data_15070 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15070 _Entry.Title ; NMR Assignments of the apo Corynebacterium diphtheria Heme Oxygenase-G135A ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-12-07 _Entry.Accession_date 2006-12-07 _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 solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Kellie Hom . . . 15070 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Dept. of Pharmaceutical Science, University of Maryland, Baltimore' . 15070 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15070 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 571 15070 '15N chemical shifts' 190 15070 '1H chemical shifts' 191 15070 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 . . 2009-08-31 2006-12-07 update BMRB 'complete entry citation; add related entry' 15070 1 . . 2007-06-26 2006-12-07 original author 'original release' 15070 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 15071 'apo Corynebacterium diptheriae heme oxygenase' 15070 BMRB 15073 'complex form, Corynebacterium diptheriae heme oxygenase' 15070 stop_ save_ ############### # Citations # ############### save_citation-1 _Citation.Sf_category citations _Citation.Sf_framecode citation-1 _Citation.Entry_ID 15070 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19636825 _Citation.Full_citation . _Citation.Title 'NMR assignments of cd-HO, a 24 kDa heme oxygenase from Corynebacterium diphtheria' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 1 _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 55 _Citation.Page_last 56 _Citation.Year 2007 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Kellie Hom . . . 15070 1 2 Lena Furci . M. . 15070 1 3 Rahul Deshmukh . . . 15070 1 4 Angela Wilks . . . 15070 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Corynebacterium diptheriae' 15070 1 'heme oxygenase' 15070 1 NMR 15070 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15070 _Assembly.ID 1 _Assembly.Name 'heme oxygenase' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic . _Assembly.Thiol_state . _Assembly.Molecular_mass 24152 _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 'heme oxygenase' 1 $heme_oxygenase A . yes native no no . . . 15070 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_heme_oxygenase _Entity.Sf_category entity _Entity.Sf_framecode heme_oxygenase _Entity.Entry_ID 15070 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name heme_oxygenase _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 ; MTTATAGLAVELKQSTAQAH EKAEHSTFMSDLLKGRLGVA EFTRLQEQAWLFYTALEQAV DAVRASGFAESLLDPALNRA EVLARDLDKLNGSSEWRSRI TASPAVIDYVNRLEEIRDNV DGPALVAHHYVRYLADLSGG QVIARMMQRHYGVDPEALGF YHFEGIAKLKVYKDEYREKL NNLELSDEQREHLLKEATDA FVFNHQVFADLGKGL ; _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 215 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation G135A _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 24152 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 15071 . cdHO . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 2 no BMRB 15073 . heme_oxygenase . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 3 no PDB 1IW0 . "Crystal Structure Of A Heme Oxygenase (Hmuo) From Corynebacterium Diphtheriae Complexed With Heme In The Ferric State" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 4 no PDB 1IW1 . "Crystal Structure Of A Heme Oxygenase (Hmuo) From Corynebacterium Diphtheriae Complexed With Heme In The Ferrous State" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 5 no PDB 1V8X . "Crystal Structure Of The Dioxygen-Bound Heme Oxygenase From Corynebacterium Diphtheriae" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 6 no PDB 1WNV . "D136a Mutant Of Heme Oxygenase From Corynebacterium Diphtheriae (Hmuo)" . . . . . 100.00 215 99.07 99.07 1.81e-152 . . . . 15070 1 7 no PDB 1WNW . "D136n Mutant Of Heme Oxygenase From Corynebacterium Diphtheriae (hmuo)" . . . . . 100.00 215 99.07 99.53 4.71e-153 . . . . 15070 1 8 no PDB 1WNX . "D136e Mutant Of Heme Oxygenase From Corynebacterium Diphtheriae (Hmuo)" . . . . . 100.00 215 99.07 99.53 4.98e-153 . . . . 15070 1 9 no PDB 1WZD . "Crystal Structure Of An Artificial Metalloprotein: Fe(10-Ch2ch2cooh- Salophen)WILD TYPE HEME OXYGENASE" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 10 no PDB 1WZF . "Crystal Structure Of An Artificial Metalloprotein: Fe(10-Cooh- Salophen)WILD TYPE HEME OXYGENASE" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 11 no PDB 1WZG . "Crystal Structure Of An Artificial Metalloprotein: Fe(Salophen)WILD Type Heme Oxygenase" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 12 no PDB 2Z68 . "Crystal Structure Of An Artificial Metalloprotein: Cr[n- Salicylidene-4-Amino-3-Hydroxyhydrocinnamic Acid]WILD Type Heme Oxygen" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 13 no PDB 3I8R . "Crystal Structure Of The Heme Oxygenase From Corynebacterium Diphtheriae (Hmuo) In Complex With Heme Binding Ditiothreit" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 14 no PDB 3MOO . "Crystal Structure Of The Hmuo, Heme Oxygenase From Corynebacterium Diphtheriae, In Complex With Azide-Bound Verdoheme" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 15 no PDB 4GOH . "Structure Of The Substrate-free Hmuo, Ho From Corynebacterium Diphtheriae" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 16 no PDB 4GPC . "Structure Of The Biliverdin-hmuo, Heme Oxygenase From Corynebacterium Diphtheriae" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 17 no PDB 4GPF . "Structure Of The Fe3+-biliverdin-hmuo, Heme Oxygenase From Corynebacterium Diphtheriae (data Set Iii)" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 18 no PDB 4GPH . "Structure Of Hmuo, Heme Oxygenase From Corynebacterium Diphtheriae, In Complex With The Putative Reaction Intermediates Between" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 19 no DBJ BAA76407 . "Heme oxygenase [Corynebacterium diphtheriae]" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 20 no EMBL CAE50198 . "heme oxygenase [Corynebacterium diphtheriae]" . . . . . 100.00 215 97.21 98.14 2.70e-149 . . . . 15070 1 21 no EMBL CKH06070 . "heme oxygenase [Corynebacterium diphtheriae]" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 22 no GB AAC44832 . "HmuO [Corynebacterium diphtheriae]" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 23 no GB AEX42338 . "heme oxygenase [Corynebacterium diphtheriae 31A]" . . . . . 100.00 215 98.14 98.14 6.84e-151 . . . . 15070 1 24 no GB AEX44660 . "heme oxygenase [Corynebacterium diphtheriae 241]" . . . . . 100.00 215 97.67 98.60 2.18e-150 . . . . 15070 1 25 no GB AEX46855 . "heme oxygenase [Corynebacterium diphtheriae INCA 402]" . . . . . 100.00 215 98.14 99.07 6.87e-152 . . . . 15070 1 26 no GB AEX67845 . "heme oxygenase [Corynebacterium diphtheriae C7 (beta)]" . . . . . 100.00 215 99.53 99.53 1.21e-153 . . . . 15070 1 27 no REF WP_003852259 . "heme oxygenase [Corynebacterium diphtheriae]" . . . . . 100.00 215 97.67 98.60 2.80e-150 . . . . 15070 1 28 no REF WP_010935240 . "heme oxygenase [Corynebacterium diphtheriae]" . . . . . 100.00 215 97.21 98.14 2.70e-149 . . . . 15070 1 29 no REF WP_014302152 . "heme oxygenase [Corynebacterium diphtheriae]" . . . . . 100.00 215 97.67 98.60 2.18e-150 . . . . 15070 1 30 no REF WP_014303664 . "heme oxygenase [Corynebacterium diphtheriae]" . . . . . 100.00 215 98.14 99.07 6.87e-152 . . . . 15070 1 31 no REF WP_014307115 . "heme oxygenase [Corynebacterium diphtheriae]" . . . . . 100.00 215 98.60 98.60 1.21e-151 . . . . 15070 1 32 no SP P71119 . "RecName: Full=Heme oxygenase" . . . . . 100.00 215 97.21 98.14 2.70e-149 . . . . 15070 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'heme degradation' 15070 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 15070 1 2 . THR . 15070 1 3 . THR . 15070 1 4 . ALA . 15070 1 5 . THR . 15070 1 6 . ALA . 15070 1 7 . GLY . 15070 1 8 . LEU . 15070 1 9 . ALA . 15070 1 10 . VAL . 15070 1 11 . GLU . 15070 1 12 . LEU . 15070 1 13 . LYS . 15070 1 14 . GLN . 15070 1 15 . SER . 15070 1 16 . THR . 15070 1 17 . ALA . 15070 1 18 . GLN . 15070 1 19 . ALA . 15070 1 20 . HIS . 15070 1 21 . GLU . 15070 1 22 . LYS . 15070 1 23 . ALA . 15070 1 24 . GLU . 15070 1 25 . HIS . 15070 1 26 . SER . 15070 1 27 . THR . 15070 1 28 . PHE . 15070 1 29 . MET . 15070 1 30 . SER . 15070 1 31 . ASP . 15070 1 32 . LEU . 15070 1 33 . LEU . 15070 1 34 . LYS . 15070 1 35 . GLY . 15070 1 36 . ARG . 15070 1 37 . LEU . 15070 1 38 . GLY . 15070 1 39 . VAL . 15070 1 40 . ALA . 15070 1 41 . GLU . 15070 1 42 . PHE . 15070 1 43 . THR . 15070 1 44 . ARG . 15070 1 45 . LEU . 15070 1 46 . GLN . 15070 1 47 . GLU . 15070 1 48 . GLN . 15070 1 49 . ALA . 15070 1 50 . TRP . 15070 1 51 . LEU . 15070 1 52 . PHE . 15070 1 53 . TYR . 15070 1 54 . THR . 15070 1 55 . ALA . 15070 1 56 . LEU . 15070 1 57 . GLU . 15070 1 58 . GLN . 15070 1 59 . ALA . 15070 1 60 . VAL . 15070 1 61 . ASP . 15070 1 62 . ALA . 15070 1 63 . VAL . 15070 1 64 . ARG . 15070 1 65 . ALA . 15070 1 66 . SER . 15070 1 67 . GLY . 15070 1 68 . PHE . 15070 1 69 . ALA . 15070 1 70 . GLU . 15070 1 71 . SER . 15070 1 72 . LEU . 15070 1 73 . LEU . 15070 1 74 . ASP . 15070 1 75 . PRO . 15070 1 76 . ALA . 15070 1 77 . LEU . 15070 1 78 . ASN . 15070 1 79 . ARG . 15070 1 80 . ALA . 15070 1 81 . GLU . 15070 1 82 . VAL . 15070 1 83 . LEU . 15070 1 84 . ALA . 15070 1 85 . ARG . 15070 1 86 . ASP . 15070 1 87 . LEU . 15070 1 88 . ASP . 15070 1 89 . LYS . 15070 1 90 . LEU . 15070 1 91 . ASN . 15070 1 92 . GLY . 15070 1 93 . SER . 15070 1 94 . SER . 15070 1 95 . GLU . 15070 1 96 . TRP . 15070 1 97 . ARG . 15070 1 98 . SER . 15070 1 99 . ARG . 15070 1 100 . ILE . 15070 1 101 . THR . 15070 1 102 . ALA . 15070 1 103 . SER . 15070 1 104 . PRO . 15070 1 105 . ALA . 15070 1 106 . VAL . 15070 1 107 . ILE . 15070 1 108 . ASP . 15070 1 109 . TYR . 15070 1 110 . VAL . 15070 1 111 . ASN . 15070 1 112 . ARG . 15070 1 113 . LEU . 15070 1 114 . GLU . 15070 1 115 . GLU . 15070 1 116 . ILE . 15070 1 117 . ARG . 15070 1 118 . ASP . 15070 1 119 . ASN . 15070 1 120 . VAL . 15070 1 121 . ASP . 15070 1 122 . GLY . 15070 1 123 . PRO . 15070 1 124 . ALA . 15070 1 125 . LEU . 15070 1 126 . VAL . 15070 1 127 . ALA . 15070 1 128 . HIS . 15070 1 129 . HIS . 15070 1 130 . TYR . 15070 1 131 . VAL . 15070 1 132 . ARG . 15070 1 133 . TYR . 15070 1 134 . LEU . 15070 1 135 . ALA . 15070 1 136 . ASP . 15070 1 137 . LEU . 15070 1 138 . SER . 15070 1 139 . GLY . 15070 1 140 . GLY . 15070 1 141 . GLN . 15070 1 142 . VAL . 15070 1 143 . ILE . 15070 1 144 . ALA . 15070 1 145 . ARG . 15070 1 146 . MET . 15070 1 147 . MET . 15070 1 148 . GLN . 15070 1 149 . ARG . 15070 1 150 . HIS . 15070 1 151 . TYR . 15070 1 152 . GLY . 15070 1 153 . VAL . 15070 1 154 . ASP . 15070 1 155 . PRO . 15070 1 156 . GLU . 15070 1 157 . ALA . 15070 1 158 . LEU . 