data_7264 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 7264 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 'Catalytic domain of the beta-1,4-glycosidase Cex from Cellulomonas fimi' 'Interactions with different ligands' 'The catalytic domain of Cex was compared in its apo- and 2-fluorocellobiosyl-enzyme intermediate states' 7264 1 stop_ loop_ _Study_keyword.Study_ID _Study_keyword.Keyword _Study_keyword.Entry_ID _Study_keyword.Study_list_ID . Glycosidase 7264 1 . 'Glycosyl-enyzme intermediate' 7264 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7264 _Entry.Title ; Backbone and Selected Sidechain 1H, 13C, and 15N Chemical Shift Assignments of the beta-1,4-glycosidase Cex from Cellulomonas fimi ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-08-15 _Entry.Accession_date 2006-08-16 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 David Poon . 'K. Y.' . 7264 2 Martin Ludwiczek . L. . 7264 3 Mario Schubert . . . 7264 4 Stephen Withers . G. . 7264 5 Lawrence McIntosh . P. . 7264 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7264 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 939 7264 '15N chemical shifts' 301 7264 '1H chemical shifts' 306 7264 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 . . 2008-07-17 2006-08-15 update BMRB 'complete entry citation' 7264 1 . . 2006-11-13 2006-08-15 original author 'original release' 7264 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID . 7265 'covalently-inhibited beta-1,4-glycosidase Cex' 7264 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7264 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17253772 _Citation.Full_citation . _Citation.Title ; NMR spectroscopic characterization of a beta-(1,4)-glycosidase along its reaction pathway: stabilization upon formation of the glycosyl-enzyme intermediate. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full . _Citation.Journal_volume 46 _Citation.Journal_issue 7 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1759 _Citation.Page_last 1770 _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 David Poon . 'K. Y.' . 7264 1 2 Martin Ludwiczek . L. . 7264 1 3 Mario Schubert . . . 7264 1 4 Emily Kwan . M. . 7264 1 5 Stephen Withers . G. . 7264 1 6 Lawrence McIntosh . P. . 7264 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7264 _Assembly.ID 1 _Assembly.Name 'Cex catalytic domain' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all disulfide bound' _Assembly.Molecular_mass 34230 _Assembly.Enzyme_commission_number 3.2.1.91 _Assembly.Details 'The family 10 catalytic domain of the beta-1,4-glycosidase Cex (or CfXyn10A) from Cellulomonas fimi' _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID protein 7264 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Cex catalytic domain' 1 $apo-CexCD . . yes native no no . . . 7264 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 167 167 SG . 1 . 1 CYS 199 199 SG . . . . . . . . . . 7264 1 2 disulfide single . 1 . 1 CYS 261 261 SG . 1 . 1 CYS 267 267 SG . . . . . . . . . . 7264 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID Cellulase 7264 1 Xylanase 7264 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_apo-CexCD _Entity.Sf_category entity _Entity.Sf_framecode apo-CexCD _Entity.Entry_ID 7264 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name apo-CexCD _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 ; ATTLKEAADGAGRDFGFALD PNRLSEAQYKAIADSEFNLV VAENAMKWDATEPSQNSFSF GAGDRVASYAADTGKELYGH TLVWHSQLPDWAKNLNGSAF ESAMVNHVTKVADHFEGKVA SWDVVNEAFADGGGRRQDSA FQQKLGNGYIETAFRAARAA DPTAKLCINDYNVEGINAKS NSLYDLVKDFKARGVPLDCV GFQSHLIVGQVPGDFRQNLQ RFADLGVDVRITELDIRMRT PSDATKLATQAADYKKVVQA CMQVTRCQGVTVWGITDKYS WVPDVFPGEGAALVWDASYA KKPAYAAVMEAFGAS ; _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 315 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 34230 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 7265 . 2FCb-CexCD . . . . . 100.00 315 100.00 100.00 0.00e+00 . . . . 7264 1 2 no PDB 1EXP . "Beta-1,4-Glycanase Cex-Cd" . . . . . 99.05 312 100.00 100.00 0.00e+00 . . . . 7264 1 3 no PDB 1FH7 . "Crystal Structure Of The Xylanase Cex With Xylobiose- Derived Inhibitor Deoxynojirimycin" . . . . . 99.05 312 100.00 100.00 0.00e+00 . . . . 7264 1 4 no PDB 1FH8 . "Crystal Structure Of The Xylanase Cex With Xylobiose- Derived Isofagomine Inhibitor" . . . . . 99.05 312 100.00 100.00 0.00e+00 . . . . 7264 1 5 no PDB 1FH9 . "Crystal Structure Of The Xylanase Cex With Xylobiose- Derived Lactam Oxime Inhibitor" . . . . . 99.05 312 100.00 100.00 0.00e+00 . . . . 7264 1 6 no PDB 1FHD . "Crystal Structure Of The Xylanase Cex With Xylobiose- Derived Imidazole Inhibitor" . . . . . 99.05 312 100.00 100.00 0.00e+00 . . . . 7264 1 7 no PDB 1J01 . "Crystal Structure Of The Xylanase Cex With Xylobiose- Derived Inhibitor Isofagomine Lactam" . . . . . 99.05 312 100.00 100.00 0.00e+00 . . . . 7264 1 8 no PDB 2EXO . "Crystal Structure Of The Catalytic Domain Of The Beta-1,4- Glycanase Cex From Cellulomonas Fimi" . . . . . 99.05 312 100.00 100.00 0.00e+00 . . . . 7264 1 9 no PDB 2HIS . "Cellulomonas Fimi XylanaseCELLULASE DOUBLE MUTANT E127aH205N WITH COVALENT CELLOBIOSE" . . . . . 99.05 312 99.36 99.68 0.00e+00 . . . . 7264 1 10 no PDB 2XYL . "Cellulomonas Fimi XylanaseCELLULASE COMPLEXED WITH 2-Deoxy- 2-Fluoro-Xylobiose" . . . . . 99.05 312 100.00 100.00 0.00e+00 . . . . 7264 1 11 no PDB 3CUF . "Cellulomonas Fimi XylanaseCELLULASE CEX (CF XYN10A) IN Complex With Cellobiose-Like Isofagomine" . . . . . 100.00 315 100.00 100.00 0.00e+00 . . . . 7264 1 12 no PDB 3CUG . "Cellulomonas Fimi XylanaseCELLULASE CEX (CF XYN10A) IN Complex With Cellotetraose-Like Isofagomine" . . . . . 100.00 315 100.00 100.00 0.00e+00 . . . . 7264 1 13 no PDB 3CUH . "Cellulomonas Fimi XylanaseCELLULASE CEX (CF XYN10A) IN Complex With Cellotriose-Like Isofagomine" . . . . . 100.00 315 100.00 100.00 0.00e+00 . . . . 7264 1 14 no PDB 3CUI . "Cellulomonas Fimi XylanaseCELLULASE CEX (CF XYN10A) IN Complex With Sulfur Substituted Beta-1,4 Xylotetraose" . . . . . 100.00 315 100.00 100.00 0.00e+00 . . . . 7264 1 15 no PDB 3CUJ . "Cellulomonas Fimi XylanaseCELLULASE CEX (CF XYN10A) IN Complex With Sulfur Substituted Beta-1,4 Xylopentaose" . . . . . 100.00 315 100.00 100.00 0.00e+00 . . . . 7264 1 16 no GB AAA56791 . "exoglucanase [Cellulomonas fimi]" . . . . . 100.00 484 99.05 99.05 0.00e+00 . . . . 7264 1 17 no GB AAA56792 . "exo-beta-1,4-glucanase [Cellulomonas fimi]" . . . . . 100.00 485 100.00 100.00 0.00e+00 . . . . 7264 1 18 no GB AEA30147 . "exoglucanase [Cellulomonas fimi ATCC 484]" . . . . . 100.00 485 100.00 100.00 0.00e+00 . . . . 7264 1 19 no GB AEE45406 . "glycoside hydrolase family 10 [Cellulomonas fimi ATCC 484]" . . . . . 100.00 510 100.00 100.00 0.00e+00 . . . . 7264 1 20 no PRF 1211268A . exoglucanase . . . . . 100.00 484 99.05 99.05 0.00e+00 . . . . 7264 1 21 no REF WP_013770432 . "endo-1,4-beta-xylanase [Cellulomonas fimi]" . . . . . 100.00 510 100.00 100.00 0.00e+00 . . . . 7264 1 22 no REF YP_004452793 . "glycoside hydrolase family 10 [Cellulomonas fimi ATCC 484]" . . . . . 100.00 510 100.00 100.00 0.00e+00 . . . . 7264 1 23 no SP P07986 . "RecName: Full=Exoglucanase/xylanase; Includes: RecName: Full=Exoglucanase; AltName: Full=1,4-beta-cellobiohydrolase; AltName: F" . . . . . 100.00 484 99.05 99.05 0.00e+00 . . . . 7264 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . ALA . 7264 1 2 . THR . 7264 1 3 . THR . 7264 1 4 . LEU . 7264 1 5 . LYS . 7264 1 6 . GLU . 7264 1 7 . ALA . 7264 1 8 . ALA . 7264 1 9 . ASP . 7264 1 10 . GLY . 7264 1 11 . ALA . 7264 1 12 . GLY . 7264 1 13 . ARG . 7264 1 14 . ASP . 7264 1 15 . PHE . 7264 1 16 . GLY . 7264 1 17 . PHE . 7264 1 18 . ALA . 7264 1 19 . LEU . 7264 1 20 . ASP . 7264 1 21 . PRO . 7264 1 22 . ASN . 7264 1 23 . ARG . 7264 1 24 . LEU . 7264 1 25 . SER . 7264 1 26 . GLU . 7264 1 27 . ALA . 7264 1 28 . GLN . 7264 1 29 . TYR . 7264 1 30 . LYS . 7264 1 31 . ALA . 7264 1 32 . ILE . 7264 1 33 . ALA . 7264 1 34 . ASP . 7264 1 35 . SER . 7264 1 36 . GLU . 7264 1 37 . PHE . 7264 1 38 . ASN . 7264 1 39 . LEU . 7264 1 40 . VAL . 7264 1 41 . VAL . 7264 1 42 . ALA . 7264 1 43 . GLU . 7264 1 44 . ASN . 7264 1 45 . ALA . 7264 1 46 . MET . 7264 1 47 . LYS . 7264 1 48 . TRP . 7264 1 49 . ASP . 7264 1 50 . ALA . 7264 1 51 . THR . 7264 1 52 . GLU . 7264 1 53 . PRO . 7264 1 54 . SER . 7264 1 55 . GLN . 7264 1 56 . ASN . 7264 1 57 . SER . 7264 1 58 . PHE . 7264 1 59 . SER . 7264 1 60 . PHE . 7264 1 61 . GLY . 7264 1 62 . ALA . 7264 1 63 . GLY . 7264 1 64 . ASP . 7264 1 65 . ARG . 7264 1 66 . VAL . 7264 1 67 . ALA . 7264 1 68 . SER . 7264 1 69 . TYR . 7264 1 70 . ALA . 7264 1 71 . ALA . 7264 1 72 . ASP . 7264 1 73 . THR . 7264 1 74 . GLY . 7264 1 75 . LYS . 7264 1 76 . GLU . 7264 1 77 . LEU . 7264 1 78 . TYR . 7264 1 79 . GLY . 7264 1 80 . HIS . 7264 1 81 . THR . 7264 1 82 . LEU . 7264 1 83 . VAL . 7264 1 84 . TRP . 7264 1 85 . HIS . 7264 1 86 . SER . 7264 1 87 . GLN . 7264 1 88 . LEU . 7264 1 89 . PRO . 7264 1 90 . ASP . 7264 1 91 . TRP . 7264 1 92 . ALA . 7264 1 93 . LYS . 7264 1 94 . ASN . 7264 1 95 . LEU . 7264 1 96 . ASN . 7264 1 97 . GLY . 7264 1 98 . SER . 7264 1 99 . ALA . 7264 1 100 . PHE . 7264 1 101 . GLU . 7264 1 102 . SER . 7264 1 103 . ALA . 7264 1 104 . MET . 7264 1 105 . VAL . 7264 1 106 . ASN . 7264 1 107 . HIS . 7264 1 108 . VAL . 7264 1 109 . THR . 7264 1 110 . LYS . 7264 1 111 . VAL . 7264 1 112 . ALA . 7264 1 113 . ASP . 7264 1 114 . HIS . 7264 1 115 . PHE . 7264 1 116 . GLU . 7264 1 117 . GLY . 7264 1 118 . LYS . 7264 1 119 . VAL . 7264 1 120 . ALA . 7264 1 121 . SER . 7264 1 122 . TRP . 7264 1 123 . ASP . 7264 1 124 . VAL . 7264 1 125 . VAL . 7264 1 126 . ASN . 7264 1 127 . GLU . 7264 1 128 . ALA . 7264 1 129 . PHE . 7264 1 130 . ALA . 7264 1 131 . ASP . 7264 1 132 . GLY . 7264 1 133 . GLY . 7264 1 134 . GLY . 7264 1 135 . ARG . 7264 1 136 . ARG . 7264 1 137 . GLN . 7264 1 138 . ASP . 7264 1 139 . SER . 7264 1 140 . ALA . 7264 1 141 . PHE . 7264 1 142 . GLN . 7264 1 143 . GLN . 7264 1 144 . LYS . 7264 1 145 . LEU . 7264 1 146 . GLY . 7264 1 147 . ASN . 7264 1 148 . GLY . 7264 1 149 . TYR . 7264 1 150 . ILE . 7264 1 151 . GLU . 7264 1 152 . THR . 7264 1 153 . ALA . 7264 1 154 . PHE . 7264 1 155 . ARG . 7264 1 156 . ALA . 7264 1 157 . ALA . 7264 1 158 . ARG . 7264 1 159 . ALA . 7264 1 160 . ALA . 7264 1 161 . ASP . 7264 1 162 . PRO . 7264 1 163 . THR . 7264 1 164 . ALA . 7264 1 165 . LYS . 7264 1 166 . LEU . 7264 1 167 . CYS . 7264 1 168 . ILE . 7264 1 169 . ASN . 7264 1 170 . ASP . 7264 1 171 . TYR . 7264 1 172 . ASN . 7264 1 173 . VAL . 7264 1 174 . GLU . 7264 1 175 . GLY . 7264 1 176 . ILE . 7264 1 177 . ASN . 7264 1 178 . ALA . 7264 1 179 . LYS . 7264 1 180 . SER . 7264 1 181 . ASN . 7264 1 182 . SER . 7264 1 183 . LEU . 7264 1 184 . TYR . 7264 1 185 . ASP . 7264 1 186 . LEU . 7264 1 187 . VAL . 7264 1 188 . LYS . 7264 1 189 . ASP . 7264 1 190 . PHE . 7264 1 191 . LYS . 7264 1 192 . ALA . 7264 1 193 . ARG . 7264 1 194 . GLY . 7264 1 195 . VAL . 7264 1 196 . PRO . 7264 1 197 . LEU . 7264 1 198 . ASP . 7264 1 199 . CYS . 7264 1 200 . VAL . 7264 1 201 . GLY . 7264 1 202 . PHE . 7264 1 203 . GLN . 7264 1 204 . SER . 7264 1 205 . HIS . 7264 1 206 . LEU . 7264 1 207 . ILE . 7264 1 208 . VAL . 7264 1 209 . GLY . 7264 1 210 . GLN . 7264 1 211 . VAL . 7264 1 212 . PRO . 7264 1 213 . GLY . 7264 1 214 . ASP . 7264 1 215 . PHE . 7264 1 216 . ARG . 7264 1 217 . GLN . 7264 1 218 . ASN . 7264 1 219 . LEU . 7264 1 220 . GLN . 7264 1 221 . ARG . 7264 1 222 . PHE . 7264 1 223 . ALA . 7264 1 224 . ASP . 7264 1 225 . LEU . 7264 1 226 . GLY . 7264 1 227 . VAL . 7264 1 228 . ASP . 7264 1 229 . VAL . 7264 1 230 . ARG . 7264 1 231 . ILE . 7264 1 232 . THR . 7264 1 233 . GLU . 7264 1 234 . LEU . 7264 1 235 . ASP . 7264 1 236 . ILE . 7264 1 237 . ARG . 7264 1 238 . MET . 7264 1 239 . ARG . 7264 1 240 . THR . 7264 1 241 . PRO . 7264 1 242 . SER . 7264 1 243 . ASP . 7264 1 244 . ALA . 7264 1 245 . THR . 7264 1 246 . LYS . 7264 1 247 . LEU . 7264 1 248 . ALA . 7264 1 249 . THR . 7264 1 250 . GLN . 7264 1 251 . ALA . 7264 1 252 . ALA . 7264 1 253 . ASP . 7264 1 254 . TYR . 7264 1 255 . LYS . 7264 1 256 . LYS . 7264 1 257 . VAL . 7264 1 258 . VAL . 7264 1 259 . GLN . 7264 1 260 . ALA . 7264 1 261 . CYS . 7264 1 262 . MET . 7264 1 263 . GLN . 7264 1 264 . VAL . 7264 1 265 . THR . 7264 1 266 . ARG . 7264 1 267 . CYS . 7264 1 268 . GLN . 7264 1 269 . GLY . 7264 1 270 . VAL . 7264 1 271 . THR . 7264 1 272 . VAL . 7264 1 273 . TRP . 7264 1 274 . GLY . 7264 1 275 . ILE . 7264 1 276 . THR . 7264 1 277 . ASP . 7264 1 278 . LYS . 7264 1 279 . TYR . 7264 1 280 . SER . 7264 1 281 . TRP . 7264 1 282 . VAL . 7264 1 283 . PRO . 7264 1 284 . ASP . 7264 1 285 . VAL . 7264 1 286 . PHE . 7264 1 287 . PRO . 7264 1 288 . GLY . 7264 1 289 . GLU . 7264 1 290 . GLY . 7264 1 291 . ALA . 7264 1 292 . ALA . 7264 1 293 . LEU . 7264 1 294 . VAL . 7264 1 295 . TRP . 7264 1 296 . ASP . 7264 1 297 . ALA . 7264 1 298 . SER . 7264 1 299 . TYR . 7264 1 300 . ALA . 7264 1 301 . LYS . 7264 1 302 . LYS . 7264 1 303 . PRO . 7264 1 304 . ALA . 7264 1 305 . TYR . 7264 1 306 . ALA . 7264 1 307 . ALA . 7264 1 308 . VAL . 7264 1 309 . MET . 7264 1 310 . GLU . 7264 1 311 . ALA . 7264 1 312 . PHE . 7264 1 313 . GLY . 7264 1 314 . ALA . 7264 1 315 . SER . 7264 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ALA 1 1 7264 1 . THR 2 2 7264 1 . THR 3 3 7264 1 . LEU 4 4 7264 1 . LYS 5 5 7264 1 . GLU 6 6 7264 1 . ALA 7 7 7264 1 . ALA 8 8 7264 1 . ASP 9 9 7264 1 . GLY 10 10 7264 1 . ALA 11 11 7264 1 . GLY 12 12 7264 1 . ARG 13 13 7264 1 . ASP 14 14 7264 1 . PHE 15 15 7264 1 . GLY 16 16 7264 1 . PHE 17 17 7264 1 . ALA 18 18 7264 1 . LEU 19 19 7264 1 . ASP 20 20 7264 1 . PRO 21 21 7264 1 . ASN 22 22 7264 1 . ARG 23 23 7264 1 . LEU 24 24 7264 1 . SER 25 25 7264 1 . GLU 26 26 7264 1 . ALA 27 27 7264 1 . GLN 28 28 7264 1 . TYR 29 29 7264 1 . LYS 30 30 7264 1 . ALA 31 31 7264 1 . ILE 32 32 7264 1 . ALA 33 33 7264 1 . ASP 34 34 7264 1 . SER 35 35 7264 1 . GLU 36 36 7264 1 . PHE 37 37 7264 1 . ASN 38 38 7264 1 . LEU 39 39 7264 1 . VAL 40 40 7264 1 . VAL 41 41 7264 1 . ALA 42 42 7264 1 . GLU 43 43 7264 1 . ASN 44 44 7264 1 . ALA 45 45 7264 1 . MET 46 46 7264 1 . LYS 47 47 7264 1 . TRP 48 48 7264 1 . ASP 49 49 7264 1 . ALA 50 50 7264 1 . THR 51 51 7264 1 . GLU 52 52 7264 1 . PRO 53 53 7264 1 . SER 54 54 7264 1 . GLN 55 55 7264 1 . ASN 56 56 7264 1 . SER 57 57 7264 1 . PHE 58 58 7264 1 . SER 59 59 7264 1 . PHE 60 60 7264 1 . GLY 61 61 7264 1 . ALA 62 62 7264 1 . GLY 63 63 7264 1 . ASP 64 64 7264 1 . ARG 65 65 7264 1 . VAL 66 66 7264 1 . ALA 67 67 7264 1 . SER 68 68 7264 1 . TYR 69 69 7264 1 . ALA 70 70 7264 1 . ALA 71 71 7264 1 . ASP 72 72 7264 1 . THR 73 73 7264 1 . GLY 74 74 7264 1 . LYS 75 75 7264 1 . GLU 76 76 7264 1 . LEU 77 77 7264 1 . TYR 78 78 7264 1 . GLY 79 79 7264 1 . HIS 80 80 7264 1 . THR 81 81 7264 1 . LEU 82 82 7264 1 . VAL 83 83 7264 1 . TRP 84 84 7264 1 . HIS 85 85 7264 1 . SER 86 86 7264 1 . GLN 87 87 7264 1 . LEU 88 88 7264 1 . PRO 89 89 7264 1 . ASP 90 90 7264 1 . TRP 91 91 7264 1 . ALA 92 92 7264 1 . LYS 93 93 7264 1 . ASN 94 94 7264 1 . LEU 95 95 7264 1 . ASN 96 96 7264 1 . GLY 97 97 7264 1 . SER 98 98 7264 1 . ALA 99 99 7264 1 . PHE 100 100 7264 1 . GLU 101 101 7264 1 . SER 102 102 7264 1 . ALA 103 103 7264 1 . MET 104 104 7264 1 . VAL 105 105 7264 1 . ASN 106 106 7264 1 . HIS 107 107 7264 1 . VAL 108 108 7264 1 . THR 109 109 7264 1 . LYS 110 110 7264 1 . VAL 111 111 7264 1 . ALA 112 112 7264 1 . ASP 113 113 7264 1 . HIS 114 114 7264 1 . PHE 115 115 7264 1 . GLU 116 116 7264 1 . GLY 117 117 7264 1 . LYS 118 118 7264 1 . VAL 119 119 7264 1 . ALA 120 120 7264 1 . SER 121 121 7264 1 . TRP 122 122 7264 1 . ASP 123 123 7264 1 . VAL 124 124 7264 1 . VAL 125 125 7264 1 . ASN 126 126 7264 1 . GLU 127 127 7264 1 . ALA 128 128 7264 1 . PHE 129 129 7264 1 . ALA 130 130 7264 1 . ASP 131 131 7264 1 . GLY 132 132 7264 1 . GLY 133 133 7264 1 . GLY 134 134 7264 1 . ARG 135 135 7264 1 . ARG 136 136 7264 1 . GLN 137 137 7264 1 . ASP 138 138 7264 1 . SER 139 139 7264 1 . ALA 140 140 7264 1 . PHE 141 141 7264 1 . GLN 142 142 7264 1 . GLN 143 143 7264 1 . LYS 144 144 7264 1 . LEU 145 145 7264 1 . GLY 146 146 7264 1 . ASN 147 147 7264 1 . GLY 148 148 7264 1 . TYR 149 149 7264 1 . ILE 150 150 7264 1 . GLU 151 151 7264 1 . THR 152 152 7264 1 . ALA 153 153 7264 1 . PHE 154 154 7264 1 . ARG 155 155 7264 1 . ALA 156 156 7264 1 . ALA 157 157 7264 1 . ARG 158 158 7264 1 . ALA 159 159 7264 1 . ALA 160 160 7264 1 . ASP 161 161 7264 1 . PRO 162 162 7264 1 . THR 163 163 7264 1 . ALA 164 164 7264 1 . LYS 165 165 7264 1 . LEU 166 166 7264 1 . CYS 167 167 7264 1 . ILE 168 168 7264 1 . ASN 169 169 7264 1 . ASP 170 170 7264 1 . TYR 171 171 7264 1 . ASN 172 172 7264 1 . VAL 173 173 7264 1 . GLU 174 174 7264 1 . GLY 175 175 7264 1 . ILE 176 176 7264 1 . ASN 177 177 7264 1 . ALA 178 178 7264 1 . LYS 179 179 7264 1 . SER 180 180 7264 1 . ASN 181 181 7264 1 . SER 182 182 7264 1 . LEU 183 183 7264 1 . TYR 184 184 7264 1 . ASP 185 185 7264 1 . LEU 186 186 7264 1 . VAL 187 187 7264 1 . LYS 188 188 7264 1 . ASP 189 189 7264 1 . PHE 190 190 7264 1 . LYS 191 191 7264 1 . ALA 192 192 7264 1 . ARG 193 193 7264 1 . GLY 194 194 7264 1 . VAL 195 195 7264 1 . PRO 196 196 7264 1 . LEU 197 197 7264 1 . ASP 198 198 7264 1 . CYS 199 199 7264 1 . VAL 200 200 7264 1 . GLY 201 201 7264 1 . PHE 202 202 7264 1 . GLN 203 203 7264 1 . SER 204 204 7264 1 . HIS 205 205 7264 1 . LEU 206 206 7264 1 . ILE 207 207 7264 1 . VAL 208 208 7264 1 . GLY 209 209 7264 1 . GLN 210 210 7264 1 . VAL 211 211 7264 1 . PRO 212 212 7264 1 . GLY 213 213 7264 1 . ASP 214 214 7264 1 . PHE 215 215 7264 1 . ARG 216 216 7264 1 . GLN 217 217 7264 1 . ASN 218 218 7264 1 . LEU 219 219 7264 1 . GLN 220 220 7264 1 . ARG 221 221 7264 1 . PHE 222 222 7264 1 . ALA 223 223 7264 1 . ASP 224 224 7264 1 . LEU 225 225 7264 1 . GLY 226 226 7264 1 . VAL 227 227 7264 1 . ASP 228 228 7264 1 . VAL 229 229 7264 1 . ARG 230 230 7264 1 . ILE 231 231 7264 1 . THR 232 232 7264 1 . GLU 233 233 7264 1 . LEU 234 234 7264 1 . ASP 235 235 7264 1 . ILE 236 236 7264 1 . ARG 237 237 7264 1 . MET 238 238 7264 1 . ARG 239 239 7264 1 . THR 240 240 7264 1 . PRO 241 241 7264 1 . SER 242 242 7264 1 . ASP 243 243 7264 1 . ALA 244 244 7264 1 . THR 245 245 7264 1 . LYS 246 246 7264 1 . LEU 247 247 7264 1 . ALA 248 248 7264 1 . THR 249 249 7264 1 . GLN 250 250 7264 1 . ALA 251 251 7264 1 . ALA 252 252 7264 1 . ASP 253 253 7264 1 . TYR 254 254 7264 1 . LYS 255 255 7264 1 . LYS 256 256 7264 1 . VAL 257 257 7264 1 . VAL 258 258 7264 1 . GLN 259 259 7264 1 . ALA 260 260 7264 1 . CYS 261 261 7264 1 . MET 262 262 7264 1 . GLN 263 263 7264 1 . VAL 264 264 7264 1 . THR 265 265 7264 1 . ARG 266 266 7264 1 . CYS 267 267 7264 1 . GLN 268 268 7264 1 . GLY 269 269 7264 1 . VAL 270 270 7264 1 . THR 271 271 7264 1 . VAL 272 272 7264 1 . TRP 273 273 7264 1 . GLY 274 274 7264 1 . ILE 275 275 7264 1 . THR 276 276 7264 1 . ASP 277 277 7264 1 . LYS 278 278 7264 1 . TYR 279 279 7264 1 . SER 280 280 7264 1 . TRP 281 281 7264 1 . VAL 282 282 7264 1 . PRO 283 283 7264 1 . ASP 284 284 7264 1 . VAL 285 285 7264 1 . PHE 286 286 7264 1 . PRO 287 287 7264 1 . GLY 288 288 7264 1 . GLU 289 289 7264 1 . GLY 290 290 7264 1 . ALA 291 291 7264 1 . ALA 292 292 7264 1 . LEU 293 293 7264 1 . VAL 294 294 7264 1 . TRP 295 295 7264 1 . ASP 296 296 7264 1 . ALA 297 297 7264 1 . SER 298 298 7264 1 . TYR 299 299 7264 1 . ALA 300 300 7264 1 . LYS 301 301 7264 1 . LYS 302 302 7264 1 . PRO 303 303 7264 1 . ALA 304 304 7264 1 . TYR 305 305 7264 1 . ALA 306 306 7264 1 . ALA 307 307 7264 1 . VAL 308 308 7264 1 . MET 309 309 7264 1 . GLU 310 310 7264 1 . ALA 311 311 7264 1 . PHE 312 312 7264 1 . GLY 313 313 7264 1 . ALA 314 314 7264 1 . SER 315 315 7264 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 7264 _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 $apo-CexCD . 1708 . no . 'Cellulomonas fimi' . . Bacteria Actinobacteria Cellulomonas fimi . . . . . . . . . . . . . . . . . . . . . 7264 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 7264 _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 $apo-CexCD . 'recombinant technology' . 'E. coli' 'E. coli BL21 (DE3)' . Escherichia coli BL21 . . . . . . . . . . . . plasmid . . pUC12-1.1Cex(PTIS) 'O'Neill, G. P., Kilburn, D. G., Warren, R. A., and Miller, R. C., Jr. (1986) Appl Environ Microbiol 52, 737-43.' . . . . . 7264 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_apo_CexCD _Sample.Sf_category sample _Sample.Sf_framecode apo_CexCD _Sample.Entry_ID 7264 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 apo-CexCD '[70% 2H; U-99% 13C; U-99% 15N]' . . 1 $apo-CexCD . . 0.4 . . mM . . . . 7264 1 2 'potassium phosphate' . . . . . . . 20 . . mM . . . . 7264 1 3 'sodium azide' . . . . . . . 0.02 . . % . . . . 7264 1 stop_ save_ ####################### # Sample conditions # ####################### save_NMR_buffering_condition _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode NMR_buffering_condition _Sample_condition_list.Entry_ID 7264 _Sample_condition_list.ID 1 _Sample_condition_list.Details ; 20mM potassium phosphate 0.02% sodium azide ; loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.5 0.1 pH 7264 1 temperature 303 . K 7264 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRpipe _Software.Sf_category software _Software.Sf_framecode NMRpipe _Software.Entry_ID 7264 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_spectrometer _NMR_spectrometer.Entry_ID 7264 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 7264 _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 '1H-15N TROSY HSQC' no . . . . . . . . . . 1 $apo_CexCD . . . 1 $NMR_buffering_condition . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 7264 1 2 HNCA no . . . . . . . . . . 1 $apo_CexCD . . . 1 $NMR_buffering_condition . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 7264 1 3 HN(CO)CA no . . . . . . . . . . 1 $apo_CexCD . . . 1 $NMR_buffering_condition . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 7264 1 4 HNCO no . . . . . . . . . . 1 $apo_CexCD . . . 1 $NMR_buffering_condition . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 7264 1 5 HN(CA)CO no . . . . . . . . . . 1 $apo_CexCD . . . 1 $NMR_buffering_condition . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 7264 1 6 HN(CA)CB no . . . . . . . . . . 1 $apo_CexCD . . . 1 $NMR_buffering_condition . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 7264 1 7 HN(COCA)CB no . . . . . . . . . . 1 $apo_CexCD . . . 1 $NMR_buffering_condition . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 7264 1 8 NN-NOESY no . . . . . . . . . . 1 $apo_CexCD . . . 1 $NMR_buffering_condition . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 7264 1 9 HN-NOESY no . . . . . . . . . . 1 $apo_CexCD . . . 1 $NMR_buffering_condition . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 7264 1 stop_ save_ save_1H-15N_TROSY_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H-15N_TROSY_HSQC _NMR_spec_expt.Entry_ID 7264 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '1H-15N TROSY HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HNCA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HNCA _NMR_spec_expt.Entry_ID 7264 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name HNCA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HN(CO)CA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HN(CO)CA _NMR_spec_expt.Entry_ID 7264 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HN(CO)CA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HNCO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HNCO _NMR_spec_expt.Entry_ID 7264 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HNCO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HN(CA)CO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HN(CA)CO _NMR_spec_expt.Entry_ID 7264 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name HN(CA)CO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HN(CA)CB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HN(CA)CB _NMR_spec_expt.Entry_ID 7264 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name HN(CA)CB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HN(COCA)CB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HN(COCA)CB _NMR_spec_expt.Entry_ID 7264 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name HN(COCA)CB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NN-NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NN-NOESY _NMR_spec_expt.Entry_ID 7264 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name NN-NOESY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HN-NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HN-NOESY _NMR_spec_expt.Entry_ID 7264 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name HN-NOESY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $NMRpipe _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 7264 _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 carbon' . . . . ppm 0 external direct 1.0 'outside sample' cylindrical parallel . . . . . . 7264 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1.0 'outside sample' cylindrical parallel . . . . . . 7264 1 N 15 NH3 nitrogen . . . . ppm 0 external indirect 0.101329118 'outside sample' cylindrical parallel . . . . . . 7264 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7264 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $NMR_buffering_condition _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details 'Chemical shifts not corrected for trosy (1HN, 15N) or deuterium-isotope shifts (13C)' _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 $apo_CexCD isotropic 7264 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID 'TROSY effect' N 15 47 . 7264 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 2 2 THR C C 13 174.177 0.20 . 1 . . . . 2 T C . 7264 1 2 . 1 1 2 2 THR CA C 13 62.648 0.20 . 1 . . . . 2 T CA . 7264 1 3 . 1 1 2 2 THR CB C 13 69.848 0.20 . 1 . . . . 2 T CB . 7264 1 4 . 1 1 3 3 THR H H 1 7.29 0.02 . 1 . . . . 3 T HN . 7264 1 5 . 1 1 3 3 THR C C 13 175.366 0.20 . 1 . . . . 3 T C . 7264 1 6 . 1 1 3 3 THR CA C 13 58.78 0.20 . 1 . . . . 3 T CA . 7264 1 7 . 1 1 3 3 THR CB C 13 74.175 0.20 . 1 . . . . 3 T CB . 7264 1 8 . 1 1 3 3 THR N N 15 110.811 0.20 . 1 . . . . 3 T N . 7264 1 9 . 1 1 4 4 LEU H H 1 9.679 0.02 . 1 . . . . 4 L HN . 7264 1 10 . 1 1 4 4 LEU C C 13 178.597 0.20 . 1 . . . . 4 L C . 7264 1 11 . 1 1 4 4 LEU CA C 13 57.062 0.20 . 1 . . . . 4 L CA . 7264 1 12 . 1 1 4 4 LEU CB C 13 39.355 0.20 . 1 . . . . 4 L CB . 7264 1 13 . 1 1 4 4 LEU N N 15 122.59 0.20 . 1 . . . . 4 L N . 7264 1 14 . 1 1 5 5 LYS H H 1 6.49 0.02 . 1 . . . . 5 K HN . 7264 1 15 . 1 1 5 5 LYS C C 13 176.961 0.20 . 1 . . . . 5 K C . 7264 1 16 . 1 1 5 5 LYS CA C 13 59.296 0.20 . 1 . . . . 5 K CA . 7264 1 17 . 1 1 5 5 LYS CB C 13 32.136 0.20 . 1 . . . . 5 K CB . 7264 1 18 . 1 1 5 5 LYS N N 15 119.296 0.20 . 1 . . . . 5 K N . 7264 1 19 . 1 1 6 6 GLU H H 1 7.601 0.02 . 1 . . . . 6 E HN . 7264 1 20 . 1 1 6 6 GLU C C 13 180.205 0.20 . 1 . . . . 6 E C . 7264 1 21 . 1 1 6 6 GLU CA C 13 58.457 0.20 . 1 . . . . 6 E CA . 7264 1 22 . 1 1 6 6 GLU CB C 13 30.007 0.20 . 1 . . . . 6 E CB . 7264 1 23 . 1 1 6 6 GLU CD C 13 183.756 0.20 . 1 . . . . 6 E CD . 7264 1 24 . 1 1 6 6 GLU N N 15 118.913 0.20 . 1 . . . . 6 E N . 7264 1 25 . 1 1 7 7 ALA H H 1 7.578 0.02 . 1 . . . . 7 A HN . 7264 1 26 . 1 1 7 7 ALA C C 13 179.072 0.20 . 1 . . . . 7 A C . 7264 1 27 . 1 1 7 7 ALA CA C 13 54.027 0.20 . 1 . . . . 7 A CA . 7264 1 28 . 1 1 7 7 ALA CB C 13 18.338 0.20 . 1 . . . . 7 A CB . 7264 1 29 . 1 1 7 7 ALA N N 15 123.268 0.20 . 1 . . . . 7 A N . 7264 1 30 . 1 1 8 8 ALA H H 1 8.252 0.02 . 1 . . . . 8 A HN . 7264 1 31 . 1 1 8 8 ALA C C 13 179.777 0.20 . 1 . . . . 8 A C . 7264 1 32 . 1 1 8 8 ALA CA C 13 55.173 0.20 . 1 . . . . 8 A CA . 7264 1 33 . 1 1 8 8 ALA CB C 13 17.772 0.20 . 1 . . . . 8 A CB . 7264 1 34 . 1 1 8 8 ALA N N 15 124.191 0.20 . 1 . . . . 8 A N . 7264 1 35 . 1 1 9 9 ASP H H 1 8.906 0.02 . 1 . . . . 9 D HN . 7264 1 36 . 1 1 9 9 ASP C C 13 181.387 0.20 . 1 . . . . 9 D C . 7264 1 37 . 1 1 9 9 ASP CA C 13 56.925 0.20 . 1 . . . . 9 D CA . 7264 1 38 . 1 1 9 9 ASP CB C 13 39.637 0.20 . 1 . . . . 9 D CB . 7264 1 39 . 1 1 9 9 ASP CG C 13 178.7 0.20 . 1 . . . . 9 D CG . 7264 1 40 . 1 1 9 9 ASP N N 15 119.639 0.20 . 1 . . . . 9 D N . 7264 1 41 . 1 1 10 10 GLY H H 1 7.96 0.02 . 1 . . . . 10 G HN . 7264 1 42 . 1 1 10 10 GLY C C 13 174.578 0.20 . 1 . . . . 10 G C . 7264 1 43 . 1 1 10 10 GLY CA C 13 46.434 0.20 . 1 . . . . 10 G CA . 7264 1 44 . 1 1 10 10 GLY N N 15 108.622 0.20 . 1 . . . . 10 G N . 7264 1 45 . 1 1 11 11 ALA H H 1 7.4 0.02 . 1 . . . . 11 A HN . 7264 1 46 . 1 1 11 11 ALA C C 13 177.661 0.20 . 1 . . . . 11 A C . 7264 1 47 . 1 1 11 11 ALA CA C 13 51.509 0.20 . 1 . . . . 11 A CA . 7264 1 48 . 1 1 11 11 ALA CB C 13 19.743 0.20 . 1 . . . . 11 A CB . 7264 1 49 . 1 1 11 11 ALA N N 15 122.936 0.20 . 1 . . . . 11 A N . 7264 1 50 . 1 1 12 12 GLY H H 1 7.919 0.02 . 1 . . . . 12 G HN . 7264 1 51 . 1 1 12 12 GLY C C 13 174.803 0.20 . 1 . . . . 12 G C . 7264 1 52 . 1 1 12 12 GLY CA C 13 46.267 0.20 . 1 . . . . 12 G CA . 7264 1 53 . 1 1 12 12 GLY N N 15 110.156 0.20 . 1 . . . . 12 G N . 7264 1 54 . 1 1 13 13 ARG H H 1 7.933 0.02 . 1 . . . . 13 R HN . 7264 1 55 . 1 1 13 13 ARG C C 13 174.902 0.20 . 1 . . . . 13 R C . 7264 1 56 . 1 1 13 13 ARG CA C 13 52.432 0.20 . 1 . . . . 13 R CA . 7264 1 57 . 1 1 13 13 ARG CB C 13 34.58 0.20 . 1 . . . . 13 R CB . 7264 1 58 . 1 1 13 13 ARG N N 15 117.48 0.20 . 1 . . . . 13 R N . 7264 1 59 . 1 1 14 14 ASP H H 1 8.816 0.02 . 1 . . . . 14 D HN . 7264 1 60 . 1 1 14 14 ASP C C 13 175.982 0.20 . 1 . . . . 14 D C . 7264 1 61 . 1 1 14 14 ASP CA C 13 53.341 0.20 . 1 . . . . 14 D CA . 7264 1 62 . 1 1 14 14 ASP CB C 13 42.534 0.20 . 1 . . . . 14 D CB . 7264 1 63 . 1 1 14 14 ASP CG C 13 177.371 0.20 . 1 . . . . 14 D CG . 7264 1 64 . 1 1 14 14 ASP N N 15 120.237 0.20 . 1 . . . . 14 D N . 7264 1 65 . 1 1 15 15 PHE H H 1 10.055 0.02 . 1 . . . . 15 F HN . 7264 1 66 . 1 1 15 15 PHE C C 13 175.02 0.20 . 1 . . . . 15 F C . 7264 1 67 . 1 1 15 15 PHE CA C 13 56.648 0.20 . 1 . . . . 15 F CA . 7264 1 68 . 1 1 15 15 PHE CB C 13 41.561 0.20 . 1 . . . . 15 F CB . 7264 1 69 . 1 1 15 15 PHE N N 15 125.185 0.20 . 1 . . . . 15 F N . 7264 1 70 . 1 1 16 16 GLY H H 1 9.213 0.02 . 1 . . . . 16 G HN . 7264 1 71 . 1 1 16 16 GLY C C 13 171.476 0.20 . 1 . . . . 16 G C . 7264 1 72 . 1 1 16 16 GLY CA C 13 44.994 0.20 . 1 . . . . 16 G CA . 7264 1 73 . 1 1 16 16 GLY N N 15 114.901 0.20 . 1 . . . . 16 G N . 7264 1 74 . 1 1 17 17 PHE H H 1 7.188 0.02 . 1 . . . . 17 F HN . 7264 1 75 . 1 1 17 17 PHE C C 13 172.284 0.20 . 1 . . . . 17 F C . 7264 1 76 . 1 1 17 17 PHE CA C 13 53.624 0.20 . 1 . . . . 17 F CA . 7264 1 77 . 1 1 17 17 PHE CB C 13 41.966 0.20 . 1 . . . . 17 F CB . 7264 1 78 . 1 1 17 17 PHE N N 15 113.745 0.20 . 1 . . . . 17 F N . 7264 1 79 . 1 1 18 18 ALA H H 1 5.772 0.02 . 1 . . . . 18 A HN . 7264 1 80 . 1 1 18 18 ALA C C 13 174.639 0.20 . 1 . . . . 18 A C . 7264 1 81 . 1 1 18 18 ALA CA C 13 49.024 0.20 . 1 . . . . 18 A CA . 7264 1 82 . 1 1 18 18 ALA CB C 13 15.625 0.20 . 1 . . . . 18 A CB . 7264 1 83 . 1 1 18 18 ALA N N 15 119.822 0.20 . 1 . . . . 18 A N . 7264 1 84 . 1 1 19 19 LEU H H 1 8.59 0.02 . 1 . . . . 19 L HN . 7264 1 85 . 1 1 19 19 LEU C C 13 176.251 0.20 . 1 . . . . 19 L C . 7264 1 86 . 1 1 19 19 LEU CA C 13 53.855 0.20 . 1 . . . . 19 L CA . 7264 1 87 . 1 1 19 19 LEU CB C 13 43.715 0.20 . 1 . . . . 19 L CB . 7264 1 88 . 1 1 19 19 LEU N N 15 125.162 0.20 . 1 . . . . 19 L N . 7264 1 89 . 1 1 20 20 ASP H H 1 7.067 0.02 . 1 . . . . 20 D HN . 7264 1 90 . 1 1 20 20 ASP C C 13 175.533 0.20 . 1 . . . . 20 D C . 7264 1 91 . 1 1 20 20 ASP CA C 13 49.972 0.20 . 1 . . . . 20 D CA . 7264 1 92 . 1 1 20 20 ASP CB C 13 41.767 0.20 . 1 . . . . 20 D CB . 7264 1 93 . 1 1 20 20 ASP N N 15 127.136 0.20 . 1 . . . . 20 D N . 7264 1 94 . 1 1 21 21 PRO C C 13 177.455 0.20 . 1 . . . . 21 P C . 7264 1 95 . 1 1 21 21 PRO CA C 13 63.815 0.20 . 1 . . . . 21 P CA . 7264 1 96 . 1 1 21 21 PRO CB C 13 31.111 0.20 . 1 . . . . 21 P CB . 7264 1 97 . 1 1 22 22 ASN H H 1 8.09 0.02 . 1 . . . . 22 N HN . 7264 1 98 . 1 1 22 22 ASN C C 13 177.015 0.20 . 1 . . . . 22 N C . 7264 1 99 . 1 1 22 22 ASN CA C 13 55.134 0.20 . 1 . . . . 22 N CA . 7264 1 100 . 1 1 22 22 ASN CB C 13 37.473 0.20 . 1 . . . . 22 N CB . 7264 1 101 . 1 1 22 22 ASN CG C 13 176.507 0.20 . 1 . . . . 22 N CG . 7264 1 102 . 1 1 22 22 ASN N N 15 118.232 0.20 . 1 . . . . 22 N N . 7264 1 103 . 1 1 23 23 ARG H H 1 7.537 0.02 . 1 . . . . 23 R HN . 7264 1 104 . 1 1 23 23 ARG C C 13 176.255 0.20 . 1 . . . . 23 R C . 7264 1 105 . 1 1 23 23 ARG CA C 13 54.064 0.20 . 1 . . . . 23 R CA . 7264 1 106 . 1 1 23 23 ARG CB C 13 25.557 0.20 . 1 . . . . 23 R CB . 7264 1 107 . 1 1 23 23 ARG N N 15 115.102 0.20 . 1 . . . . 23 R N . 7264 1 108 . 1 1 24 24 LEU H H 1 6.847 0.02 . 1 . . . . 24 L HN . 7264 1 109 . 1 1 24 24 LEU C C 13 176.171 0.20 . 1 . . . . 24 L C . 7264 1 110 . 1 1 24 24 LEU CA C 13 56.493 0.20 . 1 . . . . 24 L CA . 7264 1 111 . 1 1 24 24 LEU CB C 13 40.548 0.20 . 1 . . . . 24 L CB . 7264 1 112 . 1 1 24 24 LEU N N 15 116.4 0.20 . 1 . . . . 24 L N . 7264 1 113 . 1 1 25 25 SER H H 1 6.983 0.02 . 1 . . . . 25 S HN . 7264 1 114 . 1 1 25 25 SER C C 13 173.847 0.20 . 1 . . . . 25 S C . 7264 1 115 . 1 1 25 25 SER CA C 13 58.625 0.20 . 1 . . . . 25 S CA . 7264 1 116 . 1 1 25 25 SER CB C 13 62.998 0.20 . 1 . . . . 25 S CB . 7264 1 117 . 1 1 25 25 SER N N 15 110.726 0.20 . 1 . . . . 25 S N . 7264 1 118 . 1 1 26 26 GLU H H 1 7.746 0.02 . 1 . . . . 26 E HN . 7264 1 119 . 1 1 26 26 GLU C C 13 175.996 0.20 . 1 . . . . 26 E C . 