . 31 ARG HD2 . 7105 1 377 . 1 1 31 31 ARG HD3 H 1 3.254 0.002 . 1 . . . . 31 ARG HD3 . 7105 1 378 . 1 1 31 31 ARG CA C 13 55.975 0.000 . 1 . . . . 31 ARG CA . 7105 1 379 . 1 1 31 31 ARG CB C 13 31.309 0.075 . 1 . . . . 31 ARG CB . 7105 1 380 . 1 1 31 31 ARG CG C 13 27.799 0.000 . 1 . . . . 31 ARG CG . 7105 1 381 . 1 1 31 31 ARG CD C 13 43.715 0.000 . 1 . . . . 31 ARG CD . 7105 1 382 . 1 1 31 31 ARG N N 15 123.782 0.000 . 1 . . . . 31 ARG N . 7105 1 383 . 1 1 32 32 ASN HB2 H 1 2.000 0.000 . 1 . . . . 32 ASN HB2 . 7105 1 384 . 1 1 32 32 ASN HB3 H 1 2.000 0.000 . 1 . . . . 32 ASN HB3 . 7105 1 385 . 1 1 32 32 ASN C C 13 177.917 0.000 . 1 . . . . 32 ASN C . 7105 1 386 . 1 1 32 32 ASN CA C 13 57.859 0.000 . 1 . . . . 32 ASN CA . 7105 1 387 . 1 1 32 32 ASN CB C 13 39.264 0.000 . 1 . . . . 32 ASN CB . 7105 1 388 . 1 1 33 33 SER H H 1 8.589 0.002 . 1 . . . . 33 SER H . 7105 1 389 . 1 1 33 33 SER HA H 1 4.033 0.013 . 1 . . . . 33 SER HA . 7105 1 390 . 1 1 33 33 SER HB2 H 1 3.723 0.000 . 1 . . . . 33 SER HB2 . 7105 1 391 . 1 1 33 33 SER HB3 H 1 3.723 0.000 . 1 . . . . 33 SER HB3 . 7105 1 392 . 1 1 33 33 SER HG H 1 4.192 0.021 . 1 . . . . 33 SER HG . 7105 1 393 . 1 1 33 33 SER CA C 13 61.704 0.043 . 1 . . . . 33 SER CA . 7105 1 394 . 1 1 33 33 SER CB C 13 61.115 0.000 . 1 . . . . 33 SER CB . 7105 1 395 . 1 1 33 33 SER N N 15 112.702 0.000 . 1 . . . . 33 SER N . 7105 1 396 . 1 1 34 34 GLU H H 1 6.857 0.003 . 1 . . . . 34 GLU H . 7105 1 397 . 1 1 34 34 GLU HA H 1 4.138 0.008 . 1 . . . . 34 GLU HA . 7105 1 398 . 1 1 34 34 GLU HB2 H 1 2.315 0.000 . 2 . . . . 34 GLU HB2 . 7105 1 399 . 1 1 34 34 GLU HB3 H 1 2.215 0.019 . 2 . . . . 34 GLU HB3 . 7105 1 400 . 1 1 34 34 GLU HG2 H 1 2.354 0.004 . 2 . . . . 34 GLU HG2 . 7105 1 401 . 1 1 34 34 GLU HG3 H 1 2.358 0.010 . 2 . . . . 34 GLU HG3 . 7105 1 402 . 1 1 34 34 GLU CA C 13 58.668 0.001 . 1 . . . . 34 GLU CA . 7105 1 403 . 1 1 34 34 GLU CB C 13 29.881 0.124 . 1 . . . . 34 GLU CB . 7105 1 404 . 1 1 34 34 GLU CG C 13 36.762 0.012 . 1 . . . . 34 GLU CG . 7105 1 405 . 1 1 34 34 GLU N N 15 122.017 0.066 . 1 . . . . 34 GLU N . 7105 1 406 . 1 1 35 35 ILE H H 1 8.129 0.003 . 1 . . . . 35 ILE H . 7105 1 407 . 1 1 35 35 ILE HA H 1 3.665 0.007 . 1 . . . . 35 ILE HA . 7105 1 408 . 1 1 35 35 ILE HB H 1 2.160 0.009 . 1 . . . . 35 ILE HB . 7105 1 409 . 1 1 35 35 ILE HG12 H 1 1.669 0.000 . 2 . . . . 35 ILE HG12 . 7105 1 410 . 1 1 35 35 ILE HG13 H 1 0.980 0.000 . 2 . . . . 35 ILE HG13 . 7105 1 411 . 1 1 35 35 ILE HG21 H 1 1.001 0.001 . 1 . . . . 35 ILE HG2 . 7105 1 412 . 1 1 35 35 ILE HG22 H 1 1.001 0.001 . 1 . . . . 35 ILE HG2 . 7105 1 413 . 1 1 35 35 ILE HG23 H 1 1.001 0.001 . 1 . . . . 35 ILE HG2 . 7105 1 414 . 1 1 35 35 ILE HD11 H 1 0.838 0.003 . 1 . . . . 35 ILE HD1 . 7105 1 415 . 1 1 35 35 ILE HD12 H 1 0.838 0.003 . 1 . . . . 35 ILE HD1 . 7105 1 416 . 1 1 35 35 ILE HD13 H 1 0.838 0.003 . 1 . . . . 35 ILE HD1 . 7105 1 417 . 1 1 35 35 ILE CA C 13 66.117 0.029 . 1 . . . . 35 ILE CA . 7105 1 418 . 1 1 35 35 ILE CB C 13 37.253 0.005 . 1 . . . . 35 ILE CB . 7105 1 419 . 1 1 35 35 ILE CG1 C 13 29.295 0.000 . 1 . . . . 35 ILE CG1 . 7105 1 420 . 1 1 35 35 ILE CG2 C 13 18.301 0.088 . 1 . . . . 35 ILE CG2 . 7105 1 421 . 1 1 35 35 ILE CD1 C 13 12.522 0.000 . 1 . . . . 35 ILE CD1 . 7105 1 422 . 1 1 35 35 ILE N N 15 122.054 0.031 . 1 . . . . 35 ILE N . 7105 1 423 . 1 1 36 36 SER H H 1 8.487 0.000 . 1 . . . . 36 SER H . 7105 1 424 . 1 1 36 36 SER HA H 1 4.466 0.007 . 1 . . . . 36 SER HA . 7105 1 425 . 1 1 36 36 SER HB2 H 1 4.155 0.006 . 2 . . . . 36 SER HB2 . 7105 1 426 . 1 1 36 36 SER HB3 H 1 4.159 0.003 . 2 . . . . 36 SER HB3 . 7105 1 427 . 1 1 36 36 SER CA C 13 62.741 0.020 . 1 . . . . 36 SER CA . 7105 1 428 . 1 1 36 36 SER CB C 13 62.607 0.000 . 1 . . . . 36 SER CB . 7105 1 429 . 1 1 36 36 SER N N 15 115.046 0.000 . 1 . . . . 36 SER N . 7105 1 430 . 1 1 37 37 LYS H H 1 7.319 0.004 . 1 . . . . 37 LYS H . 7105 1 431 . 1 1 37 37 LYS HA H 1 3.873 0.010 . 1 . . . . 37 LYS HA . 7105 1 432 . 1 1 37 37 LYS HB2 H 1 2.130 0.000 . 2 . . . . 37 LYS HB2 . 7105 1 433 . 1 1 37 37 LYS HB3 H 1 1.905 0.001 . 2 . . . . 37 LYS HB3 . 7105 1 434 . 1 1 37 37 LYS HG2 H 1 1.587 0.008 . 1 . . . . 37 LYS HG2 . 7105 1 435 . 1 1 37 37 LYS HG3 H 1 1.587 0.008 . 1 . . . . 37 LYS HG3 . 7105 1 436 . 1 1 37 37 LYS HD2 H 1 1.774 0.000 . 1 . . . . 37 LYS HD2 . 7105 1 437 . 1 1 37 37 LYS HD3 H 1 1.774 0.000 . 1 . . . . 37 LYS HD3 . 7105 1 438 . 1 1 37 37 LYS HE2 H 1 2.992 0.001 . 1 . . . . 37 LYS HE2 . 7105 1 439 . 1 1 37 37 LYS HE3 H 1 2.992 0.001 . 1 . . . . 37 LYS HE3 . 7105 1 440 . 1 1 37 37 LYS CA C 13 60.297 0.069 . 1 . . . . 37 LYS CA . 7105 1 441 . 1 1 37 37 LYS CB C 13 32.812 0.077 . 1 . . . . 37 LYS CB . 7105 1 442 . 1 1 37 37 LYS CG C 13 26.082 0.031 . 1 . . . . 37 LYS CG . 7105 1 443 . 1 1 37 37 LYS CD C 13 29.997 0.000 . 1 . . . . 37 LYS CD . 7105 1 444 . 1 1 37 37 LYS CE C 13 42.493 0.000 . 1 . . . . 37 LYS CE . 7105 1 445 . 1 1 37 37 LYS N N 15 118.714 0.083 . 1 . . . . 37 LYS N . 7105 1 446 . 1 1 38 38 GLN H H 1 7.830 0.004 . 1 . . . . 38 GLN H . 7105 1 447 . 1 1 38 38 GLN HA H 1 4.225 0.009 . 1 . . . . 38 GLN HA . 7105 1 448 . 1 1 38 38 GLN HB2 H 1 2.299 0.000 . 2 . . . . 38 GLN HB2 . 7105 1 449 . 1 1 38 38 GLN HB3 H 1 2.195 0.000 . 2 . . . . 38 GLN HB3 . 7105 1 450 . 1 1 38 38 GLN HG2 H 1 2.588 0.001 . 2 . . . . 38 GLN HG2 . 7105 1 451 . 1 1 38 38 GLN HG3 H 1 2.475 0.001 . 2 . . . . 38 GLN HG3 . 7105 1 452 . 1 1 38 38 GLN HE21 H 1 6.827 0.000 . 1 . . . . 38 GLN HE21 . 7105 1 453 . 1 1 38 38 GLN HE22 H 1 7.563 0.000 . 1 . . . . 38 GLN HE22 . 7105 1 454 . 1 1 38 38 GLN CA C 13 58.747 0.006 . 1 . . . . 38 GLN CA . 7105 1 455 . 1 1 38 38 GLN CB C 13 28.284 0.039 . 1 . . . . 38 GLN CB . 7105 1 456 . 1 1 38 38 GLN CG C 13 33.765 0.010 . 1 . . . . 38 GLN CG . 7105 1 457 . 1 1 38 38 GLN N N 15 118.512 0.070 . 1 . . . . 38 GLN N . 7105 1 458 . 1 1 38 38 GLN NE2 N 15 111.601 0.008 . 1 . . . . 38 GLN NE2 . 7105 1 459 . 1 1 39 39 LEU H H 1 8.942 0.007 . 1 . . . . 39 LEU H . 7105 1 460 . 1 1 39 39 LEU HA H 1 4.416 0.000 . 1 . . . . 39 LEU HA . 7105 1 461 . 1 1 39 39 LEU HB2 H 1 2.294 0.004 . 2 . . . . 39 LEU HB2 . 7105 1 462 . 1 1 39 39 LEU HB3 H 1 1.702 0.006 . 2 . . . . 39 LEU HB3 . 7105 1 463 . 1 1 39 39 LEU HG H 1 2.003 0.002 . 1 . . . . 39 LEU HG . 7105 1 464 . 1 1 39 39 LEU HD11 H 1 0.554 0.008 . 2 . . . . 39 LEU HD1 . 7105 1 465 . 1 1 39 39 LEU HD12 H 1 0.554 0.008 . 2 . . . . 39 LEU HD1 . 7105 1 466 . 1 1 39 39 LEU HD13 H 1 0.554 0.008 . 2 . . . . 39 LEU HD1 . 7105 1 467 . 1 1 39 39 LEU HD21 H 1 0.631 0.011 . 2 . . . . 39 LEU HD2 . 7105 1 468 . 1 1 39 39 LEU HD22 H 1 0.631 0.011 . 2 . . . . 39 LEU HD2 . 7105 1 469 . 1 1 39 39 LEU HD23 H 1 0.631 0.011 . 2 . . . . 39 LEU HD2 . 7105 1 470 . 1 1 39 39 LEU C C 13 179.517 0.000 . 1 . . . . 39 LEU C . 7105 1 471 . 1 1 39 39 LEU CA C 13 58.183 0.000 . 1 . . . . 39 LEU CA . 7105 1 472 . 1 1 39 39 LEU CB C 13 41.706 0.033 . 1 . . . . 39 LEU CB . 7105 1 473 . 1 1 39 39 LEU CG C 13 26.312 0.000 . 1 . . . . 39 LEU CG . 7105 1 474 . 1 1 39 39 LEU CD1 C 13 23.858 0.056 . 2 . . . . 39 LEU CD1 . 7105 1 475 . 1 1 39 39 LEU CD2 C 13 26.830 0.032 . 2 . . . . 39 LEU CD2 . 7105 1 476 . 1 1 39 39 LEU N N 15 119.153 0.046 . 1 . . . . 39 LEU N . 7105 1 477 . 1 1 40 40 GLY H H 1 8.418 0.007 . 1 . . . . 40 GLY H . 7105 1 478 . 1 1 40 40 GLY HA2 H 1 4.017 0.004 . 2 . . . . 40 GLY HA2 . 7105 1 479 . 1 1 40 40 GLY HA3 H 1 3.742 0.015 . 2 . . . . 40 GLY HA3 . 7105 1 480 . 1 1 40 40 GLY CA C 13 48.532 0.011 . 1 . . . . 40 GLY CA . 7105 1 481 . 1 1 40 40 GLY N N 15 105.844 0.017 . 1 . . . . 40 GLY N . 7105 1 482 . 1 1 41 41 TYR H H 1 7.530 0.004 . 1 . . . . 41 TYR H . 7105 1 483 . 1 1 41 41 TYR HA H 1 4.343 0.000 . 1 . . . . 41 TYR HA . 7105 1 484 . 1 1 41 41 TYR HB2 H 1 3.231 0.007 . 2 . . . . 41 TYR HB2 . 7105 1 485 . 1 1 41 41 TYR HB3 H 1 3.229 0.008 . 2 . . . . 41 TYR HB3 . 7105 1 486 . 1 1 41 41 TYR HD1 H 1 7.144 0.016 . 1 . . . . 41 TYR HD . 7105 1 487 . 1 1 41 41 TYR HD2 H 1 7.144 0.016 . 1 . . . . 41 TYR HD . 7105 1 488 . 1 1 41 41 TYR HE1 H 1 6.824 0.002 . 1 . . . . 41 TYR HE . 7105 1 489 . 1 1 41 41 TYR HE2 H 1 6.824 0.002 . 1 . . . . 41 TYR HE . 7105 1 490 . 1 1 41 41 TYR CA C 13 60.548 0.000 . 1 . . . . 41 TYR CA . 7105 1 491 . 1 1 41 41 TYR CB C 13 38.005 0.054 . 1 . . . . 41 TYR CB . 7105 1 492 . 1 1 41 41 TYR CD1 C 13 133.125 0.075 . 1 . . . . 41 TYR CD . 7105 1 493 . 1 1 41 41 TYR CD2 C 13 133.125 0.075 . 1 . . . . 41 TYR CD . 7105 1 494 . 1 1 41 41 TYR CE1 C 13 118.347 0.063 . 1 . . . . 41 TYR CE . 7105 1 495 . 1 1 41 41 TYR CE2 C 13 118.347 0.063 . 1 . . . . 41 TYR CE . 7105 1 496 . 1 1 41 41 TYR N N 15 120.210 0.038 . 1 . . . . 41 TYR N . 7105 1 497 . 1 1 42 42 GLN H H 1 8.518 0.000 . 1 . . . . 42 GLN H . 7105 1 498 . 1 1 42 42 GLN HA H 1 3.957 0.014 . 1 . . . . 42 GLN HA . 7105 1 499 . 1 1 42 42 GLN HB2 H 1 2.568 0.001 . 2 . . . . 42 GLN HB2 . 7105 1 500 . 1 1 42 42 GLN HB3 H 1 2.465 0.009 . 2 . . . . 42 GLN HB3 . 7105 1 501 . 1 1 42 42 GLN HG2 H 1 2.838 0.003 . 2 . . . . 42 GLN HG2 . 7105 1 502 . 1 1 42 42 GLN HG3 H 1 2.618 0.010 . 2 . . . . 42 GLN HG3 . 7105 1 503 . 1 1 42 42 GLN HE21 H 1 6.669 0.000 . 1 . . . . 42 GLN HE21 . 7105 1 504 . 1 1 42 42 GLN HE22 H 1 7.398 0.000 . 1 . . . . 42 GLN HE22 . 7105 1 505 . 1 1 42 42 GLN CA C 13 59.192 0.000 . 1 . . . . 42 GLN CA . 7105 1 506 . 1 1 42 42 GLN CB C 13 29.259 0.057 . 1 . . . . 42 GLN CB . 7105 1 507 . 1 1 42 42 GLN CG C 13 34.555 0.033 . 1 . . . . 42 GLN CG . 7105 1 508 . 1 1 42 42 GLN N N 15 117.546 0.083 . 1 . . . . 42 GLN N . 7105 1 509 . 1 1 42 42 GLN NE2 N 15 108.740 0.003 . 1 . . . . 42 GLN NE2 . 7105 1 510 . 1 1 43 43 TRP H H 1 8.838 0.009 . 1 . . . . 43 TRP H . 7105 1 511 . 1 1 43 43 TRP HA H 1 3.553 0.008 . 1 . . . . 43 TRP HA . 7105 1 512 . 1 1 43 43 TRP HB2 H 1 3.201 0.010 . 1 . . . . 43 TRP HB2 . 7105 1 513 . 1 1 43 43 TRP HB3 H 1 3.201 0.010 . 1 . . . . 43 TRP HB3 . 7105 1 514 . 1 1 43 43 TRP HD1 H 1 6.695 0.011 . 1 . . . . 43 TRP HD1 . 7105 1 515 . 1 1 43 43 TRP HE1 H 1 10.944 0.006 . 1 . . . . 43 TRP HE1 . 7105 1 516 . 1 1 43 43 TRP HE3 H 1 5.480 0.002 . 1 . . . . 43 TRP HE3 . 7105 1 517 . 1 1 43 43 TRP HZ2 H 1 7.114 0.004 . 1 . . . . 43 TRP HZ2 . 7105 1 518 . 1 1 43 43 TRP HZ3 H 1 5.985 0.013 . 1 . . . . 43 TRP HZ3 . 7105 1 519 . 1 1 43 43 TRP HH2 H 1 6.530 0.000 . 1 . . . . 43 TRP HH2 . 7105 1 520 . 1 1 43 43 TRP CA C 13 59.989 0.047 . 1 . . . . 43 TRP CA . 7105 1 521 . 1 1 43 43 TRP CB C 13 29.933 0.046 . 1 . . . . 43 TRP CB . 7105 1 522 . 1 1 43 43 TRP CD1 C 13 126.674 0.051 . 1 . . . . 43 TRP CD1 . 7105 1 523 . 1 1 43 43 TRP CE3 C 13 122.387 0.002 . 1 . . . . 43 TRP CE3 . 7105 1 524 . 1 1 43 43 TRP CZ2 C 13 112.770 0.012 . 1 . . . . 43 TRP CZ2 . 7105 1 525 . 1 1 43 43 TRP CZ3 C 13 121.136 0.000 . 1 . . . . 43 TRP CZ3 . 7105 1 526 . 1 1 43 43 TRP CH2 C 13 123.522 0.000 . 1 . . . . 43 TRP CH2 . 7105 1 527 . 1 1 43 43 TRP N N 15 121.065 0.021 . 1 . . . . 43 TRP N . 7105 1 528 . 1 1 43 43 TRP NE1 N 15 130.994 0.000 . 1 . . . . 43 TRP NE1 . 7105 1 529 . 1 1 44 44 LYS H H 1 7.573 0.005 . 1 . . . . 44 LYS H . 7105 1 530 . 1 1 44 44 LYS HA H 1 3.835 0.007 . 1 . . . . 44 LYS HA . 7105 1 531 . 1 1 44 44 LYS HB2 H 1 1.952 0.001 . 2 . . . . 44 LYS HB2 . 7105 1 532 . 1 1 44 44 LYS HB3 H 1 1.892 0.000 . 2 . . . . 44 LYS HB3 . 7105 1 533 . 1 1 44 44 LYS HG2 H 1 1.554 0.000 . 1 . . . . 44 LYS HG2 . 7105 1 534 . 1 1 44 44 LYS HG3 H 1 1.554 0.000 . 1 . . . . 44 LYS HG3 . 7105 1 535 . 1 1 44 44 LYS HD2 H 1 1.729 0.002 . 1 . . . . 44 LYS HD2 . 7105 1 536 . 1 1 44 44 LYS HD3 H 1 1.729 0.002 . 1 . . . . 44 LYS HD3 . 7105 1 537 . 1 1 44 44 LYS HE2 H 1 3.048 0.005 . 1 . . . . 44 LYS HE2 . 7105 1 538 . 1 1 44 44 LYS HE3 H 1 3.048 0.005 . 1 . . . . 44 LYS HE3 . 7105 1 539 . 1 1 44 44 LYS CA C 13 58.603 0.034 . 1 . . . . 44 LYS CA . 7105 1 540 . 1 1 44 44 LYS CB C 13 32.288 0.018 . 1 . . . . 44 LYS CB . 7105 1 541 . 1 1 44 44 LYS CG C 13 25.317 0.000 . 1 . . . . 44 LYS CG . 7105 1 542 . 1 1 44 44 LYS CD C 13 29.258 0.074 . 1 . . . . 44 LYS CD . 7105 1 543 . 1 1 44 44 LYS CE C 13 42.225 0.006 . 1 . . . . 44 LYS CE . 7105 1 544 . 1 1 44 44 LYS N N 15 115.471 0.004 . 1 . . . . 44 LYS N . 7105 1 545 . 1 1 45 45 MET H H 1 7.240 0.007 . 1 . . . . 45 MET H . 7105 1 546 . 1 1 45 45 MET HA H 1 4.359 0.004 . 1 . . . . 45 MET HA . 7105 1 547 . 1 1 45 45 MET HB2 H 1 2.101 0.003 . 2 . . . . 45 MET HB2 . 7105 1 548 . 1 1 45 45 MET HB3 H 1 2.009 0.002 . 2 . . . . 45 MET HB3 . 7105 1 549 . 1 1 45 45 MET HG2 H 1 2.500 0.030 . 2 . . . . 45 MET HG2 . 7105 1 550 . 1 1 45 45 MET HG3 H 1 2.358 0.009 . 2 . . . . 45 MET HG3 . 7105 1 551 . 1 1 45 45 MET HE1 H 1 1.988 0.000 . 1 . . . . 45 MET HE . 7105 1 552 . 1 1 45 45 MET HE2 H 1 1.988 0.000 . 1 . . . . 45 MET HE . 7105 1 553 . 1 1 45 45 MET HE3 H 1 1.988 0.000 . 1 . . . . 45 MET HE . 7105 1 554 . 1 1 45 45 MET CA C 13 55.172 0.000 . 1 . . . . 45 MET CA . 7105 1 555 . 1 1 45 45 MET CB C 13 33.260 0.033 . 1 . . . . 45 MET CB . 7105 1 556 . 1 1 45 45 MET CG C 13 32.258 0.038 . 1 . . . . 45 MET CG . 7105 1 557 . 1 1 45 45 MET CE C 13 16.941 0.000 . 1 . . . . 45 MET CE . 7105 1 558 . 1 1 45 45 MET N N 15 114.927 0.062 . 1 . . . . 45 MET N . 7105 1 559 . 1 1 46 46 LEU H H 1 7.037 0.004 . 1 . . . . 46 LEU H . 7105 1 560 . 1 1 46 46 LEU HA H 1 4.262 0.006 . 1 . . . . 46 LEU HA . 7105 1 561 . 1 1 46 46 LEU HB2 H 1 1.247 0.008 . 2 . . . . 46 LEU HB2 . 7105 1 562 . 1 1 46 46 LEU HB3 H 1 1.125 0.006 . 2 . . . . 46 LEU HB3 . 7105 1 563 . 1 1 46 46 LEU HG H 1 1.798 0.009 . 1 . . . . 46 LEU HG . 7105 1 564 . 1 1 46 46 LEU HD11 H 1 0.208 0.006 . 2 . . . . 46 LEU HD1 . 7105 1 565 . 1 1 46 46 LEU HD12 H 1 0.208 0.006 . 2 . . . . 46 LEU HD1 . 7105 1 566 . 1 1 46 46 LEU HD13 H 1 0.208 0.006 . 2 . . . . 46 LEU HD1 . 7105 1 567 . 1 1 46 46 LEU HD21 H 1 0.717 0.003 . 2 . . . . 46 LEU HD2 . 7105 1 568 . 1 1 46 46 LEU HD22 H 1 0.717 0.003 . 2 . . . . 46 LEU HD2 . 7105 1 569 . 1 1 46 46 LEU HD23 H 1 0.717 0.003 . 2 . . . . 46 LEU HD2 . 7105 1 570 . 1 1 46 46 LEU C C 13 178.012 0.000 . 1 . . . . 46 LEU C . 7105 1 571 . 1 1 46 46 LEU CA C 13 55.207 0.001 . 1 . . . . 46 LEU CA . 7105 1 572 . 1 1 46 46 LEU CB C 13 42.722 0.011 . 1 . . . . 46 LEU CB . 7105 1 573 . 1 1 46 46 LEU CG C 13 26.312 0.000 . 1 . . . . 46 LEU CG . 7105 1 574 . 1 1 46 46 LEU CD1 C 13 25.807 0.013 . 2 . . . . 46 LEU CD1 . 7105 1 575 . 1 1 46 46 LEU CD2 C 13 22.778 0.084 . 2 . . . . 46 LEU CD2 . 7105 1 576 . 1 1 46 46 LEU N N 15 121.653 0.030 . 1 . . . . 46 LEU N . 7105 1 577 . 1 1 47 47 THR H H 1 8.867 0.005 . 1 . . . . 47 THR H . 7105 1 578 . 1 1 47 47 THR HA H 1 4.295 0.002 . 1 . . . . 47 THR HA . 7105 1 579 . 1 1 47 47 THR HB H 1 4.660 0.011 . 1 . . . . 47 THR HB . 7105 1 580 . 1 1 47 47 THR HG21 H 1 1.364 0.004 . 1 . . . . 47 THR HG2 . 7105 1 581 . 1 1 47 47 THR HG22 H 1 1.364 0.004 . 1 . . . . 47 THR HG2 . 7105 1 582 . 1 1 47 47 THR HG23 H 1 1.364 0.004 . 1 . . . . 47 THR HG2 . 7105 1 583 . 1 1 47 47 THR CA C 13 61.226 0.000 . 1 . . . . 47 THR CA . 7105 1 584 . 1 1 47 47 THR CB C 13 71.405 0.032 . 1 . . . . 47 THR CB . 7105 1 585 . 1 1 47 47 THR CG2 C 13 21.864 0.036 . 1 . . . . 47 THR CG2 . 7105 1 586 . 1 1 47 47 THR N N 15 112.949 0.032 . 1 . . . . 47 THR N . 7105 1 587 . 1 1 48 48 GLU H H 1 8.784 0.004 . 1 . . . . 48 GLU H . 7105 1 588 . 1 1 48 48 GLU HA H 1 3.819 0.004 . 1 . . . . 48 GLU HA . 7105 1 589 . 1 1 48 48 GLU HB2 H 1 2.038 0.007 . 1 . . . . 48 GLU HB2 . 7105 1 590 . 1 1 48 48 GLU HB3 H 1 2.038 0.007 . 1 . . . . 48 GLU HB3 . 7105 1 591 . 1 1 48 48 GLU HG2 H 1 2.341 0.002 . 2 . . . . 48 GLU HG2 . 7105 1 592 . 1 1 48 48 GLU HG3 H 1 2.283 0.001 . 2 . . . . 48 GLU HG3 . 7105 1 593 . 1 1 48 48 GLU CA C 13 60.453 0.010 . 1 . . . . 48 GLU CA . 7105 1 594 . 1 1 48 48 GLU CB C 13 29.284 0.055 . 1 . . . . 48 GLU CB . 7105 1 595 . 1 1 48 48 GLU CG C 13 36.751 0.005 . 1 . . . . 48 GLU CG . 7105 1 596 . 1 1 48 48 GLU N N 15 120.313 0.033 . 1 . . . . 48 GLU N . 7105 1 597 . 1 1 49 49 ALA H H 1 8.224 0.005 . 1 . . . . 49 ALA H . 7105 1 598 . 1 1 49 49 ALA HA H 1 4.136 0.000 . 1 . . . . 49 ALA HA . 7105 1 599 . 1 1 49 49 ALA HB1 H 1 1.390 0.015 . 1 . . . . 49 ALA HB . 7105 1 600 . 1 1 49 49 ALA HB2 H 1 1.390 0.015 . 1 . . . . 49 ALA HB . 7105 1 601 . 1 1 49 49 ALA HB3 H 1 1.390 0.015 . 1 . . . . 49 ALA HB . 7105 1 602 . 1 1 49 49 ALA CA C 13 55.005 0.000 . 1 . . . . 49 ALA CA . 7105 1 603 . 1 1 49 49 ALA CB C 13 18.521 0.045 . 1 . . . . 49 ALA CB . 7105 1 604 . 1 1 49 49 ALA N N 15 119.673 0.052 . 1 . . . . 49 ALA N . 7105 1 605 . 1 1 50 50 GLU H H 1 7.538 0.008 . 1 . . . . 50 GLU H . 7105 1 606 . 1 1 50 50 GLU HA H 1 4.129 0.001 . 1 . . . . 50 GLU HA . 7105 1 607 . 1 1 50 50 GLU HB2 H 1 2.322 0.002 . 2 . . . . 50 GLU HB2 . 7105 1 608 . 1 1 50 50 GLU HB3 H 1 2.044 0.000 . 2 . . . . 50 GLU HB3 . 7105 1 609 . 1 1 50 50 GLU HG2 H 1 2.308 0.001 . 1 . . . . 50 GLU HG2 . 7105 1 610 . 1 1 50 50 GLU HG3 H 1 2.308 0.001 . 1 . . . . 50 GLU HG3 . 7105 1 611 . 1 1 50 50 GLU CA C 13 58.493 0.001 . 1 . . . . 50 GLU CA . 7105 1 612 . 1 1 50 50 GLU CB C 13 31.487 0.022 . 1 . . . . 50 GLU CB . 7105 1 613 . 1 1 50 50 GLU CG C 13 38.245 0.000 . 1 . . . . 50 GLU CG . 7105 1 614 . 1 1 50 50 GLU N N 15 117.044 0.038 . 1 . . . . 50 GLU N . 7105 1 615 . 1 1 51 51 LYS H H 1 7.781 0.009 . 1 . . . . 51 LYS H . 7105 1 616 . 1 1 51 51 LYS HA H 1 4.182 0.001 . 1 . . . . 51 LYS HA . 7105 1 617 . 1 1 51 51 LYS HB2 H 1 1.726 0.004 . 