15070 1 159 . GLY . 15070 1 160 . PHE . 15070 1 161 . TYR . 15070 1 162 . HIS . 15070 1 163 . PHE . 15070 1 164 . GLU . 15070 1 165 . GLY . 15070 1 166 . ILE . 15070 1 167 . ALA . 15070 1 168 . LYS . 15070 1 169 . LEU . 15070 1 170 . LYS . 15070 1 171 . VAL . 15070 1 172 . TYR . 15070 1 173 . LYS . 15070 1 174 . ASP . 15070 1 175 . GLU . 15070 1 176 . TYR . 15070 1 177 . ARG . 15070 1 178 . GLU . 15070 1 179 . LYS . 15070 1 180 . LEU . 15070 1 181 . ASN . 15070 1 182 . ASN . 15070 1 183 . LEU . 15070 1 184 . GLU . 15070 1 185 . LEU . 15070 1 186 . SER . 15070 1 187 . ASP . 15070 1 188 . GLU . 15070 1 189 . GLN . 15070 1 190 . ARG . 15070 1 191 . GLU . 15070 1 192 . HIS . 15070 1 193 . LEU . 15070 1 194 . LEU . 15070 1 195 . LYS . 15070 1 196 . GLU . 15070 1 197 . ALA . 15070 1 198 . THR . 15070 1 199 . ASP . 15070 1 200 . ALA . 15070 1 201 . PHE . 15070 1 202 . VAL . 15070 1 203 . PHE . 15070 1 204 . ASN . 15070 1 205 . HIS . 15070 1 206 . GLN . 15070 1 207 . VAL . 15070 1 208 . PHE . 15070 1 209 . ALA . 15070 1 210 . ASP . 15070 1 211 . LEU . 15070 1 212 . GLY . 15070 1 213 . LYS . 15070 1 214 . GLY . 15070 1 215 . LEU . 15070 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 15070 1 . THR 2 2 15070 1 . THR 3 3 15070 1 . ALA 4 4 15070 1 . THR 5 5 15070 1 . ALA 6 6 15070 1 . GLY 7 7 15070 1 . LEU 8 8 15070 1 . ALA 9 9 15070 1 . VAL 10 10 15070 1 . GLU 11 11 15070 1 . LEU 12 12 15070 1 . LYS 13 13 15070 1 . GLN 14 14 15070 1 . SER 15 15 15070 1 . THR 16 16 15070 1 . ALA 17 17 15070 1 . GLN 18 18 15070 1 . ALA 19 19 15070 1 . HIS 20 20 15070 1 . GLU 21 21 15070 1 . LYS 22 22 15070 1 . ALA 23 23 15070 1 . GLU 24 24 15070 1 . HIS 25 25 15070 1 . SER 26 26 15070 1 . THR 27 27 15070 1 . PHE 28 28 15070 1 . MET 29 29 15070 1 . SER 30 30 15070 1 . ASP 31 31 15070 1 . LEU 32 32 15070 1 . LEU 33 33 15070 1 . LYS 34 34 15070 1 . GLY 35 35 15070 1 . ARG 36 36 15070 1 . LEU 37 37 15070 1 . GLY 38 38 15070 1 . VAL 39 39 15070 1 . ALA 40 40 15070 1 . GLU 41 41 15070 1 . PHE 42 42 15070 1 . THR 43 43 15070 1 . ARG 44 44 15070 1 . LEU 45 45 15070 1 . GLN 46 46 15070 1 . GLU 47 47 15070 1 . GLN 48 48 15070 1 . ALA 49 49 15070 1 . TRP 50 50 15070 1 . LEU 51 51 15070 1 . PHE 52 52 15070 1 . TYR 53 53 15070 1 . THR 54 54 15070 1 . ALA 55 55 15070 1 . LEU 56 56 15070 1 . GLU 57 57 15070 1 . GLN 58 58 15070 1 . ALA 59 59 15070 1 . VAL 60 60 15070 1 . ASP 61 61 15070 1 . ALA 62 62 15070 1 . VAL 63 63 15070 1 . ARG 64 64 15070 1 . ALA 65 65 15070 1 . SER 66 66 15070 1 . GLY 67 67 15070 1 . PHE 68 68 15070 1 . ALA 69 69 15070 1 . GLU 70 70 15070 1 . SER 71 71 15070 1 . LEU 72 72 15070 1 . LEU 73 73 15070 1 . ASP 74 74 15070 1 . PRO 75 75 15070 1 . ALA 76 76 15070 1 . LEU 77 77 15070 1 . ASN 78 78 15070 1 . ARG 79 79 15070 1 . ALA 80 80 15070 1 . GLU 81 81 15070 1 . VAL 82 82 15070 1 . LEU 83 83 15070 1 . ALA 84 84 15070 1 . ARG 85 85 15070 1 . ASP 86 86 15070 1 . LEU 87 87 15070 1 . ASP 88 88 15070 1 . LYS 89 89 15070 1 . LEU 90 90 15070 1 . ASN 91 91 15070 1 . GLY 92 92 15070 1 . SER 93 93 15070 1 . SER 94 94 15070 1 . GLU 95 95 15070 1 . TRP 96 96 15070 1 . ARG 97 97 15070 1 . SER 98 98 15070 1 . ARG 99 99 15070 1 . ILE 100 100 15070 1 . THR 101 101 15070 1 . ALA 102 102 15070 1 . SER 103 103 15070 1 . PRO 104 104 15070 1 . ALA 105 105 15070 1 . VAL 106 106 15070 1 . ILE 107 107 15070 1 . ASP 108 108 15070 1 . TYR 109 109 15070 1 . VAL 110 110 15070 1 . ASN 111 111 15070 1 . ARG 112 112 15070 1 . LEU 113 113 15070 1 . GLU 114 114 15070 1 . GLU 115 115 15070 1 . ILE 116 116 15070 1 . ARG 117 117 15070 1 . ASP 118 118 15070 1 . ASN 119 119 15070 1 . VAL 120 120 15070 1 . ASP 121 121 15070 1 . GLY 122 122 15070 1 . PRO 123 123 15070 1 . ALA 124 124 15070 1 . LEU 125 125 15070 1 . VAL 126 126 15070 1 . ALA 127 127 15070 1 . HIS 128 128 15070 1 . HIS 129 129 15070 1 . TYR 130 130 15070 1 . VAL 131 131 15070 1 . ARG 132 132 15070 1 . TYR 133 133 15070 1 . LEU 134 134 15070 1 . ALA 135 135 15070 1 . ASP 136 136 15070 1 . LEU 137 137 15070 1 . SER 138 138 15070 1 . GLY 139 139 15070 1 . GLY 140 140 15070 1 . GLN 141 141 15070 1 . VAL 142 142 15070 1 . ILE 143 143 15070 1 . ALA 144 144 15070 1 . ARG 145 145 15070 1 . MET 146 146 15070 1 . MET 147 147 15070 1 . GLN 148 148 15070 1 . ARG 149 149 15070 1 . HIS 150 150 15070 1 . TYR 151 151 15070 1 . GLY 152 152 15070 1 . VAL 153 153 15070 1 . ASP 154 154 15070 1 . PRO 155 155 15070 1 . GLU 156 156 15070 1 . ALA 157 157 15070 1 . LEU 158 158 15070 1 . GLY 159 159 15070 1 . PHE 160 160 15070 1 . TYR 161 161 15070 1 . HIS 162 162 15070 1 . PHE 163 163 15070 1 . GLU 164 164 15070 1 . GLY 165 165 15070 1 . ILE 166 166 15070 1 . ALA 167 167 15070 1 . LYS 168 168 15070 1 . LEU 169 169 15070 1 . LYS 170 170 15070 1 . VAL 171 171 15070 1 . TYR 172 172 15070 1 . LYS 173 173 15070 1 . ASP 174 174 15070 1 . GLU 175 175 15070 1 . TYR 176 176 15070 1 . ARG 177 177 15070 1 . GLU 178 178 15070 1 . LYS 179 179 15070 1 . LEU 180 180 15070 1 . ASN 181 181 15070 1 . ASN 182 182 15070 1 . LEU 183 183 15070 1 . GLU 184 184 15070 1 . LEU 185 185 15070 1 . SER 186 186 15070 1 . ASP 187 187 15070 1 . GLU 188 188 15070 1 . GLN 189 189 15070 1 . ARG 190 190 15070 1 . GLU 191 191 15070 1 . HIS 192 192 15070 1 . LEU 193 193 15070 1 . LEU 194 194 15070 1 . LYS 195 195 15070 1 . GLU 196 196 15070 1 . ALA 197 197 15070 1 . THR 198 198 15070 1 . ASP 199 199 15070 1 . ALA 200 200 15070 1 . PHE 201 201 15070 1 . VAL 202 202 15070 1 . PHE 203 203 15070 1 . ASN 204 204 15070 1 . HIS 205 205 15070 1 . GLN 206 206 15070 1 . VAL 207 207 15070 1 . PHE 208 208 15070 1 . ALA 209 209 15070 1 . ASP 210 210 15070 1 . LEU 211 211 15070 1 . GLY 212 212 15070 1 . LYS 213 213 15070 1 . GLY 214 214 15070 1 . LEU 215 215 15070 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 15070 _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 $heme_oxygenase . 1717 organism . 'Corynebacterium diphtheria' 'Corynebacterium diphtheria' . . Bacteria . Corynebacterium diphtheriae . . . . . . . . . . . . . . . . . . . . . 15070 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 15070 _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 $heme_oxygenase . 'recombinant technology' 'Escherichia coli' . . . . . . . . . . . . . . . . . . . . . pET21a . . . . . . 15070 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15070 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'heme oxygenase' '[U-13C; U-15N; U-2H]' . . 1 $heme_oxygenase . . . 1 2 mM . . . . 15070 1 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 15070 1 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 15070 1 4 'potassium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 15070 1 5 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 15070 1 6 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . 15070 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15070 _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 'ionic strength' 100 . mM 15070 1 pH 7.4 . pH 15070 1 pressure 1 . atm 15070 1 temperature 298 . K 15070 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15070 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15070 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15070 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 15070 _Software.ID 2 _Software.Name SPARKY _Software.Version 3.11 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 15070 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15070 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 15070 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15070 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 500 . . . 15070 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 15070 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15070 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15070 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15070 1 4 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15070 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15070 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15070 1 7 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15070 1 8 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15070 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 15070 _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 . . . 1 $citation-1 . . 1 $citation-1 15070 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . 1 $citation-1 . . 1 $citation-1 15070 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $citation-1 . . 1 $citation-1 15070 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15070 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _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 '2D 1H-15N HSQC' . . . 15070 1 2 '3D CBCA(CO)NH' . . . 15070 1 3 '3D HNCO' . . . 15070 1 4 '3D HNCA' . . . 15070 1 5 '3D HNCACB' . . . 15070 1 6 '3D 1H-15N NOESY' . . . 15070 1 7 '3D HN(CO)CA' . . . 15070 1 8 '3D HN(CA)CO' . . . 15070 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 4 4 ALA H H 1 8.535 0.02 . 1 . . . . 4 ALA H . 15070 1 2 . 1 1 4 4 ALA C C 13 176.6 0.2 . 1 . . . . 4 ALA C . 15070 1 3 . 1 1 4 4 ALA CA C 13 49.76 0.2 . 1 . . . . 4 ALA CA . 15070 1 4 . 1 1 4 4 ALA CB C 13 16.29 0.2 . 1 . . . . 4 ALA CB . 15070 1 5 . 1 1 4 4 ALA N N 15 127.2 0.2 . 1 . . . . 4 ALA N . 15070 1 6 . 1 1 5 5 THR H H 1 8.215 0.02 . 1 . . . . 5 THR H . 15070 1 7 . 1 1 5 5 THR C C 13 172.9 0.2 . 1 . . . . 5 THR C . 15070 1 8 . 1 1 5 5 THR CA C 13 58.75 0.2 . 1 . . . . 5 THR CA . 15070 1 9 . 1 1 5 5 THR CB C 13 66.82 0.2 . 1 . . . . 5 THR CB . 15070 1 10 . 1 1 5 5 THR N N 15 113.3 0.2 . 1 . . . . 5 THR N . 15070 1 11 . 1 1 6 6 ALA H H 1 8.293 0.02 . 1 . . . . 6 ALA H . 15070 1 12 . 1 1 6 6 ALA C C 13 176.2 0.2 . 1 . . . . 6 ALA C . 15070 1 13 . 1 1 6 6 ALA CA C 13 49.23 0.2 . 1 . . . . 6 ALA CA . 15070 1 14 . 1 1 6 6 ALA CB C 13 17.08 0.2 . 1 . . . . 6 ALA CB . 15070 1 15 . 1 1 6 6 ALA N N 15 126.0 0.2 . 1 . . . . 6 ALA N . 15070 1 16 . 1 1 7 7 GLY H H 1 8.357 0.02 . 1 . . . . 7 GLY H . 15070 1 17 . 1 1 7 7 GLY C C 13 173.3 0.2 . 1 . . . . 7 GLY C . 15070 1 18 . 1 1 7 7 GLY CA C 13 41.78 0.2 . 1 . . . . 7 GLY CA . 15070 1 19 . 1 1 7 7 GLY N N 15 107.9 0.2 . 1 . . . . 7 GLY N . 15070 1 20 . 1 1 8 8 LEU H H 1 8.583 0.02 . 1 . . . . 8 LEU H . 15070 1 21 . 1 1 8 8 LEU C C 13 176.7 0.2 . 1 . . . . 8 LEU C . 15070 1 22 . 1 1 8 8 LEU CA C 13 54.98 0.2 . 1 . . . . 8 LEU CA . 15070 1 23 . 1 1 8 8 LEU CB C 13 38.73 0.2 . 1 . . . . 8 LEU CB . 15070 1 24 . 1 1 8 8 LEU N N 15 124.3 0.2 . 1 . . . . 8 LEU N . 15070 1 25 . 1 1 9 9 ALA H H 1 9.069 0.02 . 1 . . . . 9 ALA H . 15070 1 26 . 1 1 9 9 ALA C C 13 179.5 0.2 . 1 . . . . 9 ALA C . 15070 1 27 . 1 1 9 9 ALA CA C 13 53.04 0.2 . 1 . . . . 9 ALA CA . 15070 1 28 . 1 1 9 9 ALA CB C 13 15.28 0.2 . 1 . . . . 9 ALA CB . 15070 1 29 . 1 1 9 9 ALA N N 15 117.4 0.2 . 1 . . . . 9 ALA N . 15070 1 30 . 