7264 1 120 . 1 1 26 26 GLU CA C 13 55.273 0.20 . 1 . . . . 26 E CA . 7264 1 121 . 1 1 26 26 GLU CB C 13 28.517 0.20 . 1 . . . . 26 E CB . 7264 1 122 . 1 1 26 26 GLU CD C 13 184.39 0.20 . 1 . . . . 26 E CD . 7264 1 123 . 1 1 26 26 GLU N N 15 126.086 0.20 . 1 . . . . 26 E N . 7264 1 124 . 1 1 27 27 ALA H H 1 8.744 0.02 . 1 . . . . 27 A HN . 7264 1 125 . 1 1 27 27 ALA C C 13 180.573 0.20 . 1 . . . . 27 A C . 7264 1 126 . 1 1 27 27 ALA CA C 13 55.82 0.20 . 1 . . . . 27 A CA . 7264 1 127 . 1 1 27 27 ALA CB C 13 18.065 0.20 . 1 . . . . 27 A CB . 7264 1 128 . 1 1 27 27 ALA N N 15 131.368 0.20 . 1 . . . . 27 A N . 7264 1 129 . 1 1 28 28 GLN H H 1 8.891 0.02 . 1 . . . . 28 Q HN . 7264 1 130 . 1 1 28 28 GLN C C 13 177.359 0.20 . 1 . . . . 28 Q C . 7264 1 131 . 1 1 28 28 GLN CA C 13 58.595 0.20 . 1 . . . . 28 Q CA . 7264 1 132 . 1 1 28 28 GLN CB C 13 28.325 0.20 . 1 . . . . 28 Q CB . 7264 1 133 . 1 1 28 28 GLN CD C 13 180.515 0.20 . 1 . . . . 28 Q CD . 7264 1 134 . 1 1 28 28 GLN N N 15 115.502 0.20 . 1 . . . . 28 Q N . 7264 1 135 . 1 1 29 29 TYR H H 1 6.46 0.02 . 1 . . . . 29 Y HN . 7264 1 136 . 1 1 29 29 TYR C C 13 176.647 0.20 . 1 . . . . 29 Y C . 7264 1 137 . 1 1 29 29 TYR CA C 13 60.912 0.20 . 1 . . . . 29 Y CA . 7264 1 138 . 1 1 29 29 TYR CB C 13 37.305 0.20 . 1 . . . . 29 Y CB . 7264 1 139 . 1 1 29 29 TYR N N 15 119.368 0.20 . 1 . . . . 29 Y N . 7264 1 140 . 1 1 30 30 LYS H H 1 8.011 0.02 . 1 . . . . 30 K HN . 7264 1 141 . 1 1 30 30 LYS C C 13 176.775 0.20 . 1 . . . . 30 K C . 7264 1 142 . 1 1 30 30 LYS CA C 13 59.044 0.20 . 1 . . . . 30 K CA . 7264 1 143 . 1 1 30 30 LYS CB C 13 32.099 0.20 . 1 . . . . 30 K CB . 7264 1 144 . 1 1 30 30 LYS N N 15 118.774 0.20 . 1 . . . . 30 K N . 7264 1 145 . 1 1 31 31 ALA H H 1 7.915 0.02 . 1 . . . . 31 A HN . 7264 1 146 . 1 1 31 31 ALA C C 13 181.331 0.20 . 1 . . . . 31 A C . 7264 1 147 . 1 1 31 31 ALA CA C 13 54.724 0.20 . 1 . . . . 31 A CA . 7264 1 148 . 1 1 31 31 ALA CB C 13 17.71 0.20 . 1 . . . . 31 A CB . 7264 1 149 . 1 1 31 31 ALA N N 15 118.234 0.20 . 1 . . . . 31 A N . 7264 1 150 . 1 1 32 32 ILE H H 1 6.83 0.02 . 1 . . . . 32 I HN . 7264 1 151 . 1 1 32 32 ILE C C 13 176.397 0.20 . 1 . . . . 32 I C . 7264 1 152 . 1 1 32 32 ILE CA C 13 64.471 0.20 . 1 . . . . 32 I CA . 7264 1 153 . 1 1 32 32 ILE CB C 13 38.013 0.20 . 1 . . . . 32 I CB . 7264 1 154 . 1 1 32 32 ILE N N 15 120.519 0.20 . 1 . . . . 32 I N . 7264 1 155 . 1 1 33 33 ALA H H 1 7.945 0.02 . 1 . . . . 33 A HN . 7264 1 156 . 1 1 33 33 ALA C C 13 179.43 0.20 . 1 . . . . 33 A C . 7264 1 157 . 1 1 33 33 ALA CA C 13 54.549 0.20 . 1 . . . . 33 A CA . 7264 1 158 . 1 1 33 33 ALA CB C 13 18.52 0.20 . 1 . . . . 33 A CB . 7264 1 159 . 1 1 33 33 ALA N N 15 123.782 0.20 . 1 . . . . 33 A N . 7264 1 160 . 1 1 34 34 ASP H H 1 8.689 0.02 . 1 . . . . 34 D HN . 7264 1 161 . 1 1 34 34 ASP C C 13 178.841 0.20 . 1 . . . . 34 D C . 7264 1 162 . 1 1 34 34 ASP CA C 13 57.053 0.20 . 1 . . . . 34 D CA . 7264 1 163 . 1 1 34 34 ASP CB C 13 40.475 0.20 . 1 . . . . 34 D CB . 7264 1 164 . 1 1 34 34 ASP CG C 13 178.863 0.20 . 1 . . . . 34 D CG . 7264 1 165 . 1 1 34 34 ASP N N 15 112.454 0.20 . 1 . . . . 34 D N . 7264 1 166 . 1 1 35 35 SER H H 1 7.454 0.02 . 1 . . . . 35 S HN . 7264 1 167 . 1 1 35 35 SER C C 13 176.468 0.20 . 1 . . . . 35 S C . 7264 1 168 . 1 1 35 35 SER CA C 13 60.131 0.20 . 1 . . . . 35 S CA . 7264 1 169 . 1 1 35 35 SER CB C 13 66.054 0.20 . 1 . . . . 35 S CB . 7264 1 170 . 1 1 35 35 SER N N 15 111.804 0.20 . 1 . . . . 35 S N . 7264 1 171 . 1 1 36 36 GLU H H 1 8.246 0.02 . 1 . . . . 36 E HN . 7264 1 172 . 1 1 36 36 GLU C C 13 173.067 0.20 . 1 . . . . 36 E C . 7264 1 173 . 1 1 36 36 GLU CA C 13 58.034 0.20 . 1 . . . . 36 E CA . 7264 1 174 . 1 1 36 36 GLU CB C 13 28.745 0.20 . 1 . . . . 36 E CB . 7264 1 175 . 1 1 36 36 GLU CD C 13 182.515 0.20 . 1 . . . . 36 E CD . 7264 1 176 . 1 1 36 36 GLU N N 15 117.314 0.20 . 1 . . . . 36 E N . 7264 1 177 . 1 1 37 37 PHE H H 1 6.413 0.02 . 1 . . . . 37 F HN . 7264 1 178 . 1 1 37 37 PHE C C 13 176.496 0.20 . 1 . . . . 37 F C . 7264 1 179 . 1 1 37 37 PHE CA C 13 56.184 0.20 . 1 . . . . 37 F CA . 7264 1 180 . 1 1 37 37 PHE CB C 13 44.243 0.20 . 1 . . . . 37 F CB . 7264 1 181 . 1 1 37 37 PHE N N 15 109.93 0.20 . 1 . . . . 37 F N . 7264 1 182 . 1 1 38 38 ASN H H 1 9.415 0.02 . 1 . . . . 38 N HN . 7264 1 183 . 1 1 38 38 ASN C C 13 174.493 0.20 . 1 . . . . 38 N C . 7264 1 184 . 1 1 38 38 ASN CA C 13 52.028 0.20 . 1 . . . . 38 N CA . 7264 1 185 . 1 1 38 38 ASN CB C 13 40.036 0.20 . 1 . . . . 38 N CB . 7264 1 186 . 1 1 38 38 ASN CG C 13 176.751 0.20 . 1 . . . . 38 N CG . 7264 1 187 . 1 1 38 38 ASN N N 15 118.746 0.20 . 1 . . . . 38 N N . 7264 1 188 . 1 1 39 39 LEU H H 1 7.586 0.02 . 1 . . . . 39 L HN . 7264 1 189 . 1 1 39 39 LEU C C 13 173.073 0.20 . 1 . . . . 39 L C . 7264 1 190 . 1 1 39 39 LEU CA C 13 54.524 0.20 . 1 . . . . 39 L CA . 7264 1 191 . 1 1 39 39 LEU CB C 13 43.087 0.20 . 1 . . . . 39 L CB . 7264 1 192 . 1 1 39 39 LEU N N 15 122.477 0.20 . 1 . . . . 39 L N . 7264 1 193 . 1 1 40 40 VAL H H 1 8.945 0.02 . 1 . . . . 40 V HN . 7264 1 194 . 1 1 40 40 VAL C C 13 170.457 0.20 . 1 . . . . 40 V C . 7264 1 195 . 1 1 40 40 VAL CA C 13 58.995 0.20 . 1 . . . . 40 V CA . 7264 1 196 . 1 1 40 40 VAL CB C 13 35.504 0.20 . 1 . . . . 40 V CB . 7264 1 197 . 1 1 40 40 VAL N N 15 124.134 0.20 . 1 . . . . 40 V N . 7264 1 198 . 1 1 41 41 VAL H H 1 7.743 0.02 . 1 . . . . 41 V HN . 7264 1 199 . 1 1 41 41 VAL C C 13 173.379 0.20 . 1 . . . . 41 V C . 7264 1 200 . 1 1 41 41 VAL CA C 13 57.832 0.20 . 1 . . . . 41 V CA . 7264 1 201 . 1 1 41 41 VAL CB C 13 35.886 0.20 . 1 . . . . 41 V CB . 7264 1 202 . 1 1 41 41 VAL N N 15 125.507 0.20 . 1 . . . . 41 V N . 7264 1 203 . 1 1 42 42 ALA H H 1 8.944 0.02 . 1 . . . . 42 A HN . 7264 1 204 . 1 1 42 42 ALA C C 13 176.205 0.20 . 1 . . . . 42 A C . 7264 1 205 . 1 1 42 42 ALA CA C 13 50.977 0.20 . 1 . . . . 42 A CA . 7264 1 206 . 1 1 42 42 ALA CB C 13 19.595 0.20 . 1 . . . . 42 A CB . 7264 1 207 . 1 1 42 42 ALA N N 15 128.508 0.20 . 1 . . . . 42 A N . 7264 1 208 . 1 1 43 43 GLU H H 1 7.711 0.02 . 1 . . . . 43 E HN . 7264 1 209 . 1 1 43 43 GLU C C 13 175.816 0.20 . 1 . . . . 43 E C . 7264 1 210 . 1 1 43 43 GLU CA C 13 58.835 0.20 . 1 . . . . 43 E CA . 7264 1 211 . 1 1 43 43 GLU CB C 13 29.783 0.20 . 1 . . . . 43 E CB . 7264 1 212 . 1 1 43 43 GLU N N 15 128.577 0.20 . 1 . . . . 43 E N . 7264 1 213 . 1 1 45 45 ALA C C 13 176.238 0.20 . 1 . . . . 45 A C . 7264 1 214 . 1 1 45 45 ALA CA C 13 54.855 0.20 . 1 . . . . 45 A CA . 7264 1 215 . 1 1 45 45 ALA CB C 13 19.517 0.20 . 1 . . . . 45 A CB . 7264 1 216 . 1 1 46 46 MET H H 1 9.008 0.02 . 1 . . . . 46 M HN . 7264 1 217 . 1 1 46 46 MET C C 13 174.771 0.20 . 1 . . . . 46 M C . 7264 1 218 . 1 1 46 46 MET CA C 13 55.458 0.20 . 1 . . . . 46 M CA . 7264 1 219 . 1 1 46 46 MET CB C 13 32.441 0.20 . 1 . . . . 46 M CB . 7264 1 220 . 1 1 46 46 MET N N 15 113.486 0.20 . 1 . . . . 46 M N . 7264 1 221 . 1 1 47 47 LYS H H 1 7.035 0.02 . 1 . . . . 47 K HN . 7264 1 222 . 1 1 47 47 LYS C C 13 179.394 0.20 . 1 . . . . 47 K C . 7264 1 223 . 1 1 47 47 LYS CA C 13 57.015 0.20 . 1 . . . . 47 K CA . 7264 1 224 . 1 1 47 47 LYS CB C 13 35.073 0.20 . 1 . . . . 47 K CB . 7264 1 225 . 1 1 47 47 LYS N N 15 118.476 0.20 . 1 . . . . 47 K N . 7264 1 226 . 1 1 48 48 TRP H H 1 10.221 0.02 . 1 . . . . 48 W HN . 7264 1 227 . 1 1 48 48 TRP HE1 H 1 8.38 0.02 . 1 . . . . 48 W HE1 . 7264 1 228 . 1 1 48 48 TRP C C 13 178.517 0.20 . 1 . . . . 48 W C . 7264 1 229 . 1 1 48 48 TRP CA C 13 59.985 0.20 . 1 . . . . 48 W CA . 7264 1 230 . 1 1 48 48 TRP CB C 13 28.205 0.20 . 1 . . . . 48 W CB . 7264 1 231 . 1 1 48 48 TRP N N 15 127.356 0.20 . 1 . . . . 48 W N . 7264 1 232 . 1 1 48 48 TRP NE1 N 15 125.4 0.21 . 1 . . . . 48 W NE1 . 7264 1 233 . 1 1 49 49 ASP H H 1 8.725 0.02 . 1 . . . . 49 D HN . 7264 1 234 . 1 1 49 49 ASP C C 13 176.894 0.20 . 1 . . . . 49 D C . 7264 1 235 . 1 1 49 49 ASP CA C 13 56.984 0.20 . 1 . . . . 49 D CA . 7264 1 236 . 1 1 49 49 ASP CB C 13 37.7 0.20 . 1 . . . . 49 D CB . 7264 1 237 . 1 1 49 49 ASP CG C 13 179.127 0.20 . 1 . . . . 49 D CG . 7264 1 238 . 1 1 49 49 ASP N N 15 119.267 0.20 . 1 . . . . 49 D N . 7264 1 239 . 1 1 50 50 ALA H H 1 7.296 0.02 . 1 . . . . 50 A HN . 7264 1 240 . 1 1 50 50 ALA C C 13 178.62 0.20 . 1 . . . . 50 A C . 7264 1 241 . 1 1 50 50 ALA CA C 13 52.95 0.20 . 1 . . . . 50 A CA . 7264 1 242 . 1 1 50 50 ALA CB C 13 20.296 0.20 . 1 . . . . 50 A CB . 7264 1 243 . 1 1 50 50 ALA N N 15 122.459 0.20 . 1 . . . . 50 A N . 7264 1 244 . 1 1 51 51 THR H H 1 7.826 0.02 . 1 . . . . 51 T HN . 7264 1 245 . 1 1 51 51 THR C C 13 175.738 0.20 . 1 . . . . 51 T C . 7264 1 246 . 1 1 51 51 THR CA C 13 61.814 0.20 . 1 . . . . 51 T CA . 7264 1 247 . 1 1 51 51 THR CB C 13 72.688 0.20 . 1 . . . . 51 T CB . 7264 1 248 . 1 1 51 51 THR N N 15 104.603 0.20 . 1 . . . . 51 T N . 7264 1 249 . 1 1 52 52 GLU H H 1 8.894 0.02 . 1 . . . . 52 E HN . 7264 1 250 . 1 1 52 52 GLU C C 13 172.886 0.20 . 1 . . . . 52 E C . 7264 1 251 . 1 1 52 52 GLU CA C 13 52.81 0.20 . 1 . . . . 52 E CA . 7264 1 252 . 1 1 52 52 GLU CB C 13 31.21 0.20 . 1 . . . . 52 E CB . 7264 1 253 . 1 1 52 52 GLU N N 15 124.103 0.20 . 1 . . . . 52 E N . 7264 1 254 . 1 1 53 53 PRO C C 13 177.323 0.20 . 1 . . . . 53 P C . 7264 1 255 . 1 1 53 53 PRO CA C 13 64.588 0.20 . 1 . . . . 53 P CA . 7264 1 256 . 1 1 53 53 PRO CB C 13 31.841 0.20 . 1 . . . . 53 P CB . 7264 1 257 . 1 1 54 54 SER H H 1 7.298 0.02 . 1 . . . . 54 S HN . 7264 1 258 . 1 1 54 54 SER C C 13 171.753 0.20 . 1 . . . . 54 S C . 7264 1 259 . 1 1 54 54 SER CA C 13 56.262 0.20 . 1 . . . . 54 S CA . 7264 1 260 . 1 1 54 54 SER CB C 13 64.802 0.20 . 1 . . . . 54 S CB . 7264 1 261 . 1 1 54 54 SER N N 15 112.531 0.20 . 1 . . . . 54 S N . 7264 1 262 . 1 1 55 55 GLN H H 1 7.311 0.02 . 1 . . . . 55 Q HN . 7264 1 263 . 1 1 55 55 GLN C C 13 177.084 0.20 . 1 . . . . 55 Q C . 7264 1 264 . 1 1 55 55 GLN CA C 13 57.759 0.20 . 1 . . . . 55 Q CA . 7264 1 265 . 1 1 55 55 GLN CB C 13 25.997 0.20 . 1 . . . . 55 Q CB . 7264 1 266 . 1 1 55 55 GLN CD C 13 179.108 0.20 . 1 . . . . 55 Q CD . 7264 1 267 . 1 1 55 55 GLN N N 15 123.708 0.20 . 1 . . . . 55 Q N . 7264 1 268 . 1 1 56 56 ASN H H 1 10.605 0.02 . 1 . . . . 56 N HN . 7264 1 269 . 1 1 56 56 ASN C C 13 173.83 0.20 . 1 . . . . 56 N C . 7264 1 270 . 1 1 56 56 ASN CA C 13 53.818 0.20 . 1 . . . . 56 N CA . 7264 1 271 . 1 1 56 56 ASN CB C 13 38.488 0.20 . 1 . . . . 56 N CB . 7264 1 272 . 1 1 56 56 ASN CG C 13 178.476 0.20 . 1 . . . . 56 N CG . 7264 1 273 . 1 1 56 56 ASN N N 15 127.311 0.20 . 1 . . . . 56 N N . 7264 1 274 . 1 1 57 57 SER H H 1 7.356 0.02 . 1 . . . . 57 S HN . 7264 1 275 . 1 1 57 57 SER C C 13 172.552 0.20 . 1 . . . . 57 S C . 7264 1 276 . 1 1 57 57 SER CA C 13 56.031 0.20 . 1 . . . . 57 S CA . 7264 1 277 . 1 1 57 57 SER CB C 13 63.169 0.20 . 1 . . . . 57 S CB . 7264 1 278 . 1 1 57 57 SER N N 15 117.335 0.20 . 1 . . . . 57 S N . 7264 1 279 . 1 1 58 58 PHE H H 1 8.101 0.02 . 1 . . . . 58 F HN . 7264 1 280 . 1 1 58 58 PHE C C 13 176.817 0.20 . 1 . . . . 58 F C . 7264 1 281 . 1 1 58 58 PHE CA C 13 56.84 0.20 . 1 . . . . 58 F CA . 7264 1 282 . 1 1 58 58 PHE CB C 13 40.594 0.20 . 1 . . . . 58 F CB . 7264 1 283 . 1 1 58 58 PHE N N 15 122.755 0.20 . 1 . . . . 58 F N . 7264 1 284 . 1 1 59 59 SER H H 1 8.559 0.02 . 1 . . . . 59 S HN . 7264 1 285 . 1 1 59 59 SER C C 13 174.558 0.20 . 1 . . . . 59 S C . 7264 1 286 . 1 1 59 59 SER CA C 13 55.05 0.20 . 1 . . . . 59 S CA . 7264 1 287 . 1 1 59 59 SER CB C 13 64.143 0.20 . 1 . . . . 59 S CB . 7264 1 288 . 1 1 59 59 SER N N 15 119.5 0.20 . 1 . . . . 59 S N . 7264 1 289 . 1 1 60 60 PHE H H 1 8.715 0.02 . 1 . . . . 60 F HN . 7264 1 290 . 1 1 60 60 PHE C C 13 175.576 0.20 . 1 . . . . 60 F C . 7264 1 291 . 1 1 60 60 PHE CA C 13 57.013 0.20 . 1 . . . . 60 F CA . 7264 1 292 . 1 1 60 60 PHE CB C 13 39.456 0.20 . 1 . . . . 60 F CB . 7264 1 293 . 1 1 60 60 PHE N N 15 122.356 0.20 . 1 . . . . 60 F N . 7264 1 294 . 1 1 61 61 GLY H H 1 8.605 0.02 . 1 . . . . 61 G HN . 7264 1 295 . 1 1 61 61 GLY C C 13 176.448 0.20 . 1 . . . . 61 G C . 7264 1 296 . 1 1 61 61 GLY CA C 13 48.192 0.20 . 1 . . . . 61 G CA . 7264 1 297 . 1 1 61 61 GLY N N 15 110.059 0.20 . 1 . . . . 61 G N . 7264 1 298 . 1 1 62 62 ALA H H 1 8.735 0.02 . 1 . . . . 62 A HN . 7264 1 299 . 1 1 62 62 ALA C C 13 180.258 0.20 . 1 . . . . 62 A C . 7264 1 300 . 1 1 62 62 ALA CA C 13 55.384 0.20 . 1 . . . . 62 A CA . 7264 1 301 . 1 1 62 62 ALA CB C 13 17.777 0.20 . 1 . . . . 62 A CB . 7264 1 302 . 1 1 62 62 ALA N N 15 125.283 0.20 . 1 . . . . 62 A N . 7264 1 303 . 1 1 63 63 GLY H H 1 9.103 0.02 . 1 . . . . 63 G HN . 7264 1 304 . 1 1 63 63 GLY C C 13 175.79 0.20 . 1 . . . . 63 G C . 7264 1 305 . 1 1 63 63 GLY CA C 13 47.41 0.20 . 1 . . . . 63 G CA . 7264 1 306 . 1 1 63 63 GLY N N 15 109.301 0.20 . 1 . . . . 63 G N . 7264 1 307 . 1 1 64 64 ASP H H 1 9.918 0.02 . 1 . . . . 64 D HN . 7264 1 308 . 1 1 64 64 ASP C C 13 179.542 0.20 . 1 . . . . 64 D C . 7264 1 309 . 1 1 64 64 ASP CA C 13 57.382 0.20 . 1 . . . . 64 D CA . 7264 1 310 . 1 1 64 64 ASP CB C 13 39.127 0.20 . 1 . . . . 64 D CB . 7264 1 311 . 1 1 64 64 ASP CG C 13 179.616 0.20 . 1 . . . . 64 D CG . 7264 1 312 . 1 1 64 64 ASP N N 15 124.719 0.20 . 1 . . . . 64 D N . 7264 1 313 . 1 1 65 65 ARG H H 1 7.894 0.02 . 1 . . . . 65 R HN . 7264 1 314 . 1 1 65 65 ARG C C 13 180.026 0.20 . 1 . . . . 65 R C . 7264 1 315 . 1 1 65 65 ARG CA C 13 59.206 0.20 . 1 . . . . 65 R CA . 7264 1 316 . 1 1 65 65 ARG CB C 13 29.53 0.20 . 1 . . . . 65 R CB . 7264 1 317 . 1 1 65 65 ARG N N 15 122.156 0.20 . 1 . . . . 65 R N . 7264 1 318 . 1 1 66 66 VAL H H 1 7.509 0.02 . 1 . . . . 66 V HN . 7264 1 319 . 1 1 66 66 VAL C C 13 176.73 0.20 . 1 . . . . 66 V C . 7264 1 320 . 1 1 66 66 VAL CA C 13 66.359 0.20 . 1 . . . . 66 V CA . 7264 1 321 . 1 1 66 66 VAL CB C 13 30.213 0.20 . 1 . . . . 66 V CB . 7264 1 322 . 1 1 66 66 VAL N N 15 121.145 0.20 . 1 . . . . 66 V N . 7264 1 323 . 1 1 67 67 ALA H H 1 8.436 0.02 . 1 . . . . 67 A HN . 7264 1 324 . 1 1 67 67 ALA C C 13 180.435 0.20 . 1 . . . . 67 A C . 7264 1 325 . 1 1 67 67 ALA CA C 13 55.087 0.20 . 1 . . . . 67 A CA . 7264 1 326 . 1 1 67 67 ALA CB C 13 17.596 0.20 . 1 . . . . 67 A CB . 7264 1 327 . 1 1 67 67 ALA N N 15 121.976 0.20 . 1 . . . . 67 A N . 7264 1 328 . 1 1 68 68 SER H H 1 8.958 0.02 . 1 . . . . 68 S HN . 7264 1 329 . 1 1 68 68 SER C C 13 175.343 0.20 . 1 . . . . 68 S C . 7264 1 330 . 1 1 68 68 SER CA C 13 61.674 0.20 . 1 . . . . 68 S CA . 7264 1 331 . 1 1 68 68 SER CB C 13 62.788 0.20 . 1 . . . . 68 S CB . 7264 1 332 . 1 1 68 68 SER N N 15 117.187 0.20 . 1 . . . . 68 S N . 7264 1 333 . 1 1 69 69 TYR H H 1 7.629 0.02 . 1 . . . . 69 Y HN . 7264 1 334 . 1 1 69 69 TYR C C 13 178.358 0.20 . 1 . . . . 69 Y C . 7264 1 335 . 1 1 69 69 TYR CA C 13 61.9 0.20 . 1 . . . . 69 Y CA . 7264 1 336 . 1 1 69 69 TYR CB C 13 37.535 0.20 . 1 . . . . 69 Y CB . 7264 1 337 . 1 1 69 69 TYR N N 15 123.339 0.20 . 1 . . . . 69 Y N . 7264 1 338 . 1 1 70 70 ALA H H 1 7.94 0.02 . 1 . . . . 70 A HN . 7264 1 339 . 1 1 70 70 ALA C C 13 178.437 0.20 . 1 . . . . 70 A C . 7264 1 340 . 1 1 70 70 ALA CA C 13 55.224 0.20 . 1 . . . . 70 A CA . 7264 1 341 . 1 1 70 70 ALA CB C 13 17.282 0.20 . 1 . . . . 70 A CB . 7264 1 342 . 1 1 70 70 ALA N N 15 122.751 0.20 . 1 . . . . 70 A N . 7264 1 343 . 1 1 71 71 ALA H H 1 7.87 0.02 . 1 . . . . 71 A HN . 7264 1 344 . 1 1 71 71 ALA C C 13 181.249 0.20 . 1 . . . . 71 A C . 7264 1 345 . 1 1 71 71 ALA CA C 13 54.491 0.20 . 1 . . . . 71 A CA . 7264 1 346 . 1 1 71 71 ALA CB C 13 17.877 0.20 . 1 . . . . 71 A CB . 7264 1 347 . 1 1 71 71 ALA N N 15 119.577 0.20 . 1 . . . . 71 A N . 7264 1 348 . 1 1 72 72 ASP H H 1 8.635 0.02 . 1 . . . . 72 D HN . 7264 1 349 . 1 1 72 72 ASP C C 13 178.306 0.20 . 1 . . . . 72 D C . 7264 1 350 . 1 1 72 72 ASP CA C 13 56.62 0.20 . 1 . . . . 72 D CA . 7264 1 351 . 1 1 72 72 ASP CB C 13 40.676 0.20 . 1 . . . . 72 D CB . 7264 1 352 . 1 1 72 72 ASP CG C 13 179.117 0.20 . 1 . . . . 72 D CG . 7264 1 353 . 1 1 72 72 ASP N N 15 119.178 0.20 . 1 . . . . 72 D N . 7264 1 354 . 1 1 73 73 THR H H 1 7.287 0.02 . 1 . . . . 73 T HN . 7264 1 355 . 1 1 73 73 THR C C 13 175.591 0.20 . 1 . . . . 73 T C . 7264 1 356 . 1 1 73 73 THR CA C 13 60.894 0.20 . 1 . . . . 73 T CA . 7264 1 357 . 1 1 73 73 THR CB C 13 69.707 0.20 . 1 . . . . 73 T CB . 7264 1 358 . 1 1 73 73 THR N N 15 105.422 0.20 . 1 . . . . 73 T N . 7264 1 359 . 1 1 74 74 GLY H H 1 7.576 0.02 . 1 . . . . 74 G HN . 7264 1 360 . 1 1 74 74 GLY C C 13 175.12 0.20 . 1 . . . . 74 G C . 7264 1 361 . 1 1 74 74 GLY CA C 13 46.855 0.20 . 1 . . . . 74 G CA . 7264 1 362 . 1 1 74 74 GLY N N 15 113.852 0.20 . 1 . . . . 74 G N . 7264 1 363 . 1 1 75 75 LYS H H 1 8.414 0.02 . 1 . . . . 75 K HN . 7264 1 364 . 1 1 75 75 LYS C C 13 175.976 0.20 . 1 . . . . 75 K C . 7264 1 365 . 1 1 75 75 LYS CA C 13 55.026 0.20 . 1 . . . . 75 K CA . 7264 1 366 . 1 1 75 75 LYS CB C 13 36.023 0.20 . 1 . . . . 75 K CB . 7264 1 367 . 