data_6759 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 6759 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 'NEAT domain structural studies' 'Structure analysis' ; The data in this study will be used for structure determination of the NEAT domain ; 6759 1 stop_ loop_ _Study_keyword.Study_ID _Study_keyword.Keyword _Study_keyword.Entry_ID _Study_keyword.Study_list_ID 1 'NMR structure' 6759 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6759 _Entry.Title ; NEAT NMR Resonance Assignments ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-08-03 _Entry.Accession_date 2005-08-03 _Entry.Last_release_date 2005-08-03 _Entry.Original_release_date 2005-08-03 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.2.0.10 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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 'Resonance assignments for NEAT domain I (D1) of IsdH' 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 Rosemarie Pilpa . M. . . 6759 2 Robert Clubb . T. . . 6759 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6759 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 565 6759 '15N chemical shifts' 123 6759 '1H chemical shifts' 820 6759 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2005-11-07 . original BMRB . 6759 stop_ save_ ############### # Citations # ############### save_NEAT_NMR_Resonance_assignments _Citation.Sf_category citations _Citation.Sf_framecode NEAT_NMR_Resonance_assignments _Citation.Entry_ID 6759 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16258836 _Citation.Full_citation . _Citation.Title ; NMR Resonance Assignments of the NEAT (NEAr Transporter) Domain from the Staphylococcus aureus IsdH Protein ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 33 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 137 _Citation.Page_last 137 _Citation.Year 2005 _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 Rosemarie Pilpa . M. . . 6759 1 2 Robert Clubb . T. . . 6759 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6759 _Assembly.ID 1 _Assembly.Name 'NEAT domain' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _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 'NEAT domain' 1 $NEAT_domain_polypeptide . . yes native no no . . . 6759 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_NEAT_domain_polypeptide _Entity.Sf_category entity _Entity.Sf_framecode NEAT_domain_polypeptide _Entity.Entry_ID 6759 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'NEAT domain' _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 ; MADESLKDAIKDPALENKEH DIGPREQVNFQLLDKNNETQ YYHFFSIKDPADVYYTKKKA EVELDINTASTWKKFEVYEN NQKLPVRLVSYSPVPEDHAY IRFPVSDGTQELKIVSSTQI DDGEETNYDYTKLVFAKPIY NDPSL ; _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 145 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _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 85 MET . 6759 1 2 86 ALA . 6759 1 3 87 ASP . 6759 1 4 88 GLU . 6759 1 5 89 SER . 6759 1 6 90 LEU . 6759 1 7 91 LYS . 6759 1 8 92 ASP . 6759 1 9 93 ALA . 6759 1 10 94 ILE . 6759 1 11 95 LYS . 6759 1 12 96 ASP . 6759 1 13 97 PRO . 6759 1 14 98 ALA . 6759 1 15 99 LEU . 6759 1 16 100 GLU . 6759 1 17 101 ASN . 6759 1 18 102 LYS . 6759 1 19 103 GLU . 6759 1 20 104 HIS . 6759 1 21 105 ASP . 6759 1 22 106 ILE . 6759 1 23 107 GLY . 6759 1 24 108 PRO . 6759 1 25 109 ARG . 6759 1 26 110 GLU . 6759 1 27 111 GLN . 6759 1 28 112 VAL . 6759 1 29 113 ASN . 6759 1 30 114 PHE . 6759 1 31 115 GLN . 6759 1 32 116 LEU . 6759 1 33 117 LEU . 6759 1 34 118 ASP . 6759 1 35 119 LYS . 6759 1 36 120 ASN . 6759 1 37 121 ASN . 6759 1 38 122 GLU . 6759 1 39 123 THR . 6759 1 40 124 GLN . 6759 1 41 125 TYR . 6759 1 42 126 TYR . 6759 1 43 127 HIS . 6759 1 44 128 PHE . 6759 1 45 129 PHE . 6759 1 46 130 SER . 6759 1 47 131 ILE . 6759 1 48 132 LYS . 6759 1 49 133 ASP . 6759 1 50 134 PRO . 6759 1 51 135 ALA . 6759 1 52 136 ASP . 6759 1 53 137 VAL . 6759 1 54 138 TYR . 6759 1 55 139 TYR . 6759 1 56 140 THR . 6759 1 57 141 LYS . 6759 1 58 142 LYS . 6759 1 59 143 LYS . 6759 1 60 144 ALA . 6759 1 61 145 GLU . 6759 1 62 146 VAL . 6759 1 63 147 GLU . 6759 1 64 148 LEU . 6759 1 65 149 ASP . 6759 1 66 150 ILE . 6759 1 67 151 ASN . 6759 1 68 152 THR . 6759 1 69 153 ALA . 6759 1 70 154 SER . 6759 1 71 155 THR . 6759 1 72 156 TRP . 6759 1 73 157 LYS . 6759 1 74 158 LYS . 6759 1 75 159 PHE . 6759 1 76 160 GLU . 6759 1 77 161 VAL . 6759 1 78 162 TYR . 6759 1 79 163 GLU . 6759 1 80 164 ASN . 6759 1 81 165 ASN . 6759 1 82 166 GLN . 6759 1 83 167 LYS . 6759 1 84 168 LEU . 6759 1 85 169 PRO . 6759 1 86 170 VAL . 6759 1 87 171 ARG . 6759 1 88 172 LEU . 6759 1 89 173 VAL . 6759 1 90 174 SER . 6759 1 91 175 TYR . 6759 1 92 176 SER . 6759 1 93 177 PRO . 6759 1 94 178 VAL . 6759 1 95 179 PRO . 6759 1 96 180 GLU . 6759 1 97 181 ASP . 6759 1 98 182 HIS . 6759 1 99 183 ALA . 6759 1 100 184 TYR . 6759 1 101 185 ILE . 6759 1 102 186 ARG . 6759 1 103 187 PHE . 6759 1 104 188 PRO . 6759 1 105 189 VAL . 6759 1 106 190 SER . 6759 1 107 191 ASP . 6759 1 108 192 GLY . 6759 1 109 193 THR . 6759 1 110 194 GLN . 6759 1 111 195 GLU . 6759 1 112 196 LEU . 6759 1 113 197 LYS . 6759 1 114 198 ILE . 6759 1 115 199 VAL . 6759 1 116 200 SER . 6759 1 117 201 SER . 6759 1 118 202 THR . 6759 1 119 203 GLN . 6759 1 120 204 ILE . 6759 1 121 205 ASP . 6759 1 122 206 ASP . 6759 1 123 207 GLY . 6759 1 124 208 GLU . 6759 1 125 209 GLU . 6759 1 126 210 THR . 6759 1 127 211 ASN . 6759 1 128 212 TYR . 6759 1 129 213 ASP . 6759 1 130 214 TYR . 6759 1 131 215 THR . 6759 1 132 216 LYS . 6759 1 133 217 LEU . 6759 1 134 218 VAL . 6759 1 135 219 PHE . 6759 1 136 220 ALA . 6759 1 137 221 LYS . 6759 1 138 222 PRO . 6759 1 139 223 ILE . 6759 1 140 224 TYR . 6759 1 141 225 ASN . 6759 1 142 226 ASP . 6759 1 143 227 PRO . 6759 1 144 228 SER . 6759 1 145 229 LEU . 6759 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 6759 1 . ALA 2 2 6759 1 . ASP 3 3 6759 1 . GLU 4 4 6759 1 . SER 5 5 6759 1 . LEU 6 6 6759 1 . LYS 7 7 6759 1 . ASP 8 8 6759 1 . ALA 9 9 6759 1 . ILE 10 10 6759 1 . LYS 11 11 6759 1 . ASP 12 12 6759 1 . PRO 13 13 6759 1 . ALA 14 14 6759 1 . LEU 15 15 6759 1 . GLU 16 16 6759 1 . ASN 17 17 6759 1 . LYS 18 18 6759 1 . GLU 19 19 6759 1 . HIS 20 20 6759 1 . ASP 21 21 6759 1 . ILE 22 22 6759 1 . GLY 23 23 6759 1 . PRO 24 24 6759 1 . ARG 25 25 6759 1 . GLU 26 26 6759 1 . GLN 27 27 6759 1 . VAL 28 28 6759 1 . ASN 29 29 6759 1 . PHE 30 30 6759 1 . GLN 31 31 6759 1 . LEU 32 32 6759 1 . LEU 33 33 6759 1 . ASP 34 34 6759 1 . LYS 35 35 6759 1 . ASN 36 36 6759 1 . ASN 37 37 6759 1 . GLU 38 38 6759 1 . THR 39 39 6759 1 . GLN 40 40 6759 1 . TYR 41 41 6759 1 . TYR 42 42 6759 1 . HIS 43 43 6759 1 . PHE 44 44 6759 1 . PHE 45 45 6759 1 . SER 46 46 6759 1 . ILE 47 47 6759 1 . LYS 48 48 6759 1 . ASP 49 49 6759 1 . PRO 50 50 6759 1 . ALA 51 51 6759 1 . ASP 52 52 6759 1 . VAL 53 53 6759 1 . TYR 54 54 6759 1 . TYR 55 55 6759 1 . THR 56 56 6759 1 . LYS 57 57 6759 1 . LYS 58 58 6759 1 . LYS 59 59 6759 1 . ALA 60 60 6759 1 . GLU 61 61 6759 1 . VAL 62 62 6759 1 . GLU 63 63 6759 1 . LEU 64 64 6759 1 . ASP 65 65 6759 1 . ILE 66 66 6759 1 . ASN 67 67 6759 1 . THR 68 68 6759 1 . ALA 69 69 6759 1 . SER 70 70 6759 1 . THR 71 71 6759 1 . TRP 72 72 6759 1 . LYS 73 73 6759 1 . LYS 74 74 6759 1 . PHE 75 75 6759 1 . GLU 76 76 6759 1 . VAL 77 77 6759 1 . TYR 78 78 6759 1 . GLU 79 79 6759 1 . ASN 80 80 6759 1 . ASN 81 81 6759 1 . GLN 82 82 6759 1 . LYS 83 83 6759 1 . LEU 84 84 6759 1 . PRO 85 85 6759 1 . VAL 86 86 6759 1 . ARG 87 87 6759 1 . LEU 88 88 6759 1 . VAL 89 89 6759 1 . SER 90 90 6759 1 . TYR 91 91 6759 1 . SER 92 92 6759 1 . PRO 93 93 6759 1 . VAL 94 94 6759 1 . PRO 95 95 6759 1 . GLU 96 96 6759 1 . ASP 97 97 6759 1 . HIS 98 98 6759 1 . ALA 99 99 6759 1 . TYR 100 100 6759 1 . ILE 101 101 6759 1 . ARG 102 102 6759 1 . PHE 103 103 6759 1 . PRO 104 104 6759 1 . VAL 105 105 6759 1 . SER 106 106 6759 1 . ASP 107 107 6759 1 . GLY 108 108 6759 1 . THR 109 109 6759 1 . GLN 110 110 6759 1 . GLU 111 111 6759 1 . LEU 112 112 6759 1 . LYS 113 113 6759 1 . ILE 114 114 6759 1 . VAL 115 115 6759 1 . SER 116 116 6759 1 . SER 117 117 6759 1 . THR 118 118 6759 1 . GLN 119 119 6759 1 . ILE 120 120 6759 1 . ASP 121 121 6759 1 . ASP 122 122 6759 1 . GLY 123 123 6759 1 . GLU 124 124 6759 1 . GLU 125 125 6759 1 . THR 126 126 6759 1 . ASN 127 127 6759 1 . TYR 128 128 6759 1 . ASP 129 129 6759 1 . TYR 130 130 6759 1 . THR 131 131 6759 1 . LYS 132 132 6759 1 . LEU 133 133 6759 1 . VAL 134 134 6759 1 . PHE 135 135 6759 1 . ALA 136 136 6759 1 . LYS 137 137 6759 1 . PRO 138 138 6759 1 . ILE 139 139 6759 1 . TYR 140 140 6759 1 . ASN 141 141 6759 1 . ASP 142 142 6759 1 . PRO 143 143 6759 1 . SER 144 144 6759 1 . LEU 145 145 6759 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 6759 _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 $NEAT_domain_polypeptide . 1280 organism . . polypeptide . . Bacteria . Staphylococcus aureus . . . . . . . . . . . . . 6759 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 6759 _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 $NEAT_domain_polypeptide . 'recombinant technology' . . . . . . . . . . . . . . . . 6759 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_NEAT_domain _Sample.Sf_category sample _Sample.Sf_framecode NEAT_domain _Sample.Entry_ID 6759 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; The NEAT protein was at 1mM concentration in 50mM sodium phospate buffer pH 6, 100mM NaCl, and 0.01% sodium azide ; _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'NEAT domain' '[U-13C; U-15N]' . . 1 $NEAT_domain_polypeptide . protein 1 . . mM . . . . 6759 1 2 'sodium phospate' . . . . . . buffer 50 . . mM . . . . 6759 1 3 NaCl . . . . . . salt 100 . . mM . . . . 6759 1 4 'sodium azide' . . . . . . 'antimicrobial agent' 0.01 . . % . . . . 