data_27064 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27064 _Entry.Title ; Solution structure of the IgI domain of CD147 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-04-05 _Entry.Accession_date 2017-04-05 _Entry.Last_release_date 2017-04-05 _Entry.Original_release_date 2017-04-05 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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.ORCID _Entry_author.Entry_ID 1 Shujuan Jin . . . . 27064 2 Bin Xia . . . . 27064 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27064 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 430 27064 '15N chemical shifts' 113 27064 '1H chemical shifts' 698 27064 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 . . 2018-04-10 2017-04-05 update BMRB 'update entry citation' 27064 1 . . 2017-12-14 2017-04-05 original author 'original release' 27064 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27064 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1007/s13238-017-0443-1 _Citation.PubMed_ID 28822092 _Citation.Full_citation . _Citation.Title ; Zn(II) can mediate self-association of the extracellular C-terminal domain of CD147. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Protein Cell' _Citation.Journal_name_full 'Protein & cell' _Citation.Journal_volume 9 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1674-8018 _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 310 _Citation.Page_last 315 _Citation.Year 2018 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Shujuan Jin S. . . . 27064 1 2 Pengfei Ding P. . . . 27064 1 3 Pengxiang Chu P. . . . 27064 1 4 Hongwei Li H. . . . 27064 1 5 Jianbo Sun J. . . . 27064 1 6 Dehai Liang D. . . . 27064 1 7 Fei Song F. . . . 27064 1 8 Bin Xia B. . . . 27064 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27064 _Assembly.ID 1 _Assembly.Name CD147 _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 CD147 1 $CD147 A . yes native no no . . . 27064 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_asym_ID_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_asym_ID_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 28 28 SG . 1 . 1 CYS 87 87 SG . . . . . . . . . . . . 27064 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CD147 _Entity.Sf_category entity _Entity.Sf_framecode CD147 _Entity.Entry_ID 27064 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CD147 _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 ; IQLHGPPRVKAVKSSEHINE GETAMLVCKSESVPPVTDWA WYKITDSEDKALMNGSESRF FVSSSQGRSELHIENLNMEA DPGQYRCNGTSSKGSDQAII TLRVRSH ; _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 107 _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 . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 99 ILE . 27064 1 2 100 GLN . 27064 1 3 101 LEU . 27064 1 4 102 HIS . 27064 1 5 103 GLY . 27064 1 6 104 PRO . 27064 1 7 105 PRO . 27064 1 8 106 ARG . 27064 1 9 107 VAL . 27064 1 10 108 LYS . 27064 1 11 109 ALA . 27064 1 12 110 VAL . 27064 1 13 111 LYS . 27064 1 14 112 SER . 27064 1 15 113 SER . 27064 1 16 114 GLU . 27064 1 17 115 HIS . 27064 1 18 116 ILE . 27064 1 19 117 ASN . 27064 1 20 118 GLU . 27064 1 21 119 GLY . 27064 1 22 120 GLU . 27064 1 23 121 THR . 27064 1 24 122 ALA . 27064 1 25 123 MET . 27064 1 26 124 LEU . 27064 1 27 125 VAL . 27064 1 28 126 CYS . 27064 1 29 127 LYS . 27064 1 30 128 SER . 27064 1 31 129 GLU . 27064 1 32 130 SER . 27064 1 33 131 VAL . 27064 1 34 132 PRO . 27064 1 35 133 PRO . 27064 1 36 134 VAL . 27064 1 37 135 THR . 27064 1 38 136 ASP . 27064 1 39 137 TRP . 27064 1 40 138 ALA . 27064 1 41 139 TRP . 27064 1 42 140 TYR . 27064 1 43 141 LYS . 27064 1 44 142 ILE . 27064 1 45 143 THR . 27064 1 46 144 ASP . 27064 1 47 145 SER . 27064 1 48 146 GLU . 27064 1 49 147 ASP . 27064 1 50 148 LYS . 27064 1 51 149 ALA . 27064 1 52 150 LEU . 27064 1 53 151 MET . 27064 1 54 152 ASN . 27064 1 55 153 GLY . 27064 1 56 154 SER . 27064 1 57 155 GLU . 27064 1 58 156 SER . 27064 1 59 157 ARG . 27064 1 60 158 PHE . 27064 1 61 159 PHE . 27064 1 62 160 VAL . 27064 1 63 161 SER . 27064 1 64 162 SER . 27064 1 65 163 SER . 27064 1 66 164 GLN . 27064 1 67 165 GLY . 27064 1 68 166 ARG . 27064 1 69 167 SER . 27064 1 70 168 GLU . 27064 1 71 169 LEU . 27064 1 72 170 HIS . 27064 1 73 171 ILE . 27064 1 74 172 GLU . 27064 1 75 173 ASN . 27064 1 76 174 LEU . 27064 1 77 175 ASN . 27064 1 78 176 MET . 27064 1 79 177 GLU . 27064 1 80 178 ALA . 27064 1 81 179 ASP . 27064 1 82 180 PRO . 27064 1 83 181 GLY . 27064 1 84 182 GLN . 27064 1 85 183 TYR . 27064 1 86 184 ARG . 27064 1 87 185 CYS . 27064 1 88 186 ASN . 27064 1 89 187 GLY . 27064 1 90 188 THR . 27064 1 91 189 SER . 27064 1 92 190 SER . 27064 1 93 191 LYS . 27064 1 94 192 GLY . 27064 1 95 193 SER . 27064 1 96 194 ASP . 27064 1 97 195 GLN . 27064 1 98 196 ALA . 27064 1 99 197 ILE . 27064 1 100 198 ILE . 27064 1 101 199 THR . 27064 1 102 200 LEU . 27064 1 103 201 ARG . 27064 1 104 202 VAL . 27064 1 105 203 ARG . 27064 1 106 204 SER . 27064 1 107 205 HIS . 27064 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 . ILE 1 1 27064 1 . GLN 2 2 27064 1 . LEU 3 3 27064 1 . HIS 4 4 27064 1 . GLY 5 5 27064 1 . PRO 6 6 27064 1 . PRO 7 7 27064 1 . ARG 8 8 27064 1 . VAL 9 9 27064 1 . LYS 10 10 27064 1 . ALA 11 11 27064 1 . VAL 12 12 27064 1 . LYS 13 13 27064 1 . SER 14 14 27064 1 . SER 15 15 27064 1 . GLU 16 16 27064 1 . HIS 17 17 27064 1 . ILE 18 18 27064 1 . ASN 19 19 27064 1 . GLU 20 20 27064 1 . GLY 21 21 27064 1 . GLU 22 22 27064 1 . THR 23 23 27064 1 . ALA 24 24 27064 1 . MET 25 25 27064 1 . LEU 26 26 27064 1 . VAL 27 27 27064 1 . CYS 28 28 27064 1 . LYS 29 29 27064 1 . SER 30 30 27064 1 . GLU 31 31 27064 1 . SER 32 32 27064 1 . VAL 33 33 27064 1 . PRO 34 34 27064 1 . PRO 35 35 27064 1 . VAL 36 36 27064 1 . THR 37 37 27064 1 . ASP 38 38 27064 1 . TRP 39 39 27064 1 . ALA 40 40 27064 1 . TRP 41 41 27064 1 . TYR 42 42 27064 1 . LYS 43 43 27064 1 . ILE 44 44 27064 1 . THR 45 45 27064 1 . ASP 46 46 27064 1 . SER 47 47 27064 1 . GLU 48 48 27064 1 . ASP 49 49 27064 1 . LYS 50 50 27064 1 . ALA 51 51 27064 1 . LEU 52 52 27064 1 . MET 53 53 27064 1 . ASN 54 54 27064 1 . GLY 55 55 27064 1 . SER 56 56 27064 1 . GLU 57 57 27064 1 . SER 58 58 27064 1 . ARG 59 59 27064 1 . PHE 60 60 27064 1 . PHE 61 61 27064 1 . VAL 62 62 27064 1 . SER 63 63 27064 1 . SER 64 64 27064 1 . SER 65 65 27064 1 . GLN 66 66 27064 1 . GLY 67 67 27064 1 . ARG 68 68 27064 1 . SER 69 69 27064 1 . GLU 70 70 27064 1 . LEU 71 71 27064 1 . HIS 72 72 27064 1 . ILE 73 73 27064 1 . GLU 74 74 27064 1 . ASN 75 75 27064 1 . LEU 76 76 27064 1 . ASN 77 77 27064 1 . MET 78 78 27064 1 . GLU 79 79 27064 1 . ALA 80 80 27064 1 . ASP 81 81 27064 1 . PRO 82 82 27064 1 . GLY 83 83 27064 1 . GLN 84 84 27064 1 . TYR 85 85 27064 1 . ARG 86 86 27064 1 . CYS 87 87 27064 1 . ASN 88 88 27064 1 . GLY 89 89 27064 1 . THR 90 90 27064 1 . SER 91 91 27064 1 . SER 92 92 27064 1 . LYS 93 93 27064 1 . GLY 94 94 27064 1 . SER 95 95 27064 1 . ASP 96 96 27064 1 . GLN 97 97 27064 1 . ALA 98 98 27064 1 . ILE 99 99 27064 1 . ILE 100 100 27064 1 . THR 101 101 27064 1 . LEU 102 102 27064 1 . ARG 103 103 27064 1 . VAL 104 104 27064 1 . ARG 105 105 27064 1 . SER 106 106 27064 1 . HIS 107 107 27064 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 27064 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $CD147 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27064 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 27064 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $CD147 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'origami B(DE3)' isoform-2 . . . . pET21a(+) . . . 27064 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27064 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CD147 '[U-100% 13C; U-100% 15N]' . . 1 $CD147 . . 0.5 . . mM . . . . 27064 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 27064 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 27064 1 4 EDTA 'natural abundance' . . . . . . 5 . . mM . . . . 27064 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 27064 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 . pH 27064 1 pressure 1 . atm 27064 1 temperature 298 . K 27064 1 stop_ save_ ############################ # Computer software used # ############################ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 27064 _Software.ID 1 _Software.Type . _Software.Name AMBER _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 27064 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 27064 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_500 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_500 _NMR_spectrometer.Entry_ID 27064 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_800 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_800 _NMR_spectrometer.Entry_ID 27064 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27064 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_500 Bruker Avance . 500 . . . 27064 1 2 spectrometer_800 Bruker Avance . 800 . . . 27064 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 27064 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_500 . . . . . . . . . . . . . . . . 27064 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_800 . . . . . . . . . . . . . . . . 27064 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_500 . . . . . . . . . . . . . . . . 27064 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_500 . . . . . . . . . . . . . . . . 27064 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_500 . . . . . . . . . . . . . . . . 27064 1 6 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_500 . . . . . . . . . . . . . . . . 27064 1 7 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_500 . . . . . . . . . . . . . . . . 27064 1 8 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_500 . . . . . . . . . . . . . . . . 27064 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_800 . . . . . . . . . . . . . . . . 27064 1 10 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_800 . . . . . . . . . . . . . . . . 27064 1 11 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_800 . . . . . . . . . . . . . . . . 27064 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27064 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 internal indirect 0.251449530 . . . . . 27064 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27064 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 internal indirect 0.101329118 . . . . . 27064 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27064 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27064 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.Ambiguity_set_ID _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 GLN H H 1 8.517 . . . . . . . . 100 Q HN . 27064 1 2 . 1 1 2 2 GLN HA H 1 4.411 . . . . . . . . 100 Q HA . 27064 1 3 . 1 1 2 2 GLN HB2 H 1 1.991 . . . . . . . . 100 Q HB1 . 27064 1 4 . 1 1 2 2 GLN HB3 H 1 1.958 . . . . . . . . 100 Q HB2 . 27064 1 5 . 1 1 2 2 GLN HG2 H 1 2.316 . . . . . . . . 100 Q HG1 . 27064 1 6 . 1 1 2 2 GLN HG3 H 1 2.316 . . . . . . . . 100 Q HG2 . 27064 1 7 . 1 1 2 2 GLN HE21 H 1 7.631 . . . . . . . . 100 Q HE21 . 27064 1 8 . 1 1 2 2 GLN HE22 H 1 6.920 . . . . . . . . 100 Q HE22 . 27064 1 9 . 1 1 2 2 GLN C C 13 175.147 . . . . . . . . 100 Q C . 27064 1 10 . 1 1 2 2 GLN CA C 13 55.587 . . . . . . . . 100 Q CA . 27064 1 11 . 1 1 2 2 GLN CB C 13 29.713 . . . . . . . . 100 Q CB . 27064 1 12 . 1 1 2 2 GLN CG C 13 33.863 . . . . . . . . 100 Q CG . 27064 1 13 . 1 1 2 2 GLN N N 15 125.911 . . . . . . . . 100 Q N . 27064 1 14 . 1 1 2 2 GLN NE2 N 15 113.479 . . . . . . . . 100 Q NE2 . 27064 1 15 . 1 1 3 3 LEU H H 1 8.446 . . . . . . . . 101 L HN . 27064 1 16 . 1 1 3 3 LEU HA H 1 4.345 . . . . . . . . 101 L HA . 27064 1 17 . 1 1 3 3 LEU HB2 H 1 1.493 . . . . . . . . 101 L HB1 . 27064 1 18 . 1 1 3 3 LEU HB3 H 1 1.571 . . . . . . . . 101 L HB2 . 27064 1 19 . 1 1 3 3 LEU HG H 1 1.560 . . . . . . . . 101 L HG . 27064 1 20 . 1 1 3 3 LEU HD11 H 1 0.903 . . . . . . . . 101 L HD11 . 27064 1 21 . 1 1 3 3 LEU HD12 H 1 0.903 . . . . . . . . 101 L HD11 . 27064 1 22 . 1 1 3 3 LEU HD13 H 1 0.903 . . . . . . . . 101 L HD11 . 27064 1 23 . 1 1 3 3 LEU HD21 H 1 0.832 . . . . . . . . 101 L HD21 . 27064 1 24 . 