1 1 75 75 LYS N N 15 120.629 0.20 . 1 . . . . 75 K N . 7264 1 368 . 1 1 76 76 GLU H H 1 7.733 0.02 . 1 . . . . 76 E HN . 7264 1 369 . 1 1 76 76 GLU C C 13 174.288 0.20 . 1 . . . . 76 E C . 7264 1 370 . 1 1 76 76 GLU CA C 13 56.052 0.20 . 1 . . . . 76 E CA . 7264 1 371 . 1 1 76 76 GLU CB C 13 30.79 0.20 . 1 . . . . 76 E CB . 7264 1 372 . 1 1 76 76 GLU CD C 13 183.332 0.20 . 1 . . . . 76 E CD . 7264 1 373 . 1 1 76 76 GLU N N 15 121.805 0.20 . 1 . . . . 76 E N . 7264 1 374 . 1 1 77 77 LEU H H 1 8.73 0.02 . 1 . . . . 77 L HN . 7264 1 375 . 1 1 77 77 LEU C C 13 173.993 0.20 . 1 . . . . 77 L C . 7264 1 376 . 1 1 77 77 LEU CA C 13 53.06 0.20 . 1 . . . . 77 L CA . 7264 1 377 . 1 1 77 77 LEU CB C 13 43.09 0.20 . 1 . . . . 77 L CB . 7264 1 378 . 1 1 77 77 LEU N N 15 124.949 0.20 . 1 . . . . 77 L N . 7264 1 379 . 1 1 78 78 TYR H H 1 8.914 0.02 . 1 . . . . 78 Y HN . 7264 1 380 . 1 1 78 78 TYR C C 13 175.075 0.20 . 1 . . . . 78 Y C . 7264 1 381 . 1 1 78 78 TYR CA C 13 56.178 0.20 . 1 . . . . 78 Y CA . 7264 1 382 . 1 1 78 78 TYR CB C 13 41.792 0.20 . 1 . . . . 78 Y CB . 7264 1 383 . 1 1 78 78 TYR N N 15 131.863 0.20 . 1 . . . . 78 Y N . 7264 1 384 . 1 1 79 79 GLY H H 1 8.626 0.02 . 1 . . . . 79 G HN . 7264 1 385 . 1 1 79 79 GLY C C 13 170.194 0.20 . 1 . . . . 79 G C . 7264 1 386 . 1 1 79 79 GLY CA C 13 45.052 0.20 . 1 . . . . 79 G CA . 7264 1 387 . 1 1 79 79 GLY N N 15 117.615 0.20 . 1 . . . . 79 G N . 7264 1 388 . 1 1 80 80 HIS H H 1 8.071 0.02 . 1 . . . . 80 H HN . 7264 1 389 . 1 1 80 80 HIS HD2 H 1 7.07 0.02 . 1 . . . . 80 H HD2 . 7264 1 390 . 1 1 80 80 HIS HE1 H 1 7.42 0.02 . 1 . . . . 80 H HE1 . 7264 1 391 . 1 1 80 80 HIS C C 13 172.862 0.20 . 1 . . . . 80 H C . 7264 1 392 . 1 1 80 80 HIS CA C 13 51.423 0.20 . 1 . . . . 80 H CA . 7264 1 393 . 1 1 80 80 HIS CB C 13 32.137 0.20 . 1 . . . . 80 H CB . 7264 1 394 . 1 1 80 80 HIS CD2 C 13 120.2 0.20 . 1 . . . . 80 H CD2 . 7264 1 395 . 1 1 80 80 HIS CE1 C 13 137.9 0.20 . 1 . . . . 80 H CE1 . 7264 1 396 . 1 1 80 80 HIS N N 15 129.492 0.20 . 1 . . . . 80 H N . 7264 1 397 . 1 1 80 80 HIS ND1 N 15 202.5 0.20 . 4 . . . . 80 H ND1 . 7264 1 398 . 1 1 80 80 HIS NE2 N 15 182.4 0.20 . 4 . . . . 80 H NE1 . 7264 1 399 . 1 1 81 81 THR H H 1 6.449 0.02 . 1 . . . . 81 T HN . 7264 1 400 . 1 1 81 81 THR C C 13 171.947 0.20 . 1 . . . . 81 T C . 7264 1 401 . 1 1 81 81 THR CA C 13 60.447 0.20 . 1 . . . . 81 T CA . 7264 1 402 . 1 1 81 81 THR CB C 13 70.868 0.20 . 1 . . . . 81 T CB . 7264 1 403 . 1 1 81 81 THR N N 15 120.082 0.20 . 1 . . . . 81 T N . 7264 1 404 . 1 1 82 82 LEU H H 1 7.783 0.02 . 1 . . . . 82 L HN . 7264 1 405 . 1 1 82 82 LEU C C 13 173.814 0.20 . 1 . . . . 82 L C . 7264 1 406 . 1 1 82 82 LEU CA C 13 58.609 0.20 . 1 . . . . 82 L CA . 7264 1 407 . 1 1 82 82 LEU CB C 13 40.704 0.20 . 1 . . . . 82 L CB . 7264 1 408 . 1 1 82 82 LEU N N 15 128.823 0.20 . 1 . . . . 82 L N . 7264 1 409 . 1 1 83 83 VAL H H 1 7.585 0.02 . 1 . . . . 83 V HN . 7264 1 410 . 1 1 83 83 VAL C C 13 172.812 0.20 . 1 . . . . 83 V C . 7264 1 411 . 1 1 83 83 VAL CA C 13 63.589 0.20 . 1 . . . . 83 V CA . 7264 1 412 . 1 1 83 83 VAL CB C 13 32.355 0.20 . 1 . . . . 83 V CB . 7264 1 413 . 1 1 83 83 VAL N N 15 116.19 0.20 . 1 . . . . 83 V N . 7264 1 414 . 1 1 84 84 TRP H H 1 6.638 0.02 . 1 . . . . 84 W HN . 7264 1 415 . 1 1 84 84 TRP HE1 H 1 10.87 0.02 . 1 . . . . 84 W HE1 . 7264 1 416 . 1 1 84 84 TRP C C 13 175.146 0.20 . 1 . . . . 84 W C . 7264 1 417 . 1 1 84 84 TRP CA C 13 53.581 0.20 . 1 . . . . 84 W CA . 7264 1 418 . 1 1 84 84 TRP N N 15 124.341 0.20 . 1 . . . . 84 W N . 7264 1 419 . 1 1 84 84 TRP NE1 N 15 135.43 0.20 . 1 . . . . 84 W NE1 . 7264 1 420 . 1 1 85 85 HIS HD2 H 1 6.91 0.02 . 1 . . . . 85 H HD2 . 7264 1 421 . 1 1 85 85 HIS HE1 H 1 8.52 0.02 . 1 . . . . 85 H HE1 . 7264 1 422 . 1 1 85 85 HIS HE2 H 1 11.83 0.02 . 1 . . . . 85 H HE2 . 7264 1 423 . 1 1 85 85 HIS CD2 C 13 118.4 0.20 . 1 . . . . 85 H CD2 . 7264 1 424 . 1 1 85 85 HIS CE1 C 13 139.2 0.20 . 1 . . . . 85 H CE1 . 7264 1 425 . 1 1 85 85 HIS ND1 N 15 247.6 0.20 . 1 . . . . 85 H ND1 . 7264 1 426 . 1 1 85 85 HIS NE2 N 15 167.7 0.20 . 1 . . . . 85 H NE1 . 7264 1 427 . 1 1 89 89 PRO C C 13 176.334 0.20 . 1 . . . . 89 P C . 7264 1 428 . 1 1 89 89 PRO CA C 13 62.101 0.20 . 1 . . . . 89 P CA . 7264 1 429 . 1 1 89 89 PRO CB C 13 32.836 0.20 . 1 . . . . 89 P CB . 7264 1 430 . 1 1 90 90 ASP H H 1 8.577 0.02 . 1 . . . . 90 D HN . 7264 1 431 . 1 1 90 90 ASP C C 13 178.315 0.20 . 1 . . . . 90 D C . 7264 1 432 . 1 1 90 90 ASP CA C 13 57.521 0.20 . 1 . . . . 90 D CA . 7264 1 433 . 1 1 90 90 ASP CB C 13 39.803 0.20 . 1 . . . . 90 D CB . 7264 1 434 . 1 1 90 90 ASP CG C 13 179.489 0.20 . 1 . . . . 90 D CG . 7264 1 435 . 1 1 90 90 ASP N N 15 122.944 0.20 . 1 . . . . 90 D N . 7264 1 436 . 1 1 91 91 TRP H H 1 8.21 0.02 . 1 . . . . 91 W HN . 7264 1 437 . 1 1 91 91 TRP HE1 H 1 9.541 0.02 . 1 . . . . 91 W HE1 . 7264 1 438 . 1 1 91 91 TRP C C 13 177.98 0.20 . 1 . . . . 91 W C . 7264 1 439 . 1 1 91 91 TRP CA C 13 58.611 0.20 . 1 . . . . 91 W CA . 7264 1 440 . 1 1 91 91 TRP CB C 13 27.26 0.20 . 1 . . . . 91 W CB . 7264 1 441 . 1 1 91 91 TRP N N 15 115.832 0.20 . 1 . . . . 91 W N . 7264 1 442 . 1 1 91 91 TRP NE1 N 15 128.3 0.21 . 1 . . . . 91 W NE1 . 7264 1 443 . 1 1 92 92 ALA H H 1 5.874 0.02 . 1 . . . . 92 A HN . 7264 1 444 . 1 1 92 92 ALA C C 13 178.064 0.20 . 1 . . . . 92 A C . 7264 1 445 . 1 1 92 92 ALA CA C 13 53.81 0.20 . 1 . . . . 92 A CA . 7264 1 446 . 1 1 92 92 ALA CB C 13 15.767 0.20 . 1 . . . . 92 A CB . 7264 1 447 . 1 1 92 92 ALA N N 15 124.755 0.20 . 1 . . . . 92 A N . 7264 1 448 . 1 1 93 93 LYS H H 1 6.706 0.02 . 1 . . . . 93 K HN . 7264 1 449 . 1 1 93 93 LYS C C 13 176.805 0.20 . 1 . . . . 93 K C . 7264 1 450 . 1 1 93 93 LYS CA C 13 58.715 0.20 . 1 . . . . 93 K CA . 7264 1 451 . 1 1 93 93 LYS CB C 13 31.634 0.20 . 1 . . . . 93 K CB . 7264 1 452 . 1 1 93 93 LYS N N 15 115.304 0.20 . 1 . . . . 93 K N . 7264 1 453 . 1 1 94 94 ASN H H 1 7.083 0.02 . 1 . . . . 94 N HN . 7264 1 454 . 1 1 94 94 ASN C C 13 175.277 0.20 . 1 . . . . 94 N C . 7264 1 455 . 1 1 94 94 ASN CA C 13 52.955 0.20 . 1 . . . . 94 N CA . 7264 1 456 . 1 1 94 94 ASN CB C 13 39.048 0.20 . 1 . . . . 94 N CB . 7264 1 457 . 1 1 94 94 ASN CG C 13 176.738 0.20 . 1 . . . . 94 N CG . 7264 1 458 . 1 1 94 94 ASN N N 15 113.744 0.20 . 1 . . . . 94 N N . 7264 1 459 . 1 1 95 95 LEU H H 1 7 0.02 . 1 . . . . 95 L HN . 7264 1 460 . 1 1 95 95 LEU C C 13 175.507 0.20 . 1 . . . . 95 L C . 7264 1 461 . 1 1 95 95 LEU CA C 13 53.939 0.20 . 1 . . . . 95 L CA . 7264 1 462 . 1 1 95 95 LEU CB C 13 43.543 0.20 . 1 . . . . 95 L CB . 7264 1 463 . 1 1 95 95 LEU N N 15 120.435 0.20 . 1 . . . . 95 L N . 7264 1 464 . 1 1 96 96 ASN H H 1 8.575 0.02 . 1 . . . . 96 N HN . 7264 1 465 . 1 1 96 96 ASN C C 13 175.745 0.20 . 1 . . . . 96 N C . 7264 1 466 . 1 1 96 96 ASN CA C 13 51.814 0.20 . 1 . . . . 96 N CA . 7264 1 467 . 1 1 96 96 ASN CB C 13 42.73 0.20 . 1 . . . . 96 N CB . 7264 1 468 . 1 1 96 96 ASN CG C 13 176.768 0.20 . 1 . . . . 96 N CG . 7264 1 469 . 1 1 96 96 ASN N N 15 118.031 0.20 . 1 . . . . 96 N N . 7264 1 470 . 1 1 97 97 GLY H H 1 8.857 0.02 . 1 . . . . 97 G HN . 7264 1 471 . 1 1 97 97 GLY C C 13 175.067 0.20 . 1 . . . . 97 G C . 7264 1 472 . 1 1 97 97 GLY CA C 13 46.862 0.20 . 1 . . . . 97 G CA . 7264 1 473 . 1 1 97 97 GLY N N 15 108.808 0.20 . 1 . . . . 97 G N . 7264 1 474 . 1 1 98 98 SER C C 13 176.832 0.20 . 1 . . . . 98 S C . 7264 1 475 . 1 1 98 98 SER CA C 13 61.041 0.20 . 1 . . . . 98 S CA . 7264 1 476 . 1 1 98 98 SER CB C 13 62.585 0.20 . 1 . . . . 98 S CB . 7264 1 477 . 1 1 99 99 ALA H H 1 8.29 0.02 . 1 . . . . 99 A HN . 7264 1 478 . 1 1 99 99 ALA C C 13 180.757 0.20 . 1 . . . . 99 A C . 7264 1 479 . 1 1 99 99 ALA CA C 13 54.763 0.20 . 1 . . . . 99 A CA . 7264 1 480 . 1 1 99 99 ALA CB C 13 18.205 0.20 . 1 . . . . 99 A CB . 7264 1 481 . 1 1 99 99 ALA N N 15 125.865 0.20 . 1 . . . . 99 A N . 7264 1 482 . 1 1 100 100 PHE H H 1 7.514 0.02 . 1 . . . . 100 F HN . 7264 1 483 . 1 1 100 100 PHE C C 13 176.848 0.20 . 1 . . . . 100 F C . 7264 1 484 . 1 1 100 100 PHE CA C 13 60.442 0.20 . 1 . . . . 100 F CA . 7264 1 485 . 1 1 100 100 PHE CB C 13 37.553 0.20 . 1 . . . . 100 F CB . 7264 1 486 . 1 1 100 100 PHE N N 15 121.812 0.20 . 1 . . . . 100 F N . 7264 1 487 . 1 1 101 101 GLU H H 1 8.431 0.02 . 1 . . . . 101 E HN . 7264 1 488 . 1 1 101 101 GLU C C 13 178.405 0.20 . 1 . . . . 101 E C . 7264 1 489 . 1 1 101 101 GLU CA C 13 60.501 0.20 . 1 . . . . 101 E CA . 7264 1 490 . 1 1 101 101 GLU CB C 13 29.755 0.20 . 1 . . . . 101 E CB . 7264 1 491 . 1 1 101 101 GLU CD C 13 182.813 0.20 . 1 . . . . 101 E CD . 7264 1 492 . 1 1 101 101 GLU N N 15 121.552 0.20 . 1 . . . . 101 E N . 7264 1 493 . 1 1 102 102 SER H H 1 8.754 0.02 . 1 . . . . 102 S HN . 7264 1 494 . 1 1 102 102 SER C C 13 177.197 0.20 . 1 . . . . 102 S C . 7264 1 495 . 1 1 102 102 SER CA C 13 61.445 0.20 . 1 . . . . 102 S CA . 7264 1 496 . 1 1 102 102 SER CB C 13 62.704 0.20 . 1 . . . . 102 S CB . 7264 1 497 . 1 1 102 102 SER N N 15 113.952 0.20 . 1 . . . . 102 S N . 7264 1 498 . 1 1 103 103 ALA H H 1 7.879 0.02 . 1 . . . . 103 A HN . 7264 1 499 . 1 1 103 103 ALA C C 13 180.655 0.20 . 1 . . . . 103 A C . 7264 1 500 . 1 1 103 103 ALA CA C 13 54.778 0.20 . 1 . . . . 103 A CA . 7264 1 501 . 1 1 103 103 ALA CB C 13 18.07 0.20 . 1 . . . . 103 A CB . 7264 1 502 . 1 1 103 103 ALA N N 15 124.885 0.20 . 1 . . . . 103 A N . 7264 1 503 . 1 1 104 104 MET H H 1 8.295 0.02 . 1 . . . . 104 M HN . 7264 1 504 . 1 1 104 104 MET C C 13 177.556 0.20 . 1 . . . . 104 M C . 7264 1 505 . 1 1 104 104 MET CA C 13 59.47 0.20 . 1 . . . . 104 M CA . 7264 1 506 . 1 1 104 104 MET CB C 13 31.997 0.20 . 1 . . . . 104 M CB . 7264 1 507 . 1 1 104 104 MET N N 15 120.881 0.20 . 1 . . . . 104 M N . 7264 1 508 . 1 1 105 105 VAL H H 1 8.731 0.02 . 1 . . . . 105 V HN . 7264 1 509 . 1 1 105 105 VAL C C 13 179.22 0.20 . 1 . . . . 105 V C . 7264 1 510 . 1 1 105 105 VAL CA C 13 67.598 0.20 . 1 . . . . 105 V CA . 7264 1 511 . 1 1 105 105 VAL CB C 13 31.324 0.20 . 1 . . . . 105 V CB . 7264 1 512 . 1 1 105 105 VAL N N 15 120.806 0.20 . 1 . . . . 105 V N . 7264 1 513 . 1 1 106 106 ASN H H 1 8.952 0.02 . 1 . . . . 106 N HN . 7264 1 514 . 1 1 106 106 ASN C C 13 175.619 0.20 . 1 . . . . 106 N C . 7264 1 515 . 1 1 106 106 ASN CA C 13 57.002 0.20 . 1 . . . . 106 N CA . 7264 1 516 . 1 1 106 106 ASN CB C 13 39.196 0.20 . 1 . . . . 106 N CB . 7264 1 517 . 1 1 106 106 ASN CG C 13 176.092 0.20 . 1 . . . . 106 N CG . 7264 1 518 . 1 1 106 106 ASN N N 15 121.624 0.20 . 1 . . . . 106 N N . 7264 1 519 . 1 1 107 107 HIS H H 1 8.34 0.02 . 1 . . . . 107 H HN . 7264 1 520 . 1 1 107 107 HIS HD1 H 1 16.74 0.02 . 1 . . . . 107 H HD1 . 7264 1 521 . 1 1 107 107 HIS HD2 H 1 6.28 0.02 . 1 . . . . 107 H HD2 . 7264 1 522 . 1 1 107 107 HIS HE1 H 1 8.27 0.02 . 1 . . . . 107 H HE1 . 7264 1 523 . 1 1 107 107 HIS HE2 H 1 13.52 0.02 . 1 . . . . 107 H HE2 . 7264 1 524 . 1 1 107 107 HIS C C 13 175.732 0.20 . 1 . . . . 107 H C . 7264 1 525 . 1 1 107 107 HIS CA C 13 60.97 0.20 . 1 . . . . 107 H CA . 7264 1 526 . 1 1 107 107 HIS CB C 13 28.493 0.20 . 1 . . . . 107 H CB . 7264 1 527 . 1 1 107 107 HIS CD2 C 13 118.6 0.20 . 1 . . . . 107 H CD2 . 7264 1 528 . 1 1 107 107 HIS CE1 C 13 135.8 0.20 . 1 . . . . 107 H CE1 . 7264 1 529 . 1 1 107 107 HIS N N 15 118.617 0.20 . 1 . . . . 107 H N . 7264 1 530 . 1 1 107 107 HIS ND1 N 15 184.8 0.20 . 1 . . . . 107 H ND1 . 7264 1 531 . 1 1 107 107 HIS NE2 N 15 170.7 0.20 . 1 . . . . 107 H NE2 . 7264 1 532 . 1 1 108 108 VAL H H 1 8.133 0.02 . 1 . . . . 108 V HN . 7264 1 533 . 1 1 108 108 VAL C C 13 176.075 0.20 . 1 . . . . 108 V C . 7264 1 534 . 1 1 108 108 VAL CA C 13 66.224 0.20 . 1 . . . . 108 V CA . 7264 1 535 . 1 1 108 108 VAL CB C 13 31.502 0.20 . 1 . . . . 108 V CB . 7264 1 536 . 1 1 108 108 VAL N N 15 116.36 0.20 . 1 . . . . 108 V N . 7264 1 537 . 1 1 109 109 THR H H 1 8.093 0.02 . 1 . . . . 109 T HN . 7264 1 538 . 1 1 109 109 THR C C 13 175.344 0.20 . 1 . . . . 109 T C . 7264 1 539 . 1 1 109 109 THR CA C 13 66.245 0.20 . 1 . . . . 109 T CA . 7264 1 540 . 1 1 109 109 THR CB C 13 68.984 0.20 . 1 . . . . 109 T CB . 7264 1 541 . 1 1 109 109 THR N N 15 112.657 0.20 . 1 . . . . 109 T N . 7264 1 542 . 1 1 110 110 LYS H H 1 8.223 0.02 . 1 . . . . 110 K HN . 7264 1 543 . 1 1 110 110 LYS C C 13 180.769 0.20 . 1 . . . . 110 K C . 7264 1 544 . 1 1 110 110 LYS CA C 13 58.214 0.20 . 1 . . . . 110 K CA . 7264 1 545 . 1 1 110 110 LYS CB C 13 30.908 0.20 . 1 . . . . 110 K CB . 7264 1 546 . 1 1 110 110 LYS N N 15 118.685 0.20 . 1 . . . . 110 K N . 7264 1 547 . 1 1 111 111 VAL H H 1 7.727 0.02 . 1 . . . . 111 V HN . 7264 1 548 . 1 1 111 111 VAL C C 13 177.143 0.20 . 1 . . . . 111 V C . 7264 1 549 . 1 1 111 111 VAL CA C 13 66.806 0.20 . 1 . . . . 111 V CA . 7264 1 550 . 1 1 111 111 VAL N N 15 120.011 0.20 . 1 . . . . 111 V N . 7264 1 551 . 1 1 112 112 ALA H H 1 7.752 0.02 . 1 . . . . 112 A HN . 7264 1 552 . 1 1 112 112 ALA C C 13 180.901 0.20 . 1 . . . . 112 A C . 7264 1 553 . 1 1 112 112 ALA CA C 13 54.978 0.20 . 1 . . . . 112 A CA . 7264 1 554 . 1 1 112 112 ALA CB C 13 16.344 0.20 . 1 . . . . 112 A CB . 7264 1 555 . 1 1 112 112 ALA N N 15 120.612 0.20 . 1 . . . . 112 A N . 7264 1 556 . 1 1 113 113 ASP H H 1 8.591 0.02 . 1 . . . . 113 D HN . 7264 1 557 . 1 1 113 113 ASP C C 13 178.27 0.20 . 1 . . . . 113 D C . 7264 1 558 . 1 1 113 113 ASP CA C 13 57.249 0.20 . 1 . . . . 113 D CA . 7264 1 559 . 1 1 113 113 ASP CB C 13 42.571 0.20 . 1 . . . . 113 D CB . 7264 1 560 . 1 1 113 113 ASP CG C 13 179.178 0.20 . 1 . . . . 113 D CG . 7264 1 561 . 1 1 113 113 ASP N N 15 116.968 0.20 . 1 . . . . 113 D N . 7264 1 562 . 1 1 114 114 HIS H H 1 7.415 0.02 . 1 . . . . 114 H HN . 7264 1 563 . 1 1 114 114 HIS HD2 H 1 3.79 0.02 . 1 . . . . 114 H HD2 . 7264 1 564 . 1 1 114 114 HIS HE1 H 1 8.28 0.02 . 1 . . . . 114 H HE1 . 7264 1 565 . 1 1 114 114 HIS C C 13 176.311 0.20 . 1 . . . . 114 H C . 7264 1 566 . 1 1 114 114 HIS CA C 13 59.292 0.20 . 1 . . . . 114 H CA . 7264 1 567 . 1 1 114 114 HIS CB C 13 27.947 0.20 . 1 . . . . 114 H CB . 7264 1 568 . 1 1 114 114 HIS CE1 C 13 135.7 0.20 . 1 . . . . 114 H CE1 . 7264 1 569 . 1 1 114 114 HIS N N 15 116.375 0.20 . 1 . . . . 114 H N . 7264 1 570 . 1 1 114 114 HIS ND1 N 15 181.7 0.20 . 4 . . . . 114 H ND1 . 7264 1 571 . 1 1 114 114 HIS NE2 N 15 177.4 0.20 . 4 . . . . 114 H NE2 . 7264 1 572 . 1 1 115 115 PHE H H 1 7.144 0.02 . 1 . . . . 115 F HN . 7264 1 573 . 1 1 115 115 PHE C C 13 173.2 0.20 . 1 . . . . 115 F C . 7264 1 574 . 1 1 115 115 PHE CA C 13 58.269 0.20 . 1 . . . . 115 F CA . 7264 1 575 . 1 1 115 115 PHE CB C 13 39.862 0.20 . 1 . . . . 115 F CB . 7264 1 576 . 1 1 115 115 PHE N N 15 112.449 0.20 . 1 . . . . 115 F N . 7264 1 577 . 1 1 116 116 GLU H H 1 7.206 0.02 . 1 . . . . 116 E HN . 7264 1 578 . 1 1 116 116 GLU C C 13 177.48 0.20 . 1 . . . . 116 E C . 7264 1 579 . 1 1 116 116 GLU CA C 13 58.45 0.20 . 1 . . . . 116 E CA . 7264 1 580 . 1 1 116 116 GLU CB C 13 27.995 0.20 . 1 . . . . 116 E CB . 7264 1 581 . 1 1 116 116 GLU CD C 13 182.394 0.20 . 1 . . . . 116 E CD . 7264 1 582 . 1 1 116 116 GLU N N 15 126.166 0.20 . 1 . . . . 116 E N . 7264 1 583 . 1 1 117 117 GLY H H 1 9.694 0.02 . 1 . . . . 117 G HN . 7264 1 584 . 1 1 117 117 GLY C C 13 174.25 0.20 . 1 . . . . 117 G C . 7264 1 585 . 1 1 117 117 GLY CA C 13 45.096 0.20 . 1 . . . . 117 G CA . 7264 1 586 . 1 1 117 117 GLY N N 15 118.603 0.20 . 1 . . . . 117 G N . 7264 1 587 . 1 1 118 118 LYS H H 1 8.235 0.02 . 1 . . . . 118 K HN . 7264 1 588 . 1 1 118 118 LYS C C 13 176.362 0.20 . 1 . . . . 118 K C . 7264 1 589 . 1 1 118 118 LYS CA C 13 56.823 0.20 . 1 . . . . 118 K CA . 7264 1 590 . 1 1 118 118 LYS CB C 13 33.074 0.20 . 1 . . . . 118 K CB . 7264 1 591 . 1 1 118 118 LYS N N 15 119.347 0.20 . 1 . . . . 118 K N . 7264 1 592 . 1 1 119 119 VAL H H 1 7.336 0.02 . 1 . . . . 119 V HN . 7264 1 593 . 1 1 119 119 VAL C C 13 174.687 0.20 . 1 . . . . 119 V C . 7264 1 594 . 1 1 119 119 VAL CA C 13 61.507 0.20 . 1 . . . . 119 V CA . 7264 1 595 . 1 1 119 119 VAL CB C 13 31.978 0.20 . 1 . . . . 119 V CB . 7264 1 596 . 1 1 119 119 VAL N N 15 117.902 0.20 . 1 . . . . 119 V N . 7264 1 597 . 1 1 120 120 ALA H H 1 8.286 0.02 . 1 . . . . 120 A HN . 7264 1 598 . 1 1 120 120 ALA C C 13 178.667 0.20 . 1 . . . . 120 A C . 7264 1 599 . 1 1 120 120 ALA CA C 13 53.187 0.20 . 1 . . . . 120 A CA . 7264 1 600 . 1 1 120 120 ALA CB C 13 19.779 0.20 . 1 . . . . 120 A CB . 7264 1 601 . 1 1 120 120 ALA N N 15 128.858 0.20 . 1 . . . . 120 A N . 7264 1 602 . 1 1 121 121 SER H H 1 6.574 0.02 . 1 . . . . 121 S HN . 7264 1 603 . 1 1 121 121 SER C C 13 171.047 0.20 . 1 . . . . 121 S C . 7264 1 604 . 1 1 121 121 SER CA C 13 55.917 0.20 . 1 . . . . 121 S CA . 7264 1 605 . 1 1 121 121 SER CB C 13 66.947 0.20 . 1 . . . . 121 S CB . 7264 1 606 . 1 1 121 121 SER N N 15 111.272 0.20 . 1 . . . . 121 S N . 7264 1 607 . 1 1 122 122 TRP H H 1 8.924 0.02 . 1 . . . . 122 W HN . 7264 1 608 . 