6759 1 stop_ save_ ####################### # Sample conditions # ####################### save_NMR_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode NMR_conditions _Sample_condition_list.Entry_ID 6759 _Sample_condition_list.ID 1 _Sample_condition_list.Details '50mM sodium phosphate pH 6, 100mM NaCl, 0.01% sodium azide' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6 0.2 pH 6759 1 temperature 295 1 K 6759 1 stop_ save_ ############################ # Computer software used # ############################ save_nmrview _Software.Sf_category software _Software.Sf_framecode nmrview _Software.Entry_ID 6759 _Software.ID 1 _Software.Type . _Software.Name NMRView _Software.Version . _Software.DOI . _Software.Details 'Blevins, B. A. J. a. R. A. (1994) J. Biomol. NMR 4, 603-614' save_ save_Pipp _Software.Sf_category software _Software.Sf_framecode Pipp _Software.Entry_ID 6759 _Software.ID 2 _Software.Type . _Software.Name PIPP _Software.Version . _Software.DOI . _Software.Details ; Garrett , P. R., Gronenborn A.M., and Clore G.M. (1991) J. Magn. Reson 95, 214-220 ; save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_500MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 500MHz_spectrometer _NMR_spectrometer.Entry_ID 6759 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'cryoprobe equipped' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_600MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_spectrometer _NMR_spectrometer.Entry_ID 6759 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'cryoprobe equipped' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_800MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800MHz_spectrometer _NMR_spectrometer.Entry_ID 6759 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details 'cryoprobe equipped' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6759 _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 1H15N_HSQC no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 2 1H13C_HSQC no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . 3 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6759 1 3 '15N-edited NOESY' no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 4 HNHA no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 5 HNHB no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 6 HNCACB no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 7 CBCACONH no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 8 CCCONH no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 9 HNCA no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 10 HNCO no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 11 HNCACO no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 12 HBHACONH no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 13 '15N-edited TOCSY' no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 14 '13C-edited NOESY in D2O' no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 15 HCCH-TOCSY no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 16 HCCH-COSY no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 17 HNHN no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 18 '13C-edited NOESY in H2O' no . . . . . . . . . . 1 $NEAT_domain . . . 1 $NMR_conditions . . . . . . . . . . . . . . . . . . . . . 6759 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6759 _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 0.0 . indirect 0.251449530 . . . . . 6759 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . 6759 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . 6759 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_neatassign3.htm _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode neatassign3.htm _Assigned_chem_shift_list.Entry_ID 6759 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $NMR_conditions _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 1H15N_HSQC 1 $NEAT_domain domain 6759 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 ALA HA H 1 4.0510 . . . . . . . . 86 ALA HA . 6759 1 2 . 1 1 2 2 ALA HB1 H 1 1.4810 . . . . . . . . 86 ALA HB# . 6759 1 3 . 1 1 2 2 ALA HB2 H 1 1.4810 . . . . . . . . 86 ALA HB# . 6759 1 4 . 1 1 2 2 ALA HB3 H 1 1.4810 . . . . . . . . 86 ALA HB# . 6759 1 5 . 1 1 2 2 ALA C C 13 173.6590 . . . . . . . . 86 ALA C . 6759 1 6 . 1 1 2 2 ALA CA C 13 51.5630 . . . . . . . . 86 ALA CA . 6759 1 7 . 1 1 2 2 ALA CB C 13 18.7700 . . . . . . . . 86 ALA CB . 6759 1 8 . 1 1 3 3 ASP H H 1 8.7000 . . . . . . . . 87 ASP HN . 6759 1 9 . 1 1 3 3 ASP HA H 1 4.5240 . . . . . . . . 87 ASP HA . 6759 1 10 . 1 1 3 3 ASP HB2 H 1 2.6820 . . . . . . . . 87 ASP HB1|HB2 . 6759 1 11 . 1 1 3 3 ASP HB3 H 1 2.5840 . . . . . . . . 87 ASP HB2|HB1 . 6759 1 12 . 1 1 3 3 ASP C C 13 175.6250 . . . . . . . . 87 ASP C . 6759 1 13 . 1 1 3 3 ASP CA C 13 54.2300 . . . . . . . . 87 ASP CA . 6759 1 14 . 1 1 3 3 ASP CB C 13 40.4340 . . . . . . . . 87 ASP CB . 6759 1 15 . 1 1 3 3 ASP N N 15 119.6900 . . . . . . . . 87 ASP N . 6759 1 16 . 1 1 4 4 GLU H H 1 8.6030 . . . . . . . . 88 GLU HN . 6759 1 17 . 1 1 4 4 GLU HA H 1 4.2700 . . . . . . . . 88 GLU HA . 6759 1 18 . 1 1 4 4 GLU HB2 H 1 2.0200 . . . . . . . . 88 GLU HB1|HB2 . 6759 1 19 . 1 1 4 4 GLU HB3 H 1 1.9050 . . . . . . . . 88 GLU HB2|HB1 . 6759 1 20 . 1 1 4 4 GLU HG2 H 1 2.2660 . . . . . . . . 88 GLU HG1|HG2 . 6759 1 21 . 1 1 4 4 GLU C C 13 176.8250 . . . . . . . . 88 GLU C . 6759 1 22 . 1 1 4 4 GLU CA C 13 56.4530 . . . . . . . . 88 GLU CA . 6759 1 23 . 1 1 4 4 GLU CB C 13 29.7900 . . . . . . . . 88 GLU CB . 6759 1 24 . 1 1 4 4 GLU CG C 13 36.0200 . . . . . . . . 88 GLU CG . 6759 1 25 . 1 1 4 4 GLU N N 15 120.7680 . . . . . . . . 88 GLU N . 6759 1 26 . 1 1 5 5 SER H H 1 8.4430 . . . . . . . . 89 SER HN . 6759 1 27 . 1 1 5 5 SER HA H 1 4.5690 . . . . . . . . 89 SER HA . 6759 1 28 . 1 1 5 5 SER HB2 H 1 3.8220 . . . . . . . . 89 SER HB1|HB2 . 6759 1 29 . 1 1 5 5 SER C C 13 176.0570 . . . . . . . . 89 SER C . 6759 1 30 . 1 1 5 5 SER CA C 13 56.1470 . . . . . . . . 89 SER CA . 6759 1 31 . 1 1 5 5 SER CB C 13 63.0490 . . . . . . . . 89 SER CB . 6759 1 32 . 1 1 5 5 SER N N 15 117.6420 . . . . . . . . 89 SER N . 6759 1 33 . 1 1 6 6 LEU H H 1 9.6340 . . . . . . . . 90 LEU HN . 6759 1 34 . 1 1 6 6 LEU HA H 1 4.0110 . . . . . . . . 90 LEU HA . 6759 1 35 . 1 1 6 6 LEU HB2 H 1 1.6730 . . . . . . . . 90 LEU HB1|HB2 . 6759 1 36 . 1 1 6 6 LEU HB3 H 1 1.5160 . . . . . . . . 90 LEU HB2|HB2 . 6759 1 37 . 1 1 6 6 LEU HG H 1 1.5380 . . . . . . . . 90 LEU HG . 6759 1 38 . 1 1 6 6 LEU HD11 H 1 0.5670 . . . . . . . . 90 LEU HD1#|HD2# . 6759 1 39 . 1 1 6 6 LEU HD12 H 1 0.5670 . . . . . . . . 90 LEU HD1#|HD2# . 6759 1 40 . 1 1 6 6 LEU HD13 H 1 0.5670 . . . . . . . . 90 LEU HD1#|HD2# . 6759 1 41 . 1 1 6 6 LEU HD21 H 1 0.5310 . . . . . . . . 90 LEU HD2#|HD1# . 6759 1 42 . 1 1 6 6 LEU HD22 H 1 0.5310 . . . . . . . . 90 LEU HD2#|HD1# . 6759 1 43 . 1 1 6 6 LEU HD23 H 1 0.5310 . . . . . . . . 90 LEU HD2#|HD1# . 6759 1 44 . 1 1 6 6 LEU C C 13 178.6120 . . . . . . . . 90 LEU C . 6759 1 45 . 1 1 6 6 LEU CA C 13 58.9980 . . . . . . . . 90 LEU CA . 6759 1 46 . 1 1 6 6 LEU CB C 13 40.4340 . . . . . . . . 90 LEU CB . 6759 1 47 . 1 1 6 6 LEU CG C 13 27.0770 . . . . . . . . 90 LEU CG . 6759 1 48 . 1 1 6 6 LEU CD1 C 13 24.2650 . . . . . . . . 90 LEU CD2|CD1 . 6759 1 49 . 1 1 6 6 LEU CD2 C 13 24.2650 . . . . . . . . 90 LEU CD1|CD2 . 6759 1 50 . 1 1 6 6 LEU N N 15 111.6130 . . . . . . . . 90 LEU N . 6759 1 51 . 1 1 7 7 LYS H H 1 8.1480 . . . . . . . . 91 LYS HN . 6759 1 52 . 1 1 7 7 LYS HA H 1 3.9460 . . . . . . . . 91 LYS HA . 6759 1 53 . 1 1 7 7 LYS HB2 H 1 1.9800 . . . . . . . . 91 LYS HB1|HB2 . 6759 1 54 . 1 1 7 7 LYS HB3 H 1 1.7870 . . . . . . . . 91 LYS HB2|HB1 . 6759 1 55 . 1 1 7 7 LYS HG2 H 1 1.4730 . . . . . . . . 91 LYS HG1|HG2 . 6759 1 56 . 1 1 7 7 LYS HG3 H 1 1.1260 . . . . . . . . 91 LYS HG2|HG1 . 6759 1 57 . 1 1 7 7 LYS HD2 H 1 1.9770 . . . . . . . . 91 LYS HD1|HD2 . 6759 1 58 . 1 1 7 7 LYS HD3 H 1 1.7890 . . . . . . . . 91 LYS HD2|HD1 . 6759 1 59 . 1 1 7 7 LYS HE2 H 1 2.9450 . . . . . . . . 91 LYS HE1|HE2 . 6759 1 60 . 1 1 7 7 LYS C C 13 176.5180 . . . . . . . . 91 LYS C . 6759 1 61 . 1 1 7 7 LYS CA C 13 57.9320 . . . . . . . . 91 LYS CA . 6759 1 62 . 1 1 7 7 LYS CB C 13 30.6640 . . . . . . . . 91 LYS CB . 6759 1 63 . 1 1 7 7 LYS CG C 13 22.9450 . . . . . . . . 91 LYS CG . 6759 1 64 . 1 1 7 7 LYS CD C 13 30.9100 . . . . . . . . 91 LYS CD . 6759 1 65 . 1 1 7 7 LYS CE C 13 41.1700 . . . . . . . . 91 LYS CE . 6759 1 66 . 1 1 7 7 LYS N N 15 112.1940 . . . . . . . . 91 LYS N . 6759 1 67 . 1 1 8 8 ASP H H 1 7.1720 . . . . . . . . 92 ASP HN . 6759 1 68 . 1 1 8 8 ASP HA H 1 4.6610 . . . . . . . . 92 ASP HA . 6759 1 69 . 1 1 8 8 ASP HB2 H 1 2.6050 . . . . . . . . 92 ASP HB1|HB2 . 6759 1 70 . 1 1 8 8 ASP C C 13 178.2800 . . . . . . . . 92 ASP C . 6759 1 71 . 1 1 8 8 ASP CA C 13 55.6650 . . . . . . . . 92 ASP CA . 6759 1 72 . 1 1 8 8 ASP CB C 13 41.2000 . . . . . . . . 92 ASP CB . 6759 1 73 . 1 1 8 8 ASP N N 15 118.3120 . . . . . . . . 92 ASP N . 6759 1 74 . 1 1 9 9 ALA H H 1 8.2710 . . . . . . . . 93 ALA HN . 6759 1 75 . 1 1 9 9 ALA HA H 1 4.0230 . . . . . . . . 93 ALA HA . 6759 1 76 . 1 1 9 9 ALA HB1 H 1 1.4330 . . . . . . . . 93 ALA HB# . 6759 1 77 . 1 1 9 9 ALA HB2 H 1 1.4330 . . . . . . . . 93 ALA HB# . 6759 1 78 . 1 1 9 9 ALA HB3 H 1 1.4330 . . . . . . . . 93 ALA HB# . 6759 1 79 . 1 1 9 9 ALA C C 13 179.9910 . . . . . . . . 93 ALA C . 6759 1 80 . 1 1 9 9 ALA CA C 13 55.0440 . . . . . . . . 93 ALA CA . 6759 1 81 . 1 1 9 9 ALA CB C 13 18.6010 . . . . . . . . 93 ALA CB . 6759 1 82 . 1 1 9 9 ALA N N 15 127.0890 . . . . . . . . 93 ALA N . 6759 1 83 . 1 1 10 10 ILE H H 1 7.5050 . . . . . . . . 94 ILE HN . 6759 1 84 . 1 1 10 10 ILE HA H 1 3.5210 . . . . . . . . 94 ILE HA . 6759 1 85 . 1 1 10 10 ILE HB H 1 0.5620 . . . . . . . . 94 ILE HB . 6759 1 86 . 1 1 10 10 ILE HG12 H 1 1.0490 . . . . . . . . 94 ILE HG11|HG12 . 6759 1 87 . 1 1 10 10 ILE HG21 H 1 0.5100 . . . . . . . . 94 ILE HG2# . 6759 1 88 . 1 1 10 10 ILE HG22 H 1 0.5100 . . . . . . . . 94 ILE HG2# . 6759 1 89 . 1 1 10 10 ILE HG23 H 1 0.5100 . . . . . . . . 94 ILE HG2# . 6759 1 90 . 1 1 10 10 ILE HD11 H 1 0.3610 . . . . . . . . 