1 1 3 3 LEU HD22 H 1 0.832 . . . . . . . . 101 L HD21 . 27064 1 25 . 1 1 3 3 LEU HD23 H 1 0.832 . . . . . . . . 101 L HD21 . 27064 1 26 . 1 1 3 3 LEU C C 13 176.906 . . . . . . . . 101 L C . 27064 1 27 . 1 1 3 3 LEU CA C 13 54.871 . . . . . . . . 101 L CA . 27064 1 28 . 1 1 3 3 LEU CB C 13 42.499 . . . . . . . . 101 L CB . 27064 1 29 . 1 1 3 3 LEU CG C 13 26.985 . . . . . . . . 101 L CG . 27064 1 30 . 1 1 3 3 LEU CD1 C 13 24.832 . . . . . . . . 101 L CD1 . 27064 1 31 . 1 1 3 3 LEU CD2 C 13 23.525 . . . . . . . . 101 L CD2 . 27064 1 32 . 1 1 3 3 LEU N N 15 126.020 . . . . . . . . 101 L N . 27064 1 33 . 1 1 4 4 HIS H H 1 8.372 . . . . . . . . 102 H HN . 27064 1 34 . 1 1 4 4 HIS HA H 1 4.835 . . . . . . . . 102 H HA . 27064 1 35 . 1 1 4 4 HIS HB2 H 1 3.002 . . . . . . . . 102 H HB1 . 27064 1 36 . 1 1 4 4 HIS HB3 H 1 3.054 . . . . . . . . 102 H HB2 . 27064 1 37 . 1 1 4 4 HIS C C 13 175.957 . . . . . . . . 102 H C . 27064 1 38 . 1 1 4 4 HIS CA C 13 55.685 . . . . . . . . 102 H CA . 27064 1 39 . 1 1 4 4 HIS CB C 13 31.929 . . . . . . . . 102 H CB . 27064 1 40 . 1 1 4 4 HIS N N 15 122.088 . . . . . . . . 102 H N . 27064 1 41 . 1 1 5 5 GLY H H 1 8.595 . . . . . . . . 103 G HN . 27064 1 42 . 1 1 5 5 GLY HA2 H 1 4.155 . . . . . . . . 103 G HA1 . 27064 1 43 . 1 1 5 5 GLY HA3 H 1 4.155 . . . . . . . . 103 G HA2 . 27064 1 44 . 1 1 5 5 GLY CA C 13 45.172 . . . . . . . . 103 G CA . 27064 1 45 . 1 1 5 5 GLY N N 15 111.312 . . . . . . . . 103 G N . 27064 1 46 . 1 1 6 6 PRO HA H 1 4.117 . . . . . . . . 104 P HA . 27064 1 47 . 1 1 6 6 PRO HB2 H 1 2.367 . . . . . . . . 104 P HB1 . 27064 1 48 . 1 1 6 6 PRO HB3 H 1 1.925 . . . . . . . . 104 P HB2 . 27064 1 49 . 1 1 6 6 PRO HG2 H 1 2.053 . . . . . . . . 104 P HG1 . 27064 1 50 . 1 1 6 6 PRO HG3 H 1 2.053 . . . . . . . . 104 P HG2 . 27064 1 51 . 1 1 6 6 PRO HD2 H 1 3.625 . . . . . . . . 104 P HD1 . 27064 1 52 . 1 1 6 6 PRO HD3 H 1 3.584 . . . . . . . . 104 P HD2 . 27064 1 53 . 1 1 6 6 PRO CA C 13 61.281 . . . . . . . . 104 P CA . 27064 1 54 . 1 1 6 6 PRO CB C 13 30.919 . . . . . . . . 104 P CB . 27064 1 55 . 1 1 6 6 PRO CG C 13 27.248 . . . . . . . . 104 P CG . 27064 1 56 . 1 1 6 6 PRO CD C 13 49.975 . . . . . . . . 104 P CD . 27064 1 57 . 1 1 7 7 PRO HA H 1 4.255 . . . . . . . . 105 P HA . 27064 1 58 . 1 1 7 7 PRO HB2 H 1 1.239 . . . . . . . . 105 P HB1 . 27064 1 59 . 1 1 7 7 PRO HB3 H 1 1.993 . . . . . . . . 105 P HB2 . 27064 1 60 . 1 1 7 7 PRO HG2 H 1 1.500 . . . . . . . . 105 P HG1 . 27064 1 61 . 1 1 7 7 PRO HG3 H 1 1.759 . . . . . . . . 105 P HG2 . 27064 1 62 . 1 1 7 7 PRO HD2 H 1 3.116 . . . . . . . . 105 P HD1 . 27064 1 63 . 1 1 7 7 PRO HD3 H 1 3.170 . . . . . . . . 105 P HD2 . 27064 1 64 . 1 1 7 7 PRO C C 13 174.903 . . . . . . . . 105 P C . 27064 1 65 . 1 1 7 7 PRO CA C 13 62.932 . . . . . . . . 105 P CA . 27064 1 66 . 1 1 7 7 PRO CB C 13 32.544 . . . . . . . . 105 P CB . 27064 1 67 . 1 1 7 7 PRO CG C 13 26.714 . . . . . . . . 105 P CG . 27064 1 68 . 1 1 7 7 PRO CD C 13 49.460 . . . . . . . . 105 P CD . 27064 1 69 . 1 1 8 8 ARG H H 1 8.029 . . . . . . . . 106 R HN . 27064 1 70 . 1 1 8 8 ARG HA H 1 5.022 . . . . . . . . 106 R HA . 27064 1 71 . 1 1 8 8 ARG HB2 H 1 1.610 . . . . . . . . 106 R HB1 . 27064 1 72 . 1 1 8 8 ARG HB3 H 1 1.670 . . . . . . . . 106 R HB2 . 27064 1 73 . 1 1 8 8 ARG HG2 H 1 1.574 . . . . . . . . 106 R HG1 . 27064 1 74 . 1 1 8 8 ARG HG3 H 1 1.509 . . . . . . . . 106 R HG2 . 27064 1 75 . 1 1 8 8 ARG HD2 H 1 3.215 . . . . . . . . 106 R HD1 . 27064 1 76 . 1 1 8 8 ARG HD3 H 1 3.215 . . . . . . . . 106 R HD2 . 27064 1 77 . 1 1 8 8 ARG C C 13 176.779 . . . . . . . . 106 R C . 27064 1 78 . 1 1 8 8 ARG CA C 13 53.619 . . . . . . . . 106 R CA . 27064 1 79 . 1 1 8 8 ARG CB C 13 31.733 . . . . . . . . 106 R CB . 27064 1 80 . 1 1 8 8 ARG CG C 13 26.823 . . . . . . . . 106 R CG . 27064 1 81 . 1 1 8 8 ARG CD C 13 43.008 . . . . . . . . 106 R CD . 27064 1 82 . 1 1 8 8 ARG N N 15 118.278 . . . . . . . . 106 R N . 27064 1 83 . 1 1 9 9 VAL H H 1 10.274 . . . . . . . . 107 V HN . 27064 1 84 . 1 1 9 9 VAL HA H 1 4.678 . . . . . . . . 107 V HA . 27064 1 85 . 1 1 9 9 VAL HB H 1 1.706 . . . . . . . . 107 V HB . 27064 1 86 . 1 1 9 9 VAL HG11 H 1 0.926 . . . . . . . . 107 V HG11 . 27064 1 87 . 1 1 9 9 VAL HG12 H 1 0.926 . . . . . . . . 107 V HG11 . 27064 1 88 . 1 1 9 9 VAL HG13 H 1 0.926 . . . . . . . . 107 V HG11 . 27064 1 89 . 1 1 9 9 VAL HG21 H 1 0.682 . . . . . . . . 107 V HG21 . 27064 1 90 . 1 1 9 9 VAL HG22 H 1 0.682 . . . . . . . . 107 V HG21 . 27064 1 91 . 1 1 9 9 VAL HG23 H 1 0.682 . . . . . . . . 107 V HG21 . 27064 1 92 . 1 1 9 9 VAL C C 13 173.679 . . . . . . . . 107 V C . 27064 1 93 . 1 1 9 9 VAL CA C 13 60.775 . . . . . . . . 107 V CA . 27064 1 94 . 1 1 9 9 VAL CB C 13 34.135 . . . . . . . . 107 V CB . 27064 1 95 . 1 1 9 9 VAL CG1 C 13 23.220 . . . . . . . . 107 V CG1 . 27064 1 96 . 1 1 9 9 VAL CG2 C 13 21.451 . . . . . . . . 107 V CG2 . 27064 1 97 . 1 1 9 9 VAL N N 15 130.562 . . . . . . . . 107 V N . 27064 1 98 . 1 1 10 10 LYS H H 1 8.875 . . . . . . . . 108 K HN . 27064 1 99 . 1 1 10 10 LYS HA H 1 4.697 . . . . . . . . 108 K HA . 27064 1 100 . 1 1 10 10 LYS HB2 H 1 1.608 . . . . . . . . 108 K HB1 . 27064 1 101 . 1 1 10 10 LYS HB3 H 1 1.767 . . . . . . . . 108 K HB2 . 27064 1 102 . 1 1 10 10 LYS HG2 H 1 1.371 . . . . . . . . 108 K HG1 . 27064 1 103 . 1 1 10 10 LYS HG3 H 1 1.334 . . . . . . . . 108 K HG2 . 27064 1 104 . 1 1 10 10 LYS HD2 H 1 1.692 . . . . . . . . 108 K HD1 . 27064 1 105 . 1 1 10 10 LYS HD3 H 1 1.692 . . . . . . . . 108 K HD2 . 27064 1 106 . 1 1 10 10 LYS HE2 H 1 2.956 . . . . . . . . 108 K HE1 . 27064 1 107 . 1 1 10 10 LYS HE3 H 1 2.954 . . . . . . . . 108 K HE2 . 27064 1 108 . 1 1 10 10 LYS C C 13 175.372 . . . . . . . . 108 K C . 27064 1 109 . 1 1 10 10 LYS CA C 13 54.358 . . . . . . . . 108 K CA . 27064 1 110 . 1 1 10 10 LYS CB C 13 36.550 . . . . . . . . 108 K CB . 27064 1 111 . 1 1 10 10 LYS CG C 13 24.435 . . . . . . . . 108 K CG . 27064 1 112 . 1 1 10 10 LYS CD C 13 29.350 . . . . . . . . 108 K CD . 27064 1 113 . 1 1 10 10 LYS CE C 13 41.983 . . . . . . . . 108 K CE . 27064 1 114 . 1 1 10 10 LYS N N 15 123.685 . . . . . . . . 108 K N . 27064 1 115 . 1 1 11 11 ALA H H 1 8.780 . . . . . . . . 109 A HN . 27064 1 116 . 1 1 11 11 ALA HA H 1 4.984 . . . . . . . . 109 A HA . 27064 1 117 . 1 1 11 11 ALA HB1 H 1 1.233 . . . . . . . . 109 A HB1 . 27064 1 118 . 1 1 11 11 ALA HB2 H 1 1.233 . . . . . . . . 109 A HB1 . 27064 1 119 . 1 1 11 11 ALA HB3 H 1 1.233 . . . . . . . . 109 A HB1 . 27064 1 120 . 1 1 11 11 ALA C C 13 178.882 . . . . . . . . 109 A C . 27064 1 121 . 1 1 11 11 ALA CA C 13 51.385 . . . . . . . . 109 A CA . 27064 1 122 . 1 1 11 11 ALA CB C 13 19.813 . . . . . . . . 109 A CB . 27064 1 123 . 1 1 11 11 ALA N N 15 126.454 . . . . . . . . 109 A N . 27064 1 124 . 1 1 12 12 VAL H H 1 8.609 . . . . . . . . 110 V HN . 27064 1 125 . 1 1 12 12 VAL HA H 1 3.674 . . . . . . . . 110 V HA . 27064 1 126 . 1 1 12 12 VAL HB H 1 1.975 . . . . . . . . 110 V HB . 27064 1 127 . 1 1 12 12 VAL HG11 H 1 0.876 . . . . . . . . 110 V HG11 . 27064 1 128 . 1 1 12 12 VAL HG12 H 1 0.876 . . . . . . . . 110 V HG11 . 27064 1 129 . 1 1 12 12 VAL HG13 H 1 0.876 . . . . . . . . 110 V HG11 . 27064 1 130 . 1 1 12 12 VAL HG21 H 1 0.981 . . . . . . . . 110 V HG21 . 27064 1 131 . 1 1 12 12 VAL HG22 H 1 0.981 . . . . . . . . 110 V HG21 . 27064 1 132 . 1 1 12 12 VAL HG23 H 1 0.981 . . . . . . . . 110 V HG21 . 27064 1 133 . 1 1 12 12 VAL C C 13 176.798 . . . . . . . . 110 V C . 27064 1 134 . 1 1 12 12 VAL CA C 13 66.539 . . . . . . . . 110 V CA . 27064 1 135 . 1 1 12 12 VAL CB C 13 31.803 . . . . . . . . 110 V CB . 27064 1 136 . 1 1 12 12 VAL CG1 C 13 23.662 . . . . . . . . 110 V CG1 . 27064 1 137 . 1 1 12 12 VAL CG2 C 13 21.078 . . . . . . . . 110 V CG2 . 27064 1 138 . 1 1 12 12 VAL N N 15 125.826 . . . . . . . . 110 V N . 27064 1 139 . 1 1 13 13 LYS H H 1 7.472 . . . . . . . . 111 K HN . 27064 1 140 . 1 1 13 13 LYS HA H 1 4.623 . . . . . . . . 111 K HA . 27064 1 141 . 1 1 13 13 LYS HB2 H 1 1.696 . . . . . . . . 111 K HB1 . 27064 1 142 . 1 1 13 13 LYS HB3 H 1 1.910 . . . . . . . . 111 K HB2 . 27064 1 143 . 1 1 13 13 LYS HG2 H 1 1.511 . . . . . . . . 111 K HG1 . 27064 1 144 . 1 1 13 13 LYS HG3 H 1 1.511 . . . . . . . . 111 K HG2 . 27064 1 145 . 1 1 13 13 LYS HD2 H 1 1.790 . . . . . . . . 111 K HD1 . 27064 1 146 . 1 1 13 13 LYS HD3 H 1 1.831 . . . . . . . . 111 K HD2 . 27064 1 147 . 1 1 13 13 LYS HE2 H 1 3.097 . . . . . . . . 111 K HE1 . 27064 1 148 . 1 1 13 13 LYS HE3 H 1 3.092 . . . . . . . . 111 K HE2 . 27064 1 149 . 1 1 13 13 LYS C C 13 176.351 . . . . . . . . 111 K C . 27064 1 150 . 1 1 13 13 LYS CA C 13 55.830 . . . . . . . . 111 K CA . 27064 1 151 . 1 1 13 13 LYS CB C 13 35.053 . . . . . . . . 111 K CB . 27064 1 152 . 1 1 13 13 LYS CG C 13 25.109 . . . . . . . . 111 K CG . 27064 1 153 . 1 1 13 13 LYS CD C 13 29.371 . . . . . . . . 111 K CD . 27064 1 154 . 1 1 13 13 LYS CE C 13 42.128 . . . . . . . . 111 K CE . 27064 1 155 . 1 1 13 13 LYS N N 15 117.758 . . . . . . . . 111 K N . 27064 1 156 . 1 1 14 14 SER H H 1 8.873 . . . . . . . . 112 S HN . 27064 1 157 . 1 1 14 14 SER HA H 1 4.390 . . . . . . . . 112 S HA . 27064 1 158 . 1 1 14 14 SER HB2 H 1 4.039 . . . . . . . . 112 S HB1 . 27064 1 159 . 1 1 14 14 SER HB3 H 1 4.165 . . . . . . . . 112 S HB2 . 27064 1 160 . 1 1 14 14 SER C C 13 173.779 . . . . . . . . 112 S C . 27064 1 161 . 1 1 14 14 SER CA C 13 60.477 . . . . . . . . 112 S CA . 27064 1 162 . 1 1 14 14 SER CB C 13 63.901 . . . . . . . . 112 S CB . 27064 1 163 . 1 1 14 14 SER N N 15 118.869 . . . . . . . . 112 S N . 27064 1 164 . 1 1 15 15 SER H H 1 7.692 . . . . . . . . 113 S HN . 27064 1 165 . 1 1 15 15 SER HA H 1 5.490 . . . . . . . . 113 S HA . 27064 1 166 . 1 1 15 15 SER HB2 H 1 3.765 . . . . . . . . 113 S HB1 . 27064 1 167 . 1 1 15 15 SER HB3 H 1 3.835 . . . . . . . . 113 S HB2 . 27064 1 168 . 1 1 15 15 SER C C 13 173.137 . . . . . . . . 113 S C . 27064 1 169 . 1 1 15 15 SER CA C 13 57.002 . . . . . . . . 113 S CA . 27064 1 170 . 1 1 15 15 SER CB C 13 64.969 . . . . . . . . 113 S CB . 27064 1 171 . 1 1 15 15 SER N N 15 116.900 . . . . . . . . 113 S N . 27064 1 172 . 1 1 16 16 GLU H H 1 8.711 . . . . . . . . 114 E HN . 27064 1 173 . 1 1 16 16 GLU HA H 1 4.938 . . . . . . . . 114 E HA . 27064 1 174 . 1 1 16 16 GLU HB2 H 1 1.531 . . . . . . . . 114 E HB1 . 27064 1 175 . 1 1 16 16 GLU HB3 H 1 1.890 . . . . . . . . 114 E HB2 . 27064 1 176 . 1 1 16 16 GLU HG2 H 1 2.036 . . . . . . . . 114 E HG1 . 27064 1 177 . 1 1 16 16 GLU HG3 H 1 2.104 . . . . . . . . 114 E HG2 . 27064 1 178 . 1 1 16 16 GLU C C 13 175.152 . . . . . . . . 114 E C . 27064 1 179 . 1 1 16 16 GLU CA C 13 54.841 . . . . . . . . 114 E CA . 27064 1 180 . 1 1 16 16 GLU CB C 13 34.243 . . . . . . . . 114 E CB . 27064 1 181 . 1 1 16 16 GLU CG C 13 34.507 . . . . . . . . 114 E CG . 27064 1 182 . 1 1 16 16 GLU N N 15 124.134 . . . . . . . . 114 E N . 27064 1 183 . 1 1 17 17 HIS H H 1 9.116 . . . . . . . . 115 H HN . 27064 1 184 . 1 1 17 17 HIS HA H 1 5.517 . . . . . . . . 115 H HA . 27064 1 185 . 1 1 17 17 HIS HB2 H 1 2.802 . . . . . . . . 115 H HB1 . 27064 1 186 . 1 1 17 17 HIS HB3 H 1 3.119 . . . . . . . . 115 H HB2 . 27064 1 187 . 1 1 17 17 HIS HD2 H 1 6.484 . . . . . . . . 115 H HD2 . 27064 1 188 . 1 1 17 17 HIS C C 13 174.020 . . . . . . . . 115 H C . 27064 1 189 . 1 1 17 17 HIS CA C 13 54.175 . . . . . . . . 115 H CA . 27064 1 190 . 1 1 17 17 HIS CB C 13 31.871 . . . . . . . . 115 H CB . 27064 1 191 . 1 1 17 17 HIS CD2 C 13 119.881 . . . . . . . . 115 H CD2 . 27064 1 192 . 1 1 17 17 HIS N N 15 127.554 . . . . . . . . 115 H N . 27064 1 193 . 1 1 18 18 ILE H H 1 8.189 . . . . . . . . 116 I HN . 27064 1 194 . 1 1 18 18 ILE HA H 1 4.445 . . . . . . . . 116 I HA . 27064 1 195 . 1 1 18 18 ILE HB H 1 1.478 . . . . . . . . 116 I HB . 27064 1 196 . 1 1 18 18 ILE HG12 H 1 1.332 . . . . . . . . 116 I HG11 . 27064 1 197 . 1 1 18 18 ILE HG13 H 1 1.154 . . . . . . . . 116 I HG12 . 27064 1 198 . 1 1 18 18 ILE HG21 H 1 0.952 . . . . . . . . 116 I HG21 . 27064 1 199 . 1 1 18 18 ILE HG22 H 1 0.952 . . . . . . . . 116 I HG21 . 27064 1 200 . 1 1 18 18 ILE HG23 H 1 0.952 . . . . . . . . 116 I HG21 . 27064 1 201 . 1 1 18 18 ILE HD11 H 1 0.777 . . . . . . . . 116 I HD11 . 