1 . . . . 51 LYS HB2 . 7105 1 618 . 1 1 51 51 LYS HB3 H 1 1.726 0.004 . 1 . . . . 51 LYS HB3 . 7105 1 619 . 1 1 51 51 LYS HG2 H 1 1.030 0.000 . 2 . . . . 51 LYS HG2 . 7105 1 620 . 1 1 51 51 LYS HG3 H 1 -0.150 0.001 . 2 . . . . 51 LYS HG3 . 7105 1 621 . 1 1 51 51 LYS HD2 H 1 0.815 0.001 . 2 . . . . 51 LYS HD2 . 7105 1 622 . 1 1 51 51 LYS HD3 H 1 0.748 0.001 . 2 . . . . 51 LYS HD3 . 7105 1 623 . 1 1 51 51 LYS HE2 H 1 2.040 0.006 . 2 . . . . 51 LYS HE2 . 7105 1 624 . 1 1 51 51 LYS HE3 H 1 1.661 0.002 . 2 . . . . 51 LYS HE3 . 7105 1 625 . 1 1 51 51 LYS CA C 13 59.003 0.003 . 1 . . . . 51 LYS CA . 7105 1 626 . 1 1 51 51 LYS CB C 13 34.035 0.017 . 1 . . . . 51 LYS CB . 7105 1 627 . 1 1 51 51 LYS CG C 13 26.799 0.024 . 1 . . . . 51 LYS CG . 7105 1 628 . 1 1 51 51 LYS CD C 13 29.327 0.009 . 1 . . . . 51 LYS CD . 7105 1 629 . 1 1 51 51 LYS CE C 13 41.729 0.016 . 1 . . . . 51 LYS CE . 7105 1 630 . 1 1 51 51 LYS N N 15 115.673 0.037 . 1 . . . . 51 LYS N . 7105 1 631 . 1 1 52 52 TRP H H 1 7.989 0.002 . 1 . . . . 52 TRP H . 7105 1 632 . 1 1 52 52 TRP HA H 1 4.898 0.004 . 1 . . . . 52 TRP HA . 7105 1 633 . 1 1 52 52 TRP HB2 H 1 3.597 0.001 . 2 . . . . 52 TRP HB2 . 7105 1 634 . 1 1 52 52 TRP HB3 H 1 3.483 0.003 . 2 . . . . 52 TRP HB3 . 7105 1 635 . 1 1 52 52 TRP HD1 H 1 7.263 0.003 . 1 . . . . 52 TRP HD1 . 7105 1 636 . 1 1 52 52 TRP HE1 H 1 10.004 0.005 . 1 . . . . 52 TRP HE1 . 7105 1 637 . 1 1 52 52 TRP HE3 H 1 7.608 0.011 . 1 . . . . 52 TRP HE3 . 7105 1 638 . 1 1 52 52 TRP HZ2 H 1 7.445 0.007 . 1 . . . . 52 TRP HZ2 . 7105 1 639 . 1 1 52 52 TRP HZ3 H 1 7.195 0.002 . 1 . . . . 52 TRP HZ3 . 7105 1 640 . 1 1 52 52 TRP HH2 H 1 7.068 0.004 . 1 . . . . 52 TRP HH2 . 7105 1 641 . 1 1 52 52 TRP CA C 13 62.712 0.012 . 1 . . . . 52 TRP CA . 7105 1 642 . 1 1 52 52 TRP CB C 13 27.524 0.057 . 1 . . . . 52 TRP CB . 7105 1 643 . 1 1 52 52 TRP CD1 C 13 127.252 0.027 . 1 . . . . 52 TRP CD1 . 7105 1 644 . 1 1 52 52 TRP CE3 C 13 121.266 0.002 . 1 . . . . 52 TRP CE3 . 7105 1 645 . 1 1 52 52 TRP CZ2 C 13 114.794 0.014 . 1 . . . . 52 TRP CZ2 . 7105 1 646 . 1 1 52 52 TRP CZ3 C 13 124.715 0.046 . 1 . . . . 52 TRP CZ3 . 7105 1 647 . 1 1 52 52 TRP CH2 C 13 121.766 0.004 . 1 . . . . 52 TRP CH2 . 7105 1 648 . 1 1 52 52 TRP N N 15 120.651 0.000 . 1 . . . . 52 TRP N . 7105 1 649 . 1 1 52 52 TRP NE1 N 15 128.830 0.021 . 1 . . . . 52 TRP NE1 . 7105 1 650 . 1 1 53 53 PRO HA H 1 4.032 0.002 . 1 . . . . 53 PRO HA . 7105 1 651 . 1 1 53 53 PRO HB2 H 1 2.153 0.004 . 2 . . . . 53 PRO HB2 . 7105 1 652 . 1 1 53 53 PRO HB3 H 1 1.035 0.004 . 2 . . . . 53 PRO HB3 . 7105 1 653 . 1 1 53 53 PRO HG2 H 1 2.003 0.004 . 2 . . . . 53 PRO HG2 . 7105 1 654 . 1 1 53 53 PRO HG3 H 1 1.911 0.002 . 2 . . . . 53 PRO HG3 . 7105 1 655 . 1 1 53 53 PRO HD2 H 1 3.979 0.002 . 2 . . . . 53 PRO HD2 . 7105 1 656 . 1 1 53 53 PRO HD3 H 1 3.777 0.002 . 2 . . . . 53 PRO HD3 . 7105 1 657 . 1 1 53 53 PRO CA C 13 65.952 0.045 . 1 . . . . 53 PRO CA . 7105 1 658 . 1 1 53 53 PRO CB C 13 31.131 0.036 . 1 . . . . 53 PRO CB . 7105 1 659 . 1 1 53 53 PRO CG C 13 28.300 0.000 . 1 . . . . 53 PRO CG . 7105 1 660 . 1 1 53 53 PRO CD C 13 50.487 0.017 . 1 . . . . 53 PRO CD . 7105 1 661 . 1 1 54 54 PHE H H 1 7.595 0.006 . 1 . . . . 54 PHE H . 7105 1 662 . 1 1 54 54 PHE HA H 1 4.243 0.006 . 1 . . . . 54 PHE HA . 7105 1 663 . 1 1 54 54 PHE HB2 H 1 3.626 0.006 . 2 . . . . 54 PHE HB2 . 7105 1 664 . 1 1 54 54 PHE HB3 H 1 3.259 0.012 . 2 . . . . 54 PHE HB3 . 7105 1 665 . 1 1 54 54 PHE HD1 H 1 7.465 0.003 . 1 . . . . 54 PHE HD . 7105 1 666 . 1 1 54 54 PHE HD2 H 1 7.465 0.003 . 1 . . . . 54 PHE HD . 7105 1 667 . 1 1 54 54 PHE HE1 H 1 7.737 0.003 . 1 . . . . 54 PHE HE . 7105 1 668 . 1 1 54 54 PHE HE2 H 1 7.737 0.003 . 1 . . . . 54 PHE HE . 7105 1 669 . 1 1 54 54 PHE HZ H 1 7.703 0.002 . 1 . . . . 54 PHE HZ . 7105 1 670 . 1 1 54 54 PHE CA C 13 61.733 0.000 . 1 . . . . 54 PHE CA . 7105 1 671 . 1 1 54 54 PHE CB C 13 38.249 0.045 . 1 . . . . 54 PHE CB . 7105 1 672 . 1 1 54 54 PHE CD1 C 13 131.762 0.031 . 1 . . . . 54 PHE CD . 7105 1 673 . 1 1 54 54 PHE CD2 C 13 131.762 0.031 . 1 . . . . 54 PHE CD . 7105 1 674 . 1 1 54 54 PHE CE1 C 13 132.824 0.115 . 1 . . . . 54 PHE CE . 7105 1 675 . 1 1 54 54 PHE CE2 C 13 132.824 0.115 . 1 . . . . 54 PHE CE . 7105 1 676 . 1 1 54 54 PHE CZ C 13 131.197 0.013 . 1 . . . . 54 PHE CZ . 7105 1 677 . 1 1 54 54 PHE N N 15 117.188 0.032 . 1 . . . . 54 PHE N . 7105 1 678 . 1 1 55 55 PHE H H 1 7.959 0.006 . 1 . . . . 55 PHE H . 7105 1 679 . 1 1 55 55 PHE HA H 1 4.327 0.019 . 1 . . . . 55 PHE HA . 7105 1 680 . 1 1 55 55 PHE HB2 H 1 3.119 0.027 . 1 . . . . 55 PHE HB2 . 7105 1 681 . 1 1 55 55 PHE HB3 H 1 3.119 0.027 . 1 . . . . 55 PHE HB3 . 7105 1 682 . 1 1 55 55 PHE HD1 H 1 7.470 0.005 . 1 . . . . 55 PHE HD . 7105 1 683 . 1 1 55 55 PHE HD2 H 1 7.470 0.005 . 1 . . . . 55 PHE HD . 7105 1 684 . 1 1 55 55 PHE HE1 H 1 7.536 0.005 . 1 . . . . 55 PHE HE . 7105 1 685 . 1 1 55 55 PHE HE2 H 1 7.536 0.005 . 1 . . . . 55 PHE HE . 7105 1 686 . 1 1 55 55 PHE CA C 13 62.729 0.000 . 1 . . . . 55 PHE CA . 7105 1 687 . 1 1 55 55 PHE CB C 13 38.832 0.038 . 1 . . . . 55 PHE CB . 7105 1 688 . 1 1 55 55 PHE CD1 C 13 132.276 0.003 . 1 . . . . 55 PHE CD . 7105 1 689 . 1 1 55 55 PHE CD2 C 13 132.276 0.003 . 1 . . . . 55 PHE CD . 7105 1 690 . 1 1 55 55 PHE CE1 C 13 132.137 0.020 . 1 . . . . 55 PHE CE . 7105 1 691 . 1 1 55 55 PHE CE2 C 13 132.137 0.020 . 1 . . . . 55 PHE CE . 7105 1 692 . 1 1 55 55 PHE N N 15 120.274 0.035 . 1 . . . . 55 PHE N . 7105 1 693 . 1 1 56 56 GLN H H 1 8.386 0.000 . 1 . . . . 56 GLN H . 7105 1 694 . 1 1 56 56 GLN HA H 1 3.757 0.004 . 1 . . . . 56 GLN HA . 7105 1 695 . 1 1 56 56 GLN HB2 H 1 1.758 0.001 . 2 . . . . 56 GLN HB2 . 7105 1 696 . 1 1 56 56 GLN HB3 H 1 1.596 0.002 . 2 . . . . 56 GLN HB3 . 7105 1 697 . 1 1 56 56 GLN HG2 H 1 1.543 0.004 . 2 . . . . 56 GLN HG2 . 7105 1 698 . 1 1 56 56 GLN HG3 H 1 1.451 0.008 . 2 . . . . 56 GLN HG3 . 7105 1 699 . 1 1 56 56 GLN HE21 H 1 6.721 0.003 . 1 . . . . 56 GLN HE21 . 7105 1 700 . 1 1 56 56 GLN HE22 H 1 6.882 0.003 . 1 . . . . 56 GLN HE22 . 7105 1 701 . 1 1 56 56 GLN CA C 13 59.180 0.022 . 1 . . . . 56 GLN CA . 7105 1 702 . 1 1 56 56 GLN CB C 13 28.299 0.002 . 1 . . . . 56 GLN CB . 7105 1 703 . 1 1 56 56 GLN CG C 13 33.783 0.026 . 1 . . . . 56 GLN CG . 7105 1 704 . 1 1 56 56 GLN N N 15 119.115 0.000 . 1 . . . . 56 GLN N . 7105 1 705 . 1 1 56 56 GLN NE2 N 15 112.130 0.104 . 1 . . . . 56 GLN NE2 . 7105 1 706 . 1 1 57 57 GLU H H 1 7.868 0.003 . 1 . . . . 57 GLU H . 7105 1 707 . 1 1 57 57 GLU HA H 1 4.166 0.017 . 1 . . . . 57 GLU HA . 7105 1 708 . 1 1 57 57 GLU HB2 H 1 2.149 0.001 . 2 . . . . 57 GLU HB2 . 7105 1 709 . 1 1 57 57 GLU HB3 H 1 2.001 0.008 . 2 . . . . 57 GLU HB3 . 7105 1 710 . 1 1 57 57 GLU HG2 H 1 2.347 0.003 . 2 . . . . 57 GLU HG2 . 7105 1 711 . 1 1 57 57 GLU HG3 H 1 2.213 0.008 . 2 . . . . 57 GLU HG3 . 7105 1 712 . 1 1 57 57 GLU CA C 13 59.236 0.052 . 1 . . . . 57 GLU CA . 7105 1 713 . 1 1 57 57 GLU CB C 13 29.400 0.000 . 1 . . . . 57 GLU CB . 7105 1 714 . 1 1 57 57 GLU CG C 13 34.765 0.000 . 1 . . . . 57 GLU CG . 7105 1 715 . 1 1 57 57 GLU N N 15 120.923 0.046 . 1 . . . . 57 GLU N . 7105 1 716 . 1 1 58 58 ALA H H 1 8.221 0.009 . 1 . . . . 58 ALA H . 7105 1 717 . 1 1 58 58 ALA HA H 1 4.076 0.000 . 1 . . . . 58 ALA HA . 7105 1 718 . 1 1 58 58 ALA HB1 H 1 1.499 0.007 . 1 . . . . 58 ALA HB . 7105 1 719 . 1 1 58 58 ALA HB2 H 1 1.499 0.007 . 1 . . . . 58 ALA HB . 7105 1 720 . 1 1 58 58 ALA HB3 H 1 1.499 0.007 . 1 . . . . 58 ALA HB . 7105 1 721 . 1 1 58 58 ALA CA C 13 55.629 0.000 . 1 . . . . 58 ALA CA . 7105 1 722 . 1 1 58 58 ALA CB C 13 17.853 0.079 . 1 . . . . 58 ALA CB . 7105 1 723 . 1 1 58 58 ALA N N 15 120.710 0.035 . 1 . . . . 58 ALA N . 7105 1 724 . 1 1 59 59 GLN H H 1 8.378 0.003 . 1 . . . . 59 GLN H . 7105 1 725 . 1 1 59 59 GLN HA H 1 4.167 0.003 . 1 . . . . 59 GLN HA . 7105 1 726 . 1 1 59 59 GLN HB2 H 1 2.228 0.013 . 1 . . . . 59 GLN HB2 . 7105 1 727 . 1 1 59 59 GLN HB3 H 1 2.228 0.013 . 1 . . . . 59 GLN HB3 . 7105 1 728 . 1 1 59 59 GLN HG2 H 1 2.642 0.011 . 2 . . . . 59 GLN HG2 . 7105 1 729 . 1 1 59 59 GLN HG3 H 1 2.498 0.006 . 2 . . . . 59 GLN HG3 . 7105 1 730 . 1 1 59 59 GLN HE21 H 1 6.744 0.013 . 1 . . . . 59 GLN HE21 . 7105 1 731 . 1 1 59 59 GLN HE22 H 1 7.441 0.002 . 1 . . . . 59 GLN HE22 . 7105 1 732 . 1 1 59 59 GLN CA C 13 59.363 0.000 . 1 . . . . 59 GLN CA . 7105 1 733 . 1 1 59 59 GLN CB C 13 28.299 0.002 . 1 . . . . 59 GLN CB . 7105 1 734 . 1 1 59 59 GLN CG C 13 34.270 0.001 . 1 . . . . 59 GLN CG . 7105 1 735 . 1 1 59 59 GLN N N 15 119.512 0.051 . 1 . . . . 59 GLN N . 7105 1 736 . 1 1 59 59 GLN NE2 N 15 110.140 0.033 . 1 . . . . 59 GLN NE2 . 7105 1 737 . 1 1 60 60 LYS H H 1 7.930 0.002 . 1 . . . . 60 LYS H . 7105 1 738 . 1 1 60 60 LYS HA H 1 4.144 0.000 . 1 . . . . 60 LYS HA . 7105 1 739 . 1 1 60 60 LYS HB2 H 1 2.048 0.004 . 1 . . . . 60 LYS HB2 . 7105 1 740 . 1 1 60 60 LYS HB3 H 1 2.048 0.004 . 1 . . . . 60 LYS HB3 . 7105 1 741 . 1 1 60 60 LYS HG2 H 1 1.376 0.000 . 1 . . . . 60 LYS HG2 . 7105 1 742 . 1 1 60 60 LYS HG3 H 1 1.376 0.000 . 1 . . . . 60 LYS HG3 . 7105 1 743 . 1 1 60 60 LYS HD2 H 1 1.694 0.000 . 1 . . . . 60 LYS HD2 . 7105 1 744 . 1 1 60 60 LYS HD3 H 1 1.694 0.000 . 1 . . . . 60 LYS HD3 . 7105 1 745 . 1 1 60 60 LYS HE2 H 1 2.915 0.001 . 1 . . . . 60 LYS HE2 . 7105 1 746 . 1 1 60 60 LYS HE3 H 1 2.915 0.001 . 1 . . . . 60 LYS HE3 . 7105 1 747 . 1 1 60 60 LYS CA C 13 59.827 0.000 . 1 . . . . 60 LYS CA . 7105 1 748 . 1 1 60 60 LYS CB C 13 32.250 0.057 . 1 . . . . 60 LYS CB . 7105 1 749 . 1 1 60 60 LYS CG C 13 24.820 0.000 . 1 . . . . 60 LYS CG . 7105 1 750 . 1 1 60 60 LYS CD C 13 29.295 0.000 . 1 . . . . 60 LYS CD . 7105 1 751 . 1 1 60 60 LYS CE C 13 42.222 0.000 . 1 . . . . 60 LYS CE . 7105 1 752 . 1 1 60 60 LYS N N 15 122.898 0.000 . 1 . . . . 60 LYS N . 7105 1 753 . 1 1 61 61 LEU H H 1 8.472 0.004 . 1 . . . . 61 LEU H . 7105 1 754 . 1 1 61 61 LEU HA H 1 4.182 0.000 . 1 . . . . 61 LEU HA . 7105 1 755 . 1 1 61 61 LEU HB2 H 1 2.101 0.000 . 2 . . . . 61 LEU HB2 . 7105 1 756 . 1 1 61 61 LEU HB3 H 1 1.472 0.001 . 2 . . . . 61 LEU HB3 . 7105 1 757 . 1 1 61 61 LEU HG H 1 1.997 0.002 . 1 . . . . 61 LEU HG . 7105 1 758 . 1 1 61 61 LEU HD11 H 1 0.940 0.006 . 2 . . . . 61 LEU HD1 . 7105 1 759 . 1 1 61 61 LEU HD12 H 1 0.940 0.006 . 2 . . . . 61 LEU HD1 . 7105 1 760 . 1 1 61 61 LEU HD13 H 1 0.940 0.006 . 2 . . . . 61 LEU HD1 . 7105 1 761 . 1 1 61 61 LEU HD21 H 1 0.942 0.004 . 2 . . . . 61 LEU HD2 . 7105 1 762 . 1 1 61 61 LEU HD22 H 1 0.942 0.004 . 2 . . . . 61 LEU HD2 . 7105 1 763 . 1 1 61 61 LEU HD23 H 1 0.942 0.004 . 2 . . . . 61 LEU HD2 . 7105 1 764 . 1 1 61 61 LEU CA C 13 58.058 0.000 . 1 . . . . 61 LEU CA . 7105 1 765 . 1 1 61 61 LEU CB C 13 41.713 0.027 . 1 . . . . 61 LEU CB . 7105 1 766 . 1 1 61 61 LEU CG C 13 26.809 0.000 . 1 . . . . 61 LEU CG . 7105 1 767 . 1 1 61 61 LEU CD1 C 13 22.324 0.019 . 2 . . . . 61 LEU CD1 . 7105 1 768 . 1 1 61 61 LEU CD2 C 13 26.328 0.035 . 2 . . . . 61 LEU CD2 . 7105 1 769 . 1 1 61 61 LEU N N 15 119.524 0.031 . 1 . . . . 61 LEU N . 7105 1 770 . 1 1 62 62 GLN H H 1 8.407 0.003 . 1 . . . . 62 GLN H . 7105 1 771 . 1 1 62 62 GLN HA H 1 3.963 0.008 . 1 . . . . 62 GLN HA . 7105 1 772 . 1 1 62 62 GLN HB2 H 1 2.255 0.010 . 1 . . . . 62 GLN HB2 . 7105 1 773 . 1 1 62 62 GLN HB3 H 1 2.255 0.010 . 1 . . . . 62 GLN HB3 . 7105 1 774 . 1 1 62 62 GLN HG2 H 1 2.443 0.015 . 2 . . . . 62 GLN HG2 . 7105 1 775 . 1 1 62 62 GLN HG3 H 1 2.383 0.001 . 2 . . . . 62 GLN HG3 . 7105 1 776 . 1 1 62 62 GLN HE21 H 1 7.045 0.000 . 1 . . . . 62 GLN HE21 . 7105 1 777 . 1 1 62 62 GLN HE22 H 1 7.309 0.001 . 1 . . . . 62 GLN HE22 . 7105 1 778 . 1 1 62 62 GLN CA C 13 59.562 0.000 . 1 . . . . 62 GLN CA . 7105 1 779 . 1 1 62 62 GLN CB C 13 28.320 0.002 . 1 . . . . 62 GLN CB . 7105 1 780 . 1 1 62 62 GLN CG C 13 34.264 0.012 . 1 . . . . 62 GLN CG . 7105 1 781 . 1 1 62 62 GLN N N 15 121.628 0.023 . 1 . . . . 62 GLN N . 7105 1 782 . 1 1 62 62 GLN NE2 N 15 111.244 0.037 . 1 . . . . 62 GLN NE2 . 7105 1 783 . 1 1 63 63 ALA H H 1 8.134 0.001 . 1 . . . . 63 ALA H . 7105 1 784 . 1 1 63 63 ALA HA H 1 4.235 0.000 . 1 . . . . 63 ALA HA . 7105 1 785 . 1 1 63 63 ALA HB1 H 1 1.621 0.010 . 1 . . . . 63 ALA HB . 7105 1 786 . 1 1 63 63 ALA HB2 H 1 1.621 0.010 . 1 . . . . 63 ALA HB . 7105 1 787 . 1 1 63 63 ALA HB3 H 1 1.621 0.010 . 1 . . . . 63 ALA HB . 7105 1 788 . 1 1 63 63 ALA CA C 13 55.532 0.000 . 1 . . . . 63 ALA CA . 7105 1 789 . 1 1 63 63 ALA CB C 13 18.026 0.035 . 1 . . . . 63 ALA CB . 7105 1 790 . 1 1 63 63 ALA N N 15 123.387 0.013 . 1 . . . . 63 ALA N . 7105 1 791 . 1 1 64 64 MET H H 1 8.242 0.003 . 1 . . . . 64 MET H . 7105 1 792 . 1 1 64 64 MET HA H 1 4.202 0.005 . 1 . . . . 64 MET HA . 7105 1 793 . 1 1 64 64 MET HB2 H 1 2.208 0.006 . 1 . . . . 64 MET HB2 . 7105 1 794 . 1 1 64 64 MET HB3 H 1 2.208 0.006 . 1 . . . . 64 MET HB3 . 7105 1 795 . 1 1 64 64 MET HG2 H 1 2.804 0.008 . 2 . . . . 64 MET HG2 . 7105 1 796 . 1 1 64 64 MET HG3 H 1 2.602 0.008 . 2 . . . . 64 MET HG3 . 7105 1 797 . 1 1 64 64 MET HE1 H 1 2.113 0.000 . 1 . . . . 64 MET HE . 7105 1 798 . 1 1 64 64 MET HE2 H 1 2.113 0.000 . 1 . . . . 64 MET HE . 7105 1 799 . 1 1 64 64 MET HE3 H 1 2.113 0.000 . 1 . . . . 64 MET HE . 7105 1 800 . 1 1 64 64 MET CA C 13 58.807 0.000 . 1 . . . . 64 MET CA . 7105 1 801 . 1 1 64 64 MET CB C 13 33.269 0.005 . 1 . . . . 64 MET CB . 7105 1 802 . 1 1 64 64 MET CG C 13 32.278 0.000 . 1 . . . . 64 MET CG . 7105 1 803 . 1 1 64 64 MET CE C 13 17.049 0.000 . 1 . . . . 64 MET CE . 7105 1 804 . 1 1 64 64 MET N N 15 117.797 0.042 . 1 . . . . 64 MET N . 7105 1 805 . 1 1 65 65 HIS H H 1 8.158 0.004 . 1 . . . . 65 HIS H . 7105 1 806 . 1 1 65 65 HIS HA H 1 4.130 0.006 . 1 . . . . 65 HIS HA . 7105 1 807 . 1 1 65 65 HIS HB2 H 1 3.371 0.006 . 2 . . . . 65 HIS HB2 . 7105 1 808 . 1 1 65 65 HIS HB3 H 1 3.242 0.011 . 2 . . . . 65 HIS HB3 . 7105 1 809 . 1 1 65 65 HIS HD2 H 1 6.940 0.000 . 1 . . . . 65 HIS HD2 . 7105 1 810 . 1 1 65 65 HIS CA C 13 61.255 0.001 . 1 . . . . 65 HIS CA . 7105 1 811 . 1 1 65 65 HIS CB C 13 31.788 0.034 . 1 . . . . 65 HIS CB . 7105 1 812 . 1 1 65 65 HIS CD2 C 13 117.749 0.000 . 1 . . . . 65 HIS CD2 . 7105 1 813 . 1 1 65 65 HIS N N 15 122.464 0.075 . 1 . . . . 65 HIS N . 7105 1 814 . 1 1 66 66 ARG H H 1 8.015 0.004 . 1 . . . . 66 ARG H . 7105 1 815 . 1 1 66 66 ARG HA H 1 4.236 0.001 . 1 . . . . 66 ARG HA . 7105 1 816 . 1 1 66 66 ARG HB2 H 1 2.021 0.001 . 2 . . . . 66 ARG HB2 . 7105 1 817 . 1 1 66 66 ARG HB3 H 1 1.975 0.000 . 2 . . . . 66 ARG HB3 . 7105 1 818 . 1 1 66 66 ARG HG2 H 1 1.951 0.001 . 2 . . . . 66 ARG HG2 . 7105 1 819 . 1 1 66 66 ARG HG3 H 1 1.853 0.001 . 2 . . . . 66 ARG HG3 . 7105 1 820 . 1 1 66 66 ARG HD2 H 1 3.369 0.000 . 2 . . . . 66 ARG HD2 . 7105 1 821 . 1 1 66 66 ARG HD3 H 1 3.332 0.000 . 2 . . . . 66 ARG HD3 . 7105 1 822 . 1 1 66 66 ARG CA C 13 58.384 0.000 . 1 . . . . 66 ARG CA . 7105 1 823 . 1 1 66 66 ARG CB C 13 30.330 0.001 . 1 . . . . 66 ARG CB . 7105 1 824 . 1 1 66 66 ARG CG C 13 27.815 0.000 . 1 . . . . 66 ARG CG . 7105 1 825 . 1 1 66 66 ARG CD C 13 43.718 0.000 . 1 . . . . 66 ARG CD . 7105 1 826 . 1 1 66 66 ARG N N 15 116.668 0.026 . 1 . . . . 66 ARG N . 7105 1 827 . 1 1 67 67 GLU H H 1 7.467 0.003 . 1 . . . . 67 GLU H . 7105 1 828 . 1 1 67 67 GLU HA H 1 4.018 0.006 . 1 . . . . 67 GLU HA . 7105 1 829 . 1 1 67 67 GLU HB2 H 1 2.069 0.004 . 1 . . . . 67 GLU HB2 . 7105 1 830 . 1 1 67 67 GLU HB3 H 1 2.069 0.004 . 1 . . . . 67 GLU HB3 . 7105 1 831 . 1 1 67 67 GLU HG2 H 1 2.366 0.001 . 2 . . . . 67 GLU HG2 . 7105 1 832 . 1 1 67 67 GLU HG3 H 1 2.178 0.001 . 2 . . . . 67 GLU HG3 . 7105 1 833 . 1 1 67 67 GLU CA C 13 58.595 0.019 . 1 . . . . 67 GLU CA . 7105 1 834 . 1 1 67 67 GLU CB C 13 30.261 0.053 . 1 . . . . 67 GLU CB . 7105 1 835 . 1 1 67 67 GLU CG C 13 36.728 0.062 . 1 . . . . 67 GLU CG . 7105 1 836 . 1 1 67 67 GLU N N 15 116.707 0.002 . 1 . . . . 67 GLU N . 7105 1 837 . 1 1 68 68 LYS H H 1 7.610 0.001 . 1 . . . . 68 LYS H . 7105 1 838 . 1 1 68 68 LYS HA H 1 3.807 0.005 . 1 . . . . 68 LYS HA . 7105 1 839 . 1 1 68 68 LYS HB2 H 1 1.355 0.006 . 2 . . . . 68 LYS HB2 . 7105 1 840 . 1 1 68 68 LYS HB3 H 1 1.002 0.003 . 2 . . . . 68 LYS HB3 . 7105 1 841 . 1 1 68 68 LYS HG2 H 1 1.039 0.006 . 2 . . . . 68 LYS HG2 . 7105 1 842 . 1 1 68 68 LYS HG3 H 1 0.684 0.006 . 2 . . . . 68 LYS HG3 . 7105 1 843 . 1 1 68 68 LYS HD2 H 1 1.434 0.007 . 1 . . . . 68 LYS HD2 . 7105 1 844 . 1 1 68 68 LYS HD3 H 1 1.434 0.007 . 1 . . . . 68 LYS HD3 . 7105 1 845 . 1 1 68 68 LYS HE2 H 1 2.843 0.006 . 1 . . . . 68 LYS HE2 . 7105 1 846 . 1 1 68 68 LYS HE3 H 1 2.843 0.006 . 1 . . . . 68 LYS HE3 . 7105 1 847 . 1 1 68 68 LYS CA C 13 58.197 0.005 . 1 . . . . 68 LYS CA . 7105 1 848 . 1 1 68 68 LYS CB C 13 33.309 0.074 . 1 . . . . 68 LYS CB . 7105 1 849 . 1 1 68 68 LYS CG C 13 25.165 0.144 . 1 . . . . 68 LYS CG . 7105 1 850 . 1 1 68 68 LYS CD C 13 29.295 0.000 . 1 . . . . 68 LYS CD . 7105 1 851 . 1 1 68 68 LYS CE C 13 42.214 0.021 . 1 . . . . 68 LYS CE . 7105 1 852 . 1 1 68 68 LYS N N 15 118.262 0.008 . 1 . . . . 68 LYS N . 7105 1 853 . 1 1 69 69 TYR H H 1 8.087 0.001 . 1 . . . . 69 TYR H . 7105 1 854 . 1 1 69 69 TYR HA H 1 5.071 0.015 . 1 . . . . 69 TYR HA . 7105 1 855 . 1 1 69 69 TYR HB2 H 1 2.886 0.007 . 2 . . . . 69 TYR HB2 . 7105 1 856 . 1 1 69 69 TYR HB3 H 1 2.593 0.008 . 2 . . . . 69 TYR HB3 . 7105 1 857 . 1 1 69 69 TYR HD1 H 1 6.523 0.010 . 1 . . . . 69 TYR HD . 7105 1 858 . 