1 1 122 122 TRP HE1 H 1 12.14 0.02 . 1 . . . . 122 W HE1 . 7264 1 609 . 1 1 122 122 TRP C C 13 175.839 0.20 . 1 . . . . 122 W C . 7264 1 610 . 1 1 122 122 TRP CA C 13 55.558 0.20 . 1 . . . . 122 W CA . 7264 1 611 . 1 1 122 122 TRP CB C 13 34.934 0.20 . 1 . . . . 122 W CB . 7264 1 612 . 1 1 122 122 TRP N N 15 121.684 0.20 . 1 . . . . 122 W N . 7264 1 613 . 1 1 122 122 TRP NE1 N 15 134.73 0.21 . 1 . . . . 122 W NE1 . 7264 1 614 . 1 1 123 123 ASP H H 1 8.77 0.02 . 1 . . . . 123 D HN . 7264 1 615 . 1 1 123 123 ASP C C 13 176.333 0.20 . 1 . . . . 123 D C . 7264 1 616 . 1 1 123 123 ASP CA C 13 53.516 0.20 . 1 . . . . 123 D CA . 7264 1 617 . 1 1 123 123 ASP CB C 13 40.356 0.20 . 1 . . . . 123 D CB . 7264 1 618 . 1 1 123 123 ASP CG C 13 182.763 0.20 . 1 . . . . 123 D CG . 7264 1 619 . 1 1 123 123 ASP N N 15 120.185 0.20 . 1 . . . . 123 D N . 7264 1 620 . 1 1 124 124 VAL H H 1 9.489 0.02 . 1 . . . . 124 V HN . 7264 1 621 . 1 1 124 124 VAL C C 13 174.344 0.20 . 1 . . . . 124 V C . 7264 1 622 . 1 1 124 124 VAL CA C 13 65.405 0.20 . 1 . . . . 124 V CA . 7264 1 623 . 1 1 124 124 VAL CB C 13 30.462 0.20 . 1 . . . . 124 V CB . 7264 1 624 . 1 1 124 124 VAL N N 15 132.518 0.20 . 1 . . . . 124 V N . 7264 1 625 . 1 1 125 125 VAL H H 1 6.458 0.02 . 1 . . . . 125 V HN . 7264 1 626 . 1 1 125 125 VAL C C 13 172.172 0.20 . 1 . . . . 125 V C . 7264 1 627 . 1 1 125 125 VAL CA C 13 60.348 0.20 . 1 . . . . 125 V CA . 7264 1 628 . 1 1 125 125 VAL CB C 13 35.248 0.20 . 1 . . . . 125 V CB . 7264 1 629 . 1 1 125 125 VAL N N 15 112.528 0.20 . 1 . . . . 125 V N . 7264 1 630 . 1 1 126 126 ASN H H 1 8.29 0.02 . 1 . . . . 126 N HN . 7264 1 631 . 1 1 126 126 ASN C C 13 173.947 0.20 . 1 . . . . 126 N C . 7264 1 632 . 1 1 126 126 ASN CA C 13 50.273 0.20 . 1 . . . . 126 N CA . 7264 1 633 . 1 1 126 126 ASN CB C 13 42.403 0.20 . 1 . . . . 126 N CB . 7264 1 634 . 1 1 126 126 ASN N N 15 126.954 0.20 . 1 . . . . 126 N N . 7264 1 635 . 1 1 127 127 GLU H H 1 8.799 0.02 . 1 . . . . 127 E HN . 7264 1 636 . 1 1 127 127 GLU C C 13 174.39 0.20 . 1 . . . . 127 E C . 7264 1 637 . 1 1 127 127 GLU CA C 13 56.882 0.20 . 1 . . . . 127 E CA . 7264 1 638 . 1 1 127 127 GLU CB C 13 26.566 0.20 . 1 . . . . 127 E CB . 7264 1 639 . 1 1 127 127 GLU CD C 13 176.643 0.20 . 1 . . . . 127 E CD . 7264 1 640 . 1 1 127 127 GLU N N 15 120.983 0.20 . 1 . . . . 127 E N . 7264 1 641 . 1 1 128 128 ALA H H 1 8.898 0.02 . 1 . . . . 128 A HN . 7264 1 642 . 1 1 128 128 ALA C C 13 179.467 0.20 . 1 . . . . 128 A C . 7264 1 643 . 1 1 128 128 ALA CA C 13 52.873 0.20 . 1 . . . . 128 A CA . 7264 1 644 . 1 1 128 128 ALA CB C 13 19.788 0.20 . 1 . . . . 128 A CB . 7264 1 645 . 1 1 128 128 ALA N N 15 118.107 0.20 . 1 . . . . 128 A N . 7264 1 646 . 1 1 129 129 PHE H H 1 7.961 0.02 . 1 . . . . 129 F HN . 7264 1 647 . 1 1 129 129 PHE C C 13 173.654 0.20 . 1 . . . . 129 F C . 7264 1 648 . 1 1 129 129 PHE CA C 13 59.082 0.20 . 1 . . . . 129 F CA . 7264 1 649 . 1 1 129 129 PHE CB C 13 40.349 0.20 . 1 . . . . 129 F CB . 7264 1 650 . 1 1 129 129 PHE N N 15 117.46 0.20 . 1 . . . . 129 F N . 7264 1 651 . 1 1 130 130 ALA H H 1 8.625 0.02 . 1 . . . . 130 A HN . 7264 1 652 . 1 1 130 130 ALA C C 13 178.542 0.20 . 1 . . . . 130 A C . 7264 1 653 . 1 1 130 130 ALA CA C 13 49.87 0.20 . 1 . . . . 130 A CA . 7264 1 654 . 1 1 130 130 ALA CB C 13 20.316 0.20 . 1 . . . . 130 A CB . 7264 1 655 . 1 1 130 130 ALA N N 15 124.004 0.20 . 1 . . . . 130 A N . 7264 1 656 . 1 1 132 132 GLY C C 13 174.728 0.20 . 1 . . . . 132 G C . 7264 1 657 . 1 1 132 132 GLY CA C 13 44.708 0.20 . 1 . . . . 132 G CA . 7264 1 658 . 1 1 133 133 GLY H H 1 7.926 0.02 . 1 . . . . 133 G HN . 7264 1 659 . 1 1 133 133 GLY C C 13 173.513 0.20 . 1 . . . . 133 G C . 7264 1 660 . 1 1 133 133 GLY CA C 13 43.557 0.20 . 1 . . . . 133 G CA . 7264 1 661 . 1 1 133 133 GLY N N 15 108.886 0.20 . 1 . . . . 133 G N . 7264 1 662 . 1 1 134 134 GLY H H 1 8.284 0.02 . 1 . . . . 134 G HN . 7264 1 663 . 1 1 134 134 GLY C C 13 173.658 0.20 . 1 . . . . 134 G C . 7264 1 664 . 1 1 134 134 GLY CA C 13 43.956 0.20 . 1 . . . . 134 G CA . 7264 1 665 . 1 1 134 134 GLY N N 15 106.739 0.20 . 1 . . . . 134 G N . 7264 1 666 . 1 1 135 135 ARG H H 1 8.672 0.02 . 1 . . . . 135 R HN . 7264 1 667 . 1 1 135 135 ARG C C 13 177.125 0.20 . 1 . . . . 135 R C . 7264 1 668 . 1 1 135 135 ARG CA C 13 53.504 0.20 . 1 . . . . 135 R CA . 7264 1 669 . 1 1 135 135 ARG CB C 13 30.372 0.20 . 1 . . . . 135 R CB . 7264 1 670 . 1 1 135 135 ARG N N 15 116.48 0.20 . 1 . . . . 135 R N . 7264 1 671 . 1 1 136 136 ARG H H 1 8.077 0.02 . 1 . . . . 136 R HN . 7264 1 672 . 1 1 136 136 ARG C C 13 175.583 0.20 . 1 . . . . 136 R C . 7264 1 673 . 1 1 136 136 ARG CA C 13 57.116 0.20 . 1 . . . . 136 R CA . 7264 1 674 . 1 1 136 136 ARG CB C 13 29.346 0.20 . 1 . . . . 136 R CB . 7264 1 675 . 1 1 136 136 ARG N N 15 122.883 0.20 . 1 . . . . 136 R N . 7264 1 676 . 1 1 137 137 GLN H H 1 8.625 0.02 . 1 . . . . 137 Q HN . 7264 1 677 . 1 1 137 137 GLN C C 13 177.11 0.20 . 1 . . . . 137 Q C . 7264 1 678 . 1 1 137 137 GLN CA C 13 56.102 0.20 . 1 . . . . 137 Q CA . 7264 1 679 . 1 1 137 137 GLN CB C 13 28.589 0.20 . 1 . . . . 137 Q CB . 7264 1 680 . 1 1 137 137 GLN CD C 13 180.325 0.20 . 1 . . . . 137 Q CD . 7264 1 681 . 1 1 137 137 GLN N N 15 124.166 0.20 . 1 . . . . 137 Q N . 7264 1 682 . 1 1 138 138 ASP H H 1 8.18 0.02 . 1 . . . . 138 D HN . 7264 1 683 . 1 1 138 138 ASP C C 13 174.701 0.20 . 1 . . . . 138 D C . 7264 1 684 . 1 1 138 138 ASP CA C 13 52.283 0.20 . 1 . . . . 138 D CA . 7264 1 685 . 1 1 138 138 ASP CB C 13 38.291 0.20 . 1 . . . . 138 D CB . 7264 1 686 . 1 1 138 138 ASP CG C 13 180.639 0.20 . 1 . . . . 138 D CG . 7264 1 687 . 1 1 138 138 ASP N N 15 118.655 0.20 . 1 . . . . 138 D N . 7264 1 688 . 1 1 139 139 SER H H 1 6.491 0.02 . 1 . . . . 139 S HN . 7264 1 689 . 1 1 139 139 SER C C 13 175.267 0.20 . 1 . . . . 139 S C . 7264 1 690 . 1 1 139 139 SER CA C 13 54.145 0.20 . 1 . . . . 139 S CA . 7264 1 691 . 1 1 139 139 SER CB C 13 63.639 0.20 . 1 . . . . 139 S CB . 7264 1 692 . 1 1 139 139 SER N N 15 111.884 0.20 . 1 . . . . 139 S N . 7264 1 693 . 1 1 140 140 ALA H H 1 8.95 0.02 . 1 . . . . 140 A HN . 7264 1 694 . 1 1 140 140 ALA C C 13 178.236 0.20 . 1 . . . . 140 A C . 7264 1 695 . 1 1 140 140 ALA CA C 13 54.534 0.20 . 1 . . . . 140 A CA . 7264 1 696 . 1 1 140 140 ALA CB C 13 17.764 0.20 . 1 . . . . 140 A CB . 7264 1 697 . 1 1 140 140 ALA N N 15 132.312 0.20 . 1 . . . . 140 A N . 7264 1 698 . 1 1 141 141 PHE H H 1 6.959 0.02 . 1 . . . . 141 F HN . 7264 1 699 . 1 1 141 141 PHE C C 13 176.122 0.20 . 1 . . . . 141 F C . 7264 1 700 . 1 1 141 141 PHE CA C 13 61.162 0.20 . 1 . . . . 141 F CA . 7264 1 701 . 1 1 141 141 PHE CB C 13 36.713 0.20 . 1 . . . . 141 F CB . 7264 1 702 . 1 1 141 141 PHE N N 15 113.491 0.20 . 1 . . . . 141 F N . 7264 1 703 . 1 1 142 142 GLN H H 1 6.811 0.02 . 1 . . . . 142 Q HN . 7264 1 704 . 1 1 142 142 GLN C C 13 179.082 0.20 . 1 . . . . 142 Q C . 7264 1 705 . 1 1 142 142 GLN CA C 13 57.268 0.20 . 1 . . . . 142 Q CA . 7264 1 706 . 1 1 142 142 GLN CB C 13 29.332 0.20 . 1 . . . . 142 Q CB . 7264 1 707 . 1 1 142 142 GLN CD C 13 180.101 0.20 . 1 . . . . 142 Q CD . 7264 1 708 . 1 1 142 142 GLN N N 15 119.828 0.20 . 1 . . . . 142 Q N . 7264 1 709 . 1 1 143 143 GLN H H 1 8.329 0.02 . 1 . . . . 143 Q HN . 7264 1 710 . 1 1 143 143 GLN C C 13 178.534 0.20 . 1 . . . . 143 Q C . 7264 1 711 . 1 1 143 143 GLN CA C 13 58.388 0.20 . 1 . . . . 143 Q CA . 7264 1 712 . 1 1 143 143 GLN CB C 13 28.373 0.20 . 1 . . . . 143 Q CB . 7264 1 713 . 1 1 143 143 GLN CD C 13 180.079 0.20 . 1 . . . . 143 Q CD . 7264 1 714 . 1 1 143 143 GLN N N 15 116.559 0.20 . 1 . . . . 143 Q N . 7264 1 715 . 1 1 144 144 LYS H H 1 7.797 0.02 . 1 . . . . 144 K HN . 7264 1 716 . 1 1 144 144 LYS C C 13 178.444 0.20 . 1 . . . . 144 K C . 7264 1 717 . 1 1 144 144 LYS CA C 13 58.419 0.20 . 1 . . . . 144 K CA . 7264 1 718 . 1 1 144 144 LYS CB C 13 34.105 0.20 . 1 . . . . 144 K CB . 7264 1 719 . 1 1 144 144 LYS N N 15 114.843 0.20 . 1 . . . . 144 K N . 7264 1 720 . 1 1 145 145 LEU H H 1 7.831 0.02 . 1 . . . . 145 L HN . 7264 1 721 . 1 1 145 145 LEU C C 13 178.067 0.20 . 1 . . . . 145 L C . 7264 1 722 . 1 1 145 145 LEU CA C 13 53.829 0.20 . 1 . . . . 145 L CA . 7264 1 723 . 1 1 145 145 LEU CB C 13 42.568 0.20 . 1 . . . . 145 L CB . 7264 1 724 . 1 1 145 145 LEU N N 15 114.952 0.20 . 1 . . . . 145 L N . 7264 1 725 . 1 1 146 146 GLY H H 1 7.582 0.02 . 1 . . . . 146 G HN . 7264 1 726 . 1 1 146 146 GLY C C 13 173.578 0.20 . 1 . . . . 146 G C . 7264 1 727 . 1 1 146 146 GLY CA C 13 44.517 0.20 . 1 . . . . 146 G CA . 7264 1 728 . 1 1 146 146 GLY N N 15 109.863 0.20 . 1 . . . . 146 G N . 7264 1 729 . 1 1 147 147 ASN H H 1 8.716 0.02 . 1 . . . . 147 N HN . 7264 1 730 . 1 1 147 147 ASN C C 13 180.537 0.20 . 1 . . . . 147 N C . 7264 1 731 . 1 1 147 147 ASN CA C 13 54.716 0.20 . 1 . . . . 147 N CA . 7264 1 732 . 1 1 147 147 ASN CB C 13 38.12 0.20 . 1 . . . . 147 N CB . 7264 1 733 . 1 1 147 147 ASN N N 15 115.454 0.20 . 1 . . . . 147 N N . 7264 1 734 . 1 1 148 148 GLY C C 13 174.8 0.20 . 1 . . . . 148 G C . 7264 1 735 . 1 1 148 148 GLY CA C 13 46.554 0.20 . 1 . . . . 148 G CA . 7264 1 736 . 1 1 149 149 TYR H H 1 7.128 0.02 . 1 . . . . 149 Y HN . 7264 1 737 . 1 1 149 149 TYR C C 13 175.375 0.20 . 1 . . . . 149 Y C . 7264 1 738 . 1 1 149 149 TYR CA C 13 60.03 0.20 . 1 . . . . 149 Y CA . 7264 1 739 . 1 1 149 149 TYR CB C 13 38.648 0.20 . 1 . . . . 149 Y CB . 7264 1 740 . 1 1 149 149 TYR N N 15 117.536 0.20 . 1 . . . . 149 Y N . 7264 1 741 . 1 1 150 150 ILE H H 1 5.871 0.02 . 1 . . . . 150 I HN . 7264 1 742 . 1 1 150 150 ILE C C 13 177.264 0.20 . 1 . . . . 150 I C . 7264 1 743 . 1 1 150 150 ILE CA C 13 65.495 0.20 . 1 . . . . 150 I CA . 7264 1 744 . 1 1 150 150 ILE CB C 13 36.262 0.20 . 1 . . . . 150 I CB . 7264 1 745 . 1 1 150 150 ILE N N 15 120.247 0.20 . 1 . . . . 150 I N . 7264 1 746 . 1 1 151 151 GLU H H 1 8.721 0.02 . 1 . . . . 151 E HN . 7264 1 747 . 1 1 151 151 GLU C C 13 177.734 0.20 . 1 . . . . 151 E C . 7264 1 748 . 1 1 151 151 GLU CA C 13 59.834 0.20 . 1 . . . . 151 E CA . 7264 1 749 . 1 1 151 151 GLU CB C 13 27.934 0.20 . 1 . . . . 151 E CB . 7264 1 750 . 1 1 151 151 GLU CD C 13 182.453 0.20 . 1 . . . . 151 E CD . 7264 1 751 . 1 1 151 151 GLU N N 15 122.831 0.20 . 1 . . . . 151 E N . 7264 1 752 . 1 1 152 152 THR H H 1 7.805 0.02 . 1 . . . . 152 T HN . 7264 1 753 . 1 1 152 152 THR C C 13 176.684 0.20 . 1 . . . . 152 T C . 7264 1 754 . 1 1 152 152 THR CA C 13 65.998 0.20 . 1 . . . . 152 T CA . 7264 1 755 . 1 1 152 152 THR CB C 13 67.779 0.20 . 1 . . . . 152 T CB . 7264 1 756 . 1 1 152 152 THR N N 15 116.426 0.20 . 1 . . . . 152 T N . 7264 1 757 . 1 1 153 153 ALA H H 1 8.379 0.02 . 1 . . . . 153 A HN . 7264 1 758 . 1 1 153 153 ALA C C 13 178.698 0.20 . 1 . . . . 153 A C . 7264 1 759 . 1 1 153 153 ALA CA C 13 55.969 0.20 . 1 . . . . 153 A CA . 7264 1 760 . 1 1 153 153 ALA CB C 13 17.577 0.20 . 1 . . . . 153 A CB . 7264 1 761 . 1 1 153 153 ALA N N 15 124.412 0.20 . 1 . . . . 153 A N . 7264 1 762 . 1 1 154 154 PHE H H 1 8.341 0.02 . 1 . . . . 154 F HN . 7264 1 763 . 1 1 154 154 PHE C C 13 178.33 0.20 . 1 . . . . 154 F C . 7264 1 764 . 1 1 154 154 PHE CA C 13 64.001 0.20 . 1 . . . . 154 F CA . 7264 1 765 . 1 1 154 154 PHE CB C 13 38.479 0.20 . 1 . . . . 154 F CB . 7264 1 766 . 1 1 154 154 PHE N N 15 117.1 0.20 . 1 . . . . 154 F N . 7264 1 767 . 1 1 155 155 ARG H H 1 8.485 0.02 . 1 . . . . 155 R HN . 7264 1 768 . 1 1 155 155 ARG C C 13 179.581 0.20 . 1 . . . . 155 R C . 7264 1 769 . 1 1 155 155 ARG CA C 13 60.416 0.20 . 1 . . . . 155 R CA . 7264 1 770 . 1 1 155 155 ARG CB C 13 28.723 0.20 . 1 . . . . 155 R CB . 7264 1 771 . 1 1 155 155 ARG N N 15 117.009 0.20 . 1 . . . . 155 R N . 7264 1 772 . 1 1 156 156 ALA H H 1 8.07 0.02 . 1 . . . . 156 A HN . 7264 1 773 . 1 1 156 156 ALA C C 13 179.718 0.20 . 1 . . . . 156 A C . 7264 1 774 . 1 1 156 156 ALA CA C 13 54.112 0.20 . 1 . . . . 156 A CA . 7264 1 775 . 1 1 156 156 ALA CB C 13 17.415 0.20 . 1 . . . . 156 A CB . 7264 1 776 . 1 1 156 156 ALA N N 15 122.299 0.20 . 1 . . . . 156 A N . 7264 1 777 . 1 1 157 157 ALA H H 1 8.181 0.02 . 1 . . . . 157 A HN . 7264 1 778 . 1 1 157 157 ALA C C 13 177.529 0.20 . 1 . . . . 157 A C . 7264 1 779 . 1 1 157 157 ALA CA C 13 55.084 0.20 . 1 . . . . 157 A CA . 7264 1 780 . 1 1 157 157 ALA CB C 13 17.953 0.20 . 1 . . . . 157 A CB . 7264 1 781 . 1 1 157 157 ALA N N 15 123.303 0.20 . 1 . . . . 157 A N . 7264 1 782 . 1 1 158 158 ARG H H 1 7.81 0.02 . 1 . . . . 158 R HN . 7264 1 783 . 1 1 158 158 ARG C C 13 177.165 0.20 . 1 . . . . 158 R C . 7264 1 784 . 1 1 158 158 ARG CA C 13 55.924 0.20 . 1 . . . . 158 R CA . 7264 1 785 . 1 1 158 158 ARG CB C 13 27.437 0.20 . 1 . . . . 158 R CB . 7264 1 786 . 1 1 158 158 ARG N N 15 117.09 0.20 . 1 . . . . 158 R N . 7264 1 787 . 1 1 159 159 ALA H H 1 7.316 0.02 . 1 . . . . 159 A HN . 7264 1 788 . 1 1 159 159 ALA C C 13 178.347 0.20 . 1 . . . . 159 A C . 7264 1 789 . 1 1 159 159 ALA CA C 13 53.581 0.20 . 1 . . . . 159 A CA . 7264 1 790 . 1 1 159 159 ALA CB C 13 17.558 0.20 . 1 . . . . 159 A CB . 7264 1 791 . 1 1 159 159 ALA N N 15 119.209 0.20 . 1 . . . . 159 A N . 7264 1 792 . 1 1 160 160 ALA H H 1 7.108 0.02 . 1 . . . . 160 A HN . 7264 1 793 . 1 1 160 160 ALA C C 13 176.787 0.20 . 1 . . . . 160 A C . 7264 1 794 . 1 1 160 160 ALA CA C 13 52.752 0.20 . 1 . . . . 160 A CA . 7264 1 795 . 1 1 160 160 ALA CB C 13 21.049 0.20 . 1 . . . . 160 A CB . 7264 1 796 . 1 1 160 160 ALA N N 15 119.267 0.20 . 1 . . . . 160 A N . 7264 1 797 . 1 1 161 161 ASP H H 1 7.76 0.02 . 1 . . . . 161 D HN . 7264 1 798 . 1 1 161 161 ASP C C 13 173.701 0.20 . 1 . . . . 161 D C . 7264 1 799 . 1 1 161 161 ASP CA C 13 50.57 0.20 . 1 . . . . 161 D CA . 7264 1 800 . 1 1 161 161 ASP CB C 13 41.124 0.20 . 1 . . . . 161 D CB . 7264 1 801 . 1 1 161 161 ASP N N 15 114.666 0.20 . 1 . . . . 161 D N . 7264 1 802 . 1 1 162 162 PRO C C 13 177.391 0.20 . 1 . . . . 162 P C . 7264 1 803 . 1 1 162 162 PRO CA C 13 63.676 0.20 . 1 . . . . 162 P CA . 7264 1 804 . 1 1 162 162 PRO CB C 13 32.587 0.20 . 1 . . . . 162 P CB . 7264 1 805 . 1 1 163 163 THR H H 1 8.24 0.02 . 1 . . . . 163 T HN . 7264 1 806 . 1 1 163 163 THR C C 13 175.271 0.20 . 1 . . . . 163 T C . 7264 1 807 . 1 1 163 163 THR CA C 13 62.247 0.20 . 1 . . . . 163 T CA . 7264 1 808 . 1 1 163 163 THR CB C 13 70.049 0.20 . 1 . . . . 163 T CB . 7264 1 809 . 1 1 163 163 THR N N 15 110.534 0.20 . 1 . . . . 163 T N . 7264 1 810 . 1 1 164 164 ALA H H 1 7.581 0.02 . 1 . . . . 164 A HN . 7264 1 811 . 1 1 164 164 ALA C C 13 177.97 0.20 . 1 . . . . 164 A C . 7264 1 812 . 1 1 164 164 ALA CA C 13 52.075 0.20 . 1 . . . . 164 A CA . 7264 1 813 . 1 1 164 164 ALA CB C 13 18.261 0.20 . 1 . . . . 164 A CB . 7264 1 814 . 1 1 164 164 ALA N N 15 126.886 0.20 . 1 . . . . 164 A N . 7264 1 815 . 1 1 165 165 LYS H H 1 8.465 0.02 . 1 . . . . 165 K HN . 7264 1 816 . 1 1 165 165 LYS C C 13 176.437 0.20 . 1 . . . . 165 K C . 7264 1 817 . 1 1 165 165 LYS CA C 13 54.938 0.20 . 1 . . . . 165 K CA . 7264 1 818 . 1 1 165 165 LYS CB C 13 31.054 0.20 . 1 . . . . 165 K CB . 7264 1 819 . 1 1 165 165 LYS N N 15 122.497 0.20 . 1 . . . . 165 K N . 7264 1 820 . 1 1 166 166 LEU H H 1 10.413 0.02 . 1 . . . . 166 L HN . 7264 1 821 . 1 1 166 166 LEU C C 13 175.786 0.20 . 1 . . . . 166 L C . 7264 1 822 . 1 1 166 166 LEU CA C 13 54.129 0.20 . 1 . . . . 166 L CA . 7264 1 823 . 1 1 166 166 LEU CB C 13 40.546 0.20 . 1 . . . . 166 L CB . 7264 1 824 . 1 1 166 166 LEU N N 15 125.21 0.20 . 1 . . . . 166 L N . 7264 1 825 . 1 1 167 167 CYS H H 1 10.021 0.02 . 1 . . . . 167 C HN . 7264 1 826 . 1 1 167 167 CYS C C 13 175.503 0.20 . 1 . . . . 167 C C . 7264 1 827 . 1 1 167 167 CYS CA C 13 52.014 0.20 . 1 . . . . 167 C CA . 7264 1 828 . 1 1 167 167 CYS CB C 13 39.43 0.20 . 1 . . . . 167 C CB . 7264 1 829 . 1 1 167 167 CYS N N 15 123.229 0.20 . 1 . . . . 167 C N . 7264 1 830 . 1 1 168 168 ILE H H 1 8.044 0.02 . 1 . . . . 168 I HN . 7264 1 831 . 1 1 168 168 ILE C C 13 171.49 0.20 . 1 . . . . 168 I C . 7264 1 832 . 1 1 168 168 ILE CA C 13 58.55 0.20 . 1 . . . . 168 I CA . 7264 1 833 . 1 1 168 168 ILE CB C 13 41.821 0.20 . 1 . . . . 168 I CB . 7264 1 834 . 1 1 168 168 ILE N N 15 121.948 0.20 . 1 . . . . 168 I N . 7264 1 835 . 1 1 169 169 ASN H H 1 8.069 0.02 . 1 . . . . 169 N HN . 7264 1 836 . 1 1 169 169 ASN C C 13 175.462 0.20 . 1 . . . . 169 N C . 7264 1 837 . 1 1 169 169 ASN CA C 13 51.744 0.20 . 1 . . . . 169 N CA . 7264 1 838 . 1 1 169 169 ASN CB C 13 43.159 0.20 . 1 . . . . 169 N CB . 7264 1 839 . 1 1 169 169 ASN N N 15 126.572 0.20 . 1 . . . . 169 N N . 7264 1 840 . 1 1 170 170 ASP H H 1 8.316 0.02 . 1 . . . . 170 D HN . 7264 1 841 . 1 1 170 170 ASP C C 13 171.707 0.20 . 1 . . . . 170 D C . 7264 1 842 . 1 1 170 170 ASP CA C 13 53.74 0.20 . 1 . . . . 170 D CA . 7264 1 843 . 1 1 170 170 ASP CB C 13 46.265 0.20 . 1 . . . . 170 D CB . 7264 1 844 . 1 1 170 170 ASP CG C 13 180.716 0.20 . 1 . . . . 170 D CG . 