94 ILE HD1# . 6759 1 91 . 1 1 10 10 ILE HD12 H 1 0.3610 . . . . . . . . 94 ILE HD1# . 6759 1 92 . 1 1 10 10 ILE HD13 H 1 0.3610 . . . . . . . . 94 ILE HD1# . 6759 1 93 . 1 1 10 10 ILE C C 13 174.9350 . . . . . . . . 94 ILE C . 6759 1 94 . 1 1 10 10 ILE CA C 13 62.5060 . . . . . . . . 94 ILE CA . 6759 1 95 . 1 1 10 10 ILE CB C 13 35.2830 . . . . . . . . 94 ILE CB . 6759 1 96 . 1 1 10 10 ILE CG1 C 13 23.4110 . . . . . . . . 94 ILE CG1 . 6759 1 97 . 1 1 10 10 ILE CG2 C 13 17.4100 . . . . . . . . 94 ILE CG2 . 6759 1 98 . 1 1 10 10 ILE CD1 C 13 13.5900 . . . . . . . . 94 ILE CD1 . 6759 1 99 . 1 1 10 10 ILE N N 15 128.2930 . . . . . . . . 94 ILE N . 6759 1 100 . 1 1 11 11 LYS H H 1 6.9630 . . . . . . . . 95 LYS HN . 6759 1 101 . 1 1 11 11 LYS HA H 1 4.0400 . . . . . . . . 95 LYS HA . 6759 1 102 . 1 1 11 11 LYS HB2 H 1 1.9280 . . . . . . . . 95 LYS HB1|HB2 . 6759 1 103 . 1 1 11 11 LYS HB3 H 1 1.7140 . . . . . . . . 95 LYS HB2|HB1 . 6759 1 104 . 1 1 11 11 LYS HG2 H 1 1.5320 . . . . . . . . 95 LYS HG1|HG2 . 6759 1 105 . 1 1 11 11 LYS HG3 H 1 1.3170 . . . . . . . . 95 LYS HG2|HG1 . 6759 1 106 . 1 1 11 11 LYS HD2 H 1 1.8260 . . . . . . . . 95 LYS HD1|HD2 . 6759 1 107 . 1 1 11 11 LYS HD3 H 1 1.7740 . . . . . . . . 95 LYS HD2|HD1 . 6759 1 108 . 1 1 11 11 LYS HE2 H 1 3.0600 . . . . . . . . 95 LYS HE1|HE2 . 6759 1 109 . 1 1 11 11 LYS HE3 H 1 3.0340 . . . . . . . . 95 LYS HE2|HE1 . 6759 1 110 . 1 1 11 11 LYS C C 13 176.6460 . . . . . . . . 95 LYS C . 6759 1 111 . 1 1 11 11 LYS CA C 13 56.1570 . . . . . . . . 95 LYS CA . 6759 1 112 . 1 1 11 11 LYS CB C 13 31.5900 . . . . . . . . 95 LYS CB . 6759 1 113 . 1 1 11 11 LYS CG C 13 25.4340 . . . . . . . . 95 LYS CG . 6759 1 114 . 1 1 11 11 LYS CD C 13 28.6840 . . . . . . . . 95 LYS CD . 6759 1 115 . 1 1 11 11 LYS CE C 13 42.1700 . . . . . . . . 95 LYS CE . 6759 1 116 . 1 1 11 11 LYS N N 15 118.1780 . . . . . . . . 95 LYS N . 6759 1 117 . 1 1 12 12 ASP H H 1 6.8360 . . . . . . . . 96 ASP HN . 6759 1 118 . 1 1 12 12 ASP HA H 1 4.7010 . . . . . . . . 96 ASP HA . 6759 1 119 . 1 1 12 12 ASP HB2 H 1 2.8120 . . . . . . . . 96 ASP HB1|HB2 . 6759 1 120 . 1 1 12 12 ASP HB3 H 1 2.6590 . . . . . . . . 96 ASP HB2|HB1 . 6759 1 121 . 1 1 12 12 ASP C C 13 176.6500 . . . . . . . . 96 ASP C . 6759 1 122 . 1 1 12 12 ASP CA C 13 51.4070 . . . . . . . . 96 ASP CA . 6759 1 123 . 1 1 12 12 ASP CB C 13 40.7940 . . . . . . . . 96 ASP CB . 6759 1 124 . 1 1 12 12 ASP N N 15 119.9200 . . . . . . . . 96 ASP N . 6759 1 125 . 1 1 13 13 PRO HA H 1 4.3620 . . . . . . . . 97 PRO HA . 6759 1 126 . 1 1 13 13 PRO HB2 H 1 2.4230 . . . . . . . . 97 PRO HB1|HB2 . 6759 1 127 . 1 1 13 13 PRO HB3 H 1 2.0060 . . . . . . . . 97 PRO HB2|HB1 . 6759 1 128 . 1 1 13 13 PRO HG2 H 1 2.0510 . . . . . . . . 97 PRO HG1|HG2 . 6759 1 129 . 1 1 13 13 PRO HD2 H 1 4.2490 . . . . . . . . 97 PRO HD1|HD2 . 6759 1 130 . 1 1 13 13 PRO HD3 H 1 3.9690 . . . . . . . . 97 PRO HD2|HD1 . 6759 1 131 . 1 1 13 13 PRO C C 13 176.2950 . . . . . . . . 97 PRO C . 6759 1 132 . 1 1 13 13 PRO CA C 13 64.2780 . . . . . . . . 97 PRO CA . 6759 1 133 . 1 1 13 13 PRO CB C 13 32.0990 . . . . . . . . 97 PRO CB . 6759 1 134 . 1 1 13 13 PRO CG C 13 27.1763 . . . . . . . . 97 PRO CG . 6759 1 135 . 1 1 13 13 PRO CD C 13 51.0900 . . . . . . . . 97 PRO CD . 6759 1 136 . 1 1 14 14 ALA H H 1 8.3800 . . . . . . . . 98 ALA HN . 6759 1 137 . 1 1 14 14 ALA HA H 1 4.1440 . . . . . . . . 98 ALA HA . 6759 1 138 . 1 1 14 14 ALA HB1 H 1 1.3880 . . . . . . . . 98 ALA HB# . 6759 1 139 . 1 1 14 14 ALA HB2 H 1 1.3880 . . . . . . . . 98 ALA HB# . 6759 1 140 . 1 1 14 14 ALA HB3 H 1 1.3880 . . . . . . . . 98 ALA HB# . 6759 1 141 . 1 1 14 14 ALA C C 13 179.3490 . . . . . . . . 98 ALA C . 6759 1 142 . 1 1 14 14 ALA CA C 13 53.8570 . . . . . . . . 98 ALA CA . 6759 1 143 . 1 1 14 14 ALA CB C 13 18.0070 . . . . . . . . 98 ALA CB . 6759 1 144 . 1 1 14 14 ALA N N 15 119.9860 . . . . . . . . 98 ALA N . 6759 1 145 . 1 1 15 15 LEU H H 1 7.4270 . . . . . . . . 99 LEU HN . 6759 1 146 . 1 1 15 15 LEU HA H 1 4.2340 . . . . . . . . 99 LEU HA . 6759 1 147 . 1 1 15 15 LEU HB2 H 1 1.8590 . . . . . . . . 99 LEU HB1|HB2 . 6759 1 148 . 1 1 15 15 LEU HB3 H 1 1.3870 . . . . . . . . 99 LEU HB2|HB1 . 6759 1 149 . 1 1 15 15 LEU HG H 1 1.5210 . . . . . . . . 99 LEU HG . 6759 1 150 . 1 1 15 15 LEU HD11 H 1 0.6380 . . . . . . . . 99 LEU HD1#|HD2# . 6759 1 151 . 1 1 15 15 LEU HD12 H 1 0.6380 . . . . . . . . 99 LEU HD1#|HD2# . 6759 1 152 . 1 1 15 15 LEU HD13 H 1 0.6380 . . . . . . . . 99 LEU HD1#|HD2# . 6759 1 153 . 1 1 15 15 LEU HD21 H 1 0.8330 . . . . . . . . 99 LEU HD2#|HD1# . 6759 1 154 . 1 1 15 15 LEU HD22 H 1 0.8330 . . . . . . . . 99 LEU HD2#|HD1# . 6759 1 155 . 1 1 15 15 LEU HD23 H 1 0.8330 . . . . . . . . 99 LEU HD2#|HD1# . 6759 1 156 . 1 1 15 15 LEU C C 13 177.9180 . . . . . . . . 99 LEU C . 6759 1 157 . 1 1 15 15 LEU CA C 13 54.0300 . . . . . . . . 99 LEU CA . 6759 1 158 . 1 1 15 15 LEU CB C 13 42.8260 . . . . . . . . 99 LEU CB . 6759 1 159 . 1 1 15 15 LEU CG C 13 26.1810 . . . . . . . . 99 LEU CG . 6759 1 160 . 1 1 15 15 LEU CD1 C 13 22.4830 . . . . . . . . 99 LEU CD1 . 6759 1 161 . 1 1 15 15 LEU CD2 C 13 26.1810 . . . . . . . . 99 LEU CD2 . 6759 1 162 . 1 1 15 15 LEU N N 15 115.2060 . . . . . . . . 99 LEU N . 6759 1 163 . 1 1 16 16 GLU H H 1 7.2380 . . . . . . . . 100 GLU HN . 6759 1 164 . 1 1 16 16 GLU HA H 1 4.3820 . . . . . . . . 100 GLU HA . 6759 1 165 . 1 1 16 16 GLU HB2 H 1 2.1110 . . . . . . . . 100 GLU HB1|HB2 . 6759 1 166 . 1 1 16 16 GLU HB3 H 1 2.0460 . . . . . . . . 100 GLU HB2|HB1 . 6759 1 167 . 1 1 16 16 GLU HG2 H 1 2.2390 . . . . . . . . 100 GLU HG1|HG2 . 6759 1 168 . 1 1 16 16 GLU HG3 H 1 2.1230 . . . . . . . . 100 GLU HG2|HG1 . 6759 1 169 . 1 1 16 16 GLU C C 13 177.2590 . . . . . . . . 100 GLU C . 6759 1 170 . 1 1 16 16 GLU CA C 13 57.5340 . . . . . . . . 100 GLU CA . 6759 1 171 . 1 1 16 16 GLU CB C 13 29.5680 . . . . . . . . 100 GLU CB . 6759 1 172 . 1 1 16 16 GLU CG C 13 37.3810 . . . . . . . . 100 GLU CG . 6759 1 173 . 1 1 16 16 GLU N N 15 121.6260 . . . . . . . . 100 GLU N . 6759 1 174 . 1 1 17 17 ASN H H 1 9.7200 . . . . . . . . 101 ASN HN . 6759 1 175 . 1 1 17 17 ASN HA H 1 4.4680 . . . . . . . . 101 ASN HA . 6759 1 176 . 1 1 17 17 ASN HB2 H 1 2.9640 . . . . . . . . 101 ASN HB1|HB2 . 6759 1 177 . 1 1 17 17 ASN HB3 H 1 2.8040 . . . . . . . . 101 ASN HB2|HB1 . 6759 1 178 . 1 1 17 17 ASN C C 13 174.4500 . . . . . . . . 101 ASN C . 6759 1 179 . 1 1 17 17 ASN CA C 13 54.1180 . . . . . . . . 101 ASN CA . 6759 1 180 . 1 1 17 17 ASN CB C 13 37.1220 . . . . . . . . 101 ASN CB . 6759 1 181 . 1 1 17 17 ASN N N 15 122.1630 . . . . . . . . 101 ASN N . 6759 1 182 . 1 1 18 18 LYS H H 1 7.3267 . . . . . . . . 102 LYS HN . 6759 1 183 . 1 1 18 18 LYS HA H 1 4.0640 . . . . . . . . 102 LYS HA . 6759 1 184 . 1 1 18 18 LYS HB2 H 1 1.9300 . . . . . . . . 102 LYS HB1|HB2 . 6759 1 185 . 1 1 18 18 LYS HB3 H 1 1.7010 . . . . . . . . 102 LYS HB2|HB1 . 6759 1 186 . 1 1 18 18 LYS HG2 H 1 1.5250 . . . . . . . . 102 LYS HG1|HG2 . 6759 1 187 . 1 1 18 18 LYS HE2 H 1 3.0450 . . . . . . . . 102 LYS HE1 . 6759 1 188 . 1 1 18 18 LYS C C 13 177.8700 . . . . . . . . 102 LYS C . 6759 1 189 . 1 1 18 18 LYS CA C 13 56.4660 . . . . . . . . 102 LYS CA . 6759 1 190 . 1 1 18 18 LYS CB C 13 33.0640 . . . . . . . . 102 LYS CB . 6759 1 191 . 1 1 18 18 LYS CG C 13 24.9710 . . . . . . . . 102 LYS CG . 6759 1 192 . 1 1 18 18 LYS CE C 13 41.7920 . . . . . . . . 102 LYS CE . 6759 1 193 . 1 1 18 18 LYS N N 15 120.5700 . . . . . . . . 102 LYS N . 6759 1 194 . 1 1 19 19 GLU H H 1 9.0540 . . . . . . . . 103 GLU HN . 6759 1 195 . 1 1 19 19 GLU HA H 1 4.0770 . . . . . . . . 103 GLU HA . 6759 1 196 . 1 1 19 19 GLU HB2 H 1 1.9610 . . . . . . . . 103 GLU HB1|HB2 . 6759 1 197 . 1 1 19 19 GLU HG2 H 1 2.2670 . . . . . . . . 103 GLU HG1|HG2 . 6759 1 198 . 1 1 19 19 GLU HG3 H 1 2.1810 . . . . . . . . 103 GLU HG2|HG1 . 6759 1 199 . 1 1 19 19 GLU C C 13 175.8800 . . . . . . . . 103 GLU C . 6759 1 200 . 1 1 19 19 GLU CA C 13 57.5680 . . . . . . . . 103 GLU CA . 6759 1 201 . 1 1 19 19 GLU CB C 13 29.2710 . . . . . . . . 103 GLU CB . 6759 1 202 . 1 1 19 19 GLU CG C 13 35.7850 . . . . . . . . 103 GLU CG . 6759 1 203 . 1 1 19 19 GLU N N 15 128.7730 . . . . . . . . 103 GLU N . 6759 1 204 . 1 1 20 20 HIS H H 1 8.8310 . . . . . . . . 104 HIS HN . 6759 1 205 . 1 1 20 20 HIS HA H 1 4.6500 . . . . . . . . 104 HIS HA . 6759 1 206 . 1 1 20 20 HIS HB2 H 1 3.0810 . . . . . . . . 104 HIS HB1|HB2 . 6759 1 207 . 1 1 20 20 HIS HB3 H 1 2.4720 . . . . . . . . 104 HIS HB2|HB1 . 6759 1 208 . 1 1 20 20 HIS C C 13 178.4840 . . . . . . . . 104 HIS C . 6759 1 209 . 1 1 20 20 HIS CA C 13 54.0500 . . . . . . . . 104 HIS CA . 6759 1 210 . 1 1 20 20 HIS CB C 13 28.0270 . . . . . . . . 104 HIS CB . 6759 1 211 . 1 1 20 20 HIS N N 15 119.9680 . . . . . . . . 104 HIS N . 6759 1 212 . 1 1 21 21 ASP H H 1 7.8200 . . . . . . . . 105 ASP HN . 6759 1 213 . 1 1 21 21 ASP HA H 1 4.9510 . . . . . . . . 105 ASP HA . 6759 1 214 . 1 1 21 21 ASP HB2 H 1 1.9530 . . . . . . . . 105 ASP HB1|HB2 . 6759 1 215 . 1 1 21 21 ASP HB3 H 1 2.4730 . . . . . . . . 105 ASP HB2|HB1 . 6759 1 216 . 1 1 21 21 ASP C C 13 175.9130 . . . . . . . . 105 ASP C . 6759 1 217 . 1 1 21 21 ASP CA C 13 52.2980 . . . . . . . . 105 ASP CA . 6759 1 218 . 1 1 21 21 ASP CB C 13 39.8290 . . . . . . . . 105 ASP CB . 6759 1 219 . 1 1 21 21 ASP N N 15 119.8300 . . . . . . . . 105 ASP N . 6759 1 220 . 1 1 22 22 ILE H H 1 7.3370 . . . . . . . . 106 ILE HN . 6759 1 221 . 1 1 22 22 ILE HA H 1 4.1370 . . . . . . . . 106 ILE HA . 6759 1 222 . 1 1 22 22 ILE HB H 1 1.6700 . . . . . . . . 106 ILE HB . 6759 1 223 . 1 1 22 22 ILE HG12 H 1 1.2850 . . . . . . . . 106 ILE HG11|HG12 . 6759 1 224 . 1 1 22 22 ILE HG13 H 1 0.9960 . . . . . . . . 106 ILE HG12|HG11 . 6759 1 225 . 1 1 22 22 ILE HG21 H 1 0.7810 . . . . . . . . 106 ILE HG2# . 6759 1 226 . 1 1 22 22 ILE HG22 H 1 0.7810 . . . . . . . . 106 ILE HG2# . 6759 1 227 . 1 1 22 22 ILE HG23 H 1 0.7810 . . . . . . . . 106 ILE HG2# . 