1 1 69 69 TYR HD2 H 1 6.523 0.010 . 1 . . . . 69 TYR HD . 7105 1 859 . 1 1 69 69 TYR HE1 H 1 6.584 0.011 . 1 . . . . 69 TYR HE . 7105 1 860 . 1 1 69 69 TYR HE2 H 1 6.584 0.011 . 1 . . . . 69 TYR HE . 7105 1 861 . 1 1 69 69 TYR CA C 13 54.145 0.012 . 1 . . . . 69 TYR CA . 7105 1 862 . 1 1 69 69 TYR CB C 13 37.991 0.078 . 1 . . . . 69 TYR CB . 7105 1 863 . 1 1 69 69 TYR CD1 C 13 134.414 0.065 . 1 . . . . 69 TYR CD . 7105 1 864 . 1 1 69 69 TYR CD2 C 13 134.414 0.065 . 1 . . . . 69 TYR CD . 7105 1 865 . 1 1 69 69 TYR CE1 C 13 117.460 0.000 . 1 . . . . 69 TYR CE . 7105 1 866 . 1 1 69 69 TYR CE2 C 13 117.460 0.000 . 1 . . . . 69 TYR CE . 7105 1 867 . 1 1 69 69 TYR N N 15 116.398 0.037 . 1 . . . . 69 TYR N . 7105 1 868 . 1 1 70 70 PRO HA H 1 4.665 0.000 . 1 . . . . 70 PRO HA . 7105 1 869 . 1 1 70 70 PRO HB2 H 1 2.427 0.001 . 2 . . . . 70 PRO HB2 . 7105 1 870 . 1 1 70 70 PRO HB3 H 1 1.941 0.003 . 2 . . . . 70 PRO HB3 . 7105 1 871 . 1 1 70 70 PRO HG2 H 1 2.375 0.000 . 1 . . . . 70 PRO HG2 . 7105 1 872 . 1 1 70 70 PRO HG3 H 1 2.375 0.000 . 1 . . . . 70 PRO HG3 . 7105 1 873 . 1 1 70 70 PRO HD2 H 1 3.619 0.004 . 2 . . . . 70 PRO HD2 . 7105 1 874 . 1 1 70 70 PRO HD3 H 1 3.369 0.002 . 2 . . . . 70 PRO HD3 . 7105 1 875 . 1 1 70 70 PRO CA C 13 64.880 0.000 . 1 . . . . 70 PRO CA . 7105 1 876 . 1 1 70 70 PRO CB C 13 32.252 0.074 . 1 . . . . 70 PRO CB . 7105 1 877 . 1 1 70 70 PRO CG C 13 29.294 0.000 . 1 . . . . 70 PRO CG . 7105 1 878 . 1 1 70 70 PRO CD C 13 50.193 0.023 . 1 . . . . 70 PRO CD . 7105 1 879 . 1 1 71 71 ASN H H 1 8.621 0.003 . 1 . . . . 71 ASN H . 7105 1 880 . 1 1 71 71 ASN HA H 1 4.910 0.014 . 1 . . . . 71 ASN HA . 7105 1 881 . 1 1 71 71 ASN HB2 H 1 2.994 0.011 . 2 . . . . 71 ASN HB2 . 7105 1 882 . 1 1 71 71 ASN HB3 H 1 2.809 0.022 . 2 . . . . 71 ASN HB3 . 7105 1 883 . 1 1 71 71 ASN HD21 H 1 6.982 0.000 . 1 . . . . 71 ASN HD21 . 7105 1 884 . 1 1 71 71 ASN HD22 H 1 7.605 0.000 . 1 . . . . 71 ASN HD22 . 7105 1 885 . 1 1 71 71 ASN CA C 13 52.764 0.017 . 1 . . . . 71 ASN CA . 7105 1 886 . 1 1 71 71 ASN CB C 13 38.774 0.041 . 1 . . . . 71 ASN CB . 7105 1 887 . 1 1 71 71 ASN N N 15 114.891 0.037 . 1 . . . . 71 ASN N . 7105 1 888 . 1 1 71 71 ASN ND2 N 15 112.803 0.005 . 1 . . . . 71 ASN ND2 . 7105 1 889 . 1 1 72 72 TYR H H 1 7.718 0.001 . 1 . . . . 72 TYR H . 7105 1 890 . 1 1 72 72 TYR HA H 1 4.288 0.000 . 1 . . . . 72 TYR HA . 7105 1 891 . 1 1 72 72 TYR HB2 H 1 3.172 0.003 . 2 . . . . 72 TYR HB2 . 7105 1 892 . 1 1 72 72 TYR HB3 H 1 3.098 0.001 . 2 . . . . 72 TYR HB3 . 7105 1 893 . 1 1 72 72 TYR HD1 H 1 7.028 0.005 . 1 . . . . 72 TYR HD . 7105 1 894 . 1 1 72 72 TYR HD2 H 1 7.028 0.005 . 1 . . . . 72 TYR HD . 7105 1 895 . 1 1 72 72 TYR HE1 H 1 6.731 0.006 . 1 . . . . 72 TYR HE . 7105 1 896 . 1 1 72 72 TYR HE2 H 1 6.731 0.006 . 1 . . . . 72 TYR HE . 7105 1 897 . 1 1 72 72 TYR CA C 13 59.830 0.000 . 1 . . . . 72 TYR CA . 7105 1 898 . 1 1 72 72 TYR CB C 13 39.225 0.028 . 1 . . . . 72 TYR CB . 7105 1 899 . 1 1 72 72 TYR CD1 C 13 133.364 0.036 . 1 . . . . 72 TYR CD . 7105 1 900 . 1 1 72 72 TYR CD2 C 13 133.364 0.036 . 1 . . . . 72 TYR CD . 7105 1 901 . 1 1 72 72 TYR CE1 C 13 118.015 0.029 . 1 . . . . 72 TYR CE . 7105 1 902 . 1 1 72 72 TYR CE2 C 13 118.015 0.029 . 1 . . . . 72 TYR CE . 7105 1 903 . 1 1 72 72 TYR N N 15 121.458 0.024 . 1 . . . . 72 TYR N . 7105 1 904 . 1 1 73 73 LYS H H 1 7.278 0.005 . 1 . . . . 73 LYS H . 7105 1 905 . 1 1 73 73 LYS HA H 1 4.179 0.002 . 1 . . . . 73 LYS HA . 7105 1 906 . 1 1 73 73 LYS HB2 H 1 1.563 0.002 . 1 . . . . 73 LYS HB2 . 7105 1 907 . 1 1 73 73 LYS HB3 H 1 1.563 0.002 . 1 . . . . 73 LYS HB3 . 7105 1 908 . 1 1 73 73 LYS HG2 H 1 1.313 0.004 . 1 . . . . 73 LYS HG2 . 7105 1 909 . 1 1 73 73 LYS HG3 H 1 1.313 0.004 . 1 . . . . 73 LYS HG3 . 7105 1 910 . 1 1 73 73 LYS HD2 H 1 1.714 0.000 . 1 . . . . 73 LYS HD2 . 7105 1 911 . 1 1 73 73 LYS HD3 H 1 1.714 0.001 . 1 . . . . 73 LYS HD3 . 7105 1 912 . 1 1 73 73 LYS HE2 H 1 2.991 0.009 . 1 . . . . 73 LYS HE2 . 7105 1 913 . 1 1 73 73 LYS HE3 H 1 2.991 0.009 . 1 . . . . 73 LYS HE3 . 7105 1 914 . 1 1 73 73 LYS CA C 13 54.861 0.000 . 1 . . . . 73 LYS CA . 7105 1 915 . 1 1 73 73 LYS CB C 13 35.078 0.015 . 1 . . . . 73 LYS CB . 7105 1 916 . 1 1 73 73 LYS CG C 13 24.323 0.000 . 1 . . . . 73 LYS CG . 7105 1 917 . 1 1 73 73 LYS CD C 13 29.295 0.000 . 1 . . . . 73 LYS CD . 7105 1 918 . 1 1 73 73 LYS CE C 13 42.222 0.000 . 1 . . . . 73 LYS CE . 7105 1 919 . 1 1 73 73 LYS N N 15 127.800 0.090 . 1 . . . . 73 LYS N . 7105 1 920 . 1 1 74 74 TYR H H 1 8.713 0.035 . 1 . . . . 74 TYR H . 7105 1 921 . 1 1 74 74 TYR HA H 1 4.347 0.000 . 1 . . . . 74 TYR HA . 7105 1 922 . 1 1 74 74 TYR HB2 H 1 3.187 0.000 . 2 . . . . 74 TYR HB2 . 7105 1 923 . 1 1 74 74 TYR HB3 H 1 2.971 0.000 . 2 . . . . 74 TYR HB3 . 7105 1 924 . 1 1 74 74 TYR HD1 H 1 7.111 0.003 . 1 . . . . 74 TYR HD . 7105 1 925 . 1 1 74 74 TYR HD2 H 1 7.111 0.003 . 1 . . . . 74 TYR HD . 7105 1 926 . 1 1 74 74 TYR HE1 H 1 6.688 0.008 . 1 . . . . 74 TYR HE . 7105 1 927 . 1 1 74 74 TYR HE2 H 1 6.688 0.008 . 1 . . . . 74 TYR HE . 7105 1 928 . 1 1 74 74 TYR CA C 13 57.769 0.000 . 1 . . . . 74 TYR CA . 7105 1 929 . 1 1 74 74 TYR CD1 C 13 132.292 0.013 . 1 . . . . 74 TYR CD . 7105 1 930 . 1 1 74 74 TYR CD2 C 13 132.292 0.013 . 1 . . . . 74 TYR CD . 7105 1 931 . 1 1 74 74 TYR CE1 C 13 118.148 0.057 . 1 . . . . 74 TYR CE . 7105 1 932 . 1 1 74 74 TYR CE2 C 13 118.148 0.057 . 1 . . . . 74 TYR CE . 7105 1 933 . 1 1 74 74 TYR N N 15 126.064 0.080 . 1 . . . . 74 TYR N . 7105 1 934 . 1 1 75 75 ARG H H 1 7.715 0.001 . 1 . . . . 75 ARG H . 7105 1 935 . 1 1 75 75 ARG HA H 1 4.289 0.000 . 1 . . . . 75 ARG HA . 7105 1 936 . 1 1 75 75 ARG HB2 H 1 1.676 0.000 . 2 . . . . 75 ARG HB2 . 7105 1 937 . 1 1 75 75 ARG HB3 H 1 1.535 0.000 . 2 . . . . 75 ARG HB3 . 7105 1 938 . 1 1 75 75 ARG HG2 H 1 1.512 0.000 . 1 . . . . 75 ARG HG2 . 7105 1 939 . 1 1 75 75 ARG HG3 H 1 1.512 0.000 . 1 . . . . 75 ARG HG3 . 7105 1 940 . 1 1 75 75 ARG HD2 H 1 3.142 0.001 . 1 . . . . 75 ARG HD2 . 7105 1 941 . 1 1 75 75 ARG HD3 H 1 3.142 0.001 . 1 . . . . 75 ARG HD3 . 7105 1 942 . 1 1 75 75 ARG CA C 13 54.286 0.000 . 1 . . . . 75 ARG CA . 7105 1 943 . 1 1 75 75 ARG CB C 13 31.899 0.092 . 1 . . . . 75 ARG CB . 7105 1 944 . 1 1 75 75 ARG CG C 13 26.809 0.000 . 1 . . . . 75 ARG CG . 7105 1 945 . 1 1 75 75 ARG CD C 13 44.211 0.000 . 1 . . . . 75 ARG CD . 7105 1 946 . 1 1 75 75 ARG N N 15 126.596 0.010 . 1 . . . . 75 ARG N . 7105 1 947 . 1 1 76 76 LYS H H 1 8.473 0.000 . 1 . . . . 76 LYS H . 7105 1 948 . 1 1 76 76 LYS HA H 1 4.031 0.002 . 1 . . . . 76 LYS HA . 7105 1 949 . 1 1 76 76 LYS HB2 H 1 1.739 0.001 . 1 . . . . 76 LYS HB2 . 7105 1 950 . 1 1 76 76 LYS HB3 H 1 1.739 0.001 . 1 . . . . 76 LYS HB3 . 7105 1 951 . 1 1 76 76 LYS HG2 H 1 1.528 0.000 . 1 . . . . 76 LYS HG2 . 7105 1 952 . 1 1 76 76 LYS HG3 H 1 1.528 0.000 . 1 . . . . 76 LYS HG3 . 7105 1 953 . 1 1 76 76 LYS HD2 H 1 1.687 0.001 . 1 . . . . 76 LYS HD2 . 7105 1 954 . 1 1 76 76 LYS HD3 H 1 1.687 0.001 . 1 . . . . 76 LYS HD3 . 7105 1 955 . 1 1 76 76 LYS HE2 H 1 2.978 0.001 . 1 . . . . 76 LYS HE2 . 7105 1 956 . 1 1 76 76 LYS HE3 H 1 2.978 0.001 . 1 . . . . 76 LYS HE3 . 7105 1 957 . 1 1 76 76 LYS C C 13 177.172 0.000 . 1 . . . . 76 LYS C . 7105 1 958 . 1 1 76 76 LYS CA C 13 56.827 0.002 . 1 . . . . 76 LYS CA . 7105 1 959 . 1 1 76 76 LYS CB C 13 33.807 0.066 . 1 . . . . 76 LYS CB . 7105 1 960 . 1 1 76 76 LYS CG C 13 25.318 0.000 . 1 . . . . 76 LYS CG . 7105 1 961 . 1 1 76 76 LYS CD C 13 29.295 0.000 . 1 . . . . 76 LYS CD . 7105 1 962 . 1 1 76 76 LYS CE C 13 42.222 0.000 . 1 . . . . 76 LYS CE . 7105 1 963 . 1 1 76 76 LYS N N 15 124.198 0.030 . 1 . . . . 76 LYS N . 7105 1 964 . 1 1 77 77 GLY H H 1 8.262 0.001 . 1 . . . . 77 GLY H . 7105 1 965 . 1 1 77 77 GLY HA2 H 1 4.069 0.000 . 2 . . . . 77 GLY HA2 . 7105 1 966 . 1 1 77 77 GLY HA3 H 1 3.902 0.000 . 2 . . . . 77 GLY HA3 . 7105 1 967 . 1 1 77 77 GLY CA C 13 45.203 0.000 . 1 . . . . 77 GLY CA . 7105 1 968 . 1 1 77 77 GLY N N 15 110.147 0.001 . 1 . . . . 77 GLY N . 7105 1 969 . 1 1 78 78 GLU H H 1 8.193 0.001 . 1 . . . . 78 GLU H . 7105 1 970 . 1 1 78 78 GLU HA H 1 4.283 0.009 . 1 . . . . 78 GLU HA . 7105 1 971 . 1 1 78 78 GLU HB2 H 1 2.005 0.001 . 1 . . . . 78 GLU HB2 . 7105 1 972 . 1 1 78 78 GLU HB3 H 1 2.005 0.001 . 1 . . . . 78 GLU HB3 . 7105 1 973 . 1 1 78 78 GLU HG2 H 1 2.289 0.006 . 2 . . . . 78 GLU HG2 . 7105 1 974 . 1 1 78 78 GLU HG3 H 1 2.291 0.007 . 2 . . . . 78 GLU HG3 . 7105 1 975 . 1 1 78 78 GLU CA C 13 56.872 0.000 . 1 . . . . 78 GLU CA . 7105 1 976 . 1 1 78 78 GLU CB C 13 30.784 0.003 . 1 . . . . 78 GLU CB . 7105 1 977 . 1 1 78 78 GLU CG C 13 36.256 0.000 . 1 . . . . 78 GLU CG . 7105 1 978 . 1 1 78 78 GLU N N 15 119.687 0.001 . 1 . . . . 78 GLU N . 7105 1 979 . 1 1 79 79 THR H H 1 8.341 0.002 . 1 . . . . 79 THR H . 7105 1 980 . 1 1 79 79 THR HA H 1 4.437 0.010 . 1 . . . . 79 THR HA . 7105 1 981 . 1 1 79 79 THR HB H 1 4.224 0.008 . 1 . . . . 79 THR HB . 7105 1 982 . 1 1 79 79 THR HG21 H 1 1.276 0.004 . 1 . . . . 79 THR HG2 . 7105 1 983 . 1 1 79 79 THR HG22 H 1 1.276 0.004 . 1 . . . . 79 THR HG2 . 7105 1 984 . 1 1 79 79 THR HG23 H 1 1.276 0.004 . 1 . . . . 79 THR HG2 . 7105 1 985 . 1 1 79 79 THR CA C 13 62.261 0.000 . 1 . . . . 79 THR CA . 7105 1 986 . 1 1 79 79 THR CB C 13 70.014 0.058 . 1 . . . . 79 THR CB . 7105 1 987 . 1 1 79 79 THR CG2 C 13 21.917 0.061 . 1 . . . . 79 THR CG2 . 7105 1 988 . 1 1 79 79 THR N N 15 116.823 0.000 . 1 . . . . 79 THR N . 7105 1 989 . 1 1 80 80 LYS H H 1 8.701 0.003 . 1 . . . . 80 LYS H . 7105 1 990 . 1 1 80 80 LYS HA H 1 4.385 0.010 . 1 . . . . 80 LYS HA . 7105 1 991 . 1 1 80 80 LYS HB2 H 1 1.879 0.000 . 2 . . . . 80 LYS HB2 . 7105 1 992 . 1 1 80 80 LYS HB3 H 1 1.840 0.000 . 2 . . . . 80 LYS HB3 . 7105 1 993 . 1 1 80 80 LYS HG2 H 1 1.525 0.000 . 1 . . . . 80 LYS HG2 . 7105 1 994 . 1 1 80 80 LYS HG3 H 1 1.525 0.000 . 1 . . . . 80 LYS HG3 . 7105 1 995 . 1 1 80 80 LYS CA C 13 56.523 0.015 . 1 . . . . 80 LYS CA . 7105 1 996 . 1 1 80 80 LYS CB C 13 33.140 0.026 . 1 . . . . 80 LYS CB . 7105 1 997 . 1 1 80 80 LYS CG C 13 25.023 0.013 . 1 . . . . 80 LYS CG . 7105 1 998 . 1 1 80 80 LYS CD C 13 29.501 0.000 . 1 . . . . 80 LYS CD . 7105 1 999 . 1 1 80 80 LYS CE C 13 42.579 0.000 . 1 . . . . 80 LYS CE . 7105 1 1000 . 1 1 80 80 LYS N N 15 124.984 0.044 . 1 . . . . 80 LYS N . 7105 1 1001 . 1 1 81 81 LYS H H 1 8.329 0.010 . 1 . . . . 81 LYS H . 7105 1 1002 . 1 1 81 81 LYS HA H 1 4.312 0.000 . 1 . . . . 81 LYS HA . 7105 1 1003 . 1 1 81 81 LYS HB2 H 1 1.793 0.001 . 1 . . . . 81 LYS HB2 . 7105 1 1004 . 1 1 81 81 LYS HB3 H 1 1.793 0.001 . 1 . . . . 81 LYS HB3 . 7105 1 1005 . 1 1 81 81 LYS HG2 H 1 1.473 0.000 . 1 . . . . 81 LYS HG2 . 7105 1 1006 . 1 1 81 81 LYS HG3 H 1 1.473 0.000 . 1 . . . . 81 LYS HG3 . 7105 1 1007 . 1 1 81 81 LYS HD2 H 1 1.678 0.001 . 1 . . . . 81 LYS HD2 . 7105 1 1008 . 1 1 81 81 LYS HD3 H 1 1.678 0.001 . 1 . . . . 81 LYS HD3 . 7105 1 1009 . 1 1 81 81 LYS HE2 H 1 3.017 0.001 . 1 . . . . 81 LYS HE2 . 7105 1 1010 . 1 1 81 81 LYS HE3 H 1 3.017 0.001 . 1 . . . . 81 LYS HE3 . 7105 1 1011 . 1 1 81 81 LYS CA C 13 55.985 0.000 . 1 . . . . 81 LYS CA . 7105 1 1012 . 1 1 81 81 LYS CB C 13 32.811 0.074 . 1 . . . . 81 LYS CB . 7105 1 1013 . 1 1 81 81 LYS CG C 13 24.821 0.000 . 1 . . . . 81 LYS CG . 7105 1 1014 . 1 1 81 81 LYS CD C 13 29.295 0.000 . 1 . . . . 81 LYS CD . 7105 1 1015 . 1 1 81 81 LYS CE C 13 42.222 0.000 . 1 . . . . 81 LYS CE . 7105 1 1016 . 1 1 81 81 LYS N N 15 122.606 0.003 . 1 . . . . 81 LYS N . 7105 1 1017 . 1 1 82 82 LYS H H 1 8.281 0.000 . 1 . . . . 82 LYS H . 7105 1 1018 . 1 1 82 82 LYS HA H 1 4.358 0.000 . 1 . . . . 82 LYS HA . 7105 1 1019 . 1 1 82 82 LYS HB2 H 1 1.733 0.001 . 1 . . . . 82 LYS HB2 . 7105 1 1020 . 1 1 82 82 LYS HB3 H 1 1.733 0.001 . 1 . . . . 82 LYS HB3 . 7105 1 1021 . 1 1 82 82 LYS HG2 H 1 1.458 0.001 . 1 . . . . 82 LYS HG2 . 7105 1 1022 . 1 1 82 82 LYS HG3 H 1 1.458 0.001 . 1 . . . . 82 LYS HG3 . 7105 1 1023 . 1 1 82 82 LYS HD2 H 1 1.685 0.000 . 1 . . . . 82 LYS HD2 . 7105 1 1024 . 1 1 82 82 LYS HD3 H 1 1.685 0.000 . 1 . . . . 82 LYS HD3 . 7105 1 1025 . 1 1 82 82 LYS HE2 H 1 3.046 0.001 . 1 . . . . 82 LYS HE2 . 7105 1 1026 . 1 1 82 82 LYS HE3 H 1 3.046 0.001 . 1 . . . . 82 LYS HE3 . 7105 1 1027 . 1 1 82 82 LYS CA C 13 56.129 0.000 . 1 . . . . 82 LYS CA . 7105 1 1028 . 1 1 82 82 LYS CB C 13 33.729 0.080 . 1 . . . . 82 LYS CB . 7105 1 1029 . 1 1 82 82 LYS CG C 13 25.317 0.000 . 1 . . . . 82 LYS CG . 7105 1 1030 . 1 1 82 82 LYS CD C 13 29.295 0.000 . 1 . . . . 82 LYS CD . 7105 1 1031 . 1 1 82 82 LYS CE C 13 42.222 0.000 . 1 . . . . 82 LYS CE . 7105 1 1032 . 1 1 82 82 LYS N N 15 121.658 0.001 . 1 . . . . 82 LYS N . 7105 1 1033 . 1 1 83 83 PHE H H 1 8.363 0.002 . 1 . . . . 83 PHE H . 7105 1 1034 . 1 1 83 83 PHE HA H 1 4.652 0.000 . 1 . . . . 83 PHE HA . 7105 1 1035 . 1 1 83 83 PHE HB2 H 1 3.099 0.011 . 2 . . . . 83 PHE HB2 . 7105 1 1036 . 1 1 83 83 PHE HB3 H 1 3.102 0.010 . 2 . . . . 83 PHE HB3 . 7105 1 1037 . 1 1 83 83 PHE HD1 H 1 7.311 0.000 . 1 . . . . 83 PHE HD . 7105 1 1038 . 1 1 83 83 PHE HD2 H 1 7.311 0.000 . 1 . . . . 83 PHE HD . 7105 1 1039 . 1 1 83 83 PHE HE1 H 1 7.399 0.006 . 1 . . . . 83 PHE HE . 7105 1 1040 . 1 1 83 83 PHE HE2 H 1 7.399 0.006 . 1 . . . . 83 PHE HE . 7105 1 1041 . 1 1 83 83 PHE HZ H 1 7.360 0.000 . 1 . . . . 83 PHE HZ . 7105 1 1042 . 1 1 83 83 PHE CA C 13 57.744 0.000 . 1 . . . . 83 PHE CA . 7105 1 1043 . 1 1 83 83 PHE CB C 13 39.957 0.003 . 1 . . . . 83 PHE CB . 7105 1 1044 . 1 1 83 83 PHE CD1 C 13 131.907 0.000 . 1 . . . . 83 PHE CD . 7105 1 1045 . 1 1 83 83 PHE CD2 C 13 131.907 0.000 . 1 . . . . 83 PHE CD . 7105 1 1046 . 1 1 83 83 PHE CE1 C 13 131.648 0.061 . 1 . . . . 83 PHE CE . 7105 1 1047 . 1 1 83 83 PHE CE2 C 13 131.648 0.061 . 1 . . . . 83 PHE CE . 7105 1 1048 . 1 1 83 83 PHE CZ C 13 129.901 0.000 . 1 . . . . 83 PHE CZ . 7105 1 1049 . 1 1 83 83 PHE N N 15 121.980 0.049 . 1 . . . . 83 PHE N . 7105 1 1050 . 1 1 84 84 LYS H H 1 8.200 0.002 . 1 . . . . 84 LYS H . 7105 1 1051 . 1 1 84 84 LYS HA H 1 4.287 0.000 . 1 . . . . 84 LYS HA . 7105 1 1052 . 1 1 84 84 LYS HB2 H 1 1.686 0.013 . 1 . . . . 84 LYS HB2 . 7105 1 1053 . 1 1 84 84 LYS HB3 H 1 1.686 0.013 . 1 . . . . 84 LYS HB3 . 7105 1 1054 . 1 1 84 84 LYS HG2 H 1 1.361 0.003 . 1 . . . . 84 LYS HG2 . 7105 1 1055 . 1 1 84 84 LYS HG3 H 1 1.361 0.003 . 1 . . . . 84 LYS HG3 . 7105 1 1056 . 1 1 84 84 LYS HD2 H 1 1.715 0.000 . 1 . . . . 84 LYS HD2 . 7105 1 1057 . 1 1 84 84 LYS HD3 H 1 1.715 0.000 . 1 . . . . 84 LYS HD3 . 7105 1 1058 . 1 1 84 84 LYS HE2 H 1 3.002 0.000 . 1 . . . . 84 LYS HE2 . 7105 1 1059 . 1 1 84 84 LYS HE3 H 1 3.002 0.000 . 1 . . . . 84 LYS HE3 . 7105 1 1060 . 1 1 84 84 LYS CA C 13 55.690 0.006 . 1 . . . . 84 LYS CA . 7105 1 1061 . 1 1 84 84 LYS CB C 13 33.306 0.060 . 1 . . . . 84 LYS CB . 7105 1 1062 . 1 1 84 84 LYS CG C 13 24.818 0.005 . 1 . . . . 84 LYS CG . 7105 1 1063 . 1 1 84 84 LYS CD C 13 29.295 0.000 . 1 . . . . 84 LYS CD . 7105 1 1064 . 1 1 84 84 LYS CE C 13 42.222 0.000 . 1 . . . . 84 LYS CE . 7105 1 1065 . 1 1 84 84 LYS N N 15 125.459 0.079 . 1 . . . . 84 LYS N . 7105 1 1066 . 1 1 85 85 ASP H H 1 8.422 0.012 . 1 . . . . 85 ASP H . 7105 1 1067 . 1 1 85 85 ASP HA H 1 4.819 0.002 . 1 . . . . 85 ASP HA . 7105 1 1068 . 1 1 85 85 ASP HB2 H 1 2.935 0.017 . 2 . . . . 85 ASP HB2 . 7105 1 1069 . 1 1 85 85 ASP HB3 H 1 2.751 0.009 . 2 . . . . 85 ASP HB3 . 7105 1 1070 . 1 1 85 85 ASP CA C 13 51.378 0.000 . 1 . . . . 85 ASP CA . 7105 1 1071 . 1 1 85 85 ASP CB C 13 42.182 0.002 . 1 . . . . 85 ASP CB . 7105 1 1072 . 1 1 85 85 ASP N N 15 124.417 0.002 . 1 . . . . 85 ASP N . 7105 1 1073 . 1 1 86 86 PRO HA H 1 4.416 0.003 . 1 . . . . 86 PRO HA . 7105 1 1074 . 1 1 86 86 PRO HB2 H 1 2.364 0.002 . 2 . . . . 86 PRO HB2 . 7105 1 1075 . 1 1 86 86 PRO HB3 H 1 1.969 0.011 . 2 . . . . 86 PRO HB3 . 7105 1 1076 . 1 1 86 86 PRO HG2 H 1 2.080 0.000 . 2 . . . . 86 PRO HG2 . 7105 1 1077 . 1 1 86 86 PRO HG3 H 1 2.005 0.001 . 2 . . . . 86 PRO HG3 . 7105 1 1078 . 1 1 86 86 PRO HD2 H 1 4.044 0.001 . 2 . . . . 86 PRO HD2 . 7105 1 1079 . 1 1 86 86 PRO HD3 H 1 4.007 0.002 . 2 . . . . 86 PRO HD3 . 7105 1 1080 . 1 1 86 86 PRO CA C 13 64.222 0.012 . 1 . . . . 86 PRO CA . 7105 1 1081 . 1 1 86 86 PRO CB C 13 32.308 0.075 . 1 . . . . 86 PRO CB . 7105 1 1082 . 1 1 86 86 PRO CG C 13 26.809 0.002 . 1 . . . . 86 PRO CG . 7105 1 1083 . 1 1 86 86 PRO CD C 13 51.483 0.043 . 1 . . . . 86 PRO CD . 7105 1 1084 . 1 1 87 87 ASN H H 1 8.396 0.002 . 1 . . . . 87 ASN H . 7105 1 1085 . 1 1 87 87 ASN HA H 1 4.745 0.000 . 1 . . . . 87 ASN HA . 7105 1 1086 . 1 1 87 87 ASN HB2 H 1 2.938 0.013 . 1 . . . . 87 ASN HB2 . 7105 1 1087 . 1 1 87 87 ASN HB3 H 1 2.938 0.013 . 1 . . . . 87 ASN HB3 . 7105 1 1088 . 1 1 87 87 ASN HD21 H 1 7.011 0.000 . 1 . . . . 87 ASN HD21 . 7105 1 1089 . 1 1 87 87 ASN HD22 H 1 7.873 0.000 . 1 . . . . 87 ASN HD22 . 7105 1 1090 . 1 1 87 87 ASN CA C 13 53.206 0.000 . 1 . . . . 87 ASN CA . 7105 1 1091 . 1 1 87 87 ASN CB C 13 39.336 0.075 . 1 . . . . 87 ASN CB . 7105 1 1092 . 1 1 87 87 ASN N N 15 115.133 0.013 . 1 . . . . 87 ASN N . 7105 1 1093 . 1 1 87 87 ASN ND2 N 15 114.239 0.000 . 1 . . . . 87 ASN ND2 . 7105 1 1094 . 1 1 88 88 ALA H H 1 7.160 0.003 . 1 . . . . 88 ALA H . 7105 1 1095 . 1 1 88 88 ALA HA H 1 3.531 0.015 . 1 . . . . 88 ALA HA . 7105 1 1096 . 1 1 88 88 ALA HB1 H 1 1.170 0.006 . 1 . . . . 88 ALA HB . 7105 1 1097 . 1 1 88 88 ALA HB2 H 1 1.170 0.006 . 1 . . . . 