7264 1 845 . 1 1 170 170 ASP N N 15 126.803 0.20 . 1 . . . . 170 D N . 7264 1 846 . 1 1 171 171 TYR H H 1 10.125 0.02 . 1 . . . . 171 Y HN . 7264 1 847 . 1 1 171 171 TYR C C 13 176.532 0.20 . 1 . . . . 171 Y C . 7264 1 848 . 1 1 171 171 TYR CA C 13 54.729 0.20 . 1 . . . . 171 Y CA . 7264 1 849 . 1 1 171 171 TYR CB C 13 40.264 0.20 . 1 . . . . 171 Y CB . 7264 1 850 . 1 1 171 171 TYR N N 15 117.188 0.20 . 1 . . . . 171 Y N . 7264 1 851 . 1 1 172 172 ASN H H 1 9.278 0.02 . 1 . . . . 172 N HN . 7264 1 852 . 1 1 172 172 ASN C C 13 173.864 0.20 . 1 . . . . 172 N C . 7264 1 853 . 1 1 172 172 ASN CA C 13 54.092 0.20 . 1 . . . . 172 N CA . 7264 1 854 . 1 1 172 172 ASN CB C 13 36.215 0.20 . 1 . . . . 172 N CB . 7264 1 855 . 1 1 172 172 ASN CG C 13 178.322 0.20 . 1 . . . . 172 N CG . 7264 1 856 . 1 1 172 172 ASN N N 15 121.805 0.20 . 1 . . . . 172 N N . 7264 1 857 . 1 1 173 173 VAL H H 1 6.608 0.02 . 1 . . . . 173 V HN . 7264 1 858 . 1 1 173 173 VAL C C 13 172.861 0.20 . 1 . . . . 173 V C . 7264 1 859 . 1 1 173 173 VAL CA C 13 58.971 0.20 . 1 . . . . 173 V CA . 7264 1 860 . 1 1 173 173 VAL CB C 13 31.011 0.20 . 1 . . . . 173 V CB . 7264 1 861 . 1 1 173 173 VAL N N 15 103.931 0.20 . 1 . . . . 173 V N . 7264 1 862 . 1 1 174 174 GLU H H 1 7.988 0.02 . 1 . . . . 174 E HN . 7264 1 863 . 1 1 174 174 GLU C C 13 176.865 0.20 . 1 . . . . 174 E C . 7264 1 864 . 1 1 174 174 GLU CA C 13 61.741 0.20 . 1 . . . . 174 E CA . 7264 1 865 . 1 1 174 174 GLU CB C 13 27.244 0.20 . 1 . . . . 174 E CB . 7264 1 866 . 1 1 174 174 GLU CD C 13 183.88 0.20 . 1 . . . . 174 E CD . 7264 1 867 . 1 1 174 174 GLU N N 15 120.776 0.20 . 1 . . . . 174 E N . 7264 1 868 . 1 1 175 175 GLY H H 1 7.421 0.02 . 1 . . . . 175 G HN . 7264 1 869 . 1 1 175 175 GLY C C 13 173.095 0.20 . 1 . . . . 175 G C . 7264 1 870 . 1 1 175 175 GLY CA C 13 42.512 0.20 . 1 . . . . 175 G CA . 7264 1 871 . 1 1 175 175 GLY N N 15 103.202 0.20 . 1 . . . . 175 G N . 7264 1 872 . 1 1 176 176 ILE H H 1 8.134 0.02 . 1 . . . . 176 I HN . 7264 1 873 . 1 1 176 176 ILE C C 13 174.51 0.20 . 1 . . . . 176 I C . 7264 1 874 . 1 1 176 176 ILE CA C 13 63.093 0.20 . 1 . . . . 176 I CA . 7264 1 875 . 1 1 176 176 ILE CB C 13 34.784 0.20 . 1 . . . . 176 I CB . 7264 1 876 . 1 1 176 176 ILE N N 15 119.892 0.20 . 1 . . . . 176 I N . 7264 1 877 . 1 1 177 177 ASN H H 1 7.876 0.02 . 1 . . . . 177 N HN . 7264 1 878 . 1 1 177 177 ASN C C 13 173.678 0.20 . 1 . . . . 177 N C . 7264 1 879 . 1 1 177 177 ASN CA C 13 51.584 0.20 . 1 . . . . 177 N CA . 7264 1 880 . 1 1 177 177 ASN CB C 13 38.59 0.20 . 1 . . . . 177 N CB . 7264 1 881 . 1 1 177 177 ASN N N 15 127.308 0.20 . 1 . . . . 177 N N . 7264 1 882 . 1 1 178 178 ALA C C 13 179.601 0.20 . 1 . . . . 178 A C . 7264 1 883 . 1 1 178 178 ALA CA C 13 55.339 0.20 . 1 . . . . 178 A CA . 7264 1 884 . 1 1 178 178 ALA CB C 13 18.157 0.20 . 1 . . . . 178 A CB . 7264 1 885 . 1 1 179 179 LYS H H 1 8.188 0.02 . 1 . . . . 179 K HN . 7264 1 886 . 1 1 179 179 LYS C C 13 178.462 0.20 . 1 . . . . 179 K C . 7264 1 887 . 1 1 179 179 LYS CA C 13 60.54 0.20 . 1 . . . . 179 K CA . 7264 1 888 . 1 1 179 179 LYS CB C 13 33.279 0.20 . 1 . . . . 179 K CB . 7264 1 889 . 1 1 179 179 LYS N N 15 121.948 0.20 . 1 . . . . 179 K N . 7264 1 890 . 1 1 180 180 SER H H 1 9.493 0.02 . 1 . . . . 180 S HN . 7264 1 891 . 1 1 180 180 SER C C 13 177.437 0.20 . 1 . . . . 180 S C . 7264 1 892 . 1 1 180 180 SER CA C 13 60.773 0.20 . 1 . . . . 180 S CA . 7264 1 893 . 1 1 180 180 SER CB C 13 63.052 0.20 . 1 . . . . 180 S CB . 7264 1 894 . 1 1 180 180 SER N N 15 116.225 0.20 . 1 . . . . 180 S N . 7264 1 895 . 1 1 181 181 ASN H H 1 8.998 0.02 . 1 . . . . 181 N HN . 7264 1 896 . 1 1 181 181 ASN C C 13 177.858 0.20 . 1 . . . . 181 N C . 7264 1 897 . 1 1 181 181 ASN CA C 13 55.525 0.20 . 1 . . . . 181 N CA . 7264 1 898 . 1 1 181 181 ASN CB C 13 36.264 0.20 . 1 . . . . 181 N CB . 7264 1 899 . 1 1 181 181 ASN CG C 13 175.835 0.20 . 1 . . . . 181 N CG . 7264 1 900 . 1 1 181 181 ASN N N 15 123.699 0.20 . 1 . . . . 181 N N . 7264 1 901 . 1 1 182 182 SER H H 1 7.827 0.02 . 1 . . . . 182 S HN . 7264 1 902 . 1 1 182 182 SER C C 13 175.902 0.20 . 1 . . . . 182 S C . 7264 1 903 . 1 1 182 182 SER CA C 13 62.671 0.20 . 1 . . . . 182 S CA . 7264 1 904 . 1 1 182 182 SER CB C 13 63.398 0.20 . 1 . . . . 182 S CB . 7264 1 905 . 1 1 182 182 SER N N 15 119.84 0.20 . 1 . . . . 182 S N . 7264 1 906 . 1 1 183 183 LEU H H 1 7.368 0.02 . 1 . . . . 183 L HN . 7264 1 907 . 1 1 183 183 LEU C C 13 176.633 0.20 . 1 . . . . 183 L C . 7264 1 908 . 1 1 183 183 LEU CA C 13 57.537 0.20 . 1 . . . . 183 L CA . 7264 1 909 . 1 1 183 183 LEU CB C 13 41.186 0.20 . 1 . . . . 183 L CB . 7264 1 910 . 1 1 183 183 LEU N N 15 126.383 0.20 . 1 . . . . 183 L N . 7264 1 911 . 1 1 184 184 TYR H H 1 8.916 0.02 . 1 . . . . 184 Y HN . 7264 1 912 . 1 1 184 184 TYR C C 13 176.067 0.20 . 1 . . . . 184 Y C . 7264 1 913 . 1 1 184 184 TYR CA C 13 61.785 0.20 . 1 . . . . 184 Y CA . 7264 1 914 . 1 1 184 184 TYR CB C 13 37.458 0.20 . 1 . . . . 184 Y CB . 7264 1 915 . 1 1 184 184 TYR N N 15 122.288 0.20 . 1 . . . . 184 Y N . 7264 1 916 . 1 1 185 185 ASP H H 1 7.955 0.02 . 1 . . . . 185 D HN . 7264 1 917 . 1 1 185 185 ASP C C 13 179.248 0.20 . 1 . . . . 185 D C . 7264 1 918 . 1 1 185 185 ASP CA C 13 56.995 0.20 . 1 . . . . 185 D CA . 7264 1 919 . 1 1 185 185 ASP CB C 13 40.123 0.20 . 1 . . . . 185 D CB . 7264 1 920 . 1 1 185 185 ASP CG C 13 177.254 0.20 . 1 . . . . 185 D CG . 7264 1 921 . 1 1 185 185 ASP N N 15 118.735 0.20 . 1 . . . . 185 D N . 7264 1 922 . 1 1 186 186 LEU H H 1 7.307 0.02 . 1 . . . . 186 L HN . 7264 1 923 . 1 1 186 186 LEU C C 13 177.522 0.20 . 1 . . . . 186 L C . 7264 1 924 . 1 1 186 186 LEU CA C 13 58.27 0.20 . 1 . . . . 186 L CA . 7264 1 925 . 1 1 186 186 LEU CB C 13 40.727 0.20 . 1 . . . . 186 L CB . 7264 1 926 . 1 1 186 186 LEU N N 15 122.723 0.20 . 1 . . . . 186 L N . 7264 1 927 . 1 1 187 187 VAL H H 1 8.183 0.02 . 1 . . . . 187 V HN . 7264 1 928 . 1 1 187 187 VAL C C 13 177.183 0.20 . 1 . . . . 187 V C . 7264 1 929 . 1 1 187 187 VAL CA C 13 66.674 0.20 . 1 . . . . 187 V CA . 7264 1 930 . 1 1 187 187 VAL CB C 13 30.24 0.20 . 1 . . . . 187 V CB . 7264 1 931 . 1 1 187 187 VAL N N 15 121.223 0.20 . 1 . . . . 187 V N . 7264 1 932 . 1 1 188 188 LYS H H 1 8.447 0.02 . 1 . . . . 188 K HN . 7264 1 933 . 1 1 188 188 LYS C C 13 178.916 0.20 . 1 . . . . 188 K C . 7264 1 934 . 1 1 188 188 LYS CA C 13 59.91 0.20 . 1 . . . . 188 K CA . 7264 1 935 . 1 1 188 188 LYS CB C 13 31.991 0.20 . 1 . . . . 188 K CB . 7264 1 936 . 1 1 188 188 LYS N N 15 119.673 0.20 . 1 . . . . 188 K N . 7264 1 937 . 1 1 189 189 ASP H H 1 7.631 0.02 . 1 . . . . 189 D HN . 7264 1 938 . 1 1 189 189 ASP C C 13 176.959 0.20 . 1 . . . . 189 D C . 7264 1 939 . 1 1 189 189 ASP CA C 13 57.001 0.20 . 1 . . . . 189 D CA . 7264 1 940 . 1 1 189 189 ASP CB C 13 42.266 0.20 . 1 . . . . 189 D CB . 7264 1 941 . 1 1 189 189 ASP CG C 13 180.229 0.20 . 1 . . . . 189 D CG . 7264 1 942 . 1 1 189 189 ASP N N 15 120.33 0.20 . 1 . . . . 189 D N . 7264 1 943 . 1 1 190 190 PHE H H 1 9.185 0.02 . 1 . . . . 190 F HN . 7264 1 944 . 1 1 190 190 PHE C C 13 179.443 0.20 . 1 . . . . 190 F C . 7264 1 945 . 1 1 190 190 PHE CA C 13 59.538 0.20 . 1 . . . . 190 F CA . 7264 1 946 . 1 1 190 190 PHE CB C 13 36.876 0.20 . 1 . . . . 190 F CB . 7264 1 947 . 1 1 190 190 PHE N N 15 120.989 0.20 . 1 . . . . 190 F N . 7264 1 948 . 1 1 191 191 LYS H H 1 8.641 0.02 . 1 . . . . 191 K HN . 7264 1 949 . 1 1 191 191 LYS C C 13 180.161 0.20 . 1 . . . . 191 K C . 7264 1 950 . 1 1 191 191 LYS CA C 13 56.067 0.20 . 1 . . . . 191 K CA . 7264 1 951 . 1 1 191 191 LYS CB C 13 28.495 0.20 . 1 . . . . 191 K CB . 7264 1 952 . 1 1 191 191 LYS N N 15 116.569 0.20 . 1 . . . . 191 K N . 7264 1 953 . 1 1 192 192 ALA H H 1 8.072 0.02 . 1 . . . . 192 A HN . 7264 1 954 . 1 1 192 192 ALA C C 13 180.213 0.20 . 1 . . . . 192 A C . 7264 1 955 . 1 1 192 192 ALA CA C 13 54.726 0.20 . 1 . . . . 192 A CA . 7264 1 956 . 1 1 192 192 ALA CB C 13 17.935 0.20 . 1 . . . . 192 A CB . 7264 1 957 . 1 1 192 192 ALA N N 15 123.762 0.20 . 1 . . . . 192 A N . 7264 1 958 . 1 1 193 193 ARG H H 1 7.794 0.02 . 1 . . . . 193 R HN . 7264 1 959 . 1 1 193 193 ARG C C 13 176.734 0.20 . 1 . . . . 193 R C . 7264 1 960 . 1 1 193 193 ARG CA C 13 56.469 0.20 . 1 . . . . 193 R CA . 7264 1 961 . 1 1 193 193 ARG CB C 13 30.99 0.20 . 1 . . . . 193 R CB . 7264 1 962 . 1 1 193 193 ARG N N 15 114.193 0.20 . 1 . . . . 193 R N . 7264 1 963 . 1 1 194 194 GLY H H 1 7.634 0.02 . 1 . . . . 194 G HN . 7264 1 964 . 1 1 194 194 GLY C C 13 175.299 0.20 . 1 . . . . 194 G C . 7264 1 965 . 1 1 194 194 GLY CA C 13 45.965 0.20 . 1 . . . . 194 G CA . 7264 1 966 . 1 1 194 194 GLY N N 15 109.445 0.20 . 1 . . . . 194 G N . 7264 1 967 . 1 1 195 195 VAL H H 1 8.325 0.02 . 1 . . . . 195 V HN . 7264 1 968 . 1 1 195 195 VAL C C 13 175.128 0.20 . 1 . . . . 195 V C . 7264 1 969 . 1 1 195 195 VAL CA C 13 60.321 0.20 . 1 . . . . 195 V CA . 7264 1 970 . 1 1 195 195 VAL CB C 13 31.852 0.20 . 1 . . . . 195 V CB . 7264 1 971 . 1 1 195 195 VAL N N 15 125.466 0.20 . 1 . . . . 195 V N . 7264 1 972 . 1 1 196 196 PRO C C 13 172.281 0.20 . 1 . . . . 196 P C . 7264 1 973 . 1 1 196 196 PRO CA C 13 63.621 0.20 . 1 . . . . 196 P CA . 7264 1 974 . 1 1 196 196 PRO CB C 13 30.799 0.20 . 1 . . . . 196 P CB . 7264 1 975 . 1 1 197 197 LEU H H 1 7.258 0.02 . 1 . . . . 197 L HN . 7264 1 976 . 1 1 197 197 LEU C C 13 175.429 0.20 . 1 . . . . 197 L C . 7264 1 977 . 1 1 197 197 LEU CA C 13 56.986 0.20 . 1 . . . . 197 L CA . 7264 1 978 . 1 1 197 197 LEU CB C 13 42.064 0.20 . 1 . . . . 197 L CB . 7264 1 979 . 1 1 197 197 LEU N N 15 121.768 0.20 . 1 . . . . 197 L N . 7264 1 980 . 1 1 198 198 ASP H H 1 9.811 0.02 . 1 . . . . 198 D HN . 7264 1 981 . 1 1 198 198 ASP C C 13 175.939 0.20 . 1 . . . . 198 D C . 7264 1 982 . 1 1 198 198 ASP CA C 13 54.731 0.20 . 1 . . . . 198 D CA . 7264 1 983 . 1 1 198 198 ASP CB C 13 45.014 0.20 . 1 . . . . 198 D CB . 7264 1 984 . 1 1 198 198 ASP CG C 13 178.738 0.20 . 1 . . . . 198 D CG . 7264 1 985 . 1 1 198 198 ASP N N 15 123.676 0.20 . 1 . . . . 198 D N . 7264 1 986 . 1 1 199 199 CYS H H 1 8.119 0.02 . 1 . . . . 199 C HN . 7264 1 987 . 1 1 199 199 CYS C C 13 172.713 0.20 . 1 . . . . 199 C C . 7264 1 988 . 1 1 199 199 CYS CA C 13 53.402 0.20 . 1 . . . . 199 C CA . 7264 1 989 . 1 1 199 199 CYS CB C 13 49.053 0.20 . 1 . . . . 199 C CB . 7264 1 990 . 1 1 199 199 CYS N N 15 116.687 0.20 . 1 . . . . 199 C N . 7264 1 991 . 1 1 200 200 VAL H H 1 8.512 0.02 . 1 . . . . 200 V HN . 7264 1 992 . 1 1 200 200 VAL C C 13 173.405 0.20 . 1 . . . . 200 V C . 7264 1 993 . 1 1 200 200 VAL CA C 13 60.612 0.20 . 1 . . . . 200 V CA . 7264 1 994 . 1 1 200 200 VAL CB C 13 34.401 0.20 . 1 . . . . 200 V CB . 7264 1 995 . 1 1 200 200 VAL N N 15 120.725 0.20 . 1 . . . . 200 V N . 7264 1 996 . 1 1 201 201 GLY H H 1 9.559 0.02 . 1 . . . . 201 G HN . 7264 1 997 . 1 1 201 201 GLY C C 13 170.703 0.20 . 1 . . . . 201 G C . 7264 1 998 . 1 1 201 201 GLY CA C 13 44.426 0.20 . 1 . . . . 201 G CA . 7264 1 999 . 1 1 201 201 GLY N N 15 115.838 0.20 . 1 . . . . 201 G N . 7264 1 1000 . 1 1 202 202 PHE H H 1 8.461 0.02 . 1 . . . . 202 F HN . 7264 1 1001 . 1 1 202 202 PHE C C 13 178 0.20 . 1 . . . . 202 F C . 7264 1 1002 . 1 1 202 202 PHE CA C 13 55.066 0.20 . 1 . . . . 202 F CA . 7264 1 1003 . 1 1 202 202 PHE CB C 13 38.739 0.20 . 1 . . . . 202 F CB . 7264 1 1004 . 1 1 202 202 PHE N N 15 122.364 0.20 . 1 . . . . 202 F N . 7264 1 1005 . 1 1 203 203 GLN H H 1 9 0.02 . 1 . . . . 203 Q HN . 7264 1 1006 . 1 1 203 203 GLN C C 13 175.765 0.20 . 1 . . . . 203 Q C . 7264 1 1007 . 1 1 203 203 GLN CA C 13 58.811 0.20 . 1 . . . . 203 Q CA . 7264 1 1008 . 1 1 203 203 GLN CB C 13 28.843 0.20 . 1 . . . . 203 Q CB . 7264 1 1009 . 1 1 203 203 GLN CD C 13 177.993 0.20 . 1 . . . . 203 Q CD . 7264 1 1010 . 1 1 203 203 GLN N N 15 125.226 0.20 . 1 . . . . 203 Q N . 7264 1 1011 . 1 1 204 204 SER H H 1 8.463 0.02 . 1 . . . . 204 S HN . 7264 1 1012 . 1 1 204 204 SER C C 13 174.341 0.20 . 1 . . . . 204 S C . 7264 1 1013 . 1 1 204 204 SER CA C 13 58.446 0.20 . 1 . . . . 204 S CA . 7264 1 1014 . 1 1 204 204 SER CB C 13 61.388 0.20 . 1 . . . . 204 S CB . 7264 1 1015 . 1 1 204 204 SER N N 15 101.914 0.20 . 1 . . . . 204 S N . 7264 1 1016 . 1 1 205 205 HIS H H 1 8.134 0.02 . 1 . . . . 205 H HN . 7264 1 1017 . 1 1 205 205 HIS HD2 H 1 7.59 0.02 . 1 . . . . 205 H HD2 . 7264 1 1018 . 1 1 205 205 HIS HE1 H 1 7.7 0.02 . 1 . . . . 205 H HE1 . 7264 1 1019 . 1 1 205 205 HIS C C 13 175.289 0.20 . 1 . . . . 205 H C . 7264 1 1020 . 1 1 205 205 HIS CA C 13 54.747 0.20 . 1 . . . . 205 H CA . 7264 1 1021 . 1 1 205 205 HIS CB C 13 27.011 0.20 . 1 . . . . 205 H CB . 7264 1 1022 . 1 1 205 205 HIS CD2 C 13 120 0.20 . 1 . . . . 205 H CD2 . 7264 1 1023 . 1 1 205 205 HIS CE1 C 13 138.2 0.20 . 1 . . . . 205 H CE1 . 7264 1 1024 . 1 1 205 205 HIS N N 15 118.556 0.20 . 1 . . . . 205 H N . 7264 1 1025 . 1 1 205 205 HIS ND1 N 15 182.8 0.20 . 4 . . . . 205 H ND1 . 7264 1 1026 . 1 1 205 205 HIS NE2 N 15 171.2 0.20 . 4 . . . . 205 H NE2 . 7264 1 1027 . 1 1 206 206 LEU H H 1 8.583 0.02 . 1 . . . . 206 L HN . 7264 1 1028 . 1 1 206 206 LEU C C 13 175.186 0.20 . 1 . . . . 206 L C . 7264 1 1029 . 1 1 206 206 LEU CA C 13 52.811 0.20 . 1 . . . . 206 L CA . 7264 1 1030 . 1 1 206 206 LEU CB C 13 44.123 0.20 . 1 . . . . 206 L CB . 7264 1 1031 . 1 1 206 206 LEU N N 15 125.4 0.20 . 1 . . . . 206 L N . 7264 1 1032 . 1 1 207 207 ILE H H 1 8.383 0.02 . 1 . . . . 207 I HN . 7264 1 1033 . 1 1 207 207 ILE C C 13 174.719 0.20 . 1 . . . . 207 I C . 7264 1 1034 . 1 1 207 207 ILE CA C 13 60.159 0.20 . 1 . . . . 207 I CA . 7264 1 1035 . 1 1 207 207 ILE CB C 13 40.429 0.20 . 1 . . . . 207 I CB . 7264 1 1036 . 1 1 207 207 ILE N N 15 123.829 0.20 . 1 . . . . 207 I N . 7264 1 1037 . 1 1 208 208 VAL H H 1 8.241 0.02 . 1 . . . . 208 V HN . 7264 1 1038 . 1 1 208 208 VAL C C 13 177.29 0.20 . 1 . . . . 208 V C . 7264 1 1039 . 1 1 208 208 VAL CA C 13 62.443 0.20 . 1 . . . . 208 V CA . 7264 1 1040 . 1 1 208 208 VAL CB C 13 31.542 0.20 . 1 . . . . 208 V CB . 7264 1 1041 . 1 1 208 208 VAL N N 15 125.418 0.20 . 1 . . . . 208 V N . 7264 1 1042 . 1 1 209 209 GLY H H 1 11.868 0.02 . 1 . . . . 209 G HN . 7264 1 1043 . 1 1 209 209 GLY C C 13 176.357 0.20 . 1 . . . . 209 G C . 7264 1 1044 . 1 1 209 209 GLY CA C 13 44.578 0.20 . 1 . . . . 209 G CA . 7264 1 1045 . 1 1 209 209 GLY N N 15 119.97 0.20 . 1 . . . . 209 G N . 7264 1 1046 . 1 1 210 210 GLN H H 1 8.371 0.02 . 1 . . . . 210 Q HN . 7264 1 1047 . 1 1 210 210 GLN C C 13 177.125 0.20 . 1 . . . . 210 Q C . 7264 1 1048 . 1 1 210 210 GLN CA C 13 53.596 0.20 . 1 . . . . 210 Q CA . 7264 1 1049 . 1 1 210 210 GLN CB C 13 27.977 0.20 . 1 . . . . 210 Q CB . 7264 1 1050 . 1 1 210 210 GLN CD C 13 180.639 0.20 . 1 . . . . 210 Q CD . 7264 1 1051 . 1 1 210 210 GLN N N 15 120.803 0.20 . 1 . . . . 210 Q N . 7264 1 1052 . 1 1 211 211 VAL H H 1 8.859 0.02 . 1 . . . . 211 V HN . 7264 1 1053 . 1 1 211 211 VAL C C 13 175.559 0.20 . 1 . . . . 211 V C . 7264 1 1054 . 1 1 211 211 VAL CA C 13 61.771 0.20 . 1 . . . . 211 V CA . 7264 1 1055 . 1 1 211 211 VAL CB C 13 31.476 0.20 . 1 . . . . 211 V CB . 7264 1 1056 . 1 1 211 211 VAL N N 15 126.92 0.20 . 1 . . . . 211 V N . 7264 1 1057 . 1 1 212 212 PRO C C 13 178.751 0.20 . 1 . . . . 212 P C . 7264 1 1058 . 1 1 212 212 PRO CA C 13 63.438 0.20 . 1 . . . . 212 P CA . 7264 1 1059 . 1 1 212 212 PRO CB C 13 31.436 0.20 . 1 . . . . 212 P CB . 7264 1 1060 . 1 1 213 213 GLY H H 1 8.977 0.02 . 1 . . . . 213 G HN . 7264 1 1061 . 1 1 213 213 GLY C C 13 174.28 0.20 . 1 . . . . 213 G C . 7264 1 1062 . 1 1 213 213 GLY CA C 13 46.255 0.20 . 1 . . . . 213 G CA . 7264 1 1063 . 1 1 213 213 GLY N N 15 113.726 0.20 . 1 . . . . 213 G N . 7264 1 1064 . 1 1 214 214 ASP H H 1 8.893 0.02 . 1 . . . . 214 D HN . 7264 1 1065 . 1 1 214 214 ASP C C 13 175.663 0.20 . 1 . . . . 214 D C . 7264 1 1066 . 1 1 214 214 ASP CA C 13 51.733 0.20 . 1 . . . . 214 D CA . 7264 1 1067 . 1 1 214 214 ASP CB C 13 38.093 0.20 . 1 . . . . 214 D CB . 7264 1 1068 . 1 1 214 214 ASP CG C 13 180.62 0.20 . 1 . . . . 214 D CG . 7264 1 1069 . 1 1 214 214 ASP N N 15 118.698 0.20 . 1 . . . . 214 D N . 7264 1 1070 . 1 1 215 215 PHE H H 1 6.902 0.02 . 1 . . . . 215 F HN . 7264 1 1071 . 1 1 215 215 PHE C C 13 178.591 0.20 . 1 . . . . 215 F C . 7264 1 1072 . 1 1 215 215 PHE CA C 13 57.951 0.20 . 1 . . . . 215 F CA . 7264 1 1073 . 1 1 215 215 PHE CB C 13 38.957 0.20 . 1 . . . . 215 F CB . 7264 1 1074 . 1 1 215 215 PHE N N 15 121.574 0.20 . 1 . . . . 215 F N . 7264 1 1075 . 1 1 216 216 ARG H H 1 8.947 0.02 . 1 . . . . 216 R HN . 7264 1 1076 . 1 1 216 216 ARG C C 13 177.745 0.20 . 1 . . . . 216 R C . 7264 1 1077 . 1 1 216 216 ARG CA C 13 60.348 0.20 . 1 . . . . 216 R CA . 7264 1 1078 . 1 1 216 216 ARG CB C 13 28.081 0.20 . 1 . . . . 216 R CB . 7264 1 1079 . 1 1 216 216 ARG N N 15 118.905 0.20 . 1 . . . . 216 R N . 7264 1 1080 . 1 1 217 217 GLN H H 1 8.429 0.02 . 