27064 1 202 . 1 1 18 18 ILE HD12 H 1 0.777 . . . . . . . . 116 I HD11 . 27064 1 203 . 1 1 18 18 ILE HD13 H 1 0.777 . . . . . . . . 116 I HD11 . 27064 1 204 . 1 1 18 18 ILE C C 13 174.528 . . . . . . . . 116 I C . 27064 1 205 . 1 1 18 18 ILE CA C 13 59.044 . . . . . . . . 116 I CA . 27064 1 206 . 1 1 18 18 ILE CB C 13 41.468 . . . . . . . . 116 I CB . 27064 1 207 . 1 1 18 18 ILE CG1 C 13 27.483 . . . . . . . . 116 I CG1 . 27064 1 208 . 1 1 18 18 ILE CG2 C 13 18.535 . . . . . . . . 116 I CG2 . 27064 1 209 . 1 1 18 18 ILE CD1 C 13 12.776 . . . . . . . . 116 I CD1 . 27064 1 210 . 1 1 18 18 ILE N N 15 125.165 . . . . . . . . 116 I N . 27064 1 211 . 1 1 19 19 ASN H H 1 8.340 . . . . . . . . 117 N HN . 27064 1 212 . 1 1 19 19 ASN HA H 1 4.796 . . . . . . . . 117 N HA . 27064 1 213 . 1 1 19 19 ASN HB2 H 1 2.637 . . . . . . . . 117 N HB1 . 27064 1 214 . 1 1 19 19 ASN HB3 H 1 2.570 . . . . . . . . 117 N HB2 . 27064 1 215 . 1 1 19 19 ASN HD21 H 1 6.779 . . . . . . . . 117 N HD21 . 27064 1 216 . 1 1 19 19 ASN HD22 H 1 7.598 . . . . . . . . 117 N HD22 . 27064 1 217 . 1 1 19 19 ASN C C 13 174.648 . . . . . . . . 117 N C . 27064 1 218 . 1 1 19 19 ASN CA C 13 53.591 . . . . . . . . 117 N CA . 27064 1 219 . 1 1 19 19 ASN CB C 13 39.147 . . . . . . . . 117 N CB . 27064 1 220 . 1 1 19 19 ASN N N 15 125.337 . . . . . . . . 117 N N . 27064 1 221 . 1 1 19 19 ASN ND2 N 15 112.784 . . . . . . . . 117 N ND2 . 27064 1 222 . 1 1 20 20 GLU H H 1 8.541 . . . . . . . . 118 E HN . 27064 1 223 . 1 1 20 20 GLU HA H 1 3.617 . . . . . . . . 118 E HA . 27064 1 224 . 1 1 20 20 GLU HB2 H 1 1.877 . . . . . . . . 118 E HB1 . 27064 1 225 . 1 1 20 20 GLU HB3 H 1 1.984 . . . . . . . . 118 E HB2 . 27064 1 226 . 1 1 20 20 GLU HG2 H 1 2.249 . . . . . . . . 118 E HG1 . 27064 1 227 . 1 1 20 20 GLU HG3 H 1 2.307 . . . . . . . . 118 E HG2 . 27064 1 228 . 1 1 20 20 GLU C C 13 176.519 . . . . . . . . 118 E C . 27064 1 229 . 1 1 20 20 GLU CA C 13 57.452 . . . . . . . . 118 E CA . 27064 1 230 . 1 1 20 20 GLU CB C 13 29.866 . . . . . . . . 118 E CB . 27064 1 231 . 1 1 20 20 GLU CG C 13 35.813 . . . . . . . . 118 E CG . 27064 1 232 . 1 1 20 20 GLU N N 15 120.651 . . . . . . . . 118 E N . 27064 1 233 . 1 1 21 21 GLY H H 1 9.580 . . . . . . . . 119 G HN . 27064 1 234 . 1 1 21 21 GLY HA2 H 1 4.357 . . . . . . . . 119 G HA1 . 27064 1 235 . 1 1 21 21 GLY HA3 H 1 3.865 . . . . . . . . 119 G HA2 . 27064 1 236 . 1 1 21 21 GLY C C 13 174.888 . . . . . . . . 119 G C . 27064 1 237 . 1 1 21 21 GLY CA C 13 45.335 . . . . . . . . 119 G CA . 27064 1 238 . 1 1 21 21 GLY N N 15 114.583 . . . . . . . . 119 G N . 27064 1 239 . 1 1 22 22 GLU H H 1 7.482 . . . . . . . . 120 E HN . 27064 1 240 . 1 1 22 22 GLU HA H 1 4.521 . . . . . . . . 120 E HA . 27064 1 241 . 1 1 22 22 GLU HB2 H 1 2.127 . . . . . . . . 120 E HB1 . 27064 1 242 . 1 1 22 22 GLU HB3 H 1 2.198 . . . . . . . . 120 E HB2 . 27064 1 243 . 1 1 22 22 GLU HG2 H 1 2.204 . . . . . . . . 120 E HG1 . 27064 1 244 . 1 1 22 22 GLU HG3 H 1 2.283 . . . . . . . . 120 E HG2 . 27064 1 245 . 1 1 22 22 GLU C C 13 174.074 . . . . . . . . 120 E C . 27064 1 246 . 1 1 22 22 GLU CA C 13 55.905 . . . . . . . . 120 E CA . 27064 1 247 . 1 1 22 22 GLU CB C 13 29.963 . . . . . . . . 120 E CB . 27064 1 248 . 1 1 22 22 GLU CG C 13 37.391 . . . . . . . . 120 E CG . 27064 1 249 . 1 1 22 22 GLU N N 15 120.937 . . . . . . . . 120 E N . 27064 1 250 . 1 1 23 23 THR H H 1 8.167 . . . . . . . . 121 T HN . 27064 1 251 . 1 1 23 23 THR HA H 1 5.250 . . . . . . . . 121 T HA . 27064 1 252 . 1 1 23 23 THR HB H 1 3.947 . . . . . . . . 121 T HB . 27064 1 253 . 1 1 23 23 THR HG21 H 1 1.014 . . . . . . . . 121 T HG21 . 27064 1 254 . 1 1 23 23 THR HG22 H 1 1.014 . . . . . . . . 121 T HG21 . 27064 1 255 . 1 1 23 23 THR HG23 H 1 1.014 . . . . . . . . 121 T HG21 . 27064 1 256 . 1 1 23 23 THR C C 13 174.763 . . . . . . . . 121 T C . 27064 1 257 . 1 1 23 23 THR CA C 13 61.061 . . . . . . . . 121 T CA . 27064 1 258 . 1 1 23 23 THR CB C 13 70.600 . . . . . . . . 121 T CB . 27064 1 259 . 1 1 23 23 THR CG2 C 13 21.629 . . . . . . . . 121 T CG2 . 27064 1 260 . 1 1 23 23 THR N N 15 114.833 . . . . . . . . 121 T N . 27064 1 261 . 1 1 24 24 ALA H H 1 8.774 . . . . . . . . 122 A HN . 27064 1 262 . 1 1 24 24 ALA HA H 1 4.460 . . . . . . . . 122 A HA . 27064 1 263 . 1 1 24 24 ALA HB1 H 1 1.113 . . . . . . . . 122 A HB1 . 27064 1 264 . 1 1 24 24 ALA HB2 H 1 1.113 . . . . . . . . 122 A HB1 . 27064 1 265 . 1 1 24 24 ALA HB3 H 1 1.113 . . . . . . . . 122 A HB1 . 27064 1 266 . 1 1 24 24 ALA C C 13 175.378 . . . . . . . . 122 A C . 27064 1 267 . 1 1 24 24 ALA CA C 13 50.491 . . . . . . . . 122 A CA . 27064 1 268 . 1 1 24 24 ALA CB C 13 22.142 . . . . . . . . 122 A CB . 27064 1 269 . 1 1 24 24 ALA N N 15 128.728 . . . . . . . . 122 A N . 27064 1 270 . 1 1 25 25 MET H H 1 8.492 . . . . . . . . 123 M HN . 27064 1 271 . 1 1 25 25 MET HA H 1 4.763 . . . . . . . . 123 M HA . 27064 1 272 . 1 1 25 25 MET HB2 H 1 1.655 . . . . . . . . 123 M HB1 . 27064 1 273 . 1 1 25 25 MET HB3 H 1 1.483 . . . . . . . . 123 M HB2 . 27064 1 274 . 1 1 25 25 MET HG2 H 1 1.383 . . . . . . . . 123 M HG1 . 27064 1 275 . 1 1 25 25 MET HG3 H 1 1.497 . . . . . . . . 123 M HG2 . 27064 1 276 . 1 1 25 25 MET HE1 H 1 1.818 . . . . . . . . 123 M HE1 . 27064 1 277 . 1 1 25 25 MET HE2 H 1 1.818 . . . . . . . . 123 M HE1 . 27064 1 278 . 1 1 25 25 MET HE3 H 1 1.818 . . . . . . . . 123 M HE1 . 27064 1 279 . 1 1 25 25 MET C C 13 173.534 . . . . . . . . 123 M C . 27064 1 280 . 1 1 25 25 MET CA C 13 54.614 . . . . . . . . 123 M CA . 27064 1 281 . 1 1 25 25 MET CB C 13 33.991 . . . . . . . . 123 M CB . 27064 1 282 . 1 1 25 25 MET CG C 13 31.103 . . . . . . . . 123 M CG . 27064 1 283 . 1 1 25 25 MET CE C 13 16.789 . . . . . . . . 123 M CE . 27064 1 284 . 1 1 25 25 MET N N 15 121.621 . . . . . . . . 123 M N . 27064 1 285 . 1 1 26 26 LEU H H 1 9.102 . . . . . . . . 124 L HN . 27064 1 286 . 1 1 26 26 LEU HA H 1 4.577 . . . . . . . . 124 L HA . 27064 1 287 . 1 1 26 26 LEU HB2 H 1 1.544 . . . . . . . . 124 L HB1 . 27064 1 288 . 1 1 26 26 LEU HB3 H 1 1.419 . . . . . . . . 124 L HB2 . 27064 1 289 . 1 1 26 26 LEU HG H 1 1.351 . . . . . . . . 124 L HG . 27064 1 290 . 1 1 26 26 LEU HD11 H 1 0.350 . . . . . . . . 124 L HD11 . 27064 1 291 . 1 1 26 26 LEU HD12 H 1 0.350 . . . . . . . . 124 L HD11 . 27064 1 292 . 1 1 26 26 LEU HD13 H 1 0.350 . . . . . . . . 124 L HD11 . 27064 1 293 . 1 1 26 26 LEU HD21 H 1 0.575 . . . . . . . . 124 L HD21 . 27064 1 294 . 1 1 26 26 LEU HD22 H 1 0.575 . . . . . . . . 124 L HD21 . 27064 1 295 . 1 1 26 26 LEU HD23 H 1 0.575 . . . . . . . . 124 L HD21 . 27064 1 296 . 1 1 26 26 LEU C C 13 175.581 . . . . . . . . 124 L C . 27064 1 297 . 1 1 26 26 LEU CA C 13 53.842 . . . . . . . . 124 L CA . 27064 1 298 . 1 1 26 26 LEU CB C 13 41.599 . . . . . . . . 124 L CB . 27064 1 299 . 1 1 26 26 LEU CG C 13 27.804 . . . . . . . . 124 L CG . 27064 1 300 . 1 1 26 26 LEU CD1 C 13 24.960 . . . . . . . . 124 L CD1 . 27064 1 301 . 1 1 26 26 LEU CD2 C 13 23.129 . . . . . . . . 124 L CD2 . 27064 1 302 . 1 1 26 26 LEU N N 15 129.789 . . . . . . . . 124 L N . 27064 1 303 . 1 1 27 27 VAL H H 1 8.547 . . . . . . . . 125 V HN . 27064 1 304 . 1 1 27 27 VAL HA H 1 5.283 . . . . . . . . 125 V HA . 27064 1 305 . 1 1 27 27 VAL HB H 1 1.829 . . . . . . . . 125 V HB . 27064 1 306 . 1 1 27 27 VAL HG11 H 1 0.808 . . . . . . . . 125 V HG11 . 27064 1 307 . 1 1 27 27 VAL HG12 H 1 0.808 . . . . . . . . 125 V HG11 . 27064 1 308 . 1 1 27 27 VAL HG13 H 1 0.808 . . . . . . . . 125 V HG11 . 27064 1 309 . 1 1 27 27 VAL HG21 H 1 0.808 . . . . . . . . 125 V HG21 . 27064 1 310 . 1 1 27 27 VAL HG22 H 1 0.808 . . . . . . . . 125 V HG21 . 27064 1 311 . 1 1 27 27 VAL HG23 H 1 0.808 . . . . . . . . 125 V HG21 . 27064 1 312 . 1 1 27 27 VAL C C 13 175.349 . . . . . . . . 125 V C . 27064 1 313 . 1 1 27 27 VAL CA C 13 61.319 . . . . . . . . 125 V CA . 27064 1 314 . 1 1 27 27 VAL CB C 13 35.796 . . . . . . . . 125 V CB . 27064 1 315 . 1 1 27 27 VAL CG1 C 13 21.882 . . . . . . . . 125 V CG1 . 27064 1 316 . 1 1 27 27 VAL CG2 C 13 21.501 . . . . . . . . 125 V CG2 . 27064 1 317 . 1 1 27 27 VAL N N 15 121.118 . . . . . . . . 125 V N . 27064 1 318 . 1 1 28 28 CYS H H 1 8.975 . . . . . . . . 126 C HN . 27064 1 319 . 1 1 28 28 CYS HA H 1 5.369 . . . . . . . . 126 C HA . 27064 1 320 . 1 1 28 28 CYS HB2 H 1 2.780 . . . . . . . . 126 C HB1 . 27064 1 321 . 1 1 28 28 CYS HB3 H 1 2.670 . . . . . . . . 126 C HB2 . 27064 1 322 . 1 1 28 28 CYS C C 13 171.784 . . . . . . . . 126 C C . 27064 1 323 . 1 1 28 28 CYS CA C 13 53.842 . . . . . . . . 126 C CA . 27064 1 324 . 1 1 28 28 CYS CB C 13 47.913 . . . . . . . . 126 C CB . 27064 1 325 . 1 1 28 28 CYS N N 15 124.370 . . . . . . . . 126 C N . 27064 1 326 . 1 1 29 29 LYS H H 1 9.247 . . . . . . . . 127 K HN . 27064 1 327 . 1 1 29 29 LYS HA H 1 5.369 . . . . . . . . 127 K HA . 27064 1 328 . 1 1 29 29 LYS HB2 H 1 1.862 . . . . . . . . 127 K HB1 . 27064 1 329 . 1 1 29 29 LYS HB3 H 1 1.775 . . . . . . . . 127 K HB2 . 27064 1 330 . 1 1 29 29 LYS HG2 H 1 1.249 . . . . . . . . 127 K HG1 . 27064 1 331 . 1 1 29 29 LYS HG3 H 1 1.362 . . . . . . . . 127 K HG2 . 27064 1 332 . 1 1 29 29 LYS HD2 H 1 1.616 . . . . . . . . 127 K HD1 . 27064 1 333 . 1 1 29 29 LYS HD3 H 1 1.616 . . . . . . . . 127 K HD2 . 27064 1 334 . 1 1 29 29 LYS HE2 H 1 2.886 . . . . . . . . 127 K HE1 . 27064 1 335 . 1 1 29 29 LYS HE3 H 1 2.886 . . . . . . . . 127 K HE2 . 27064 1 336 . 1 1 29 29 LYS C C 13 175.483 . . . . . . . . 127 K C . 27064 1 337 . 1 1 29 29 LYS CA C 13 54.616 . . . . . . . . 127 K CA . 27064 1 338 . 1 1 29 29 LYS CB C 13 37.343 . . . . . . . . 127 K CB . 27064 1 339 . 1 1 29 29 LYS CG C 13 24.452 . . . . . . . . 127 K CG . 27064 1 340 . 1 1 29 29 LYS CD C 13 29.616 . . . . . . . . 127 K CD . 27064 1 341 . 1 1 29 29 LYS CE C 13 41.943 . . . . . . . . 127 K CE . 27064 1 342 . 1 1 29 29 LYS N N 15 117.820 . . . . . . . . 127 K N . 27064 1 343 . 1 1 30 30 SER H H 1 8.721 . . . . . . . . 128 S HN . 27064 1 344 . 1 1 30 30 SER HA H 1 4.974 . . . . . . . . 128 S HA . 27064 1 345 . 1 1 30 30 SER HB2 H 1 3.632 . . . . . . . . 128 S HB1 . 27064 1 346 . 1 1 30 30 SER HB3 H 1 3.948 . . . . . . . . 128 S HB2 . 27064 1 347 . 1 1 30 30 SER C C 13 170.762 . . . . . . . . 128 S C . 27064 1 348 . 1 1 30 30 SER CA C 13 57.841 . . . . . . . . 128 S CA . 27064 1 349 . 1 1 30 30 SER CB C 13 66.475 . . . . . . . . 128 S CB . 27064 1 350 . 1 1 30 30 SER N N 15 112.859 . . . . . . . . 128 S N . 27064 1 351 . 1 1 31 31 GLU HA H 1 4.777 . . . . . . . . 129 E HA . 27064 1 352 . 1 1 31 31 GLU HB2 H 1 2.303 . . . . . . . . 129 E HB1 . 27064 1 353 . 1 1 31 31 GLU HB3 H 1 1.879 . . . . . . . . 129 E HB2 . 27064 1 354 . 1 1 31 31 GLU HG2 H 1 2.301 . . . . . . . . 129 E HG1 . 27064 1 355 . 1 1 31 31 GLU HG3 H 1 2.225 . . . . . . . . 129 E HG2 . 27064 1 356 . 1 1 31 31 GLU C C 13 175.744 . . . . . . . . 129 E C . 27064 1 357 . 1 1 31 31 GLU CA C 13 55.283 . . . . . . . . 129 E CA . 27064 1 358 . 1 1 31 31 GLU CB C 13 29.913 . . . . . . . . 129 E CB . 27064 1 359 . 1 1 31 31 GLU CG C 13 36.312 . . . . . . . . 129 E CG . 27064 1 360 . 1 1 32 32 SER H H 1 8.305 . . . . . . . . 130 S HN . 27064 1 361 . 1 1 32 32 SER HA H 1 4.322 . . . . . . . . 130 S HA . 27064 1 362 . 1 1 32 32 SER HB2 H 1 3.908 . . . . . . . . 130 S HB1 . 27064 1 363 . 1 1 32 32 SER HB3 H 1 3.496 . . . . . . . . 130 S HB2 . 27064 1 364 . 1 1 32 32 SER C C 13 171.758 . . . . . . . . 130 S C . 27064 1 365 . 1 1 32 32 SER CA C 13 60.335 . . . . . . . . 130 S CA . 27064 1 366 . 1 1 32 32 SER CB C 13 64.539 . . . . . . . . 130 S CB . 27064 1 367 . 1 1 32 32 SER N N 15 118.154 . . . . . . . . 130 S N . 27064 1 368 . 1 1 33 33 VAL H H 1 8.110 . . . . . . . . 131 V HN . 27064 1 369 . 1 1 33 33 VAL HA H 1 3.746 . . . . . . . . 131 V HA . 27064 1 370 . 1 1 33 33 VAL HB H 1 1.762 . . . . . . . . 131 V HB . 27064 1 371 . 1 1 33 33 VAL HG11 H 1 0.808 . . . . . . . . 131 V HG11 . 27064 1 372 . 1 1 33 33 VAL HG12 H 1 0.808 . . . . . . . . 131 V HG11 . 27064 1 373 . 1 1 33 33 VAL HG13 H 1 0.808 . . . . . . . . 131 V HG11 . 27064 1 374 . 1 1 33 33 VAL HG21 H 1 0.750 . . . . . . . . 131 V HG21 . 27064 1 375 . 1 1 33 33 VAL HG22 H 1 0.750 . . . . . . . . 131 V HG21 . 27064 1 376 . 1 1 33 33 VAL HG23 H 1 0.750 . . . . . . . . 