1 1 10 10 VAL H H 1 7.640 0.02 . 1 . . . . 10 VAL H . 15070 1 31 . 1 1 10 10 VAL C C 13 176.9 0.2 . 1 . . . . 10 VAL C . 15070 1 32 . 1 1 10 10 VAL CA C 13 62.80 0.2 . 1 . . . . 10 VAL CA . 15070 1 33 . 1 1 10 10 VAL CB C 13 28.73 0.2 . 1 . . . . 10 VAL CB . 15070 1 34 . 1 1 10 10 VAL N N 15 118.9 0.2 . 1 . . . . 10 VAL N . 15070 1 35 . 1 1 11 11 GLU H H 1 8.045 0.02 . 1 . . . . 11 GLU H . 15070 1 36 . 1 1 11 11 GLU C C 13 178.9 0.2 . 1 . . . . 11 GLU C . 15070 1 37 . 1 1 11 11 GLU CA C 13 56.62 0.2 . 1 . . . . 11 GLU CA . 15070 1 38 . 1 1 11 11 GLU CB C 13 26.62 0.2 . 1 . . . . 11 GLU CB . 15070 1 39 . 1 1 11 11 GLU N N 15 121.4 0.2 . 1 . . . . 11 GLU N . 15070 1 40 . 1 1 12 12 LEU H H 1 8.946 0.02 . 1 . . . . 12 LEU H . 15070 1 41 . 1 1 12 12 LEU C C 13 177.9 0.2 . 1 . . . . 12 LEU C . 15070 1 42 . 1 1 12 12 LEU CA C 13 55.06 0.2 . 1 . . . . 12 LEU CA . 15070 1 43 . 1 1 12 12 LEU CB C 13 38.88 0.2 . 1 . . . . 12 LEU CB . 15070 1 44 . 1 1 12 12 LEU N N 15 120.6 0.2 . 1 . . . . 12 LEU N . 15070 1 45 . 1 1 13 13 LYS H H 1 7.490 0.02 . 1 . . . . 13 LYS H . 15070 1 46 . 1 1 13 13 LYS C C 13 177.5 0.2 . 1 . . . . 13 LYS C . 15070 1 47 . 1 1 13 13 LYS CA C 13 56.62 0.2 . 1 . . . . 13 LYS CA . 15070 1 48 . 1 1 13 13 LYS CB C 13 29.15 0.2 . 1 . . . . 13 LYS CB . 15070 1 49 . 1 1 13 13 LYS N N 15 121.0 0.2 . 1 . . . . 13 LYS N . 15070 1 50 . 1 1 14 14 GLN H H 1 8.251 0.02 . 1 . . . . 14 GLN H . 15070 1 51 . 1 1 14 14 GLN C C 13 178.1 0.2 . 1 . . . . 14 GLN C . 15070 1 52 . 1 1 14 14 GLN CA C 13 55.45 0.2 . 1 . . . . 14 GLN CA . 15070 1 53 . 1 1 14 14 GLN N N 15 116.9 0.2 . 1 . . . . 14 GLN N . 15070 1 54 . 1 1 15 15 SER H H 1 8.622 0.02 . 1 . . . . 15 SER H . 15070 1 55 . 1 1 15 15 SER C C 13 175.3 0.2 . 1 . . . . 15 SER C . 15070 1 56 . 1 1 15 15 SER CA C 13 58.82 0.2 . 1 . . . . 15 SER CA . 15070 1 57 . 1 1 15 15 SER CB C 13 60.46 0.2 . 1 . . . . 15 SER CB . 15070 1 58 . 1 1 15 15 SER N N 15 114.9 0.2 . 1 . . . . 15 SER N . 15070 1 59 . 1 1 16 16 THR H H 1 7.541 0.02 . 1 . . . . 16 THR H . 15070 1 60 . 1 1 16 16 THR C C 13 174.0 0.2 . 1 . . . . 16 THR C . 15070 1 61 . 1 1 16 16 THR CA C 13 59.76 0.2 . 1 . . . . 16 THR CA . 15070 1 62 . 1 1 16 16 THR CB C 13 66.78 0.2 . 1 . . . . 16 THR CB . 15070 1 63 . 1 1 16 16 THR N N 15 109.1 0.2 . 1 . . . . 16 THR N . 15070 1 64 . 1 1 17 17 ALA H H 1 7.407 0.02 . 1 . . . . 17 ALA H . 15070 1 65 . 1 1 17 17 ALA C C 13 178.9 0.2 . 1 . . . . 17 ALA C . 15070 1 66 . 1 1 17 17 ALA CA C 13 52.89 0.2 . 1 . . . . 17 ALA CA . 15070 1 67 . 1 1 17 17 ALA CB C 13 15.59 0.2 . 1 . . . . 17 ALA CB . 15070 1 68 . 1 1 17 17 ALA N N 15 124.9 0.2 . 1 . . . . 17 ALA N . 15070 1 69 . 1 1 18 18 GLN H H 1 8.375 0.02 . 1 . . . . 18 GLN H . 15070 1 70 . 1 1 18 18 GLN C C 13 177.1 0.2 . 1 . . . . 18 GLN C . 15070 1 71 . 1 1 18 18 GLN CA C 13 55.58 0.2 . 1 . . . . 18 GLN CA . 15070 1 72 . 1 1 18 18 GLN CB C 13 25.10 0.2 . 1 . . . . 18 GLN CB . 15070 1 73 . 1 1 18 18 GLN N N 15 116.9 0.2 . 1 . . . . 18 GLN N . 15070 1 74 . 1 1 19 19 ALA H H 1 8.021 0.02 . 1 . . . . 19 ALA H . 15070 1 75 . 1 1 19 19 ALA C C 13 178.5 0.2 . 1 . . . . 19 ALA C . 15070 1 76 . 1 1 19 19 ALA CA C 13 51.61 0.2 . 1 . . . . 19 ALA CA . 15070 1 77 . 1 1 19 19 ALA CB C 13 16.00 0.2 . 1 . . . . 19 ALA CB . 15070 1 78 . 1 1 19 19 ALA N N 15 122.7 0.2 . 1 . . . . 19 ALA N . 15070 1 79 . 1 1 20 20 HIS H H 1 8.364 0.02 . 1 . . . . 20 HIS H . 15070 1 80 . 1 1 20 20 HIS C C 13 176.9 0.2 . 1 . . . . 20 HIS C . 15070 1 81 . 1 1 20 20 HIS CA C 13 55.70 0.2 . 1 . . . . 20 HIS CA . 15070 1 82 . 1 1 20 20 HIS CB C 13 26.35 0.2 . 1 . . . . 20 HIS CB . 15070 1 83 . 1 1 20 20 HIS N N 15 118.1 0.2 . 1 . . . . 20 HIS N . 15070 1 84 . 1 1 21 21 GLU H H 1 7.664 0.02 . 1 . . . . 21 GLU H . 15070 1 85 . 1 1 21 21 GLU CA C 13 54.82 0.2 . 1 . . . . 21 GLU CA . 15070 1 86 . 1 1 21 21 GLU CB C 13 29.40 0.2 . 1 . . . . 21 GLU CB . 15070 1 87 . 1 1 21 21 GLU N N 15 117.5 0.2 . 1 . . . . 21 GLU N . 15070 1 88 . 1 1 22 22 LYS C C 13 176.9 0.2 . 1 . . . . 22 LYS C . 15070 1 89 . 1 1 22 22 LYS CA C 13 54.76 0.2 . 1 . . . . 22 LYS CA . 15070 1 90 . 1 1 22 22 LYS CB C 13 29.60 0.2 . 1 . . . . 22 LYS CB . 15070 1 91 . 1 1 23 23 ALA H H 1 7.663 0.02 . 1 . . . . 23 ALA H . 15070 1 92 . 1 1 23 23 ALA C C 13 177.3 0.2 . 1 . . . . 23 ALA C . 15070 1 93 . 1 1 23 23 ALA CA C 13 51.16 0.2 . 1 . . . . 23 ALA CA . 15070 1 94 . 1 1 23 23 ALA CB C 13 16.16 0.2 . 1 . . . . 23 ALA CB . 15070 1 95 . 1 1 23 23 ALA N N 15 121.0 0.2 . 1 . . . . 23 ALA N . 15070 1 96 . 1 1 24 24 GLU H H 1 8.305 0.02 . 1 . . . . 24 GLU H . 15070 1 97 . 1 1 24 24 GLU C C 13 175.7 0.2 . 1 . . . . 24 GLU C . 15070 1 98 . 1 1 24 24 GLU CA C 13 54.56 0.2 . 1 . . . . 24 GLU CA . 15070 1 99 . 1 1 24 24 GLU CB C 13 26.89 0.2 . 1 . . . . 24 GLU CB . 15070 1 100 . 1 1 24 24 GLU N N 15 118.5 0.2 . 1 . . . . 24 GLU N . 15070 1 101 . 1 1 25 25 HIS H H 1 8.053 0.02 . 1 . . . . 25 HIS H . 15070 1 102 . 1 1 25 25 HIS C C 13 173.5 0.2 . 1 . . . . 25 HIS C . 15070 1 103 . 1 1 25 25 HIS CA C 13 52.39 0.2 . 1 . . . . 25 HIS CA . 15070 1 104 . 1 1 25 25 HIS CB C 13 26.39 0.2 . 1 . . . . 25 HIS CB . 15070 1 105 . 1 1 25 25 HIS N N 15 117.6 0.2 . 1 . . . . 25 HIS N . 15070 1 106 . 1 1 26 26 SER H H 1 7.941 0.02 . 1 . . . . 26 SER H . 15070 1 107 . 1 1 26 26 SER CA C 13 55.36 0.2 . 1 . . . . 26 SER CA . 15070 1 108 . 1 1 26 26 SER CB C 13 61.93 0.2 . 1 . . . . 26 SER CB . 15070 1 109 . 1 1 26 26 SER N N 15 116.9 0.2 . 1 . . . . 26 SER N . 15070 1 110 . 1 1 27 27 THR C C 13 174.0 0.2 . 1 . . . . 27 THR C . 15070 1 111 . 1 1 27 27 THR CA C 13 62.11 0.2 . 1 . . . . 27 THR CA . 15070 1 112 . 1 1 27 27 THR CB C 13 60.23 0.2 . 1 . . . . 27 THR CB . 15070 1 113 . 1 1 28 28 PHE H H 1 8.399 0.02 . 1 . . . . 28 PHE H . 15070 1 114 . 1 1 28 28 PHE C C 13 174.9 0.2 . 1 . . . . 28 PHE C . 15070 1 115 . 1 1 28 28 PHE CA C 13 59.02 0.2 . 1 . . . . 28 PHE CA . 15070 1 116 . 1 1 28 28 PHE CB C 13 37.51 0.2 . 1 . . . . 28 PHE CB . 15070 1 117 . 1 1 28 28 PHE N N 15 120.4 0.2 . 1 . . . . 28 PHE N . 15070 1 118 . 1 1 29 29 MET H H 1 7.570 0.02 . 1 . . . . 29 MET H . 15070 1 119 . 1 1 29 29 MET C C 13 177.1 0.2 . 1 . . . . 29 MET C . 15070 1 120 . 1 1 29 29 MET CA C 13 53.00 0.2 . 1 . . . . 29 MET CA . 15070 1 121 . 1 1 29 29 MET CB C 13 26.57 0.2 . 1 . . . . 29 MET CB . 15070 1 122 . 1 1 30 30 SER H H 1 8.051 0.02 . 1 . . . . 30 SER H . 15070 1 123 . 1 1 30 30 SER C C 13 175.5 0.2 . 1 . . . . 30 SER C . 15070 1 124 . 1 1 30 30 SER CA C 13 58.26 0.2 . 1 . . . . 30 SER CA . 15070 1 125 . 1 1 30 30 SER CB C 13 59.88 0.2 . 1 . . . . 30 SER CB . 15070 1 126 . 1 1 30 30 SER N N 15 114.2 0.2 . 1 . . . . 30 SER N . 15070 1 127 . 1 1 31 31 ASP H H 1 8.587 0.02 . 1 . . . . 31 ASP H . 15070 1 128 . 1 1 31 31 ASP CA C 13 54.44 0.2 . 1 . . . . 31 ASP CA . 15070 1 129 . 1 1 31 31 ASP CB C 13 36.14 0.2 . 1 . . . . 31 ASP CB . 15070 1 130 . 1 1 31 31 ASP N N 15 120.0 0.2 . 1 . . . . 31 ASP N . 15070 1 131 . 1 1 32 32 LEU C C 13 176.6 0.2 . 1 . . . . 32 LEU C . 15070 1 132 . 1 1 32 32 LEU CA C 13 54.32 0.2 . 1 . . . . 32 LEU CA . 15070 1 133 . 1 1 33 33 LEU H H 1 7.973 0.02 . 1 . . . . 33 LEU H . 15070 1 134 . 1 1 33 33 LEU C C 13 176.0 0.2 . 1 . . . . 33 LEU C . 15070 1 135 . 1 1 33 33 LEU CA C 13 54.57 0.2 . 1 . . . . 33 LEU CA . 15070 1 136 . 1 1 33 33 LEU CB C 13 38.02 0.2 . 1 . . . . 33 LEU CB . 15070 1 137 . 1 1 33 33 LEU N N 15 120.1 0.2 . 1 . . . . 33 LEU N . 15070 1 138 . 1 1 34 34 LYS H H 1 7.603 0.02 . 1 . . . . 34 LYS H . 15070 1 139 . 1 1 34 34 LYS C C 13 175.8 0.2 . 1 . . . . 34 LYS C . 15070 1 140 . 1 1 34 34 LYS CA C 13 52.86 0.2 . 1 . . . . 34 LYS CA . 15070 1 141 . 1 1 34 34 LYS CB C 13 29.69 0.2 . 1 . . . . 34 LYS CB . 15070 1 142 . 1 1 34 34 LYS N N 15 114.3 0.2 . 1 . . . . 34 LYS N . 15070 1 143 . 1 1 35 35 GLY H H 1 7.098 0.02 . 1 . . . . 35 GLY H . 15070 1 144 . 1 1 35 35 GLY C C 13 173.6 0.2 . 1 . . . . 35 GLY C . 15070 1 145 . 1 1 35 35 GLY CA C 13 42.63 0.2 . 1 . . . . 35 GLY CA . 15070 1 146 . 1 1 35 35 GLY N N 15 106.2 0.2 . 1 . . . . 35 GLY N . 15070 1 147 . 1 1 36 36 ARG H H 1 7.963 0.02 . 1 . . . . 36 ARG H . 15070 1 148 . 1 1 36 36 ARG C C 13 174.9 0.2 . 1 . . . . 36 ARG C . 15070 1 149 . 1 1 36 36 ARG CA C 13 53.36 0.2 . 1 . . . . 36 ARG CA . 15070 1 150 . 1 1 36 36 ARG CB C 13 27.86 0.2 . 1 . . . . 36 ARG CB . 15070 1 151 . 1 1 36 36 ARG N N 15 115.9 0.2 . 1 . . . . 36 ARG N . 15070 1 152 . 1 1 37 37 LEU H H 1 7.413 0.02 . 1 . . . . 37 LEU H . 15070 1 153 . 1 1 37 37 LEU C C 13 172.3 0.2 . 1 . . . . 37 LEU C . 15070 1 154 . 1 1 37 37 LEU CA C 13 49.28 0.2 . 1 . . . . 37 LEU CA . 15070 1 155 . 1 1 37 37 LEU CB C 13 37.06 0.2 . 1 . . . . 37 LEU CB . 15070 1 156 . 1 1 37 37 LEU N N 15 118.7 0.2 . 1 . . . . 37 LEU N . 15070 1 157 . 1 1 38 38 GLY H H 1 6.975 0.02 . 1 . . . . 38 GLY H . 15070 1 158 . 1 1 38 38 GLY C C 13 170.8 0.2 . 1 . . . . 38 GLY C . 15070 1 159 . 1 1 38 38 GLY CA C 13 41.81 0.2 . 1 . . . . 38 GLY CA . 15070 1 160 . 1 1 38 38 GLY N N 15 109.2 0.2 . 1 . . . . 38 GLY N . 15070 1 161 . 1 1 39 39 VAL H H 1 8.537 0.02 . 1 . . . . 39 VAL H . 15070 1 162 . 1 1 39 39 VAL C C 13 177.1 0.2 . 1 . . . . 39 VAL C . 15070 1 163 . 1 1 39 39 VAL CA C 13 62.43 0.2 . 1 . . . . 39 VAL CA . 15070 1 164 . 1 1 39 39 VAL CB C 13 28.79 0.2 . 1 . . . . 39 VAL CB . 15070 1 165 . 1 1 39 39 VAL N N 15 118.4 0.2 . 1 . . . . 39 VAL N . 15070 1 166 . 1 1 40 40 ALA H H 1 9.007 0.02 . 1 . . . . 40 ALA H . 15070 1 167 . 1 1 40 40 ALA C C 13 178.5 0.2 . 1 . . . . 40 ALA C . 15070 1 168 . 1 1 40 40 ALA CA C 13 52.72 0.2 . 1 . . . . 40 ALA CA . 15070 1 169 . 1 1 40 40 ALA CB C 13 14.74 0.2 . 1 . . . . 40 ALA CB . 15070 1 170 . 1 1 40 40 ALA N N 15 126.7 0.2 . 1 . . . . 40 ALA N . 15070 1 171 . 1 1 41 41 GLU H H 1 8.589 0.02 . 1 . . . . 41 GLU H . 15070 1 172 . 1 1 41 41 GLU C C 13 177.2 0.2 . 1 . . . . 41 GLU C . 15070 1 173 . 1 1 41 41 GLU CA C 13 56.72 0.2 . 1 . . . . 41 GLU CA . 15070 1 174 . 1 1 41 41 GLU CB C 13 25.03 0.2 . 1 . . . . 41 GLU CB . 15070 1 175 . 1 1 41 41 GLU N N 15 118.1 0.2 . 1 . . . . 41 GLU N . 15070 1 176 . 1 1 42 42 PHE H H 1 7.524 0.02 . 1 . . . . 42 PHE H . 15070 1 177 . 1 1 42 42 PHE C C 13 174.6 0.2 . 1 . . . . 42 PHE C . 15070 1 178 . 1 1 42 42 PHE CA C 13 57.56 0.2 . 1 . . . . 42 PHE CA . 15070 1 179 . 1 1 42 42 PHE CB C 13 37.83 0.2 . 1 . . . . 42 PHE CB . 15070 1 180 . 1 1 42 42 PHE N N 15 118.1 0.2 . 1 . . . . 42 PHE N . 15070 1 181 . 1 1 43 43 THR H H 1 8.558 0.02 . 1 . . . . 43 THR H . 15070 1 182 . 1 1 43 43 THR CA C 13 64.31 0.2 . 1 . . . . 43 THR CA . 15070 1 183 . 1 1 43 43 THR CB C 13 68.41 0.2 . 1 . . . . 43 THR CB . 15070 1 184 . 1 1 43 43 THR N N 15 115.3 0.2 . 1 . . . . 43 THR N . 15070 1 185 . 1 1 44 44 ARG C C 13 178.1 0.2 . 1 . . . . 44 ARG C . 15070 1 186 . 1 1 44 44 ARG CA C 13 56.10 0.2 . 1 . . . . 44 ARG CA . 15070 1 187 . 1 1 45 45 LEU H H 1 7.682 0.02 . 1 . . . . 45 LEU H . 15070 1 188 . 1 1 45 45 LEU C C 13 175.8 0.2 . 