1 . . . . 217 Q HN . 7264 1 1081 . 1 1 217 217 GLN C C 13 179.088 0.20 . 1 . . . . 217 Q C . 7264 1 1082 . 1 1 217 217 GLN CA C 13 59.197 0.20 . 1 . . . . 217 Q CA . 7264 1 1083 . 1 1 217 217 GLN CB C 13 27.538 0.20 . 1 . . . . 217 Q CB . 7264 1 1084 . 1 1 217 217 GLN CD C 13 180.108 0.20 . 1 . . . . 217 Q CD . 7264 1 1085 . 1 1 217 217 GLN N N 15 118.929 0.20 . 1 . . . . 217 Q N . 7264 1 1086 . 1 1 218 218 ASN H H 1 8.55 0.02 . 1 . . . . 218 N HN . 7264 1 1087 . 1 1 218 218 ASN C C 13 176.465 0.20 . 1 . . . . 218 N C . 7264 1 1088 . 1 1 218 218 ASN CA C 13 55.713 0.20 . 1 . . . . 218 N CA . 7264 1 1089 . 1 1 218 218 ASN CB C 13 39.002 0.20 . 1 . . . . 218 N CB . 7264 1 1090 . 1 1 218 218 ASN N N 15 120.291 0.20 . 1 . . . . 218 N N . 7264 1 1091 . 1 1 219 219 LEU H H 1 8.596 0.02 . 1 . . . . 219 L HN . 7264 1 1092 . 1 1 219 219 LEU C C 13 179.577 0.20 . 1 . . . . 219 L C . 7264 1 1093 . 1 1 219 219 LEU CA C 13 58.191 0.20 . 1 . . . . 219 L CA . 7264 1 1094 . 1 1 219 219 LEU CB C 13 42.655 0.20 . 1 . . . . 219 L CB . 7264 1 1095 . 1 1 219 219 LEU N N 15 119.013 0.20 . 1 . . . . 219 L N . 7264 1 1096 . 1 1 220 220 GLN H H 1 8.693 0.02 . 1 . . . . 220 Q HN . 7264 1 1097 . 1 1 220 220 GLN C C 13 177.595 0.20 . 1 . . . . 220 Q C . 7264 1 1098 . 1 1 220 220 GLN CA C 13 57.456 0.20 . 1 . . . . 220 Q CA . 7264 1 1099 . 1 1 220 220 GLN CB C 13 28.51 0.20 . 1 . . . . 220 Q CB . 7264 1 1100 . 1 1 220 220 GLN CD C 13 180.28 0.20 . 1 . . . . 220 Q CD . 7264 1 1101 . 1 1 220 220 GLN N N 15 117.116 0.20 . 1 . . . . 220 Q N . 7264 1 1102 . 1 1 221 221 ARG H H 1 8.059 0.02 . 1 . . . . 221 R HN . 7264 1 1103 . 1 1 221 221 ARG C C 13 179.512 0.20 . 1 . . . . 221 R C . 7264 1 1104 . 1 1 221 221 ARG CA C 13 58.637 0.20 . 1 . . . . 221 R CA . 7264 1 1105 . 1 1 221 221 ARG CB C 13 26.886 0.20 . 1 . . . . 221 R CB . 7264 1 1106 . 1 1 221 221 ARG N N 15 117.516 0.20 . 1 . . . . 221 R N . 7264 1 1107 . 1 1 222 222 PHE H H 1 7.596 0.02 . 1 . . . . 222 F HN . 7264 1 1108 . 1 1 222 222 PHE C C 13 177.06 0.20 . 1 . . . . 222 F C . 7264 1 1109 . 1 1 222 222 PHE CA C 13 63.087 0.20 . 1 . . . . 222 F CA . 7264 1 1110 . 1 1 222 222 PHE CB C 13 39.464 0.20 . 1 . . . . 222 F CB . 7264 1 1111 . 1 1 222 222 PHE N N 15 121.817 0.20 . 1 . . . . 222 F N . 7264 1 1112 . 1 1 223 223 ALA H H 1 8.283 0.02 . 1 . . . . 223 A HN . 7264 1 1113 . 1 1 223 223 ALA C C 13 182.241 0.20 . 1 . . . . 223 A C . 7264 1 1114 . 1 1 223 223 ALA CA C 13 54.158 0.20 . 1 . . . . 223 A CA . 7264 1 1115 . 1 1 223 223 ALA CB C 13 18.335 0.20 . 1 . . . . 223 A CB . 7264 1 1116 . 1 1 223 223 ALA N N 15 123.855 0.20 . 1 . . . . 223 A N . 7264 1 1117 . 1 1 224 224 ASP H H 1 8.573 0.02 . 1 . . . . 224 D HN . 7264 1 1118 . 1 1 224 224 ASP C C 13 177.897 0.20 . 1 . . . . 224 D C . 7264 1 1119 . 1 1 224 224 ASP CA C 13 56.306 0.20 . 1 . . . . 224 D CA . 7264 1 1120 . 1 1 224 224 ASP CB C 13 40.279 0.20 . 1 . . . . 224 D CB . 7264 1 1121 . 1 1 224 224 ASP CG C 13 179.242 0.20 . 1 . . . . 224 D CG . 7264 1 1122 . 1 1 224 224 ASP N N 15 118.708 0.20 . 1 . . . . 224 D N . 7264 1 1123 . 1 1 225 225 LEU H H 1 7.871 0.02 . 1 . . . . 225 L HN . 7264 1 1124 . 1 1 225 225 LEU C C 13 177.44 0.20 . 1 . . . . 225 L C . 7264 1 1125 . 1 1 225 225 LEU CA C 13 55.202 0.20 . 1 . . . . 225 L CA . 7264 1 1126 . 1 1 225 225 LEU CB C 13 41.784 0.20 . 1 . . . . 225 L CB . 7264 1 1127 . 1 1 225 225 LEU N N 15 120.159 0.20 . 1 . . . . 225 L N . 7264 1 1128 . 1 1 226 226 GLY H H 1 8.396 0.02 . 1 . . . . 226 G HN . 7264 1 1129 . 1 1 226 226 GLY C C 13 174.202 0.20 . 1 . . . . 226 G C . 7264 1 1130 . 1 1 226 226 GLY CA C 13 45.243 0.20 . 1 . . . . 226 G CA . 7264 1 1131 . 1 1 226 226 GLY N N 15 106.631 0.20 . 1 . . . . 226 G N . 7264 1 1132 . 1 1 227 227 VAL H H 1 6.835 0.02 . 1 . . . . 227 V HN . 7264 1 1133 . 1 1 227 227 VAL C C 13 173.584 0.20 . 1 . . . . 227 V C . 7264 1 1134 . 1 1 227 227 VAL CA C 13 57.962 0.20 . 1 . . . . 227 V CA . 7264 1 1135 . 1 1 227 227 VAL CB C 13 33.964 0.20 . 1 . . . . 227 V CB . 7264 1 1136 . 1 1 227 227 VAL N N 15 110.802 0.20 . 1 . . . . 227 V N . 7264 1 1137 . 1 1 228 228 ASP H H 1 7.62 0.02 . 1 . . . . 228 D HN . 7264 1 1138 . 1 1 228 228 ASP C C 13 176.187 0.20 . 1 . . . . 228 D C . 7264 1 1139 . 1 1 228 228 ASP CA C 13 53.581 0.20 . 1 . . . . 228 D CA . 7264 1 1140 . 1 1 228 228 ASP CB C 13 42.298 0.20 . 1 . . . . 228 D CB . 7264 1 1141 . 1 1 228 228 ASP CG C 13 178.834 0.20 . 1 . . . . 228 D CG . 7264 1 1142 . 1 1 228 228 ASP N N 15 117.639 0.20 . 1 . . . . 228 D N . 7264 1 1143 . 1 1 229 229 VAL H H 1 8.076 0.02 . 1 . . . . 229 V HN . 7264 1 1144 . 1 1 229 229 VAL C C 13 174.916 0.20 . 1 . . . . 229 V C . 7264 1 1145 . 1 1 229 229 VAL CA C 13 57.805 0.20 . 1 . . . . 229 V CA . 7264 1 1146 . 1 1 229 229 VAL CB C 13 35.084 0.20 . 1 . . . . 229 V CB . 7264 1 1147 . 1 1 229 229 VAL N N 15 110.084 0.20 . 1 . . . . 229 V N . 7264 1 1148 . 1 1 230 230 ARG H H 1 8.627 0.02 . 1 . . . . 230 R HN . 7264 1 1149 . 1 1 230 230 ARG C C 13 173.451 0.20 . 1 . . . . 230 R C . 7264 1 1150 . 1 1 230 230 ARG CA C 13 55.893 0.20 . 1 . . . . 230 R CA . 7264 1 1151 . 1 1 230 230 ARG CB C 13 34.556 0.20 . 1 . . . . 230 R CB . 7264 1 1152 . 1 1 230 230 ARG N N 15 121.373 0.20 . 1 . . . . 230 R N . 7264 1 1153 . 1 1 231 231 ILE H H 1 7.967 0.02 . 1 . . . . 231 I HN . 7264 1 1154 . 1 1 231 231 ILE C C 13 177.042 0.20 . 1 . . . . 231 I C . 7264 1 1155 . 1 1 231 231 ILE CA C 13 60.301 0.20 . 1 . . . . 231 I CA . 7264 1 1156 . 1 1 231 231 ILE CB C 13 37.674 0.20 . 1 . . . . 231 I CB . 7264 1 1157 . 1 1 231 231 ILE N N 15 128.684 0.20 . 1 . . . . 231 I N . 7264 1 1158 . 1 1 232 232 THR H H 1 7.995 0.02 . 1 . . . . 232 T HN . 7264 1 1159 . 1 1 232 232 THR C C 13 174.777 0.20 . 1 . . . . 232 T C . 7264 1 1160 . 1 1 232 232 THR CA C 13 62.984 0.20 . 1 . . . . 232 T CA . 7264 1 1161 . 1 1 232 232 THR CB C 13 69.024 0.20 . 1 . . . . 232 T CB . 7264 1 1162 . 1 1 232 232 THR N N 15 118.033 0.20 . 1 . . . . 232 T N . 7264 1 1163 . 1 1 233 233 GLU H H 1 7.469 0.02 . 1 . . . . 233 E HN . 7264 1 1164 . 1 1 233 233 GLU C C 13 173.303 0.20 . 1 . . . . 233 E C . 7264 1 1165 . 1 1 233 233 GLU CA C 13 52.536 0.20 . 1 . . . . 233 E CA . 7264 1 1166 . 1 1 233 233 GLU CB C 13 31.454 0.20 . 1 . . . . 233 E CB . 7264 1 1167 . 1 1 233 233 GLU CD C 13 173.515 0.20 . 1 . . . . 233 E CD . 7264 1 1168 . 1 1 233 233 GLU N N 15 123.783 0.20 . 1 . . . . 233 E N . 7264 1 1169 . 1 1 234 234 LEU H H 1 7.99 0.02 . 1 . . . . 234 L HN . 7264 1 1170 . 1 1 234 234 LEU C C 13 178.042 0.20 . 1 . . . . 234 L C . 7264 1 1171 . 1 1 234 234 LEU CA C 13 55.848 0.20 . 1 . . . . 234 L CA . 7264 1 1172 . 1 1 234 234 LEU CB C 13 41.714 0.20 . 1 . . . . 234 L CB . 7264 1 1173 . 1 1 234 234 LEU N N 15 115.707 0.20 . 1 . . . . 234 L N . 7264 1 1174 . 1 1 236 236 ILE C C 13 175.032 0.20 . 1 . . . . 236 I C . 7264 1 1175 . 1 1 236 236 ILE CA C 13 59.986 0.20 . 1 . . . . 236 I CA . 7264 1 1176 . 1 1 236 236 ILE CB C 13 37.662 0.20 . 1 . . . . 236 I CB . 7264 1 1177 . 1 1 237 237 ARG H H 1 8.448 0.02 . 1 . . . . 237 R HN . 7264 1 1178 . 1 1 237 237 ARG C C 13 173.735 0.20 . 1 . . . . 237 R C . 7264 1 1179 . 1 1 237 237 ARG CA C 13 54.833 0.20 . 1 . . . . 237 R CA . 7264 1 1180 . 1 1 237 237 ARG CB C 13 32.445 0.20 . 1 . . . . 237 R CB . 7264 1 1181 . 1 1 237 237 ARG N N 15 123.232 0.20 . 1 . . . . 237 R N . 7264 1 1182 . 1 1 238 238 MET H H 1 8.402 0.02 . 1 . . . . 238 M HN . 7264 1 1183 . 1 1 238 238 MET C C 13 174.677 0.20 . 1 . . . . 238 M C . 7264 1 1184 . 1 1 238 238 MET CA C 13 52.418 0.20 . 1 . . . . 238 M CA . 7264 1 1185 . 1 1 238 238 MET CB C 13 37.008 0.20 . 1 . . . . 238 M CB . 7264 1 1186 . 1 1 238 238 MET N N 15 117.819 0.20 . 1 . . . . 238 M N . 7264 1 1187 . 1 1 239 239 ARG H H 1 8.557 0.02 . 1 . . . . 239 R HN . 7264 1 1188 . 1 1 239 239 ARG C C 13 177.028 0.20 . 1 . . . . 239 R C . 7264 1 1189 . 1 1 239 239 ARG CA C 13 55.76 0.20 . 1 . . . . 239 R CA . 7264 1 1190 . 1 1 239 239 ARG CB C 13 28.712 0.20 . 1 . . . . 239 R CB . 7264 1 1191 . 1 1 239 239 ARG N N 15 121.291 0.20 . 1 . . . . 239 R N . 7264 1 1192 . 1 1 240 240 THR H H 1 7.994 0.02 . 1 . . . . 240 T HN . 7264 1 1193 . 1 1 240 240 THR C C 13 173.107 0.20 . 1 . . . . 240 T C . 7264 1 1194 . 1 1 240 240 THR CA C 13 59.407 0.20 . 1 . . . . 240 T CA . 7264 1 1195 . 1 1 240 240 THR CB C 13 67.17 0.20 . 1 . . . . 240 T CB . 7264 1 1196 . 1 1 240 240 THR N N 15 117.653 0.20 . 1 . . . . 240 T N . 7264 1 1197 . 1 1 244 244 ALA C C 13 180.724 0.20 . 1 . . . . 244 A C . 7264 1 1198 . 1 1 244 244 ALA CA C 13 55.678 0.20 . 1 . . . . 244 A CA . 7264 1 1199 . 1 1 244 244 ALA CB C 13 18.249 0.20 . 1 . . . . 244 A CB . 7264 1 1200 . 1 1 245 245 THR H H 1 8.202 0.02 . 1 . . . . 245 T HN . 7264 1 1201 . 1 1 245 245 THR C C 13 177.333 0.20 . 1 . . . . 245 T C . 7264 1 1202 . 1 1 245 245 THR CA C 13 66.121 0.20 . 1 . . . . 245 T CA . 7264 1 1203 . 1 1 245 245 THR CB C 13 68.216 0.20 . 1 . . . . 245 T CB . 7264 1 1204 . 1 1 245 245 THR N N 15 117.915 0.20 . 1 . . . . 245 T N . 7264 1 1205 . 1 1 246 246 LYS H H 1 8.981 0.02 . 1 . . . . 246 K HN . 7264 1 1206 . 1 1 246 246 LYS C C 13 179.878 0.20 . 1 . . . . 246 K C . 7264 1 1207 . 1 1 246 246 LYS CA C 13 60.113 0.20 . 1 . . . . 246 K CA . 7264 1 1208 . 1 1 246 246 LYS CB C 13 34.794 0.20 . 1 . . . . 246 K CB . 7264 1 1209 . 1 1 246 246 LYS N N 15 125.59 0.20 . 1 . . . . 246 K N . 7264 1 1210 . 1 1 247 247 LEU H H 1 8.43 0.02 . 1 . . . . 247 L HN . 7264 1 1211 . 1 1 247 247 LEU C C 13 180.254 0.20 . 1 . . . . 247 L C . 7264 1 1212 . 1 1 247 247 LEU CA C 13 57.654 0.20 . 1 . . . . 247 L CA . 7264 1 1213 . 1 1 247 247 LEU CB C 13 41.654 0.20 . 1 . . . . 247 L CB . 7264 1 1214 . 1 1 247 247 LEU N N 15 117.303 0.20 . 1 . . . . 247 L N . 7264 1 1215 . 1 1 248 248 ALA H H 1 7.901 0.02 . 1 . . . . 248 A HN . 7264 1 1216 . 1 1 248 248 ALA C C 13 181.038 0.20 . 1 . . . . 248 A C . 7264 1 1217 . 1 1 248 248 ALA CA C 13 54.808 0.20 . 1 . . . . 248 A CA . 7264 1 1218 . 1 1 248 248 ALA CB C 13 17.6 0.20 . 1 . . . . 248 A CB . 7264 1 1219 . 1 1 248 248 ALA N N 15 125.02 0.20 . 1 . . . . 248 A N . 7264 1 1220 . 1 1 249 249 THR H H 1 8.435 0.02 . 1 . . . . 249 T HN . 7264 1 1221 . 1 1 249 249 THR C C 13 175.034 0.20 . 1 . . . . 249 T C . 7264 1 1222 . 1 1 249 249 THR CA C 13 66.365 0.20 . 1 . . . . 249 T CA . 7264 1 1223 . 1 1 249 249 THR CB C 13 68.195 0.20 . 1 . . . . 249 T CB . 7264 1 1224 . 1 1 249 249 THR N N 15 120.907 0.20 . 1 . . . . 249 T N . 7264 1 1225 . 1 1 250 250 GLN H H 1 8.611 0.02 . 1 . . . . 250 Q HN . 7264 1 1226 . 1 1 250 250 GLN C C 13 177.537 0.20 . 1 . . . . 250 Q C . 7264 1 1227 . 1 1 250 250 GLN CA C 13 58.871 0.20 . 1 . . . . 250 Q CA . 7264 1 1228 . 1 1 250 250 GLN CB C 13 30.334 0.20 . 1 . . . . 250 Q CB . 7264 1 1229 . 1 1 250 250 GLN CD C 13 177.625 0.20 . 1 . . . . 250 Q CD . 7264 1 1230 . 1 1 250 250 GLN N N 15 120.269 0.20 . 1 . . . . 250 Q N . 7264 1 1231 . 1 1 251 251 ALA H H 1 7.907 0.02 . 1 . . . . 251 A HN . 7264 1 1232 . 1 1 251 251 ALA C C 13 177.368 0.20 . 1 . . . . 251 A C . 7264 1 1233 . 1 1 251 251 ALA CA C 13 55.787 0.20 . 1 . . . . 251 A CA . 7264 1 1234 . 1 1 251 251 ALA CB C 13 17.421 0.20 . 1 . . . . 251 A CB . 7264 1 1235 . 1 1 251 251 ALA N N 15 122.242 0.20 . 1 . . . . 251 A N . 7264 1 1236 . 1 1 252 252 ALA H H 1 7.513 0.02 . 1 . . . . 252 A HN . 7264 1 1237 . 1 1 252 252 ALA C C 13 180.624 0.20 . 1 . . . . 252 A C . 7264 1 1238 . 1 1 252 252 ALA CA C 13 54.637 0.20 . 1 . . . . 252 A CA . 7264 1 1239 . 1 1 252 252 ALA CB C 13 17.445 0.20 . 1 . . . . 252 A CB . 7264 1 1240 . 1 1 252 252 ALA N N 15 120.715 0.20 . 1 . . . . 252 A N . 7264 1 1241 . 1 1 253 253 ASP H H 1 8.483 0.02 . 1 . . . . 253 D HN . 7264 1 1242 . 1 1 253 253 ASP C C 13 177.979 0.20 . 1 . . . . 253 D C . 7264 1 1243 . 1 1 253 253 ASP CA C 13 57.661 0.20 . 1 . . . . 253 D CA . 7264 1 1244 . 1 1 253 253 ASP CB C 13 41.271 0.20 . 1 . . . . 253 D CB . 7264 1 1245 . 1 1 253 253 ASP N N 15 123.154 0.20 . 1 . . . . 253 D N . 7264 1 1246 . 1 1 256 256 LYS C C 13 180.003 0.20 . 1 . . . . 256 K C . 7264 1 1247 . 1 1 256 256 LYS CA C 13 59.433 0.20 . 1 . . . . 256 K CA . 7264 1 1248 . 1 1 256 256 LYS CB C 13 32.614 0.20 . 1 . . . . 256 K CB . 7264 1 1249 . 1 1 257 257 VAL H H 1 7.921 0.20 . 1 . . . . 257 V NH . 7264 1 1250 . 1 1 257 257 VAL C C 13 176.689 0.20 . 1 . . . . 257 V C . 7264 1 1251 . 1 1 257 257 VAL CA C 13 66.576 0.20 . 1 . . . . 257 V CA . 7264 1 1252 . 1 1 257 257 VAL CB C 13 31.108 0.20 . 1 . . . . 257 V CB . 7264 1 1253 . 1 1 257 257 VAL N N 15 120.602 0.20 . 1 . . . . 257 V N . 7264 1 1254 . 1 1 258 258 VAL H H 1 7.835 0.02 . 1 . . . . 258 V HN . 7264 1 1255 . 1 1 258 258 VAL C C 13 178.56 0.20 . 1 . . . . 258 V C . 7264 1 1256 . 1 1 258 258 VAL CA C 13 66.784 0.20 . 1 . . . . 258 V CA . 7264 1 1257 . 1 1 258 258 VAL CB C 13 29.871 0.20 . 1 . . . . 258 V CB . 7264 1 1258 . 1 1 258 258 VAL N N 15 118.266 0.20 . 1 . . . . 258 V N . 7264 1 1259 . 1 1 259 259 GLN H H 1 8.798 0.02 . 1 . . . . 259 Q HN . 7264 1 1260 . 1 1 259 259 GLN C C 13 177.548 0.20 . 1 . . . . 259 Q C . 7264 1 1261 . 1 1 259 259 GLN CA C 13 59.356 0.20 . 1 . . . . 259 Q CA . 7264 1 1262 . 1 1 259 259 GLN CB C 13 28.342 0.20 . 1 . . . . 259 Q CB . 7264 1 1263 . 1 1 259 259 GLN CD C 13 180.277 0.20 . 1 . . . . 259 Q CD . 7264 1 1264 . 1 1 259 259 GLN N N 15 118.855 0.20 . 1 . . . . 259 Q N . 7264 1 1265 . 1 1 260 260 ALA H H 1 7.537 0.02 . 1 . . . . 260 A HN . 7264 1 1266 . 1 1 260 260 ALA C C 13 177.905 0.20 . 1 . . . . 260 A C . 7264 1 1267 . 1 1 260 260 ALA CA C 13 55.24 0.20 . 1 . . . . 260 A CA . 7264 1 1268 . 1 1 260 260 ALA CB C 13 16.226 0.20 . 1 . . . . 260 A CB . 7264 1 1269 . 1 1 260 260 ALA N N 15 121.702 0.20 . 1 . . . . 260 A N . 7264 1 1270 . 1 1 261 261 CYS H H 1 6.9 0.02 . 1 . . . . 261 C HN . 7264 1 1271 . 1 1 261 261 CYS C C 13 176.882 0.20 . 1 . . . . 261 C C . 7264 1 1272 . 1 1 261 261 CYS CA C 13 57.589 0.20 . 1 . . . . 261 C CA . 7264 1 1273 . 1 1 261 261 CYS CB C 13 41.316 0.20 . 1 . . . . 261 C CB . 7264 1 1274 . 1 1 261 261 CYS N N 15 111.503 0.20 . 1 . . . . 261 C N . 7264 1 1275 . 1 1 262 262 MET H H 1 8.384 0.02 . 1 . . . . 262 M HN . 7264 1 1276 . 1 1 262 262 MET C C 13 178.595 0.20 . 1 . . . . 262 M C . 7264 1 1277 . 1 1 262 262 MET CA C 13 55.752 0.20 . 1 . . . . 262 M CA . 7264 1 1278 . 1 1 262 262 MET CB C 13 30.051 0.20 . 1 . . . . 262 M CB . 7264 1 1279 . 1 1 262 262 MET N N 15 118.472 0.20 . 1 . . . . 262 M N . 7264 1 1280 . 1 1 263 263 GLN H H 1 7.554 0.02 . 1 . . . . 263 Q HN . 7264 1 1281 . 1 1 263 263 GLN C C 13 174.92 0.20 . 1 . . . . 263 Q C . 7264 1 1282 . 1 1 263 263 GLN CA C 13 56.091 0.20 . 1 . . . . 263 Q CA . 7264 1 1283 . 1 1 263 263 GLN CB C 13 28.923 0.20 . 1 . . . . 263 Q CB . 7264 1 1284 . 1 1 263 263 GLN CD C 13 180.36 0.20 . 1 . . . . 263 Q CD . 7264 1 1285 . 1 1 263 263 GLN N N 15 116.857 0.20 . 1 . . . . 263 Q N . 7264 1 1286 . 1 1 264 264 VAL H H 1 7.629 0.02 . 1 . . . . 264 V HN . 7264 1 1287 . 1 1 264 264 VAL C C 13 177.031 0.20 . 1 . . . . 264 V C . 7264 1 1288 . 1 1 264 264 VAL CA C 13 61.151 0.20 . 1 . . . . 264 V CA . 7264 1 1289 . 1 1 264 264 VAL CB C 13 32.755 0.20 . 1 . . . . 264 V CB . 7264 1 1290 . 1 1 264 264 VAL N N 15 124.211 0.20 . 1 . . . . 264 V N . 7264 1 1291 . 1 1 265 265 THR H H 1 9.092 0.02 . 1 . . . . 265 T HN . 7264 1 1292 . 1 1 265 265 THR C C 13 176.352 0.20 . 1 . . . . 265 T C . 7264 1 1293 . 1 1 265 265 THR CA C 13 66.026 0.20 . 1 . . . . 265 T CA . 7264 1 1294 . 1 1 265 265 THR CB C 13 68.367 0.20 . 1 . . . . 265 T CB . 7264 1 1295 . 1 1 265 265 THR N N 15 124.009 0.20 . 1 . . . . 265 T N . 7264 1 1296 . 1 1 266 266 ARG H H 1 7.28 0.02 . 1 . . . . 266 R HN . 7264 1 1297 . 1 1 266 266 ARG C C 13 176.593 0.20 . 1 . . . . 266 R C . 7264 1 1298 . 1 1 266 266 ARG CA C 13 55.974 0.20 . 1 . . . . 266 R CA . 7264 1 1299 . 1 1 266 266 ARG CB C 13 29.229 0.20 . 1 . . . . 266 R CB . 7264 1 1300 . 1 1 266 266 ARG N N 15 114.379 0.20 . 1 . . . . 266 R N . 7264 1 1301 . 1 1 267 267 CYS H H 1 8.171 0.02 . 1 . . . . 267 C HN . 7264 1 1302 . 1 1 267 267 CYS C C 13 174.634 0.20 . 1 . . . . 267 C C . 7264 1 1303 . 1 1 267 267 CYS CA C 13 55.496 0.20 . 1 . . . . 267 C CA . 7264 1 1304 . 1 1 267 267 CYS CB C 13 44.763 0.20 . 1 . . . . 267 C CB . 7264 1 1305 . 1 1 267 267 CYS N N 15 122.465 0.20 . 1 . . . . 267 C N . 7264 1 1306 . 1 1 268 268 GLN H H 1 9.272 0.02 . 1 . . . . 268 Q HN . 7264 1 1307 . 1 1 268 268 GLN C C 13 176.358 0.20 . 1 . . . . 268 Q C . 7264 1 1308 . 1 1 268 268 GLN CA C 13 56.109 0.20 . 1 . . . . 268 Q CA . 7264 1 1309 . 1 1 268 268 GLN CB C 13 30.123 0.20 . 1 . . . . 268 Q CB . 7264 1 1310 . 1 1 268 268 GLN CD C 13 178.346 0.20 . 1 . . . . 268 Q CD . 7264 1 1311 . 1 1 268 268 GLN N N 15 128.568 0.20 . 1 . . . . 268 Q N . 7264 1 1312 . 1 1 269 269 GLY H H 1 7.326 0.02 . 1 . . . . 269 G HN . 7264 1 1313 . 1 1 269 269 GLY C C 13 169.747 0.20 . 1 . . . . 