131 V HG21 . 27064 1 377 . 1 1 33 33 VAL CA C 13 60.046 . . . . . . . . 131 V CA . 27064 1 378 . 1 1 33 33 VAL CB C 13 35.280 . . . . . . . . 131 V CB . 27064 1 379 . 1 1 33 33 VAL CG1 C 13 20.536 . . . . . . . . 131 V CG1 . 27064 1 380 . 1 1 33 33 VAL CG2 C 13 20.766 . . . . . . . . 131 V CG2 . 27064 1 381 . 1 1 33 33 VAL N N 15 122.139 . . . . . . . . 131 V N . 27064 1 382 . 1 1 34 34 PRO HA H 1 4.694 . . . . . . . . 132 P HA . 27064 1 383 . 1 1 34 34 PRO HB2 H 1 2.237 . . . . . . . . 132 P HB1 . 27064 1 384 . 1 1 34 34 PRO HB3 H 1 2.412 . . . . . . . . 132 P HB2 . 27064 1 385 . 1 1 34 34 PRO HG2 H 1 1.640 . . . . . . . . 132 P HG1 . 27064 1 386 . 1 1 34 34 PRO HG3 H 1 1.839 . . . . . . . . 132 P HG2 . 27064 1 387 . 1 1 34 34 PRO HD2 H 1 3.153 . . . . . . . . 132 P HD1 . 27064 1 388 . 1 1 34 34 PRO HD3 H 1 3.692 . . . . . . . . 132 P HD2 . 27064 1 389 . 1 1 34 34 PRO CA C 13 61.535 . . . . . . . . 132 P CA . 27064 1 390 . 1 1 34 34 PRO CB C 13 33.185 . . . . . . . . 132 P CB . 27064 1 391 . 1 1 34 34 PRO CG C 13 25.481 . . . . . . . . 132 P CG . 27064 1 392 . 1 1 34 34 PRO CD C 13 49.975 . . . . . . . . 132 P CD . 27064 1 393 . 1 1 35 35 PRO HA H 1 4.479 . . . . . . . . 133 P HA . 27064 1 394 . 1 1 35 35 PRO HB2 H 1 1.602 . . . . . . . . 133 P HB1 . 27064 1 395 . 1 1 35 35 PRO HB3 H 1 2.246 . . . . . . . . 133 P HB2 . 27064 1 396 . 1 1 35 35 PRO HG2 H 1 1.922 . . . . . . . . 133 P HG1 . 27064 1 397 . 1 1 35 35 PRO HG3 H 1 2.035 . . . . . . . . 133 P HG2 . 27064 1 398 . 1 1 35 35 PRO HD2 H 1 3.646 . . . . . . . . 133 P HD1 . 27064 1 399 . 1 1 35 35 PRO HD3 H 1 3.718 . . . . . . . . 133 P HD2 . 27064 1 400 . 1 1 35 35 PRO C C 13 177.080 . . . . . . . . 133 P C . 27064 1 401 . 1 1 35 35 PRO CA C 13 62.091 . . . . . . . . 133 P CA . 27064 1 402 . 1 1 35 35 PRO CB C 13 32.396 . . . . . . . . 133 P CB . 27064 1 403 . 1 1 35 35 PRO CG C 13 27.546 . . . . . . . . 133 P CG . 27064 1 404 . 1 1 35 35 PRO CD C 13 50.501 . . . . . . . . 133 P CD . 27064 1 405 . 1 1 36 36 VAL H H 1 8.339 . . . . . . . . 134 V HN . 27064 1 406 . 1 1 36 36 VAL HA H 1 3.293 . . . . . . . . 134 V HA . 27064 1 407 . 1 1 36 36 VAL HB H 1 1.571 . . . . . . . . 134 V HB . 27064 1 408 . 1 1 36 36 VAL HG11 H 1 0.503 . . . . . . . . 134 V HG11 . 27064 1 409 . 1 1 36 36 VAL HG12 H 1 0.503 . . . . . . . . 134 V HG11 . 27064 1 410 . 1 1 36 36 VAL HG13 H 1 0.503 . . . . . . . . 134 V HG11 . 27064 1 411 . 1 1 36 36 VAL HG21 H 1 -0.446 . . . . . . . . 134 V HG21 . 27064 1 412 . 1 1 36 36 VAL HG22 H 1 -0.446 . . . . . . . . 134 V HG21 . 27064 1 413 . 1 1 36 36 VAL HG23 H 1 -0.446 . . . . . . . . 134 V HG21 . 27064 1 414 . 1 1 36 36 VAL C C 13 176.096 . . . . . . . . 134 V C . 27064 1 415 . 1 1 36 36 VAL CA C 13 63.757 . . . . . . . . 134 V CA . 27064 1 416 . 1 1 36 36 VAL CB C 13 31.624 . . . . . . . . 134 V CB . 27064 1 417 . 1 1 36 36 VAL CG1 C 13 22.840 . . . . . . . . 134 V CG1 . 27064 1 418 . 1 1 36 36 VAL CG2 C 13 20.327 . . . . . . . . 134 V CG2 . 27064 1 419 . 1 1 36 36 VAL N N 15 121.019 . . . . . . . . 134 V N . 27064 1 420 . 1 1 37 37 THR H H 1 7.932 . . . . . . . . 135 T HN . 27064 1 421 . 1 1 37 37 THR HA H 1 4.470 . . . . . . . . 135 T HA . 27064 1 422 . 1 1 37 37 THR HB H 1 4.345 . . . . . . . . 135 T HB . 27064 1 423 . 1 1 37 37 THR HG21 H 1 1.162 . . . . . . . . 135 T HG21 . 27064 1 424 . 1 1 37 37 THR HG22 H 1 1.162 . . . . . . . . 135 T HG21 . 27064 1 425 . 1 1 37 37 THR HG23 H 1 1.162 . . . . . . . . 135 T HG21 . 27064 1 426 . 1 1 37 37 THR C C 13 173.906 . . . . . . . . 135 T C . 27064 1 427 . 1 1 37 37 THR CA C 13 61.721 . . . . . . . . 135 T CA . 27064 1 428 . 1 1 37 37 THR CB C 13 69.947 . . . . . . . . 135 T CB . 27064 1 429 . 1 1 37 37 THR CG2 C 13 21.359 . . . . . . . . 135 T CG2 . 27064 1 430 . 1 1 37 37 THR N N 15 117.758 . . . . . . . . 135 T N . 27064 1 431 . 1 1 38 38 ASP H H 1 7.380 . . . . . . . . 136 D HN . 27064 1 432 . 1 1 38 38 ASP HA H 1 5.099 . . . . . . . . 136 D HA . 27064 1 433 . 1 1 38 38 ASP HB2 H 1 2.389 . . . . . . . . 136 D HB1 . 27064 1 434 . 1 1 38 38 ASP HB3 H 1 2.527 . . . . . . . . 136 D HB2 . 27064 1 435 . 1 1 38 38 ASP C C 13 173.660 . . . . . . . . 136 D C . 27064 1 436 . 1 1 38 38 ASP CA C 13 53.585 . . . . . . . . 136 D CA . 27064 1 437 . 1 1 38 38 ASP CB C 13 43.307 . . . . . . . . 136 D CB . 27064 1 438 . 1 1 38 38 ASP N N 15 124.439 . . . . . . . . 136 D N . 27064 1 439 . 1 1 39 39 TRP H H 1 8.794 . . . . . . . . 137 W HN . 27064 1 440 . 1 1 39 39 TRP HA H 1 5.632 . . . . . . . . 137 W HA . 27064 1 441 . 1 1 39 39 TRP HB2 H 1 3.057 . . . . . . . . 137 W HB1 . 27064 1 442 . 1 1 39 39 TRP HB3 H 1 2.972 . . . . . . . . 137 W HB2 . 27064 1 443 . 1 1 39 39 TRP HD1 H 1 7.073 . . . . . . . . 137 W HD1 . 27064 1 444 . 1 1 39 39 TRP HE1 H 1 9.161 . . . . . . . . 137 W HE1 . 27064 1 445 . 1 1 39 39 TRP HE3 H 1 7.073 . . . . . . . . 137 W HE3 . 27064 1 446 . 1 1 39 39 TRP HZ2 H 1 6.767 . . . . . . . . 137 W HZ2 . 27064 1 447 . 1 1 39 39 TRP HZ3 H 1 6.663 . . . . . . . . 137 W HZ3 . 27064 1 448 . 1 1 39 39 TRP HH2 H 1 6.468 . . . . . . . . 137 W HH2 . 27064 1 449 . 1 1 39 39 TRP C C 13 175.792 . . . . . . . . 137 W C . 27064 1 450 . 1 1 39 39 TRP CA C 13 55.573 . . . . . . . . 137 W CA . 27064 1 451 . 1 1 39 39 TRP CB C 13 33.689 . . . . . . . . 137 W CB . 27064 1 452 . 1 1 39 39 TRP CD1 C 13 127.477 . . . . . . . . 137 W CD1 . 27064 1 453 . 1 1 39 39 TRP CE3 C 13 120.514 . . . . . . . . 137 W CE3 . 27064 1 454 . 1 1 39 39 TRP CZ2 C 13 113.551 . . . . . . . . 137 W CZ2 . 27064 1 455 . 1 1 39 39 TRP CZ3 C 13 121.569 . . . . . . . . 137 W CZ3 . 27064 1 456 . 1 1 39 39 TRP CH2 C 13 122.624 . . . . . . . . 137 W CH2 . 27064 1 457 . 1 1 39 39 TRP N N 15 124.720 . . . . . . . . 137 W N . 27064 1 458 . 1 1 39 39 TRP NE1 N 15 128.500 . . . . . . . . 137 W NE1 . 27064 1 459 . 1 1 40 40 ALA H H 1 9.058 . . . . . . . . 138 A HN . 27064 1 460 . 1 1 40 40 ALA HA H 1 4.724 . . . . . . . . 138 A HA . 27064 1 461 . 1 1 40 40 ALA HB1 H 1 1.441 . . . . . . . . 138 A HB1 . 27064 1 462 . 1 1 40 40 ALA HB2 H 1 1.441 . . . . . . . . 138 A HB1 . 27064 1 463 . 1 1 40 40 ALA HB3 H 1 1.441 . . . . . . . . 138 A HB1 . 27064 1 464 . 1 1 40 40 ALA C C 13 174.615 . . . . . . . . 138 A C . 27064 1 465 . 1 1 40 40 ALA CA C 13 51.804 . . . . . . . . 138 A CA . 27064 1 466 . 1 1 40 40 ALA CB C 13 23.421 . . . . . . . . 138 A CB . 27064 1 467 . 1 1 40 40 ALA N N 15 125.899 . . . . . . . . 138 A N . 27064 1 468 . 1 1 41 41 TRP H H 1 8.757 . . . . . . . . 139 W HN . 27064 1 469 . 1 1 41 41 TRP HA H 1 5.634 . . . . . . . . 139 W HA . 27064 1 470 . 1 1 41 41 TRP HB2 H 1 2.882 . . . . . . . . 139 W HB1 . 27064 1 471 . 1 1 41 41 TRP HB3 H 1 3.118 . . . . . . . . 139 W HB2 . 27064 1 472 . 1 1 41 41 TRP HD1 H 1 6.909 . . . . . . . . 139 W HD1 . 27064 1 473 . 1 1 41 41 TRP HE1 H 1 10.100 . . . . . . . . 139 W HE1 . 27064 1 474 . 1 1 41 41 TRP HZ2 H 1 7.145 . . . . . . . . 139 W HZ2 . 27064 1 475 . 1 1 41 41 TRP HH2 H 1 6.707 . . . . . . . . 139 W HH2 . 27064 1 476 . 1 1 41 41 TRP C C 13 176.149 . . . . . . . . 139 W C . 27064 1 477 . 1 1 41 41 TRP CA C 13 56.419 . . . . . . . . 139 W CA . 27064 1 478 . 1 1 41 41 TRP CB C 13 33.331 . . . . . . . . 139 W CB . 27064 1 479 . 1 1 41 41 TRP CD1 C 13 126.000 . . . . . . . . 139 W CD1 . 27064 1 480 . 1 1 41 41 TRP CZ2 C 13 114.184 . . . . . . . . 139 W CZ2 . 27064 1 481 . 1 1 41 41 TRP CH2 C 13 126.633 . . . . . . . . 139 W CH2 . 27064 1 482 . 1 1 41 41 TRP N N 15 121.225 . . . . . . . . 139 W N . 27064 1 483 . 1 1 41 41 TRP NE1 N 15 129.138 . . . . . . . . 139 W NE1 . 27064 1 484 . 1 1 42 42 TYR H H 1 9.415 . . . . . . . . 140 Y HN . 27064 1 485 . 1 1 42 42 TYR HA H 1 5.411 . . . . . . . . 140 Y HA . 27064 1 486 . 1 1 42 42 TYR HB2 H 1 2.485 . . . . . . . . 140 Y HB1 . 27064 1 487 . 1 1 42 42 TYR HB3 H 1 2.597 . . . . . . . . 140 Y HB2 . 27064 1 488 . 1 1 42 42 TYR HD1 H 1 6.739 . . . . . . . . 140 Y HD1 . 27064 1 489 . 1 1 42 42 TYR HE1 H 1 6.647 . . . . . . . . 140 Y HE1 . 27064 1 490 . 1 1 42 42 TYR C C 13 175.057 . . . . . . . . 140 Y C . 27064 1 491 . 1 1 42 42 TYR CA C 13 56.163 . . . . . . . . 140 Y CA . 27064 1 492 . 1 1 42 42 TYR CB C 13 43.364 . . . . . . . . 140 Y CB . 27064 1 493 . 1 1 42 42 TYR CD1 C 13 132.963 . . . . . . . . 140 Y CD1 . 27064 1 494 . 1 1 42 42 TYR CE1 C 13 118.404 . . . . . . . . 140 Y CE1 . 27064 1 495 . 1 1 42 42 TYR N N 15 118.029 . . . . . . . . 140 Y N . 27064 1 496 . 1 1 43 43 LYS H H 1 9.327 . . . . . . . . 141 K HN . 27064 1 497 . 1 1 43 43 LYS HA H 1 4.537 . . . . . . . . 141 K HA . 27064 1 498 . 1 1 43 43 LYS HB2 H 1 1.769 . . . . . . . . 141 K HB1 . 27064 1 499 . 1 1 43 43 LYS HB3 H 1 1.400 . . . . . . . . 141 K HB2 . 27064 1 500 . 1 1 43 43 LYS HG2 H 1 0.638 . . . . . . . . 141 K HG1 . 27064 1 501 . 1 1 43 43 LYS HG3 H 1 1.186 . . . . . . . . 141 K HG2 . 27064 1 502 . 1 1 43 43 LYS HD2 H 1 1.300 . . . . . . . . 141 K HD1 . 27064 1 503 . 1 1 43 43 LYS HD3 H 1 1.394 . . . . . . . . 141 K HD2 . 27064 1 504 . 1 1 43 43 LYS HE2 H 1 2.789 . . . . . . . . 141 K HE1 . 27064 1 505 . 1 1 43 43 LYS HE3 H 1 2.856 . . . . . . . . 141 K HE2 . 27064 1 506 . 1 1 43 43 LYS C C 13 175.622 . . . . . . . . 141 K C . 27064 1 507 . 1 1 43 43 LYS CA C 13 54.910 . . . . . . . . 141 K CA . 27064 1 508 . 1 1 43 43 LYS CB C 13 35.487 . . . . . . . . 141 K CB . 27064 1 509 . 1 1 43 43 LYS CG C 13 25.226 . . . . . . . . 141 K CG . 27064 1 510 . 1 1 43 43 LYS CD C 13 29.093 . . . . . . . . 141 K CD . 27064 1 511 . 1 1 43 43 LYS CE C 13 43.371 . . . . . . . . 141 K CE . 27064 1 512 . 1 1 43 43 LYS N N 15 123.604 . . . . . . . . 141 K N . 27064 1 513 . 1 1 44 44 ILE H H 1 8.442 . . . . . . . . 142 I HN . 27064 1 514 . 1 1 44 44 ILE HA H 1 4.267 . . . . . . . . 142 I HA . 27064 1 515 . 1 1 44 44 ILE HB H 1 1.790 . . . . . . . . 142 I HB . 27064 1 516 . 1 1 44 44 ILE HG12 H 1 1.045 . . . . . . . . 142 I HG11 . 27064 1 517 . 1 1 44 44 ILE HG13 H 1 1.297 . . . . . . . . 142 I HG12 . 27064 1 518 . 1 1 44 44 ILE HG21 H 1 0.850 . . . . . . . . 142 I HG21 . 27064 1 519 . 1 1 44 44 ILE HG22 H 1 0.850 . . . . . . . . 142 I HG21 . 27064 1 520 . 1 1 44 44 ILE HG23 H 1 0.850 . . . . . . . . 142 I HG21 . 27064 1 521 . 1 1 44 44 ILE HD11 H 1 0.663 . . . . . . . . 142 I HD11 . 27064 1 522 . 1 1 44 44 ILE HD12 H 1 0.663 . . . . . . . . 142 I HD11 . 27064 1 523 . 1 1 44 44 ILE HD13 H 1 0.663 . . . . . . . . 142 I HD11 . 27064 1 524 . 1 1 44 44 ILE C C 13 176.606 . . . . . . . . 142 I C . 27064 1 525 . 1 1 44 44 ILE CA C 13 61.577 . . . . . . . . 142 I CA . 27064 1 526 . 1 1 44 44 ILE CB C 13 37.343 . . . . . . . . 142 I CB . 27064 1 527 . 1 1 44 44 ILE CG1 C 13 27.544 . . . . . . . . 142 I CG1 . 27064 1 528 . 1 1 44 44 ILE CG2 C 13 17.384 . . . . . . . . 142 I CG2 . 27064 1 529 . 1 1 44 44 ILE CD1 C 13 13.136 . . . . . . . . 142 I CD1 . 27064 1 530 . 1 1 44 44 ILE N N 15 129.450 . . . . . . . . 142 I N . 27064 1 531 . 1 1 45 45 THR H H 1 8.616 . . . . . . . . 143 T HN . 27064 1 532 . 1 1 45 45 THR HA H 1 4.900 . . . . . . . . 143 T HA . 27064 1 533 . 1 1 45 45 THR HB H 1 4.540 . . . . . . . . 143 T HB . 27064 1 534 . 1 1 45 45 THR HG21 H 1 1.234 . . . . . . . . 143 T HG21 . 27064 1 535 . 1 1 45 45 THR HG22 H 1 1.234 . . . . . . . . 143 T HG21 . 27064 1 536 . 1 1 45 45 THR HG23 H 1 1.234 . . . . . . . . 143 T HG21 . 27064 1 537 . 1 1 45 45 THR C C 13 173.996 . . . . . . . . 143 T C . 27064 1 538 . 1 1 45 45 THR CA C 13 60.158 . . . . . . . . 143 T CA . 27064 1 539 . 1 1 45 45 THR CB C 13 71.464 . . . . . . . . 143 T CB . 27064 1 540 . 1 1 45 45 THR CG2 C 13 21.087 . . . . . . . . 143 T CG2 . 27064 1 541 . 1 1 45 45 THR N N 15 121.185 . . . . . . . . 143 T N . 27064 1 542 . 1 1 46 46 ASP H H 1 8.594 . . . . . . . . 144 D HN . 27064 1 543 . 1 1 46 46 ASP HA H 1 4.406 . . . . . . . . 144 D HA . 27064 1 544 . 1 1 46 46 ASP HB2 H 1 2.732 . . . . . . . . 144 D HB1 . 27064 1 545 . 1 1 46 46 ASP HB3 H 1 2.711 . . . . . . . . 144 D HB2 . 27064 1 546 . 1 1 46 46 ASP C C 13 176.783 . . . . . . . . 144 D C . 27064 1 547 . 1 1 46 46 ASP CA C 13 56.101 . . . . . . . . 144 D CA . 27064 1 548 . 1 1 46 46 ASP CB C 13 40.477 . . . . . . . . 144 D CB . 27064 1 549 . 1 1 46 46 ASP N N 15 119.205 . . . . . . . . 144 D N . 27064 1 550 . 