1 . . . . 45 LEU C . 15070 1 189 . 1 1 45 45 LEU CA C 13 55.72 0.2 . 1 . . . . 45 LEU CA . 15070 1 190 . 1 1 45 45 LEU CB C 13 37.49 0.2 . 1 . . . . 45 LEU CB . 15070 1 191 . 1 1 45 45 LEU N N 15 120.0 0.2 . 1 . . . . 45 LEU N . 15070 1 192 . 1 1 46 46 GLN H H 1 7.676 0.02 . 1 . . . . 46 GLN H . 15070 1 193 . 1 1 46 46 GLN C C 13 177.4 0.2 . 1 . . . . 46 GLN C . 15070 1 194 . 1 1 46 46 GLN CA C 13 53.63 0.2 . 1 . . . . 46 GLN CA . 15070 1 195 . 1 1 46 46 GLN CB C 13 25.20 0.2 . 1 . . . . 46 GLN CB . 15070 1 196 . 1 1 46 46 GLN N N 15 116.6 0.2 . 1 . . . . 46 GLN N . 15070 1 197 . 1 1 47 47 GLU H H 1 8.301 0.02 . 1 . . . . 47 GLU H . 15070 1 198 . 1 1 47 47 GLU C C 13 177.2 0.2 . 1 . . . . 47 GLU C . 15070 1 199 . 1 1 47 47 GLU CA C 13 56.51 0.2 . 1 . . . . 47 GLU CA . 15070 1 200 . 1 1 47 47 GLU CB C 13 26.81 0.2 . 1 . . . . 47 GLU CB . 15070 1 201 . 1 1 47 47 GLU N N 15 120.2 0.2 . 1 . . . . 47 GLU N . 15070 1 202 . 1 1 48 48 GLN H H 1 7.499 0.02 . 1 . . . . 48 GLN H . 15070 1 203 . 1 1 48 48 GLN C C 13 177.1 0.2 . 1 . . . . 48 GLN C . 15070 1 204 . 1 1 48 48 GLN CA C 13 55.02 0.2 . 1 . . . . 48 GLN CA . 15070 1 205 . 1 1 48 48 GLN CB C 13 24.50 0.2 . 1 . . . . 48 GLN CB . 15070 1 206 . 1 1 48 48 GLN N N 15 114.4 0.2 . 1 . . . . 48 GLN N . 15070 1 207 . 1 1 49 49 ALA H H 1 8.554 0.02 . 1 . . . . 49 ALA H . 15070 1 208 . 1 1 49 49 ALA C C 13 177.9 0.2 . 1 . . . . 49 ALA C . 15070 1 209 . 1 1 49 49 ALA CA C 13 50.39 0.2 . 1 . . . . 49 ALA CA . 15070 1 210 . 1 1 49 49 ALA CB C 13 13.43 0.2 . 1 . . . . 49 ALA CB . 15070 1 211 . 1 1 49 49 ALA N N 15 119.6 0.2 . 1 . . . . 49 ALA N . 15070 1 212 . 1 1 50 50 TRP H H 1 8.669 0.02 . 1 . . . . 50 TRP H . 15070 1 213 . 1 1 50 50 TRP C C 13 178.1 0.2 . 1 . . . . 50 TRP C . 15070 1 214 . 1 1 50 50 TRP CA C 13 60.76 0.2 . 1 . . . . 50 TRP CA . 15070 1 215 . 1 1 50 50 TRP CB C 13 24.51 0.2 . 1 . . . . 50 TRP CB . 15070 1 216 . 1 1 50 50 TRP N N 15 121.5 0.2 . 1 . . . . 50 TRP N . 15070 1 217 . 1 1 51 51 LEU H H 1 7.514 0.02 . 1 . . . . 51 LEU H . 15070 1 218 . 1 1 51 51 LEU C C 13 179.3 0.2 . 1 . . . . 51 LEU C . 15070 1 219 . 1 1 51 51 LEU CA C 13 55.10 0.2 . 1 . . . . 51 LEU CA . 15070 1 220 . 1 1 51 51 LEU CB C 13 38.55 0.2 . 1 . . . . 51 LEU CB . 15070 1 221 . 1 1 51 51 LEU N N 15 119.0 0.2 . 1 . . . . 51 LEU N . 15070 1 222 . 1 1 52 52 PHE H H 1 7.846 0.02 . 1 . . . . 52 PHE H . 15070 1 223 . 1 1 52 52 PHE C C 13 176.8 0.2 . 1 . . . . 52 PHE C . 15070 1 224 . 1 1 52 52 PHE CA C 13 56.28 0.2 . 1 . . . . 52 PHE CA . 15070 1 225 . 1 1 52 52 PHE CB C 13 35.68 0.2 . 1 . . . . 52 PHE CB . 15070 1 226 . 1 1 52 52 PHE N N 15 114.7 0.2 . 1 . . . . 52 PHE N . 15070 1 227 . 1 1 53 53 TYR H H 1 9.892 0.02 . 1 . . . . 53 TYR H . 15070 1 228 . 1 1 53 53 TYR C C 13 177.5 0.2 . 1 . . . . 53 TYR C . 15070 1 229 . 1 1 53 53 TYR CA C 13 61.81 0.2 . 1 . . . . 53 TYR CA . 15070 1 230 . 1 1 53 53 TYR CB C 13 33.26 0.2 . 1 . . . . 53 TYR CB . 15070 1 231 . 1 1 53 53 TYR N N 15 124.2 0.2 . 1 . . . . 53 TYR N . 15070 1 232 . 1 1 54 54 THR H H 1 7.677 0.02 . 1 . . . . 54 THR H . 15070 1 233 . 1 1 54 54 THR C C 13 175.3 0.2 . 1 . . . . 54 THR C . 15070 1 234 . 1 1 54 54 THR CA C 13 64.83 0.2 . 1 . . . . 54 THR CA . 15070 1 235 . 1 1 54 54 THR N N 15 115.9 0.2 . 1 . . . . 54 THR N . 15070 1 236 . 1 1 55 55 ALA H H 1 6.746 0.02 . 1 . . . . 55 ALA H . 15070 1 237 . 1 1 55 55 ALA C C 13 178.5 0.2 . 1 . . . . 55 ALA C . 15070 1 238 . 1 1 55 55 ALA CA C 13 51.91 0.2 . 1 . . . . 55 ALA CA . 15070 1 239 . 1 1 55 55 ALA CB C 13 16.88 0.2 . 1 . . . . 55 ALA CB . 15070 1 240 . 1 1 55 55 ALA N N 15 122.0 0.2 . 1 . . . . 55 ALA N . 15070 1 241 . 1 1 56 56 LEU H H 1 8.759 0.02 . 1 . . . . 56 LEU H . 15070 1 242 . 1 1 56 56 LEU C C 13 177.3 0.2 . 1 . . . . 56 LEU C . 15070 1 243 . 1 1 56 56 LEU CA C 13 55.08 0.2 . 1 . . . . 56 LEU CA . 15070 1 244 . 1 1 56 56 LEU CB C 13 39.03 0.2 . 1 . . . . 56 LEU CB . 15070 1 245 . 1 1 56 56 LEU N N 15 120.5 0.2 . 1 . . . . 56 LEU N . 15070 1 246 . 1 1 57 57 GLU H H 1 8.634 0.02 . 1 . . . . 57 GLU H . 15070 1 247 . 1 1 57 57 GLU C C 13 177.5 0.2 . 1 . . . . 57 GLU C . 15070 1 248 . 1 1 57 57 GLU CA C 13 57.25 0.2 . 1 . . . . 57 GLU CA . 15070 1 249 . 1 1 57 57 GLU CB C 13 24.33 0.2 . 1 . . . . 57 GLU CB . 15070 1 250 . 1 1 57 57 GLU N N 15 118.0 0.2 . 1 . . . . 57 GLU N . 15070 1 251 . 1 1 58 58 GLN CA C 13 56.00 0.2 . 1 . . . . 58 GLN CA . 15070 1 252 . 1 1 58 58 GLN H H 1 7.607 0.02 . 1 . . . . 58 GLN H . 15070 1 253 . 1 1 58 58 GLN C C 13 179.0 0.2 . 1 . . . . 58 GLN C . 15070 1 254 . 1 1 58 58 GLN CB C 13 25.42 0.2 . 1 . . . . 58 GLN CB . 15070 1 255 . 1 1 58 58 GLN N N 15 119.2 0.2 . 1 . . . . 58 GLN N . 15070 1 256 . 1 1 59 59 ALA H H 1 7.733 0.02 . 1 . . . . 59 ALA H . 15070 1 257 . 1 1 59 59 ALA C C 13 177.6 0.2 . 1 . . . . 59 ALA C . 15070 1 258 . 1 1 59 59 ALA CA C 13 53.04 0.2 . 1 . . . . 59 ALA CA . 15070 1 259 . 1 1 59 59 ALA CB C 13 14.47 0.2 . 1 . . . . 59 ALA CB . 15070 1 260 . 1 1 59 59 ALA N N 15 123.7 0.2 . 1 . . . . 59 ALA N . 15070 1 261 . 1 1 60 60 VAL H H 1 9.419 0.02 . 1 . . . . 60 VAL H . 15070 1 262 . 1 1 60 60 VAL C C 13 176.7 0.2 . 1 . . . . 60 VAL C . 15070 1 263 . 1 1 60 60 VAL CA C 13 63.55 0.2 . 1 . . . . 60 VAL CA . 15070 1 264 . 1 1 60 60 VAL CB C 13 28.72 0.2 . 1 . . . . 60 VAL CB . 15070 1 265 . 1 1 60 60 VAL N N 15 119.7 0.2 . 1 . . . . 60 VAL N . 15070 1 266 . 1 1 61 61 ASP H H 1 8.257 0.02 . 1 . . . . 61 ASP H . 15070 1 267 . 1 1 61 61 ASP C C 13 178.3 0.2 . 1 . . . . 61 ASP C . 15070 1 268 . 1 1 61 61 ASP CA C 13 54.27 0.2 . 1 . . . . 61 ASP CA . 15070 1 269 . 1 1 61 61 ASP CB C 13 36.94 0.2 . 1 . . . . 61 ASP CB . 15070 1 270 . 1 1 61 61 ASP N N 15 118.5 0.2 . 1 . . . . 61 ASP N . 15070 1 271 . 1 1 62 62 ALA H H 1 7.578 0.02 . 1 . . . . 62 ALA H . 15070 1 272 . 1 1 62 62 ALA C C 13 179.1 0.2 . 1 . . . . 62 ALA C . 15070 1 273 . 1 1 62 62 ALA CA C 13 52.05 0.2 . 1 . . . . 62 ALA CA . 15070 1 274 . 1 1 62 62 ALA CB C 13 16.00 0.2 . 1 . . . . 62 ALA CB . 15070 1 275 . 1 1 62 62 ALA N N 15 121.6 0.2 . 1 . . . . 62 ALA N . 15070 1 276 . 1 1 63 63 VAL H H 1 8.398 0.02 . 1 . . . . 63 VAL H . 15070 1 277 . 1 1 63 63 VAL C C 13 178.8 0.2 . 1 . . . . 63 VAL C . 15070 1 278 . 1 1 63 63 VAL CA C 13 63.44 0.2 . 1 . . . . 63 VAL CA . 15070 1 279 . 1 1 63 63 VAL CB C 13 28.84 0.2 . 1 . . . . 63 VAL CB . 15070 1 280 . 1 1 63 63 VAL N N 15 119.0 0.2 . 1 . . . . 63 VAL N . 15070 1 281 . 1 1 64 64 ARG H H 1 9.806 0.02 . 1 . . . . 64 ARG H . 15070 1 282 . 1 1 64 64 ARG C C 13 178.8 0.2 . 1 . . . . 64 ARG C . 15070 1 283 . 1 1 64 64 ARG CA C 13 57.41 0.2 . 1 . . . . 64 ARG CA . 15070 1 284 . 1 1 64 64 ARG CB C 13 27.14 0.2 . 1 . . . . 64 ARG CB . 15070 1 285 . 1 1 64 64 ARG N N 15 124.8 0.2 . 1 . . . . 64 ARG N . 15070 1 286 . 1 1 65 65 ALA H H 1 7.875 0.02 . 1 . . . . 65 ALA H . 15070 1 287 . 1 1 65 65 ALA C C 13 177.4 0.2 . 1 . . . . 65 ALA C . 15070 1 288 . 1 1 65 65 ALA CA C 13 51.67 0.2 . 1 . . . . 65 ALA CA . 15070 1 289 . 1 1 65 65 ALA CB C 13 15.08 0.2 . 1 . . . . 65 ALA CB . 15070 1 290 . 1 1 65 65 ALA N N 15 119.8 0.2 . 1 . . . . 65 ALA N . 15070 1 291 . 1 1 66 66 SER H H 1 7.650 0.02 . 1 . . . . 66 SER H . 15070 1 292 . 1 1 66 66 SER C C 13 173.6 0.2 . 1 . . . . 66 SER C . 15070 1 293 . 1 1 66 66 SER CA C 13 56.58 0.2 . 1 . . . . 66 SER CA . 15070 1 294 . 1 1 66 66 SER CB C 13 62.33 0.2 . 1 . . . . 66 SER CB . 15070 1 295 . 1 1 66 66 SER N N 15 113.2 0.2 . 1 . . . . 66 SER N . 15070 1 296 . 1 1 67 67 GLY H H 1 8.094 0.02 . 1 . . . . 67 GLY H . 15070 1 297 . 1 1 67 67 GLY C C 13 172.1 0.2 . 1 . . . . 67 GLY C . 15070 1 298 . 1 1 67 67 GLY CA C 13 42.53 0.2 . 1 . . . . 67 GLY CA . 15070 1 299 . 1 1 67 67 GLY N N 15 110.8 0.2 . 1 . . . . 67 GLY N . 15070 1 300 . 1 1 68 68 PHE H H 1 7.163 0.02 . 1 . . . . 68 PHE H . 15070 1 301 . 1 1 68 68 PHE C C 13 171.5 0.2 . 1 . . . . 68 PHE C . 15070 1 302 . 1 1 68 68 PHE CA C 13 54.86 0.2 . 1 . . . . 68 PHE CA . 15070 1 303 . 1 1 68 68 PHE CB C 13 37.76 0.2 . 1 . . . . 68 PHE CB . 15070 1 304 . 1 1 68 68 PHE N N 15 123.2 0.2 . 1 . . . . 68 PHE N . 15070 1 305 . 1 1 69 69 ALA H H 1 8.102 0.02 . 1 . . . . 69 ALA H . 15070 1 306 . 1 1 69 69 ALA C C 13 176.7 0.2 . 1 . . . . 69 ALA C . 15070 1 307 . 1 1 69 69 ALA CA C 13 48.88 0.2 . 1 . . . . 69 ALA CA . 15070 1 308 . 1 1 69 69 ALA CB C 13 14.45 0.2 . 1 . . . . 69 ALA CB . 15070 1 309 . 1 1 69 69 ALA N N 15 122.7 0.2 . 1 . . . . 69 ALA N . 15070 1 310 . 1 1 70 70 GLU H H 1 7.623 0.02 . 1 . . . . 70 GLU H . 15070 1 311 . 1 1 70 70 GLU C C 13 177.5 0.2 . 1 . . . . 70 GLU C . 15070 1 312 . 1 1 70 70 GLU CA C 13 58.28 0.2 . 1 . . . . 70 GLU CA . 15070 1 313 . 1 1 70 70 GLU CB C 13 26.70 0.2 . 1 . . . . 70 GLU CB . 15070 1 314 . 1 1 70 70 GLU N N 15 115.6 0.2 . 1 . . . . 70 GLU N . 15070 1 315 . 1 1 71 71 SER H H 1 8.264 0.02 . 1 . . . . 71 SER H . 15070 1 316 . 1 1 71 71 SER C C 13 175.1 0.2 . 1 . . . . 71 SER C . 15070 1 317 . 1 1 71 71 SER CA C 13 56.79 0.2 . 1 . . . . 71 SER CA . 15070 1 318 . 1 1 71 71 SER CB C 13 60.02 0.2 . 1 . . . . 71 SER CB . 15070 1 319 . 1 1 71 71 SER N N 15 110.2 0.2 . 1 . . . . 71 SER N . 15070 1 320 . 1 1 72 72 LEU H H 1 7.455 0.02 . 1 . . . . 72 LEU H . 15070 1 321 . 1 1 72 72 LEU C C 13 177.6 0.2 . 1 . . . . 72 LEU C . 15070 1 322 . 1 1 72 72 LEU CA C 13 53.95 0.2 . 1 . . . . 72 LEU CA . 15070 1 323 . 1 1 72 72 LEU CB C 13 39.95 0.2 . 1 . . . . 72 LEU CB . 15070 1 324 . 1 1 72 72 LEU N N 15 121.7 0.2 . 1 . . . . 72 LEU N . 15070 1 325 . 1 1 73 73 LEU H H 1 7.129 0.02 . 1 . . . . 73 LEU H . 15070 1 326 . 1 1 73 73 LEU CA C 13 49.73 0.2 . 1 . . . . 73 LEU CA . 15070 1 327 . 1 1 73 73 LEU CB C 13 34.04 0.2 . 1 . . . . 73 LEU CB . 15070 1 328 . 1 1 73 73 LEU N N 15 120.3 0.2 . 1 . . . . 73 LEU N . 15070 1 329 . 1 1 74 74 ASP H H 1 7.754 0.02 . 1 . . . . 74 ASP H . 15070 1 330 . 1 1 74 74 ASP C C 13 175.5 0.2 . 1 . . . . 74 ASP C . 15070 1 331 . 1 1 74 74 ASP CA C 13 48.57 0.2 . 1 . . . . 74 ASP CA . 15070 1 332 . 1 1 74 74 ASP CB C 13 39.72 0.2 . 1 . . . . 74 ASP CB . 15070 1 333 . 1 1 74 74 ASP N N 15 123.5 0.2 . 1 . . . . 74 ASP N . 15070 1 334 . 1 1 75 75 PRO C C 13 176.8 0.2 . 1 . . . . 75 PRO C . 15070 1 335 . 1 1 75 75 PRO CA C 13 61.43 0.2 . 1 . . . . 75 PRO CA . 15070 1 336 . 1 1 75 75 PRO CB C 13 28.70 0.2 . 1 . . . . 75 PRO CB . 15070 1 337 . 1 1 76 76 ALA H H 1 8.378 0.02 . 1 . . . . 76 ALA H . 15070 1 338 . 1 1 76 76 ALA C C 13 177.8 0.2 . 1 . . . . 76 ALA C . 15070 1 339 . 1 1 76 76 ALA CA C 13 51.14 0.2 . 1 . . . . 76 ALA CA . 15070 1 340 . 1 1 76 76 ALA CB C 13 15.30 0.2 . 1 . . . . 76 ALA CB . 15070 1 341 . 1 1 76 76 ALA N N 15 121.8 0.2 . 1 . . . . 76 ALA N . 15070 1 342 . 1 1 77 77 LEU H H 1 7.483 0.02 . 1 . . . . 77 LEU H . 15070 1 343 . 1 1 77 77 LEU C C 13 175.7 0.2 . 1 . . . . 77 LEU C . 15070 1 344 . 1 1 77 77 LEU CA C 13 52.29 0.2 . 1 . . . . 77 LEU CA . 15070 1 345 . 1 1 77 77 LEU CB C 13 37.57 0.2 . 1 . . . . 