88 ALA HB . 7105 1 1098 . 1 1 88 88 ALA HB3 H 1 1.170 0.006 . 1 . . . . 88 ALA HB . 7105 1 1099 . 1 1 88 88 ALA CA C 13 50.654 0.017 . 1 . . . . 88 ALA CA . 7105 1 1100 . 1 1 88 88 ALA CB C 13 17.488 0.101 . 1 . . . . 88 ALA CB . 7105 1 1101 . 1 1 88 88 ALA N N 15 123.297 0.058 . 1 . . . . 88 ALA N . 7105 1 1102 . 1 1 89 89 PRO HA H 1 4.318 0.001 . 1 . . . . 89 PRO HA . 7105 1 1103 . 1 1 89 89 PRO HB2 H 1 2.393 0.003 . 2 . . . . 89 PRO HB2 . 7105 1 1104 . 1 1 89 89 PRO HB3 H 1 1.844 0.001 . 2 . . . . 89 PRO HB3 . 7105 1 1105 . 1 1 89 89 PRO HG2 H 1 1.807 0.002 . 2 . . . . 89 PRO HG2 . 7105 1 1106 . 1 1 89 89 PRO HG3 H 1 1.616 0.003 . 2 . . . . 89 PRO HG3 . 7105 1 1107 . 1 1 89 89 PRO HD2 H 1 3.131 0.013 . 2 . . . . 89 PRO HD2 . 7105 1 1108 . 1 1 89 89 PRO HD3 H 1 2.952 0.009 . 2 . . . . 89 PRO HD3 . 7105 1 1109 . 1 1 89 89 PRO CA C 13 63.036 0.000 . 1 . . . . 89 PRO CA . 7105 1 1110 . 1 1 89 89 PRO CB C 13 31.869 0.076 . 1 . . . . 89 PRO CB . 7105 1 1111 . 1 1 89 89 PRO CG C 13 27.797 0.021 . 1 . . . . 89 PRO CG . 7105 1 1112 . 1 1 89 89 PRO CD C 13 49.729 0.084 . 1 . . . . 89 PRO CD . 7105 1 1113 . 1 1 90 90 LYS H H 1 8.371 0.003 . 1 . . . . 90 LYS H . 7105 1 1114 . 1 1 90 90 LYS HA H 1 4.353 0.001 . 1 . . . . 90 LYS HA . 7105 1 1115 . 1 1 90 90 LYS HB2 H 1 1.834 0.001 . 1 . . . . 90 LYS HB2 . 7105 1 1116 . 1 1 90 90 LYS HB3 H 1 1.834 0.001 . 1 . . . . 90 LYS HB3 . 7105 1 1117 . 1 1 90 90 LYS HG2 H 1 1.555 0.001 . 1 . . . . 90 LYS HG2 . 7105 1 1118 . 1 1 90 90 LYS HG3 H 1 1.555 0.001 . 1 . . . . 90 LYS HG3 . 7105 1 1119 . 1 1 90 90 LYS HD2 H 1 1.701 0.001 . 1 . . . . 90 LYS HD2 . 7105 1 1120 . 1 1 90 90 LYS HD3 H 1 1.701 0.001 . 1 . . . . 90 LYS HD3 . 7105 1 1121 . 1 1 90 90 LYS HE2 H 1 3.039 0.000 . 1 . . . . 90 LYS HE2 . 7105 1 1122 . 1 1 90 90 LYS HE3 H 1 3.039 0.000 . 1 . . . . 90 LYS HE3 . 7105 1 1123 . 1 1 90 90 LYS CA C 13 55.693 0.000 . 1 . . . . 90 LYS CA . 7105 1 1124 . 1 1 90 90 LYS CB C 13 33.794 0.043 . 1 . . . . 90 LYS CB . 7105 1 1125 . 1 1 90 90 LYS CG C 13 25.317 0.000 . 1 . . . . 90 LYS CG . 7105 1 1126 . 1 1 90 90 LYS CD C 13 29.294 0.000 . 1 . . . . 90 LYS CD . 7105 1 1127 . 1 1 90 90 LYS CE C 13 42.222 0.000 . 1 . . . . 90 LYS CE . 7105 1 1128 . 1 1 90 90 LYS N N 15 123.437 0.048 . 1 . . . . 90 LYS N . 7105 1 1129 . 1 1 91 91 ARG H H 1 8.414 0.004 . 1 . . . . 91 ARG H . 7105 1 1130 . 1 1 91 91 ARG HA H 1 3.414 0.008 . 1 . . . . 91 ARG HA . 7105 1 1131 . 1 1 91 91 ARG HB2 H 1 1.567 0.007 . 2 . . . . 91 ARG HB2 . 7105 1 1132 . 1 1 91 91 ARG HB3 H 1 1.568 0.007 . 2 . . . . 91 ARG HB3 . 7105 1 1133 . 1 1 91 91 ARG HG2 H 1 1.612 0.000 . 2 . . . . 91 ARG HG2 . 7105 1 1134 . 1 1 91 91 ARG HG3 H 1 1.447 0.001 . 2 . . . . 91 ARG HG3 . 7105 1 1135 . 1 1 91 91 ARG HD2 H 1 3.137 0.009 . 1 . . . . 91 ARG HD2 . 7105 1 1136 . 1 1 91 91 ARG HD3 H 1 3.137 0.009 . 1 . . . . 91 ARG HD3 . 7105 1 1137 . 1 1 91 91 ARG CA C 13 54.716 0.045 . 1 . . . . 91 ARG CA . 7105 1 1138 . 1 1 91 91 ARG CB C 13 29.307 0.069 . 1 . . . . 91 ARG CB . 7105 1 1139 . 1 1 91 91 ARG CG C 13 27.390 0.115 . 1 . . . . 91 ARG CG . 7105 1 1140 . 1 1 91 91 ARG CD C 13 43.705 0.028 . 1 . . . . 91 ARG CD . 7105 1 1141 . 1 1 91 91 ARG N N 15 122.972 0.007 . 1 . . . . 91 ARG N . 7105 1 1142 . 1 1 92 92 PRO HA H 1 4.332 0.003 . 1 . . . . 92 PRO HA . 7105 1 1143 . 1 1 92 92 PRO HB2 H 1 2.385 0.004 . 2 . . . . 92 PRO HB2 . 7105 1 1144 . 1 1 92 92 PRO HB3 H 1 1.845 0.000 . 2 . . . . 92 PRO HB3 . 7105 1 1145 . 1 1 92 92 PRO HG2 H 1 1.798 0.001 . 2 . . . . 92 PRO HG2 . 7105 1 1146 . 1 1 92 92 PRO HG3 H 1 1.634 0.011 . 2 . . . . 92 PRO HG3 . 7105 1 1147 . 1 1 92 92 PRO HD2 H 1 2.972 0.001 . 2 . . . . 92 PRO HD2 . 7105 1 1148 . 1 1 92 92 PRO HD3 H 1 2.844 0.017 . 2 . . . . 92 PRO HD3 . 7105 1 1149 . 1 1 92 92 PRO CA C 13 63.098 0.000 . 1 . . . . 92 PRO CA . 7105 1 1150 . 1 1 92 92 PRO CB C 13 31.876 0.000 . 1 . . . . 92 PRO CB . 7105 1 1151 . 1 1 92 92 PRO CG C 13 27.575 0.037 . 1 . . . . 92 PRO CG . 7105 1 1152 . 1 1 92 92 PRO CD C 13 49.571 0.003 . 1 . . . . 92 PRO CD . 7105 1 1153 . 1 1 93 93 PRO HA H 1 4.419 0.000 . 1 . . . . 93 PRO HA . 7105 1 1154 . 1 1 93 93 PRO HB2 H 1 2.036 0.010 . 1 . . . . 93 PRO HB2 . 7105 1 1155 . 1 1 93 93 PRO HB3 H 1 2.036 0.010 . 1 . . . . 93 PRO HB3 . 7105 1 1156 . 1 1 93 93 PRO HG2 H 1 1.953 0.014 . 1 . . . . 93 PRO HG2 . 7105 1 1157 . 1 1 93 93 PRO HG3 H 1 1.953 0.014 . 1 . . . . 93 PRO HG3 . 7105 1 1158 . 1 1 93 93 PRO HD2 H 1 3.723 0.000 . 2 . . . . 93 PRO HD2 . 7105 1 1159 . 1 1 93 93 PRO HD3 H 1 3.507 0.001 . 2 . . . . 93 PRO HD3 . 7105 1 1160 . 1 1 93 93 PRO C C 13 178.261 0.000 . 1 . . . . 93 PRO C . 7105 1 1161 . 1 1 93 93 PRO CA C 13 62.113 0.002 . 1 . . . . 93 PRO CA . 7105 1 1162 . 1 1 93 93 PRO CB C 13 32.838 0.078 . 1 . . . . 93 PRO CB . 7105 1 1163 . 1 1 93 93 PRO CG C 13 27.270 0.062 . 1 . . . . 93 PRO CG . 7105 1 1164 . 1 1 93 93 PRO CD C 13 50.481 0.000 . 1 . . . . 93 PRO CD . 7105 1 1165 . 1 1 94 94 SER H H 1 7.612 0.002 . 1 . . . . 94 SER H . 7105 1 1166 . 1 1 94 94 SER HA H 1 4.440 0.009 . 1 . . . . 94 SER HA . 7105 1 1167 . 1 1 94 94 SER HB2 H 1 4.025 0.000 . 1 . . . . 94 SER HB2 . 7105 1 1168 . 1 1 94 94 SER HB3 H 1 4.025 0.000 . 1 . . . . 94 SER HB3 . 7105 1 1169 . 1 1 94 94 SER CA C 13 56.513 0.000 . 1 . . . . 94 SER CA . 7105 1 1170 . 1 1 94 94 SER CB C 13 65.611 0.011 . 1 . . . . 94 SER CB . 7105 1 1171 . 1 1 94 94 SER N N 15 114.036 0.000 . 1 . . . . 94 SER N . 7105 1 1172 . 1 1 95 95 ALA H H 1 9.073 0.004 . 1 . . . . 95 ALA H . 7105 1 1173 . 1 1 95 95 ALA HA H 1 4.008 0.000 . 1 . . . . 95 ALA HA . 7105 1 1174 . 1 1 95 95 ALA HB1 H 1 1.642 0.009 . 1 . . . . 95 ALA HB . 7105 1 1175 . 1 1 95 95 ALA HB2 H 1 1.642 0.009 . 1 . . . . 95 ALA HB . 7105 1 1176 . 1 1 95 95 ALA HB3 H 1 1.642 0.009 . 1 . . . . 95 ALA HB . 7105 1 1177 . 1 1 95 95 ALA CA C 13 56.310 0.000 . 1 . . . . 95 ALA CA . 7105 1 1178 . 1 1 95 95 ALA CB C 13 18.552 0.093 . 1 . . . . 95 ALA CB . 7105 1 1179 . 1 1 95 95 ALA N N 15 122.301 0.044 . 1 . . . . 95 ALA N . 7105 1 1180 . 1 1 96 96 PHE H H 1 8.362 0.002 . 1 . . . . 96 PHE H . 7105 1 1181 . 1 1 96 96 PHE HA H 1 2.756 0.007 . 1 . . . . 96 PHE HA . 7105 1 1182 . 1 1 96 96 PHE HB2 H 1 2.373 0.006 . 1 . . . . 96 PHE HB2 . 7105 1 1183 . 1 1 96 96 PHE HB3 H 1 2.373 0.006 . 1 . . . . 96 PHE HB3 . 7105 1 1184 . 1 1 96 96 PHE HD1 H 1 6.128 0.005 . 1 . . . . 96 PHE HD . 7105 1 1185 . 1 1 96 96 PHE HD2 H 1 6.128 0.005 . 1 . . . . 96 PHE HD . 7105 1 1186 . 1 1 96 96 PHE HE1 H 1 6.979 0.020 . 1 . . . . 96 PHE HE . 7105 1 1187 . 1 1 96 96 PHE HE2 H 1 6.979 0.020 . 1 . . . . 96 PHE HE . 7105 1 1188 . 1 1 96 96 PHE HZ H 1 6.828 0.004 . 1 . . . . 96 PHE HZ . 7105 1 1189 . 1 1 96 96 PHE CA C 13 59.152 0.008 . 1 . . . . 96 PHE CA . 7105 1 1190 . 1 1 96 96 PHE CB C 13 38.680 0.061 . 1 . . . . 96 PHE CB . 7105 1 1191 . 1 1 96 96 PHE CD1 C 13 132.106 0.099 . 1 . . . . 96 PHE CD . 7105 1 1192 . 1 1 96 96 PHE CD2 C 13 132.106 0.099 . 1 . . . . 96 PHE CD . 7105 1 1193 . 1 1 96 96 PHE CE1 C 13 131.025 0.112 . 1 . . . . 96 PHE CE . 7105 1 1194 . 1 1 96 96 PHE CE2 C 13 131.025 0.112 . 1 . . . . 96 PHE CE . 7105 1 1195 . 1 1 96 96 PHE CZ C 13 128.207 0.030 . 1 . . . . 96 PHE CZ . 7105 1 1196 . 1 1 96 96 PHE N N 15 115.666 0.046 . 1 . . . . 96 PHE N . 7105 1 1197 . 1 1 97 97 PHE H H 1 8.017 0.004 . 1 . . . . 97 PHE H . 7105 1 1198 . 1 1 97 97 PHE HA H 1 3.743 0.012 . 1 . . . . 97 PHE HA . 7105 1 1199 . 1 1 97 97 PHE HB2 H 1 3.212 0.011 . 2 . . . . 97 PHE HB2 . 7105 1 1200 . 1 1 97 97 PHE HB3 H 1 3.011 0.022 . 2 . . . . 97 PHE HB3 . 7105 1 1201 . 1 1 97 97 PHE HD1 H 1 6.852 0.002 . 1 . . . . 97 PHE HD . 7105 1 1202 . 1 1 97 97 PHE HD2 H 1 6.852 0.002 . 1 . . . . 97 PHE HD . 7105 1 1203 . 1 1 97 97 PHE HE1 H 1 6.505 0.008 . 1 . . . . 97 PHE HE . 7105 1 1204 . 1 1 97 97 PHE HE2 H 1 6.505 0.008 . 1 . . . . 97 PHE HE . 7105 1 1205 . 1 1 97 97 PHE HZ H 1 6.789 0.009 . 1 . . . . 97 PHE HZ . 7105 1 1206 . 1 1 97 97 PHE CA C 13 61.183 0.032 . 1 . . . . 97 PHE CA . 7105 1 1207 . 1 1 97 97 PHE CB C 13 37.704 0.060 . 1 . . . . 97 PHE CB . 7105 1 1208 . 1 1 97 97 PHE CD1 C 13 130.215 0.001 . 1 . . . . 97 PHE CD . 7105 1 1209 . 1 1 97 97 PHE CD2 C 13 130.215 0.001 . 1 . . . . 97 PHE CD . 7105 1 1210 . 1 1 97 97 PHE CE1 C 13 130.621 0.093 . 1 . . . . 97 PHE CE . 7105 1 1211 . 1 1 97 97 PHE CE2 C 13 130.621 0.093 . 1 . . . . 97 PHE CE . 7105 1 1212 . 1 1 97 97 PHE CZ C 13 127.635 0.002 . 1 . . . . 97 PHE CZ . 7105 1 1213 . 1 1 97 97 PHE N N 15 122.608 0.012 . 1 . . . . 97 PHE N . 7105 1 1214 . 1 1 98 98 LEU H H 1 8.296 0.000 . 1 . . . . 98 LEU H . 7105 1 1215 . 1 1 98 98 LEU HA H 1 4.101 0.000 . 1 . . . . 98 LEU HA . 7105 1 1216 . 1 1 98 98 LEU HB2 H 1 2.448 0.002 . 2 . . . . 98 LEU HB2 . 7105 1 1217 . 1 1 98 98 LEU HB3 H 1 1.724 0.001 . 2 . . . . 98 LEU HB3 . 7105 1 1218 . 1 1 98 98 LEU HG H 1 1.925 0.001 . 1 . . . . 98 LEU HG . 7105 1 1219 . 1 1 98 98 LEU HD11 H 1 0.954 0.001 . 2 . . . . 98 LEU HD1 . 7105 1 1220 . 1 1 98 98 LEU HD12 H 1 0.954 0.001 . 2 . . . . 98 LEU HD1 . 7105 1 1221 . 1 1 98 98 LEU HD13 H 1 0.954 0.001 . 2 . . . . 98 LEU HD1 . 7105 1 1222 . 1 1 98 98 LEU HD21 H 1 1.015 0.006 . 2 . . . . 98 LEU HD2 . 7105 1 1223 . 1 1 98 98 LEU HD22 H 1 1.015 0.006 . 2 . . . . 98 LEU HD2 . 7105 1 1224 . 1 1 98 98 LEU HD23 H 1 1.015 0.006 . 2 . . . . 98 LEU HD2 . 7105 1 1225 . 1 1 98 98 LEU CA C 13 58.370 0.000 . 1 . . . . 98 LEU CA . 7105 1 1226 . 1 1 98 98 LEU CB C 13 42.165 0.000 . 1 . . . . 98 LEU CB . 7105 1 1227 . 1 1 98 98 LEU CG C 13 26.809 0.000 . 1 . . . . 98 LEU CG . 7105 1 1228 . 1 1 98 98 LEU CD1 C 13 22.334 0.000 . 2 . . . . 98 LEU CD1 . 7105 1 1229 . 1 1 98 98 LEU CD2 C 13 26.785 0.054 . 2 . . . . 98 LEU CD2 . 7105 1 1230 . 1 1 98 98 LEU N N 15 121.809 0.011 . 1 . . . . 98 LEU N . 7105 1 1231 . 1 1 99 99 PHE H H 1 8.086 0.004 . 1 . . . . 99 PHE H . 7105 1 1232 . 1 1 99 99 PHE HA H 1 3.753 0.008 . 1 . . . . 99 PHE HA . 7105 1 1233 . 1 1 99 99 PHE HB2 H 1 2.765 0.000 . 2 . . . . 99 PHE HB2 . 7105 1 1234 . 1 1 99 99 PHE HB3 H 1 2.078 0.000 . 2 . . . . 99 PHE HB3 . 7105 1 1235 . 1 1 99 99 PHE HD1 H 1 6.823 0.008 . 1 . . . . 99 PHE HD . 7105 1 1236 . 1 1 99 99 PHE HD2 H 1 6.823 0.008 . 1 . . . . 99 PHE HD . 7105 1 1237 . 1 1 99 99 PHE HE1 H 1 7.205 0.012 . 1 . . . . 99 PHE HE . 7105 1 1238 . 1 1 99 99 PHE HE2 H 1 7.205 0.012 . 1 . . . . 99 PHE HE . 7105 1 1239 . 1 1 99 99 PHE HZ H 1 6.730 0.013 . 1 . . . . 99 PHE HZ . 7105 1 1240 . 1 1 99 99 PHE CA C 13 61.584 0.003 . 1 . . . . 99 PHE CA . 7105 1 1241 . 1 1 99 99 PHE CB C 13 39.204 0.046 . 1 . . . . 99 PHE CB . 7105 1 1242 . 1 1 99 99 PHE CD1 C 13 132.251 0.006 . 1 . . . . 99 PHE CD . 7105 1 1243 . 1 1 99 99 PHE CD2 C 13 132.251 0.006 . 1 . . . . 99 PHE CD . 7105 1 1244 . 1 1 99 99 PHE CE1 C 13 131.633 0.099 . 1 . . . . 99 PHE CE . 7105 1 1245 . 1 1 99 99 PHE CE2 C 13 131.633 0.099 . 1 . . . . 99 PHE CE . 7105 1 1246 . 1 1 99 99 PHE CZ C 13 128.937 0.034 . 1 . . . . 99 PHE CZ . 7105 1 1247 . 1 1 99 99 PHE N N 15 124.155 0.051 . 1 . . . . 99 PHE N . 7105 1 1248 . 1 1 100 100 CYS H H 1 8.463 0.007 . 1 . . . . 100 CYS H . 7105 1 1249 . 1 1 100 100 CYS HA H 1 3.658 0.008 . 1 . . . . 100 CYS HA . 7105 1 1250 . 1 1 100 100 CYS HB2 H 1 2.705 0.011 . 2 . . . . 100 CYS HB2 . 7105 1 1251 . 1 1 100 100 CYS HB3 H 1 2.102 0.003 . 2 . . . . 100 CYS HB3 . 7105 1 1252 . 1 1 100 100 CYS HG H 1 1.479 0.055 . 1 . . . . 100 CYS HG . 7105 1 1253 . 1 1 100 100 CYS C C 13 176.343 0.000 . 1 . . . . 100 CYS C . 7105 1 1254 . 1 1 100 100 CYS CA C 13 64.143 0.018 . 1 . . . . 100 CYS CA . 7105 1 1255 . 1 1 100 100 CYS CB C 13 26.566 0.078 . 1 . . . . 100 CYS CB . 7105 1 1256 . 1 1 100 100 CYS N N 15 118.190 0.075 . 1 . . . . 100 CYS N . 7105 1 1257 . 1 1 101 101 SER H H 1 7.976 0.004 . 1 . . . . 101 SER H . 7105 1 1258 . 1 1 101 101 SER HA H 1 3.935 0.001 . 1 . . . . 101 SER HA . 7105 1 1259 . 1 1 101 101 SER HB2 H 1 3.890 0.000 . 2 . . . . 101 SER HB2 . 7105 1 1260 . 1 1 101 101 SER HB3 H 1 3.859 0.000 . 2 . . . . 101 SER HB3 . 7105 1 1261 . 1 1 101 101 SER CA C 13 61.812 0.014 . 1 . . . . 101 SER CA . 7105 1 1262 . 1 1 101 101 SER CB C 13 62.867 0.053 . 1 . . . . 101 SER CB . 7105 1 1263 . 1 1 101 101 SER N N 15 114.407 0.022 . 1 . . . . 101 SER N . 7105 1 1264 . 1 1 102 102 GLU H H 1 7.090 0.008 . 1 . . . . 102 GLU H . 7105 1 1265 . 1 1 102 102 GLU HA H 1 4.069 0.009 . 1 . . . . 102 GLU HA . 7105 1 1266 . 1 1 102 102 GLU HB2 H 1 2.021 0.004 . 2 . . . . 102 GLU HB2 . 7105 1 1267 . 1 1 102 102 GLU HB3 H 1 1.915 0.000 . 2 . . . . 102 GLU HB3 . 7105 1 1268 . 1 1 102 102 GLU HG2 H 1 2.024 0.003 . 2 . . . . 102 GLU HG2 . 7105 1 1269 . 1 1 102 102 GLU HG3 H 1 1.758 0.006 . 2 . . . . 102 GLU HG3 . 7105 1 1270 . 1 1 102 102 GLU CA C 13 58.245 0.000 . 1 . . . . 102 GLU CA . 7105 1 1271 . 1 1 102 102 GLU CB C 13 30.292 0.061 . 1 . . . . 102 GLU CB . 7105 1 1272 . 1 1 102 102 GLU CG C 13 35.825 0.010 . 1 . . . . 102 GLU CG . 7105 1 1273 . 1 1 102 102 GLU N N 15 118.400 0.052 . 1 . . . . 102 GLU N . 7105 1 1274 . 1 1 103 103 TYR H H 1 7.908 0.000 . 1 . . . . 103 TYR H . 7105 1 1275 . 1 1 103 103 TYR HA H 1 4.120 0.008 . 1 . . . . 103 TYR HA . 7105 1 1276 . 1 1 103 103 TYR HB2 H 1 2.569 0.004 . 2 . . . . 103 TYR HB2 . 7105 1 1277 . 1 1 103 103 TYR HB3 H 1 1.970 0.014 . 2 . . . . 103 TYR HB3 . 7105 1 1278 . 1 1 103 103 TYR HD1 H 1 6.528 0.006 . 1 . . . . 103 TYR HD . 7105 1 1279 . 1 1 103 103 TYR HD2 H 1 6.528 0.006 . 1 . . . . 103 TYR HD . 7105 1 1280 . 1 1 103 103 TYR HE1 H 1 6.780 0.020 . 1 . . . . 103 TYR HE . 7105 1 1281 . 1 1 103 103 TYR HE2 H 1 6.780 0.020 . 1 . . . . 103 TYR HE . 7105 1 1282 . 1 1 103 103 TYR CA C 13 61.787 0.000 . 1 . . . . 103 TYR CA . 7105 1 1283 . 1 1 103 103 TYR CB C 13 39.767 0.032 . 1 . . . . 103 TYR CB . 7105 1 1284 . 1 1 103 103 TYR CD1 C 13 132.701 0.001 . 1 . . . . 103 TYR CD . 7105 1 1285 . 1 1 103 103 TYR CD2 C 13 132.701 0.001 . 1 . . . . 103 TYR CD . 7105 1 1286 . 1 1 103 103 TYR CE1 C 13 118.342 0.076 . 1 . . . . 103 TYR CE . 7105 1 1287 . 1 1 103 103 TYR CE2 C 13 118.342 0.076 . 1 . . . . 103 TYR CE . 7105 1 1288 . 1 1 103 103 TYR N N 15 114.471 0.000 . 1 . . . . 103 TYR N . 7105 1 1289 . 1 1 104 104 ARG H H 1 9.175 0.006 . 1 . . . . 104 ARG H . 7105 1 1290 . 1 1 104 104 ARG HA H 1 3.902 0.011 . 1 . . . . 104 ARG HA . 7105 1 1291 . 1 1 104 104 ARG HB2 H 1 1.940 0.000 . 2 . . . . 104 ARG HB2 . 7105 1 1292 . 1 1 104 104 ARG HB3 H 1 1.842 0.000 . 2 . . . . 104 ARG HB3 . 7105 1 1293 . 1 1 104 104 ARG HG2 H 1 1.395 0.000 . 1 . . . . 104 ARG HG2 . 7105 1 1294 . 1 1 104 104 ARG HG3 H 1 1.395 0.000 . 1 . . . . 104 ARG HG3 . 7105 1 1295 . 1 1 104 104 ARG HD2 H 1 3.213 0.004 . 2 . . . . 104 ARG HD2 . 7105 1 1296 . 1 1 104 104 ARG HD3 H 1 3.150 0.017 . 2 . . . . 104 ARG HD3 . 7105 1 1297 . 1 1 104 104 ARG CA C 13 62.570 0.017 . 1 . . . . 104 ARG CA . 7105 1 1298 . 1 1 104 104 ARG CB C 13 27.335 0.086 . 1 . . . . 104 ARG CB . 7105 1 1299 . 1 1 104 104 ARG CG C 13 28.808 0.000 . 1 . . . . 104 ARG CG . 7105 1 1300 . 1 1 104 104 ARG CD C 13 43.725 0.001 . 1 . . . . 104 ARG CD . 7105 1 1301 . 1 1 104 104 ARG N N 15 123.408 0.026 . 1 . . . . 104 ARG N . 7105 1 1302 . 1 1 105 105 PRO HA H 1 4.244 0.005 . 1 . . . . 105 PRO HA . 7105 1 1303 . 1 1 105 105 PRO HB2 H 1 2.286 0.002 . 2 . . . . 105 PRO HB2 . 7105 1 1304 . 1 1 105 105 PRO HB3 H 1 1.761 0.005 . 2 . . . . 105 PRO HB3 . 7105 1 1305 . 1 1 105 105 PRO HG2 H 1 1.958 0.016 . 1 . . . . 105 PRO HG2 . 7105 1 1306 . 1 1 105 105 PRO HG3 H 1 1.958 0.016 . 1 . . . . 105 PRO HG3 . 7105 1 1307 . 1 1 105 105 PRO HD2 H 1 3.500 0.001 . 2 . . . . 105 PRO HD2 . 7105 1 1308 . 1 1 105 105 PRO HD3 H 1 3.445 0.001 . 2 . . . . 105 PRO HD3 . 7105 1 1309 . 1 1 105 105 PRO CA C 13 65.712 0.000 . 1 . . . . 105 PRO CA . 7105 1 1310 . 1 1 105 105 PRO CB C 13 30.813 0.060 . 1 . . . . 105 PRO CB . 7105 1 1311 . 1 1 105 105 PRO CG C 13 28.284 0.036 . 1 . . . . 105 PRO CG . 7105 1 1312 . 1 1 105 105 PRO CD C 13 50.181 0.002 . 1 . . . . 105 PRO CD . 7105 1 1313 . 1 1 106 106 LYS H H 1 6.785 0.001 . 1 . . . . 106 LYS H . 7105 1 1314 . 1 1 106 106 LYS HA H 1 4.101 0.004 . 1 . . . . 106 LYS HA . 7105 1 1315 . 1 1 106 106 LYS HB2 H 1 1.981 0.004 . 1 . . . . 106 LYS HB2 . 7105 1 1316 . 1 1 106 106 LYS HB3 H 1 1.981 0.004 . 1 . . . . 106 LYS HB3 . 7105 1 1317 . 1 1 106 106 LYS HG2 H 1 1.457 0.002 . 2 . . . . 106 LYS HG2 . 7105 1 1318 . 1 1 106 106 LYS HG3 H 1 1.374 0.003 . 2 . . . . 106 LYS HG3 . 7105 1 1319 . 1 1 106 106 LYS HD2 H 1 1.587 0.007 . 2 . . . . 106 LYS HD2 . 7105 1 1320 . 1 1 106 106 LYS HD3 H 1 1.445 0.000 . 2 . . . . 106 LYS HD3 . 7105 1 1321 . 1 1 106 106 LYS HE2 H 1 2.823 0.006 . 1 . . . . 106 LYS HE2 . 7105 1 1322 . 1 1 106 106 LYS HE3 H 1 2.823 0.006 . 1 . . . . 106 LYS HE3 . 7105 1 1323 . 1 1 106 106 LYS CA C 13 58.987 0.001 . 1 . . . . 106 LYS CA . 7105 1 1324 . 1 1 106 106 LYS CB C 13 32.752 0.049 . 1 . . . . 106 LYS CB . 7105 1 1325 . 1 1 106 106 LYS CG C 13 25.297 0.071 . 1 . . . . 106 LYS CG . 7105 1 1326 . 1 1 106 106 LYS CD C 13 29.791 0.000 . 1 . . . . 106 LYS CD . 7105 1 1327 . 1 1 106 106 LYS CE C 13 42.222 0.000 . 1 . . . . 106 LYS CE . 7105 1 1328 . 1 1 106 106 LYS N N 15 117.206 0.026 . 1 . . . . 106 LYS N . 7105 1 1329 . 1 1 107 107 ILE H H 1 8.112 0.002 . 1 . . . . 107 ILE H . 7105 1 1330 . 1 1 107 107 ILE HA H 1 4.012 0.012 . 1 . . . . 107 ILE HA . 7105 1 1331 . 1 1 107 107 ILE HB H 1 1.987 0.007 . 1 . . . . 107 ILE HB . 7105 1 1332 . 