6759 1 228 . 1 1 22 22 ILE HD11 H 1 0.6850 . . . . . . . . 106 ILE HD1# . 6759 1 229 . 1 1 22 22 ILE HD12 H 1 0.6850 . . . . . . . . 106 ILE HD1# . 6759 1 230 . 1 1 22 22 ILE HD13 H 1 0.6850 . . . . . . . . 106 ILE HD1# . 6759 1 231 . 1 1 22 22 ILE C C 13 176.2120 . . . . . . . . 106 ILE C . 6759 1 232 . 1 1 22 22 ILE CA C 13 60.4230 . . . . . . . . 106 ILE CA . 6759 1 233 . 1 1 22 22 ILE CB C 13 38.5100 . . . . . . . . 106 ILE CB . 6759 1 234 . 1 1 22 22 ILE CG1 C 13 26.9300 . . . . . . . . 106 ILE CG1 . 6759 1 235 . 1 1 22 22 ILE CG2 C 13 16.9710 . . . . . . . . 106 ILE CG2 . 6759 1 236 . 1 1 22 22 ILE CD1 C 13 12.2600 . . . . . . . . 106 ILE CD1 . 6759 1 237 . 1 1 22 22 ILE N N 15 120.0640 . . . . . . . . 106 ILE N . 6759 1 238 . 1 1 23 23 GLY H H 1 8.3690 . . . . . . . . 107 GLY HN . 6759 1 239 . 1 1 23 23 GLY HA2 H 1 4.5290 . . . . . . . . 107 GLY HA1|HA2 . 6759 1 240 . 1 1 23 23 GLY HA3 H 1 3.9110 . . . . . . . . 107 GLY HA2|HA1 . 6759 1 241 . 1 1 23 23 GLY C C 13 171.1160 . . . . . . . . 107 GLY C . 6759 1 242 . 1 1 23 23 GLY CA C 13 43.6340 . . . . . . . . 107 GLY CA . 6759 1 243 . 1 1 23 23 GLY N N 15 114.3500 . . . . . . . . 107 GLY N . 6759 1 244 . 1 1 24 24 PRO HA H 1 4.5950 . . . . . . . . 108 PRO HA . 6759 1 245 . 1 1 24 24 PRO HB2 H 1 2.2710 . . . . . . . . 108 PRO HB1|HB2 . 6759 1 246 . 1 1 24 24 PRO HB3 H 1 2.0800 . . . . . . . . 108 PRO HB2|HB1 . 6759 1 247 . 1 1 24 24 PRO HD2 H 1 3.5500 . . . . . . . . 108 PRO HD1|HD2 . 6759 1 248 . 1 1 24 24 PRO CA C 13 63.1680 . . . . . . . . 108 PRO CA . 6759 1 249 . 1 1 24 24 PRO CB C 13 32.3650 . . . . . . . . 108 PRO CB . 6759 1 250 . 1 1 24 24 PRO CD C 13 49.5120 . . . . . . . . 108 PRO CD . 6759 1 251 . 1 1 25 25 ARG H H 1 8.0980 . . . . . . . . 109 ARG HN . 6759 1 252 . 1 1 25 25 ARG HA H 1 4.7740 . . . . . . . . 109 ARG HA . 6759 1 253 . 1 1 25 25 ARG HB2 H 1 1.9150 . . . . . . . . 109 ARG HB1|HB2 . 6759 1 254 . 1 1 25 25 ARG C C 13 174.7920 . . . . . . . . 109 ARG C . 6759 1 255 . 1 1 25 25 ARG CA C 13 53.7820 . . . . . . . . 109 ARG CA . 6759 1 256 . 1 1 25 25 ARG CB C 13 31.8870 . . . . . . . . 109 ARG CB . 6759 1 257 . 1 1 25 25 ARG N N 15 118.7520 . . . . . . . . 109 ARG N . 6759 1 258 . 1 1 26 26 GLU H H 1 8.4340 . . . . . . . . 110 GLU HN . 6759 1 259 . 1 1 26 26 GLU HA H 1 4.5610 . . . . . . . . 110 GLU HA . 6759 1 260 . 1 1 26 26 GLU HB2 H 1 1.9380 . . . . . . . . 110 GLU HB1|HB2 . 6759 1 261 . 1 1 26 26 GLU HG2 H 1 2.0800 . . . . . . . . 110 GLU HG1|HG2 . 6759 1 262 . 1 1 26 26 GLU HG3 H 1 1.9390 . . . . . . . . 110 GLU HG2|HG1 . 6759 1 263 . 1 1 26 26 GLU C C 13 174.0160 . . . . . . . . 110 GLU C . 6759 1 264 . 1 1 26 26 GLU CA C 13 53.6340 . . . . . . . . 110 GLU CA . 6759 1 265 . 1 1 26 26 GLU CB C 13 32.7030 . . . . . . . . 110 GLU CB . 6759 1 266 . 1 1 26 26 GLU CG C 13 34.5370 . . . . . . . . 110 GLU CG . 6759 1 267 . 1 1 26 26 GLU N N 15 118.1480 . . . . . . . . 110 GLU N . 6759 1 268 . 1 1 27 27 GLN H H 1 8.4370 . . . . . . . . 111 GLN HN . 6759 1 269 . 1 1 27 27 GLN HA H 1 5.4570 . . . . . . . . 111 GLN HA . 6759 1 270 . 1 1 27 27 GLN HB2 H 1 1.9700 . . . . . . . . 111 GLN HB1 . 6759 1 271 . 1 1 27 27 GLN HB3 H 1 1.5320 . . . . . . . . 111 GLN HB2 . 6759 1 272 . 1 1 27 27 GLN HG2 H 1 2.3850 . . . . . . . . 111 GLN HG1|HG2 . 6759 1 273 . 1 1 27 27 GLN HG3 H 1 2.2120 . . . . . . . . 111 GLN HG2|HG1 . 6759 1 274 . 1 1 27 27 GLN C C 13 176.4620 . . . . . . . . 111 GLN C . 6759 1 275 . 1 1 27 27 GLN CA C 13 55.1180 . . . . . . . . 111 GLN CA . 6759 1 276 . 1 1 27 27 GLN CB C 13 30.4020 . . . . . . . . 111 GLN CB . 6759 1 277 . 1 1 27 27 GLN CG C 13 34.0520 . . . . . . . . 111 GLN CG . 6759 1 278 . 1 1 27 27 GLN N N 15 119.7080 . . . . . . . . 111 GLN N . 6759 1 279 . 1 1 28 28 VAL H H 1 8.9190 . . . . . . . . 112 VAL HN . 6759 1 280 . 1 1 28 28 VAL HA H 1 4.4210 . . . . . . . . 112 VAL HA . 6759 1 281 . 1 1 28 28 VAL HB H 1 1.8180 . . . . . . . . 112 VAL HB . 6759 1 282 . 1 1 28 28 VAL HG11 H 1 1.2900 . . . . . . . . 112 VAL HG1# . 6759 1 283 . 1 1 28 28 VAL HG12 H 1 1.2900 . . . . . . . . 112 VAL HG1# . 6759 1 284 . 1 1 28 28 VAL HG13 H 1 1.2900 . . . . . . . . 112 VAL HG1# . 6759 1 285 . 1 1 28 28 VAL HG21 H 1 0.7760 . . . . . . . . 112 VAL HG2# . 6759 1 286 . 1 1 28 28 VAL HG22 H 1 0.7760 . . . . . . . . 112 VAL HG2# . 6759 1 287 . 1 1 28 28 VAL HG23 H 1 0.7760 . . . . . . . . 112 VAL HG2# . 6759 1 288 . 1 1 28 28 VAL C C 13 174.5780 . . . . . . . . 112 VAL C . 6759 1 289 . 1 1 28 28 VAL CA C 13 61.4770 . . . . . . . . 112 VAL CA . 6759 1 290 . 1 1 28 28 VAL CB C 13 35.1270 . . . . . . . . 112 VAL CB . 6759 1 291 . 1 1 28 28 VAL CG1 C 13 21.5970 . . . . . . . . 112 VAL CG1 . 6759 1 292 . 1 1 28 28 VAL CG2 C 13 21.1830 . . . . . . . . 112 VAL CG2 . 6759 1 293 . 1 1 28 28 VAL N N 15 123.0320 . . . . . . . . 112 VAL N . 6759 1 294 . 1 1 29 29 ASN H H 1 8.7410 . . . . . . . . 113 ASN HN . 6759 1 295 . 1 1 29 29 ASN HA H 1 5.1640 . . . . . . . . 113 ASN HA . 6759 1 296 . 1 1 29 29 ASN HB2 H 1 3.1550 . . . . . . . . 113 ASN HB1|HB2 . 6759 1 297 . 1 1 29 29 ASN HB3 H 1 2.3540 . . . . . . . . 113 ASN HB2|HB1 . 6759 1 298 . 1 1 29 29 ASN C C 13 174.2670 . . . . . . . . 113 ASN C . 6759 1 299 . 1 1 29 29 ASN CA C 13 54.3700 . . . . . . . . 113 ASN CA . 6759 1 300 . 1 1 29 29 ASN CB C 13 40.6820 . . . . . . . . 113 ASN CB . 6759 1 301 . 1 1 29 29 ASN N N 15 125.8970 . . . . . . . . 113 ASN N . 6759 1 302 . 1 1 30 30 PHE H H 1 8.1080 . . . . . . . . 114 PHE HN . 6759 1 303 . 1 1 30 30 PHE HA H 1 5.4150 . . . . . . . . 114 PHE HA . 6759 1 304 . 1 1 30 30 PHE HB2 H 1 2.8330 . . . . . . . . 114 PHE HB1|HB2 . 6759 1 305 . 1 1 30 30 PHE HB3 H 1 2.4730 . . . . . . . . 114 PHE HB2|HB1 . 6759 1 306 . 1 1 30 30 PHE HD1 H 1 6.9000 . . . . . . . . 114 PHE HD1|HD2 . 6759 1 307 . 1 1 30 30 PHE HE1 H 1 7.4240 . . . . . . . . 114 PHE HE1|HE2 . 6759 1 308 . 1 1 30 30 PHE CA C 13 56.0830 . . . . . . . . 114 PHE CA . 6759 1 309 . 1 1 30 30 PHE CB C 13 42.4260 . . . . . . . . 114 PHE CB . 6759 1 310 . 1 1 30 30 PHE CD1 C 13 131.4300 . . . . . . . . 114 PHE CD1|CD2 . 6759 1 311 . 1 1 30 30 PHE CE1 C 13 130.6120 . . . . . . . . 114 PHE CE1|CE2 . 6759 1 312 . 1 1 30 30 PHE N N 15 114.2600 . . . . . . . . 114 PHE N . 6759 1 313 . 1 1 31 31 GLN H H 1 8.4850 . . . . . . . . 115 GLN HN . 6759 1 314 . 1 1 31 31 GLN HA H 1 4.7959 . . . . . . . . 115 GLN HA . 6759 1 315 . 1 1 31 31 GLN HB2 H 1 1.9510 . . . . . . . . 115 GLN HB1|HB2 . 6759 1 316 . 1 1 31 31 GLN HB3 H 1 1.6870 . . . . . . . . 115 GLN HB2|HB1 . 6759 1 317 . 1 1 31 31 GLN HG2 H 1 2.8570 . . . . . . . . 115 GLN HG1|HG2 . 6759 1 318 . 1 1 31 31 GLN HG3 H 1 2.2390 . . . . . . . . 115 GLN HG2|HG1 . 6759 1 319 . 1 1 31 31 GLN C C 13 174.8870 . . . . . . . . 115 GLN C . 6759 1 320 . 1 1 31 31 GLN CA C 13 53.4850 . . . . . . . . 115 GLN CA . 6759 1 321 . 1 1 31 31 GLN CB C 13 33.5200 . . . . . . . . 115 GLN CB . 6759 1 322 . 1 1 31 31 GLN CG C 13 34.1600 . . . . . . . . 115 GLN CG . 6759 1 323 . 1 1 31 31 GLN N N 15 116.8520 . . . . . . . . 115 GLN N . 6759 1 324 . 1 1 32 32 LEU H H 1 8.9190 . . . . . . . . 116 LEU HN . 6759 1 325 . 1 1 32 32 LEU HA H 1 5.2650 . . . . . . . . 116 LEU HA . 6759 1 326 . 1 1 32 32 LEU HB2 H 1 1.8520 . . . . . . . . 116 LEU HB1|HB2 . 6759 1 327 . 1 1 32 32 LEU HB3 H 1 0.9660 . . . . . . . . 116 LEU HB2|HB1 . 6759 1 328 . 1 1 32 32 LEU HG H 1 1.7180 . . . . . . . . 116 LEU HG . 6759 1 329 . 1 1 32 32 LEU HD11 H 1 1.0550 . . . . . . . . 116 LEU HD1#|HD2# . 6759 1 330 . 1 1 32 32 LEU HD12 H 1 1.0550 . . . . . . . . 116 LEU HD1#|HD2# . 6759 1 331 . 1 1 32 32 LEU HD13 H 1 1.0550 . . . . . . . . 116 LEU HD1#|HD2# . 6759 1 332 . 1 1 32 32 LEU HD21 H 1 0.6830 . . . . . . . . 116 LEU HD2#|HD1# . 6759 1 333 . 1 1 32 32 LEU HD22 H 1 0.6830 . . . . . . . . 116 LEU HD2#|HD1# . 6759 1 334 . 1 1 32 32 LEU HD23 H 1 0.6830 . . . . . . . . 116 LEU HD2#|HD1# . 6759 1 335 . 1 1 32 32 LEU C C 13 175.4360 . . . . . . . . 116 LEU C . 6759 1 336 . 1 1 32 32 LEU CA C 13 53.1890 . . . . . . . . 116 LEU CA . 6759 1 337 . 1 1 32 32 LEU CB C 13 44.3560 . . . . . . . . 116 LEU CB . 6759 1 338 . 1 1 32 32 LEU CG C 13 25.9320 . . . . . . . . 116 LEU CG . 6759 1 339 . 1 1 32 32 LEU CD1 C 13 28.1410 . . . . . . . . 116 LEU CD1 . 6759 1 340 . 1 1 32 32 LEU CD2 C 13 24.4140 . . . . . . . . 116 LEU CD2 . 6759 1 341 . 1 1 32 32 LEU N N 15 123.1300 . . . . . . . . 116 LEU N . 6759 1 342 . 1 1 33 33 LEU H H 1 9.1640 . . . . . . . . 117 LEU HN . 6759 1 343 . 1 1 33 33 LEU HA H 1 5.1150 . . . . . . . . 117 LEU HA . 6759 1 344 . 1 1 33 33 LEU HB2 H 1 1.6750 . . . . . . . . 117 LEU HB1|HB2 . 6759 1 345 . 1 1 33 33 LEU HB3 H 1 1.3880 . . . . . . . . 117 LEU HB2|HB1 . 6759 1 346 . 1 1 33 33 LEU HG H 1 1.3140 . . . . . . . . 117 LEU HG . 6759 1 347 . 1 1 33 33 LEU HD11 H 1 0.7130 . . . . . . . . 117 LEU HD1#|HD2# . 6759 1 348 . 1 1 33 33 LEU HD12 H 1 0.7130 . . . . . . . . 117 LEU HD1#|HD2# . 6759 1 349 . 1 1 33 33 LEU HD13 H 1 0.7130 . . . . . . . . 117 LEU HD1#|HD2# . 6759 1 350 . 1 1 33 33 LEU HD21 H 1 0.5050 . . . . . . . . 117 LEU HD2#|HD1# . 6759 1 351 . 1 1 33 33 LEU HD22 H 1 0.5050 . . . . . . . . 117 LEU HD2#|HD1# . 6759 1 352 . 1 1 33 33 LEU HD23 H 1 0.5050 . . . . . . . . 117 LEU HD2#|HD1# . 6759 1 353 . 1 1 33 33 LEU CA C 13 52.4460 . . . . . . . . 117 LEU CA . 6759 1 354 . 1 1 33 33 LEU CB C 13 46.3600 . . . . . . . . 117 LEU CB . 6759 1 355 . 1 1 33 33 LEU CG C 13 26.6220 . . . . . . . . 117 LEU CG . 6759 1 356 . 1 1 33 33 LEU CD1 C 13 25.1490 . . . . . . . . 117 LEU CD1 . 6759 1 357 . 1 1 33 33 LEU CD2 C 13 22.3790 . . . . . . . . 117 LEU CD2 . 6759 1 358 . 1 1 33 33 LEU N N 15 123.4830 . . . . . . . . 117 LEU N . 6759 1 359 . 1 1 34 34 ASP H H 1 9.3320 . . . . . . . . 118 ASP HN . 6759 1 360 . 1 1 34 34 ASP HA H 1 4.8440 . . . . . . . . 118 ASP HA . 6759 1 361 . 1 1 34 34 ASP HB2 H 1 3.5900 . . . . . . . . 118 ASP HB1|HB2 . 6759 1 362 . 1 1 34 34 ASP HB3 H 1 2.3820 . . . . . . . . 118 ASP HB2|HB1 . 6759 1 363 . 1 1 34 34 ASP C C 13 178.5140 . . . . . . . . 