77 LEU CB . 15070 1 346 . 1 1 77 77 LEU N N 15 114.2 0.2 . 1 . . . . 77 LEU N . 15070 1 347 . 1 1 78 78 ASN H H 1 7.287 0.02 . 1 . . . . 78 ASN H . 15070 1 348 . 1 1 78 78 ASN C C 13 177.1 0.2 . 1 . . . . 78 ASN C . 15070 1 349 . 1 1 78 78 ASN CA C 13 51.32 0.2 . 1 . . . . 78 ASN CA . 15070 1 350 . 1 1 78 78 ASN CB C 13 35.06 0.2 . 1 . . . . 78 ASN CB . 15070 1 351 . 1 1 78 78 ASN N N 15 115.6 0.2 . 1 . . . . 78 ASN N . 15070 1 352 . 1 1 79 79 ARG H H 1 12.48 0.02 . 1 . . . . 79 ARG H . 15070 1 353 . 1 1 79 79 ARG C C 13 176.7 0.2 . 1 . . . . 79 ARG C . 15070 1 354 . 1 1 79 79 ARG CA C 13 52.47 0.2 . 1 . . . . 79 ARG CA . 15070 1 355 . 1 1 79 79 ARG N N 15 126.3 0.2 . 1 . . . . 79 ARG N . 15070 1 356 . 1 1 80 80 ALA H H 1 10.24 0.02 . 1 . . . . 80 ALA H . 15070 1 357 . 1 1 80 80 ALA C C 13 178.4 0.2 . 1 . . . . 80 ALA C . 15070 1 358 . 1 1 80 80 ALA CA C 13 55.18 0.2 . 1 . . . . 80 ALA CA . 15070 1 359 . 1 1 80 80 ALA CB C 13 15.45 0.2 . 1 . . . . 80 ALA CB . 15070 1 360 . 1 1 80 80 ALA N N 15 125.6 0.2 . 1 . . . . 80 ALA N . 15070 1 361 . 1 1 81 81 GLU H H 1 8.561 0.02 . 1 . . . . 81 GLU H . 15070 1 362 . 1 1 81 81 GLU C C 13 178.4 0.2 . 1 . . . . 81 GLU C . 15070 1 363 . 1 1 81 81 GLU CA C 13 56.30 0.2 . 1 . . . . 81 GLU CA . 15070 1 364 . 1 1 81 81 GLU CB C 13 26.09 0.2 . 1 . . . . 81 GLU CB . 15070 1 365 . 1 1 81 81 GLU N N 15 115.1 0.2 . 1 . . . . 81 GLU N . 15070 1 366 . 1 1 82 82 VAL H H 1 7.772 0.02 . 1 . . . . 82 VAL H . 15070 1 367 . 1 1 82 82 VAL C C 13 176.6 0.2 . 1 . . . . 82 VAL C . 15070 1 368 . 1 1 82 82 VAL CA C 13 62.81 0.2 . 1 . . . . 82 VAL CA . 15070 1 369 . 1 1 82 82 VAL CB C 13 29.02 0.2 . 1 . . . . 82 VAL CB . 15070 1 370 . 1 1 82 82 VAL N N 15 120.8 0.2 . 1 . . . . 82 VAL N . 15070 1 371 . 1 1 83 83 LEU H H 1 8.712 0.02 . 1 . . . . 83 LEU H . 15070 1 372 . 1 1 83 83 LEU C C 13 174.1 0.2 . 1 . . . . 83 LEU C . 15070 1 373 . 1 1 83 83 LEU CA C 13 55.08 0.2 . 1 . . . . 83 LEU CA . 15070 1 374 . 1 1 83 83 LEU CB C 13 39.55 0.2 . 1 . . . . 83 LEU CB . 15070 1 375 . 1 1 83 83 LEU N N 15 121.4 0.2 . 1 . . . . 83 LEU N . 15070 1 376 . 1 1 84 84 ALA H H 1 7.969 0.02 . 1 . . . . 84 ALA H . 15070 1 377 . 1 1 84 84 ALA C C 13 177.6 0.2 . 1 . . . . 84 ALA C . 15070 1 378 . 1 1 84 84 ALA CA C 13 52.08 0.2 . 1 . . . . 84 ALA CA . 15070 1 379 . 1 1 84 84 ALA CB C 13 14.67 0.2 . 1 . . . . 84 ALA CB . 15070 1 380 . 1 1 84 84 ALA N N 15 119.5 0.2 . 1 . . . . 84 ALA N . 15070 1 381 . 1 1 85 85 ARG H H 1 7.377 0.02 . 1 . . . . 85 ARG H . 15070 1 382 . 1 1 85 85 ARG C C 13 178.8 0.2 . 1 . . . . 85 ARG C . 15070 1 383 . 1 1 85 85 ARG CA C 13 56.80 0.2 . 1 . . . . 85 ARG CA . 15070 1 384 . 1 1 85 85 ARG CB C 13 27.03 0.2 . 1 . . . . 85 ARG CB . 15070 1 385 . 1 1 85 85 ARG N N 15 116.5 0.2 . 1 . . . . 85 ARG N . 15070 1 386 . 1 1 86 86 ASP H H 1 8.425 0.02 . 1 . . . . 86 ASP H . 15070 1 387 . 1 1 86 86 ASP C C 13 178.0 0.2 . 1 . . . . 86 ASP C . 15070 1 388 . 1 1 86 86 ASP CA C 13 55.25 0.2 . 1 . . . . 86 ASP CA . 15070 1 389 . 1 1 86 86 ASP CB C 13 36.89 0.2 . 1 . . . . 86 ASP CB . 15070 1 390 . 1 1 86 86 ASP N N 15 122.9 0.2 . 1 . . . . 86 ASP N . 15070 1 391 . 1 1 87 87 LEU H H 1 8.441 0.02 . 1 . . . . 87 LEU H . 15070 1 392 . 1 1 87 87 LEU C C 13 178.8 0.2 . 1 . . . . 87 LEU C . 15070 1 393 . 1 1 87 87 LEU CA C 13 54.89 0.2 . 1 . . . . 87 LEU CA . 15070 1 394 . 1 1 87 87 LEU CB C 13 38.06 0.2 . 1 . . . . 87 LEU CB . 15070 1 395 . 1 1 87 87 LEU N N 15 120.5 0.2 . 1 . . . . 87 LEU N . 15070 1 396 . 1 1 88 88 ASP H H 1 8.502 0.02 . 1 . . . . 88 ASP H . 15070 1 397 . 1 1 88 88 ASP C C 13 178.8 0.2 . 1 . . . . 88 ASP C . 15070 1 398 . 1 1 88 88 ASP CA C 13 54.07 0.2 . 1 . . . . 88 ASP CA . 15070 1 399 . 1 1 88 88 ASP CB C 13 36.82 0.2 . 1 . . . . 88 ASP CB . 15070 1 400 . 1 1 88 88 ASP N N 15 122.2 0.2 . 1 . . . . 88 ASP N . 15070 1 401 . 1 1 89 89 LYS H H 1 7.534 0.02 . 1 . . . . 89 LYS H . 15070 1 402 . 1 1 89 89 LYS C C 13 178.7 0.2 . 1 . . . . 89 LYS C . 15070 1 403 . 1 1 89 89 LYS CA C 13 55.26 0.2 . 1 . . . . 89 LYS CA . 15070 1 404 . 1 1 89 89 LYS CB C 13 28.93 0.2 . 1 . . . . 89 LYS CB . 15070 1 405 . 1 1 89 89 LYS N N 15 120.1 0.2 . 1 . . . . 89 LYS N . 15070 1 406 . 1 1 90 90 LEU H H 1 9.153 0.02 . 1 . . . . 90 LEU H . 15070 1 407 . 1 1 90 90 LEU C C 13 178.0 0.2 . 1 . . . . 90 LEU C . 15070 1 408 . 1 1 90 90 LEU CA C 13 54.99 0.2 . 1 . . . . 90 LEU CA . 15070 1 409 . 1 1 90 90 LEU CB C 13 39.60 0.2 . 1 . . . . 90 LEU CB . 15070 1 410 . 1 1 90 90 LEU N N 15 121.5 0.2 . 1 . . . . 90 LEU N . 15070 1 411 . 1 1 91 91 ASN H H 1 8.541 0.02 . 1 . . . . 91 ASN H . 15070 1 412 . 1 1 91 91 ASN C C 13 175.4 0.2 . 1 . . . . 91 ASN C . 15070 1 413 . 1 1 91 91 ASN CA C 13 51.78 0.2 . 1 . . . . 91 ASN CA . 15070 1 414 . 1 1 91 91 ASN CB C 13 37.59 0.2 . 1 . . . . 91 ASN CB . 15070 1 415 . 1 1 91 91 ASN N N 15 112.8 0.2 . 1 . . . . 91 ASN N . 15070 1 416 . 1 1 92 92 GLY H H 1 7.711 0.02 . 1 . . . . 92 GLY H . 15070 1 417 . 1 1 92 92 GLY C C 13 171.7 0.2 . 1 . . . . 92 GLY C . 15070 1 418 . 1 1 92 92 GLY CA C 13 43.37 0.2 . 1 . . . . 92 GLY CA . 15070 1 419 . 1 1 92 92 GLY N N 15 109.8 0.2 . 1 . . . . 92 GLY N . 15070 1 420 . 1 1 93 93 SER H H 1 7.993 0.02 . 1 . . . . 93 SER H . 15070 1 421 . 1 1 93 93 SER C C 13 171.7 0.2 . 1 . . . . 93 SER C . 15070 1 422 . 1 1 93 93 SER CA C 13 54.25 0.2 . 1 . . . . 93 SER CA . 15070 1 423 . 1 1 93 93 SER CB C 13 61.40 0.2 . 1 . . . . 93 SER CB . 15070 1 424 . 1 1 93 93 SER N N 15 112.1 0.2 . 1 . . . . 93 SER N . 15070 1 425 . 1 1 94 94 SER H H 1 8.486 0.02 . 1 . . . . 94 SER H . 15070 1 426 . 1 1 94 94 SER C C 13 175.2 0.2 . 1 . . . . 94 SER C . 15070 1 427 . 1 1 94 94 SER CA C 13 55.47 0.2 . 1 . . . . 94 SER CA . 15070 1 428 . 1 1 94 94 SER CB C 13 61.19 0.2 . 1 . . . . 94 SER CB . 15070 1 429 . 1 1 94 94 SER N N 15 113.0 0.2 . 1 . . . . 94 SER N . 15070 1 430 . 1 1 95 95 GLU H H 1 8.292 0.02 . 1 . . . . 95 GLU H . 15070 1 431 . 1 1 95 95 GLU C C 13 175.3 0.2 . 1 . . . . 95 GLU C . 15070 1 432 . 1 1 95 95 GLU CA C 13 55.31 0.2 . 1 . . . . 95 GLU CA . 15070 1 433 . 1 1 95 95 GLU CB C 13 26.01 0.2 . 1 . . . . 95 GLU CB . 15070 1 434 . 1 1 95 95 GLU N N 15 121.6 0.2 . 1 . . . . 95 GLU N . 15070 1 435 . 1 1 96 96 TRP H H 1 7.259 0.02 . 1 . . . . 96 TRP H . 15070 1 436 . 1 1 96 96 TRP C C 13 176.0 0.2 . 1 . . . . 96 TRP C . 15070 1 437 . 1 1 96 96 TRP CA C 13 54.90 0.2 . 1 . . . . 96 TRP CA . 15070 1 438 . 1 1 96 96 TRP CB C 13 25.70 0.2 . 1 . . . . 96 TRP CB . 15070 1 439 . 1 1 96 96 TRP N N 15 118.9 0.2 . 1 . . . . 96 TRP N . 15070 1 440 . 1 1 97 97 ARG H H 1 5.991 0.02 . 1 . . . . 97 ARG H . 15070 1 441 . 1 1 97 97 ARG C C 13 176.5 0.2 . 1 . . . . 97 ARG C . 15070 1 442 . 1 1 97 97 ARG CA C 13 56.08 0.2 . 1 . . . . 97 ARG CA . 15070 1 443 . 1 1 97 97 ARG CB C 13 26.42 0.2 . 1 . . . . 97 ARG CB . 15070 1 444 . 1 1 97 97 ARG N N 15 120.3 0.2 . 1 . . . . 97 ARG N . 15070 1 445 . 1 1 98 98 SER H H 1 7.421 0.02 . 1 . . . . 98 SER H . 15070 1 446 . 1 1 98 98 SER C C 13 173.2 0.2 . 1 . . . . 98 SER C . 15070 1 447 . 1 1 98 98 SER CA C 13 55.90 0.2 . 1 . . . . 98 SER CA . 15070 1 448 . 1 1 98 98 SER CB C 13 60.96 0.2 . 1 . . . . 98 SER CB . 15070 1 449 . 1 1 98 98 SER N N 15 110.5 0.2 . 1 . . . . 98 SER N . 15070 1 450 . 1 1 99 99 ARG H H 1 7.386 0.02 . 1 . . . . 99 ARG H . 15070 1 451 . 1 1 99 99 ARG C C 13 175.2 0.2 . 1 . . . . 99 ARG C . 15070 1 452 . 1 1 99 99 ARG CA C 13 52.91 0.2 . 1 . . . . 99 ARG CA . 15070 1 453 . 1 1 99 99 ARG CB C 13 28.22 0.2 . 1 . . . . 99 ARG CB . 15070 1 454 . 1 1 99 99 ARG N N 15 119.0 0.2 . 1 . . . . 99 ARG N . 15070 1 455 . 1 1 100 100 ILE H H 1 7.540 0.02 . 1 . . . . 100 ILE H . 15070 1 456 . 1 1 100 100 ILE C C 13 174.3 0.2 . 1 . . . . 100 ILE C . 15070 1 457 . 1 1 100 100 ILE CA C 13 59.07 0.2 . 1 . . . . 100 ILE CA . 15070 1 458 . 1 1 100 100 ILE N N 15 118.9 0.2 . 1 . . . . 100 ILE N . 15070 1 459 . 1 1 101 101 THR H H 1 8.534 0.02 . 1 . . . . 101 THR H . 15070 1 460 . 1 1 101 101 THR C C 13 172.4 0.2 . 1 . . . . 101 THR C . 15070 1 461 . 1 1 101 101 THR CA C 13 57.38 0.2 . 1 . . . . 101 THR CA . 15070 1 462 . 1 1 101 101 THR CB C 13 68.26 0.2 . 1 . . . . 101 THR CB . 15070 1 463 . 1 1 101 101 THR N N 15 119.3 0.2 . 1 . . . . 101 THR N . 15070 1 464 . 1 1 102 102 ALA H H 1 8.742 0.02 . 1 . . . . 102 ALA H . 15070 1 465 . 1 1 102 102 ALA C C 13 176.5 0.2 . 1 . . . . 102 ALA C . 15070 1 466 . 1 1 102 102 ALA CA C 13 48.94 0.2 . 1 . . . . 102 ALA CA . 15070 1 467 . 1 1 102 102 ALA CB C 13 17.24 0.2 . 1 . . . . 102 ALA CB . 15070 1 468 . 1 1 102 102 ALA N N 15 129.5 0.2 . 1 . . . . 102 ALA N . 15070 1 469 . 1 1 103 103 SER H H 1 8.873 0.02 . 1 . . . . 103 SER H . 15070 1 470 . 1 1 103 103 SER CA C 13 55.07 0.2 . 1 . . . . 103 SER CA . 15070 1 471 . 1 1 103 103 SER CB C 13 59.11 0.2 . 1 . . . . 103 SER CB . 15070 1 472 . 1 1 103 103 SER N N 15 122.5 0.2 . 1 . . . . 103 SER N . 15070 1 473 . 1 1 104 104 PRO C C 13 178.0 0.2 . 1 . . . . 104 PRO C . 15070 1 474 . 1 1 104 104 PRO CA C 13 63.70 0.2 . 1 . . . . 104 PRO CA . 15070 1 475 . 1 1 105 105 ALA H H 1 9.546 0.02 . 1 . . . . 105 ALA H . 15070 1 476 . 1 1 105 105 ALA C C 13 179.7 0.2 . 1 . . . . 105 ALA C . 15070 1 477 . 1 1 105 105 ALA CA C 13 51.81 0.2 . 1 . . . . 105 ALA CA . 15070 1 478 . 1 1 105 105 ALA CB C 13 16.37 0.2 . 1 . . . . 105 ALA CB . 15070 1 479 . 1 1 105 105 ALA N N 15 118.9 0.2 . 1 . . . . 105 ALA N . 15070 1 480 . 1 1 106 106 VAL H H 1 7.584 0.02 . 1 . . . . 106 VAL H . 15070 1 481 . 1 1 106 106 VAL C C 13 176.0 0.2 . 1 . . . . 106 VAL C . 15070 1 482 . 1 1 106 106 VAL CA C 13 63.85 0.2 . 1 . . . . 106 VAL CA . 15070 1 483 . 1 1 106 106 VAL CB C 13 29.14 0.2 . 1 . . . . 106 VAL CB . 15070 1 484 . 1 1 106 106 VAL N N 15 120.2 0.2 . 1 . . . . 106 VAL N . 15070 1 485 . 1 1 107 107 ILE H H 1 8.427 0.02 . 1 . . . . 107 ILE H . 15070 1 486 . 1 1 107 107 ILE C C 13 177.5 0.2 . 1 . . . . 107 ILE C . 15070 1 487 . 1 1 107 107 ILE CA C 13 61.86 0.2 . 1 . . . . 107 ILE CA . 15070 1 488 . 1 1 107 107 ILE CB C 13 34.37 0.2 . 1 . . . . 107 ILE CB . 15070 1 489 . 1 1 107 107 ILE N N 15 121.6 0.2 . 1 . . . . 107 ILE N . 15070 1 490 . 1 1 108 108 ASP H H 1 7.253 0.02 . 1 . . . . 108 ASP H . 15070 1 491 . 1 1 108 108 ASP C C 13 177.0 0.2 . 1 . . . . 108 ASP C . 15070 1 492 . 1 1 108 108 ASP CA C 13 54.33 0.2 . 1 . . . . 108 ASP CA . 15070 1 493 . 1 1 108 108 ASP CB C 13 37.61 0.2 . 1 . . . . 108 ASP CB . 15070 1 494 . 1 1 108 108 ASP N N 15 117.9 0.2 . 1 . . . . 108 ASP N . 15070 1 495 . 1 1 109 109 TYR H H 1 7.955 0.02 . 1 . . . . 109 TYR H . 15070 1 496 . 1 1 109 109 TYR C C 13 176.3 0.2 . 1 . . . . 109 TYR C . 15070 1 497 . 1 1 109 109 TYR CA C 13 54.93 0.2 . 1 . . . . 109 TYR CA . 15070 1 498 . 1 1 109 109 TYR CB C 13 36.35 0.2 . 1 . . . . 109 TYR CB . 15070 1 499 . 1 1 109 109 TYR N N 15 123.6 0.2 . 1 . . . . 109 TYR N . 15070 1 500 . 1 1 110 110 VAL H H 1 9.174 0.02 . 1 . . . . 110 VAL H . 15070 1 501 . 