1 1 47 47 SER H H 1 8.261 . . . . . . . . 145 S HN . 27064 1 551 . 1 1 47 47 SER HA H 1 4.482 . . . . . . . . 145 S HA . 27064 1 552 . 1 1 47 47 SER HB2 H 1 3.793 . . . . . . . . 145 S HB1 . 27064 1 553 . 1 1 47 47 SER HB3 H 1 3.898 . . . . . . . . 145 S HB2 . 27064 1 554 . 1 1 47 47 SER C C 13 173.926 . . . . . . . . 145 S C . 27064 1 555 . 1 1 47 47 SER CA C 13 57.967 . . . . . . . . 145 S CA . 27064 1 556 . 1 1 47 47 SER CB C 13 63.975 . . . . . . . . 145 S CB . 27064 1 557 . 1 1 47 47 SER N N 15 113.283 . . . . . . . . 145 S N . 27064 1 558 . 1 1 48 48 GLU H H 1 7.714 . . . . . . . . 146 E HN . 27064 1 559 . 1 1 48 48 GLU HA H 1 4.451 . . . . . . . . 146 E HA . 27064 1 560 . 1 1 48 48 GLU HB2 H 1 1.917 . . . . . . . . 146 E HB1 . 27064 1 561 . 1 1 48 48 GLU HB3 H 1 2.060 . . . . . . . . 146 E HB2 . 27064 1 562 . 1 1 48 48 GLU HG2 H 1 2.110 . . . . . . . . 146 E HG1 . 27064 1 563 . 1 1 48 48 GLU HG3 H 1 2.110 . . . . . . . . 146 E HG2 . 27064 1 564 . 1 1 48 48 GLU C C 13 175.381 . . . . . . . . 146 E C . 27064 1 565 . 1 1 48 48 GLU CA C 13 55.977 . . . . . . . . 146 E CA . 27064 1 566 . 1 1 48 48 GLU CB C 13 31.742 . . . . . . . . 146 E CB . 27064 1 567 . 1 1 48 48 GLU CG C 13 35.550 . . . . . . . . 146 E CG . 27064 1 568 . 1 1 48 48 GLU N N 15 121.452 . . . . . . . . 146 E N . 27064 1 569 . 1 1 49 49 ASP H H 1 8.758 . . . . . . . . 147 D HN . 27064 1 570 . 1 1 49 49 ASP HA H 1 4.922 . . . . . . . . 147 D HA . 27064 1 571 . 1 1 49 49 ASP HB2 H 1 2.442 . . . . . . . . 147 D HB1 . 27064 1 572 . 1 1 49 49 ASP HB3 H 1 2.195 . . . . . . . . 147 D HB2 . 27064 1 573 . 1 1 49 49 ASP C C 13 173.691 . . . . . . . . 147 D C . 27064 1 574 . 1 1 49 49 ASP CA C 13 54.122 . . . . . . . . 147 D CA . 27064 1 575 . 1 1 49 49 ASP CB C 13 40.436 . . . . . . . . 147 D CB . 27064 1 576 . 1 1 49 49 ASP N N 15 126.540 . . . . . . . . 147 D N . 27064 1 577 . 1 1 50 50 LYS H H 1 9.058 . . . . . . . . 148 K HN . 27064 1 578 . 1 1 50 50 LYS HA H 1 4.532 . . . . . . . . 148 K HA . 27064 1 579 . 1 1 50 50 LYS HB2 H 1 1.758 . . . . . . . . 148 K HB1 . 27064 1 580 . 1 1 50 50 LYS HB3 H 1 1.887 . . . . . . . . 148 K HB2 . 27064 1 581 . 1 1 50 50 LYS HG2 H 1 1.410 . . . . . . . . 148 K HG1 . 27064 1 582 . 1 1 50 50 LYS HG3 H 1 1.239 . . . . . . . . 148 K HG2 . 27064 1 583 . 1 1 50 50 LYS HD2 H 1 1.553 . . . . . . . . 148 K HD1 . 27064 1 584 . 1 1 50 50 LYS HD3 H 1 1.671 . . . . . . . . 148 K HD2 . 27064 1 585 . 1 1 50 50 LYS HE2 H 1 2.883 . . . . . . . . 148 K HE1 . 27064 1 586 . 1 1 50 50 LYS HE3 H 1 3.089 . . . . . . . . 148 K HE2 . 27064 1 587 . 1 1 50 50 LYS C C 13 175.541 . . . . . . . . 148 K C . 27064 1 588 . 1 1 50 50 LYS CA C 13 55.389 . . . . . . . . 148 K CA . 27064 1 589 . 1 1 50 50 LYS CB C 13 34.249 . . . . . . . . 148 K CB . 27064 1 590 . 1 1 50 50 LYS CG C 13 24.719 . . . . . . . . 148 K CG . 27064 1 591 . 1 1 50 50 LYS CD C 13 29.521 . . . . . . . . 148 K CD . 27064 1 592 . 1 1 50 50 LYS CE C 13 42.130 . . . . . . . . 148 K CE . 27064 1 593 . 1 1 50 50 LYS N N 15 125.938 . . . . . . . . 148 K N . 27064 1 594 . 1 1 51 51 ALA H H 1 8.894 . . . . . . . . 149 A HN . 27064 1 595 . 1 1 51 51 ALA HA H 1 4.022 . . . . . . . . 149 A HA . 27064 1 596 . 1 1 51 51 ALA HB1 H 1 1.346 . . . . . . . . 149 A HB1 . 27064 1 597 . 1 1 51 51 ALA HB2 H 1 1.346 . . . . . . . . 149 A HB1 . 27064 1 598 . 1 1 51 51 ALA HB3 H 1 1.346 . . . . . . . . 149 A HB1 . 27064 1 599 . 1 1 51 51 ALA C C 13 177.276 . . . . . . . . 149 A C . 27064 1 600 . 1 1 51 51 ALA CA C 13 53.146 . . . . . . . . 149 A CA . 27064 1 601 . 1 1 51 51 ALA CB C 13 18.686 . . . . . . . . 149 A CB . 27064 1 602 . 1 1 51 51 ALA N N 15 131.078 . . . . . . . . 149 A N . 27064 1 603 . 1 1 52 52 LEU H H 1 8.033 . . . . . . . . 150 L HN . 27064 1 604 . 1 1 52 52 LEU HA H 1 4.314 . . . . . . . . 150 L HA . 27064 1 605 . 1 1 52 52 LEU HB2 H 1 0.699 . . . . . . . . 150 L HB1 . 27064 1 606 . 1 1 52 52 LEU HB3 H 1 1.555 . . . . . . . . 150 L HB2 . 27064 1 607 . 1 1 52 52 LEU HG H 1 1.577 . . . . . . . . 150 L HG . 27064 1 608 . 1 1 52 52 LEU HD11 H 1 0.859 . . . . . . . . 150 L HD11 . 27064 1 609 . 1 1 52 52 LEU HD12 H 1 0.859 . . . . . . . . 150 L HD11 . 27064 1 610 . 1 1 52 52 LEU HD13 H 1 0.859 . . . . . . . . 150 L HD11 . 27064 1 611 . 1 1 52 52 LEU HD21 H 1 0.191 . . . . . . . . 150 L HD21 . 27064 1 612 . 1 1 52 52 LEU HD22 H 1 0.191 . . . . . . . . 150 L HD21 . 27064 1 613 . 1 1 52 52 LEU HD23 H 1 0.191 . . . . . . . . 150 L HD21 . 27064 1 614 . 1 1 52 52 LEU C C 13 174.885 . . . . . . . . 150 L C . 27064 1 615 . 1 1 52 52 LEU CA C 13 53.127 . . . . . . . . 150 L CA . 27064 1 616 . 1 1 52 52 LEU CB C 13 41.417 . . . . . . . . 150 L CB . 27064 1 617 . 1 1 52 52 LEU CG C 13 25.999 . . . . . . . . 150 L CG . 27064 1 618 . 1 1 52 52 LEU CD1 C 13 27.288 . . . . . . . . 150 L CD1 . 27064 1 619 . 1 1 52 52 LEU CD2 C 13 21.865 . . . . . . . . 150 L CD2 . 27064 1 620 . 1 1 52 52 LEU N N 15 125.474 . . . . . . . . 150 L N . 27064 1 621 . 1 1 53 53 MET H H 1 7.936 . . . . . . . . 151 M HN . 27064 1 622 . 1 1 53 53 MET HA H 1 4.611 . . . . . . . . 151 M HA . 27064 1 623 . 1 1 53 53 MET HB2 H 1 1.938 . . . . . . . . 151 M HB1 . 27064 1 624 . 1 1 53 53 MET HB3 H 1 2.090 . . . . . . . . 151 M HB2 . 27064 1 625 . 1 1 53 53 MET HG2 H 1 2.468 . . . . . . . . 151 M HG1 . 27064 1 626 . 1 1 53 53 MET HG3 H 1 2.578 . . . . . . . . 151 M HG2 . 27064 1 627 . 1 1 53 53 MET C C 13 176.184 . . . . . . . . 151 M C . 27064 1 628 . 1 1 53 53 MET CA C 13 53.842 . . . . . . . . 151 M CA . 27064 1 629 . 1 1 53 53 MET CB C 13 33.930 . . . . . . . . 151 M CB . 27064 1 630 . 1 1 53 53 MET CG C 13 32.155 . . . . . . . . 151 M CG . 27064 1 631 . 1 1 53 53 MET N N 15 120.630 . . . . . . . . 151 M N . 27064 1 632 . 1 1 54 54 ASN H H 1 8.869 . . . . . . . . 152 N HN . 27064 1 633 . 1 1 54 54 ASN HA H 1 4.458 . . . . . . . . 152 N HA . 27064 1 634 . 1 1 54 54 ASN HB2 H 1 2.820 . . . . . . . . 152 N HB1 . 27064 1 635 . 1 1 54 54 ASN HB3 H 1 2.904 . . . . . . . . 152 N HB2 . 27064 1 636 . 1 1 54 54 ASN HD21 H 1 7.819 . . . . . . . . 152 N HD21 . 27064 1 637 . 1 1 54 54 ASN HD22 H 1 7.244 . . . . . . . . 152 N HD22 . 27064 1 638 . 1 1 54 54 ASN C C 13 176.273 . . . . . . . . 152 N C . 27064 1 639 . 1 1 54 54 ASN CA C 13 55.647 . . . . . . . . 152 N CA . 27064 1 640 . 1 1 54 54 ASN CB C 13 39.147 . . . . . . . . 152 N CB . 27064 1 641 . 1 1 54 54 ASN N N 15 120.348 . . . . . . . . 152 N N . 27064 1 642 . 1 1 54 54 ASN ND2 N 15 114.462 . . . . . . . . 152 N ND2 . 27064 1 643 . 1 1 55 55 GLY H H 1 9.203 . . . . . . . . 153 G HN . 27064 1 644 . 1 1 55 55 GLY HA2 H 1 3.503 . . . . . . . . 153 G HA1 . 27064 1 645 . 1 1 55 55 GLY HA3 H 1 4.289 . . . . . . . . 153 G HA2 . 27064 1 646 . 1 1 55 55 GLY C C 13 175.167 . . . . . . . . 153 G C . 27064 1 647 . 1 1 55 55 GLY CA C 13 45.335 . . . . . . . . 153 G CA . 27064 1 648 . 1 1 55 55 GLY N N 15 115.510 . . . . . . . . 153 G N . 27064 1 649 . 1 1 56 56 SER H H 1 8.242 . . . . . . . . 154 S HN . 27064 1 650 . 1 1 56 56 SER HA H 1 4.266 . . . . . . . . 154 S HA . 27064 1 651 . 1 1 56 56 SER HB2 H 1 3.905 . . . . . . . . 154 S HB1 . 27064 1 652 . 1 1 56 56 SER HB3 H 1 4.002 . . . . . . . . 154 S HB2 . 27064 1 653 . 1 1 56 56 SER C C 13 175.670 . . . . . . . . 154 S C . 27064 1 654 . 1 1 56 56 SER CA C 13 60.771 . . . . . . . . 154 S CA . 27064 1 655 . 1 1 56 56 SER CB C 13 63.295 . . . . . . . . 154 S CB . 27064 1 656 . 1 1 56 56 SER N N 15 119.045 . . . . . . . . 154 S N . 27064 1 657 . 1 1 57 57 GLU H H 1 9.078 . . . . . . . . 155 E HN . 27064 1 658 . 1 1 57 57 GLU HA H 1 4.194 . . . . . . . . 155 E HA . 27064 1 659 . 1 1 57 57 GLU HB2 H 1 2.145 . . . . . . . . 155 E HB1 . 27064 1 660 . 1 1 57 57 GLU HB3 H 1 2.358 . . . . . . . . 155 E HB2 . 27064 1 661 . 1 1 57 57 GLU HG2 H 1 2.289 . . . . . . . . 155 E HG1 . 27064 1 662 . 1 1 57 57 GLU HG3 H 1 2.289 . . . . . . . . 155 E HG2 . 27064 1 663 . 1 1 57 57 GLU CA C 13 57.305 . . . . . . . . 155 E CA . 27064 1 664 . 1 1 57 57 GLU CB C 13 29.314 . . . . . . . . 155 E CB . 27064 1 665 . 1 1 57 57 GLU CG C 13 36.727 . . . . . . . . 155 E CG . 27064 1 666 . 1 1 57 57 GLU N N 15 122.305 . . . . . . . . 155 E N . 27064 1 667 . 1 1 58 58 SER H H 1 8.378 . . . . . . . . 156 S HN . 27064 1 668 . 1 1 58 58 SER HA H 1 4.782 . . . . . . . . 156 S HA . 27064 1 669 . 1 1 58 58 SER HB2 H 1 4.128 . . . . . . . . 156 S HB1 . 27064 1 670 . 1 1 58 58 SER HB3 H 1 4.063 . . . . . . . . 156 S HB2 . 27064 1 671 . 1 1 58 58 SER CA C 13 59.360 . . . . . . . . 156 S CA . 27064 1 672 . 1 1 58 58 SER CB C 13 63.160 . . . . . . . . 156 S CB . 27064 1 673 . 1 1 58 58 SER N N 15 113.101 . . . . . . . . 156 S N . 27064 1 674 . 1 1 59 59 ARG H H 1 8.047 . . . . . . . . 157 R HN . 27064 1 675 . 1 1 59 59 ARG HA H 1 4.492 . . . . . . . . 157 R HA . 27064 1 676 . 1 1 59 59 ARG HB2 H 1 1.701 . . . . . . . . 157 R HB1 . 27064 1 677 . 1 1 59 59 ARG HB3 H 1 1.646 . . . . . . . . 157 R HB2 . 27064 1 678 . 1 1 59 59 ARG HG2 H 1 1.323 . . . . . . . . 157 R HG1 . 27064 1 679 . 1 1 59 59 ARG HG3 H 1 1.248 . . . . . . . . 157 R HG2 . 27064 1 680 . 1 1 59 59 ARG HD2 H 1 3.169 . . . . . . . . 157 R HD1 . 27064 1 681 . 1 1 59 59 ARG HD3 H 1 3.176 . . . . . . . . 157 R HD2 . 27064 1 682 . 1 1 59 59 ARG HE H 1 6.825 . . . . . . . . 157 R HE . 27064 1 683 . 1 1 59 59 ARG C C 13 172.721 . . . . . . . . 157 R C . 27064 1 684 . 1 1 59 59 ARG CA C 13 56.936 . . . . . . . . 157 R CA . 27064 1 685 . 1 1 59 59 ARG CB C 13 31.671 . . . . . . . . 157 R CB . 27064 1 686 . 1 1 59 59 ARG CG C 13 28.108 . . . . . . . . 157 R CG . 27064 1 687 . 1 1 59 59 ARG CD C 13 42.757 . . . . . . . . 157 R CD . 27064 1 688 . 1 1 59 59 ARG N N 15 117.328 . . . . . . . . 157 R N . 27064 1 689 . 1 1 59 59 ARG NE N 15 82.282 . . . . . . . . 157 R NE . 27064 1 690 . 1 1 60 60 PHE H H 1 7.218 . . . . . . . . 158 F HN . 27064 1 691 . 1 1 60 60 PHE HA H 1 5.264 . . . . . . . . 158 F HA . 27064 1 692 . 1 1 60 60 PHE HB2 H 1 2.993 . . . . . . . . 158 F HB1 . 27064 1 693 . 1 1 60 60 PHE HB3 H 1 2.447 . . . . . . . . 158 F HB2 . 27064 1 694 . 1 1 60 60 PHE HD2 H 1 7.097 . . . . . . . . 158 F HD2 . 27064 1 695 . 1 1 60 60 PHE HE2 H 1 7.226 . . . . . . . . 158 F HE2 . 27064 1 696 . 1 1 60 60 PHE C C 13 174.620 . . . . . . . . 158 F C . 27064 1 697 . 1 1 60 60 PHE CA C 13 56.163 . . . . . . . . 158 F CA . 27064 1 698 . 1 1 60 60 PHE CB C 13 40.437 . . . . . . . . 158 F CB . 27064 1 699 . 1 1 60 60 PHE CD2 C 13 132.119 . . . . . . . . 158 F CD2 . 27064 1 700 . 1 1 60 60 PHE CE2 C 13 131.697 . . . . . . . . 158 F CE2 . 27064 1 701 . 1 1 60 60 PHE N N 15 118.376 . . . . . . . . 158 F N . 27064 1 702 . 1 1 61 61 PHE H H 1 8.999 . . . . . . . . 159 F HN . 27064 1 703 . 1 1 61 61 PHE HA H 1 4.973 . . . . . . . . 159 F HA . 27064 1 704 . 1 1 61 61 PHE HB2 H 1 2.663 . . . . . . . . 159 F HB1 . 27064 1 705 . 1 1 61 61 PHE HB3 H 1 3.041 . . . . . . . . 159 F HB2 . 27064 1 706 . 1 1 61 61 PHE HD1 H 1 6.997 . . . . . . . . 159 F HD1 . 27064 1 707 . 1 1 61 61 PHE HE1 H 1 7.042 . . . . . . . . 159 F HE1 . 27064 1 708 . 1 1 61 61 PHE CA C 13 56.722 . . . . . . . . 159 F CA . 27064 1 709 . 1 1 61 61 PHE CB C 13 42.238 . . . . . . . . 159 F CB . 27064 1 710 . 1 1 61 61 PHE CD1 C 13 132.541 . . . . . . . . 159 F CD1 . 27064 1 711 . 1 1 61 61 PHE CE1 C 13 131.068 . . . . . . . . 159 F CE1 . 27064 1 712 . 1 1 61 61 PHE N N 15 120.782 . . . . . . . . 159 F N . 27064 1 713 . 1 1 62 62 VAL H H 1 9.051 . . . . . . . . 160 V HN . 27064 1 714 . 1 1 62 62 VAL HA H 1 4.924 . . . . . . . . 160 V HA . 27064 1 715 . 1 1 62 62 VAL HB H 1 1.808 . . . . . . . . 160 V HB . 27064 1 716 . 1 1 62 62 VAL HG11 H 1 0.757 . . . . . . . . 160 V HG11 . 27064 1 717 . 1 1 62 62 VAL HG12 H 1 0.757 . . . . . . . . 160 V HG11 . 27064 1 718 . 1 1 62 62 VAL HG13 H 1 0.757 . . . . . . . . 160 V HG11 . 27064 1 719 . 1 1 62 62 VAL HG21 H 1 0.964 . . . . . . . . 160 V HG21 . 27064 1 720 . 1 1 62 62 VAL HG22 H 1 0.964 . . . . . . . . 160 V HG21 . 27064 1 721 . 1 1 62 62 VAL HG23 H 1 0.964 . . . . . . . . 160 V HG21 . 27064 1 722 . 1 1 62 62 VAL C C 13 176.119 . . . . . . . . 160 V C . 27064 1 723 . 1 1 62 62 VAL CA C 13 60.693 . . . . . . . . 160 V CA . 27064 1 724 . 1 1 62 62 VAL CB C 13 35.166 . . . . . . . . 160 V CB . 27064 1 725 . 