1 1 107 107 ILE HG12 H 1 1.596 0.002 . 2 . . . . 107 ILE HG12 . 7105 1 1333 . 1 1 107 107 ILE HG13 H 1 1.460 0.003 . 2 . . . . 107 ILE HG13 . 7105 1 1334 . 1 1 107 107 ILE HG21 H 1 0.974 0.008 . 1 . . . . 107 ILE HG2 . 7105 1 1335 . 1 1 107 107 ILE HG22 H 1 0.974 0.008 . 1 . . . . 107 ILE HG2 . 7105 1 1336 . 1 1 107 107 ILE HG23 H 1 0.974 0.008 . 1 . . . . 107 ILE HG2 . 7105 1 1337 . 1 1 107 107 ILE HD11 H 1 0.889 0.009 . 1 . . . . 107 ILE HD1 . 7105 1 1338 . 1 1 107 107 ILE HD12 H 1 0.889 0.009 . 1 . . . . 107 ILE HD1 . 7105 1 1339 . 1 1 107 107 ILE HD13 H 1 0.889 0.009 . 1 . . . . 107 ILE HD1 . 7105 1 1340 . 1 1 107 107 ILE CA C 13 63.813 0.004 . 1 . . . . 107 ILE CA . 7105 1 1341 . 1 1 107 107 ILE CB C 13 37.586 0.014 . 1 . . . . 107 ILE CB . 7105 1 1342 . 1 1 107 107 ILE CG1 C 13 28.307 0.000 . 1 . . . . 107 ILE CG1 . 7105 1 1343 . 1 1 107 107 ILE CG2 C 13 18.823 0.034 . 1 . . . . 107 ILE CG2 . 7105 1 1344 . 1 1 107 107 ILE CD1 C 13 12.899 0.040 . 1 . . . . 107 ILE CD1 . 7105 1 1345 . 1 1 107 107 ILE N N 15 119.530 0.039 . 1 . . . . 107 ILE N . 7105 1 1346 . 1 1 108 108 LYS H H 1 8.171 0.001 . 1 . . . . 108 LYS H . 7105 1 1347 . 1 1 108 108 LYS HA H 1 3.967 0.005 . 1 . . . . 108 LYS HA . 7105 1 1348 . 1 1 108 108 LYS HB2 H 1 1.820 0.005 . 2 . . . . 108 LYS HB2 . 7105 1 1349 . 1 1 108 108 LYS HB3 H 1 1.693 0.007 . 2 . . . . 108 LYS HB3 . 7105 1 1350 . 1 1 108 108 LYS HG2 H 1 1.591 0.007 . 2 . . . . 108 LYS HG2 . 7105 1 1351 . 1 1 108 108 LYS HG3 H 1 1.438 0.005 . 2 . . . . 108 LYS HG3 . 7105 1 1352 . 1 1 108 108 LYS HE2 H 1 2.949 0.009 . 1 . . . . 108 LYS HE2 . 7105 1 1353 . 1 1 108 108 LYS HE3 H 1 2.949 0.009 . 1 . . . . 108 LYS HE3 . 7105 1 1354 . 1 1 108 108 LYS C C 13 178.480 0.000 . 1 . . . . 108 LYS C . 7105 1 1355 . 1 1 108 108 LYS CA C 13 59.057 0.018 . 1 . . . . 108 LYS CA . 7105 1 1356 . 1 1 108 108 LYS CB C 13 32.272 0.017 . 1 . . . . 108 LYS CB . 7105 1 1357 . 1 1 108 108 LYS CG C 13 25.317 0.000 . 1 . . . . 108 LYS CG . 7105 1 1358 . 1 1 108 108 LYS CD C 13 29.167 0.000 . 1 . . . . 108 LYS CD . 7105 1 1359 . 1 1 108 108 LYS CE C 13 41.913 0.000 . 1 . . . . 108 LYS CE . 7105 1 1360 . 1 1 108 108 LYS N N 15 118.354 0.019 . 1 . . . . 108 LYS N . 7105 1 1361 . 1 1 109 109 GLY H H 1 7.591 0.004 . 1 . . . . 109 GLY H . 7105 1 1362 . 1 1 109 109 GLY HA2 H 1 3.843 0.018 . 1 . . . . 109 GLY HA2 . 7105 1 1363 . 1 1 109 109 GLY HA3 H 1 3.843 0.018 . 1 . . . . 109 GLY HA3 . 7105 1 1364 . 1 1 109 109 GLY CA C 13 46.361 0.015 . 1 . . . . 109 GLY CA . 7105 1 1365 . 1 1 109 109 GLY N N 15 103.454 0.033 . 1 . . . . 109 GLY N . 7105 1 1366 . 1 1 110 110 GLU H H 1 7.437 0.003 . 1 . . . . 110 GLU H . 7105 1 1367 . 1 1 110 110 GLU HA H 1 4.083 0.007 . 1 . . . . 110 GLU HA . 7105 1 1368 . 1 1 110 110 GLU HB2 H 1 1.922 0.015 . 2 . . . . 110 GLU HB2 . 7105 1 1369 . 1 1 110 110 GLU HB3 H 1 1.728 0.008 . 2 . . . . 110 GLU HB3 . 7105 1 1370 . 1 1 110 110 GLU HG2 H 1 2.282 0.007 . 2 . . . . 110 GLU HG2 . 7105 1 1371 . 1 1 110 110 GLU HG3 H 1 1.966 0.012 . 2 . . . . 110 GLU HG3 . 7105 1 1372 . 1 1 110 110 GLU CA C 13 57.585 0.000 . 1 . . . . 110 GLU CA . 7105 1 1373 . 1 1 110 110 GLU CB C 13 31.265 0.054 . 1 . . . . 110 GLU CB . 7105 1 1374 . 1 1 110 110 GLU CG C 13 36.742 0.027 . 1 . . . . 110 GLU CG . 7105 1 1375 . 1 1 110 110 GLU N N 15 118.784 0.064 . 1 . . . . 110 GLU N . 7105 1 1376 . 1 1 111 111 HIS H H 1 7.816 0.003 . 1 . . . . 111 HIS H . 7105 1 1377 . 1 1 111 111 HIS HA H 1 4.998 0.006 . 1 . . . . 111 HIS HA . 7105 1 1378 . 1 1 111 111 HIS HB2 H 1 3.080 0.005 . 2 . . . . 111 HIS HB2 . 7105 1 1379 . 1 1 111 111 HIS HB3 H 1 3.017 0.002 . 2 . . . . 111 HIS HB3 . 7105 1 1380 . 1 1 111 111 HIS HD2 H 1 7.077 0.005 . 1 . . . . 111 HIS HD2 . 7105 1 1381 . 1 1 111 111 HIS HE1 H 1 7.954 0.000 . 1 . . . . 111 HIS HE1 . 7105 1 1382 . 1 1 111 111 HIS CA C 13 53.208 0.015 . 1 . . . . 111 HIS CA . 7105 1 1383 . 1 1 111 111 HIS CB C 13 30.785 0.004 . 1 . . . . 111 HIS CB . 7105 1 1384 . 1 1 111 111 HIS CD2 C 13 121.321 0.044 . 1 . . . . 111 HIS CD2 . 7105 1 1385 . 1 1 111 111 HIS CE1 C 13 138.284 0.000 . 1 . . . . 111 HIS CE1 . 7105 1 1386 . 1 1 111 111 HIS N N 15 116.223 0.000 . 1 . . . . 111 HIS N . 7105 1 1387 . 1 1 112 112 PRO HA H 1 4.555 0.000 . 1 . . . . 112 PRO HA . 7105 1 1388 . 1 1 112 112 PRO HB2 H 1 1.949 0.000 . 2 . . . . 112 PRO HB2 . 7105 1 1389 . 1 1 112 112 PRO HB3 H 1 2.358 0.001 . 2 . . . . 112 PRO HB3 . 7105 1 1390 . 1 1 112 112 PRO HG2 H 1 1.957 0.003 . 1 . . . . 112 PRO HG2 . 7105 1 1391 . 1 1 112 112 PRO HG3 H 1 1.957 0.003 . 1 . . . . 112 PRO HG3 . 7105 1 1392 . 1 1 112 112 PRO HD2 H 1 3.601 0.004 . 2 . . . . 112 PRO HD2 . 7105 1 1393 . 1 1 112 112 PRO HD3 H 1 3.358 0.008 . 2 . . . . 112 PRO HD3 . 7105 1 1394 . 1 1 112 112 PRO C C 13 178.173 0.000 . 1 . . . . 112 PRO C . 7105 1 1395 . 1 1 112 112 PRO CA C 13 64.389 0.000 . 1 . . . . 112 PRO CA . 7105 1 1396 . 1 1 112 112 PRO CB C 13 32.005 0.043 . 1 . . . . 112 PRO CB . 7105 1 1397 . 1 1 112 112 PRO CG C 13 27.392 0.000 . 1 . . . . 112 PRO CG . 7105 1 1398 . 1 1 112 112 PRO CD C 13 50.251 0.091 . 1 . . . . 112 PRO CD . 7105 1 1399 . 1 1 113 113 GLY H H 1 8.682 0.000 . 1 . . . . 113 GLY H . 7105 1 1400 . 1 1 113 113 GLY HA2 H 1 4.009 0.000 . 2 . . . . 113 GLY HA2 . 7105 1 1401 . 1 1 113 113 GLY HA3 H 1 3.841 0.010 . 2 . . . . 113 GLY HA3 . 7105 1 1402 . 1 1 113 113 GLY CA C 13 45.368 0.020 . 1 . . . . 113 GLY CA . 7105 1 1403 . 1 1 113 113 GLY N N 15 107.845 0.000 . 1 . . . . 113 GLY N . 7105 1 1404 . 1 1 114 114 LEU H H 1 7.364 0.008 . 1 . . . . 114 LEU H . 7105 1 1405 . 1 1 114 114 LEU HA H 1 4.417 0.005 . 1 . . . . 114 LEU HA . 7105 1 1406 . 1 1 114 114 LEU HB2 H 1 1.762 0.005 . 2 . . . . 114 LEU HB2 . 7105 1 1407 . 1 1 114 114 LEU HB3 H 1 1.571 0.007 . 2 . . . . 114 LEU HB3 . 7105 1 1408 . 1 1 114 114 LEU HG H 1 1.876 0.004 . 1 . . . . 114 LEU HG . 7105 1 1409 . 1 1 114 114 LEU HD11 H 1 0.744 0.007 . 2 . . . . 114 LEU HD1 . 7105 1 1410 . 1 1 114 114 LEU HD12 H 1 0.744 0.007 . 2 . . . . 114 LEU HD1 . 7105 1 1411 . 1 1 114 114 LEU HD13 H 1 0.744 0.007 . 2 . . . . 114 LEU HD1 . 7105 1 1412 . 1 1 114 114 LEU HD21 H 1 0.758 0.010 . 2 . . . . 114 LEU HD2 . 7105 1 1413 . 1 1 114 114 LEU HD22 H 1 0.758 0.010 . 2 . . . . 114 LEU HD2 . 7105 1 1414 . 1 1 114 114 LEU HD23 H 1 0.758 0.010 . 2 . . . . 114 LEU HD2 . 7105 1 1415 . 1 1 114 114 LEU CA C 13 55.168 0.017 . 1 . . . . 114 LEU CA . 7105 1 1416 . 1 1 114 114 LEU CB C 13 43.214 0.007 . 1 . . . . 114 LEU CB . 7105 1 1417 . 1 1 114 114 LEU CG C 13 26.808 0.000 . 1 . . . . 114 LEU CG . 7105 1 1418 . 1 1 114 114 LEU CD1 C 13 23.076 0.039 . 2 . . . . 114 LEU CD1 . 7105 1 1419 . 1 1 114 114 LEU CD2 C 13 25.786 0.050 . 2 . . . . 114 LEU CD2 . 7105 1 1420 . 1 1 114 114 LEU N N 15 120.738 0.070 . 1 . . . . 114 LEU N . 7105 1 1421 . 1 1 115 115 SER H H 1 9.146 0.008 . 1 . . . . 115 SER H . 7105 1 1422 . 1 1 115 115 SER HA H 1 4.448 0.000 . 1 . . . . 115 SER HA . 7105 1 1423 . 1 1 115 115 SER HB2 H 1 4.257 0.000 . 2 . . . . 115 SER HB2 . 7105 1 1424 . 1 1 115 115 SER HB3 H 1 4.074 0.000 . 2 . . . . 115 SER HB3 . 7105 1 1425 . 1 1 115 115 SER CA C 13 57.601 0.000 . 1 . . . . 115 SER CA . 7105 1 1426 . 1 1 115 115 SER CB C 13 65.099 0.003 . 1 . . . . 115 SER CB . 7105 1 1427 . 1 1 115 115 SER N N 15 120.340 0.076 . 1 . . . . 115 SER N . 7105 1 1428 . 1 1 116 116 ILE H H 1 8.583 0.007 . 1 . . . . 116 ILE H . 7105 1 1429 . 1 1 116 116 ILE HA H 1 3.793 0.004 . 1 . . . . 116 ILE HA . 7105 1 1430 . 1 1 116 116 ILE HB H 1 1.691 0.003 . 1 . . . . 116 ILE HB . 7105 1 1431 . 1 1 116 116 ILE HG12 H 1 1.344 0.004 . 2 . . . . 116 ILE HG12 . 7105 1 1432 . 1 1 116 116 ILE HG13 H 1 1.086 0.004 . 2 . . . . 116 ILE HG13 . 7105 1 1433 . 1 1 116 116 ILE HG21 H 1 0.714 0.004 . 1 . . . . 116 ILE HG2 . 7105 1 1434 . 1 1 116 116 ILE HG22 H 1 0.714 0.004 . 1 . . . . 116 ILE HG2 . 7105 1 1435 . 1 1 116 116 ILE HG23 H 1 0.714 0.004 . 1 . . . . 116 ILE HG2 . 7105 1 1436 . 1 1 116 116 ILE HD11 H 1 0.595 0.003 . 1 . . . . 116 ILE HD1 . 7105 1 1437 . 1 1 116 116 ILE HD12 H 1 0.595 0.003 . 1 . . . . 116 ILE HD1 . 7105 1 1438 . 1 1 116 116 ILE HD13 H 1 0.595 0.003 . 1 . . . . 116 ILE HD1 . 7105 1 1439 . 1 1 116 116 ILE C C 13 179.278 0.000 . 1 . . . . 116 ILE C . 7105 1 1440 . 1 1 116 116 ILE CA C 13 64.624 0.006 . 1 . . . . 116 ILE CA . 7105 1 1441 . 1 1 116 116 ILE CB C 13 37.772 0.019 . 1 . . . . 116 ILE CB . 7105 1 1442 . 1 1 116 116 ILE CG1 C 13 28.017 0.043 . 1 . . . . 116 ILE CG1 . 7105 1 1443 . 1 1 116 116 ILE CG2 C 13 17.377 0.030 . 1 . . . . 116 ILE CG2 . 7105 1 1444 . 1 1 116 116 ILE CD1 C 13 12.894 0.002 . 1 . . . . 116 ILE CD1 . 7105 1 1445 . 1 1 116 116 ILE N N 15 119.909 0.042 . 1 . . . . 116 ILE N . 7105 1 1446 . 1 1 117 117 GLY H H 1 8.503 0.002 . 1 . . . . 117 GLY H . 7105 1 1447 . 1 1 117 117 GLY HA2 H 1 3.860 0.006 . 1 . . . . 117 GLY HA2 . 7105 1 1448 . 1 1 117 117 GLY HA3 H 1 3.860 0.006 . 1 . . . . 117 GLY HA3 . 7105 1 1449 . 1 1 117 117 GLY CA C 13 47.043 0.004 . 1 . . . . 117 GLY CA . 7105 1 1450 . 1 1 117 117 GLY N N 15 109.653 0.039 . 1 . . . . 117 GLY N . 7105 1 1451 . 1 1 118 118 ASP H H 1 7.698 0.002 . 1 . . . . 118 ASP H . 7105 1 1452 . 1 1 118 118 ASP HA H 1 4.539 0.014 . 1 . . . . 118 ASP HA . 7105 1 1453 . 1 1 118 118 ASP HB2 H 1 2.880 0.007 . 2 . . . . 118 ASP HB2 . 7105 1 1454 . 1 1 118 118 ASP HB3 H 1 2.553 0.010 . 2 . . . . 118 ASP HB3 . 7105 1 1455 . 1 1 118 118 ASP CA C 13 57.294 0.000 . 1 . . . . 118 ASP CA . 7105 1 1456 . 1 1 118 118 ASP CB C 13 41.165 0.069 . 1 . . . . 118 ASP CB . 7105 1 1457 . 1 1 118 118 ASP N N 15 122.593 0.000 . 1 . . . . 118 ASP N . 7105 1 1458 . 1 1 119 119 VAL H H 1 8.438 0.005 . 1 . . . . 119 VAL H . 7105 1 1459 . 1 1 119 119 VAL HA H 1 3.414 0.010 . 1 . . . . 119 VAL HA . 7105 1 1460 . 1 1 119 119 VAL HB H 1 2.200 0.009 . 1 . . . . 119 VAL HB . 7105 1 1461 . 1 1 119 119 VAL HG11 H 1 0.906 0.005 . 2 . . . . 119 VAL HG1 . 7105 1 1462 . 1 1 119 119 VAL HG12 H 1 0.906 0.005 . 2 . . . . 119 VAL HG1 . 7105 1 1463 . 1 1 119 119 VAL HG13 H 1 0.906 0.005 . 2 . . . . 119 VAL HG1 . 7105 1 1464 . 1 1 119 119 VAL HG21 H 1 0.954 0.009 . 2 . . . . 119 VAL HG2 . 7105 1 1465 . 1 1 119 119 VAL HG22 H 1 0.954 0.009 . 2 . . . . 119 VAL HG2 . 7105 1 1466 . 1 1 119 119 VAL HG23 H 1 0.954 0.009 . 2 . . . . 119 VAL HG2 . 7105 1 1467 . 1 1 119 119 VAL CA C 13 67.385 0.005 . 1 . . . . 119 VAL CA . 7105 1 1468 . 1 1 119 119 VAL CB C 13 31.767 0.028 . 1 . . . . 119 VAL CB . 7105 1 1469 . 1 1 119 119 VAL CG1 C 13 21.838 0.053 . 2 . . . . 119 VAL CG1 . 7105 1 1470 . 1 1 119 119 VAL CG2 C 13 24.342 0.015 . 2 . . . . 119 VAL CG2 . 7105 1 1471 . 1 1 119 119 VAL N N 15 122.596 0.067 . 1 . . . . 119 VAL N . 7105 1 1472 . 1 1 120 120 ALA H H 1 7.881 0.003 . 1 . . . . 120 ALA H . 7105 1 1473 . 1 1 120 120 ALA HA H 1 4.182 0.000 . 1 . . . . 120 ALA HA . 7105 1 1474 . 1 1 120 120 ALA HB1 H 1 1.611 0.016 . 1 . . . . 120 ALA HB . 7105 1 1475 . 1 1 120 120 ALA HB2 H 1 1.611 0.016 . 1 . . . . 120 ALA HB . 7105 1 1476 . 1 1 120 120 ALA HB3 H 1 1.611 0.016 . 1 . . . . 120 ALA HB . 7105 1 1477 . 1 1 120 120 ALA CA C 13 55.699 0.000 . 1 . . . . 120 ALA CA . 7105 1 1478 . 1 1 120 120 ALA CB C 13 18.534 0.088 . 1 . . . . 120 ALA CB . 7105 1 1479 . 1 1 120 120 ALA N N 15 121.343 0.045 . 1 . . . . 120 ALA N . 7105 1 1480 . 1 1 121 121 LYS H H 1 7.967 0.004 . 1 . . . . 121 LYS H . 7105 1 1481 . 1 1 121 121 LYS HA H 1 4.049 0.004 . 1 . . . . 121 LYS HA . 7105 1 1482 . 1 1 121 121 LYS HB2 H 1 1.997 0.003 . 1 . . . . 121 LYS HB2 . 7105 1 1483 . 1 1 121 121 LYS HB3 H 1 1.997 0.002 . 1 . . . . 121 LYS HB3 . 7105 1 1484 . 1 1 121 121 LYS HG2 H 1 1.673 0.008 . 2 . . . . 121 LYS HG2 . 7105 1 1485 . 1 1 121 121 LYS HG3 H 1 1.522 0.000 . 2 . . . . 121 LYS HG3 . 7105 1 1486 . 1 1 121 121 LYS HD2 H 1 1.710 0.018 . 1 . . . . 121 LYS HD2 . 7105 1 1487 . 1 1 121 121 LYS HD3 H 1 1.710 0.018 . 1 . . . . 121 LYS HD3 . 7105 1 1488 . 1 1 121 121 LYS HE2 H 1 2.974 0.001 . 1 . . . . 121 LYS HE2 . 7105 1 1489 . 1 1 121 121 LYS HE3 H 1 2.974 0.001 . 1 . . . . 121 LYS HE3 . 7105 1 1490 . 1 1 121 121 LYS CA C 13 59.726 0.073 . 1 . . . . 121 LYS CA . 7105 1 1491 . 1 1 121 121 LYS CB C 13 32.807 0.056 . 1 . . . . 121 LYS CB . 7105 1 1492 . 1 1 121 121 LYS CG C 13 25.774 0.074 . 1 . . . . 121 LYS CG . 7105 1 1493 . 1 1 121 121 LYS CD C 13 29.830 0.063 . 1 . . . . 121 LYS CD . 7105 1 1494 . 1 1 121 121 LYS CE C 13 42.201 0.042 . 1 . . . . 121 LYS CE . 7105 1 1495 . 1 1 121 121 LYS N N 15 117.591 0.073 . 1 . . . . 121 LYS N . 7105 1 1496 . 1 1 122 122 LYS H H 1 7.981 0.008 . 1 . . . . 122 LYS H . 7105 1 1497 . 1 1 122 122 LYS HA H 1 4.183 0.003 . 1 . . . . 122 LYS HA . 7105 1 1498 . 1 1 122 122 LYS HB2 H 1 1.934 0.001 . 1 . . . . 122 LYS HB2 . 7105 1 1499 . 1 1 122 122 LYS HB3 H 1 1.934 0.001 . 1 . . . . 122 LYS HB3 . 7105 1 1500 . 1 1 122 122 LYS HG2 H 1 1.483 0.000 . 1 . . . . 122 LYS HG2 . 7105 1 1501 . 1 1 122 122 LYS HG3 H 1 1.483 0.000 . 1 . . . . 122 LYS HG3 . 7105 1 1502 . 1 1 122 122 LYS HD2 H 1 1.563 0.001 . 2 . . . . 122 LYS HD2 . 7105 1 1503 . 1 1 122 122 LYS HD3 H 1 1.458 0.001 . 2 . . . . 122 LYS HD3 . 7105 1 1504 . 1 1 122 122 LYS HE2 H 1 2.731 0.001 . 2 . . . . 122 LYS HE2 . 7105 1 1505 . 1 1 122 122 LYS HE3 H 1 2.662 0.003 . 2 . . . . 122 LYS HE3 . 7105 1 1506 . 1 1 122 122 LYS CA C 13 58.977 0.001 . 1 . . . . 122 LYS CA . 7105 1 1507 . 1 1 122 122 LYS CB C 13 32.273 0.016 . 1 . . . . 122 LYS CB . 7105 1 1508 . 1 1 122 122 LYS CG C 13 24.820 0.000 . 1 . . . . 122 LYS CG . 7105 1 1509 . 1 1 122 122 LYS CD C 13 28.659 0.000 . 1 . . . . 122 LYS CD . 7105 1 1510 . 1 1 122 122 LYS CE C 13 41.701 0.000 . 1 . . . . 122 LYS CE . 7105 1 1511 . 1 1 122 122 LYS N N 15 120.648 0.011 . 1 . . . . 122 LYS N . 7105 1 1512 . 1 1 123 123 LEU H H 1 8.630 0.006 . 1 . . . . 123 LEU H . 7105 1 1513 . 1 1 123 123 LEU HA H 1 4.287 0.007 . 1 . . . . 123 LEU HA . 7105 1 1514 . 1 1 123 123 LEU HB2 H 1 2.207 0.004 . 2 . . . . 123 LEU HB2 . 7105 1 1515 . 1 1 123 123 LEU HB3 H 1 1.808 0.001 . 2 . . . . 123 LEU HB3 . 7105 1 1516 . 1 1 123 123 LEU HG H 1 1.827 0.001 . 1 . . . . 123 LEU HG . 7105 1 1517 . 1 1 123 123 LEU HD11 H 1 0.807 0.020 . 2 . . . . 123 LEU HD1 . 7105 1 1518 . 1 1 123 123 LEU HD12 H 1 0.807 0.020 . 2 . . . . 123 LEU HD1 . 7105 1 1519 . 1 1 123 123 LEU HD13 H 1 0.807 0.020 . 2 . . . . 123 LEU HD1 . 7105 1 1520 . 1 1 123 123 LEU HD21 H 1 0.792 0.014 . 2 . . . . 123 LEU HD2 . 7105 1 1521 . 1 1 123 123 LEU HD22 H 1 0.792 0.014 . 2 . . . . 123 LEU HD2 . 7105 1 1522 . 1 1 123 123 LEU HD23 H 1 0.792 0.014 . 2 . . . . 123 LEU HD2 . 7105 1 1523 . 1 1 123 123 LEU C C 13 179.799 0.000 . 1 . . . . 123 LEU C . 7105 1 1524 . 1 1 123 123 LEU CA C 13 58.425 0.050 . 1 . . . . 123 LEU CA . 7105 1 1525 . 1 1 123 123 LEU CB C 13 41.712 0.020 . 1 . . . . 123 LEU CB . 7105 1 1526 . 1 1 123 123 LEU CG C 13 27.306 0.000 . 1 . . . . 123 LEU CG . 7105 1 1527 . 1 1 123 123 LEU CD1 C 13 24.811 0.019 . 2 . . . . 123 LEU CD1 . 7105 1 1528 . 1 1 123 123 LEU CD2 C 13 26.813 0.009 . 2 . . . . 123 LEU CD2 . 7105 1 1529 . 1 1 123 123 LEU N N 15 120.236 0.027 . 1 . . . . 123 LEU N . 7105 1 1530 . 1 1 124 124 GLY H H 1 8.397 0.006 . 1 . . . . 124 GLY H . 7105 1 1531 . 1 1 124 124 GLY HA2 H 1 4.034 0.010 . 2 . . . . 124 GLY HA2 . 7105 1 1532 . 1 1 124 124 GLY HA3 H 1 3.849 0.006 . 2 . . . . 124 GLY HA3 . 7105 1 1533 . 1 1 124 124 GLY CA C 13 48.169 0.033 . 1 . . . . 124 GLY CA . 7105 1 1534 . 1 1 124 124 GLY N N 15 106.283 0.148 . 1 . . . . 124 GLY N . 7105 1 1535 . 1 1 125 125 GLU H H 1 8.031 0.002 . 1 . . . . 125 GLU H . 7105 1 1536 . 1 1 125 125 GLU HA H 1 4.083 0.000 . 1 . . . . 125 GLU HA . 7105 1 1537 . 1 1 125 125 GLU HB2 H 1 2.196 0.007 . 1 . . . . 125 GLU HB2 . 7105 1 1538 . 1 1 125 125 GLU HB3 H 1 2.196 0.007 . 1 . . . . 125 GLU HB3 . 7105 1 1539 . 1 1 125 125 GLU HG2 H 1 2.392 0.000 . 2 . . . . 125 GLU HG2 . 7105 1 1540 . 1 1 125 125 GLU HG3 H 1 2.182 0.000 . 2 . . . . 125 GLU HG3 . 7105 1 1541 . 1 1 125 125 GLU CA C 13 59.630 0.000 . 1 . . . . 125 GLU CA . 7105 1 1542 . 1 1 125 125 GLU CB C 13 30.052 0.003 . 1 . . . . 125 GLU CB . 7105 1 1543 . 1 1 125 125 GLU CG C 13 36.257 0.000 . 1 . . . . 125 GLU CG . 7105 1 1544 . 1 1 125 125 GLU N N 15 122.485 0.032 . 1 . . . . 125 GLU N . 7105 1 1545 . 1 1 126 126 MET H H 1 8.645 0.004 . 1 . . . . 126 MET H . 7105 1 1546 . 1 1 126 126 MET HA H 1 4.076 0.003 . 1 . . . . 126 MET HA . 7105 1 1547 . 1 1 126 126 MET HB2 H 1 2.397 0.010 . 1 . . . . 126 MET HB2 . 7105 1 1548 . 1 1 126 126 MET HB3 H 1 2.397 0.010 . 1 . . . . 126 MET HB3 . 7105 1 1549 . 1 1 126 126 MET HG2 H 1 2.826 0.008 . 2 . . . . 126 MET HG2 . 7105 1 1550 . 1 1 126 126 MET HG3 H 1 2.561 0.002 . 2 . . . . 126 MET HG3 . 7105 1 1551 . 1 1 126 126 MET HE1 H 1 1.886 0.002 . 1 . . . . 126 MET HE . 7105 1 1552 . 1 1 126 126 MET HE2 H 1 1.886 0.002 . 1 . . . . 126 MET HE . 7105 1 1553 . 1 1 126 126 MET HE3 H 1 1.886 0.002 . 1 . . . . 126 MET HE . 7105 1 1554 . 1 1 126 126 MET CA C 13 59.393 0.000 . 1 . . . . 126 MET CA . 7105 1 1555 . 1 1 126 126 MET CB C 13 34.231 0.051 . 1 . . . . 126 MET CB . 7105 1 1556 . 1 1 126 126 MET CG C 13 32.277 0.003 . 1 . . . . 126 MET CG . 7105 1 1557 . 1 1 126 126 MET CE C 13 16.551 0.014 . 1 . . . . 126 MET CE . 7105 1 1558 . 1 1 126 126 MET N N 15 118.272 0.086 . 1 . . . . 126 MET N . 7105 1 1559 . 1 1 127 127 TRP H H 1 8.769 0.001 . 1 . . . . 127 TRP H . 7105 1 1560 . 