118 ASP C . 6759 1 364 . 1 1 34 34 ASP CA C 13 51.1850 . . . . . . . . 118 ASP CA . 6759 1 365 . 1 1 34 34 ASP CB C 13 41.4620 . . . . . . . . 118 ASP CB . 6759 1 366 . 1 1 34 34 ASP N N 15 121.1850 . . . . . . . . 118 ASP N . 6759 1 367 . 1 1 35 35 LYS H H 1 8.7210 . . . . . . . . 119 LYS HN . 6759 1 368 . 1 1 35 35 LYS HA H 1 3.8150 . . . . . . . . 119 LYS HA . 6759 1 369 . 1 1 35 35 LYS HB2 H 1 1.6050 . . . . . . . . 119 LYS HB1|HB2 . 6759 1 370 . 1 1 35 35 LYS HB3 H 1 1.5160 . . . . . . . . 119 LYS HB2|HB1 . 6759 1 371 . 1 1 35 35 LYS HG2 H 1 1.2380 . . . . . . . . 119 LYS HG1|HG2 . 6759 1 372 . 1 1 35 35 LYS HG3 H 1 1.0260 . . . . . . . . 119 LYS HG2|HG1 . 6759 1 373 . 1 1 35 35 LYS HD2 H 1 1.4360 . . . . . . . . 119 LYS HD1|HD2 . 6759 1 374 . 1 1 35 35 LYS HE2 H 1 2.8080 . . . . . . . . 119 LYS HE1|HE2 . 6759 1 375 . 1 1 35 35 LYS HE3 H 1 2.6930 . . . . . . . . 119 LYS HE2|HE1 . 6759 1 376 . 1 1 35 35 LYS C C 13 176.4140 . . . . . . . . 119 LYS C . 6759 1 377 . 1 1 35 35 LYS CA C 13 58.0870 . . . . . . . . 119 LYS CA . 6759 1 378 . 1 1 35 35 LYS CB C 13 31.4420 . . . . . . . . 119 LYS CB . 6759 1 379 . 1 1 35 35 LYS CG C 13 23.3600 . . . . . . . . 119 LYS CG . 6759 1 380 . 1 1 35 35 LYS CD C 13 28.4210 . . . . . . . . 119 LYS CD . 6759 1 381 . 1 1 35 35 LYS CE C 13 43.1070 . . . . . . . . 119 LYS CE . 6759 1 382 . 1 1 35 35 LYS N N 15 116.4500 . . . . . . . . 119 LYS N . 6759 1 383 . 1 1 36 36 ASN H H 1 8.3290 . . . . . . . . 120 ASN HN . 6759 1 384 . 1 1 36 36 ASN HA H 1 4.8310 . . . . . . . . 120 ASN HA . 6759 1 385 . 1 1 36 36 ASN HB2 H 1 2.9740 . . . . . . . . 120 ASN HB1|HB2 . 6759 1 386 . 1 1 36 36 ASN HB3 H 1 2.7880 . . . . . . . . 120 ASN HB2|HB1 . 6759 1 387 . 1 1 36 36 ASN C C 13 174.7200 . . . . . . . . 120 ASN C . 6759 1 388 . 1 1 36 36 ASN CA C 13 52.1490 . . . . . . . . 120 ASN CA . 6759 1 389 . 1 1 36 36 ASN CB C 13 38.5670 . . . . . . . . 120 ASN CB . 6759 1 390 . 1 1 36 36 ASN N N 15 118.0000 . . . . . . . . 120 ASN N . 6759 1 391 . 1 1 37 37 ASN H H 1 8.2900 . . . . . . . . 121 ASN HN . 6759 1 392 . 1 1 37 37 ASN HA H 1 4.3050 . . . . . . . . 121 ASN HA . 6759 1 393 . 1 1 37 37 ASN HB2 H 1 3.0310 . . . . . . . . 121 ASN HB1|HB2 . 6759 1 394 . 1 1 37 37 ASN HB3 H 1 2.8480 . . . . . . . . 121 ASN HB2|HB1 . 6759 1 395 . 1 1 37 37 ASN CA C 13 55.2670 . . . . . . . . 121 ASN CA . 6759 1 396 . 1 1 37 37 ASN CB C 13 36.6370 . . . . . . . . 121 ASN CB . 6759 1 397 . 1 1 37 37 ASN N N 15 113.5230 . . . . . . . . 121 ASN N . 6759 1 398 . 1 1 38 38 GLU H H 1 8.1890 . . . . . . . . 122 GLU HN . 6759 1 399 . 1 1 38 38 GLU HA H 1 4.4940 . . . . . . . . 122 GLU HA . 6759 1 400 . 1 1 38 38 GLU HB2 H 1 2.0070 . . . . . . . . 122 GLU HB1|HB2 . 6759 1 401 . 1 1 38 38 GLU HG2 H 1 2.2860 . . . . . . . . 122 GLU HG1 . 6759 1 402 . 1 1 38 38 GLU HG3 H 1 2.1450 . . . . . . . . 122 GLU HG2 . 6759 1 403 . 1 1 38 38 GLU CA C 13 53.9310 . . . . . . . . 122 GLU CA . 6759 1 404 . 1 1 38 38 GLU CB C 13 30.6990 . . . . . . . . 122 GLU CB . 6759 1 405 . 1 1 38 38 GLU CG C 13 36.4870 . . . . . . . . 122 GLU CG . 6759 1 406 . 1 1 38 38 GLU N N 15 118.8920 . . . . . . . . 122 GLU N . 6759 1 407 . 1 1 39 39 THR H H 1 8.3840 . . . . . . . . 123 THR HN . 6759 1 408 . 1 1 39 39 THR HA H 1 3.8130 . . . . . . . . 123 THR HA . 6759 1 409 . 1 1 39 39 THR HB H 1 3.0330 . . . . . . . . 123 THR HB . 6759 1 410 . 1 1 39 39 THR HG21 H 1 0.2210 . . . . . . . . 123 THR HG2# . 6759 1 411 . 1 1 39 39 THR HG22 H 1 0.2210 . . . . . . . . 123 THR HG2# . 6759 1 412 . 1 1 39 39 THR HG23 H 1 0.2210 . . . . . . . . 123 THR HG2# . 6759 1 413 . 1 1 39 39 THR C C 13 173.2650 . . . . . . . . 123 THR C . 6759 1 414 . 1 1 39 39 THR CA C 13 64.6190 . . . . . . . . 123 THR CA . 6759 1 415 . 1 1 39 39 THR CB C 13 68.6270 . . . . . . . . 123 THR CB . 6759 1 416 . 1 1 39 39 THR CG2 C 13 20.9580 . . . . . . . . 123 THR CG2 . 6759 1 417 . 1 1 39 39 THR N N 15 118.5260 . . . . . . . . 123 THR N . 6759 1 418 . 1 1 40 40 GLN H H 1 8.0640 . . . . . . . . 124 GLN HN . 6759 1 419 . 1 1 40 40 GLN HG2 H 1 2.2750 . . . . . . . . 124 GLN HG1|HG2 . 6759 1 420 . 1 1 40 40 GLN C C 13 171.3610 . . . . . . . . 124 GLN C . 6759 1 421 . 1 1 40 40 GLN CA C 13 61.0840 . . . . . . . . 124 GLN CA . 6759 1 422 . 1 1 40 40 GLN CB C 13 32.1600 . . . . . . . . 124 GLN CB . 6759 1 423 . 1 1 40 40 GLN N N 15 127.9970 . . . . . . . . 124 GLN N . 6759 1 424 . 1 1 41 41 TYR HA H 1 4.3660 . . . . . . . . 125 TYR HA . 6759 1 425 . 1 1 41 41 TYR HB2 H 1 2.6620 . . . . . . . . 125 TYR HB1 . 6759 1 426 . 1 1 41 41 TYR CA C 13 57.0700 . . . . . . . . 125 TYR CA . 6759 1 427 . 1 1 41 41 TYR CB C 13 40.1060 . . . . . . . . 125 TYR CB . 6759 1 428 . 1 1 42 42 TYR H H 1 7.9590 . . . . . . . . 126 TYR HN . 6759 1 429 . 1 1 42 42 TYR HA H 1 4.2840 . . . . . . . . 126 TYR HA . 6759 1 430 . 1 1 42 42 TYR HB2 H 1 2.7960 . . . . . . . . 126 TYR HB1|HB2 . 6759 1 431 . 1 1 42 42 TYR HD1 H 1 6.8310 . . . . . . . . 126 TYR HD1|HD2 . 6759 1 432 . 1 1 42 42 TYR HE1 H 1 6.5620 . . . . . . . . 126 TYR HE1|HD2 . 6759 1 433 . 1 1 42 42 TYR CA C 13 59.6460 . . . . . . . . 126 TYR CA . 6759 1 434 . 1 1 42 42 TYR CB C 13 39.9030 . . . . . . . . 126 TYR CB . 6759 1 435 . 1 1 42 42 TYR CD1 C 13 131.8880 . . . . . . . . 126 TYR CD1|CD2 . 6759 1 436 . 1 1 42 42 TYR CE1 C 13 118.0750 . . . . . . . . 126 TYR CE1|CE2 . 6759 1 437 . 1 1 42 42 TYR N N 15 116.7650 . . . . . . . . 126 TYR N . 6759 1 438 . 1 1 46 46 SER HA H 1 4.6120 . . . . . . . . 130 SER HA . 6759 1 439 . 1 1 46 46 SER HB2 H 1 3.7780 . . . . . . . . 130 SER HB1|HB2 . 6759 1 440 . 1 1 46 46 SER C C 13 173.4800 . . . . . . . . 130 SER C . 6759 1 441 . 1 1 46 46 SER CA C 13 58.1120 . . . . . . . . 130 SER CA . 6759 1 442 . 1 1 46 46 SER CB C 13 65.0490 . . . . . . . . 130 SER CB . 6759 1 443 . 1 1 47 47 ILE H H 1 7.8590 . . . . . . . . 131 ILE HN . 6759 1 444 . 1 1 47 47 ILE HA H 1 4.7610 . . . . . . . . 131 ILE HA . 6759 1 445 . 1 1 47 47 ILE HB H 1 1.7760 . . . . . . . . 131 ILE HB . 6759 1 446 . 1 1 47 47 ILE HG12 H 1 1.8760 . . . . . . . . 131 ILE HG11|HG12 . 6759 1 447 . 1 1 47 47 ILE HG21 H 1 0.8700 . . . . . . . . 131 ILE HG2# . 6759 1 448 . 1 1 47 47 ILE HG22 H 1 0.8700 . . . . . . . . 131 ILE HG2# . 6759 1 449 . 1 1 47 47 ILE HG23 H 1 0.8700 . . . . . . . . 131 ILE HG2# . 6759 1 450 . 1 1 47 47 ILE C C 13 175.2930 . . . . . . . . 131 ILE C . 6759 1 451 . 1 1 47 47 ILE CA C 13 60.3310 . . . . . . . . 131 ILE CA . 6759 1 452 . 1 1 47 47 ILE CB C 13 38.1230 . . . . . . . . 131 ILE CB . 6759 1 453 . 1 1 47 47 ILE CG1 C 13 28.1110 . . . . . . . . 131 ILE CG1 . 6759 1 454 . 1 1 47 47 ILE CG2 C 13 18.2360 . . . . . . . . 131 ILE CG2 . 6759 1 455 . 1 1 47 47 ILE N N 15 121.3300 . . . . . . . . 131 ILE N . 6759 1 456 . 1 1 48 48 LYS H H 1 8.1660 . . . . . . . . 132 LYS HN . 6759 1 457 . 1 1 48 48 LYS HA H 1 3.8820 . . . . . . . . 132 LYS HA . 6759 1 458 . 1 1 48 48 LYS HB2 H 1 2.2750 . . . . . . . . 132 LYS HB1|HB2 . 6759 1 459 . 1 1 48 48 LYS HB3 H 1 1.8520 . . . . . . . . 132 LYS HB2|HB1 . 6759 1 460 . 1 1 48 48 LYS HG2 H 1 1.4580 . . . . . . . . 132 LYS HG1|HG2 . 6759 1 461 . 1 1 48 48 LYS HG3 H 1 1.2510 . . . . . . . . 132 LYS HG2|HG1 . 6759 1 462 . 1 1 48 48 LYS HD2 H 1 1.7020 . . . . . . . . 132 LYS HD1|HD2 . 6759 1 463 . 1 1 48 48 LYS HE2 H 1 3.0430 . . . . . . . . 132 LYS HE1|HE2 . 6759 1 464 . 1 1 48 48 LYS C C 13 174.0760 . . . . . . . . 132 LYS C . 6759 1 465 . 1 1 48 48 LYS CA C 13 58.0070 . . . . . . . . 132 LYS CA . 6759 1 466 . 1 1 48 48 LYS CB C 13 33.0740 . . . . . . . . 132 LYS CB . 6759 1 467 . 1 1 48 48 LYS CG C 13 23.5790 . . . . . . . . 132 LYS CG . 6759 1 468 . 1 1 48 48 LYS CD C 13 28.6700 . . . . . . . . 132 LYS CD . 6759 1 469 . 1 1 48 48 LYS CE C 13 41.8620 . . . . . . . . 132 LYS CE . 6759 1 470 . 1 1 48 48 LYS N N 15 108.8100 . . . . . . . . 132 LYS N . 6759 1 471 . 1 1 49 49 ASP H H 1 8.0180 . . . . . . . . 133 ASP HN . 6759 1 472 . 1 1 49 49 ASP HA H 1 4.7930 . . . . . . . . 133 ASP HA . 6759 1 473 . 1 1 49 49 ASP HB2 H 1 2.2960 . . . . . . . . 133 ASP HB1|HB2 . 6759 1 474 . 1 1 49 49 ASP HB3 H 1 1.8320 . . . . . . . . 133 ASP HB2|HB1 . 6759 1 475 . 1 1 49 49 ASP C C 13 175.6710 . . . . . . . . 133 ASP C . 6759 1 476 . 1 1 49 49 ASP CA C 13 49.6260 . . . . . . . . 133 ASP CA . 6759 1 477 . 1 1 49 49 ASP CB C 13 43.4650 . . . . . . . . 133 ASP CB . 6759 1 478 . 1 1 49 49 ASP N N 15 126.0720 . . . . . . . . 133 ASP N . 6759 1 479 . 1 1 50 50 PRO HA H 1 5.4580 . . . . . . . . 134 PRO HA . 6759 1 480 . 1 1 50 50 PRO HB2 H 1 2.0340 . . . . . . . . 134 PRO HB1|HB2 . 6759 1 481 . 1 1 50 50 PRO HB3 H 1 1.9000 . . . . . . . . 134 PRO HB2|HB1 . 6759 1 482 . 1 1 50 50 PRO C C 13 176.0330 . . . . . . . . 134 PRO C . 6759 1 483 . 1 1 50 50 PRO CA C 13 62.6150 . . . . . . . . 134 PRO CA . 6759 1 484 . 1 1 50 50 PRO CB C 13 33.9650 . . . . . . . . 134 PRO CB . 6759 1 485 . 1 1 50 50 PRO CD C 13 49.6670 . . . . . . . . 134 PRO CD . 6759 1 486 . 1 1 51 51 ALA H H 1 8.4060 . . . . . . . . 135 ALA HN . 6759 1 487 . 1 1 51 51 ALA HA H 1 5.0010 . . . . . . . . 135 ALA HA . 6759 1 488 . 1 1 51 51 ALA HB1 H 1 1.6570 . . . . . . . . 135 ALA HB# . 6759 1 489 . 1 1 51 51 ALA HB2 H 1 1.6570 . . . . . . . . 135 ALA HB# . 6759 1 490 . 1 1 51 51 ALA HB3 H 1 1.6570 . . . . . . . . 135 ALA HB# . 6759 1 491 . 1 1 51 51 ALA C C 13 176.1520 . . . . . . . . 135 ALA C . 6759 1 492 . 1 1 51 51 ALA CA C 13 50.8700 . . . . . . . . 135 ALA CA . 6759 1 493 . 1 1 51 51 ALA CB C 13 19.7480 . . . . . . . . 135 ALA CB . 6759 1 494 . 1 1 51 51 ALA N N 15 118.8940 . . . . . . . . 135 ALA N . 6759 1 495 . 1 1 52 52 ASP H H 1 8.0000 . . . . . . . . 136 ASP HN . 6759 1 496 . 1 1 52 52 ASP HA H 1 5.0300 . . . . . . . . 136 ASP HA . 6759 1 497 . 1 1 52 52 ASP HB2 H 1 2.0900 . . . . . . . . 136 ASP HB1|HB2 . 6759 1 498 . 1 1 52 52 ASP HB3 H 1 2.6100 . . . . . . . . 136 ASP HB2|HB1 . 6759 1 499 . 1 1 52 52 ASP C C 13 173.5990 . . . . . . . . 136 ASP C . 6759 1 500 . 1 1 52 52 ASP CA C 13 54.0630 . . . . . . . . 