1 1 62 62 VAL CG1 C 13 21.101 . . . . . . . . 160 V CG1 . 27064 1 726 . 1 1 62 62 VAL CG2 C 13 21.820 . . . . . . . . 160 V CG2 . 27064 1 727 . 1 1 62 62 VAL N N 15 125.853 . . . . . . . . 160 V N . 27064 1 728 . 1 1 63 63 SER H H 1 9.033 . . . . . . . . 161 S HN . 27064 1 729 . 1 1 63 63 SER HA H 1 4.837 . . . . . . . . 161 S HA . 27064 1 730 . 1 1 63 63 SER HB2 H 1 3.645 . . . . . . . . 161 S HB1 . 27064 1 731 . 1 1 63 63 SER HB3 H 1 3.829 . . . . . . . . 161 S HB2 . 27064 1 732 . 1 1 63 63 SER C C 13 174.565 . . . . . . . . 161 S C . 27064 1 733 . 1 1 63 63 SER CA C 13 56.404 . . . . . . . . 161 S CA . 27064 1 734 . 1 1 63 63 SER CB C 13 64.495 . . . . . . . . 161 S CB . 27064 1 735 . 1 1 63 63 SER N N 15 123.446 . . . . . . . . 161 S N . 27064 1 736 . 1 1 64 64 SER H H 1 9.120 . . . . . . . . 162 S HN . 27064 1 737 . 1 1 64 64 SER HA H 1 5.283 . . . . . . . . 162 S HA . 27064 1 738 . 1 1 64 64 SER HB2 H 1 3.918 . . . . . . . . 162 S HB1 . 27064 1 739 . 1 1 64 64 SER HB3 H 1 4.139 . . . . . . . . 162 S HB2 . 27064 1 740 . 1 1 64 64 SER C C 13 172.295 . . . . . . . . 162 S C . 27064 1 741 . 1 1 64 64 SER CA C 13 57.452 . . . . . . . . 162 S CA . 27064 1 742 . 1 1 64 64 SER CB C 13 65.923 . . . . . . . . 162 S CB . 27064 1 743 . 1 1 64 64 SER N N 15 124.843 . . . . . . . . 162 S N . 27064 1 744 . 1 1 65 65 SER H H 1 9.216 . . . . . . . . 163 S HN . 27064 1 745 . 1 1 65 65 SER HA H 1 4.779 . . . . . . . . 163 S HA . 27064 1 746 . 1 1 65 65 SER HB2 H 1 3.934 . . . . . . . . 163 S HB1 . 27064 1 747 . 1 1 65 65 SER HB3 H 1 4.031 . . . . . . . . 163 S HB2 . 27064 1 748 . 1 1 65 65 SER C C 13 174.335 . . . . . . . . 163 S C . 27064 1 749 . 1 1 65 65 SER CA C 13 57.499 . . . . . . . . 163 S CA . 27064 1 750 . 1 1 65 65 SER CB C 13 65.021 . . . . . . . . 163 S CB . 27064 1 751 . 1 1 65 65 SER N N 15 119.923 . . . . . . . . 163 S N . 27064 1 752 . 1 1 66 66 GLN H H 1 8.826 . . . . . . . . 164 Q HN . 27064 1 753 . 1 1 66 66 GLN HA H 1 4.425 . . . . . . . . 164 Q HA . 27064 1 754 . 1 1 66 66 GLN HB2 H 1 2.108 . . . . . . . . 164 Q HB1 . 27064 1 755 . 1 1 66 66 GLN HB3 H 1 2.194 . . . . . . . . 164 Q HB2 . 27064 1 756 . 1 1 66 66 GLN HG2 H 1 2.385 . . . . . . . . 164 Q HG1 . 27064 1 757 . 1 1 66 66 GLN HG3 H 1 2.444 . . . . . . . . 164 Q HG2 . 27064 1 758 . 1 1 66 66 GLN HE21 H 1 6.956 . . . . . . . . 164 Q HE21 . 27064 1 759 . 1 1 66 66 GLN HE22 H 1 7.648 . . . . . . . . 164 Q HE22 . 27064 1 760 . 1 1 66 66 GLN C C 13 177.967 . . . . . . . . 164 Q C . 27064 1 761 . 1 1 66 66 GLN CA C 13 58.507 . . . . . . . . 164 Q CA . 27064 1 762 . 1 1 66 66 GLN CB C 13 28.061 . . . . . . . . 164 Q CB . 27064 1 763 . 1 1 66 66 GLN CG C 13 34.483 . . . . . . . . 164 Q CG . 27064 1 764 . 1 1 66 66 GLN N N 15 121.108 . . . . . . . . 164 Q N . 27064 1 765 . 1 1 66 66 GLN NE2 N 15 112.605 . . . . . . . . 164 Q NE2 . 27064 1 766 . 1 1 67 67 GLY H H 1 9.227 . . . . . . . . 165 G HN . 27064 1 767 . 1 1 67 67 GLY HA2 H 1 4.523 . . . . . . . . 165 G HA1 . 27064 1 768 . 1 1 67 67 GLY HA3 H 1 4.193 . . . . . . . . 165 G HA2 . 27064 1 769 . 1 1 67 67 GLY C C 13 173.861 . . . . . . . . 165 G C . 27064 1 770 . 1 1 67 67 GLY CA C 13 46.981 . . . . . . . . 165 G CA . 27064 1 771 . 1 1 67 67 GLY N N 15 112.360 . . . . . . . . 165 G N . 27064 1 772 . 1 1 68 68 ARG H H 1 7.964 . . . . . . . . 166 R HN . 27064 1 773 . 1 1 68 68 ARG HA H 1 4.948 . . . . . . . . 166 R HA . 27064 1 774 . 1 1 68 68 ARG HB2 H 1 1.539 . . . . . . . . 166 R HB1 . 27064 1 775 . 1 1 68 68 ARG HB3 H 1 1.716 . . . . . . . . 166 R HB2 . 27064 1 776 . 1 1 68 68 ARG HG2 H 1 1.268 . . . . . . . . 166 R HG1 . 27064 1 777 . 1 1 68 68 ARG HG3 H 1 1.373 . . . . . . . . 166 R HG2 . 27064 1 778 . 1 1 68 68 ARG HD2 H 1 3.011 . . . . . . . . 166 R HD1 . 27064 1 779 . 1 1 68 68 ARG HD3 H 1 3.127 . . . . . . . . 166 R HD2 . 27064 1 780 . 1 1 68 68 ARG C C 13 175.971 . . . . . . . . 166 R C . 27064 1 781 . 1 1 68 68 ARG CA C 13 55.647 . . . . . . . . 166 R CA . 27064 1 782 . 1 1 68 68 ARG CB C 13 33.694 . . . . . . . . 166 R CB . 27064 1 783 . 1 1 68 68 ARG CG C 13 28.012 . . . . . . . . 166 R CG . 27064 1 784 . 1 1 68 68 ARG CD C 13 43.313 . . . . . . . . 166 R CD . 27064 1 785 . 1 1 68 68 ARG N N 15 122.930 . . . . . . . . 166 R N . 27064 1 786 . 1 1 69 69 SER H H 1 8.124 . . . . . . . . 167 S HN . 27064 1 787 . 1 1 69 69 SER HA H 1 4.642 . . . . . . . . 167 S HA . 27064 1 788 . 1 1 69 69 SER HB2 H 1 2.001 . . . . . . . . 167 S HB1 . 27064 1 789 . 1 1 69 69 SER HB3 H 1 2.211 . . . . . . . . 167 S HB2 . 27064 1 790 . 1 1 69 69 SER C C 13 172.270 . . . . . . . . 167 S C . 27064 1 791 . 1 1 69 69 SER CA C 13 57.191 . . . . . . . . 167 S CA . 27064 1 792 . 1 1 69 69 SER CB C 13 63.241 . . . . . . . . 167 S CB . 27064 1 793 . 1 1 69 69 SER N N 15 117.788 . . . . . . . . 167 S N . 27064 1 794 . 1 1 70 70 GLU H H 1 8.579 . . . . . . . . 168 E HN . 27064 1 795 . 1 1 70 70 GLU HA H 1 5.335 . . . . . . . . 168 E HA . 27064 1 796 . 1 1 70 70 GLU HB2 H 1 1.583 . . . . . . . . 168 E HB1 . 27064 1 797 . 1 1 70 70 GLU HB3 H 1 2.066 . . . . . . . . 168 E HB2 . 27064 1 798 . 1 1 70 70 GLU HG2 H 1 2.192 . . . . . . . . 168 E HG1 . 27064 1 799 . 1 1 70 70 GLU HG3 H 1 2.192 . . . . . . . . 168 E HG2 . 27064 1 800 . 1 1 70 70 GLU CA C 13 53.069 . . . . . . . . 168 E CA . 27064 1 801 . 1 1 70 70 GLU CB C 13 33.188 . . . . . . . . 168 E CB . 27064 1 802 . 1 1 70 70 GLU CG C 13 35.494 . . . . . . . . 168 E CG . 27064 1 803 . 1 1 70 70 GLU N N 15 126.531 . . . . . . . . 168 E N . 27064 1 804 . 1 1 71 71 LEU H H 1 8.786 . . . . . . . . 169 L HN . 27064 1 805 . 1 1 71 71 LEU HA H 1 4.431 . . . . . . . . 169 L HA . 27064 1 806 . 1 1 71 71 LEU HB2 H 1 -1.230 . . . . . . . . 169 L HB1 . 27064 1 807 . 1 1 71 71 LEU HB3 H 1 0.142 . . . . . . . . 169 L HB2 . 27064 1 808 . 1 1 71 71 LEU HG H 1 0.777 . . . . . . . . 169 L HG . 27064 1 809 . 1 1 71 71 LEU HD11 H 1 0.424 . . . . . . . . 169 L HD11 . 27064 1 810 . 1 1 71 71 LEU HD12 H 1 0.424 . . . . . . . . 169 L HD11 . 27064 1 811 . 1 1 71 71 LEU HD13 H 1 0.424 . . . . . . . . 169 L HD11 . 27064 1 812 . 1 1 71 71 LEU HD21 H 1 0.343 . . . . . . . . 169 L HD21 . 27064 1 813 . 1 1 71 71 LEU HD22 H 1 0.343 . . . . . . . . 169 L HD21 . 27064 1 814 . 1 1 71 71 LEU HD23 H 1 0.343 . . . . . . . . 169 L HD21 . 27064 1 815 . 1 1 71 71 LEU C C 13 174.670 . . . . . . . . 169 L C . 27064 1 816 . 1 1 71 71 LEU CA C 13 53.069 . . . . . . . . 169 L CA . 27064 1 817 . 1 1 71 71 LEU CB C 13 41.059 . . . . . . . . 169 L CB . 27064 1 818 . 1 1 71 71 LEU CG C 13 27.181 . . . . . . . . 169 L CG . 27064 1 819 . 1 1 71 71 LEU CD1 C 13 23.421 . . . . . . . . 169 L CD1 . 27064 1 820 . 1 1 71 71 LEU CD2 C 13 27.795 . . . . . . . . 169 L CD2 . 27064 1 821 . 1 1 71 71 LEU N N 15 126.432 . . . . . . . . 169 L N . 27064 1 822 . 1 1 72 72 HIS H H 1 9.546 . . . . . . . . 170 H HN . 27064 1 823 . 1 1 72 72 HIS HA H 1 5.366 . . . . . . . . 170 H HA . 27064 1 824 . 1 1 72 72 HIS HB2 H 1 3.059 . . . . . . . . 170 H HB1 . 27064 1 825 . 1 1 72 72 HIS HB3 H 1 2.740 . . . . . . . . 170 H HB2 . 27064 1 826 . 1 1 72 72 HIS HD2 H 1 6.703 . . . . . . . . 170 H HD2 . 27064 1 827 . 1 1 72 72 HIS HE1 H 1 7.149 . . . . . . . . 170 H HE1 . 27064 1 828 . 1 1 72 72 HIS C C 13 174.515 . . . . . . . . 170 H C . 27064 1 829 . 1 1 72 72 HIS CA C 13 53.354 . . . . . . . . 170 H CA . 27064 1 830 . 1 1 72 72 HIS CB C 13 31.720 . . . . . . . . 170 H CB . 27064 1 831 . 1 1 72 72 HIS CD2 C 13 117.349 . . . . . . . . 170 H CD2 . 27064 1 832 . 1 1 72 72 HIS CE1 C 13 114.184 . . . . . . . . 170 H CE1 . 27064 1 833 . 1 1 72 72 HIS N N 15 127.485 . . . . . . . . 170 H N . 27064 1 834 . 1 1 73 73 ILE H H 1 8.564 . . . . . . . . 171 I HN . 27064 1 835 . 1 1 73 73 ILE HA H 1 4.326 . . . . . . . . 171 I HA . 27064 1 836 . 1 1 73 73 ILE HB H 1 1.344 . . . . . . . . 171 I HB . 27064 1 837 . 1 1 73 73 ILE HG12 H 1 0.581 . . . . . . . . 171 I HG11 . 27064 1 838 . 1 1 73 73 ILE HG13 H 1 1.045 . . . . . . . . 171 I HG12 . 27064 1 839 . 1 1 73 73 ILE HG21 H 1 0.185 . . . . . . . . 171 I HG21 . 27064 1 840 . 1 1 73 73 ILE HG22 H 1 0.185 . . . . . . . . 171 I HG21 . 27064 1 841 . 1 1 73 73 ILE HG23 H 1 0.185 . . . . . . . . 171 I HG21 . 27064 1 842 . 1 1 73 73 ILE HD11 H 1 0.258 . . . . . . . . 171 I HD11 . 27064 1 843 . 1 1 73 73 ILE HD12 H 1 0.258 . . . . . . . . 171 I HD11 . 27064 1 844 . 1 1 73 73 ILE HD13 H 1 0.258 . . . . . . . . 171 I HD11 . 27064 1 845 . 1 1 73 73 ILE C C 13 175.251 . . . . . . . . 171 I C . 27064 1 846 . 1 1 73 73 ILE CA C 13 60.273 . . . . . . . . 171 I CA . 27064 1 847 . 1 1 73 73 ILE CB C 13 40.106 . . . . . . . . 171 I CB . 27064 1 848 . 1 1 73 73 ILE CG1 C 13 25.474 . . . . . . . . 171 I CG1 . 27064 1 849 . 1 1 73 73 ILE CG2 C 13 17.749 . . . . . . . . 171 I CG2 . 27064 1 850 . 1 1 73 73 ILE CD1 C 13 13.610 . . . . . . . . 171 I CD1 . 27064 1 851 . 1 1 73 73 ILE N N 15 122.673 . . . . . . . . 171 I N . 27064 1 852 . 1 1 74 74 GLU H H 1 8.655 . . . . . . . . 172 E HN . 27064 1 853 . 1 1 74 74 GLU HA H 1 4.441 . . . . . . . . 172 E HA . 27064 1 854 . 1 1 74 74 GLU HB2 H 1 1.938 . . . . . . . . 172 E HB1 . 27064 1 855 . 1 1 74 74 GLU HB3 H 1 1.942 . . . . . . . . 172 E HB2 . 27064 1 856 . 1 1 74 74 GLU HG2 H 1 2.263 . . . . . . . . 172 E HG1 . 27064 1 857 . 1 1 74 74 GLU HG3 H 1 2.349 . . . . . . . . 172 E HG2 . 27064 1 858 . 1 1 74 74 GLU C C 13 175.531 . . . . . . . . 172 E C . 27064 1 859 . 1 1 74 74 GLU CA C 13 55.602 . . . . . . . . 172 E CA . 27064 1 860 . 1 1 74 74 GLU CB C 13 31.481 . . . . . . . . 172 E CB . 27064 1 861 . 1 1 74 74 GLU CG C 13 36.582 . . . . . . . . 172 E CG . 27064 1 862 . 1 1 74 74 GLU N N 15 124.993 . . . . . . . . 172 E N . 27064 1 863 . 1 1 75 75 ASN H H 1 8.223 . . . . . . . . 173 N HN . 27064 1 864 . 1 1 75 75 ASN HA H 1 3.946 . . . . . . . . 173 N HA . 27064 1 865 . 1 1 75 75 ASN HB2 H 1 2.505 . . . . . . . . 173 N HB1 . 27064 1 866 . 1 1 75 75 ASN HB3 H 1 3.020 . . . . . . . . 173 N HB2 . 27064 1 867 . 1 1 75 75 ASN HD21 H 1 7.331 . . . . . . . . 173 N HD21 . 27064 1 868 . 1 1 75 75 ASN HD22 H 1 6.792 . . . . . . . . 173 N HD22 . 27064 1 869 . 1 1 75 75 ASN C C 13 174.080 . . . . . . . . 173 N C . 27064 1 870 . 1 1 75 75 ASN CA C 13 52.889 . . . . . . . . 173 N CA . 27064 1 871 . 1 1 75 75 ASN CB C 13 36.909 . . . . . . . . 173 N CB . 27064 1 872 . 1 1 75 75 ASN N N 15 117.774 . . . . . . . . 173 N N . 27064 1 873 . 1 1 75 75 ASN ND2 N 15 111.744 . . . . . . . . 173 N ND2 . 27064 1 874 . 1 1 76 76 LEU H H 1 8.117 . . . . . . . . 174 L HN . 27064 1 875 . 1 1 76 76 LEU HA H 1 4.006 . . . . . . . . 174 L HA . 27064 1 876 . 1 1 76 76 LEU HB2 H 1 1.245 . . . . . . . . 174 L HB1 . 27064 1 877 . 1 1 76 76 LEU HB3 H 1 1.672 . . . . . . . . 174 L HB2 . 27064 1 878 . 1 1 76 76 LEU HG H 1 0.702 . . . . . . . . 174 L HG . 27064 1 879 . 1 1 76 76 LEU HD11 H 1 1.699 . . . . . . . . 174 L HD11 . 27064 1 880 . 1 1 76 76 LEU HD12 H 1 1.699 . . . . . . . . 174 L HD11 . 27064 1 881 . 1 1 76 76 LEU HD13 H 1 1.699 . . . . . . . . 174 L HD11 . 27064 1 882 . 1 1 76 76 LEU HD21 H 1 0.682 . . . . . . . . 174 L HD21 . 27064 1 883 . 1 1 76 76 LEU HD22 H 1 0.682 . . . . . . . . 174 L HD21 . 27064 1 884 . 1 1 76 76 LEU HD23 H 1 0.682 . . . . . . . . 174 L HD21 . 27064 1 885 . 1 1 76 76 LEU C C 13 178.329 . . . . . . . . 174 L C . 27064 1 886 . 1 1 76 76 LEU CA C 13 56.097 . . . . . . . . 174 L CA . 27064 1 887 . 1 1 76 76 LEU CB C 13 43.797 . . . . . . . . 174 L CB . 27064 1 888 . 1 1 76 76 LEU CG C 13 26.885 . . . . . . . . 174 L CG . 27064 1 889 . 1 1 76 76 LEU CD1 C 13 26.773 . . . . . . . . 174 L CD1 . 27064 1 890 . 1 1 76 76 LEU CD2 C 13 25.372 . . . . . . . . 174 L CD2 . 27064 1 891 . 1 1 76 76 LEU N N 15 117.774 . . . . . . . . 174 L N . 27064 1 892 . 1 1 77 77 ASN H H 1 10.193 . . . . . . . . 175 N HN . 27064 1 893 . 1 1 77 77 ASN HA H 1 5.089 . . . . . . . . 175 N HA . 27064 1 894 . 1 1 77 77 ASN HB2 H 1 2.726 . . . . . . . . 175 N HB1 . 27064 1 895 . 1 1 77 77 ASN HB3 H 1 2.981 . . . . . . . . 175 N HB2 . 27064 1 896 . 1 1 77 77 ASN HD21 H 1 6.929 . . . . . . . . 175 N HD21 . 27064 1 897 . 1 1 77 77 ASN HD22 H 1 8.034 . . . . . . . . 175 N HD22 . 27064 1 898 . 1 1 77 77 ASN C C 13 175.155 . . . . . . . . 175 N C . 27064 1 899 . 1 1 77 77 ASN CA C 13 51.910 . . . . . . . . 