1 1 127 127 TRP HA H 1 3.877 0.009 . 1 . . . . 127 TRP HA . 7105 1 1561 . 1 1 127 127 TRP HB2 H 1 3.244 0.000 . 2 . . . . 127 TRP HB2 . 7105 1 1562 . 1 1 127 127 TRP HB3 H 1 3.144 0.000 . 2 . . . . 127 TRP HB3 . 7105 1 1563 . 1 1 127 127 TRP HD1 H 1 6.840 0.004 . 1 . . . . 127 TRP HD1 . 7105 1 1564 . 1 1 127 127 TRP HE1 H 1 10.419 0.003 . 1 . . . . 127 TRP HE1 . 7105 1 1565 . 1 1 127 127 TRP HE3 H 1 5.620 0.003 . 1 . . . . 127 TRP HE3 . 7105 1 1566 . 1 1 127 127 TRP HZ2 H 1 7.538 0.003 . 1 . . . . 127 TRP HZ2 . 7105 1 1567 . 1 1 127 127 TRP HZ3 H 1 6.500 0.005 . 1 . . . . 127 TRP HZ3 . 7105 1 1568 . 1 1 127 127 TRP HH2 H 1 7.022 0.000 . 1 . . . . 127 TRP HH2 . 7105 1 1569 . 1 1 127 127 TRP CA C 13 59.625 0.000 . 1 . . . . 127 TRP CA . 7105 1 1570 . 1 1 127 127 TRP CB C 13 30.786 0.000 . 1 . . . . 127 TRP CB . 7105 1 1571 . 1 1 127 127 TRP CD1 C 13 127.772 0.000 . 1 . . . . 127 TRP CD1 . 7105 1 1572 . 1 1 127 127 TRP CE3 C 13 120.643 0.016 . 1 . . . . 127 TRP CE3 . 7105 1 1573 . 1 1 127 127 TRP CZ2 C 13 114.213 0.025 . 1 . . . . 127 TRP CZ2 . 7105 1 1574 . 1 1 127 127 TRP CZ3 C 13 121.799 0.018 . 1 . . . . 127 TRP CZ3 . 7105 1 1575 . 1 1 127 127 TRP CH2 C 13 123.715 0.000 . 1 . . . . 127 TRP CH2 . 7105 1 1576 . 1 1 127 127 TRP N N 15 122.727 0.000 . 1 . . . . 127 TRP N . 7105 1 1577 . 1 1 127 127 TRP NE1 N 15 129.503 0.027 . 1 . . . . 127 TRP NE1 . 7105 1 1578 . 1 1 128 128 ASN H H 1 8.292 0.001 . 1 . . . . 128 ASN H . 7105 1 1579 . 1 1 128 128 ASN HA H 1 4.286 0.000 . 1 . . . . 128 ASN HA . 7105 1 1580 . 1 1 128 128 ASN HB2 H 1 2.848 0.008 . 2 . . . . 128 ASN HB2 . 7105 1 1581 . 1 1 128 128 ASN HB3 H 1 2.766 0.000 . 2 . . . . 128 ASN HB3 . 7105 1 1582 . 1 1 128 128 ASN HD21 H 1 7.034 0.002 . 1 . . . . 128 ASN HD21 . 7105 1 1583 . 1 1 128 128 ASN HD22 H 1 7.344 0.000 . 1 . . . . 128 ASN HD22 . 7105 1 1584 . 1 1 128 128 ASN CA C 13 55.775 0.000 . 1 . . . . 128 ASN CA . 7105 1 1585 . 1 1 128 128 ASN CB C 13 38.545 0.011 . 1 . . . . 128 ASN CB . 7105 1 1586 . 1 1 128 128 ASN N N 15 116.784 0.002 . 1 . . . . 128 ASN N . 7105 1 1587 . 1 1 128 128 ASN ND2 N 15 113.287 0.029 . 1 . . . . 128 ASN ND2 . 7105 1 1588 . 1 1 129 129 ASN H H 1 7.526 0.003 . 1 . . . . 129 ASN H . 7105 1 1589 . 1 1 129 129 ASN HA H 1 4.737 0.000 . 1 . . . . 129 ASN HA . 7105 1 1590 . 1 1 129 129 ASN HB2 H 1 2.975 0.014 . 2 . . . . 129 ASN HB2 . 7105 1 1591 . 1 1 129 129 ASN HB3 H 1 2.689 0.001 . 2 . . . . 129 ASN HB3 . 7105 1 1592 . 1 1 129 129 ASN HD21 H 1 6.971 0.000 . 1 . . . . 129 ASN HD21 . 7105 1 1593 . 1 1 129 129 ASN HD22 H 1 7.600 0.000 . 1 . . . . 129 ASN HD22 . 7105 1 1594 . 1 1 129 129 ASN CA C 13 53.244 0.000 . 1 . . . . 129 ASN CA . 7105 1 1595 . 1 1 129 129 ASN CB C 13 39.743 0.012 . 1 . . . . 129 ASN CB . 7105 1 1596 . 1 1 129 129 ASN N N 15 115.599 0.017 . 1 . . . . 129 ASN N . 7105 1 1597 . 1 1 129 129 ASN ND2 N 15 112.804 0.004 . 1 . . . . 129 ASN ND2 . 7105 1 1598 . 1 1 130 130 THR H H 1 7.272 0.004 . 1 . . . . 130 THR H . 7105 1 1599 . 1 1 130 130 THR HA H 1 4.124 0.009 . 1 . . . . 130 THR HA . 7105 1 1600 . 1 1 130 130 THR HB H 1 3.753 0.002 . 1 . . . . 130 THR HB . 7105 1 1601 . 1 1 130 130 THR HG1 H 1 5.319 0.000 . 1 . . . . 130 THR HG1 . 7105 1 1602 . 1 1 130 130 THR HG21 H 1 1.188 0.004 . 1 . . . . 130 THR HG2 . 7105 1 1603 . 1 1 130 130 THR HG22 H 1 1.188 0.004 . 1 . . . . 130 THR HG2 . 7105 1 1604 . 1 1 130 130 THR HG23 H 1 1.188 0.004 . 1 . . . . 130 THR HG2 . 7105 1 1605 . 1 1 130 130 THR C C 13 173.340 0.000 . 1 . . . . 130 THR C . 7105 1 1606 . 1 1 130 130 THR CA C 13 63.967 0.004 . 1 . . . . 130 THR CA . 7105 1 1607 . 1 1 130 130 THR CB C 13 69.039 0.051 . 1 . . . . 130 THR CB . 7105 1 1608 . 1 1 130 130 THR CG2 C 13 21.601 0.034 . 1 . . . . 130 THR CG2 . 7105 1 1609 . 1 1 130 130 THR N N 15 119.509 0.034 . 1 . . . . 130 THR N . 7105 1 1610 . 1 1 131 131 ALA H H 1 9.077 0.005 . 1 . . . . 131 ALA H . 7105 1 1611 . 1 1 131 131 ALA HA H 1 4.137 0.004 . 1 . . . . 131 ALA HA . 7105 1 1612 . 1 1 131 131 ALA HB1 H 1 1.535 0.005 . 1 . . . . 131 ALA HB . 7105 1 1613 . 1 1 131 131 ALA HB2 H 1 1.535 0.005 . 1 . . . . 131 ALA HB . 7105 1 1614 . 1 1 131 131 ALA HB3 H 1 1.535 0.005 . 1 . . . . 131 ALA HB . 7105 1 1615 . 1 1 131 131 ALA CA C 13 52.247 0.012 . 1 . . . . 131 ALA CA . 7105 1 1616 . 1 1 131 131 ALA CB C 13 19.288 0.052 . 1 . . . . 131 ALA CB . 7105 1 1617 . 1 1 131 131 ALA N N 15 130.703 0.020 . 1 . . . . 131 ALA N . 7105 1 1618 . 1 1 132 132 ALA H H 1 8.708 0.004 . 1 . . . . 132 ALA H . 7105 1 1619 . 1 1 132 132 ALA HA H 1 3.795 0.002 . 1 . . . . 132 ALA HA . 7105 1 1620 . 1 1 132 132 ALA HB1 H 1 1.449 0.012 . 1 . . . . 132 ALA HB . 7105 1 1621 . 1 1 132 132 ALA HB2 H 1 1.449 0.012 . 1 . . . . 132 ALA HB . 7105 1 1622 . 1 1 132 132 ALA HB3 H 1 1.449 0.012 . 1 . . . . 132 ALA HB . 7105 1 1623 . 1 1 132 132 ALA C C 13 181.273 0.000 . 1 . . . . 132 ALA C . 7105 1 1624 . 1 1 132 132 ALA CA C 13 56.362 0.049 . 1 . . . . 132 ALA CA . 7105 1 1625 . 1 1 132 132 ALA CB C 13 18.444 0.061 . 1 . . . . 132 ALA CB . 7105 1 1626 . 1 1 132 132 ALA N N 15 124.332 0.014 . 1 . . . . 132 ALA N . 7105 1 1627 . 1 1 133 133 ASP H H 1 8.829 0.003 . 1 . . . . 133 ASP H . 7105 1 1628 . 1 1 133 133 ASP HA H 1 4.387 0.008 . 1 . . . . 133 ASP HA . 7105 1 1629 . 1 1 133 133 ASP HB2 H 1 2.687 0.006 . 2 . . . . 133 ASP HB2 . 7105 1 1630 . 1 1 133 133 ASP HB3 H 1 2.488 0.003 . 2 . . . . 133 ASP HB3 . 7105 1 1631 . 1 1 133 133 ASP CA C 13 57.361 0.000 . 1 . . . . 133 ASP CA . 7105 1 1632 . 1 1 133 133 ASP CB C 13 40.252 0.035 . 1 . . . . 133 ASP CB . 7105 1 1633 . 1 1 133 133 ASP N N 15 115.105 0.037 . 1 . . . . 133 ASP N . 7105 1 1634 . 1 1 134 134 ASP H H 1 7.313 0.003 . 1 . . . . 134 ASP H . 7105 1 1635 . 1 1 134 134 ASP HA H 1 4.818 0.007 . 1 . . . . 134 ASP HA . 7105 1 1636 . 1 1 134 134 ASP HB2 H 1 2.864 0.013 . 2 . . . . 134 ASP HB2 . 7105 1 1637 . 1 1 134 134 ASP HB3 H 1 2.753 0.006 . 2 . . . . 134 ASP HB3 . 7105 1 1638 . 1 1 134 134 ASP CA C 13 55.870 0.004 . 1 . . . . 134 ASP CA . 7105 1 1639 . 1 1 134 134 ASP CB C 13 41.730 0.007 . 1 . . . . 134 ASP CB . 7105 1 1640 . 1 1 134 134 ASP N N 15 117.502 0.017 . 1 . . . . 134 ASP N . 7105 1 1641 . 1 1 135 135 LYS H H 1 7.739 0.007 . 1 . . . . 135 LYS H . 7105 1 1642 . 1 1 135 135 LYS HA H 1 4.436 0.022 . 1 . . . . 135 LYS HA . 7105 1 1643 . 1 1 135 135 LYS HB2 H 1 1.748 0.014 . 1 . . . . 135 LYS HB2 . 7105 1 1644 . 1 1 135 135 LYS HB3 H 1 1.748 0.014 . 1 . . . . 135 LYS HB3 . 7105 1 1645 . 1 1 135 135 LYS HG2 H 1 1.012 0.008 . 2 . . . . 135 LYS HG2 . 7105 1 1646 . 1 1 135 135 LYS HG3 H 1 -0.044 0.004 . 2 . . . . 135 LYS HG3 . 7105 1 1647 . 1 1 135 135 LYS HD2 H 1 0.905 0.002 . 2 . . . . 135 LYS HD2 . 7105 1 1648 . 1 1 135 135 LYS HD3 H 1 0.740 0.009 . 2 . . . . 135 LYS HD3 . 7105 1 1649 . 1 1 135 135 LYS HE2 H 1 1.731 0.005 . 2 . . . . 135 LYS HE2 . 7105 1 1650 . 1 1 135 135 LYS HE3 H 1 1.236 0.006 . 2 . . . . 135 LYS HE3 . 7105 1 1651 . 1 1 135 135 LYS CA C 13 59.171 0.012 . 1 . . . . 135 LYS CA . 7105 1 1652 . 1 1 135 135 LYS CB C 13 34.205 0.091 . 1 . . . . 135 LYS CB . 7105 1 1653 . 1 1 135 135 LYS CG C 13 26.628 0.057 . 1 . . . . 135 LYS CG . 7105 1 1654 . 1 1 135 135 LYS CD C 13 29.798 0.002 . 1 . . . . 135 LYS CD . 7105 1 1655 . 1 1 135 135 LYS CE C 13 42.219 0.000 . 1 . . . . 135 LYS CE . 7105 1 1656 . 1 1 135 135 LYS N N 15 118.514 0.087 . 1 . . . . 135 LYS N . 7105 1 1657 . 1 1 136 136 GLN H H 1 7.414 0.002 . 1 . . . . 136 GLN H . 7105 1 1658 . 1 1 136 136 GLN HA H 1 4.392 0.003 . 1 . . . . 136 GLN HA . 7105 1 1659 . 1 1 136 136 GLN HB2 H 1 2.325 0.002 . 2 . . . . 136 GLN HB2 . 7105 1 1660 . 1 1 136 136 GLN HB3 H 1 2.248 0.003 . 2 . . . . 136 GLN HB3 . 7105 1 1661 . 1 1 136 136 GLN HG2 H 1 2.678 0.001 . 2 . . . . 136 GLN HG2 . 7105 1 1662 . 1 1 136 136 GLN HG3 H 1 2.508 0.000 . 2 . . . . 136 GLN HG3 . 7105 1 1663 . 1 1 136 136 GLN HE21 H 1 6.464 0.000 . 1 . . . . 136 GLN HE21 . 7105 1 1664 . 1 1 136 136 GLN HE22 H 1 7.126 0.000 . 1 . . . . 136 GLN HE22 . 7105 1 1665 . 1 1 136 136 GLN CA C 13 60.893 0.000 . 1 . . . . 136 GLN CA . 7105 1 1666 . 1 1 136 136 GLN CB C 13 27.302 0.053 . 1 . . . . 136 GLN CB . 7105 1 1667 . 1 1 136 136 GLN CG C 13 34.760 0.000 . 1 . . . . 136 GLN CG . 7105 1 1668 . 1 1 136 136 GLN N N 15 118.108 0.040 . 1 . . . . 136 GLN N . 7105 1 1669 . 1 1 136 136 GLN NE2 N 15 114.303 0.000 . 1 . . . . 136 GLN NE2 . 7105 1 1670 . 1 1 137 137 PRO HA H 1 4.237 0.000 . 1 . . . . 137 PRO HA . 7105 1 1671 . 1 1 137 137 PRO HB2 H 1 2.235 0.000 . 2 . . . . 137 PRO HB2 . 7105 1 1672 . 1 1 137 137 PRO HB3 H 1 1.300 0.001 . 2 . . . . 137 PRO HB3 . 7105 1 1673 . 1 1 137 137 PRO HG2 H 1 2.055 0.001 . 2 . . . . 137 PRO HG2 . 7105 1 1674 . 1 1 137 137 PRO HG3 H 1 1.991 0.001 . 2 . . . . 137 PRO HG3 . 7105 1 1675 . 1 1 137 137 PRO HD2 H 1 3.803 0.001 . 2 . . . . 137 PRO HD2 . 7105 1 1676 . 1 1 137 137 PRO HD3 H 1 3.686 0.001 . 2 . . . . 137 PRO HD3 . 7105 1 1677 . 1 1 137 137 PRO CA C 13 66.588 0.005 . 1 . . . . 137 PRO CA . 7105 1 1678 . 1 1 137 137 PRO CB C 13 31.291 0.018 . 1 . . . . 137 PRO CB . 7105 1 1679 . 1 1 137 137 PRO CG C 13 28.797 0.000 . 1 . . . . 137 PRO CG . 7105 1 1680 . 1 1 137 137 PRO CD C 13 50.220 0.084 . 1 . . . . 137 PRO CD . 7105 1 1681 . 1 1 138 138 TYR H H 1 7.187 0.002 . 1 . . . . 138 TYR H . 7105 1 1682 . 1 1 138 138 TYR HA H 1 4.234 0.003 . 1 . . . . 138 TYR HA . 7105 1 1683 . 1 1 138 138 TYR HB2 H 1 3.712 0.010 . 2 . . . . 138 TYR HB2 . 7105 1 1684 . 1 1 138 138 TYR HB3 H 1 3.479 0.012 . 2 . . . . 138 TYR HB3 . 7105 1 1685 . 1 1 138 138 TYR HD1 H 1 7.455 0.007 . 1 . . . . 138 TYR HD . 7105 1 1686 . 1 1 138 138 TYR HD2 H 1 7.455 0.007 . 1 . . . . 138 TYR HD . 7105 1 1687 . 1 1 138 138 TYR HE1 H 1 7.249 0.016 . 1 . . . . 138 TYR HE . 7105 1 1688 . 1 1 138 138 TYR HE2 H 1 7.249 0.016 . 1 . . . . 138 TYR HE . 7105 1 1689 . 1 1 138 138 TYR CA C 13 61.661 0.000 . 1 . . . . 138 TYR CA . 7105 1 1690 . 1 1 138 138 TYR CB C 13 38.481 0.032 . 1 . . . . 138 TYR CB . 7105 1 1691 . 1 1 138 138 TYR CD1 C 13 132.774 0.058 . 1 . . . . 138 TYR CD . 7105 1 1692 . 1 1 138 138 TYR CD2 C 13 132.774 0.058 . 1 . . . . 138 TYR CD . 7105 1 1693 . 1 1 138 138 TYR CE1 C 13 118.900 0.086 . 1 . . . . 138 TYR CE . 7105 1 1694 . 1 1 138 138 TYR CE2 C 13 118.900 0.086 . 1 . . . . 138 TYR CE . 7105 1 1695 . 1 1 138 138 TYR N N 15 115.413 0.063 . 1 . . . . 138 TYR N . 7105 1 1696 . 1 1 139 139 GLU H H 1 8.137 0.000 . 1 . . . . 139 GLU H . 7105 1 1697 . 1 1 139 139 GLU HA H 1 4.247 0.006 . 1 . . . . 139 GLU HA . 7105 1 1698 . 1 1 139 139 GLU HB2 H 1 2.340 0.008 . 2 . . . . 139 GLU HB2 . 7105 1 1699 . 1 1 139 139 GLU HB3 H 1 2.188 0.000 . 2 . . . . 139 GLU HB3 . 7105 1 1700 . 1 1 139 139 GLU HG2 H 1 2.519 0.010 . 2 . . . . 139 GLU HG2 . 7105 1 1701 . 1 1 139 139 GLU HG3 H 1 2.353 0.000 . 2 . . . . 139 GLU HG3 . 7105 1 1702 . 1 1 139 139 GLU CA C 13 59.726 0.026 . 1 . . . . 139 GLU CA . 7105 1 1703 . 1 1 139 139 GLU CB C 13 29.781 0.031 . 1 . . . . 139 GLU CB . 7105 1 1704 . 1 1 139 139 GLU CG C 13 36.240 0.025 . 1 . . . . 139 GLU CG . 7105 1 1705 . 1 1 139 139 GLU N N 15 119.697 0.001 . 1 . . . . 139 GLU N . 7105 1 1706 . 1 1 140 140 LYS H H 1 9.028 0.008 . 1 . . . . 140 LYS H . 7105 1 1707 . 1 1 140 140 LYS HA H 1 4.180 0.005 . 1 . . . . 140 LYS HA . 7105 1 1708 . 1 1 140 140 LYS HB2 H 1 1.903 0.001 . 2 . . . . 140 LYS HB2 . 7105 1 1709 . 1 1 140 140 LYS HB3 H 1 1.877 0.000 . 2 . . . . 140 LYS HB3 . 7105 1 1710 . 1 1 140 140 LYS HG2 H 1 1.649 0.001 . 2 . . . . 140 LYS HG2 . 7105 1 1711 . 1 1 140 140 LYS HG3 H 1 1.529 0.003 . 2 . . . . 140 LYS HG3 . 7105 1 1712 . 1 1 140 140 LYS HD2 H 1 1.690 0.001 . 1 . . . . 140 LYS HD2 . 7105 1 1713 . 1 1 140 140 LYS HD3 H 1 1.690 0.001 . 1 . . . . 140 LYS HD3 . 7105 1 1714 . 1 1 140 140 LYS HE2 H 1 2.981 0.002 . 1 . . . . 140 LYS HE2 . 7105 1 1715 . 1 1 140 140 LYS HE3 H 1 2.981 0.002 . 1 . . . . 140 LYS HE3 . 7105 1 1716 . 1 1 140 140 LYS CA C 13 59.535 0.019 . 1 . . . . 140 LYS CA . 7105 1 1717 . 1 1 140 140 LYS CB C 13 32.304 0.064 . 1 . . . . 140 LYS CB . 7105 1 1718 . 1 1 140 140 LYS CG C 13 25.814 0.000 . 1 . . . . 140 LYS CG . 7105 1 1719 . 1 1 140 140 LYS CD C 13 29.281 0.031 . 1 . . . . 140 LYS CD . 7105 1 1720 . 1 1 140 140 LYS CE C 13 42.222 0.000 . 1 . . . . 140 LYS CE . 7105 1 1721 . 1 1 140 140 LYS N N 15 120.298 0.022 . 1 . . . . 140 LYS N . 7105 1 1722 . 1 1 141 141 LYS H H 1 7.648 0.003 . 1 . . . . 141 LYS H . 7105 1 1723 . 1 1 141 141 LYS HA H 1 4.129 0.001 . 1 . . . . 141 LYS HA . 7105 1 1724 . 1 1 141 141 LYS HB2 H 1 1.950 0.001 . 1 . . . . 141 LYS HB2 . 7105 1 1725 . 1 1 141 141 LYS HB3 H 1 1.950 0.001 . 1 . . . . 141 LYS HB3 . 7105 1 1726 . 1 1 141 141 LYS HG2 H 1 1.488 0.002 . 1 . . . . 141 LYS HG2 . 7105 1 1727 . 1 1 141 141 LYS HG3 H 1 1.488 0.002 . 1 . . . . 141 LYS HG3 . 7105 1 1728 . 1 1 141 141 LYS HD2 H 1 1.754 0.010 . 1 . . . . 141 LYS HD2 . 7105 1 1729 . 1 1 141 141 LYS HD3 H 1 1.754 0.010 . 1 . . . . 141 LYS HD3 . 7105 1 1730 . 1 1 141 141 LYS HE2 H 1 2.968 0.008 . 1 . . . . 141 LYS HE2 . 7105 1 1731 . 1 1 141 141 LYS HE3 H 1 2.968 0.008 . 1 . . . . 141 LYS HE3 . 7105 1 1732 . 1 1 141 141 LYS CA C 13 59.805 0.012 . 1 . . . . 141 LYS CA . 7105 1 1733 . 1 1 141 141 LYS CB C 13 32.789 0.079 . 1 . . . . 141 LYS CB . 7105 1 1734 . 1 1 141 141 LYS CG C 13 25.319 0.000 . 1 . . . . 141 LYS CG . 7105 1 1735 . 1 1 141 141 LYS CD C 13 29.809 0.047 . 1 . . . . 141 LYS CD . 7105 1 1736 . 1 1 141 141 LYS CE C 13 42.223 0.000 . 1 . . . . 141 LYS CE . 7105 1 1737 . 1 1 141 141 LYS N N 15 120.118 0.035 . 1 . . . . 141 LYS N . 7105 1 1738 . 1 1 142 142 ALA H H 1 8.457 0.002 . 1 . . . . 142 ALA H . 7105 1 1739 . 1 1 142 142 ALA HA H 1 4.003 0.000 . 1 . . . . 142 ALA HA . 7105 1 1740 . 1 1 142 142 ALA HB1 H 1 1.631 0.010 . 1 . . . . 142 ALA HB . 7105 1 1741 . 1 1 142 142 ALA HB2 H 1 1.631 0.010 . 1 . . . . 142 ALA HB . 7105 1 1742 . 1 1 142 142 ALA HB3 H 1 1.631 0.010 . 1 . . . . 142 ALA HB . 7105 1 1743 . 1 1 142 142 ALA CA C 13 55.927 0.000 . 1 . . . . 142 ALA CA . 7105 1 1744 . 1 1 142 142 ALA CB C 13 18.010 0.024 . 1 . . . . 142 ALA CB . 7105 1 1745 . 1 1 142 142 ALA N N 15 121.100 0.043 . 1 . . . . 142 ALA N . 7105 1 1746 . 1 1 143 143 ALA H H 1 8.312 0.002 . 1 . . . . 143 ALA H . 7105 1 1747 . 1 1 143 143 ALA HA H 1 4.290 0.000 . 1 . . . . 143 ALA HA . 7105 1 1748 . 1 1 143 143 ALA HB1 H 1 1.646 0.016 . 1 . . . . 143 ALA HB . 7105 1 1749 . 1 1 143 143 ALA HB2 H 1 1.646 0.016 . 1 . . . . 143 ALA HB . 7105 1 1750 . 1 1 143 143 ALA HB3 H 1 1.646 0.016 . 1 . . . . 143 ALA HB . 7105 1 1751 . 1 1 143 143 ALA CA C 13 55.496 0.000 . 1 . . . . 143 ALA CA . 7105 1 1752 . 1 1 143 143 ALA CB C 13 18.383 0.099 . 1 . . . . 143 ALA CB . 7105 1 1753 . 1 1 143 143 ALA N N 15 121.481 0.042 . 1 . . . . 143 ALA N . 7105 1 1754 . 1 1 144 144 LYS H H 1 7.844 0.002 . 1 . . . . 144 LYS H . 7105 1 1755 . 1 1 144 144 LYS HA H 1 4.255 0.003 . 1 . . . . 144 LYS HA . 7105 1 1756 . 1 1 144 144 LYS HB2 H 1 2.067 0.008 . 1 . . . . 144 LYS HB2 . 7105 1 1757 . 1 1 144 144 LYS HB3 H 1 2.067 0.008 . 1 . . . . 144 LYS HB3 . 7105 1 1758 . 1 1 144 144 LYS HG2 H 1 1.616 0.002 . 1 . . . . 144 LYS HG2 . 7105 1 1759 . 1 1 144 144 LYS HG3 H 1 1.616 0.002 . 1 . . . . 144 LYS HG3 . 7105 1 1760 . 1 1 144 144 LYS HD2 H 1 1.746 0.005 . 1 . . . . 144 LYS HD2 . 7105 1 1761 . 1 1 144 144 LYS HD3 H 1 1.746 0.005 . 1 . . . . 144 LYS HD3 . 7105 1 1762 . 1 1 144 144 LYS HE2 H 1 3.009 0.001 . 1 . . . . 144 LYS HE2 . 7105 1 1763 . 1 1 144 144 LYS HE3 H 1 3.009 0.001 . 1 . . . . 144 LYS HE3 . 7105 1 1764 . 1 1 144 144 LYS CA C 13 58.817 0.082 . 1 . . . . 144 LYS CA . 7105 1 1765 . 1 1 144 144 LYS CB C 13 31.994 0.042 . 1 . . . . 144 LYS CB . 7105 1 1766 . 1 1 144 144 LYS CG C 13 24.823 0.003 . 1 . . . . 144 LYS CG . 7105 1 1767 . 1 1 144 144 LYS CD C 13 28.796 0.000 . 1 . . . . 144 LYS CD . 7105 1 1768 . 1 1 144 144 LYS CE C 13 42.226 0.000 . 1 . . . . 144 LYS CE . 7105 1 1769 . 1 1 144 144 LYS N N 15 119.907 0.017 . 1 . . . . 144 LYS N . 7105 1 1770 . 1 1 145 145 LEU H H 1 8.166 0.005 . 1 . . . . 145 LEU H . 7105 1 1771 . 1 1 145 145 LEU HA H 1 4.252 0.008 . 1 . . . . 145 LEU HA . 7105 1 1772 . 1 1 145 145 LEU HB2 H 1 2.037 0.001 . 2 . . . . 145 LEU HB2 . 7105 1 1773 . 1 1 145 145 LEU HB3 H 1 1.504 0.005 . 2 . . . . 145 LEU HB3 . 7105 1 1774 . 1 1 145 145 LEU HG H 1 2.003 0.003 . 1 . . . . 145 LEU HG . 7105 1 1775 . 1 1 145 145 LEU HD11 H 1 0.954 0.006 . 2 . . . . 145 LEU HD1 . 7105 1 1776 . 1 1 145 145 LEU HD12 H 1 0.954 0.006 . 2 . . . . 145 LEU HD1 . 7105 1 1777 . 1 1 145 145 LEU HD13 H 1 0.954 0.006 . 2 . . . . 145 LEU HD1 . 7105 1 1778 . 1 1 145 145 LEU HD21 H 1 0.955 0.005 . 2 . . . . 145 LEU HD2 . 7105 1 1779 . 1 1 145 145 LEU HD22 H 1 0.955 0.005 . 2 . . . . 145 LEU HD2 . 7105 1 1780 . 1 1 145 145 LEU HD23 H 1 0.955 0.005 . 2 . . . . 145 LEU HD2 . 7105 1 1781 . 1 1 145 145 LEU CA C 13 57.834 0.044 . 1 . . . . 145 LEU CA . 7105 1 1782 . 1 1 145 145 LEU CB C 13 41.714 0.027 . 1 . . . . 145 LEU CB . 7105 1 1783 . 1 1 145 145 LEU CG C 13 26.808 0.000 . 1 . . . . 145 LEU CG . 7105 1 1784 . 1 1 145 145 LEU CD1 C 13 22.296 0.065 . 2 . . . . 145 LEU CD1 . 7105 1 1785 . 1 1 145 145 LEU CD2 C 13 26.312 0.000 . 2 . . . . 145 LEU CD2 . 7105 1 1786 . 1 1 145 145 LEU N N 15 119.865 0.030 . 1 . . . . 145 LEU N . 7105 1 1787 . 1 1 146 146 LYS H H 1 8.432 0.001 . 1 . . . . 146 LYS H . 7105 1 1788 . 1 1 146 146 LYS HA H 1 4.123 0.007 . 