136 ASP CA . 6759 1 501 . 1 1 52 52 ASP CB C 13 43.9590 . . . . . . . . 136 ASP CB . 6759 1 502 . 1 1 52 52 ASP N N 15 120.5000 . . . . . . . . 136 ASP N . 6759 1 503 . 1 1 53 53 VAL H H 1 8.8320 . . . . . . . . 137 VAL HN . 6759 1 504 . 1 1 53 53 VAL HA H 1 4.3430 . . . . . . . . 137 VAL HA . 6759 1 505 . 1 1 53 53 VAL HB H 1 1.6850 . . . . . . . . 137 VAL HB . 6759 1 506 . 1 1 53 53 VAL HG11 H 1 0.4770 . . . . . . . . 137 VAL HG1# . 6759 1 507 . 1 1 53 53 VAL HG12 H 1 0.4770 . . . . . . . . 137 VAL HG1# . 6759 1 508 . 1 1 53 53 VAL HG13 H 1 0.4770 . . . . . . . . 137 VAL HG1# . 6759 1 509 . 1 1 53 53 VAL HG21 H 1 0.5940 . . . . . . . . 137 VAL HG2# . 6759 1 510 . 1 1 53 53 VAL HG22 H 1 0.5940 . . . . . . . . 137 VAL HG2# . 6759 1 511 . 1 1 53 53 VAL HG23 H 1 0.5940 . . . . . . . . 137 VAL HG2# . 6759 1 512 . 1 1 53 53 VAL C C 13 174.0170 . . . . . . . . 137 VAL C . 6759 1 513 . 1 1 53 53 VAL CA C 13 60.8780 . . . . . . . . 137 VAL CA . 6759 1 514 . 1 1 53 53 VAL CB C 13 32.3670 . . . . . . . . 137 VAL CB . 6759 1 515 . 1 1 53 53 VAL CG1 C 13 21.2030 . . . . . . . . 137 VAL CG1 . 6759 1 516 . 1 1 53 53 VAL CG2 C 13 20.7050 . . . . . . . . 137 VAL CG2 . 6759 1 517 . 1 1 53 53 VAL N N 15 122.9120 . . . . . . . . 137 VAL N . 6759 1 518 . 1 1 54 54 TYR H H 1 9.2900 . . . . . . . . 138 TYR HN . 6759 1 519 . 1 1 54 54 TYR HA H 1 4.2250 . . . . . . . . 138 TYR HA . 6759 1 520 . 1 1 54 54 TYR HB2 H 1 2.8750 . . . . . . . . 138 TYR HB1|HB2 . 6759 1 521 . 1 1 54 54 TYR HB3 H 1 2.6280 . . . . . . . . 138 TYR HB2|HB1 . 6759 1 522 . 1 1 54 54 TYR HD1 H 1 6.7820 . . . . . . . . 138 TYR HD1|HD2 . 6759 1 523 . 1 1 54 54 TYR HE1 H 1 6.2940 . . . . . . . . 138 TYR HE1|HE2 . 6759 1 524 . 1 1 54 54 TYR C C 13 174.0290 . . . . . . . . 138 TYR C . 6759 1 525 . 1 1 54 54 TYR CA C 13 57.4910 . . . . . . . . 138 TYR CA . 6759 1 526 . 1 1 54 54 TYR CB C 13 39.6650 . . . . . . . . 138 TYR CB . 6759 1 527 . 1 1 54 54 TYR CD1 C 13 132.1530 . . . . . . . . 138 TYR CD1|CD2 . 6759 1 528 . 1 1 54 54 TYR CE1 C 13 117.4830 . . . . . . . . 138 TYR CE1|CE2 . 6759 1 529 . 1 1 54 54 TYR N N 15 125.1000 . . . . . . . . 138 TYR N . 6759 1 530 . 1 1 55 55 TYR H H 1 7.3050 . . . . . . . . 139 TYR HN . 6759 1 531 . 1 1 55 55 TYR HA H 1 5.2980 . . . . . . . . 139 TYR HA . 6759 1 532 . 1 1 55 55 TYR HB2 H 1 3.3230 . . . . . . . . 139 TYR HB1|HB2 . 6759 1 533 . 1 1 55 55 TYR HB3 H 1 2.5390 . . . . . . . . 139 TYR HB2|HB1 . 6759 1 534 . 1 1 55 55 TYR HD1 H 1 7.0680 . . . . . . . . 139 TYR HD1|HD2 . 6759 1 535 . 1 1 55 55 TYR HE1 H 1 6.7100 . . . . . . . . 139 TYR HE1|HE2 . 6759 1 536 . 1 1 55 55 TYR C C 13 177.6040 . . . . . . . . 139 TYR C . 6759 1 537 . 1 1 55 55 TYR CA C 13 55.1930 . . . . . . . . 139 TYR CA . 6759 1 538 . 1 1 55 55 TYR CB C 13 38.1960 . . . . . . . . 139 TYR CB . 6759 1 539 . 1 1 55 55 TYR CD1 C 13 131.2280 . . . . . . . . 139 TYR CD1|CD2 . 6759 1 540 . 1 1 55 55 TYR CE1 C 13 117.9250 . . . . . . . . 139 TYR CE1|CE2 . 6759 1 541 . 1 1 55 55 TYR N N 15 121.0070 . . . . . . . . 139 TYR N . 6759 1 542 . 1 1 56 56 THR H H 1 8.3580 . . . . . . . . 140 THR HN . 6759 1 543 . 1 1 56 56 THR HA H 1 4.9240 . . . . . . . . 140 THR HA . 6759 1 544 . 1 1 56 56 THR HB H 1 4.4750 . . . . . . . . 140 THR HB . 6759 1 545 . 1 1 56 56 THR HG21 H 1 1.1690 . . . . . . . . 140 THR HG2# . 6759 1 546 . 1 1 56 56 THR HG22 H 1 1.1690 . . . . . . . . 140 THR HG2# . 6759 1 547 . 1 1 56 56 THR HG23 H 1 1.1690 . . . . . . . . 140 THR HG2# . 6759 1 548 . 1 1 56 56 THR C C 13 174.6970 . . . . . . . . 140 THR C . 6759 1 549 . 1 1 56 56 THR CA C 13 60.0910 . . . . . . . . 140 THR CA . 6759 1 550 . 1 1 56 56 THR CB C 13 71.5210 . . . . . . . . 140 THR CB . 6759 1 551 . 1 1 56 56 THR CG2 C 13 19.3040 . . . . . . . . 140 THR CG2 . 6759 1 552 . 1 1 56 56 THR N N 15 112.5880 . . . . . . . . 140 THR N . 6759 1 553 . 1 1 57 57 LYS H H 1 8.3750 . . . . . . . . 141 LYS HN . 6759 1 554 . 1 1 57 57 LYS HA H 1 4.2870 . . . . . . . . 141 LYS HA . 6759 1 555 . 1 1 57 57 LYS HB2 H 1 1.9830 . . . . . . . . 141 LYS HB1|HB2 . 6759 1 556 . 1 1 57 57 LYS HB3 H 1 1.7720 . . . . . . . . 141 LYS HB2|HB1 . 6759 1 557 . 1 1 57 57 LYS HE2 H 1 2.9820 . . . . . . . . 141 LYS HE1 . 6759 1 558 . 1 1 57 57 LYS HE3 H 1 2.9450 . . . . . . . . 141 LYS HE2 . 6759 1 559 . 1 1 57 57 LYS C C 13 177.3690 . . . . . . . . 141 LYS C . 6759 1 560 . 1 1 57 57 LYS CA C 13 56.7390 . . . . . . . . 141 LYS CA . 6759 1 561 . 1 1 57 57 LYS CB C 13 31.5620 . . . . . . . . 141 LYS CB . 6759 1 562 . 1 1 57 57 LYS CE C 13 41.6130 . . . . . . . . 141 LYS CE . 6759 1 563 . 1 1 57 57 LYS N N 15 116.5580 . . . . . . . . 141 LYS N . 6759 1 564 . 1 1 58 58 LYS H H 1 8.3600 . . . . . . . . 142 LYS HN . 6759 1 565 . 1 1 58 58 LYS HA H 1 4.3940 . . . . . . . . 142 LYS HA . 6759 1 566 . 1 1 58 58 LYS HB2 H 1 1.8060 . . . . . . . . 142 LYS HB1|HB2 . 6759 1 567 . 1 1 58 58 LYS C C 13 174.0760 . . . . . . . . 142 LYS C . 6759 1 568 . 1 1 58 58 LYS CA C 13 56.8190 . . . . . . . . 142 LYS CA . 6759 1 569 . 1 1 58 58 LYS CB C 13 32.7530 . . . . . . . . 142 LYS CB . 6759 1 570 . 1 1 58 58 LYS CG C 13 25.0290 . . . . . . . . 142 LYS CG . 6759 1 571 . 1 1 58 58 LYS CD C 13 28.9300 . . . . . . . . 142 LYS CD . 6759 1 572 . 1 1 58 58 LYS CE C 13 42.1760 . . . . . . . . 142 LYS CE . 6759 1 573 . 1 1 58 58 LYS N N 15 120.1200 . . . . . . . . 142 LYS N . 6759 1 574 . 1 1 59 59 LYS H H 1 7.1070 . . . . . . . . 143 LYS HN . 6759 1 575 . 1 1 59 59 LYS HA H 1 4.6750 . . . . . . . . 143 LYS HA . 6759 1 576 . 1 1 59 59 LYS HB2 H 1 2.1190 . . . . . . . . 143 LYS HB1|HB2 . 6759 1 577 . 1 1 59 59 LYS HB3 H 1 1.4920 . . . . . . . . 143 LYS HB2|HB1 . 6759 1 578 . 1 1 59 59 LYS HG2 H 1 1.3950 . . . . . . . . 143 LYS HG1|HG2 . 6759 1 579 . 1 1 59 59 LYS HG3 H 1 1.3460 . . . . . . . . 143 LYS HG2|HG1 . 6759 1 580 . 1 1 59 59 LYS HD2 H 1 1.5150 . . . . . . . . 143 LYS HD1|HD2 . 6759 1 581 . 1 1 59 59 LYS HD3 H 1 1.4270 . . . . . . . . 143 LYS HD2|HD1 . 6759 1 582 . 1 1 59 59 LYS HE2 H 1 2.9450 . . . . . . . . 143 LYS HE1|HE2 . 6759 1 583 . 1 1 59 59 LYS HE3 H 1 2.9020 . . . . . . . . 143 LYS HE2|HE1 . 6759 1 584 . 1 1 59 59 LYS C C 13 176.9390 . . . . . . . . 143 LYS C . 6759 1 585 . 1 1 59 59 LYS CA C 13 54.9330 . . . . . . . . 143 LYS CA . 6759 1 586 . 1 1 59 59 LYS CB C 13 35.5240 . . . . . . . . 143 LYS CB . 6759 1 587 . 1 1 59 59 LYS CG C 13 25.6250 . . . . . . . . 143 LYS CG . 6759 1 588 . 1 1 59 59 LYS CD C 13 29.6610 . . . . . . . . 143 LYS CD . 6759 1 589 . 1 1 59 59 LYS CE C 13 41.7930 . . . . . . . . 143 LYS CE . 6759 1 590 . 1 1 59 59 LYS N N 15 118.0500 . . . . . . . . 143 LYS N . 6759 1 591 . 1 1 60 60 ALA H H 1 9.0480 . . . . . . . . 144 ALA HN . 6759 1 592 . 1 1 60 60 ALA HA H 1 4.4900 . . . . . . . . 144 ALA HA . 6759 1 593 . 1 1 60 60 ALA HB1 H 1 1.0670 . . . . . . . . 144 ALA HB# . 6759 1 594 . 1 1 60 60 ALA HB2 H 1 1.0670 . . . . . . . . 144 ALA HB# . 6759 1 595 . 1 1 60 60 ALA HB3 H 1 1.0670 . . . . . . . . 144 ALA HB# . 6759 1 596 . 1 1 60 60 ALA C C 13 176.9300 . . . . . . . . 144 ALA C . 6759 1 597 . 1 1 60 60 ALA CA C 13 52.3870 . . . . . . . . 144 ALA CA . 6759 1 598 . 1 1 60 60 ALA CB C 13 17.8210 . . . . . . . . 144 ALA CB . 6759 1 599 . 1 1 60 60 ALA N N 15 128.2610 . . . . . . . . 144 ALA N . 6759 1 600 . 1 1 61 61 GLU H H 1 8.9380 . . . . . . . . 145 GLU HN . 6759 1 601 . 1 1 61 61 GLU HA H 1 4.9520 . . . . . . . . 145 GLU HA . 6759 1 602 . 1 1 61 61 GLU HB2 H 1 1.7200 . . . . . . . . 145 GLU HB1|HB2 . 6759 1 603 . 1 1 61 61 GLU HB3 H 1 1.5120 . . . . . . . . 145 GLU HB2|HB1 . 6759 1 604 . 1 1 61 61 GLU HG2 H 1 2.2140 . . . . . . . . 145 GLU HG1|HG2 . 6759 1 605 . 1 1 61 61 GLU HG3 H 1 1.7580 . . . . . . . . 145 GLU HG2|HG1 . 6759 1 606 . 1 1 61 61 GLU C C 13 175.2430 . . . . . . . . 145 GLU C . 6759 1 607 . 1 1 61 61 GLU CA C 13 53.7080 . . . . . . . . 145 GLU CA . 6759 1 608 . 1 1 61 61 GLU CB C 13 32.0350 . . . . . . . . 145 GLU CB . 6759 1 609 . 1 1 61 61 GLU CG C 13 36.8120 . . . . . . . . 145 GLU CG . 6759 1 610 . 1 1 61 61 GLU N N 15 117.5420 . . . . . . . . 145 GLU N . 6759 1 611 . 1 1 62 62 VAL H H 1 8.0870 . . . . . . . . 146 VAL HN . 6759 1 612 . 1 1 62 62 VAL HA H 1 4.0220 . . . . . . . . 146 VAL HA . 6759 1 613 . 1 1 62 62 VAL HB H 1 0.9690 . . . . . . . . 146 VAL HB . 6759 1 614 . 1 1 62 62 VAL HG11 H 1 0.7240 . . . . . . . . 146 VAL HG1# . 6759 1 615 . 1 1 62 62 VAL HG12 H 1 0.7240 . . . . . . . . 146 VAL HG1# . 6759 1 616 . 1 1 62 62 VAL HG13 H 1 0.7240 . . . . . . . . 146 VAL HG1# . 6759 1 617 . 1 1 62 62 VAL HG21 H 1 0.5930 . . . . . . . . 146 VAL HG2# . 6759 1 618 . 1 1 62 62 VAL HG22 H 1 0.5930 . . . . . . . . 146 VAL HG2# . 6759 1 619 . 1 1 62 62 VAL HG23 H 1 0.5930 . . . . . . . . 146 VAL HG2# . 6759 1 620 . 1 1 62 62 VAL C C 13 175.2460 . . . . . . . . 146 VAL C . 6759 1 621 . 1 1 62 62 VAL CA C 13 61.5760 . . . . . . . . 146 VAL CA . 6759 1 622 . 1 1 62 62 VAL CB C 13 32.1100 . . . . . . . . 146 VAL CB . 6759 1 623 . 1 1 62 62 VAL CG1 C 13 22.1980 . . . . . . . . 146 VAL CG1 . 6759 1 624 . 1 1 62 62 VAL CG2 C 13 21.5660 . . . . . . . . 146 VAL CG2 . 6759 1 625 . 1 1 62 62 VAL N N 15 124.8420 . . . . . . . . 146 VAL N . 6759 1 626 . 1 1 63 63 GLU H H 1 9.1810 . . . . . . . . 147 GLU HN . 6759 1 627 . 1 1 63 63 GLU HA H 1 5.7730 . . . . . . . . 147 GLU HA . 6759 1 628 . 1 1 63 63 GLU HB2 H 1 1.7780 . . . . . . . . 147 GLU HB1|HB2 . 6759 1 629 . 1 1 63 63 GLU HG2 H 1 2.1720 . . . . . . . . 147 GLU HG1|HG2 . 6759 1 630 . 1 1 63 63 GLU HG3 H 1 2.0980 . . . . . . . . 147 GLU HG2|HG1 . 6759 1 631 . 1 1 63 63 GLU CA C 13 53.1890 . . . . . . . . 147 GLU CA . 6759 1 632 . 1 1 63 63 GLU CB C 13 34.2620 . . . . . . . . 147 GLU CB . 6759 1 633 . 1 1 63 63 GLU CG C 13 38.6650 . . . . . . . . 147 GLU CG . 6759 1 634 . 1 1 63 63 GLU N N 15 125.7200 . . . . . . . . 147 GLU N . 6759 1 635 . 1 1 64 64 LEU H H 1 8.5850 . . . . . . . . 148 LEU HN . 6759 1 636 . 1 1 64 64 LEU HA H 1 5.3140 . . . . . . . . 148 LEU HA . 6759 1 637 . 1 1 64 64 LEU HB2 H 1 1.4660 . . . . . . . . 