1 1 110 110 VAL C C 13 176.4 0.2 . 1 . . . . 110 VAL C . 15070 1 502 . 1 1 110 110 VAL CA C 13 64.11 0.2 . 1 . . . . 110 VAL CA . 15070 1 503 . 1 1 110 110 VAL CB C 13 27.73 0.2 . 1 . . . . 110 VAL CB . 15070 1 504 . 1 1 110 110 VAL N N 15 118.7 0.2 . 1 . . . . 110 VAL N . 15070 1 505 . 1 1 111 111 ASN H H 1 8.279 0.02 . 1 . . . . 111 ASN H . 15070 1 506 . 1 1 111 111 ASN CA C 13 53.27 0.2 . 1 . . . . 111 ASN CA . 15070 1 507 . 1 1 111 111 ASN N N 15 117.2 0.2 . 1 . . . . 111 ASN N . 15070 1 508 . 1 1 113 113 LEU C C 13 178.0 0.2 . 1 . . . . 113 LEU C . 15070 1 509 . 1 1 113 113 LEU CA C 13 54.73 0.2 . 1 . . . . 113 LEU CA . 15070 1 510 . 1 1 114 114 GLU H H 1 8.726 0.02 . 1 . . . . 114 GLU H . 15070 1 511 . 1 1 114 114 GLU C C 13 176.9 0.2 . 1 . . . . 114 GLU C . 15070 1 512 . 1 1 114 114 GLU CA C 13 56.63 0.2 . 1 . . . . 114 GLU CA . 15070 1 513 . 1 1 114 114 GLU CB C 13 26.12 0.2 . 1 . . . . 114 GLU CB . 15070 1 514 . 1 1 114 114 GLU N N 15 119.9 0.2 . 1 . . . . 114 GLU N . 15070 1 515 . 1 1 115 115 GLU H H 1 7.706 0.02 . 1 . . . . 115 GLU H . 15070 1 516 . 1 1 115 115 GLU C C 13 178.1 0.2 . 1 . . . . 115 GLU C . 15070 1 517 . 1 1 115 115 GLU CA C 13 56.48 0.2 . 1 . . . . 115 GLU CA . 15070 1 518 . 1 1 115 115 GLU CB C 13 26.80 0.2 . 1 . . . . 115 GLU CB . 15070 1 519 . 1 1 115 115 GLU N N 15 121.1 0.2 . 1 . . . . 115 GLU N . 15070 1 520 . 1 1 116 116 ILE H H 1 8.185 0.02 . 1 . . . . 116 ILE H . 15070 1 521 . 1 1 116 116 ILE C C 13 176.9 0.2 . 1 . . . . 116 ILE C . 15070 1 522 . 1 1 116 116 ILE CA C 13 62.77 0.2 . 1 . . . . 116 ILE CA . 15070 1 523 . 1 1 116 116 ILE CB C 13 34.40 0.2 . 1 . . . . 116 ILE CB . 15070 1 524 . 1 1 116 116 ILE N N 15 120.8 0.2 . 1 . . . . 116 ILE N . 15070 1 525 . 1 1 117 117 ARG H H 1 8.144 0.02 . 1 . . . . 117 ARG H . 15070 1 526 . 1 1 117 117 ARG C C 13 177.2 0.2 . 1 . . . . 117 ARG C . 15070 1 527 . 1 1 117 117 ARG CA C 13 56.47 0.2 . 1 . . . . 117 ARG CA . 15070 1 528 . 1 1 117 117 ARG CB C 13 27.09 0.2 . 1 . . . . 117 ARG CB . 15070 1 529 . 1 1 117 117 ARG N N 15 119.5 0.2 . 1 . . . . 117 ARG N . 15070 1 530 . 1 1 118 118 ASP H H 1 8.697 0.02 . 1 . . . . 118 ASP H . 15070 1 531 . 1 1 118 118 ASP C C 13 176.6 0.2 . 1 . . . . 118 ASP C . 15070 1 532 . 1 1 118 118 ASP CA C 13 54.22 0.2 . 1 . . . . 118 ASP CA . 15070 1 533 . 1 1 118 118 ASP CB C 13 36.89 0.2 . 1 . . . . 118 ASP CB . 15070 1 534 . 1 1 118 118 ASP N N 15 119.8 0.2 . 1 . . . . 118 ASP N . 15070 1 535 . 1 1 119 119 ASN H H 1 8.362 0.02 . 1 . . . . 119 ASN H . 15070 1 536 . 1 1 119 119 ASN C C 13 172.8 0.2 . 1 . . . . 119 ASN C . 15070 1 537 . 1 1 119 119 ASN CA C 13 50.06 0.2 . 1 . . . . 119 ASN CA . 15070 1 538 . 1 1 119 119 ASN CB C 13 35.74 0.2 . 1 . . . . 119 ASN CB . 15070 1 539 . 1 1 119 119 ASN N N 15 115.6 0.2 . 1 . . . . 119 ASN N . 15070 1 540 . 1 1 120 120 VAL H H 1 7.867 0.02 . 1 . . . . 120 VAL H . 15070 1 541 . 1 1 120 120 VAL C C 13 173.1 0.2 . 1 . . . . 120 VAL C . 15070 1 542 . 1 1 120 120 VAL CA C 13 59.79 0.2 . 1 . . . . 120 VAL CA . 15070 1 543 . 1 1 120 120 VAL CB C 13 26.16 0.2 . 1 . . . . 120 VAL CB . 15070 1 544 . 1 1 120 120 VAL N N 15 123.1 0.2 . 1 . . . . 120 VAL N . 15070 1 545 . 1 1 121 121 ASP H H 1 7.683 0.02 . 1 . . . . 121 ASP H . 15070 1 546 . 1 1 121 121 ASP C C 13 174.2 0.2 . 1 . . . . 121 ASP C . 15070 1 547 . 1 1 121 121 ASP CA C 13 49.24 0.2 . 1 . . . . 121 ASP CA . 15070 1 548 . 1 1 121 121 ASP CB C 13 37.27 0.2 . 1 . . . . 121 ASP CB . 15070 1 549 . 1 1 121 121 ASP N N 15 118.2 0.2 . 1 . . . . 121 ASP N . 15070 1 550 . 1 1 122 122 GLY H H 1 7.956 0.02 . 1 . . . . 122 GLY H . 15070 1 551 . 1 1 122 122 GLY CA C 13 46.29 0.2 . 1 . . . . 122 GLY CA . 15070 1 552 . 1 1 122 122 GLY N N 15 111.6 0.2 . 1 . . . . 122 GLY N . 15070 1 553 . 1 1 123 123 PRO C C 13 176.2 0.2 . 1 . . . . 123 PRO C . 15070 1 554 . 1 1 123 123 PRO CA C 13 63.02 0.2 . 1 . . . . 123 PRO CA . 15070 1 555 . 1 1 123 123 PRO CB C 13 29.26 0.2 . 1 . . . . 123 PRO CB . 15070 1 556 . 1 1 124 124 ALA H H 1 7.152 0.02 . 1 . . . . 124 ALA H . 15070 1 557 . 1 1 124 124 ALA C C 13 178.0 0.2 . 1 . . . . 124 ALA C . 15070 1 558 . 1 1 124 124 ALA CA C 13 51.73 0.2 . 1 . . . . 124 ALA CA . 15070 1 559 . 1 1 124 124 ALA CB C 13 16.24 0.2 . 1 . . . . 124 ALA CB . 15070 1 560 . 1 1 124 124 ALA N N 15 114.4 0.2 . 1 . . . . 124 ALA N . 15070 1 561 . 1 1 125 125 LEU H H 1 8.477 0.02 . 1 . . . . 125 LEU H . 15070 1 562 . 1 1 125 125 LEU C C 13 178.7 0.2 . 1 . . . . 125 LEU C . 15070 1 563 . 1 1 125 125 LEU CA C 13 53.39 0.2 . 1 . . . . 125 LEU CA . 15070 1 564 . 1 1 125 125 LEU CB C 13 36.92 0.2 . 1 . . . . 125 LEU CB . 15070 1 565 . 1 1 125 125 LEU N N 15 118.8 0.2 . 1 . . . . 125 LEU N . 15070 1 566 . 1 1 126 126 VAL H H 1 8.630 0.02 . 1 . . . . 126 VAL H . 15070 1 567 . 1 1 126 126 VAL C C 13 175.5 0.2 . 1 . . . . 126 VAL C . 15070 1 568 . 1 1 126 126 VAL CA C 13 64.41 0.2 . 1 . . . . 126 VAL CA . 15070 1 569 . 1 1 126 126 VAL CB C 13 28.10 0.2 . 1 . . . . 126 VAL CB . 15070 1 570 . 1 1 126 126 VAL N N 15 119.5 0.2 . 1 . . . . 126 VAL N . 15070 1 571 . 1 1 127 127 ALA H H 1 7.397 0.02 . 1 . . . . 127 ALA H . 15070 1 572 . 1 1 127 127 ALA C C 13 177.6 0.2 . 1 . . . . 127 ALA C . 15070 1 573 . 1 1 127 127 ALA CA C 13 53.02 0.2 . 1 . . . . 127 ALA CA . 15070 1 574 . 1 1 127 127 ALA CB C 13 16.48 0.2 . 1 . . . . 127 ALA CB . 15070 1 575 . 1 1 127 127 ALA N N 15 120.1 0.2 . 1 . . . . 127 ALA N . 15070 1 576 . 1 1 128 128 HIS H H 1 7.589 0.02 . 1 . . . . 128 HIS H . 15070 1 577 . 1 1 128 128 HIS C C 13 176.4 0.2 . 1 . . . . 128 HIS C . 15070 1 578 . 1 1 128 128 HIS CA C 13 58.43 0.2 . 1 . . . . 128 HIS CA . 15070 1 579 . 1 1 128 128 HIS CB C 13 28.24 0.2 . 1 . . . . 128 HIS CB . 15070 1 580 . 1 1 128 128 HIS N N 15 114.5 0.2 . 1 . . . . 128 HIS N . 15070 1 581 . 1 1 129 129 HIS H H 1 9.222 0.02 . 1 . . . . 129 HIS H . 15070 1 582 . 1 1 129 129 HIS C C 13 175.0 0.2 . 1 . . . . 129 HIS C . 15070 1 583 . 1 1 129 129 HIS CA C 13 58.65 0.2 . 1 . . . . 129 HIS CA . 15070 1 584 . 1 1 129 129 HIS CB C 13 30.10 0.2 . 1 . . . . 129 HIS CB . 15070 1 585 . 1 1 129 129 HIS N N 15 122.8 0.2 . 1 . . . . 129 HIS N . 15070 1 586 . 1 1 130 130 TYR H H 1 8.841 0.02 . 1 . . . . 130 TYR H . 15070 1 587 . 1 1 130 130 TYR C C 13 176.9 0.2 . 1 . . . . 130 TYR C . 15070 1 588 . 1 1 130 130 TYR CA C 13 58.45 0.2 . 1 . . . . 130 TYR CA . 15070 1 589 . 1 1 130 130 TYR CB C 13 34.79 0.2 . 1 . . . . 130 TYR CB . 15070 1 590 . 1 1 130 130 TYR N N 15 119.5 0.2 . 1 . . . . 130 TYR N . 15070 1 591 . 1 1 131 131 VAL H H 1 7.810 0.02 . 1 . . . . 131 VAL H . 15070 1 592 . 1 1 131 131 VAL CA C 13 63.54 0.2 . 1 . . . . 131 VAL CA . 15070 1 593 . 1 1 131 131 VAL CB C 13 28.20 0.2 . 1 . . . . 131 VAL CB . 15070 1 594 . 1 1 131 131 VAL N N 15 118.1 0.2 . 1 . . . . 131 VAL N . 15070 1 595 . 1 1 134 134 LEU C C 13 178.5 0.2 . 1 . . . . 134 LEU C . 15070 1 596 . 1 1 134 134 LEU CA C 13 52.87 0.2 . 1 . . . . 134 LEU CA . 15070 1 597 . 1 1 135 135 ALA H H 1 7.547 0.02 . 1 . . . . 135 ALA H . 15070 1 598 . 1 1 135 135 ALA CB C 13 15.41 0.2 . 1 . . . . 135 ALA CB . 15070 1 599 . 1 1 135 135 ALA N N 15 122.1 0.2 . 1 . . . . 135 ALA N . 15070 1 600 . 1 1 137 137 LEU C C 13 177.7 0.2 . 1 . . . . 137 LEU C . 15070 1 601 . 1 1 137 137 LEU CA C 13 54.71 0.2 . 1 . . . . 137 LEU CA . 15070 1 602 . 1 1 138 138 SER H H 1 8.344 0.02 . 1 . . . . 138 SER H . 15070 1 603 . 1 1 138 138 SER C C 13 174.8 0.2 . 1 . . . . 138 SER C . 15070 1 604 . 1 1 138 138 SER CA C 13 57.81 0.2 . 1 . . . . 138 SER CA . 15070 1 605 . 1 1 138 138 SER CB C 13 60.31 0.2 . 1 . . . . 138 SER CB . 15070 1 606 . 1 1 138 138 SER N N 15 112.6 0.2 . 1 . . . . 138 SER N . 15070 1 607 . 1 1 139 139 GLY H H 1 8.297 0.02 . 1 . . . . 139 GLY H . 15070 1 608 . 1 1 139 139 GLY C C 13 175.2 0.2 . 1 . . . . 139 GLY C . 15070 1 609 . 1 1 139 139 GLY CA C 13 43.11 0.2 . 1 . . . . 139 GLY CA . 15070 1 610 . 1 1 139 139 GLY N N 15 109.7 0.2 . 1 . . . . 139 GLY N . 15070 1 611 . 1 1 140 140 GLY H H 1 8.255 0.02 . 1 . . . . 140 GLY H . 15070 1 612 . 1 1 140 140 GLY C C 13 173.9 0.2 . 1 . . . . 140 GLY C . 15070 1 613 . 1 1 140 140 GLY CA C 13 45.52 0.2 . 1 . . . . 140 GLY CA . 15070 1 614 . 1 1 140 140 GLY N N 15 109.7 0.2 . 1 . . . . 140 GLY N . 15070 1 615 . 1 1 141 141 GLN H H 1 8.278 0.02 . 1 . . . . 141 GLN H . 15070 1 616 . 1 1 141 141 GLN C C 13 177.6 0.2 . 1 . . . . 141 GLN C . 15070 1 617 . 1 1 141 141 GLN CA C 13 55.47 0.2 . 1 . . . . 141 GLN CA . 15070 1 618 . 1 1 141 141 GLN CB C 13 25.35 0.2 . 1 . . . . 141 GLN CB . 15070 1 619 . 1 1 141 141 GLN N N 15 117.7 0.2 . 1 . . . . 141 GLN N . 15070 1 620 . 1 1 142 142 VAL H H 1 7.466 0.02 . 1 . . . . 142 VAL H . 15070 1 621 . 1 1 142 142 VAL C C 13 176.5 0.2 . 1 . . . . 142 VAL C . 15070 1 622 . 1 1 142 142 VAL CA C 13 62.96 0.2 . 1 . . . . 142 VAL CA . 15070 1 623 . 1 1 142 142 VAL CB C 13 28.75 0.2 . 1 . . . . 142 VAL CB . 15070 1 624 . 1 1 142 142 VAL N N 15 119.0 0.2 . 1 . . . . 142 VAL N . 15070 1 625 . 1 1 143 143 ILE H H 1 7.424 0.02 . 1 . . . . 143 ILE H . 15070 1 626 . 1 1 143 143 ILE C C 13 176.9 0.2 . 1 . . . . 143 ILE C . 15070 1 627 . 1 1 143 143 ILE CA C 13 62.87 0.2 . 1 . . . . 143 ILE CA . 15070 1 628 . 1 1 143 143 ILE CB C 13 34.79 0.2 . 1 . . . . 143 ILE CB . 15070 1 629 . 1 1 143 143 ILE N N 15 119.9 0.2 . 1 . . . . 143 ILE N . 15070 1 630 . 1 1 144 144 ALA H H 1 7.720 0.02 . 1 . . . . 144 ALA H . 15070 1 631 . 1 1 144 144 ALA C C 13 178.7 0.2 . 1 . . . . 144 ALA C . 15070 1 632 . 1 1 144 144 ALA CA C 13 52.43 0.2 . 1 . . . . 144 ALA CA . 15070 1 633 . 1 1 144 144 ALA CB C 13 14.95 0.2 . 1 . . . . 144 ALA CB . 15070 1 634 . 1 1 144 144 ALA N N 15 119.4 0.2 . 1 . . . . 144 ALA N . 15070 1 635 . 1 1 145 145 ARG H H 1 7.656 0.02 . 1 . . . . 145 ARG H . 15070 1 636 . 1 1 145 145 ARG CA C 13 56.31 0.2 . 1 . . . . 145 ARG CA . 15070 1 637 . 1 1 145 145 ARG CB C 13 26.90 0.2 . 1 . . . . 145 ARG CB . 15070 1 638 . 1 1 145 145 ARG N N 15 116.3 0.2 . 1 . . . . 145 ARG N . 15070 1 639 . 1 1 147 147 MET C C 13 179.0 0.2 . 1 . . . . 147 MET C . 15070 1 640 . 1 1 147 147 MET CA C 13 53.94 0.2 . 1 . . . . 147 MET CA . 15070 1 641 . 1 1 148 148 GLN H H 1 7.525 0.02 . 1 . . . . 148 GLN H . 15070 1 642 . 1 1 148 148 GLN C C 13 176.9 0.2 . 1 . . . . 148 GLN C . 15070 1 643 . 1 1 148 148 GLN CA C 13 56.29 0.2 . 1 . . . . 148 GLN CA . 15070 1 644 . 1 1 148 148 GLN CB C 13 31.61 0.2 . 1 . . . . 148 GLN CB . 15070 1 645 . 1 1 148 148 GLN N N 15 118.4 0.2 . 1 . . . . 148 GLN N . 15070 1 646 . 1 1 149 149 ARG H H 1 8.079 0.02 . 1 . . . . 149 ARG H . 15070 1 647 . 1 1 149 149 ARG C C 13 177.0 0.2 . 1 . . . . 149 ARG C . 15070 1 648 . 1 1 149 149 ARG CA C 13 55.94 0.2 . 1 . . . . 149 ARG CA . 15070 1 649 . 1 1 149 149 ARG CB C 13 27.58 0.2 . 1 . . . . 149 ARG CB . 15070 1 650 . 1 1 149 149 ARG N N 15 118.5 0.2 . 1 . . . . 149 ARG N . 15070 1 651 . 1 1 150 150 HIS H H 1 8.370 0.02 . 1 . . . . 