269 G C . 7264 1 1314 . 1 1 269 269 GLY CA C 13 45.505 0.20 . 1 . . . . 269 G CA . 7264 1 1315 . 1 1 269 269 GLY N N 15 101.572 0.20 . 1 . . . . 269 G N . 7264 1 1316 . 1 1 270 270 VAL H H 1 8.297 0.02 . 1 . . . . 270 V HN . 7264 1 1317 . 1 1 270 270 VAL C C 13 173.13 0.20 . 1 . . . . 270 V C . 7264 1 1318 . 1 1 270 270 VAL CA C 13 60.334 0.20 . 1 . . . . 270 V CA . 7264 1 1319 . 1 1 270 270 VAL CB C 13 36.761 0.20 . 1 . . . . 270 V CB . 7264 1 1320 . 1 1 270 270 VAL N N 15 118.933 0.20 . 1 . . . . 270 V N . 7264 1 1321 . 1 1 271 271 THR H H 1 8.67 0.02 . 1 . . . . 271 T HN . 7264 1 1322 . 1 1 271 271 THR C C 13 172.569 0.20 . 1 . . . . 271 T C . 7264 1 1323 . 1 1 271 271 THR CA C 13 59.682 0.20 . 1 . . . . 271 T CA . 7264 1 1324 . 1 1 271 271 THR CB C 13 70.139 0.20 . 1 . . . . 271 T CB . 7264 1 1325 . 1 1 271 271 THR N N 15 128.421 0.20 . 1 . . . . 271 T N . 7264 1 1326 . 1 1 272 272 VAL H H 1 8.365 0.02 . 1 . . . . 272 V HN . 7264 1 1327 . 1 1 272 272 VAL C C 13 178.231 0.20 . 1 . . . . 272 V C . 7264 1 1328 . 1 1 272 272 VAL CA C 13 58.632 0.20 . 1 . . . . 272 V CA . 7264 1 1329 . 1 1 272 272 VAL CB C 13 33.508 0.20 . 1 . . . . 272 V CB . 7264 1 1330 . 1 1 272 272 VAL N N 15 119.748 0.20 . 1 . . . . 272 V N . 7264 1 1331 . 1 1 273 273 TRP H H 1 8.979 0.02 . 1 . . . . 273 W HN . 7264 1 1332 . 1 1 273 273 TRP HE1 H 1 9.655 0.02 . 1 . . . . 273 W HE1 . 7264 1 1333 . 1 1 273 273 TRP C C 13 175.382 0.20 . 1 . . . . 273 W C . 7264 1 1334 . 1 1 273 273 TRP CA C 13 55.486 0.20 . 1 . . . . 273 W CA . 7264 1 1335 . 1 1 273 273 TRP CB C 13 27.509 0.20 . 1 . . . . 273 W CB . 7264 1 1336 . 1 1 273 273 TRP N N 15 130.174 0.20 . 1 . . . . 273 W N . 7264 1 1337 . 1 1 273 273 TRP NE1 N 15 128 0.21 . 1 . . . . 273 W NE1 . 7264 1 1338 . 1 1 274 274 GLY H H 1 8.196 0.02 . 1 . . . . 274 G HN . 7264 1 1339 . 1 1 274 274 GLY C C 13 171.644 0.20 . 1 . . . . 274 G C . 7264 1 1340 . 1 1 274 274 GLY CA C 13 42.821 0.20 . 1 . . . . 274 G CA . 7264 1 1341 . 1 1 274 274 GLY N N 15 111.773 0.20 . 1 . . . . 274 G N . 7264 1 1342 . 1 1 275 275 ILE H H 1 8.767 0.02 . 1 . . . . 275 I HN . 7264 1 1343 . 1 1 275 275 ILE C C 13 174.746 0.20 . 1 . . . . 275 I C . 7264 1 1344 . 1 1 275 275 ILE CA C 13 63.391 0.20 . 1 . . . . 275 I CA . 7264 1 1345 . 1 1 275 275 ILE CB C 13 40.636 0.20 . 1 . . . . 275 I CB . 7264 1 1346 . 1 1 275 275 ILE N N 15 115.907 0.20 . 1 . . . . 275 I N . 7264 1 1347 . 1 1 276 276 THR H H 1 7.148 0.02 . 1 . . . . 276 T HN . 7264 1 1348 . 1 1 276 276 THR C C 13 174.34 0.20 . 1 . . . . 276 T C . 7264 1 1349 . 1 1 276 276 THR CA C 13 56.068 0.20 . 1 . . . . 276 T CA . 7264 1 1350 . 1 1 276 276 THR CB C 13 69.536 0.20 . 1 . . . . 276 T CB . 7264 1 1351 . 1 1 276 276 THR N N 15 109.832 0.20 . 1 . . . . 276 T N . 7264 1 1352 . 1 1 277 277 ASP H H 1 8.414 0.02 . 1 . . . . 277 D HN . 7264 1 1353 . 1 1 277 277 ASP C C 13 177.501 0.20 . 1 . . . . 277 D C . 7264 1 1354 . 1 1 277 277 ASP CA C 13 56.977 0.20 . 1 . . . . 277 D CA . 7264 1 1355 . 1 1 277 277 ASP CB C 13 41.883 0.20 . 1 . . . . 277 D CB . 7264 1 1356 . 1 1 277 277 ASP CG C 13 175.833 0.20 . 1 . . . . 277 D CG . 7264 1 1357 . 1 1 277 277 ASP N N 15 131.111 0.20 . 1 . . . . 277 D N . 7264 1 1358 . 1 1 278 278 LYS H H 1 7.799 0.02 . 1 . . . . 278 K HN . 7264 1 1359 . 1 1 278 278 LYS C C 13 176.207 0.20 . 1 . . . . 278 K C . 7264 1 1360 . 1 1 278 278 LYS CA C 13 58.975 0.20 . 1 . . . . 278 K CA . 7264 1 1361 . 1 1 278 278 LYS CB C 13 33.389 0.20 . 1 . . . . 278 K CB . 7264 1 1362 . 1 1 278 278 LYS N N 15 119.186 0.20 . 1 . . . . 278 K N . 7264 1 1363 . 1 1 279 279 TYR H H 1 7.219 0.02 . 1 . . . . 279 Y HN . 7264 1 1364 . 1 1 279 279 TYR C C 13 174.764 0.20 . 1 . . . . 279 Y C . 7264 1 1365 . 1 1 279 279 TYR CA C 13 54.396 0.20 . 1 . . . . 279 Y CA . 7264 1 1366 . 1 1 279 279 TYR CB C 13 38.642 0.20 . 1 . . . . 279 Y CB . 7264 1 1367 . 1 1 279 279 TYR N N 15 115.771 0.20 . 1 . . . . 279 Y N . 7264 1 1368 . 1 1 280 280 SER H H 1 7.173 0.02 . 1 . . . . 280 S HN . 7264 1 1369 . 1 1 280 280 SER C C 13 175.621 0.20 . 1 . . . . 280 S C . 7264 1 1370 . 1 1 280 280 SER CA C 13 57.023 0.20 . 1 . . . . 280 S CA . 7264 1 1371 . 1 1 280 280 SER CB C 13 64.276 0.20 . 1 . . . . 280 S CB . 7264 1 1372 . 1 1 280 280 SER N N 15 114.131 0.20 . 1 . . . . 280 S N . 7264 1 1373 . 1 1 281 281 TRP H H 1 8.777 0.02 . 1 . . . . 281 W HN . 7264 1 1374 . 1 1 281 281 TRP HE1 H 1 11.93 0.02 . 1 . . . . 281 W HE1 . 7264 1 1375 . 1 1 281 281 TRP C C 13 176.59 0.20 . 1 . . . . 281 W C . 7264 1 1376 . 1 1 281 281 TRP CA C 13 58.397 0.20 . 1 . . . . 281 W CA . 7264 1 1377 . 1 1 281 281 TRP CB C 13 28.114 0.20 . 1 . . . . 281 W CB . 7264 1 1378 . 1 1 281 281 TRP N N 15 129.043 0.20 . 1 . . . . 281 W N . 7264 1 1379 . 1 1 281 281 TRP NE1 N 15 135.03 0.21 . 1 . . . . 281 W NE1 . 7264 1 1380 . 1 1 282 282 VAL H H 1 6.751 0.02 . 1 . . . . 282 V HN . 7264 1 1381 . 1 1 282 282 VAL C C 13 174.091 0.20 . 1 . . . . 282 V C . 7264 1 1382 . 1 1 282 282 VAL CA C 13 67.561 0.20 . 1 . . . . 282 V CA . 7264 1 1383 . 1 1 282 282 VAL N N 15 119.84 0.20 . 1 . . . . 282 V N . 7264 1 1384 . 1 1 283 283 PRO C C 13 177.78 0.20 . 1 . . . . 283 P C . 7264 1 1385 . 1 1 283 283 PRO CA C 13 64.977 0.20 . 1 . . . . 283 P CA . 7264 1 1386 . 1 1 283 283 PRO CB C 13 30.618 0.20 . 1 . . . . 283 P CB . 7264 1 1387 . 1 1 284 284 ASP H H 1 7.226 0.02 . 1 . . . . 284 D HN . 7264 1 1388 . 1 1 284 284 ASP C C 13 176.754 0.20 . 1 . . . . 284 D C . 7264 1 1389 . 1 1 284 284 ASP CA C 13 55.785 0.20 . 1 . . . . 284 D CA . 7264 1 1390 . 1 1 284 284 ASP CB C 13 40.821 0.20 . 1 . . . . 284 D CB . 7264 1 1391 . 1 1 284 284 ASP CG C 13 179.818 0.20 . 1 . . . . 284 D CG . 7264 1 1392 . 1 1 284 284 ASP N N 15 114.799 0.20 . 1 . . . . 284 D N . 7264 1 1393 . 1 1 285 285 VAL H H 1 7.143 0.02 . 1 . . . . 285 V HN . 7264 1 1394 . 1 1 285 285 VAL C C 13 174.675 0.20 . 1 . . . . 285 V C . 7264 1 1395 . 1 1 285 285 VAL CA C 13 63.221 0.20 . 1 . . . . 285 V CA . 7264 1 1396 . 1 1 285 285 VAL CB C 13 33.302 0.20 . 1 . . . . 285 V CB . 7264 1 1397 . 1 1 285 285 VAL N N 15 119.193 0.20 . 1 . . . . 285 V N . 7264 1 1398 . 1 1 286 286 PHE H H 1 8.396 0.02 . 1 . . . . 286 F HN . 7264 1 1399 . 1 1 286 286 PHE C C 13 171.385 0.20 . 1 . . . . 286 F C . 7264 1 1400 . 1 1 286 286 PHE CA C 13 54.182 0.20 . 1 . . . . 286 F CA . 7264 1 1401 . 1 1 286 286 PHE CB C 13 38.263 0.20 . 1 . . . . 286 F CB . 7264 1 1402 . 1 1 286 286 PHE N N 15 122.029 0.20 . 1 . . . . 286 F N . 7264 1 1403 . 1 1 287 287 PRO C C 13 179.305 0.20 . 1 . . . . 287 P C . 7264 1 1404 . 1 1 287 287 PRO CA C 13 63.463 0.20 . 1 . . . . 287 P CA . 7264 1 1405 . 1 1 287 287 PRO CB C 13 31.061 0.20 . 1 . . . . 287 P CB . 7264 1 1406 . 1 1 288 288 GLY H H 1 8.832 0.02 . 1 . . . . 288 G HN . 7264 1 1407 . 1 1 288 288 GLY C C 13 173.708 0.20 . 1 . . . . 288 G C . 7264 1 1408 . 1 1 288 288 GLY CA C 13 44.797 0.20 . 1 . . . . 288 G CA . 7264 1 1409 . 1 1 288 288 GLY N N 15 112.46 0.20 . 1 . . . . 288 G N . 7264 1 1410 . 1 1 289 289 GLU H H 1 8.313 0.02 . 1 . . . . 289 E HN . 7264 1 1411 . 1 1 289 289 GLU C C 13 176.387 0.20 . 1 . . . . 289 E C . 7264 1 1412 . 1 1 289 289 GLU CA C 13 53.916 0.20 . 1 . . . . 289 E CA . 7264 1 1413 . 1 1 289 289 GLU CB C 13 32.983 0.20 . 1 . . . . 289 E CB . 7264 1 1414 . 1 1 289 289 GLU CD C 13 182.693 0.20 . 1 . . . . 289 E CD . 7264 1 1415 . 1 1 289 289 GLU N N 15 120.149 0.20 . 1 . . . . 289 E N . 7264 1 1416 . 1 1 290 290 GLY H H 1 8.77 0.02 . 1 . . . . 290 G HN . 7264 1 1417 . 1 1 290 290 GLY C C 13 170.947 0.20 . 1 . . . . 290 G C . 7264 1 1418 . 1 1 290 290 GLY CA C 13 46.361 0.20 . 1 . . . . 290 G CA . 7264 1 1419 . 1 1 290 290 GLY N N 15 104.81 0.20 . 1 . . . . 290 G N . 7264 1 1420 . 1 1 291 291 ALA H H 1 8.227 0.02 . 1 . . . . 291 A HN . 7264 1 1421 . 1 1 291 291 ALA C C 13 178.041 0.20 . 1 . . . . 291 A C . 7264 1 1422 . 1 1 291 291 ALA CA C 13 52.092 0.20 . 1 . . . . 291 A CA . 7264 1 1423 . 1 1 291 291 ALA CB C 13 17.789 0.20 . 1 . . . . 291 A CB . 7264 1 1424 . 1 1 291 291 ALA N N 15 124.302 0.20 . 1 . . . . 291 A N . 7264 1 1425 . 1 1 292 292 ALA H H 1 8.887 0.02 . 1 . . . . 292 A HN . 7264 1 1426 . 1 1 292 292 ALA C C 13 178.923 0.20 . 1 . . . . 292 A C . 7264 1 1427 . 1 1 292 292 ALA CA C 13 53.811 0.20 . 1 . . . . 292 A CA . 7264 1 1428 . 1 1 292 292 ALA CB C 13 22.495 0.20 . 1 . . . . 292 A CB . 7264 1 1429 . 1 1 292 292 ALA N N 15 120.921 0.20 . 1 . . . . 292 A N . 7264 1 1430 . 1 1 293 293 LEU H H 1 9.456 0.02 . 1 . . . . 293 L HN . 7264 1 1431 . 1 1 293 293 LEU C C 13 176.999 0.20 . 1 . . . . 293 L C . 7264 1 1432 . 1 1 293 293 LEU CA C 13 54.342 0.20 . 1 . . . . 293 L CA . 7264 1 1433 . 1 1 293 293 LEU CB C 13 41.41 0.20 . 1 . . . . 293 L CB . 7264 1 1434 . 1 1 293 293 LEU N N 15 123.407 0.20 . 1 . . . . 293 L N . 7264 1 1435 . 1 1 294 294 VAL H H 1 8.061 0.02 . 1 . . . . 294 V HN . 7264 1 1436 . 1 1 294 294 VAL C C 13 173.322 0.20 . 1 . . . . 294 V C . 7264 1 1437 . 1 1 294 294 VAL CA C 13 65.418 0.20 . 1 . . . . 294 V CA . 7264 1 1438 . 1 1 294 294 VAL CB C 13 30.276 0.20 . 1 . . . . 294 V CB . 7264 1 1439 . 1 1 294 294 VAL N N 15 119.411 0.20 . 1 . . . . 294 V N . 7264 1 1440 . 1 1 295 295 TRP H H 1 7.355 0.02 . 1 . . . . 295 W HN . 7264 1 1441 . 1 1 295 295 TRP HE1 H 1 10.09 0.02 . 1 . . . . 295 W HE1 . 7264 1 1442 . 1 1 295 295 TRP C C 13 176.236 0.20 . 1 . . . . 295 W C . 7264 1 1443 . 1 1 295 295 TRP CA C 13 58.045 0.20 . 1 . . . . 295 W CA . 7264 1 1444 . 1 1 295 295 TRP CB C 13 32.503 0.20 . 1 . . . . 295 W CB . 7264 1 1445 . 1 1 295 295 TRP N N 15 116.626 0.20 . 1 . . . . 295 W N . 7264 1 1446 . 1 1 295 295 TRP NE1 N 15 130.5 0.21 . 1 . . . . 295 W NE1 . 7264 1 1447 . 1 1 296 296 ASP H H 1 8.727 0.02 . 1 . . . . 296 D HN . 7264 1 1448 . 1 1 296 296 ASP C C 13 179.564 0.20 . 1 . . . . 296 D C . 7264 1 1449 . 1 1 296 296 ASP CA C 13 52.049 0.20 . 1 . . . . 296 D CA . 7264 1 1450 . 1 1 296 296 ASP CB C 13 40.241 0.20 . 1 . . . . 296 D CB . 7264 1 1451 . 1 1 296 296 ASP N N 15 120.052 0.20 . 1 . . . . 296 D N . 7264 1 1452 . 1 1 297 297 ALA C C 13 175.803 0.20 . 1 . . . . 297 A C . 7264 1 1453 . 1 1 297 297 ALA CA C 13 54.202 0.20 . 1 . . . . 297 A CA . 7264 1 1454 . 1 1 297 297 ALA CB C 13 17.909 0.20 . 1 . . . . 297 A CB . 7264 1 1455 . 1 1 298 298 SER H H 1 8.44 0.02 . 1 . . . . 298 S HN . 7264 1 1456 . 1 1 298 298 SER C C 13 174.021 0.20 . 1 . . . . 298 S C . 7264 1 1457 . 1 1 298 298 SER CA C 13 57.342 0.20 . 1 . . . . 298 S CA . 7264 1 1458 . 1 1 298 298 SER CB C 13 63.896 0.20 . 1 . . . . 298 S CB . 7264 1 1459 . 1 1 298 298 SER N N 15 114.539 0.20 . 1 . . . . 298 S N . 7264 1 1460 . 1 1 299 299 TYR H H 1 7.927 0.02 . 1 . . . . 299 Y HN . 7264 1 1461 . 1 1 299 299 TYR C C 13 173.354 0.20 . 1 . . . . 299 Y C . 7264 1 1462 . 1 1 299 299 TYR CA C 13 61.919 0.20 . 1 . . . . 299 Y CA . 7264 1 1463 . 1 1 299 299 TYR CB C 13 33.428 0.20 . 1 . . . . 299 Y CB . 7264 1 1464 . 1 1 299 299 TYR N N 15 113.745 0.20 . 1 . . . . 299 Y N . 7264 1 1465 . 1 1 300 300 ALA H H 1 8.468 0.02 . 1 . . . . 300 A HN . 7264 1 1466 . 1 1 300 300 ALA C C 13 178.429 0.20 . 1 . . . . 300 A C . 7264 1 1467 . 1 1 300 300 ALA CA C 13 50.858 0.20 . 1 . . . . 300 A CA . 7264 1 1468 . 1 1 300 300 ALA CB C 13 18.839 0.20 . 1 . . . . 300 A CB . 7264 1 1469 . 1 1 300 300 ALA N N 15 123.594 0.20 . 1 . . . . 300 A N . 7264 1 1470 . 1 1 301 301 LYS H H 1 8.429 0.02 . 1 . . . . 301 K HN . 7264 1 1471 . 1 1 301 301 LYS C C 13 177.601 0.20 . 1 . . . . 301 K C . 7264 1 1472 . 1 1 301 301 LYS CA C 13 57.262 0.20 . 1 . . . . 301 K CA . 7264 1 1473 . 1 1 301 301 LYS CB C 13 32.745 0.20 . 1 . . . . 301 K CB . 7264 1 1474 . 1 1 301 301 LYS N N 15 122.168 0.20 . 1 . . . . 301 K N . 7264 1 1475 . 1 1 302 302 LYS H H 1 7.747 0.02 . 1 . . . . 302 K HN . 7264 1 1476 . 1 1 302 302 LYS HZ1 H 1 8.063 0.02 . 1 . . . . 302 K HZ . 7264 1 1477 . 1 1 302 302 LYS HZ2 H 1 8.063 0.02 . 1 . . . . 302 K HZ . 7264 1 1478 . 1 1 302 302 LYS HZ3 H 1 8.063 0.02 . 1 . . . . 302 K HZ . 7264 1 1479 . 1 1 302 302 LYS C C 13 176.257 0.20 . 1 . . . . 302 K C . 7264 1 1480 . 1 1 302 302 LYS CA C 13 55.053 0.20 . 1 . . . . 302 K CA . 7264 1 1481 . 1 1 302 302 LYS CB C 13 29.528 0.20 . 1 . . . . 302 K CB . 7264 1 1482 . 1 1 302 302 LYS N N 15 125.821 0.20 . 1 . . . . 302 K N . 7264 1 1483 . 1 1 302 302 LYS NZ N 15 34.823 0.20 . 1 . . . . 302 K NZ . 7264 1 1484 . 1 1 303 303 PRO C C 13 177.007 0.20 . 1 . . . . 303 P C . 7264 1 1485 . 1 1 303 303 PRO CA C 13 65.368 0.20 . 1 . . . . 303 P CA . 7264 1 1486 . 1 1 303 303 PRO CB C 13 30.564 0.20 . 1 . . . . 303 P CB . 7264 1 1487 . 1 1 304 304 ALA H H 1 7.566 0.02 . 1 . . . . 304 A HN . 7264 1 1488 . 1 1 304 304 ALA C C 13 176.218 0.20 . 1 . . . . 304 A C . 7264 1 1489 . 1 1 304 304 ALA CA C 13 54.413 0.20 . 1 . . . . 304 A CA . 7264 1 1490 . 1 1 304 304 ALA CB C 13 19.395 0.20 . 1 . . . . 304 A CB . 7264 1 1491 . 1 1 304 304 ALA N N 15 117.294 0.20 . 1 . . . . 304 A N . 7264 1 1492 . 1 1 305 305 TYR H H 1 7.862 0.02 . 1 . . . . 305 Y HN . 7264 1 1493 . 1 1 305 305 TYR C C 13 176.005 0.20 . 1 . . . . 305 Y C . 7264 1 1494 . 1 1 305 305 TYR CA C 13 62.462 0.20 . 1 . . . . 305 Y CA . 7264 1 1495 . 1 1 305 305 TYR CB C 13 37.619 0.20 . 1 . . . . 305 Y CB . 7264 1 1496 . 1 1 305 305 TYR N N 15 118.348 0.20 . 1 . . . . 305 Y N . 7264 1 1497 . 1 1 306 306 ALA H H 1 7.63 0.02 . 1 . . . . 306 A HN . 7264 1 1498 . 1 1 306 306 ALA C C 13 179.554 0.20 . 1 . . . . 306 A C . 7264 1 1499 . 1 1 306 306 ALA CA C 13 53.91 0.20 . 1 . . . . 306 A CA . 7264 1 1500 . 1 1 306 306 ALA CB C 13 17.914 0.20 . 1 . . . . 306 A CB . 7264 1 1501 . 1 1 306 306 ALA N N 15 120.343 0.20 . 1 . . . . 306 A N . 7264 1 1502 . 1 1 307 307 ALA H H 1 6.955 0.02 . 1 . . . . 307 A HN . 7264 1 1503 . 1 1 307 307 ALA C C 13 179.244 0.20 . 1 . . . . 307 A C . 7264 1 1504 . 1 1 307 307 ALA CA C 13 54.501 0.20 . 1 . . . . 307 A CA . 7264 1 1505 . 1 1 307 307 ALA CB C 13 20.249 0.20 . 1 . . . . 307 A CB . 7264 1 1506 . 1 1 307 307 ALA N N 15 120.592 0.20 . 1 . . . . 307 A N . 7264 1 1507 . 1 1 308 308 VAL H H 1 7.799 0.02 . 1 . . . . 308 V HN . 7264 1 1508 . 1 1 308 308 VAL C C 13 176.951 0.20 . 1 . . . . 308 V C . 7264 1 1509 . 1 1 308 308 VAL CA C 13 66.721 0.20 . 1 . . . . 308 V CA . 7264 1 1510 . 1 1 308 308 VAL CB C 13 30.449 0.20 . 1 . . . . 308 V CB . 7264 1 1511 . 1 1 308 308 VAL N N 15 119.593 0.20 . 1 . . . . 308 V N . 7264 1 1512 . 1 1 309 309 MET H H 1 7.458 0.02 . 1 . . . . 309 M HN . 7264 1 1513 . 1 1 309 309 MET C C 13 178.557 0.20 . 1 . . . . 309 M C . 7264 1 1514 . 1 1 309 309 MET CA C 13 59.11 0.20 . 1 . . . . 309 M CA . 7264 1 1515 . 1 1 309 309 MET CB C 13 31.852 0.20 . 1 . . . . 309 M CB . 7264 1 1516 . 1 1 309 309 MET N N 15 118.738 0.20 . 1 . . . . 309 M N . 7264 1 1517 . 1 1 310 310 GLU H H 1 8.05 0.02 . 1 . . . . 310 E HN . 7264 1 1518 . 1 1 310 310 GLU C C 13 180.525 0.20 . 1 . . . . 310 E C . 7264 1 1519 . 1 1 310 310 GLU CA C 13 58.182 0.20 . 1 . . . . 310 E CA . 7264 1 1520 . 1 1 310 310 GLU CB C 13 29.439 0.20 . 1 . . . . 310 E CB . 7264 1 1521 . 1 1 310 310 GLU CD C 13 183.38 0.20 . 1 . . . . 310 E CD . 7264 1 1522 . 1 1 310 310 GLU N N 15 117.941 0.20 . 1 . . . . 310 E N . 7264 1 1523 . 1 1 311 311 ALA H H 1 8.099 0.02 . 1 . . . . 311 A HN . 7264 1 1524 . 1 1 311 311 ALA C C 13 179.016 0.20 . 1 . . . . 311 A C . 7264 1 1525 . 1 1 311 311 ALA CA C 13 54.329 0.20 . 1 . . . . 311 A CA . 7264 1 1526 . 1 1 311 311 ALA CB C 13 19.754 0.20 . 1 . . . . 311 A CB . 7264 1 1527 . 1 1 311 311 ALA N N 15 124.09 0.20 . 1 . . . . 311 A N . 7264 1 1528 . 1 1 312 312 PHE H H 1 7.562 0.02 . 1 . . . . 312 F HN . 7264 1 1529 . 1 1 312 312 PHE C C 13 176.679 0.20 . 1 . . . . 312 F C . 7264 1 1530 . 1 1 312 312 PHE CA C 13 59.325 0.20 . 1 . . . . 312 F CA . 7264 1 1531 . 1 1 312 312 PHE CB C 13 39.566 0.20 . 1 . . . . 312 F CB . 7264 1 1532 . 1 1 312 312 PHE N N 15 115.052 0.20 . 1 . . . . 312 F N . 7264 1 1533 . 1 1 313 313 GLY H H 1 7.826 0.02 . 1 . . . . 313 G HN . 7264 1 1534 . 1 1 313 313 GLY C C 13 173.87 0.20 . 1 . . . . 313 G C . 7264 1 1535 . 1 1 313 313 GLY CA C 13 45.086 0.20 . 1 . . . . 313 G CA . 7264 1 1536 . 1 1 313 313 GLY N N 15 107.017 0.20 . 1 . . . . 313 G N . 7264 1 1537 . 1 1 314 314 ALA H H 1 7.466 0.02 . 1 . . . . 314 A HN . 7264 1 1538 . 1 1 314 314 ALA C C 13 176.571 0.20 . 1 . . . . 314 A C . 7264 1 1539 . 1 1 314 314 ALA CA C 13 51.117 0.20 . 1 . . . . 314 A CA . 7264 1 1540 . 1 1 314 314 ALA CB C 13 19.824 0.20 . 1 . . . . 314 A CB . 7264 1 1541 . 1 1 314 314 ALA N N 15 123.555 0.20 . 1 . . . . 314 A N . 7264 1 1542 . 1 1 315 315 SER H H 1 8.11 0.02 . 1 . . . . 315 S HN . 7264 1 1543 . 1 1 315 315 SER C C 13 172.79 0.20 . 1 . . . . 315 S C . 7264 1 1544 . 1 1 315 315 SER CA C 13 55.892 0.20 . 1 . . . . 315 S CA . 7264 1 1545 . 1 1 315 315 SER CB C 13 63.693 0.20 . 1 . . . . 315 S CB . 7264 1 1546 . 1 1 315 315 SER N N 15 116.722 0.20 . 1 . . . . 315 S N . 7264 1 stop_ save_