1 . . . . 146 LYS HA . 7105 1 1789 . 1 1 146 146 LYS HB2 H 1 2.166 0.000 . 2 . . . . 146 LYS HB2 . 7105 1 1790 . 1 1 146 146 LYS HB3 H 1 1.983 0.003 . 2 . . . . 146 LYS HB3 . 7105 1 1791 . 1 1 146 146 LYS HG2 H 1 1.568 0.002 . 1 . . . . 146 LYS HG2 . 7105 1 1792 . 1 1 146 146 LYS HG3 H 1 1.568 0.002 . 1 . . . . 146 LYS HG3 . 7105 1 1793 . 1 1 146 146 LYS HD2 H 1 1.736 0.014 . 1 . . . . 146 LYS HD2 . 7105 1 1794 . 1 1 146 146 LYS HD3 H 1 1.736 0.014 . 1 . . . . 146 LYS HD3 . 7105 1 1795 . 1 1 146 146 LYS HE2 H 1 2.936 0.003 . 1 . . . . 146 LYS HE2 . 7105 1 1796 . 1 1 146 146 LYS HE3 H 1 2.936 0.003 . 1 . . . . 146 LYS HE3 . 7105 1 1797 . 1 1 146 146 LYS CA C 13 60.142 0.014 . 1 . . . . 146 LYS CA . 7105 1 1798 . 1 1 146 146 LYS CB C 13 32.327 0.075 . 1 . . . . 146 LYS CB . 7105 1 1799 . 1 1 146 146 LYS CG C 13 25.310 0.022 . 1 . . . . 146 LYS CG . 7105 1 1800 . 1 1 146 146 LYS CD C 13 29.776 0.084 . 1 . . . . 146 LYS CD . 7105 1 1801 . 1 1 146 146 LYS CE C 13 42.223 0.000 . 1 . . . . 146 LYS CE . 7105 1 1802 . 1 1 146 146 LYS N N 15 123.226 0.067 . 1 . . . . 146 LYS N . 7105 1 1803 . 1 1 147 147 GLU H H 1 8.047 0.001 . 1 . . . . 147 GLU H . 7105 1 1804 . 1 1 147 147 GLU HA H 1 4.181 0.001 . 1 . . . . 147 GLU HA . 7105 1 1805 . 1 1 147 147 GLU HB2 H 1 2.251 0.007 . 1 . . . . 147 GLU HB2 . 7105 1 1806 . 1 1 147 147 GLU HB3 H 1 2.251 0.007 . 1 . . . . 147 GLU HB3 . 7105 1 1807 . 1 1 147 147 GLU HG2 H 1 2.514 0.004 . 2 . . . . 147 GLU HG2 . 7105 1 1808 . 1 1 147 147 GLU HG3 H 1 2.253 0.000 . 2 . . . . 147 GLU HG3 . 7105 1 1809 . 1 1 147 147 GLU CA C 13 59.688 0.070 . 1 . . . . 147 GLU CA . 7105 1 1810 . 1 1 147 147 GLU CB C 13 29.828 0.087 . 1 . . . . 147 GLU CB . 7105 1 1811 . 1 1 147 147 GLU CG C 13 36.770 0.046 . 1 . . . . 147 GLU CG . 7105 1 1812 . 1 1 147 147 GLU N N 15 119.784 0.070 . 1 . . . . 147 GLU N . 7105 1 1813 . 1 1 148 148 LYS H H 1 7.604 0.002 . 1 . . . . 148 LYS H . 7105 1 1814 . 1 1 148 148 LYS HA H 1 4.110 0.001 . 1 . . . . 148 LYS HA . 7105 1 1815 . 1 1 148 148 LYS HB2 H 1 1.991 0.001 . 1 . . . . 148 LYS HB2 . 7105 1 1816 . 1 1 148 148 LYS HB3 H 1 1.991 0.001 . 1 . . . . 148 LYS HB3 . 7105 1 1817 . 1 1 148 148 LYS HG2 H 1 1.576 0.001 . 1 . . . . 148 LYS HG2 . 7105 1 1818 . 1 1 148 148 LYS HG3 H 1 1.576 0.001 . 1 . . . . 148 LYS HG3 . 7105 1 1819 . 1 1 148 148 LYS HD2 H 1 1.712 0.002 . 1 . . . . 148 LYS HD2 . 7105 1 1820 . 1 1 148 148 LYS HD3 H 1 1.712 0.002 . 1 . . . . 148 LYS HD3 . 7105 1 1821 . 1 1 148 148 LYS HE2 H 1 3.094 0.004 . 1 . . . . 148 LYS HE2 . 7105 1 1822 . 1 1 148 148 LYS HE3 H 1 3.094 0.004 . 1 . . . . 148 LYS HE3 . 7105 1 1823 . 1 1 148 148 LYS CA C 13 59.447 0.032 . 1 . . . . 148 LYS CA . 7105 1 1824 . 1 1 148 148 LYS CB C 13 32.777 0.036 . 1 . . . . 148 LYS CB . 7105 1 1825 . 1 1 148 148 LYS CG C 13 24.954 0.003 . 1 . . . . 148 LYS CG . 7105 1 1826 . 1 1 148 148 LYS CD C 13 29.859 0.004 . 1 . . . . 148 LYS CD . 7105 1 1827 . 1 1 148 148 LYS CE C 13 42.709 0.020 . 1 . . . . 148 LYS CE . 7105 1 1828 . 1 1 148 148 LYS N N 15 119.574 0.049 . 1 . . . . 148 LYS N . 7105 1 1829 . 1 1 149 149 TYR H H 1 8.083 0.005 . 1 . . . . 149 TYR H . 7105 1 1830 . 1 1 149 149 TYR HA H 1 4.425 0.000 . 1 . . . . 149 TYR HA . 7105 1 1831 . 1 1 149 149 TYR HB2 H 1 3.279 0.000 . 1 . . . . 149 TYR HB2 . 7105 1 1832 . 1 1 149 149 TYR HB3 H 1 3.279 0.000 . 1 . . . . 149 TYR HB3 . 7105 1 1833 . 1 1 149 149 TYR HD1 H 1 7.094 0.007 . 1 . . . . 149 TYR HD . 7105 1 1834 . 1 1 149 149 TYR HD2 H 1 7.094 0.007 . 1 . . . . 149 TYR HD . 7105 1 1835 . 1 1 149 149 TYR HE1 H 1 6.642 0.007 . 1 . . . . 149 TYR HE . 7105 1 1836 . 1 1 149 149 TYR HE2 H 1 6.642 0.007 . 1 . . . . 149 TYR HE . 7105 1 1837 . 1 1 149 149 TYR CA C 13 61.372 0.000 . 1 . . . . 149 TYR CA . 7105 1 1838 . 1 1 149 149 TYR CB C 13 38.611 0.060 . 1 . . . . 149 TYR CB . 7105 1 1839 . 1 1 149 149 TYR CD1 C 13 133.751 0.060 . 1 . . . . 149 TYR CD . 7105 1 1840 . 1 1 149 149 TYR CD2 C 13 133.751 0.060 . 1 . . . . 149 TYR CD . 7105 1 1841 . 1 1 149 149 TYR CE1 C 13 118.194 0.082 . 1 . . . . 149 TYR CE . 7105 1 1842 . 1 1 149 149 TYR CE2 C 13 118.194 0.082 . 1 . . . . 149 TYR CE . 7105 1 1843 . 1 1 149 149 TYR N N 15 120.291 0.056 . 1 . . . . 149 TYR N . 7105 1 1844 . 1 1 150 150 GLU H H 1 8.523 0.004 . 1 . . . . 150 GLU H . 7105 1 1845 . 1 1 150 150 GLU HA H 1 3.774 0.004 . 1 . . . . 150 GLU HA . 7105 1 1846 . 1 1 150 150 GLU HB2 H 1 2.261 0.003 . 2 . . . . 150 GLU HB2 . 7105 1 1847 . 1 1 150 150 GLU HB3 H 1 2.060 0.000 . 2 . . . . 150 GLU HB3 . 7105 1 1848 . 1 1 150 150 GLU HG2 H 1 2.695 0.002 . 2 . . . . 150 GLU HG2 . 7105 1 1849 . 1 1 150 150 GLU HG3 H 1 2.400 0.003 . 2 . . . . 150 GLU HG3 . 7105 1 1850 . 1 1 150 150 GLU CA C 13 59.609 0.056 . 1 . . . . 150 GLU CA . 7105 1 1851 . 1 1 150 150 GLU CB C 13 29.311 0.033 . 1 . . . . 150 GLU CB . 7105 1 1852 . 1 1 150 150 GLU CG C 13 37.225 0.046 . 1 . . . . 150 GLU CG . 7105 1 1853 . 1 1 150 150 GLU N N 15 117.509 0.034 . 1 . . . . 150 GLU N . 7105 1 1854 . 1 1 151 151 LYS H H 1 7.594 0.004 . 1 . . . . 151 LYS H . 7105 1 1855 . 1 1 151 151 LYS HA H 1 4.138 0.000 . 1 . . . . 151 LYS HA . 7105 1 1856 . 1 1 151 151 LYS HB2 H 1 2.042 0.009 . 1 . . . . 151 LYS HB2 . 7105 1 1857 . 1 1 151 151 LYS HB3 H 1 2.042 0.009 . 1 . . . . 151 LYS HB3 . 7105 1 1858 . 1 1 151 151 LYS HG2 H 1 1.538 0.000 . 2 . . . . 151 LYS HG2 . 7105 1 1859 . 1 1 151 151 LYS HG3 H 1 1.676 0.000 . 2 . . . . 151 LYS HG3 . 7105 1 1860 . 1 1 151 151 LYS HD2 H 1 1.698 0.005 . 1 . . . . 151 LYS HD2 . 7105 1 1861 . 1 1 151 151 LYS HD3 H 1 1.698 0.005 . 1 . . . . 151 LYS HD3 . 7105 1 1862 . 1 1 151 151 LYS HE2 H 1 3.091 0.009 . 1 . . . . 151 LYS HE2 . 7105 1 1863 . 1 1 151 151 LYS HE3 H 1 3.091 0.009 . 1 . . . . 151 LYS HE3 . 7105 1 1864 . 1 1 151 151 LYS CA C 13 59.406 0.045 . 1 . . . . 151 LYS CA . 7105 1 1865 . 1 1 151 151 LYS CB C 13 32.608 0.071 . 1 . . . . 151 LYS CB . 7105 1 1866 . 1 1 151 151 LYS CG C 13 25.339 0.033 . 1 . . . . 151 LYS CG . 7105 1 1867 . 1 1 151 151 LYS CD C 13 29.294 0.002 . 1 . . . . 151 LYS CD . 7105 1 1868 . 1 1 151 151 LYS CE C 13 42.221 0.000 . 1 . . . . 151 LYS CE . 7105 1 1869 . 1 1 151 151 LYS N N 15 119.328 0.076 . 1 . . . . 151 LYS N . 7105 1 1870 . 1 1 152 152 ASP H H 1 8.782 0.005 . 1 . . . . 152 ASP H . 7105 1 1871 . 1 1 152 152 ASP HA H 1 4.477 0.003 . 1 . . . . 152 ASP HA . 7105 1 1872 . 1 1 152 152 ASP HB2 H 1 2.846 0.007 . 2 . . . . 152 ASP HB2 . 7105 1 1873 . 1 1 152 152 ASP HB3 H 1 2.484 0.000 . 2 . . . . 152 ASP HB3 . 7105 1 1874 . 1 1 152 152 ASP CA C 13 57.490 0.000 . 1 . . . . 152 ASP CA . 7105 1 1875 . 1 1 152 152 ASP CB C 13 40.082 0.034 . 1 . . . . 152 ASP CB . 7105 1 1876 . 1 1 152 152 ASP N N 15 122.701 0.073 . 1 . . . . 152 ASP N . 7105 1 1877 . 1 1 153 153 ILE H H 1 9.119 0.011 . 1 . . . . 153 ILE H . 7105 1 1878 . 1 1 153 153 ILE HA H 1 4.031 0.007 . 1 . . . . 153 ILE HA . 7105 1 1879 . 1 1 153 153 ILE HB H 1 1.441 0.003 . 1 . . . . 153 ILE HB . 7105 1 1880 . 1 1 153 153 ILE HG12 H 1 1.151 0.005 . 2 . . . . 153 ILE HG12 . 7105 1 1881 . 1 1 153 153 ILE HG13 H 1 1.135 0.007 . 2 . . . . 153 ILE HG13 . 7105 1 1882 . 1 1 153 153 ILE HG21 H 1 0.769 0.008 . 1 . . . . 153 ILE HG2 . 7105 1 1883 . 1 1 153 153 ILE HG22 H 1 0.769 0.008 . 1 . . . . 153 ILE HG2 . 7105 1 1884 . 1 1 153 153 ILE HG23 H 1 0.769 0.008 . 1 . . . . 153 ILE HG2 . 7105 1 1885 . 1 1 153 153 ILE HD11 H 1 0.776 0.005 . 1 . . . . 153 ILE HD1 . 7105 1 1886 . 1 1 153 153 ILE HD12 H 1 0.776 0.005 . 1 . . . . 153 ILE HD1 . 7105 1 1887 . 1 1 153 153 ILE HD13 H 1 0.776 0.005 . 1 . . . . 153 ILE HD1 . 7105 1 1888 . 1 1 153 153 ILE CA C 13 62.116 0.008 . 1 . . . . 153 ILE CA . 7105 1 1889 . 1 1 153 153 ILE CB C 13 37.257 0.015 . 1 . . . . 153 ILE CB . 7105 1 1890 . 1 1 153 153 ILE CG1 C 13 28.301 0.000 . 1 . . . . 153 ILE CG1 . 7105 1 1891 . 1 1 153 153 ILE CG2 C 13 18.379 0.049 . 1 . . . . 153 ILE CG2 . 7105 1 1892 . 1 1 153 153 ILE CD1 C 13 12.884 0.003 . 1 . . . . 153 ILE CD1 . 7105 1 1893 . 1 1 153 153 ILE N N 15 121.861 0.037 . 1 . . . . 153 ILE N . 7105 1 1894 . 1 1 154 154 ALA H H 1 7.325 0.004 . 1 . . . . 154 ALA H . 7105 1 1895 . 1 1 154 154 ALA HA H 1 4.163 0.000 . 1 . . . . 154 ALA HA . 7105 1 1896 . 1 1 154 154 ALA HB1 H 1 1.544 0.018 . 1 . . . . 154 ALA HB . 7105 1 1897 . 1 1 154 154 ALA HB2 H 1 1.544 0.018 . 1 . . . . 154 ALA HB . 7105 1 1898 . 1 1 154 154 ALA HB3 H 1 1.544 0.018 . 1 . . . . 154 ALA HB . 7105 1 1899 . 1 1 154 154 ALA CA C 13 55.039 0.000 . 1 . . . . 154 ALA CA . 7105 1 1900 . 1 1 154 154 ALA CB C 13 18.123 0.054 . 1 . . . . 154 ALA CB . 7105 1 1901 . 1 1 154 154 ALA N N 15 124.163 0.017 . 1 . . . . 154 ALA N . 7105 1 1902 . 1 1 155 155 ALA H H 1 7.653 0.004 . 1 . . . . 155 ALA H . 7105 1 1903 . 1 1 155 155 ALA HA H 1 4.234 0.001 . 1 . . . . 155 ALA HA . 7105 1 1904 . 1 1 155 155 ALA HB1 H 1 1.514 0.008 . 1 . . . . 155 ALA HB . 7105 1 1905 . 1 1 155 155 ALA HB2 H 1 1.514 0.008 . 1 . . . . 155 ALA HB . 7105 1 1906 . 1 1 155 155 ALA HB3 H 1 1.514 0.008 . 1 . . . . 155 ALA HB . 7105 1 1907 . 1 1 155 155 ALA CA C 13 54.254 0.000 . 1 . . . . 155 ALA CA . 7105 1 1908 . 1 1 155 155 ALA CB C 13 18.625 0.045 . 1 . . . . 155 ALA CB . 7105 1 1909 . 1 1 155 155 ALA N N 15 118.986 0.073 . 1 . . . . 155 ALA N . 7105 1 1910 . 1 1 156 156 TYR H H 1 8.041 0.005 . 1 . . . . 156 TYR H . 7105 1 1911 . 1 1 156 156 TYR HA H 1 4.287 0.000 . 1 . . . . 156 TYR HA . 7105 1 1912 . 1 1 156 156 TYR HB2 H 1 3.209 0.001 . 2 . . . . 156 TYR HB2 . 7105 1 1913 . 1 1 156 156 TYR HB3 H 1 3.118 0.001 . 2 . . . . 156 TYR HB3 . 7105 1 1914 . 1 1 156 156 TYR HD1 H 1 7.118 0.005 . 1 . . . . 156 TYR HD . 7105 1 1915 . 1 1 156 156 TYR HD2 H 1 7.118 0.005 . 1 . . . . 156 TYR HD . 7105 1 1916 . 1 1 156 156 TYR HE1 H 1 6.815 0.012 . 1 . . . . 156 TYR HE . 7105 1 1917 . 1 1 156 156 TYR HE2 H 1 6.815 0.012 . 1 . . . . 156 TYR HE . 7105 1 1918 . 1 1 156 156 TYR CA C 13 60.421 0.000 . 1 . . . . 156 TYR CA . 7105 1 1919 . 1 1 156 156 TYR CB C 13 39.221 0.025 . 1 . . . . 156 TYR CB . 7105 1 1920 . 1 1 156 156 TYR CD1 C 13 133.183 0.019 . 1 . . . . 156 TYR CD . 7105 1 1921 . 1 1 156 156 TYR CD2 C 13 133.183 0.019 . 1 . . . . 156 TYR CD . 7105 1 1922 . 1 1 156 156 TYR CE1 C 13 118.375 0.060 . 1 . . . . 156 TYR CE . 7105 1 1923 . 1 1 156 156 TYR CE2 C 13 118.375 0.060 . 1 . . . . 156 TYR CE . 7105 1 1924 . 1 1 156 156 TYR N N 15 119.496 0.018 . 1 . . . . 156 TYR N . 7105 1 1925 . 1 1 157 157 ARG H H 1 7.977 0.003 . 1 . . . . 157 ARG H . 7105 1 1926 . 1 1 157 157 ARG HA H 1 4.123 0.004 . 1 . . . . 157 ARG HA . 7105 1 1927 . 1 1 157 157 ARG HB2 H 1 1.950 0.005 . 2 . . . . 157 ARG HB2 . 7105 1 1928 . 1 1 157 157 ARG HB3 H 1 1.795 0.001 . 2 . . . . 157 ARG HB3 . 7105 1 1929 . 1 1 157 157 ARG HG2 H 1 1.711 0.002 . 2 . . . . 157 ARG HG2 . 7105 1 1930 . 1 1 157 157 ARG HG3 H 1 1.616 0.005 . 2 . . . . 157 ARG HG3 . 7105 1 1931 . 1 1 157 157 ARG HD2 H 1 3.191 0.003 . 1 . . . . 157 ARG HD2 . 7105 1 1932 . 1 1 157 157 ARG HD3 H 1 3.191 0.003 . 1 . . . . 157 ARG HD3 . 7105 1 1933 . 1 1 157 157 ARG CA C 13 57.017 0.000 . 1 . . . . 157 ARG CA . 7105 1 1934 . 1 1 157 157 ARG CB C 13 30.961 0.002 . 1 . . . . 157 ARG CB . 7105 1 1935 . 1 1 157 157 ARG CG C 13 28.307 0.004 . 1 . . . . 157 ARG CG . 7105 1 1936 . 1 1 157 157 ARG CD C 13 43.715 0.000 . 1 . . . . 157 ARG CD . 7105 1 1937 . 1 1 157 157 ARG N N 15 117.594 0.026 . 1 . . . . 157 ARG N . 7105 1 1938 . 1 1 158 158 ALA H H 1 7.492 0.003 . 1 . . . . 158 ALA H . 7105 1 1939 . 1 1 158 158 ALA HA H 1 4.309 0.005 . 1 . . . . 158 ALA HA . 7105 1 1940 . 1 1 158 158 ALA HB1 H 1 1.440 0.014 . 1 . . . . 158 ALA HB . 7105 1 1941 . 1 1 158 158 ALA HB2 H 1 1.440 0.014 . 1 . . . . 158 ALA HB . 7105 1 1942 . 1 1 158 158 ALA HB3 H 1 1.440 0.014 . 1 . . . . 158 ALA HB . 7105 1 1943 . 1 1 158 158 ALA CA C 13 52.719 0.007 . 1 . . . . 158 ALA CA . 7105 1 1944 . 1 1 158 158 ALA CB C 13 19.215 0.080 . 1 . . . . 158 ALA CB . 7105 1 1945 . 1 1 158 158 ALA N N 15 122.909 0.014 . 1 . . . . 158 ALA N . 7105 1 1946 . 1 1 159 159 LYS H H 1 7.527 0.002 . 1 . . . . 159 LYS H . 7105 1 1947 . 1 1 159 159 LYS HA H 1 4.116 0.004 . 1 . . . . 159 LYS HA . 7105 1 1948 . 1 1 159 159 LYS HB2 H 1 1.791 0.003 . 2 . . . . 159 LYS HB2 . 7105 1 1949 . 1 1 159 159 LYS HB3 H 1 1.720 0.001 . 2 . . . . 159 LYS HB3 . 7105 1 1950 . 1 1 159 159 LYS HG2 H 1 1.415 0.002 . 1 . . . . 159 LYS HG2 . 7105 1 1951 . 1 1 159 159 LYS HG3 H 1 1.415 0.002 . 1 . . . . 159 LYS HG3 . 7105 1 1952 . 1 1 159 159 LYS HD2 H 1 1.669 0.001 . 1 . . . . 159 LYS HD2 . 7105 1 1953 . 1 1 159 159 LYS HD3 H 1 1.669 0.001 . 1 . . . . 159 LYS HD3 . 7105 1 1954 . 1 1 159 159 LYS HE2 H 1 2.981 0.000 . 2 . . . . 159 LYS HE2 . 7105 1 1955 . 1 1 159 159 LYS HE3 H 1 2.982 0.000 . 2 . . . . 159 LYS HE3 . 7105 1 1956 . 1 1 159 159 LYS CA C 13 58.053 0.011 . 1 . . . . 159 LYS CA . 7105 1 1957 . 1 1 159 159 LYS CB C 13 33.768 0.003 . 1 . . . . 159 LYS CB . 7105 1 1958 . 1 1 159 159 LYS CG C 13 24.820 0.000 . 1 . . . . 159 LYS CG . 7105 1 1959 . 1 1 159 159 LYS CD C 13 29.294 0.000 . 1 . . . . 159 LYS CD . 7105 1 1960 . 1 1 159 159 LYS CE C 13 42.224 0.000 . 1 . . . . 159 LYS CE . 7105 1 1961 . 1 1 159 159 LYS N N 15 124.926 0.000 . 1 . . . . 159 LYS N . 7105 1 1962 . 2 2 1 1 DG H8 H 1 7.716 0.000 . 1 . . . . 1 G H8 . 7105 1 1963 . 2 2 1 1 DG H1' H 1 5.734 0.003 . 1 . . . . 1 G H1' . 7105 1 1964 . 2 2 1 1 DG H2' H 1 2.322 0.001 . 1 . . . . 1 G H2' . 7105 1 1965 . 2 2 1 1 DG H3' H 1 4.743 0.001 . 1 . . . . 1 G H3' . 7105 1 1966 . 2 2 1 1 DG H4' H 1 4.113 0.001 . 1 . . . . 1 G H4' . 7105 1 1967 . 2 2 1 1 DG H5' H 1 4.055 0.000 . 1 . . . . 1 G H5' . 7105 1 1968 . 2 2 1 1 DG H2'' H 1 2.322 0.001 . 1 . . . . 1 G H2'' . 7105 1 1969 . 2 2 1 1 DG H5'' H 1 3.633 0.005 . 1 . . . . 1 G H5'' . 7105 1 1970 . 2 2 2 2 DG H8 H 1 7.865 0.002 . 1 . . . . 2 G H8 . 7105 1 1971 . 2 2 2 2 DG H1' H 1 5.535 0.005 . 1 . . . . 2 G H1' . 7105 1 1972 . 2 2 2 2 DG H2' H 1 2.596 0.006 . 1 . . . . 2 G H2' . 7105 1 1973 . 2 2 2 2 DG H3' H 1 4.952 0.002 . 1 . . . . 2 G H3' . 7105 1 1974 . 2 2 2 2 DG H4' H 1 4.214 0.013 . 1 . . . . 2 G H4' . 7105 1 1975 . 2 2 2 2 DG H5' H 1 3.951 0.006 . 1 . . . . 2 G H5' . 7105 1 1976 . 2 2 2 2 DG H2'' H 1 2.649 0.025 . 1 . . . . 2 G H2'' . 7105 1 1977 . 2 2 2 2 DG H5'' H 1 4.114 0.000 . 1 . . . . 2 G H5'' . 7105 1 1978 . 2 2 3 3 DG H1 H 1 12.650 0.000 . 1 . . . . 3 G H1 . 7105 1 1979 . 2 2 3 3 DG H8 H 1 7.823 0.003 . 1 . . . . 3 G H8 . 7105 1 1980 . 2 2 3 3 DG H21 H 1 6.116 0.000 . 1 . . . . 3 G H21 . 7105 1 1981 . 2 2 3 3 DG H22 H 1 6.116 0.000 . 1 . . . . 3 G H22 . 7105 1 1982 . 2 2 3 3 DG H1' H 1 5.760 0.004 . 1 . . . . 3 G H1' . 7105 1 1983 . 2 2 3 3 DG H2' H 1 2.563 0.001 . 1 . . . . 3 G H2' . 7105 1 1984 . 2 2 3 3 DG H3' H 1 5.014 0.003 . 1 . . . . 3 G H3' . 7105 1 1985 . 2 2 3 3 DG H4' H 1 4.204 0.014 . 1 . . . . 3 G H4' . 7105 1 1986 . 2 2 3 3 DG H5' H 1 3.948 0.007 . 1 . . . . 3 G H5' . 7105 1 1987 . 2 2 3 3 DG H2'' H 1 2.640 0.001 . 1 . . . . 3 G H2'' . 7105 1 1988 . 2 2 3 3 DG H5'' H 1 4.183 0.022 . 1 . . . . 3 G H5'' . 7105 1 1989 . 2 2 4 4 DA H2 H 1 7.841 0.000 . 1 . . . . 4 A H2 . 7105 1 1990 . 2 2 4 4 DA H8 H 1 8.174 0.002 . 1 . . . . 4 A H8 . 7105 1 1991 . 2 2 4 4 DA H1' H 1 6.080 0.011 . 1 . . . . 4 A H1' . 7105 1 1992 . 2 2 4 4 DA H2' H 1 2.498 0.003 . 1 . . . . 4 A H2' . 7105 1 1993 . 2 2 4 4 DA H3' H 1 4.939 0.005 . 1 . . . . 4 A H3' . 7105 1 1994 . 2 2 4 4 DA H4' H 1 4.204 0.014 . 1 . . . . 4 A H4' . 7105 1 1995 . 2 2 4 4 DA H5' H 1 4.061 0.000 . 1 . . . . 4 A H5' . 7105 1 1996 . 2 2 4 4 DA H2'' H 1 2.792 0.005 . 1 . . . . 4 A H2'' . 7105 1 1997 . 2 2 4 4 DA H5'' H 1 4.061 0.000 . 1 . . . . 4 A H5'' . 7105 1 1998 . 2 2 5 5 DT H3 H 1 13.384 0.000 . 1 . . . . 5 T H3 . 7105 1 1999 . 2 2 5 5 DT H6 H 1 7.140 0.002 . 1 . . . . 5 T H6 . 7105 1 2000 . 2 2 5 5 DT H71 H 1 1.317 0.002 . 1 . . . . 5 T H7 . 7105 1 2001 . 2 2 5 5 DT H72 H 1 1.317 0.002 . 1 . . . . 5 T H7 . 7105 1 2002 . 2 2 5 5 DT H73 H 1 1.317 0.002 . 1 . . . . 5 T H7 . 7105 1 2003 . 2 2 5 5 DT H1' H 1 5.880 0.006 . 1 . . . . 5 T H1' . 7105 1 2004 . 2 2 5 5 DT H2' H 1 2.081 0.003 . 1 . . . . 5 T H2' . 7105 1 2005 . 2 2 5 5 DT H3' H 1 4.832 0.005 . 1 . . . . 5 T H3' . 7105 1 2006 . 2 2 5 5 DT H4' H 1 4.117 0.020 . 1 . . . . 5 T H4' . 7105 1 2007 . 2 2 5 5 DT H5' H 1 4.040 0.029 . 1 . . . . 5 T H5' . 7105 1 2008 . 2 2 5 5 DT H2'' H 1 2.429 0.003 . 1 . . . . 5 T H2'' . 7105 1 2009 . 2 2 5 5 DT H5'' H 1 4.028 0.023 . 1 . . . . 5 T H5'' . 7105 1 2010 . 2 2 6 6 DC H5 H 1 5.550 0.008 . 1 . . . . 6 C H5 . 7105 1 2011 . 2 2 6 6 DC H6 H 1 7.501 0.002 . 1 . . . . 6 C H6 . 7105 1 2012 . 2 2 6 6 DC H41 H 1 6.809 0.003 . 1 . . . . 6 C H41 . 7105 1 2013 . 2 2 6 6 DC H42 H 1 8.188 0.008 . 1 . . . . 6 C H42 . 7105 1 2014 . 2 2 6 6 DC H1' H 1 5.867 0.003 . 1 . . . . 6 C H1' . 7105 1 2015 . 2 2 6 6 DC H2' H 1 2.016 0.003 . 1 . . . . 6 C H2' . 7105 1 2016 . 2 2 6 6 DC H4' H 1 4.125 0.000 . 1 . . . . 6 C H4' . 7105 1 2017 . 2 2 6 6 DC H5' H 1 4.036 0.024 . 1 . . . . 6 C H5' . 7105 1 2018 . 2 2 6 6 DC H2'' H 1 2.382 0.005 . 1 . . . . 6 C H2'' . 7105 1 2019 . 2 2 6 6 DC H5'' H 1 3.979 0.023 . 1 . . . . 6 C H5'' . 7105 1 2020 . 2 2 7 7 DT H3 H 1 13.546 0.053 . 1 . . . . 7 T H3 . 7105 1 2021 . 2 2 7 7 DT H6 H 1 7.332 0.003 . 1 . . . . 7 T H6 . 7105 1 2022 . 2 2 7 7 DT H71 H 1 1.660 0.005 . 1 . . . . 7 T H7 . 7105 1 2023 . 2 2 7 7 DT H72 H 1 1.660 0.005 . 1 . . . . 7 T H7 . 7105 1 2024 . 