150 HIS H . 15070 1 652 . 1 1 150 150 HIS C C 13 176.4 0.2 . 1 . . . . 150 HIS C . 15070 1 653 . 1 1 150 150 HIS CA C 13 54.83 0.2 . 1 . . . . 150 HIS CA . 15070 1 654 . 1 1 150 150 HIS CB C 13 27.70 0.2 . 1 . . . . 150 HIS CB . 15070 1 655 . 1 1 150 150 HIS N N 15 113.0 0.2 . 1 . . . . 150 HIS N . 15070 1 656 . 1 1 151 151 TYR H H 1 6.732 0.02 . 1 . . . . 151 TYR H . 15070 1 657 . 1 1 151 151 TYR C C 13 175.2 0.2 . 1 . . . . 151 TYR C . 15070 1 658 . 1 1 151 151 TYR CA C 13 52.28 0.2 . 1 . . . . 151 TYR CA . 15070 1 659 . 1 1 151 151 TYR CB C 13 36.94 0.2 . 1 . . . . 151 TYR CB . 15070 1 660 . 1 1 151 151 TYR N N 15 112.2 0.2 . 1 . . . . 151 TYR N . 15070 1 661 . 1 1 152 152 GLY H H 1 7.581 0.02 . 1 . . . . 152 GLY H . 15070 1 662 . 1 1 152 152 GLY C C 13 173.2 0.2 . 1 . . . . 152 GLY C . 15070 1 663 . 1 1 152 152 GLY CA C 13 43.77 0.2 . 1 . . . . 152 GLY CA . 15070 1 664 . 1 1 152 152 GLY N N 15 108.7 0.2 . 1 . . . . 152 GLY N . 15070 1 665 . 1 1 153 153 VAL H H 1 7.007 0.02 . 1 . . . . 153 VAL H . 15070 1 666 . 1 1 153 153 VAL C C 13 173.5 0.2 . 1 . . . . 153 VAL C . 15070 1 667 . 1 1 153 153 VAL CA C 13 60.45 0.2 . 1 . . . . 153 VAL CA . 15070 1 668 . 1 1 153 153 VAL CB C 13 29.24 0.2 . 1 . . . . 153 VAL CB . 15070 1 669 . 1 1 153 153 VAL N N 15 119.3 0.2 . 1 . . . . 153 VAL N . 15070 1 670 . 1 1 154 154 ASP H H 1 8.485 0.02 . 1 . . . . 154 ASP H . 15070 1 671 . 1 1 154 154 ASP CA C 13 49.44 0.2 . 1 . . . . 154 ASP CA . 15070 1 672 . 1 1 154 154 ASP CB C 13 39.67 0.2 . 1 . . . . 154 ASP CB . 15070 1 673 . 1 1 154 154 ASP N N 15 128.3 0.2 . 1 . . . . 154 ASP N . 15070 1 674 . 1 1 155 155 PRO C C 13 178.0 0.2 . 1 . . . . 155 PRO C . 15070 1 675 . 1 1 155 155 PRO CA C 13 62.17 0.2 . 1 . . . . 155 PRO CA . 15070 1 676 . 1 1 155 155 PRO CB C 13 28.79 0.2 . 1 . . . . 155 PRO CB . 15070 1 677 . 1 1 156 156 GLU H H 1 9.147 0.02 . 1 . . . . 156 GLU H . 15070 1 678 . 1 1 156 156 GLU C C 13 174.6 0.2 . 1 . . . . 156 GLU C . 15070 1 679 . 1 1 156 156 GLU CA C 13 55.08 0.2 . 1 . . . . 156 GLU CA . 15070 1 680 . 1 1 156 156 GLU CB C 13 25.96 0.2 . 1 . . . . 156 GLU CB . 15070 1 681 . 1 1 156 156 GLU N N 15 117.4 0.2 . 1 . . . . 156 GLU N . 15070 1 682 . 1 1 157 157 ALA H H 1 8.260 0.02 . 1 . . . . 157 ALA H . 15070 1 683 . 1 1 157 157 ALA C C 13 173.3 0.2 . 1 . . . . 157 ALA C . 15070 1 684 . 1 1 157 157 ALA CA C 13 48.29 0.2 . 1 . . . . 157 ALA CA . 15070 1 685 . 1 1 157 157 ALA CB C 13 16.03 0.2 . 1 . . . . 157 ALA CB . 15070 1 686 . 1 1 157 157 ALA N N 15 121.6 0.2 . 1 . . . . 157 ALA N . 15070 1 687 . 1 1 158 158 LEU H H 1 6.911 0.02 . 1 . . . . 158 LEU H . 15070 1 688 . 1 1 158 158 LEU C C 13 177.9 0.2 . 1 . . . . 158 LEU C . 15070 1 689 . 1 1 158 158 LEU CA C 13 50.58 0.2 . 1 . . . . 158 LEU CA . 15070 1 690 . 1 1 158 158 LEU CB C 13 39.37 0.2 . 1 . . . . 158 LEU CB . 15070 1 691 . 1 1 158 158 LEU N N 15 117.1 0.2 . 1 . . . . 158 LEU N . 15070 1 692 . 1 1 159 159 GLY H H 1 10.13 0.02 . 1 . . . . 159 GLY H . 15070 1 693 . 1 1 159 159 GLY C C 13 176.1 0.2 . 1 . . . . 159 GLY C . 15070 1 694 . 1 1 159 159 GLY CA C 13 45.21 0.2 . 1 . . . . 159 GLY CA . 15070 1 695 . 1 1 159 159 GLY N N 15 118.4 0.2 . 1 . . . . 159 GLY N . 15070 1 696 . 1 1 160 160 PHE H H 1 11.14 0.02 . 1 . . . . 160 PHE H . 15070 1 697 . 1 1 160 160 PHE C C 13 174.4 0.2 . 1 . . . . 160 PHE C . 15070 1 698 . 1 1 160 160 PHE CA C 13 57.82 0.2 . 1 . . . . 160 PHE CA . 15070 1 699 . 1 1 160 160 PHE CB C 13 37.25 0.2 . 1 . . . . 160 PHE CB . 15070 1 700 . 1 1 160 160 PHE N N 15 124.4 0.2 . 1 . . . . 160 PHE N . 15070 1 701 . 1 1 161 161 TYR H H 1 7.247 0.02 . 1 . . . . 161 TYR H . 15070 1 702 . 1 1 161 161 TYR C C 13 172.5 0.2 . 1 . . . . 161 TYR C . 15070 1 703 . 1 1 161 161 TYR CA C 13 55.94 0.2 . 1 . . . . 161 TYR CA . 15070 1 704 . 1 1 161 161 TYR CB C 13 35.92 0.2 . 1 . . . . 161 TYR CB . 15070 1 705 . 1 1 161 161 TYR N N 15 113.6 0.2 . 1 . . . . 161 TYR N . 15070 1 706 . 1 1 162 162 HIS H H 1 7.946 0.02 . 1 . . . . 162 HIS H . 15070 1 707 . 1 1 162 162 HIS C C 13 171.7 0.2 . 1 . . . . 162 HIS C . 15070 1 708 . 1 1 162 162 HIS CA C 13 51.66 0.2 . 1 . . . . 162 HIS CA . 15070 1 709 . 1 1 162 162 HIS CB C 13 29.13 0.2 . 1 . . . . 162 HIS CB . 15070 1 710 . 1 1 162 162 HIS N N 15 120.1 0.2 . 1 . . . . 162 HIS N . 15070 1 711 . 1 1 163 163 PHE H H 1 8.892 0.02 . 1 . . . . 163 PHE H . 15070 1 712 . 1 1 163 163 PHE C C 13 174.4 0.2 . 1 . . . . 163 PHE C . 15070 1 713 . 1 1 163 163 PHE CA C 13 53.32 0.2 . 1 . . . . 163 PHE CA . 15070 1 714 . 1 1 163 163 PHE CB C 13 36.01 0.2 . 1 . . . . 163 PHE CB . 15070 1 715 . 1 1 163 163 PHE N N 15 126.3 0.2 . 1 . . . . 163 PHE N . 15070 1 716 . 1 1 164 164 GLU H H 1 8.959 0.02 . 1 . . . . 164 GLU H . 15070 1 717 . 1 1 164 164 GLU C C 13 176.5 0.2 . 1 . . . . 164 GLU C . 15070 1 718 . 1 1 164 164 GLU CA C 13 55.25 0.2 . 1 . . . . 164 GLU CA . 15070 1 719 . 1 1 164 164 GLU CB C 13 26.47 0.2 . 1 . . . . 164 GLU CB . 15070 1 720 . 1 1 164 164 GLU N N 15 125.6 0.2 . 1 . . . . 164 GLU N . 15070 1 721 . 1 1 165 165 GLY H H 1 8.847 0.02 . 1 . . . . 165 GLY H . 15070 1 722 . 1 1 165 165 GLY C C 13 172.5 0.2 . 1 . . . . 165 GLY C . 15070 1 723 . 1 1 165 165 GLY CA C 13 41.96 0.2 . 1 . . . . 165 GLY CA . 15070 1 724 . 1 1 165 165 GLY N N 15 106.6 0.2 . 1 . . . . 165 GLY N . 15070 1 725 . 1 1 166 166 ILE H H 1 7.128 0.02 . 1 . . . . 166 ILE H . 15070 1 726 . 1 1 166 166 ILE C C 13 173.2 0.2 . 1 . . . . 166 ILE C . 15070 1 727 . 1 1 166 166 ILE CA C 13 57.51 0.2 . 1 . . . . 166 ILE CA . 15070 1 728 . 1 1 166 166 ILE CB C 13 35.80 0.2 . 1 . . . . 166 ILE CB . 15070 1 729 . 1 1 166 166 ILE N N 15 119.7 0.2 . 1 . . . . 166 ILE N . 15070 1 730 . 1 1 167 167 ALA H H 1 8.450 0.02 . 1 . . . . 167 ALA H . 15070 1 731 . 1 1 167 167 ALA C C 13 177.3 0.2 . 1 . . . . 167 ALA C . 15070 1 732 . 1 1 167 167 ALA CA C 13 51.45 0.2 . 1 . . . . 167 ALA CA . 15070 1 733 . 1 1 167 167 ALA CB C 13 16.44 0.2 . 1 . . . . 167 ALA CB . 15070 1 734 . 1 1 167 167 ALA N N 15 128.5 0.2 . 1 . . . . 167 ALA N . 15070 1 735 . 1 1 168 168 LYS H H 1 8.033 0.02 . 1 . . . . 168 LYS H . 15070 1 736 . 1 1 168 168 LYS CB C 13 30.21 0.2 . 1 . . . . 168 LYS CB . 15070 1 737 . 1 1 168 168 LYS N N 15 116.8 0.2 . 1 . . . . 168 LYS N . 15070 1 738 . 1 1 169 169 LEU C C 13 177.3 0.2 . 1 . . . . 169 LEU C . 15070 1 739 . 1 1 169 169 LEU CA C 13 55.88 0.2 . 1 . . . . 169 LEU CA . 15070 1 740 . 1 1 169 169 LEU CB C 13 38.77 0.2 . 1 . . . . 169 LEU CB . 15070 1 741 . 1 1 170 170 LYS H H 1 8.695 0.02 . 1 . . . . 170 LYS H . 15070 1 742 . 1 1 170 170 LYS C C 13 177.6 0.2 . 1 . . . . 170 LYS C . 15070 1 743 . 1 1 170 170 LYS CA C 13 57.23 0.2 . 1 . . . . 170 LYS CA . 15070 1 744 . 1 1 170 170 LYS CB C 13 29.18 0.2 . 1 . . . . 170 LYS CB . 15070 1 745 . 1 1 170 170 LYS N N 15 118.2 0.2 . 1 . . . . 170 LYS N . 15070 1 746 . 1 1 171 171 VAL H H 1 6.739 0.02 . 1 . . . . 171 VAL H . 15070 1 747 . 1 1 171 171 VAL C C 13 176.5 0.2 . 1 . . . . 171 VAL C . 15070 1 748 . 1 1 171 171 VAL CA C 13 62.06 0.2 . 1 . . . . 171 VAL CA . 15070 1 749 . 1 1 171 171 VAL CB C 13 29.19 0.2 . 1 . . . . 171 VAL CB . 15070 1 750 . 1 1 171 171 VAL N N 15 117.5 0.2 . 1 . . . . 171 VAL N . 15070 1 751 . 1 1 172 172 TYR H H 1 8.086 0.02 . 1 . . . . 172 TYR H . 15070 1 752 . 1 1 172 172 TYR C C 13 177.2 0.2 . 1 . . . . 172 TYR C . 15070 1 753 . 1 1 172 172 TYR CA C 13 58.41 0.2 . 1 . . . . 172 TYR CA . 15070 1 754 . 1 1 172 172 TYR CB C 13 36.55 0.2 . 1 . . . . 172 TYR CB . 15070 1 755 . 1 1 172 172 TYR N N 15 121.1 0.2 . 1 . . . . 172 TYR N . 15070 1 756 . 1 1 173 173 LYS H H 1 7.886 0.02 . 1 . . . . 173 LYS H . 15070 1 757 . 1 1 173 173 LYS CA C 13 54.64 0.2 . 1 . . . . 173 LYS CA . 15070 1 758 . 1 1 173 173 LYS N N 15 120.3 0.2 . 1 . . . . 173 LYS N . 15070 1 759 . 1 1 174 174 ASP C C 13 178.2 0.2 . 1 . . . . 174 ASP C . 15070 1 760 . 1 1 174 174 ASP CA C 13 54.76 0.2 . 1 . . . . 174 ASP CA . 15070 1 761 . 1 1 174 174 ASP CB C 13 36.89 0.2 . 1 . . . . 174 ASP CB . 15070 1 762 . 1 1 175 175 GLU H H 1 8.455 0.02 . 1 . . . . 175 GLU H . 15070 1 763 . 1 1 175 175 GLU C C 13 177.7 0.2 . 1 . . . . 175 GLU C . 15070 1 764 . 1 1 175 175 GLU CA C 13 56.27 0.2 . 1 . . . . 175 GLU CA . 15070 1 765 . 1 1 175 175 GLU CB C 13 26.03 0.2 . 1 . . . . 175 GLU CB . 15070 1 766 . 1 1 175 175 GLU N N 15 121.5 0.2 . 1 . . . . 175 GLU N . 15070 1 767 . 1 1 176 176 TYR H H 1 8.624 0.02 . 1 . . . . 176 TYR H . 15070 1 768 . 1 1 176 176 TYR C C 13 176.1 0.2 . 1 . . . . 176 TYR C . 15070 1 769 . 1 1 176 176 TYR CA C 13 58.87 0.2 . 1 . . . . 176 TYR CA . 15070 1 770 . 1 1 176 176 TYR CB C 13 35.77 0.2 . 1 . . . . 176 TYR CB . 15070 1 771 . 1 1 176 176 TYR N N 15 123.5 0.2 . 1 . . . . 176 TYR N . 15070 1 772 . 1 1 177 177 ARG H H 1 8.110 0.02 . 1 . . . . 177 ARG H . 15070 1 773 . 1 1 177 177 ARG C C 13 176.5 0.2 . 1 . . . . 177 ARG C . 15070 1 774 . 1 1 177 177 ARG CA C 13 57.43 0.2 . 1 . . . . 177 ARG CA . 15070 1 775 . 1 1 177 177 ARG CB C 13 26.42 0.2 . 1 . . . . 177 ARG CB . 15070 1 776 . 1 1 177 177 ARG N N 15 117.5 0.2 . 1 . . . . 177 ARG N . 15070 1 777 . 1 1 178 178 GLU H H 1 7.607 0.02 . 1 . . . . 178 GLU H . 15070 1 778 . 1 1 178 178 GLU C C 13 177.8 0.2 . 1 . . . . 178 GLU C . 15070 1 779 . 1 1 178 178 GLU CA C 13 56.13 0.2 . 1 . . . . 178 GLU CA . 15070 1 780 . 1 1 178 178 GLU N N 15 117.6 0.2 . 1 . . . . 178 GLU N . 15070 1 781 . 1 1 179 179 LYS H H 1 7.993 0.02 . 1 . . . . 179 LYS H . 15070 1 782 . 1 1 179 179 LYS C C 13 179.6 0.2 . 1 . . . . 179 LYS C . 15070 1 783 . 1 1 179 179 LYS CA C 13 56.71 0.2 . 1 . . . . 179 LYS CA . 15070 1 784 . 1 1 179 179 LYS CB C 13 26.32 0.2 . 1 . . . . 179 LYS CB . 15070 1 785 . 1 1 179 179 LYS N N 15 118.8 0.2 . 1 . . . . 179 LYS N . 15070 1 786 . 1 1 180 180 LEU H H 1 8.303 0.02 . 1 . . . . 180 LEU H . 15070 1 787 . 1 1 180 180 LEU C C 13 177.5 0.2 . 1 . . . . 180 LEU C . 15070 1 788 . 1 1 180 180 LEU CA C 13 54.80 0.2 . 1 . . . . 180 LEU CA . 15070 1 789 . 1 1 180 180 LEU CB C 13 38.81 0.2 . 1 . . . . 180 LEU CB . 15070 1 790 . 1 1 180 180 LEU N N 15 120.5 0.2 . 1 . . . . 180 LEU N . 15070 1 791 . 1 1 181 181 ASN H H 1 7.984 0.02 . 1 . . . . 181 ASN H . 15070 1 792 . 1 1 181 181 ASN C C 13 175.3 0.2 . 1 . . . . 181 ASN C . 15070 1 793 . 1 1 181 181 ASN CA C 13 51.66 0.2 . 1 . . . . 181 ASN CA . 15070 1 794 . 1 1 181 181 ASN CB C 13 34.91 0.2 . 1 . . . . 181 ASN CB . 15070 1 795 . 1 1 181 181 ASN N N 15 116.2 0.2 . 1 . . . . 181 ASN N . 15070 1 796 . 1 1 182 182 ASN H H 1 7.550 0.02 . 1 . . . . 182 ASN H . 15070 1 797 . 1 1 182 182 ASN C C 13 173.9 0.2 . 1 . . . . 182 ASN C . 15070 1 798 . 1 1 182 182 ASN CA C 13 50.06 0.2 . 1 . . . . 182 ASN CA . 15070 1 799 . 1 1 182 182 ASN CB C 13 36.90 0.2 . 1 . . . . 182 ASN CB . 15070 1 800 . 1 1 182 182 ASN N N 15 116.0 0.2 . 1 . . . . 182 ASN N . 15070 1 801 . 1 1 183 183 LEU H H 1 7.202 0.02 . 1 . . . . 183 LEU H . 15070 1 802 . 1 1 183 183 LEU C C 13 175.3 0.2 . 