175 N CA . 27064 1 900 . 1 1 77 77 ASN CB C 13 42.011 . . . . . . . . 175 N CB . 27064 1 901 . 1 1 77 77 ASN N N 15 125.423 . . . . . . . . 175 N N . 27064 1 902 . 1 1 77 77 ASN ND2 N 15 116.657 . . . . . . . . 175 N ND2 . 27064 1 903 . 1 1 78 78 MET H H 1 9.156 . . . . . . . . 176 M HN . 27064 1 904 . 1 1 78 78 MET HA H 1 4.024 . . . . . . . . 176 M HA . 27064 1 905 . 1 1 78 78 MET HB2 H 1 2.000 . . . . . . . . 176 M HB1 . 27064 1 906 . 1 1 78 78 MET HB3 H 1 2.073 . . . . . . . . 176 M HB2 . 27064 1 907 . 1 1 78 78 MET HG2 H 1 2.470 . . . . . . . . 176 M HG1 . 27064 1 908 . 1 1 78 78 MET HG3 H 1 2.537 . . . . . . . . 176 M HG2 . 27064 1 909 . 1 1 78 78 MET HE1 H 1 2.082 . . . . . . . . 176 M HE1 . 27064 1 910 . 1 1 78 78 MET HE2 H 1 2.082 . . . . . . . . 176 M HE1 . 27064 1 911 . 1 1 78 78 MET HE3 H 1 2.082 . . . . . . . . 176 M HE1 . 27064 1 912 . 1 1 78 78 MET C C 13 174.444 . . . . . . . . 176 M C . 27064 1 913 . 1 1 78 78 MET CA C 13 57.307 . . . . . . . . 176 M CA . 27064 1 914 . 1 1 78 78 MET CB C 13 33.196 . . . . . . . . 176 M CB . 27064 1 915 . 1 1 78 78 MET CG C 13 32.187 . . . . . . . . 176 M CG . 27064 1 916 . 1 1 78 78 MET CE C 13 17.166 . . . . . . . . 176 M CE . 27064 1 917 . 1 1 78 78 MET N N 15 121.982 . . . . . . . . 176 M N . 27064 1 918 . 1 1 79 79 GLU H H 1 8.096 . . . . . . . . 177 E HN . 27064 1 919 . 1 1 79 79 GLU HA H 1 4.287 . . . . . . . . 177 E HA . 27064 1 920 . 1 1 79 79 GLU HB2 H 1 2.026 . . . . . . . . 177 E HB1 . 27064 1 921 . 1 1 79 79 GLU HB3 H 1 2.050 . . . . . . . . 177 E HB2 . 27064 1 922 . 1 1 79 79 GLU HG2 H 1 2.254 . . . . . . . . 177 E HG1 . 27064 1 923 . 1 1 79 79 GLU HG3 H 1 2.254 . . . . . . . . 177 E HG2 . 27064 1 924 . 1 1 79 79 GLU C C 13 177.532 . . . . . . . . 177 E C . 27064 1 925 . 1 1 79 79 GLU CA C 13 58.225 . . . . . . . . 177 E CA . 27064 1 926 . 1 1 79 79 GLU CB C 13 30.473 . . . . . . . . 177 E CB . 27064 1 927 . 1 1 79 79 GLU CG C 13 36.552 . . . . . . . . 177 E CG . 27064 1 928 . 1 1 79 79 GLU N N 15 117.688 . . . . . . . . 177 E N . 27064 1 929 . 1 1 80 80 ALA H H 1 8.221 . . . . . . . . 178 A HN . 27064 1 930 . 1 1 80 80 ALA HA H 1 4.439 . . . . . . . . 178 A HA . 27064 1 931 . 1 1 80 80 ALA HB1 H 1 1.403 . . . . . . . . 178 A HB1 . 27064 1 932 . 1 1 80 80 ALA HB2 H 1 1.403 . . . . . . . . 178 A HB1 . 27064 1 933 . 1 1 80 80 ALA HB3 H 1 1.403 . . . . . . . . 178 A HB1 . 27064 1 934 . 1 1 80 80 ALA C C 13 178.157 . . . . . . . . 178 A C . 27064 1 935 . 1 1 80 80 ALA CA C 13 53.842 . . . . . . . . 178 A CA . 27064 1 936 . 1 1 80 80 ALA CB C 13 20.843 . . . . . . . . 178 A CB . 27064 1 937 . 1 1 80 80 ALA N N 15 120.782 . . . . . . . . 178 A N . 27064 1 938 . 1 1 81 81 ASP H H 1 7.620 . . . . . . . . 179 D HN . 27064 1 939 . 1 1 81 81 ASP HA H 1 4.932 . . . . . . . . 179 D HA . 27064 1 940 . 1 1 81 81 ASP HB2 H 1 2.431 . . . . . . . . 179 D HB1 . 27064 1 941 . 1 1 81 81 ASP HB3 H 1 3.008 . . . . . . . . 179 D HB2 . 27064 1 942 . 1 1 81 81 ASP CA C 13 57.583 . . . . . . . . 179 D CA . 27064 1 943 . 1 1 81 81 ASP CB C 13 40.745 . . . . . . . . 179 D CB . 27064 1 944 . 1 1 81 81 ASP N N 15 117.258 . . . . . . . . 179 D N . 27064 1 945 . 1 1 82 82 PRO HA H 1 4.329 . . . . . . . . 180 P HA . 27064 1 946 . 1 1 82 82 PRO HB2 H 1 1.916 . . . . . . . . 180 P HB1 . 27064 1 947 . 1 1 82 82 PRO HB3 H 1 2.454 . . . . . . . . 180 P HB2 . 27064 1 948 . 1 1 82 82 PRO HG2 H 1 1.880 . . . . . . . . 180 P HG1 . 27064 1 949 . 1 1 82 82 PRO HG3 H 1 2.365 . . . . . . . . 180 P HG2 . 27064 1 950 . 1 1 82 82 PRO HD2 H 1 3.332 . . . . . . . . 180 P HD1 . 27064 1 951 . 1 1 82 82 PRO HD3 H 1 3.994 . . . . . . . . 180 P HD2 . 27064 1 952 . 1 1 82 82 PRO C C 13 176.132 . . . . . . . . 180 P C . 27064 1 953 . 1 1 82 82 PRO CA C 13 65.444 . . . . . . . . 180 P CA . 27064 1 954 . 1 1 82 82 PRO CB C 13 31.671 . . . . . . . . 180 P CB . 27064 1 955 . 1 1 82 82 PRO CG C 13 29.281 . . . . . . . . 180 P CG . 27064 1 956 . 1 1 82 82 PRO CD C 13 51.402 . . . . . . . . 180 P CD . 27064 1 957 . 1 1 83 83 GLY H H 1 8.887 . . . . . . . . 181 G HN . 27064 1 958 . 1 1 83 83 GLY HA2 H 1 3.865 . . . . . . . . 181 G HA1 . 27064 1 959 . 1 1 83 83 GLY HA3 H 1 4.606 . . . . . . . . 181 G HA2 . 27064 1 960 . 1 1 83 83 GLY C C 13 171.580 . . . . . . . . 181 G C . 27064 1 961 . 1 1 83 83 GLY CA C 13 44.359 . . . . . . . . 181 G CA . 27064 1 962 . 1 1 83 83 GLY N N 15 110.361 . . . . . . . . 181 G N . 27064 1 963 . 1 1 84 84 GLN H H 1 8.794 . . . . . . . . 182 Q HN . 27064 1 964 . 1 1 84 84 GLN HA H 1 5.264 . . . . . . . . 182 Q HA . 27064 1 965 . 1 1 84 84 GLN HB2 H 1 1.769 . . . . . . . . 182 Q HB1 . 27064 1 966 . 1 1 84 84 GLN HB3 H 1 2.012 . . . . . . . . 182 Q HB2 . 27064 1 967 . 1 1 84 84 GLN HG2 H 1 2.280 . . . . . . . . 182 Q HG1 . 27064 1 968 . 1 1 84 84 GLN HG3 H 1 2.419 . . . . . . . . 182 Q HG2 . 27064 1 969 . 1 1 84 84 GLN HE21 H 1 7.270 . . . . . . . . 182 Q HE21 . 27064 1 970 . 1 1 84 84 GLN HE22 H 1 6.772 . . . . . . . . 182 Q HE22 . 27064 1 971 . 1 1 84 84 GLN C C 13 174.129 . . . . . . . . 182 Q C . 27064 1 972 . 1 1 84 84 GLN CA C 13 55.389 . . . . . . . . 182 Q CA . 27064 1 973 . 1 1 84 84 GLN CB C 13 32.224 . . . . . . . . 182 Q CB . 27064 1 974 . 1 1 84 84 GLN CG C 13 35.086 . . . . . . . . 182 Q CG . 27064 1 975 . 1 1 84 84 GLN N N 15 120.248 . . . . . . . . 182 Q N . 27064 1 976 . 1 1 84 84 GLN NE2 N 15 111.744 . . . . . . . . 182 Q NE2 . 27064 1 977 . 1 1 85 85 TYR H H 1 9.604 . . . . . . . . 183 Y HN . 27064 1 978 . 1 1 85 85 TYR HA H 1 5.201 . . . . . . . . 183 Y HA . 27064 1 979 . 1 1 85 85 TYR HB2 H 1 2.949 . . . . . . . . 183 Y HB1 . 27064 1 980 . 1 1 85 85 TYR HB3 H 1 2.937 . . . . . . . . 183 Y HB2 . 27064 1 981 . 1 1 85 85 TYR HD2 H 1 6.959 . . . . . . . . 183 Y HD2 . 27064 1 982 . 1 1 85 85 TYR HE2 H 1 6.636 . . . . . . . . 183 Y HE2 . 27064 1 983 . 1 1 85 85 TYR C C 13 173.866 . . . . . . . . 183 Y C . 27064 1 984 . 1 1 85 85 TYR CA C 13 57.061 . . . . . . . . 183 Y CA . 27064 1 985 . 1 1 85 85 TYR CB C 13 42.063 . . . . . . . . 183 Y CB . 27064 1 986 . 1 1 85 85 TYR CD2 C 13 132.963 . . . . . . . . 183 Y CD2 . 27064 1 987 . 1 1 85 85 TYR CE2 C 13 117.349 . . . . . . . . 183 Y CE2 . 27064 1 988 . 1 1 85 85 TYR N N 15 123.102 . . . . . . . . 183 Y N . 27064 1 989 . 1 1 86 86 ARG H H 1 9.681 . . . . . . . . 184 R HN . 27064 1 990 . 1 1 86 86 ARG HA H 1 5.644 . . . . . . . . 184 R HA . 27064 1 991 . 1 1 86 86 ARG HB2 H 1 1.460 . . . . . . . . 184 R HB1 . 27064 1 992 . 1 1 86 86 ARG HB3 H 1 1.789 . . . . . . . . 184 R HB2 . 27064 1 993 . 1 1 86 86 ARG HG2 H 1 1.271 . . . . . . . . 184 R HG1 . 27064 1 994 . 1 1 86 86 ARG HG3 H 1 1.540 . . . . . . . . 184 R HG2 . 27064 1 995 . 1 1 86 86 ARG HD2 H 1 2.876 . . . . . . . . 184 R HD1 . 27064 1 996 . 1 1 86 86 ARG HD3 H 1 2.876 . . . . . . . . 184 R HD2 . 27064 1 997 . 1 1 86 86 ARG HE H 1 7.565 . . . . . . . . 184 R HE . 27064 1 998 . 1 1 86 86 ARG C C 13 174.686 . . . . . . . . 184 R C . 27064 1 999 . 1 1 86 86 ARG CA C 13 53.396 . . . . . . . . 184 R CA . 27064 1 1000 . 1 1 86 86 ARG CB C 13 36.034 . . . . . . . . 184 R CB . 27064 1 1001 . 1 1 86 86 ARG CG C 13 27.177 . . . . . . . . 184 R CG . 27064 1 1002 . 1 1 86 86 ARG CD C 13 43.456 . . . . . . . . 184 R CD . 27064 1 1003 . 1 1 86 86 ARG N N 15 123.515 . . . . . . . . 184 R N . 27064 1 1004 . 1 1 86 86 ARG NE N 15 83.948 . . . . . . . . 184 R NE . 27064 1 1005 . 1 1 87 87 CYS H H 1 8.843 . . . . . . . . 185 C HN . 27064 1 1006 . 1 1 87 87 CYS HA H 1 4.725 . . . . . . . . 185 C HA . 27064 1 1007 . 1 1 87 87 CYS HB2 H 1 0.684 . . . . . . . . 185 C HB1 . 27064 1 1008 . 1 1 87 87 CYS HB3 H 1 2.330 . . . . . . . . 185 C HB2 . 27064 1 1009 . 1 1 87 87 CYS C C 13 172.415 . . . . . . . . 185 C C . 27064 1 1010 . 1 1 87 87 CYS CA C 13 52.399 . . . . . . . . 185 C CA . 27064 1 1011 . 1 1 87 87 CYS CB C 13 42.458 . . . . . . . . 185 C CB . 27064 1 1012 . 1 1 87 87 CYS N N 15 122.329 . . . . . . . . 185 C N . 27064 1 1013 . 1 1 88 88 ASN H H 1 9.450 . . . . . . . . 186 N HN . 27064 1 1014 . 1 1 88 88 ASN HA H 1 5.258 . . . . . . . . 186 N HA . 27064 1 1015 . 1 1 88 88 ASN HB2 H 1 2.755 . . . . . . . . 186 N HB1 . 27064 1 1016 . 1 1 88 88 ASN HB3 H 1 2.460 . . . . . . . . 186 N HB2 . 27064 1 1017 . 1 1 88 88 ASN HD21 H 1 6.249 . . . . . . . . 186 N HD21 . 27064 1 1018 . 1 1 88 88 ASN HD22 H 1 7.226 . . . . . . . . 186 N HD22 . 27064 1 1019 . 1 1 88 88 ASN C C 13 174.381 . . . . . . . . 186 N C . 27064 1 1020 . 1 1 88 88 ASN CA C 13 52.310 . . . . . . . . 186 N CA . 27064 1 1021 . 1 1 88 88 ASN CB C 13 42.006 . . . . . . . . 186 N CB . 27064 1 1022 . 1 1 88 88 ASN N N 15 123.253 . . . . . . . . 186 N N . 27064 1 1023 . 1 1 88 88 ASN ND2 N 15 111.414 . . . . . . . . 186 N ND2 . 27064 1 1024 . 1 1 89 89 GLY H H 1 8.889 . . . . . . . . 187 G HN . 27064 1 1025 . 1 1 89 89 GLY HA2 H 1 2.061 . . . . . . . . 187 G HA1 . 27064 1 1026 . 1 1 89 89 GLY HA3 H 1 4.299 . . . . . . . . 187 G HA2 . 27064 1 1027 . 1 1 89 89 GLY C C 13 171.337 . . . . . . . . 187 G C . 27064 1 1028 . 1 1 89 89 GLY CA C 13 44.997 . . . . . . . . 187 G CA . 27064 1 1029 . 1 1 89 89 GLY N N 15 113.391 . . . . . . . . 187 G N . 27064 1 1030 . 1 1 90 90 THR H H 1 8.447 . . . . . . . . 188 T HN . 27064 1 1031 . 1 1 90 90 THR HA H 1 4.921 . . . . . . . . 188 T HA . 27064 1 1032 . 1 1 90 90 THR HB H 1 3.777 . . . . . . . . 188 T HB . 27064 1 1033 . 1 1 90 90 THR HG21 H 1 1.177 . . . . . . . . 188 T HG21 . 27064 1 1034 . 1 1 90 90 THR HG22 H 1 1.177 . . . . . . . . 188 T HG21 . 27064 1 1035 . 1 1 90 90 THR HG23 H 1 1.177 . . . . . . . . 188 T HG21 . 27064 1 1036 . 1 1 90 90 THR C C 13 172.771 . . . . . . . . 188 T C . 27064 1 1037 . 1 1 90 90 THR CA C 13 62.064 . . . . . . . . 188 T CA . 27064 1 1038 . 1 1 90 90 THR CB C 13 71.684 . . . . . . . . 188 T CB . 27064 1 1039 . 1 1 90 90 THR CG2 C 13 21.685 . . . . . . . . 188 T CG2 . 27064 1 1040 . 1 1 90 90 THR N N 15 121.469 . . . . . . . . 188 T N . 27064 1 1041 . 1 1 91 91 SER H H 1 9.468 . . . . . . . . 189 S HN . 27064 1 1042 . 1 1 91 91 SER HA H 1 5.061 . . . . . . . . 189 S HA . 27064 1 1043 . 1 1 91 91 SER HB2 H 1 3.219 . . . . . . . . 189 S HB1 . 27064 1 1044 . 1 1 91 91 SER HB3 H 1 3.929 . . . . . . . . 189 S HB2 . 27064 1 1045 . 1 1 91 91 SER C C 13 174.894 . . . . . . . . 189 S C . 27064 1 1046 . 1 1 91 91 SER CA C 13 55.123 . . . . . . . . 189 S CA . 27064 1 1047 . 1 1 91 91 SER CB C 13 69.827 . . . . . . . . 189 S CB . 27064 1 1048 . 1 1 91 91 SER N N 15 124.735 . . . . . . . . 189 S N . 27064 1 1049 . 1 1 92 92 SER H H 1 8.846 . . . . . . . . 190 S HN . 27064 1 1050 . 1 1 92 92 SER HA H 1 4.214 . . . . . . . . 190 S HA . 27064 1 1051 . 1 1 92 92 SER HB2 H 1 3.848 . . . . . . . . 190 S HB1 . 27064 1 1052 . 1 1 92 92 SER HB3 H 1 4.000 . . . . . . . . 190 S HB2 . 27064 1 1053 . 1 1 92 92 SER C C 13 175.262 . . . . . . . . 190 S C . 27064 1 1054 . 1 1 92 92 SER CA C 13 60.496 . . . . . . . . 190 S CA . 27064 1 1055 . 1 1 92 92 SER CB C 13 62.788 . . . . . . . . 190 S CB . 27064 1 1056 . 1 1 92 92 SER N N 15 114.856 . . . . . . . . 190 S N . 27064 1 1057 . 1 1 93 93 LYS H H 1 8.025 . . . . . . . . 191 K HN . 27064 1 1058 . 1 1 93 93 LYS HA H 1 4.546 . . . . . . . . 191 K HA . 27064 1 1059 . 1 1 93 93 LYS HB2 H 1 1.796 . . . . . . . . 191 K HB1 . 27064 1 1060 . 1 1 93 93 LYS HB3 H 1 1.294 . . . . . . . . 191 K HB2 . 27064 1 1061 . 1 1 93 93 LYS HG2 H 1 1.246 . . . . . . . . 191 K HG1 . 27064 1 1062 . 1 1 93 93 LYS HG3 H 1 1.246 . . . . . . . . 191 K HG2 . 27064 1 1063 . 1 1 93 93 LYS HD2 H 1 1.534 . . . . . . . . 191 K HD1 . 27064 1 1064 . 1 1 93 93 LYS HD3 H 1 1.627 . . . . . . . . 191 K HD2 . 27064 1 1065 . 1 1 93 93 LYS HE2 H 1 2.848 . . . . . . . . 191 K HE1 . 27064 1 1066 . 1 1 93 93 LYS HE3 H 1 2.885 . . . . . . . . 191 K HE2 . 27064 1 1067 . 1 1 93 93 LYS C C 13 175.654 . . . . . . . . 191 K C . 27064 1 1068 . 1 1 93 93 LYS CA C 13 54.286 . . . . . . . . 191 K CA . 27064 1 1069 . 1 1 93 93 LYS CB C 13 33.977 . . . . . . . . 191 K CB . 27064 1 1070 . 1 1 93 93 LYS CG C 13 24.986 . . . . . . . . 191 K CG . 27064 1 1071 . 1 1 93 93 LYS CD C 13 28.027 . . . . . . . . 191 K CD . 27064 1 1072 . 1 1 93 93 LYS CE C 13 42.112 . . . . . . . . 191 K CE . 27064 1 1073 . 