148 LEU HB1|HB2 . 6759 1 638 . 1 1 64 64 LEU HB3 H 1 1.0300 . . . . . . . . 148 LEU HB2|HB1 . 6759 1 639 . 1 1 64 64 LEU HG H 1 1.5790 . . . . . . . . 148 LEU HG . 6759 1 640 . 1 1 64 64 LEU HD11 H 1 0.7630 . . . . . . . . 148 LEU HD1#|HD2# . 6759 1 641 . 1 1 64 64 LEU HD12 H 1 0.7630 . . . . . . . . 148 LEU HD1#|HD2# . 6759 1 642 . 1 1 64 64 LEU HD13 H 1 0.7630 . . . . . . . . 148 LEU HD1#|HD2# . 6759 1 643 . 1 1 64 64 LEU HD21 H 1 0.6400 . . . . . . . . 148 LEU HD2#|HD2# . 6759 1 644 . 1 1 64 64 LEU HD22 H 1 0.6400 . . . . . . . . 148 LEU HD2#|HD2# . 6759 1 645 . 1 1 64 64 LEU HD23 H 1 0.6400 . . . . . . . . 148 LEU HD2#|HD2# . 6759 1 646 . 1 1 64 64 LEU C C 13 174.2190 . . . . . . . . 148 LEU C . 6759 1 647 . 1 1 64 64 LEU CA C 13 52.0010 . . . . . . . . 148 LEU CA . 6759 1 648 . 1 1 64 64 LEU CB C 13 43.4650 . . . . . . . . 148 LEU CB . 6759 1 649 . 1 1 64 64 LEU CG C 13 26.1370 . . . . . . . . 148 LEU CG . 6759 1 650 . 1 1 64 64 LEU CD1 C 13 24.7300 . . . . . . . . 148 LEU CD1 . 6759 1 651 . 1 1 64 64 LEU CD2 C 13 21.8350 . . . . . . . . 148 LEU CD2 . 6759 1 652 . 1 1 64 64 LEU N N 15 125.1800 . . . . . . . . 148 LEU N . 6759 1 653 . 1 1 65 65 ASP H H 1 9.1620 . . . . . . . . 149 ASP HN . 6759 1 654 . 1 1 65 65 ASP HA H 1 4.5260 . . . . . . . . 149 ASP HA . 6759 1 655 . 1 1 65 65 ASP HB2 H 1 3.1360 . . . . . . . . 149 ASP HB1|HB2 . 6759 1 656 . 1 1 65 65 ASP HB3 H 1 2.8100 . . . . . . . . 149 ASP HB2|HB1 . 6759 1 657 . 1 1 65 65 ASP C C 13 175.6010 . . . . . . . . 149 ASP C . 6759 1 658 . 1 1 65 65 ASP CA C 13 52.0010 . . . . . . . . 149 ASP CA . 6759 1 659 . 1 1 65 65 ASP CB C 13 41.4620 . . . . . . . . 149 ASP CB . 6759 1 660 . 1 1 65 65 ASP N N 15 123.3400 . . . . . . . . 149 ASP N . 6759 1 661 . 1 1 66 66 ILE H H 1 8.6390 . . . . . . . . 150 ILE HN . 6759 1 662 . 1 1 66 66 ILE HA H 1 4.0050 . . . . . . . . 150 ILE HA . 6759 1 663 . 1 1 66 66 ILE HB H 1 1.1960 . . . . . . . . 150 ILE HB . 6759 1 664 . 1 1 66 66 ILE HG12 H 1 0.2270 . . . . . . . . 150 ILE HG11|HG12 . 6759 1 665 . 1 1 66 66 ILE HG21 H 1 0.0250 . . . . . . . . 150 ILE HG2# . 6759 1 666 . 1 1 66 66 ILE HG22 H 1 0.0250 . . . . . . . . 150 ILE HG2# . 6759 1 667 . 1 1 66 66 ILE HG23 H 1 0.0250 . . . . . . . . 150 ILE HG2# . 6759 1 668 . 1 1 66 66 ILE HD11 H 1 -0.4830 . . . . . . . . 150 ILE HD1# . 6759 1 669 . 1 1 66 66 ILE HD12 H 1 -0.4830 . . . . . . . . 150 ILE HD1# . 6759 1 670 . 1 1 66 66 ILE HD13 H 1 -0.4830 . . . . . . . . 150 ILE HD1# . 6759 1 671 . 1 1 66 66 ILE CA C 13 59.9430 . . . . . . . . 150 ILE CA . 6759 1 672 . 1 1 66 66 ILE CB C 13 39.3830 . . . . . . . . 150 ILE CB . 6759 1 673 . 1 1 66 66 ILE CG1 C 13 26.6840 . . . . . . . . 150 ILE CG1 . 6759 1 674 . 1 1 66 66 ILE CG2 C 13 16.1570 . . . . . . . . 150 ILE CG2 . 6759 1 675 . 1 1 66 66 ILE CD1 C 13 12.6800 . . . . . . . . 150 ILE CD1 . 6759 1 676 . 1 1 66 66 ILE N N 15 125.4280 . . . . . . . . 150 ILE N . 6759 1 677 . 1 1 67 67 ASN HA H 1 4.2510 . . . . . . . . 151 ASN HA . 6759 1 678 . 1 1 67 67 ASN HB2 H 1 2.8340 . . . . . . . . 151 ASN HB1|HB2 . 6759 1 679 . 1 1 67 67 ASN HB3 H 1 2.2610 . . . . . . . . 151 ASN HB2|HB1 . 6759 1 680 . 1 1 67 67 ASN C C 13 174.9830 . . . . . . . . 151 ASN C . 6759 1 681 . 1 1 67 67 ASN CA C 13 51.2300 . . . . . . . . 151 ASN CA . 6759 1 682 . 1 1 67 67 ASN CB C 13 37.9260 . . . . . . . . 151 ASN CB . 6759 1 683 . 1 1 68 68 THR H H 1 8.7450 . . . . . . . . 152 THR HN . 6759 1 684 . 1 1 68 68 THR HA H 1 4.0770 . . . . . . . . 152 THR HA . 6759 1 685 . 1 1 68 68 THR HB H 1 4.3480 . . . . . . . . 152 THR HB . 6759 1 686 . 1 1 68 68 THR HG21 H 1 1.2020 . . . . . . . . 152 THR HG2# . 6759 1 687 . 1 1 68 68 THR HG22 H 1 1.2020 . . . . . . . . 152 THR HG2# . 6759 1 688 . 1 1 68 68 THR HG23 H 1 1.2020 . . . . . . . . 152 THR HG2# . 6759 1 689 . 1 1 68 68 THR C C 13 176.9870 . . . . . . . . 152 THR C . 6759 1 690 . 1 1 68 68 THR CA C 13 61.1900 . . . . . . . . 152 THR CA . 6759 1 691 . 1 1 68 68 THR CB C 13 68.1790 . . . . . . . . 152 THR CB . 6759 1 692 . 1 1 68 68 THR CG2 C 13 22.4190 . . . . . . . . 152 THR CG2 . 6759 1 693 . 1 1 68 68 THR N N 15 114.4130 . . . . . . . . 152 THR N . 6759 1 694 . 1 1 69 69 ALA H H 1 8.0620 . . . . . . . . 153 ALA HN . 6759 1 695 . 1 1 69 69 ALA HA H 1 3.9380 . . . . . . . . 153 ALA HA . 6759 1 696 . 1 1 69 69 ALA HB1 H 1 1.3330 . . . . . . . . 153 ALA HB# . 6759 1 697 . 1 1 69 69 ALA HB2 H 1 1.3330 . . . . . . . . 153 ALA HB# . 6759 1 698 . 1 1 69 69 ALA HB3 H 1 1.3330 . . . . . . . . 153 ALA HB# . 6759 1 699 . 1 1 69 69 ALA C C 13 175.3740 . . . . . . . . 153 ALA C . 6759 1 700 . 1 1 69 69 ALA CA C 13 55.8460 . . . . . . . . 153 ALA CA . 6759 1 701 . 1 1 69 69 ALA CB C 13 19.9040 . . . . . . . . 153 ALA CB . 6759 1 702 . 1 1 69 69 ALA N N 15 122.1680 . . . . . . . . 153 ALA N . 6759 1 703 . 1 1 70 70 SER H H 1 8.8790 . . . . . . . . 154 SER HN . 6759 1 704 . 1 1 70 70 SER HA H 1 3.9720 . . . . . . . . 154 SER HA . 6759 1 705 . 1 1 70 70 SER HB2 H 1 3.8020 . . . . . . . . 154 SER HB1|HB2 . 6759 1 706 . 1 1 70 70 SER C C 13 175.0540 . . . . . . . . 154 SER C . 6759 1 707 . 1 1 70 70 SER CA C 13 60.5090 . . . . . . . . 154 SER CA . 6759 1 708 . 1 1 70 70 SER CB C 13 65.0980 . . . . . . . . 154 SER CB . 6759 1 709 . 1 1 70 70 SER N N 15 108.9220 . . . . . . . . 154 SER N . 6759 1 710 . 1 1 71 71 THR H H 1 8.2770 . . . . . . . . 155 THR HN . 6759 1 711 . 1 1 71 71 THR HA H 1 4.6910 . . . . . . . . 155 THR HA . 6759 1 712 . 1 1 71 71 THR HB H 1 4.1480 . . . . . . . . 155 THR HB . 6759 1 713 . 1 1 71 71 THR HG21 H 1 1.1120 . . . . . . . . 155 THR HG2# . 6759 1 714 . 1 1 71 71 THR HG22 H 1 1.1120 . . . . . . . . 155 THR HG2# . 6759 1 715 . 1 1 71 71 THR HG23 H 1 1.1120 . . . . . . . . 155 THR HG2# . 6759 1 716 . 1 1 71 71 THR C C 13 174.1960 . . . . . . . . 155 THR C . 6759 1 717 . 1 1 71 71 THR CA C 13 60.6970 . . . . . . . . 155 THR CA . 6759 1 718 . 1 1 71 71 THR CB C 13 69.6020 . . . . . . . . 155 THR CB . 6759 1 719 . 1 1 71 71 THR CG2 C 13 21.9460 . . . . . . . . 155 THR CG2 . 6759 1 720 . 1 1 71 71 THR N N 15 111.1260 . . . . . . . . 155 THR N . 6759 1 721 . 1 1 72 72 TRP H H 1 7.9120 . . . . . . . . 156 TRP HN . 6759 1 722 . 1 1 72 72 TRP HA H 1 4.6220 . . . . . . . . 156 TRP HA . 6759 1 723 . 1 1 72 72 TRP HB2 H 1 3.2780 . . . . . . . . 156 TRP HB1|HB2 . 6759 1 724 . 1 1 72 72 TRP HB3 H 1 3.0400 . . . . . . . . 156 TRP HB2|HB1 . 6759 1 725 . 1 1 72 72 TRP HD1 H 1 7.3440 . . . . . . . . 156 TRP HD1|HD2 . 6759 1 726 . 1 1 72 72 TRP HE1 H 1 9.2970 . . . . . . . . 156 TRP HE1 . 6759 1 727 . 1 1 72 72 TRP HE3 H 1 6.7070 . . . . . . . . 156 TRP HE3 . 6759 1 728 . 1 1 72 72 TRP HZ2 H 1 6.9790 . . . . . . . . 156 TRP HZ2 . 6759 1 729 . 1 1 72 72 TRP HZ3 H 1 6.2160 . . . . . . . . 156 TRP HZ3 . 6759 1 730 . 1 1 72 72 TRP HH2 H 1 6.4840 . . . . . . . . 156 TRP HH2 . 6759 1 731 . 1 1 72 72 TRP C C 13 174.3630 . . . . . . . . 156 TRP C . 6759 1 732 . 1 1 72 72 TRP CA C 13 57.8620 . . . . . . . . 156 TRP CA . 6759 1 733 . 1 1 72 72 TRP CB C 13 30.7310 . . . . . . . . 156 TRP CB . 6759 1 734 . 1 1 72 72 TRP CD1 C 13 128.2700 . . . . . . . . 156 TRP CD1|CD2 . 6759 1 735 . 1 1 72 72 TRP CE3 C 13 131.0430 . . . . . . . . 156 TRP CE3 . 6759 1 736 . 1 1 72 72 TRP CZ2 C 13 113.1300 . . . . . . . . 156 TRP CZ2 . 6759 1 737 . 1 1 72 72 TRP CZ3 C 13 129.8500 . . . . . . . . 156 TRP CZ3 . 6759 1 738 . 1 1 72 72 TRP CH2 C 13 127.2040 . . . . . . . . 156 TRP CH2 . 6759 1 739 . 1 1 72 72 TRP N N 15 123.6640 . . . . . . . . 156 TRP N . 6759 1 740 . 1 1 72 72 TRP NE1 N 15 127.4500 . . . . . . . . 156 TRP NE1 . 6759 1 741 . 1 1 73 73 LYS H H 1 9.0040 . . . . . . . . 157 LYS HN . 6759 1 742 . 1 1 73 73 LYS HA H 1 4.7530 . . . . . . . . 157 LYS HA . 6759 1 743 . 1 1 73 73 LYS HB2 H 1 2.0670 . . . . . . . . 157 LYS HB1|HB2 . 6759 1 744 . 1 1 73 73 LYS HB3 H 1 1.3060 . . . . . . . . 157 LYS HB2|HB1 . 6759 1 745 . 1 1 73 73 LYS HE2 H 1 2.8630 . . . . . . . . 157 LYS HE1 . 6759 1 746 . 1 1 73 73 LYS C C 13 174.4340 . . . . . . . . 157 LYS C . 6759 1 747 . 1 1 73 73 LYS CA C 13 55.8610 . . . . . . . . 157 LYS CA . 6759 1 748 . 1 1 73 73 LYS CB C 13 32.7780 . . . . . . . . 157 LYS CB . 6759 1 749 . 1 1 73 73 LYS CE C 13 42.0130 . . . . . . . . 157 LYS CE . 6759 1 750 . 1 1 73 73 LYS N N 15 124.6980 . . . . . . . . 157 LYS N . 6759 1 751 . 1 1 74 74 LYS H H 1 8.2200 . . . . . . . . 158 LYS HN . 6759 1 752 . 1 1 74 74 LYS HA H 1 4.2940 . . . . . . . . 158 LYS HA . 6759 1 753 . 1 1 74 74 LYS HB2 H 1 1.7930 . . . . . . . . 158 LYS HB1 . 6759 1 754 . 1 1 74 74 LYS C C 13 176.3910 . . . . . . . . 158 LYS C . 6759 1 755 . 1 1 74 74 LYS CA C 13 56.0830 . . . . . . . . 158 LYS CA . 6759 1 756 . 1 1 74 74 LYS CB C 13 32.8520 . . . . . . . . 158 LYS CB . 6759 1 757 . 1 1 74 74 LYS CE C 13 42.0130 . . . . . . . . 158 LYS CE . 6759 1 758 . 1 1 74 74 LYS N N 15 122.6420 . . . . . . . . 158 LYS N . 6759 1 759 . 1 1 75 75 PHE H H 1 9.0030 . . . . . . . . 159 PHE HN . 6759 1 760 . 1 1 75 75 PHE HA H 1 4.0920 . . . . . . . . 159 PHE HA . 6759 1 761 . 1 1 75 75 PHE HB2 H 1 1.6800 . . . . . . . . 159 PHE HB1|HB2 . 6759 1 762 . 1 1 75 75 PHE HB3 H 1 1.5330 . . . . . . . . 159 PHE HB2|HB1 . 6759 1 763 . 1 1 75 75 PHE CA C 13 60.2580 . . . . . . . . 159 PHE CA . 6759 1 764 . 1 1 75 75 PHE CB C 13 39.6800 . . . . . . . . 159 PHE CB . 6759 1 765 . 1 1 75 75 PHE N N 15 127.8090 . . . . . . . . 159 PHE N . 6759 1 766 . 1 1 76 76 GLU H H 1 8.6610 . . . . . . . . 160 GLU HN . 6759 1 767 . 1 1 76 76 GLU HA H 1 4.5590 . . . . . . . . 160 GLU HA . 6759 1 768 . 1 1 76 76 GLU HB2 H 1 1.7240 . . . . . . . . 160 GLU HB1 . 6759 1 769 . 1 1 76 76 GLU C C 13 174.9590 . . . . . . . . 160 GLU C . 6759 1 770 . 1 1 76 76 GLU CA C 13 53.4850 . . . . . . . . 160 GLU CA . 6759 1 771 . 1 1 76 76 GLU CB C 13 33.8910 . . . . . . . . 160 GLU CB . 6759 1 772 . 1 1 76 76 GLU N N 15 125.4040 . . . . . . . . 160 GLU N . 6759 1 773 . 1 1 77 77 VAL H H 1 8.6610 . . . . . . . . 161 VAL HN . 6759 1 774 . 1 1 77 77 VAL HA H 1 4.4960 . . . . . . . . 