1 . . . . 183 LEU C . 15070 1 803 . 1 1 183 183 LEU CA C 13 52.65 0.2 . 1 . . . . 183 LEU CA . 15070 1 804 . 1 1 183 183 LEU CB C 13 39.03 0.2 . 1 . . . . 183 LEU CB . 15070 1 805 . 1 1 183 183 LEU N N 15 122.4 0.2 . 1 . . . . 183 LEU N . 15070 1 806 . 1 1 184 184 GLU H H 1 8.727 0.02 . 1 . . . . 184 GLU H . 15070 1 807 . 1 1 184 184 GLU C C 13 173.9 0.2 . 1 . . . . 184 GLU C . 15070 1 808 . 1 1 184 184 GLU CA C 13 53.34 0.2 . 1 . . . . 184 GLU CA . 15070 1 809 . 1 1 184 184 GLU CB C 13 26.12 0.2 . 1 . . . . 184 GLU CB . 15070 1 810 . 1 1 184 184 GLU N N 15 127.5 0.2 . 1 . . . . 184 GLU N . 15070 1 811 . 1 1 185 185 LEU H H 1 8.153 0.02 . 1 . . . . 185 LEU H . 15070 1 812 . 1 1 185 185 LEU C C 13 176.3 0.2 . 1 . . . . 185 LEU C . 15070 1 813 . 1 1 185 185 LEU CA C 13 50.12 0.2 . 1 . . . . 185 LEU CA . 15070 1 814 . 1 1 185 185 LEU CB C 13 42.72 0.2 . 1 . . . . 185 LEU CB . 15070 1 815 . 1 1 185 185 LEU N N 15 125.1 0.2 . 1 . . . . 185 LEU N . 15070 1 816 . 1 1 186 186 SER H H 1 9.325 0.02 . 1 . . . . 186 SER H . 15070 1 817 . 1 1 186 186 SER C C 13 173.7 0.2 . 1 . . . . 186 SER C . 15070 1 818 . 1 1 186 186 SER CA C 13 54.01 0.2 . 1 . . . . 186 SER CA . 15070 1 819 . 1 1 186 186 SER CB C 13 62.25 0.2 . 1 . . . . 186 SER CB . 15070 1 820 . 1 1 186 186 SER N N 15 119.6 0.2 . 1 . . . . 186 SER N . 15070 1 821 . 1 1 187 187 ASP H H 1 9.115 0.02 . 1 . . . . 187 ASP H . 15070 1 822 . 1 1 187 187 ASP C C 13 177.6 0.2 . 1 . . . . 187 ASP C . 15070 1 823 . 1 1 187 187 ASP CA C 13 55.26 0.2 . 1 . . . . 187 ASP CA . 15070 1 824 . 1 1 187 187 ASP CB C 13 36.83 0.2 . 1 . . . . 187 ASP CB . 15070 1 825 . 1 1 187 187 ASP N N 15 121.8 0.2 . 1 . . . . 187 ASP N . 15070 1 826 . 1 1 188 188 GLU H H 1 8.753 0.02 . 1 . . . . 188 GLU H . 15070 1 827 . 1 1 188 188 GLU C C 13 178.5 0.2 . 1 . . . . 188 GLU C . 15070 1 828 . 1 1 188 188 GLU CA C 13 56.60 0.2 . 1 . . . . 188 GLU CA . 15070 1 829 . 1 1 188 188 GLU CB C 13 26.31 0.2 . 1 . . . . 188 GLU CB . 15070 1 830 . 1 1 188 188 GLU N N 15 119.3 0.2 . 1 . . . . 188 GLU N . 15070 1 831 . 1 1 189 189 GLN H H 1 7.870 0.02 . 1 . . . . 189 GLN H . 15070 1 832 . 1 1 189 189 GLN C C 13 177.2 0.2 . 1 . . . . 189 GLN C . 15070 1 833 . 1 1 189 189 GLN CA C 13 55.53 0.2 . 1 . . . . 189 GLN CA . 15070 1 834 . 1 1 189 189 GLN N N 15 119.6 0.2 . 1 . . . . 189 GLN N . 15070 1 835 . 1 1 190 190 ARG H H 1 8.790 0.02 . 1 . . . . 190 ARG H . 15070 1 836 . 1 1 190 190 ARG C C 13 176.3 0.2 . 1 . . . . 190 ARG C . 15070 1 837 . 1 1 190 190 ARG CA C 13 57.14 0.2 . 1 . . . . 190 ARG CA . 15070 1 838 . 1 1 190 190 ARG CB C 13 27.34 0.2 . 1 . . . . 190 ARG CB . 15070 1 839 . 1 1 190 190 ARG N N 15 120.4 0.2 . 1 . . . . 190 ARG N . 15070 1 840 . 1 1 191 191 GLU H H 1 8.142 0.02 . 1 . . . . 191 GLU H . 15070 1 841 . 1 1 191 191 GLU C C 13 177.8 0.2 . 1 . . . . 191 GLU C . 15070 1 842 . 1 1 191 191 GLU CA C 13 56.43 0.2 . 1 . . . . 191 GLU CA . 15070 1 843 . 1 1 191 191 GLU CB C 13 26.30 0.2 . 1 . . . . 191 GLU CB . 15070 1 844 . 1 1 191 191 GLU N N 15 117.6 0.2 . 1 . . . . 191 GLU N . 15070 1 845 . 1 1 193 193 LEU C C 13 177.6 0.2 . 1 . . . . 193 LEU C . 15070 1 846 . 1 1 193 193 LEU CA C 13 54.48 0.2 . 1 . . . . 193 LEU CA . 15070 1 847 . 1 1 193 193 LEU CB C 13 36.41 0.2 . 1 . . . . 193 LEU CB . 15070 1 848 . 1 1 194 194 LEU H H 1 8.499 0.02 . 1 . . . . 194 LEU H . 15070 1 849 . 1 1 194 194 LEU C C 13 179.1 0.2 . 1 . . . . 194 LEU C . 15070 1 850 . 1 1 194 194 LEU CA C 13 55.34 0.2 . 1 . . . . 194 LEU CA . 15070 1 851 . 1 1 194 194 LEU CB C 13 38.27 0.2 . 1 . . . . 194 LEU CB . 15070 1 852 . 1 1 194 194 LEU N N 15 121.4 0.2 . 1 . . . . 194 LEU N . 15070 1 853 . 1 1 195 195 LYS H H 1 8.164 0.02 . 1 . . . . 195 LYS H . 15070 1 854 . 1 1 195 195 LYS C C 13 177.8 0.2 . 1 . . . . 195 LYS C . 15070 1 855 . 1 1 195 195 LYS CA C 13 56.49 0.2 . 1 . . . . 195 LYS CA . 15070 1 856 . 1 1 195 195 LYS CB C 13 29.14 0.2 . 1 . . . . 195 LYS CB . 15070 1 857 . 1 1 195 195 LYS N N 15 121.1 0.2 . 1 . . . . 195 LYS N . 15070 1 858 . 1 1 196 196 GLU H H 1 8.231 0.02 . 1 . . . . 196 GLU H . 15070 1 859 . 1 1 196 196 GLU C C 13 176.7 0.2 . 1 . . . . 196 GLU C . 15070 1 860 . 1 1 196 196 GLU CA C 13 55.48 0.2 . 1 . . . . 196 GLU CA . 15070 1 861 . 1 1 196 196 GLU CB C 13 24.43 0.2 . 1 . . . . 196 GLU CB . 15070 1 862 . 1 1 196 196 GLU N N 15 120.4 0.2 . 1 . . . . 196 GLU N . 15070 1 863 . 1 1 197 197 ALA H H 1 8.350 0.02 . 1 . . . . 197 ALA H . 15070 1 864 . 1 1 197 197 ALA C C 13 177.7 0.2 . 1 . . . . 197 ALA C . 15070 1 865 . 1 1 197 197 ALA CA C 13 52.29 0.2 . 1 . . . . 197 ALA CA . 15070 1 866 . 1 1 197 197 ALA CB C 13 14.96 0.2 . 1 . . . . 197 ALA CB . 15070 1 867 . 1 1 197 197 ALA N N 15 119.9 0.2 . 1 . . . . 197 ALA N . 15070 1 868 . 1 1 198 198 THR H H 1 7.387 0.02 . 1 . . . . 198 THR H . 15070 1 869 . 1 1 198 198 THR C C 13 174.8 0.2 . 1 . . . . 198 THR C . 15070 1 870 . 1 1 198 198 THR CA C 13 65.26 0.2 . 1 . . . . 198 THR CA . 15070 1 871 . 1 1 198 198 THR N N 15 114.2 0.2 . 1 . . . . 198 THR N . 15070 1 872 . 1 1 199 199 ASP H H 1 7.778 0.02 . 1 . . . . 199 ASP H . 15070 1 873 . 1 1 199 199 ASP C C 13 177.2 0.2 . 1 . . . . 199 ASP C . 15070 1 874 . 1 1 199 199 ASP CA C 13 54.43 0.2 . 1 . . . . 199 ASP CA . 15070 1 875 . 1 1 199 199 ASP CB C 13 36.24 0.2 . 1 . . . . 199 ASP CB . 15070 1 876 . 1 1 199 199 ASP N N 15 121.7 0.2 . 1 . . . . 199 ASP N . 15070 1 877 . 1 1 200 200 ALA H H 1 8.884 0.02 . 1 . . . . 200 ALA H . 15070 1 878 . 1 1 200 200 ALA C C 13 178.4 0.2 . 1 . . . . 200 ALA C . 15070 1 879 . 1 1 200 200 ALA CA C 13 52.52 0.2 . 1 . . . . 200 ALA CA . 15070 1 880 . 1 1 200 200 ALA CB C 13 14.67 0.2 . 1 . . . . 200 ALA CB . 15070 1 881 . 1 1 200 200 ALA N N 15 123.0 0.2 . 1 . . . . 200 ALA N . 15070 1 882 . 1 1 201 201 PHE H H 1 7.976 0.02 . 1 . . . . 201 PHE H . 15070 1 883 . 1 1 201 201 PHE C C 13 177.8 0.2 . 1 . . . . 201 PHE C . 15070 1 884 . 1 1 201 201 PHE CA C 13 59.75 0.2 . 1 . . . . 201 PHE CA . 15070 1 885 . 1 1 201 201 PHE CB C 13 36.67 0.2 . 1 . . . . 201 PHE CB . 15070 1 886 . 1 1 201 201 PHE N N 15 118.1 0.2 . 1 . . . . 201 PHE N . 15070 1 887 . 1 1 202 202 VAL H H 1 8.307 0.02 . 1 . . . . 202 VAL H . 15070 1 888 . 1 1 202 202 VAL CA C 13 64.17 0.2 . 1 . . . . 202 VAL CA . 15070 1 889 . 1 1 202 202 VAL CB C 13 27.73 0.2 . 1 . . . . 202 VAL CB . 15070 1 890 . 1 1 202 202 VAL N N 15 122.9 0.2 . 1 . . . . 202 VAL N . 15070 1 891 . 1 1 203 203 PHE H H 1 8.374 0.02 . 1 . . . . 203 PHE H . 15070 1 892 . 1 1 203 203 PHE C C 13 176.7 0.2 . 1 . . . . 203 PHE C . 15070 1 893 . 1 1 203 203 PHE CA C 13 57.69 0.2 . 1 . . . . 203 PHE CA . 15070 1 894 . 1 1 203 203 PHE N N 15 119.1 0.2 . 1 . . . . 203 PHE N . 15070 1 895 . 1 1 204 204 ASN H H 1 7.445 0.02 . 1 . . . . 204 ASN H . 15070 1 896 . 1 1 204 204 ASN C C 13 174.7 0.2 . 1 . . . . 204 ASN C . 15070 1 897 . 1 1 204 204 ASN CA C 13 53.68 0.2 . 1 . . . . 204 ASN CA . 15070 1 898 . 1 1 204 204 ASN CB C 13 35.77 0.2 . 1 . . . . 204 ASN CB . 15070 1 899 . 1 1 204 204 ASN N N 15 115.7 0.2 . 1 . . . . 204 ASN N . 15070 1 900 . 1 1 205 205 HIS H H 1 7.825 0.02 . 1 . . . . 205 HIS H . 15070 1 901 . 1 1 205 205 HIS C C 13 177.1 0.2 . 1 . . . . 205 HIS C . 15070 1 902 . 1 1 205 205 HIS CA C 13 57.16 0.2 . 1 . . . . 205 HIS CA . 15070 1 903 . 1 1 205 205 HIS CB C 13 27.43 0.2 . 1 . . . . 205 HIS CB . 15070 1 904 . 1 1 205 205 HIS N N 15 116.2 0.2 . 1 . . . . 205 HIS N . 15070 1 905 . 1 1 206 206 GLN H H 1 8.358 0.02 . 1 . . . . 206 GLN H . 15070 1 906 . 1 1 206 206 GLN C C 13 177.1 0.2 . 1 . . . . 206 GLN C . 15070 1 907 . 1 1 206 206 GLN CA C 13 55.31 0.2 . 1 . . . . 206 GLN CA . 15070 1 908 . 1 1 206 206 GLN CB C 13 25.45 0.2 . 1 . . . . 206 GLN CB . 15070 1 909 . 1 1 206 206 GLN N N 15 119.4 0.2 . 1 . . . . 206 GLN N . 15070 1 910 . 1 1 207 207 VAL H H 1 8.088 0.02 . 1 . . . . 207 VAL H . 15070 1 911 . 1 1 207 207 VAL C C 13 176.9 0.2 . 1 . . . . 207 VAL C . 15070 1 912 . 1 1 207 207 VAL CA C 13 63.60 0.2 . 1 . . . . 207 VAL CA . 15070 1 913 . 1 1 207 207 VAL CB C 13 28.05 0.2 . 1 . . . . 207 VAL CB . 15070 1 914 . 1 1 207 207 VAL N N 15 120.7 0.2 . 1 . . . . 207 VAL N . 15070 1 915 . 1 1 208 208 PHE H H 1 7.340 0.02 . 1 . . . . 208 PHE H . 15070 1 916 . 1 1 208 208 PHE C C 13 177.5 0.2 . 1 . . . . 208 PHE C . 15070 1 917 . 1 1 208 208 PHE CA C 13 56.21 0.2 . 1 . . . . 208 PHE CA . 15070 1 918 . 1 1 208 208 PHE CB C 13 34.53 0.2 . 1 . . . . 208 PHE CB . 15070 1 919 . 1 1 208 208 PHE N N 15 117.5 0.2 . 1 . . . . 208 PHE N . 15070 1 920 . 1 1 209 209 ALA H H 1 8.218 0.02 . 1 . . . . 209 ALA H . 15070 1 921 . 1 1 209 209 ALA C C 13 179.4 0.2 . 1 . . . . 209 ALA C . 15070 1 922 . 1 1 209 209 ALA CA C 13 51.99 0.2 . 1 . . . . 209 ALA CA . 15070 1 923 . 1 1 209 209 ALA CB C 13 14.83 0.2 . 1 . . . . 209 ALA CB . 15070 1 924 . 1 1 209 209 ALA N N 15 123.8 0.2 . 1 . . . . 209 ALA N . 15070 1 925 . 1 1 210 210 ASP H H 1 8.172 0.02 . 1 . . . . 210 ASP H . 15070 1 926 . 1 1 210 210 ASP C C 13 178.5 0.2 . 1 . . . . 210 ASP C . 15070 1 927 . 1 1 210 210 ASP CA C 13 54.44 0.2 . 1 . . . . 210 ASP CA . 15070 1 928 . 1 1 210 210 ASP CB C 13 37.50 0.2 . 1 . . . . 210 ASP CB . 15070 1 929 . 1 1 210 210 ASP N N 15 120.2 0.2 . 1 . . . . 210 ASP N . 15070 1 930 . 1 1 211 211 LEU H H 1 7.932 0.02 . 1 . . . . 211 LEU H . 15070 1 931 . 1 1 211 211 LEU C C 13 178.9 0.2 . 1 . . . . 211 LEU C . 15070 1 932 . 1 1 211 211 LEU CA C 13 54.64 0.2 . 1 . . . . 211 LEU CA . 15070 1 933 . 1 1 211 211 LEU CB C 13 36.82 0.2 . 1 . . . . 211 LEU CB . 15070 1 934 . 1 1 211 211 LEU N N 15 120.6 0.2 . 1 . . . . 211 LEU N . 15070 1 935 . 1 1 212 212 GLY H H 1 8.146 0.02 . 1 . . . . 212 GLY H . 15070 1 936 . 1 1 212 212 GLY C C 13 173.6 0.2 . 1 . . . . 212 GLY C . 15070 1 937 . 1 1 212 212 GLY CA C 13 43.04 0.2 . 1 . . . . 212 GLY CA . 15070 1 938 . 1 1 212 212 GLY N N 15 105.4 0.2 . 1 . . . . 212 GLY N . 15070 1 939 . 1 1 213 213 LYS H H 1 7.565 0.02 . 1 . . . . 213 LYS H . 15070 1 940 . 1 1 213 213 LYS C C 13 175.9 0.2 . 1 . . . . 213 LYS C . 15070 1 941 . 1 1 213 213 LYS CA C 13 54.28 0.2 . 1 . . . . 213 LYS CA . 15070 1 942 . 1 1 213 213 LYS CB C 13 30.02 0.2 . 1 . . . . 213 LYS CB . 15070 1 943 . 1 1 213 213 LYS N N 15 119.9 0.2 . 1 . . . . 213 LYS N . 15070 1 944 . 1 1 214 214 GLY H H 1 8.075 0.02 . 1 . . . . 214 GLY H . 15070 1 945 . 1 1 214 214 GLY C C 13 172.5 0.2 . 1 . . . . 214 GLY C . 15070 1 946 . 1 1 214 214 GLY CA C 13 42.67 0.2 . 1 . . . . 214 GLY CA . 15070 1 947 . 1 1 214 214 GLY N N 15 108.5 0.2 . 1 . . . . 214 GLY N . 15070 1 948 . 1 1 215 215 LEU H H 1 7.726 0.02 . 1 . . . . 215 LEU H . 15070 1 949 . 1 1 215 215 LEU C C 13 180.9 0.2 . 1 . . . . 215 LEU C . 15070 1 950 . 1 1 215 215 LEU CA C 13 53.31 0.2 . 1 . . . . 215 LEU CA . 15070 1 951 . 1 1 215 215 LEU CB C 13 39.57 0.2 . 1 . . . . 215 LEU CB . 15070 1 952 . 1 1 215 215 LEU N N 15 126.4 0.2 . 1 . . . . 215 LEU N . 15070 1 stop_ save_