1 1 93 93 LYS N N 15 118.977 . . . . . . . . 191 K N . 27064 1 1074 . 1 1 94 94 GLY H H 1 7.381 . . . . . . . . 192 G HN . 27064 1 1075 . 1 1 94 94 GLY HA2 H 1 3.825 . . . . . . . . 192 G HA1 . 27064 1 1076 . 1 1 94 94 GLY HA3 H 1 4.527 . . . . . . . . 192 G HA2 . 27064 1 1077 . 1 1 94 94 GLY C C 13 170.276 . . . . . . . . 192 G C . 27064 1 1078 . 1 1 94 94 GLY CA C 13 45.118 . . . . . . . . 192 G CA . 27064 1 1079 . 1 1 94 94 GLY N N 15 108.302 . . . . . . . . 192 G N . 27064 1 1080 . 1 1 95 95 SER H H 1 8.476 . . . . . . . . 193 S HN . 27064 1 1081 . 1 1 95 95 SER HA H 1 5.587 . . . . . . . . 193 S HA . 27064 1 1082 . 1 1 95 95 SER HB2 H 1 3.749 . . . . . . . . 193 S HB1 . 27064 1 1083 . 1 1 95 95 SER HB3 H 1 3.580 . . . . . . . . 193 S HB2 . 27064 1 1084 . 1 1 95 95 SER C C 13 172.666 . . . . . . . . 193 S C . 27064 1 1085 . 1 1 95 95 SER CA C 13 56.924 . . . . . . . . 193 S CA . 27064 1 1086 . 1 1 95 95 SER CB C 13 66.923 . . . . . . . . 193 S CB . 27064 1 1087 . 1 1 95 95 SER N N 15 114.323 . . . . . . . . 193 S N . 27064 1 1088 . 1 1 96 96 ASP H H 1 8.751 . . . . . . . . 194 D HN . 27064 1 1089 . 1 1 96 96 ASP HA H 1 4.930 . . . . . . . . 194 D HA . 27064 1 1090 . 1 1 96 96 ASP HB2 H 1 2.030 . . . . . . . . 194 D HB1 . 27064 1 1091 . 1 1 96 96 ASP HB3 H 1 2.891 . . . . . . . . 194 D HB2 . 27064 1 1092 . 1 1 96 96 ASP C C 13 177.475 . . . . . . . . 194 D C . 27064 1 1093 . 1 1 96 96 ASP CA C 13 53.544 . . . . . . . . 194 D CA . 27064 1 1094 . 1 1 96 96 ASP CB C 13 45.030 . . . . . . . . 194 D CB . 27064 1 1095 . 1 1 96 96 ASP N N 15 120.250 . . . . . . . . 194 D N . 27064 1 1096 . 1 1 97 97 GLN H H 1 7.952 . . . . . . . . 195 Q HN . 27064 1 1097 . 1 1 97 97 GLN HA H 1 5.746 . . . . . . . . 195 Q HA . 27064 1 1098 . 1 1 97 97 GLN HB2 H 1 1.738 . . . . . . . . 195 Q HB1 . 27064 1 1099 . 1 1 97 97 GLN HB3 H 1 2.237 . . . . . . . . 195 Q HB2 . 27064 1 1100 . 1 1 97 97 GLN HG2 H 1 2.069 . . . . . . . . 195 Q HG1 . 27064 1 1101 . 1 1 97 97 GLN HG3 H 1 2.072 . . . . . . . . 195 Q HG2 . 27064 1 1102 . 1 1 97 97 GLN HE21 H 1 7.427 . . . . . . . . 195 Q HE21 . 27064 1 1103 . 1 1 97 97 GLN HE22 H 1 6.692 . . . . . . . . 195 Q HE22 . 27064 1 1104 . 1 1 97 97 GLN C C 13 173.554 . . . . . . . . 195 Q C . 27064 1 1105 . 1 1 97 97 GLN CA C 13 53.585 . . . . . . . . 195 Q CA . 27064 1 1106 . 1 1 97 97 GLN CB C 13 32.517 . . . . . . . . 195 Q CB . 27064 1 1107 . 1 1 97 97 GLN CG C 13 32.444 . . . . . . . . 195 Q CG . 27064 1 1108 . 1 1 97 97 GLN N N 15 116.485 . . . . . . . . 195 Q N . 27064 1 1109 . 1 1 97 97 GLN NE2 N 15 112.188 . . . . . . . . 195 Q NE2 . 27064 1 1110 . 1 1 98 98 ALA H H 1 8.244 . . . . . . . . 196 A HN . 27064 1 1111 . 1 1 98 98 ALA HA H 1 4.729 . . . . . . . . 196 A HA . 27064 1 1112 . 1 1 98 98 ALA HB1 H 1 1.402 . . . . . . . . 196 A HB1 . 27064 1 1113 . 1 1 98 98 ALA HB2 H 1 1.402 . . . . . . . . 196 A HB1 . 27064 1 1114 . 1 1 98 98 ALA HB3 H 1 1.402 . . . . . . . . 196 A HB1 . 27064 1 1115 . 1 1 98 98 ALA C C 13 174.485 . . . . . . . . 196 A C . 27064 1 1116 . 1 1 98 98 ALA CA C 13 51.243 . . . . . . . . 196 A CA . 27064 1 1117 . 1 1 98 98 ALA CB C 13 23.128 . . . . . . . . 196 A CB . 27064 1 1118 . 1 1 98 98 ALA N N 15 121.126 . . . . . . . . 196 A N . 27064 1 1119 . 1 1 99 99 ILE H H 1 7.956 . . . . . . . . 197 I HN . 27064 1 1120 . 1 1 99 99 ILE HA H 1 5.155 . . . . . . . . 197 I HA . 27064 1 1121 . 1 1 99 99 ILE HB H 1 1.711 . . . . . . . . 197 I HB . 27064 1 1122 . 1 1 99 99 ILE HG12 H 1 0.986 . . . . . . . . 197 I HG11 . 27064 1 1123 . 1 1 99 99 ILE HG13 H 1 1.521 . . . . . . . . 197 I HG12 . 27064 1 1124 . 1 1 99 99 ILE HG21 H 1 0.851 . . . . . . . . 197 I HG21 . 27064 1 1125 . 1 1 99 99 ILE HG22 H 1 0.851 . . . . . . . . 197 I HG21 . 27064 1 1126 . 1 1 99 99 ILE HG23 H 1 0.851 . . . . . . . . 197 I HG21 . 27064 1 1127 . 1 1 99 99 ILE HD11 H 1 0.777 . . . . . . . . 197 I HD11 . 27064 1 1128 . 1 1 99 99 ILE HD12 H 1 0.777 . . . . . . . . 197 I HD11 . 27064 1 1129 . 1 1 99 99 ILE HD13 H 1 0.777 . . . . . . . . 197 I HD11 . 27064 1 1130 . 1 1 99 99 ILE C C 13 176.117 . . . . . . . . 197 I C . 27064 1 1131 . 1 1 99 99 ILE CA C 13 59.798 . . . . . . . . 197 I CA . 27064 1 1132 . 1 1 99 99 ILE CB C 13 40.281 . . . . . . . . 197 I CB . 27064 1 1133 . 1 1 99 99 ILE CG1 C 13 28.050 . . . . . . . . 197 I CG1 . 27064 1 1134 . 1 1 99 99 ILE CG2 C 13 17.855 . . . . . . . . 197 I CG2 . 27064 1 1135 . 1 1 99 99 ILE CD1 C 13 12.736 . . . . . . . . 197 I CD1 . 27064 1 1136 . 1 1 99 99 ILE N N 15 118.462 . . . . . . . . 197 I N . 27064 1 1137 . 1 1 100 100 ILE H H 1 9.697 . . . . . . . . 198 I HN . 27064 1 1138 . 1 1 100 100 ILE HA H 1 4.774 . . . . . . . . 198 I HA . 27064 1 1139 . 1 1 100 100 ILE HB H 1 1.753 . . . . . . . . 198 I HB . 27064 1 1140 . 1 1 100 100 ILE HG12 H 1 1.337 . . . . . . . . 198 I HG11 . 27064 1 1141 . 1 1 100 100 ILE HG13 H 1 1.601 . . . . . . . . 198 I HG12 . 27064 1 1142 . 1 1 100 100 ILE HG21 H 1 0.959 . . . . . . . . 198 I HG21 . 27064 1 1143 . 1 1 100 100 ILE HG22 H 1 0.959 . . . . . . . . 198 I HG21 . 27064 1 1144 . 1 1 100 100 ILE HG23 H 1 0.959 . . . . . . . . 198 I HG21 . 27064 1 1145 . 1 1 100 100 ILE HD11 H 1 1.232 . . . . . . . . 198 I HD11 . 27064 1 1146 . 1 1 100 100 ILE HD12 H 1 1.232 . . . . . . . . 198 I HD11 . 27064 1 1147 . 1 1 100 100 ILE HD13 H 1 1.232 . . . . . . . . 198 I HD11 . 27064 1 1148 . 1 1 100 100 ILE C C 13 175.640 . . . . . . . . 198 I C . 27064 1 1149 . 1 1 100 100 ILE CA C 13 60.278 . . . . . . . . 198 I CA . 27064 1 1150 . 1 1 100 100 ILE CB C 13 43.169 . . . . . . . . 198 I CB . 27064 1 1151 . 1 1 100 100 ILE CG1 C 13 29.282 . . . . . . . . 198 I CG1 . 27064 1 1152 . 1 1 100 100 ILE CG2 C 13 18.265 . . . . . . . . 198 I CG2 . 27064 1 1153 . 1 1 100 100 ILE CD1 C 13 16.205 . . . . . . . . 198 I CD1 . 27064 1 1154 . 1 1 100 100 ILE N N 15 130.407 . . . . . . . . 198 I N . 27064 1 1155 . 1 1 101 101 THR H H 1 8.722 . . . . . . . . 199 T HN . 27064 1 1156 . 1 1 101 101 THR HA H 1 4.892 . . . . . . . . 199 T HA . 27064 1 1157 . 1 1 101 101 THR HB H 1 4.131 . . . . . . . . 199 T HB . 27064 1 1158 . 1 1 101 101 THR HG21 H 1 1.179 . . . . . . . . 199 T HG21 . 27064 1 1159 . 1 1 101 101 THR HG22 H 1 1.179 . . . . . . . . 199 T HG21 . 27064 1 1160 . 1 1 101 101 THR HG23 H 1 1.179 . . . . . . . . 199 T HG21 . 27064 1 1161 . 1 1 101 101 THR C C 13 172.387 . . . . . . . . 199 T C . 27064 1 1162 . 1 1 101 101 THR CA C 13 62.856 . . . . . . . . 199 T CA . 27064 1 1163 . 1 1 101 101 THR CB C 13 70.093 . . . . . . . . 199 T CB . 27064 1 1164 . 1 1 101 101 THR CG2 C 13 21.617 . . . . . . . . 199 T CG2 . 27064 1 1165 . 1 1 101 101 THR N N 15 124.048 . . . . . . . . 199 T N . 27064 1 1166 . 1 1 102 102 LEU H H 1 9.566 . . . . . . . . 200 L HN . 27064 1 1167 . 1 1 102 102 LEU HA H 1 5.080 . . . . . . . . 200 L HA . 27064 1 1168 . 1 1 102 102 LEU HB2 H 1 1.150 . . . . . . . . 200 L HB1 . 27064 1 1169 . 1 1 102 102 LEU HB3 H 1 2.228 . . . . . . . . 200 L HB2 . 27064 1 1170 . 1 1 102 102 LEU HG H 1 1.227 . . . . . . . . 200 L HG . 27064 1 1171 . 1 1 102 102 LEU HD11 H 1 0.621 . . . . . . . . 200 L HD11 . 27064 1 1172 . 1 1 102 102 LEU HD12 H 1 0.621 . . . . . . . . 200 L HD11 . 27064 1 1173 . 1 1 102 102 LEU HD13 H 1 0.621 . . . . . . . . 200 L HD11 . 27064 1 1174 . 1 1 102 102 LEU HD21 H 1 0.683 . . . . . . . . 200 L HD21 . 27064 1 1175 . 1 1 102 102 LEU HD22 H 1 0.683 . . . . . . . . 200 L HD21 . 27064 1 1176 . 1 1 102 102 LEU HD23 H 1 0.683 . . . . . . . . 200 L HD21 . 27064 1 1177 . 1 1 102 102 LEU C C 13 175.536 . . . . . . . . 200 L C . 27064 1 1178 . 1 1 102 102 LEU CA C 13 53.842 . . . . . . . . 200 L CA . 27064 1 1179 . 1 1 102 102 LEU CB C 13 45.507 . . . . . . . . 200 L CB . 27064 1 1180 . 1 1 102 102 LEU CG C 13 28.157 . . . . . . . . 200 L CG . 27064 1 1181 . 1 1 102 102 LEU CD1 C 13 25.999 . . . . . . . . 200 L CD1 . 27064 1 1182 . 1 1 102 102 LEU CD2 C 13 24.208 . . . . . . . . 200 L CD2 . 27064 1 1183 . 1 1 102 102 LEU N N 15 129.964 . . . . . . . . 200 L N . 27064 1 1184 . 1 1 103 103 ARG H H 1 8.885 . . . . . . . . 201 R HN . 27064 1 1185 . 1 1 103 103 ARG HA H 1 4.631 . . . . . . . . 201 R HA . 27064 1 1186 . 1 1 103 103 ARG HB2 H 1 1.299 . . . . . . . . 201 R HB1 . 27064 1 1187 . 1 1 103 103 ARG HB3 H 1 1.513 . . . . . . . . 201 R HB2 . 27064 1 1188 . 1 1 103 103 ARG HG2 H 1 1.503 . . . . . . . . 201 R HG1 . 27064 1 1189 . 1 1 103 103 ARG HG3 H 1 1.503 . . . . . . . . 201 R HG2 . 27064 1 1190 . 1 1 103 103 ARG HD2 H 1 2.932 . . . . . . . . 201 R HD1 . 27064 1 1191 . 1 1 103 103 ARG HD3 H 1 2.932 . . . . . . . . 201 R HD2 . 27064 1 1192 . 1 1 103 103 ARG C C 13 174.000 . . . . . . . . 201 R C . 27064 1 1193 . 1 1 103 103 ARG CA C 13 54.855 . . . . . . . . 201 R CA . 27064 1 1194 . 1 1 103 103 ARG CB C 13 32.936 . . . . . . . . 201 R CB . 27064 1 1195 . 1 1 103 103 ARG CG C 13 27.591 . . . . . . . . 201 R CG . 27064 1 1196 . 1 1 103 103 ARG CD C 13 43.417 . . . . . . . . 201 R CD . 27064 1 1197 . 1 1 103 103 ARG N N 15 128.569 . . . . . . . . 201 R N . 27064 1 1198 . 1 1 104 104 VAL H H 1 8.280 . . . . . . . . 202 V HN . 27064 1 1199 . 1 1 104 104 VAL HA H 1 5.087 . . . . . . . . 202 V HA . 27064 1 1200 . 1 1 104 104 VAL HB H 1 1.939 . . . . . . . . 202 V HB . 27064 1 1201 . 1 1 104 104 VAL HG11 H 1 0.790 . . . . . . . . 202 V HG11 . 27064 1 1202 . 1 1 104 104 VAL HG12 H 1 0.790 . . . . . . . . 202 V HG11 . 27064 1 1203 . 1 1 104 104 VAL HG13 H 1 0.790 . . . . . . . . 202 V HG11 . 27064 1 1204 . 1 1 104 104 VAL HG21 H 1 0.790 . . . . . . . . 202 V HG21 . 27064 1 1205 . 1 1 104 104 VAL HG22 H 1 0.790 . . . . . . . . 202 V HG21 . 27064 1 1206 . 1 1 104 104 VAL HG23 H 1 0.790 . . . . . . . . 202 V HG21 . 27064 1 1207 . 1 1 104 104 VAL C C 13 174.943 . . . . . . . . 202 V C . 27064 1 1208 . 1 1 104 104 VAL CA C 13 60.443 . . . . . . . . 202 V CA . 27064 1 1209 . 1 1 104 104 VAL CB C 13 33.918 . . . . . . . . 202 V CB . 27064 1 1210 . 1 1 104 104 VAL CG1 C 13 21.454 . . . . . . . . 202 V CG1 . 27064 1 1211 . 1 1 104 104 VAL CG2 C 13 21.454 . . . . . . . . 202 V CG2 . 27064 1 1212 . 1 1 104 104 VAL N N 15 122.501 . . . . . . . . 202 V N . 27064 1 1213 . 1 1 105 105 ARG H H 1 8.577 . . . . . . . . 203 R HN . 27064 1 1214 . 1 1 105 105 ARG HA H 1 4.610 . . . . . . . . 203 R HA . 27064 1 1215 . 1 1 105 105 ARG HB2 H 1 1.793 . . . . . . . . 203 R HB1 . 27064 1 1216 . 1 1 105 105 ARG HB3 H 1 1.569 . . . . . . . . 203 R HB2 . 27064 1 1217 . 1 1 105 105 ARG HG2 H 1 1.495 . . . . . . . . 203 R HG1 . 27064 1 1218 . 1 1 105 105 ARG HG3 H 1 1.495 . . . . . . . . 203 R HG2 . 27064 1 1219 . 1 1 105 105 ARG HD2 H 1 2.979 . . . . . . . . 203 R HD1 . 27064 1 1220 . 1 1 105 105 ARG HD3 H 1 3.023 . . . . . . . . 203 R HD2 . 27064 1 1221 . 1 1 105 105 ARG C C 13 175.461 . . . . . . . . 203 R C . 27064 1 1222 . 1 1 105 105 ARG CA C 13 55.096 . . . . . . . . 203 R CA . 27064 1 1223 . 1 1 105 105 ARG CB C 13 32.206 . . . . . . . . 203 R CB . 27064 1 1224 . 1 1 105 105 ARG CG C 13 27.296 . . . . . . . . 203 R CG . 27064 1 1225 . 1 1 105 105 ARG CD C 13 43.284 . . . . . . . . 203 R CD . 27064 1 1226 . 1 1 105 105 ARG N N 15 128.672 . . . . . . . . 203 R N . 27064 1 1227 . 1 1 106 106 SER H H 1 8.636 . . . . . . . . 204 S HN . 27064 1 1228 . 1 1 106 106 SER HA H 1 4.525 . . . . . . . . 204 S HA . 27064 1 1229 . 1 1 106 106 SER HB2 H 1 3.832 . . . . . . . . 204 S HB1 . 27064 1 1230 . 1 1 106 106 SER HB3 H 1 3.934 . . . . . . . . 204 S HB2 . 27064 1 1231 . 1 1 106 106 SER C C 13 174.513 . . . . . . . . 204 S C . 27064 1 1232 . 1 1 106 106 SER CA C 13 58.443 . . . . . . . . 204 S CA . 27064 1 1233 . 1 1 106 106 SER CB C 13 64.359 . . . . . . . . 204 S CB . 27064 1 1234 . 1 1 106 106 SER N N 15 121.000 . . . . . . . . 204 S N . 27064 1 1235 . 1 1 107 107 HIS H H 1 8.627 . . . . . . . . 205 H HN . 27064 1 1236 . 1 1 107 107 HIS HA H 1 4.434 . . . . . . . . 205 H HA . 27064 1 1237 . 1 1 107 107 HIS HB2 H 1 3.169 . . . . . . . . 205 H HB1 . 27064 1 1238 . 1 1 107 107 HIS HB3 H 1 3.103 . . . . . . . . 205 H HB2 . 27064 1 1239 . 1 1 107 107 HIS CA C 13 57.910 . . . . . . . . 205 H CA . 27064 1 1240 . 1 1 107 107 HIS CB C 13 30.210 . . . . . . . . 205 H CB . 27064 1 1241 . 1 1 107 107 HIS N N 15 127.209 . . . . . . . . 205 H N . 27064 1 stop_ save_