2 2 7 7 DT H73 H 1 1.660 0.005 . 1 . . . . 7 T H7 . 7105 1 2025 . 2 2 7 7 DT H1' H 1 5.382 0.003 . 1 . . . . 7 T H1' . 7105 1 2026 . 2 2 7 7 DT H2' H 1 2.123 0.000 . 1 . . . . 7 T H2' . 7105 1 2027 . 2 2 7 7 DT H3' H 1 4.845 0.002 . 1 . . . . 7 T H3' . 7105 1 2028 . 2 2 7 7 DT H4' H 1 4.051 0.031 . 1 . . . . 7 T H4' . 7105 1 2029 . 2 2 7 7 DT H5' H 1 4.025 0.010 . 1 . . . . 7 T H5' . 7105 1 2030 . 2 2 7 7 DT H2'' H 1 2.322 0.004 . 1 . . . . 7 T H2'' . 7105 1 2031 . 2 2 7 7 DT H5'' H 1 3.969 0.031 . 1 . . . . 7 T H5'' . 7105 1 2032 . 2 2 8 8 DA H2 H 1 6.868 0.013 . 1 . . . . 8 A H2 . 7105 1 2033 . 2 2 8 8 DA H8 H 1 8.219 0.003 . 1 . . . . 8 A H8 . 7105 1 2034 . 2 2 8 8 DA H1' H 1 5.850 0.004 . 1 . . . . 8 A H1' . 7105 1 2035 . 2 2 8 8 DA H2' H 1 2.746 0.005 . 1 . . . . 8 A H2' . 7105 1 2036 . 2 2 8 8 DA H3' H 1 5.056 0.000 . 1 . . . . 8 A H3' . 7105 1 2037 . 2 2 8 8 DA H4' H 1 4.320 0.009 . 1 . . . . 8 A H4' . 7105 1 2038 . 2 2 8 8 DA H5' H 1 3.973 0.030 . 1 . . . . 8 A H5' . 7105 1 2039 . 2 2 8 8 DA H2'' H 1 2.861 0.003 . 1 . . . . 8 A H2'' . 7105 1 2040 . 2 2 8 8 DA H5'' H 1 3.988 0.040 . 1 . . . . 8 A H5'' . 7105 1 2041 . 2 2 9 9 DA H2 H 1 7.069 0.006 . 1 . . . . 9 A H2 . 7105 1 2042 . 2 2 9 9 DA H8 H 1 8.145 0.002 . 1 . . . . 9 A H8 . 7105 1 2043 . 2 2 9 9 DA H1' H 1 5.845 0.004 . 1 . . . . 9 A H1' . 7105 1 2044 . 2 2 9 9 DA H2' H 1 2.654 0.002 . 1 . . . . 9 A H2' . 7105 1 2045 . 2 2 9 9 DA H3' H 1 5.037 0.003 . 1 . . . . 9 A H3' . 7105 1 2046 . 2 2 9 9 DA H4' H 1 4.395 0.016 . 1 . . . . 9 A H4' . 7105 1 2047 . 2 2 9 9 DA H5' H 1 4.268 0.032 . 1 . . . . 9 A H5' . 7105 1 2048 . 2 2 9 9 DA H2'' H 1 2.872 0.001 . 1 . . . . 9 A H2'' . 7105 1 2049 . 2 2 9 9 DA H5'' H 1 4.203 0.011 . 1 . . . . 9 A H5'' . 7105 1 2050 . 2 2 10 10 DA H2 H 1 7.765 0.008 . 1 . . . . 10 A H2 . 7105 1 2051 . 2 2 10 10 DA H8 H 1 8.243 0.004 . 1 . . . . 10 A H8 . 7105 1 2052 . 2 2 10 10 DA H1' H 1 5.523 0.004 . 1 . . . . 10 A H1' . 7105 1 2053 . 2 2 10 10 DA H2' H 1 2.567 0.001 . 1 . . . . 10 A H2' . 7105 1 2054 . 2 2 10 10 DA H3' H 1 5.060 0.014 . 1 . . . . 10 A H3' . 7105 1 2055 . 2 2 10 10 DA H4' H 1 4.397 0.019 . 1 . . . . 10 A H4' . 7105 1 2056 . 2 2 10 10 DA H5' H 1 4.353 0.034 . 1 . . . . 10 A H5' . 7105 1 2057 . 2 2 10 10 DA H2'' H 1 2.784 0.002 . 1 . . . . 10 A H2'' . 7105 1 2058 . 2 2 10 10 DA H5'' H 1 4.202 0.010 . 1 . . . . 10 A H5'' . 7105 1 2059 . 2 2 11 11 DC H5 H 1 5.415 0.002 . 1 . . . . 11 C H5 . 7105 1 2060 . 2 2 11 11 DC H6 H 1 7.362 0.002 . 1 . . . . 11 C H6 . 7105 1 2061 . 2 2 11 11 DC H41 H 1 6.516 0.009 . 1 . . . . 11 C H41 . 7105 1 2062 . 2 2 11 11 DC H42 H 1 8.123 0.002 . 1 . . . . 11 C H42 . 7105 1 2063 . 2 2 11 11 DC H1' H 1 5.420 0.000 . 1 . . . . 11 C H1' . 7105 1 2064 . 2 2 11 11 DC H2' H 1 1.978 0.000 . 1 . . . . 11 C H2' . 7105 1 2065 . 2 2 11 11 DC H3' H 1 5.019 0.013 . 1 . . . . 11 C H3' . 7105 1 2066 . 2 2 11 11 DC H4' H 1 4.195 0.009 . 1 . . . . 11 C H4' . 7105 1 2067 . 2 2 11 11 DC H2'' H 1 2.182 0.000 . 1 . . . . 11 C H2'' . 7105 1 2068 . 2 2 12 12 DA H2 H 1 7.579 0.012 . 1 . . . . 12 A H2 . 7105 1 2069 . 2 2 12 12 DA H8 H 1 8.285 0.004 . 1 . . . . 12 A H8 . 7105 1 2070 . 2 2 12 12 DA H62 H 1 6.277 0.000 . 1 . . . . 12 A H62 . 7105 1 2071 . 2 2 12 12 DA H1' H 1 5.984 0.005 . 1 . . . . 12 A H1' . 7105 1 2072 . 2 2 12 12 DA H2' H 1 1.639 0.000 . 1 . . . . 12 A H2' . 7105 1 2073 . 2 2 12 12 DA H3' H 1 4.745 0.004 . 1 . . . . 12 A H3' . 7105 1 2074 . 2 2 12 12 DA H4' H 1 4.455 0.000 . 1 . . . . 12 A H4' . 7105 1 2075 . 2 2 12 12 DA H5' H 1 4.121 0.033 . 1 . . . . 12 A H5' . 7105 1 2076 . 2 2 12 12 DA H2'' H 1 2.080 0.002 . 1 . . . . 12 A H2'' . 7105 1 2077 . 2 2 12 12 DA H5'' H 1 4.121 0.033 . 1 . . . . 12 A H5'' . 7105 1 2078 . 2 2 13 13 DA H2 H 1 7.641 0.027 . 1 . . . . 13 A H2 . 7105 1 2079 . 2 2 13 13 DA H8 H 1 8.287 0.002 . 1 . . . . 13 A H8 . 7105 1 2080 . 2 2 13 13 DA H61 H 1 6.071 0.014 . 1 . . . . 13 A H61 . 7105 1 2081 . 2 2 13 13 DA H62 H 1 7.942 0.007 . 1 . . . . 13 A H62 . 7105 1 2082 . 2 2 13 13 DA H1' H 1 5.960 0.007 . 1 . . . . 13 A H1' . 7105 1 2083 . 2 2 13 13 DA H2' H 1 2.521 0.003 . 1 . . . . 13 A H2' . 7105 1 2084 . 2 2 13 13 DA H3' H 1 4.955 0.001 . 1 . . . . 13 A H3' . 7105 1 2085 . 2 2 13 13 DA H4' H 1 4.385 0.013 . 1 . . . . 13 A H4' . 7105 1 2086 . 2 2 13 13 DA H5' H 1 3.449 0.000 . 1 . . . . 13 A H5' . 7105 1 2087 . 2 2 13 13 DA H2'' H 1 2.880 0.005 . 1 . . . . 13 A H2'' . 7105 1 2088 . 2 2 13 13 DA H5'' H 1 4.117 0.020 . 1 . . . . 13 A H5'' . 7105 1 2089 . 2 2 14 14 DT H3 H 1 13.368 0.002 . 1 . . . . 14 T H3 . 7105 1 2090 . 2 2 14 14 DT H6 H 1 6.893 0.002 . 1 . . . . 14 T H6 . 7105 1 2091 . 2 2 14 14 DT H71 H 1 1.581 0.001 . 1 . . . . 14 T H7 . 7105 1 2092 . 2 2 14 14 DT H72 H 1 1.581 0.001 . 1 . . . . 14 T H7 . 7105 1 2093 . 2 2 14 14 DT H73 H 1 1.581 0.001 . 1 . . . . 14 T H7 . 7105 1 2094 . 2 2 14 14 DT H1' H 1 5.644 0.002 . 1 . . . . 14 T H1' . 7105 1 2095 . 2 2 14 14 DT H2' H 1 1.628 0.011 . 1 . . . . 14 T H2' . 7105 1 2096 . 2 2 14 14 DT H3' H 1 4.795 0.002 . 1 . . . . 14 T H3' . 7105 1 2097 . 2 2 14 14 DT H4' H 1 4.118 0.011 . 1 . . . . 14 T H4' . 7105 1 2098 . 2 2 14 14 DT H5' H 1 4.120 0.011 . 1 . . . . 14 T H5' . 7105 1 2099 . 2 2 14 14 DT H2'' H 1 1.917 0.004 . 1 . . . . 14 T H2'' . 7105 1 2100 . 2 2 14 14 DT H5'' H 1 3.743 0.002 . 1 . . . . 14 T H5'' . 7105 1 2101 . 2 2 15 15 DG H8 H 1 7.871 0.002 . 1 . . . . 15 G H8 . 7105 1 2102 . 2 2 15 15 DG H1' H 1 5.788 0.004 . 1 . . . . 15 G H1' . 7105 1 2103 . 2 2 15 15 DG H2' H 1 2.577 0.001 . 1 . . . . 15 G H2' . 7105 1 2104 . 2 2 15 15 DG H3' H 1 4.933 0.000 . 1 . . . . 15 G H3' . 7105 1 2105 . 2 2 15 15 DG H4' H 1 4.129 0.019 . 1 . . . . 15 G H4' . 7105 1 2106 . 2 2 15 15 DG H5' H 1 3.782 0.000 . 1 . . . . 15 G H5' . 7105 1 2107 . 2 2 15 15 DG H2'' H 1 2.650 0.000 . 1 . . . . 15 G H2'' . 7105 1 2108 . 2 2 15 15 DG H5'' H 1 4.077 0.026 . 1 . . . . 15 G H5'' . 7105 1 2109 . 2 2 16 16 DC H5 H 1 5.767 0.013 . 1 . . . . 16 C H5 . 7105 1 2110 . 2 2 16 16 DC H6 H 1 7.683 0.002 . 1 . . . . 16 C H6 . 7105 1 2111 . 2 2 16 16 DC H1' H 1 6.286 0.001 . 1 . . . . 16 C H1' . 7105 1 2112 . 2 2 16 16 DC H2' H 1 2.226 0.004 . 1 . . . . 16 C H2' . 7105 1 2113 . 2 2 16 16 DC H3' H 1 4.497 0.002 . 1 . . . . 16 C H3' . 7105 1 2114 . 2 2 16 16 DC H4' H 1 4.165 0.001 . 1 . . . . 16 C H4' . 7105 1 2115 . 2 2 16 16 DC H5' H 1 4.046 0.003 . 1 . . . . 16 C H5' . 7105 1 2116 . 2 2 16 16 DC H2'' H 1 2.327 0.002 . 1 . . . . 16 C H2'' . 7105 1 2117 . 2 2 16 16 DC H5'' H 1 4.046 0.003 . 1 . . . . 16 C H5'' . 7105 1 2118 . 3 3 1 1 DG H8 H 1 7.897 0.004 . 1 . . . . 1 G H8 . 7105 1 2119 . 3 3 1 1 DG H1' H 1 6.056 0.006 . 1 . . . . 1 G H1' . 7105 1 2120 . 3 3 1 1 DG H2' H 1 2.593 0.003 . 1 . . . . 1 G H2' . 7105 1 2121 . 3 3 1 1 DG H3' H 1 4.838 0.004 . 1 . . . . 1 G H3' . 7105 1 2122 . 3 3 1 1 DG H4' H 1 4.220 0.002 . 1 . . . . 1 G H4' . 7105 1 2123 . 3 3 1 1 DG H5' H 1 3.733 0.001 . 1 . . . . 1 G H5' . 7105 1 2124 . 3 3 1 1 DG H2'' H 1 2.669 0.003 . 1 . . . . 1 G H2'' . 7105 1 2125 . 3 3 1 1 DG H5'' H 1 3.733 0.001 . 1 . . . . 1 G H5'' . 7105 1 2126 . 3 3 2 2 DC H5 H 1 5.757 0.003 . 1 . . . . 2 C H5 . 7105 1 2127 . 3 3 2 2 DC H6 H 1 7.494 0.004 . 1 . . . . 2 C H6 . 7105 1 2128 . 3 3 2 2 DC H41 H 1 7.691 0.000 . 1 . . . . 2 C H41 . 7105 1 2129 . 3 3 2 2 DC H42 H 1 7.691 0.000 . 1 . . . . 2 C H42 . 7105 1 2130 . 3 3 2 2 DC H1' H 1 5.815 0.006 . 1 . . . . 2 C H1' . 7105 1 2131 . 3 3 2 2 DC H2' H 1 1.997 0.007 . 1 . . . . 2 C H2' . 7105 1 2132 . 3 3 2 2 DC H3' H 1 4.929 0.003 . 1 . . . . 2 C H3' . 7105 1 2133 . 3 3 2 2 DC H4' H 1 4.183 0.003 . 1 . . . . 2 C H4' . 7105 1 2134 . 3 3 2 2 DC H5' H 1 4.066 0.002 . 1 . . . . 2 C H5' . 7105 1 2135 . 3 3 2 2 DC H2'' H 1 2.198 0.003 . 1 . . . . 2 C H2'' . 7105 1 2136 . 3 3 2 2 DC H5'' H 1 4.066 0.002 . 1 . . . . 2 C H5'' . 7105 1 2137 . 3 3 3 3 DA H2 H 1 7.768 0.001 . 1 . . . . 3 A H2 . 7105 1 2138 . 3 3 3 3 DA H8 H 1 8.393 0.002 . 1 . . . . 3 A H8 . 7105 1 2139 . 3 3 3 3 DA H1' H 1 6.253 0.004 . 1 . . . . 3 A H1' . 7105 1 2140 . 3 3 3 3 DA H2' H 1 2.340 0.006 . 1 . . . . 3 A H2' . 7105 1 2141 . 3 3 3 3 DA H3' H 1 4.915 0.001 . 1 . . . . 3 A H3' . 7105 1 2142 . 3 3 3 3 DA H4' H 1 4.207 0.021 . 1 . . . . 3 A H4' . 7105 1 2143 . 3 3 3 3 DA H5' H 1 4.195 0.019 . 1 . . . . 3 A H5' . 7105 1 2144 . 3 3 3 3 DA H2'' H 1 2.512 0.002 . 1 . . . . 3 A H2'' . 7105 1 2145 . 3 3 3 3 DA H5'' H 1 4.065 0.000 . 1 . . . . 3 A H5'' . 7105 1 2146 . 3 3 4 4 DT H3 H 1 12.896 0.012 . 1 . . . . 4 T H3 . 7105 1 2147 . 3 3 4 4 DT H6 H 1 6.857 0.002 . 1 . . . . 4 T H6 . 7105 1 2148 . 3 3 4 4 DT H71 H 1 1.657 0.007 . 1 . . . . 4 T H7 . 7105 1 2149 . 3 3 4 4 DT H72 H 1 1.657 0.007 . 1 . . . . 4 T H7 . 7105 1 2150 . 3 3 4 4 DT H73 H 1 1.657 0.007 . 1 . . . . 4 T H7 . 7105 1 2151 . 3 3 4 4 DT H1' H 1 6.124 0.007 . 1 . . . . 4 T H1' . 7105 1 2152 . 3 3 4 4 DT H2' H 1 1.295 0.015 . 1 . . . . 4 T H2' . 7105 1 2153 . 3 3 4 4 DT H3' H 1 4.718 0.010 . 1 . . . . 4 T H3' . 7105 1 2154 . 3 3 4 4 DT H4' H 1 4.206 0.008 . 1 . . . . 4 T H4' . 7105 1 2155 . 3 3 4 4 DT H5' H 1 3.831 0.010 . 1 . . . . 4 T H5' . 7105 1 2156 . 3 3 4 4 DT H2'' H 1 1.429 0.003 . 1 . . . . 4 T H2'' . 7105 1 2157 . 3 3 4 4 DT H5'' H 1 3.831 0.010 . 1 . . . . 4 T H5'' . 7105 1 2158 . 3 3 5 5 DT H3 H 1 13.637 0.010 . 1 . . . . 5 T H3 . 7105 1 2159 . 3 3 5 5 DT H6 H 1 7.188 0.005 . 1 . . . . 5 T H6 . 7105 1 2160 . 3 3 5 5 DT H71 H 1 1.825 0.003 . 1 . . . . 5 T H7 . 7105 1 2161 . 3 3 5 5 DT H72 H 1 1.825 0.003 . 1 . . . . 5 T H7 . 7105 1 2162 . 3 3 5 5 DT H73 H 1 1.825 0.003 . 1 . . . . 5 T H7 . 7105 1 2163 . 3 3 5 5 DT H1' H 1 5.381 0.002 . 1 . . . . 5 T H1' . 7105 1 2164 . 3 3 5 5 DT H2' H 1 2.053 0.006 . 1 . . . . 5 T H2' . 7105 1 2165 . 3 3 5 5 DT H3' H 1 4.729 0.013 . 1 . . . . 5 T H3' . 7105 1 2166 . 3 3 5 5 DT H4' H 1 2.667 0.003 . 1 . . . . 5 T H4' . 7105 1 2167 . 3 3 5 5 DT H5' H 1 3.679 0.000 . 1 . . . . 5 T H5' . 7105 1 2168 . 3 3 5 5 DT H2'' H 1 2.491 0.001 . 1 . . . . 5 T H2'' . 7105 1 2169 . 3 3 5 5 DT H5'' H 1 3.782 0.000 . 1 . . . . 5 T H5'' . 7105 1 2170 . 3 3 6 6 DG H1 H 1 12.166 0.007 . 1 . . . . 6 G H1 . 7105 1 2171 . 3 3 6 6 DG H8 H 1 8.036 0.002 . 1 . . . . 6 G H8 . 7105 1 2172 . 3 3 6 6 DG H1' H 1 5.313 0.001 . 1 . . . . 6 G H1' . 7105 1 2173 . 3 3 6 6 DG H2' H 1 2.851 0.005 . 1 . . . . 6 G H2' . 7105 1 2174 . 3 3 6 6 DG H3' H 1 4.961 0.000 . 1 . . . . 6 G H3' . 7105 1 2175 . 3 3 6 6 DG H4' H 1 4.338 0.006 . 1 . . . . 6 G H4' . 7105 1 2176 . 3 3 6 6 DG H5' H 1 3.798 0.004 . 1 . . . . 6 G H5' . 7105 1 2177 . 3 3 6 6 DG H2'' H 1 2.851 0.005 . 1 . . . . 6 G H2'' . 7105 1 2178 . 3 3 6 6 DG H5'' H 1 3.945 0.007 . 1 . . . . 6 G H5'' . 7105 1 2179 . 3 3 7 7 DT H3 H 1 13.869 0.013 . 1 . . . . 7 T H3 . 7105 1 2180 . 3 3 7 7 DT H6 H 1 7.407 0.002 . 1 . . . . 7 T H6 . 7105 1 2181 . 3 3 7 7 DT H71 H 1 1.427 0.001 . 1 . . . . 7 T H7 . 7105 1 2182 . 3 3 7 7 DT H72 H 1 1.427 0.001 . 1 . . . . 7 T H7 . 7105 1 2183 . 3 3 7 7 DT H73 H 1 1.427 0.001 . 1 . . . . 7 T H7 . 7105 1 2184 . 3 3 7 7 DT H1' H 1 5.930 0.023 . 1 . . . . 7 T H1' . 7105 1 2185 . 3 3 7 7 DT H2' H 1 1.786 0.005 . 1 . . . . 7 T H2' . 7105 1 2186 . 3 3 7 7 DT H3' H 1 5.020 0.000 . 1 . . . . 7 T H3' . 7105 1 2187 . 3 3 7 7 DT H4' H 1 4.345 0.007 . 1 . . . . 7 T H4' . 7105 1 2188 . 3 3 7 7 DT H5' H 1 3.949 0.015 . 1 . . . . 7 T H5' . 7105 1 2189 . 3 3 7 7 DT H2'' H 1 2.146 0.000 . 1 . . . . 7 T H2'' . 7105 1 2190 . 3 3 7 7 DT H5'' H 1 4.171 0.001 . 1 . . . . 7 T H5'' . 7105 1 2191 . 3 3 8 8 DT H3 H 1 13.952 0.010 . 1 . . . . 8 T H3 . 7105 1 2192 . 3 3 8 8 DT H6 H 1 7.437 0.003 . 1 . . . . 8 T H6 . 7105 1 2193 . 3 3 8 8 DT H71 H 1 1.666 0.005 . 1 . . . . 8 T H7 . 7105 1 2194 . 3 3 8 8 DT H72 H 1 1.666 0.005 . 1 . . . . 8 T H7 . 7105 1 2195 . 3 3 8 8 DT H73 H 1 1.666 0.005 . 1 . . . . 8 T H7 . 7105 1 2196 . 3 3 8 8 DT H1' H 1 6.137 0.007 . 1 . . . . 8 T H1' . 7105 1 2197 . 3 3 8 8 DT H2' H 1 2.172 0.004 . 1 . . . . 8 T H2' . 7105 1 2198 . 3 3 8 8 DT H3' H 1 4.934 0.002 . 1 . . . . 8 T H3' . 7105 1 2199 . 3 3 8 8 DT H4' H 1 4.190 0.013 . 1 . . . . 8 T H4' . 7105 1 2200 . 3 3 8 8 DT H5' H 1 4.075 0.003 . 1 . . . . 8 T H5' . 7105 1 2201 . 3 3 8 8 DT H2'' H 1 2.692 0.004 . 1 . . . . 8 T H2'' . 7105 1 2202 . 3 3 8 8 DT H5'' H 1 3.895 0.025 . 1 . . . . 8 T H5'' . 7105 1 2203 . 3 3 9 9 DT H3 H 1 13.521 0.006 . 1 . . . . 9 T H3 . 7105 1 2204 . 3 3 9 9 DT H6 H 1 7.411 0.003 . 1 . . . . 9 T H6 . 7105 1 2205 . 3 3 9 9 DT H71 H 1 1.721 0.001 . 1 . . . . 9 T H7 . 7105 1 2206 . 3 3 9 9 DT H72 H 1 1.721 0.001 . 1 . . . . 9 T H7 . 7105 1 2207 . 3 3 9 9 DT H73 H 1 1.721 0.001 . 1 . . . . 9 T H7 . 7105 1 2208 . 3 3 9 9 DT H1' H 1 5.522 0.002 . 1 . . . . 9 T H1' . 7105 1 2209 . 3 3 9 9 DT H2' H 1 1.900 0.000 . 1 . . . . 9 T H2' . 7105 1 2210 . 3 3 9 9 DT H3' H 1 4.766 0.000 . 1 . . . . 9 T H3' . 7105 1 2211 . 3 3 9 9 DT H4' H 1 4.346 0.000 . 1 . . . . 9 T H4' . 7105 1 2212 . 3 3 9 9 DT H5' H 1 3.970 0.001 . 1 . . . . 9 T H5' . 7105 1 2213 . 3 3 9 9 DT H2'' H 1 2.249 0.003 . 1 . . . . 9 T H2'' . 7105 1 2214 . 3 3 9 9 DT H5'' H 1 4.182 0.009 . 1 . . . . 9 T H5'' . 7105 1 2215 . 3 3 10 10 DA H2 H 1 7.184 0.009 . 1 . . . . 10 A H2 . 7105 1 2216 . 3 3 10 10 DA H8 H 1 8.188 0.002 . 1 . . . . 10 A H8 . 7105 1 2217 . 3 3 10 10 DA H1' H 1 5.820 0.003 . 1 . . . . 10 A H1' . 7105 1 2218 . 3 3 10 10 DA H2' H 1 2.670 0.000 . 1 . . . . 10 A H2' . 7105 1 2219 . 3 3 10 10 DA H2'' H 1 2.837 0.002 . 1 . . . . 10 A H2'' . 7105 1 2220 . 3 3 11 11 DG H1 H 1 12.441 0.010 . 1 . . . . 11 G H1 . 7105 1 2221 . 3 3 11 11 DG H8 H 1 7.659 0.001 . 1 . . . . 11 G H8 . 7105 1 2222 . 3 3 11 11 DG H1' H 1 5.567 0.002 . 1 . . . . 11 G H1' . 7105 1 2223 . 3 3 11 11 DG H2' H 1 2.535 0.003 . 1 . . . . 11 G H2' . 7105 1 2224 . 3 3 11 11 DG H3' H 1 4.982 0.002 . 1 . . . . 11 G H3' . 7105 1 2225 . 3 3 11 11 DG H4' H 1 4.323 0.017 . 1 . . . . 11 G H4' . 7105 1 2226 . 3 3 11 11 DG H5' H 1 4.137 0.000 . 1 . . . . 11 G H5' . 7105 1 2227 . 3 3 11 11 DG H2'' H 1 2.684 0.002 . 1 . . . . 11 G H2'' . 7105 1 2228 . 3 3 11 11 DG H5'' H 1 4.137 0.000 . 1 . . . . 11 G H5'' . 7105 1 2229 . 3 3 12 12 DA H2 H 1 7.735 0.005 . 1 . . . . 12 A H2 . 7105 1 2230 . 3 3 12 12 DA H8 H 1 8.038 0.001 . 1 . . . . 12 A H8 . 7105 1 2231 . 3 3 12 12 DA H61 H 1 7.501 0.011 . 1 . . . . 12 A H61 . 7105 1 2232 . 3 3 12 12 DA H62 H 1 7.501 0.011 . 1 . . . . 12 A H62 . 7105 1 2233 . 3 3 12 12 DA H1' H 1 6.133 0.001 . 1 . . . . 12 A H1' . 7105 1 2234 . 3 3 12 12 DA H2' H 1 2.488 0.002 . 1 . . . . 12 A H2' . 7105 1 2235 . 3 3 12 12 DA H3' H 1 4.954 0.002 . 1 . . . . 12 A H3' . 7105 1 2236 . 3 3 12 12 DA H4' H 1 4.332 0.002 . 1 . . . . 12 A H4' . 7105 1 2237 . 3 3 12 12 DA H5' H 1 4.167 0.005 . 1 . . . . 12 A H5' . 7105 1 2238 . 3 3 12 12 DA H2'' H 1 2.767 0.001 . 1 . . . . 12 A H2'' . 7105 1 2239 . 3 3 12 12 DA H5'' H 1 4.167 0.005 . 1 . . . . 12 A H5'' . 7105 1 2240 . 3 3 13 13 DT H3 H 1 13.491 0.000 . 1 . . . . 13 T H3 . 7105 1 2241 . 3 3 13 13 DT H6 H 1 7.111 0.002 . 1 . . . . 13 T H6 . 7105 1 2242 . 3 3 13 13 DT H71 H 1 1.434 0.004 . 1 . . . . 13 T H7 . 7105 1 2243 . 3 3 13 13 DT H72 H 1 1.434 0.004 . 1 . . . . 13 T H7 . 7105 1 2244 . 3 3 13 13 DT H73 H 1 1.434 0.004 . 1 . . . . 13 T H7 . 7105 1 2245 . 3 3 13 13 DT H1' H 1 5.862 0.003 . 1 . . . . 13 T H1' . 7105 1 2246 . 3 3 13 13 DT H2' H 1 1.991 0.002 . 1 . . . . 13 T H2' . 7105 1 2247 . 3 3 13 13 DT H3' H 1 4.807 0.000 . 1 . . . . 13 T H3' . 7105 1 2248 . 3 3 13 13 DT H4' H 1 4.179 0.000 . 1 . . . . 13 T H4' . 7105 1 2249 . 3 3 13 13 DT H5' H 1 4.118 0.003 . 1 . . . . 13 T H5' . 7105 1 2250 . 3 3 13 13 DT H2'' H 1 2.305 0.002 . 1 . . . . 13 T H2'' . 7105 1 2251 . 3 3 13 13 DT H5'' H 1 4.016 0.004 . 1 . . . . 13 T H5'' . 7105 1 2252 . 3 3 14 14 DC H5 H 1 5.699 0.003 . 1 . . . . 14 C H5 . 7105 1 2253 . 3 3 14 14 DC H6 H 1 7.492 0.003 . 1 . . . . 14 C H6 . 7105 1 2254 . 3 3 14 14 DC H41 H 1 6.598 0.000 . 1 . . . . 14 C H41 . 7105 1 2255 . 3 3 14 14 DC H4' H 1 4.338 0.000 . 1 . . . . 14 C H4' . 7105 1 2256 . 3 3 14 14 DC H5' H 1 4.178 0.000 . 1 . . . . 14 C H5' . 7105 1 2257 . 3 3 14 14 DC H5'' H 1 4.178 0.000 . 1 . . . . 14 C H5'' . 7105 1 2258 . 3 3 15 15 DC H5 H 1 5.889 0.003 . 1 . . . . 15 C H5 . 7105 1 2259 . 3 3 15 15 DC H6 H 1 7.717 0.003 . 1 . . . . 15 C H6 . 7105 1 2260 . 3 3 15 15 DC H1' H 1 6.023 0.003 . 1 . . . . 15 C H1' . 7105 1 2261 . 3 3 15 15 DC H2' H 1 2.155 0.004 . 1 . . . . 15 C H2' . 7105 1 2262 . 3 3 15 15 DC H3' H 1 4.745 0.000 . 1 . . . . 15 C H3' . 7105 1 2263 . 3 3 15 15 DC H4' H 1 4.027 0.025 . 1 . . . . 15 C H4' . 7105 1 2264 . 3 3 15 15 DC H5' H 1 3.981 0.029 . 1 . . . . 15 C H5' . 7105 1 2265 . 3 3 15 15 DC H2'' H 1 2.360 0.001 . 1 . . . . 15 C H2'' . 7105 1 2266 . 3 3 15 15 DC H5'' H 1 3.981 0.029 . 1 . . . . 15 C H5'' . 7105 1 2267 . 3 3 16 16 DC H5 H 1 5.953 0.004 . 1 . . . . 16 C H5 . 7105 1 2268 . 3 3 16 16 DC H6 H 1 7.716 0.001 . 1 . . . . 16 C H6 . 7105 1 2269 . 3 3 16 16 DC H1' H 1 6.233 0.007 . 1 . . . . 16 C H1' . 7105 1 2270 . 3 3 16 16 DC H2' H 1 2.260 0.003 . 1 . . . . 16 C H2' . 7105 1 2271 . 3 3 16 16 DC H3' H 1 4.503 0.003 . 1 . . . . 16 C H3' . 7105 1 2272 . 3 3 16 16 DC H4' H 1 3.998 0.021 . 1 . . . . 16 C H4' . 7105 1 2273 . 3 3 16 16 DC H5' H 1 4.047 0.028 . 1 . . . . 16 C H5' . 7105 1 2274 . 3 3 16 16 DC H2'' H 1 2.303 0.004 . 1 . . . . 16 C H2'' . 7105 1 2275 . 3 3 16 16 DC H5'' H 1 4.047 0.028 . 1 . . . . 16 C H5'' . 7105 1 stop_ save_