161 VAL HA . 6759 1 775 . 1 1 77 77 VAL HB H 1 0.9180 . . . . . . . . 161 VAL HB . 6759 1 776 . 1 1 77 77 VAL HG11 H 1 0.2230 . . . . . . . . 161 VAL HG1# . 6759 1 777 . 1 1 77 77 VAL HG12 H 1 0.2230 . . . . . . . . 161 VAL HG1# . 6759 1 778 . 1 1 77 77 VAL HG13 H 1 0.2230 . . . . . . . . 161 VAL HG1# . 6759 1 779 . 1 1 77 77 VAL HG21 H 1 0.0490 . . . . . . . . 161 VAL HG2# . 6759 1 780 . 1 1 77 77 VAL HG22 H 1 0.0490 . . . . . . . . 161 VAL HG2# . 6759 1 781 . 1 1 77 77 VAL HG23 H 1 0.0490 . . . . . . . . 161 VAL HG2# . 6759 1 782 . 1 1 77 77 VAL C C 13 173.2550 . . . . . . . . 161 VAL C . 6759 1 783 . 1 1 77 77 VAL CA C 13 60.5370 . . . . . . . . 161 VAL CA . 6759 1 784 . 1 1 77 77 VAL CB C 13 33.5200 . . . . . . . . 161 VAL CB . 6759 1 785 . 1 1 77 77 VAL CG1 C 13 20.2700 . . . . . . . . 161 VAL CG1 . 6759 1 786 . 1 1 77 77 VAL CG2 C 13 22.1550 . . . . . . . . 161 VAL CG2 . 6759 1 787 . 1 1 77 77 VAL N N 15 121.4840 . . . . . . . . 161 VAL N . 6759 1 788 . 1 1 78 78 TYR H H 1 9.4430 . . . . . . . . 162 TYR HN . 6759 1 789 . 1 1 78 78 TYR HA H 1 5.0490 . . . . . . . . 162 TYR HA . 6759 1 790 . 1 1 78 78 TYR HB2 H 1 2.8240 . . . . . . . . 162 TYR HB1|HB2 . 6759 1 791 . 1 1 78 78 TYR HB3 H 1 2.3460 . . . . . . . . 162 TYR HB2|HB1 . 6759 1 792 . 1 1 78 78 TYR HD1 H 1 6.6390 . . . . . . . . 162 TYR HD1|HD2 . 6759 1 793 . 1 1 78 78 TYR HE1 H 1 6.1270 . . . . . . . . 162 TYR HE1|HE2 . 6759 1 794 . 1 1 78 78 TYR C C 13 175.1480 . . . . . . . . 162 TYR C . 6759 1 795 . 1 1 78 78 TYR CA C 13 56.0090 . . . . . . . . 162 TYR CA . 6759 1 796 . 1 1 78 78 TYR CB C 13 41.6100 . . . . . . . . 162 TYR CB . 6759 1 797 . 1 1 78 78 TYR CD1 C 13 131.9480 . . . . . . . . 162 TYR CD1|CD2 . 6759 1 798 . 1 1 78 78 TYR CE1 C 13 117.5300 . . . . . . . . 162 TYR CE1|CE2 . 6759 1 799 . 1 1 78 78 TYR N N 15 123.1920 . . . . . . . . 162 TYR N . 6759 1 800 . 1 1 79 79 GLU H H 1 8.6420 . . . . . . . . 163 GLU HN . 6759 1 801 . 1 1 79 79 GLU HB2 H 1 2.1330 . . . . . . . . 163 GLU HB1|HB2 . 6759 1 802 . 1 1 79 79 GLU HB3 H 1 1.9370 . . . . . . . . 163 GLU HB2|HB1 . 6759 1 803 . 1 1 79 79 GLU CA C 13 54.0040 . . . . . . . . 163 GLU CA . 6759 1 804 . 1 1 79 79 GLU CB C 13 33.8060 . . . . . . . . 163 GLU CB . 6759 1 805 . 1 1 79 79 GLU N N 15 122.6750 . . . . . . . . 163 GLU N . 6759 1 806 . 1 1 80 80 ASN H H 1 9.6560 . . . . . . . . 164 ASN HN . 6759 1 807 . 1 1 80 80 ASN HA H 1 4.3010 . . . . . . . . 164 ASN HA . 6759 1 808 . 1 1 80 80 ASN HB2 H 1 3.0410 . . . . . . . . 164 ASN HB1|HB2 . 6759 1 809 . 1 1 80 80 ASN CA C 13 54.6730 . . . . . . . . 164 ASN CA . 6759 1 810 . 1 1 80 80 ASN CB C 13 36.7860 . . . . . . . . 164 ASN CB . 6759 1 811 . 1 1 80 80 ASN N N 15 128.8240 . . . . . . . . 164 ASN N . 6759 1 812 . 1 1 81 81 ASN H H 1 9.1390 . . . . . . . . 165 ASN HN . 6759 1 813 . 1 1 81 81 ASN HA H 1 4.2810 . . . . . . . . 165 ASN HA . 6759 1 814 . 1 1 81 81 ASN HB2 H 1 2.9460 . . . . . . . . 165 ASN HB1|HB2 . 6759 1 815 . 1 1 81 81 ASN CA C 13 54.5600 . . . . . . . . 165 ASN CA . 6759 1 816 . 1 1 81 81 ASN CB C 13 36.9850 . . . . . . . . 165 ASN CB . 6759 1 817 . 1 1 81 81 ASN N N 15 110.7950 . . . . . . . . 165 ASN N . 6759 1 818 . 1 1 82 82 GLN H H 1 8.1520 . . . . . . . . 166 GLN HN . 6759 1 819 . 1 1 82 82 GLN HA H 1 4.6340 . . . . . . . . 166 GLN HA . 6759 1 820 . 1 1 82 82 GLN HB2 H 1 2.1560 . . . . . . . . 166 GLN HB1|HB2 . 6759 1 821 . 1 1 82 82 GLN HG2 H 1 2.3480 . . . . . . . . 166 GLN HG1|HG2 . 6759 1 822 . 1 1 82 82 GLN C C 13 174.6490 . . . . . . . . 166 GLN C . 6759 1 823 . 1 1 82 82 GLN CA C 13 53.6340 . . . . . . . . 166 GLN CA . 6759 1 824 . 1 1 82 82 GLN CB C 13 29.4380 . . . . . . . . 166 GLN CB . 6759 1 825 . 1 1 82 82 GLN CG C 13 33.0550 . . . . . . . . 166 GLN CG . 6759 1 826 . 1 1 82 82 GLN N N 15 120.3440 . . . . . . . . 166 GLN N . 6759 1 827 . 1 1 83 83 LYS H H 1 8.7090 . . . . . . . . 167 LYS HN . 6759 1 828 . 1 1 83 83 LYS HA H 1 3.2390 . . . . . . . . 167 LYS HA . 6759 1 829 . 1 1 83 83 LYS HB2 H 1 1.5520 . . . . . . . . 167 LYS HB1 . 6759 1 830 . 1 1 83 83 LYS HB3 H 1 1.3850 . . . . . . . . 167 LYS HB2 . 6759 1 831 . 1 1 83 83 LYS HG2 H 1 1.0530 . . . . . . . . 167 LYS HG1|HG2 . 6759 1 832 . 1 1 83 83 LYS HG3 H 1 0.6520 . . . . . . . . 167 LYS HG2|HG1 . 6759 1 833 . 1 1 83 83 LYS HD2 H 1 1.5500 . . . . . . . . 167 LYS HD1|HD2 . 6759 1 834 . 1 1 83 83 LYS HD3 H 1 1.4720 . . . . . . . . 167 LYS HD2|HD1 . 6759 1 835 . 1 1 83 83 LYS HE2 H 1 2.8550 . . . . . . . . 167 LYS HE1|HE2 . 6759 1 836 . 1 1 83 83 LYS HE3 H 1 2.8040 . . . . . . . . 167 LYS HE2|HE1 . 6759 1 837 . 1 1 83 83 LYS C C 13 176.8920 . . . . . . . . 167 LYS C . 6759 1 838 . 1 1 83 83 LYS CA C 13 57.3450 . . . . . . . . 167 LYS CA . 6759 1 839 . 1 1 83 83 LYS CB C 13 32.6290 . . . . . . . . 167 LYS CB . 6759 1 840 . 1 1 83 83 LYS CG C 13 25.0630 . . . . . . . . 167 LYS CG . 6759 1 841 . 1 1 83 83 LYS CD C 13 29.2280 . . . . . . . . 167 LYS CD . 6759 1 842 . 1 1 83 83 LYS CE C 13 41.4230 . . . . . . . . 167 LYS CE . 6759 1 843 . 1 1 83 83 LYS N N 15 127.4230 . . . . . . . . 167 LYS N . 6759 1 844 . 1 1 84 84 LEU H H 1 8.9920 . . . . . . . . 168 LEU HN . 6759 1 845 . 1 1 84 84 LEU HA H 1 4.6140 . . . . . . . . 168 LEU HA . 6759 1 846 . 1 1 84 84 LEU HB2 H 1 1.4670 . . . . . . . . 168 LEU HB1|HB2 . 6759 1 847 . 1 1 84 84 LEU HB3 H 1 1.0680 . . . . . . . . 168 LEU HB2|HB1 . 6759 1 848 . 1 1 84 84 LEU HG H 1 1.5950 . . . . . . . . 168 LEU HG . 6759 1 849 . 1 1 84 84 LEU HD11 H 1 0.8770 . . . . . . . . 168 LEU HD1#|HD2# . 6759 1 850 . 1 1 84 84 LEU HD12 H 1 0.8770 . . . . . . . . 168 LEU HD1#|HD2# . 6759 1 851 . 1 1 84 84 LEU HD13 H 1 0.8770 . . . . . . . . 168 LEU HD1#|HD2# . 6759 1 852 . 1 1 84 84 LEU HD21 H 1 0.9370 . . . . . . . . 168 LEU HD2#|HD1# . 6759 1 853 . 1 1 84 84 LEU HD22 H 1 0.9370 . . . . . . . . 168 LEU HD2#|HD1# . 6759 1 854 . 1 1 84 84 LEU HD23 H 1 0.9370 . . . . . . . . 168 LEU HD2#|HD1# . 6759 1 855 . 1 1 84 84 LEU C C 13 175.5980 . . . . . . . . 168 LEU C . 6759 1 856 . 1 1 84 84 LEU CA C 13 52.0010 . . . . . . . . 168 LEU CA . 6759 1 857 . 1 1 84 84 LEU CB C 13 42.0550 . . . . . . . . 168 LEU CB . 6759 1 858 . 1 1 84 84 LEU CG C 13 25.9530 . . . . . . . . 168 LEU CG . 6759 1 859 . 1 1 84 84 LEU CD1 C 13 25.1780 . . . . . . . . 168 LEU CD1 . 6759 1 860 . 1 1 84 84 LEU CD2 C 13 21.7000 . . . . . . . . 168 LEU CD2 . 6759 1 861 . 1 1 84 84 LEU N N 15 129.4770 . . . . . . . . 168 LEU N . 6759 1 862 . 1 1 85 85 PRO HA H 1 4.6290 . . . . . . . . 169 PRO HA . 6759 1 863 . 1 1 85 85 PRO HB2 H 1 2.1570 . . . . . . . . 169 PRO HB1|HB2 . 6759 1 864 . 1 1 85 85 PRO C C 13 175.1500 . . . . . . . . 169 PRO C . 6759 1 865 . 1 1 85 85 PRO CA C 13 61.7590 . . . . . . . . 169 PRO CA . 6759 1 866 . 1 1 85 85 PRO CB C 13 29.4180 . . . . . . . . 169 PRO CB . 6759 1 867 . 1 1 85 85 PRO CD C 13 49.9770 . . . . . . . . 169 PRO CD . 6759 1 868 . 1 1 86 86 VAL H H 1 7.9590 . . . . . . . . 170 VAL HN . 6759 1 869 . 1 1 86 86 VAL HA H 1 4.5200 . . . . . . . . 170 VAL HA . 6759 1 870 . 1 1 86 86 VAL HB H 1 2.0360 . . . . . . . . 170 VAL HB . 6759 1 871 . 1 1 86 86 VAL HG11 H 1 0.9350 . . . . . . . . 170 VAL HG1# . 6759 1 872 . 1 1 86 86 VAL HG12 H 1 0.9350 . . . . . . . . 170 VAL HG1# . 6759 1 873 . 1 1 86 86 VAL HG13 H 1 0.9350 . . . . . . . . 170 VAL HG1# . 6759 1 874 . 1 1 86 86 VAL HG21 H 1 0.9290 . . . . . . . . 170 VAL HG2# . 6759 1 875 . 1 1 86 86 VAL HG22 H 1 0.9290 . . . . . . . . 170 VAL HG2# . 6759 1 876 . 1 1 86 86 VAL HG23 H 1 0.9290 . . . . . . . . 170 VAL HG2# . 6759 1 877 . 1 1 86 86 VAL C C 13 176.0570 . . . . . . . . 170 VAL C . 6759 1 878 . 1 1 86 86 VAL CA C 13 61.8410 . . . . . . . . 170 VAL CA . 6759 1 879 . 1 1 86 86 VAL CB C 13 32.9930 . . . . . . . . 170 VAL CB . 6759 1 880 . 1 1 86 86 VAL CG1 C 13 21.9490 . . . . . . . . 170 VAL CG1 . 6759 1 881 . 1 1 86 86 VAL CG2 C 13 21.7000 . . . . . . . . 170 VAL CG2 . 6759 1 882 . 1 1 86 86 VAL N N 15 126.9770 . . . . . . . . 170 VAL N . 6759 1 883 . 1 1 87 87 ARG H H 1 9.1220 . . . . . . . . 171 ARG HN . 6759 1 884 . 1 1 87 87 ARG HA H 1 4.9100 . . . . . . . . 171 ARG HA . 6759 1 885 . 1 1 87 87 ARG HB2 H 1 1.7050 . . . . . . . . 171 ARG HB1|HB2 . 6759 1 886 . 1 1 87 87 ARG HB3 H 1 1.5800 . . . . . . . . 171 ARG HB2|HB1 . 6759 1 887 . 1 1 87 87 ARG HG2 H 1 1.5750 . . . . . . . . 171 ARG HG1|HG2 . 6759 1 888 . 1 1 87 87 ARG HG3 H 1 1.2850 . . . . . . . . 171 ARG HG2|HG1 . 6759 1 889 . 1 1 87 87 ARG HD2 H 1 3.0910 . . . . . . . . 171 ARG HD1|HD2 . 6759 1 890 . 1 1 87 87 ARG HD3 H 1 3.0300 . . . . . . . . 171 ARG HD2|HD1 . 6759 1 891 . 1 1 87 87 ARG C C 13 174.3150 . . . . . . . . 171 ARG C . 6759 1 892 . 1 1 87 87 ARG CA C 13 53.2450 . . . . . . . . 171 ARG CA . 6759 1 893 . 1 1 87 87 ARG CB C 13 32.9120 . . . . . . . . 171 ARG CB . 6759 1 894 . 1 1 87 87 ARG CG C 13 26.6910 . . . . . . . . 171 ARG CG . 6759 1 895 . 1 1 87 87 ARG CD C 13 42.8050 . . . . . . . . 171 ARG CD . 6759 1 896 . 1 1 87 87 ARG N N 15 126.9770 . . . . . . . . 171 ARG N . 6759 1 897 . 1 1 88 88 LEU H H 1 8.8050 . . . . . . . . 172 LEU HN . 6759 1 898 . 1 1 88 88 LEU HA H 1 4.6190 . . . . . . . . 172 LEU HA . 6759 1 899 . 1 1 88 88 LEU HB2 H 1 1.7190 . . . . . . . . 172 LEU HB1|HB2 . 6759 1 900 . 1 1 88 88 LEU HB3 H 1 1.2870 . . . . . . . . 172 LEU HB2|HB1 . 6759 1 901 . 1 1 88 88 LEU HG H 1 1.3980 . . . . . . . . 172 LEU HG . 6759 1 902 . 1 1 88 88 LEU HD11 H 1 1.3990 . . . . . . . . 172 LEU HD1#|HD2# . 6759 1 903 . 1 1 88 88 LEU HD12 H 1 1.3990 . . . . . . . . 172 LEU HD1#|HD2# . 6759 1 904 . 1 1 88 88 LEU HD13 H 1 1.3990 . . . . . . . . 172 LEU HD1#|HD2# . 6759 1 905 . 1 1 88 88 LEU HD21 H 1 0.7080 . . . . . . . . 172 LEU HD2#|HD1# . 6759 1 906 . 1 1 88 88 LEU HD22 H 1 0.7080 . . . . . . . . 172 LEU HD2#|HD1# . 6759 1 907 . 1 1 88 88 LEU HD23 H 1 0.7080 . . . . . . . . 172 LEU HD2#|HD1# . 6759 1 908 . 1 1 88 88 LEU C C 13 176.6270 . . . . . . . . 172 LEU C . 6759 1 909 . 1 1 88 88 LEU CA C 13 54.5160 . . . . . . . . 172 LEU CA . 6759 1 910 . 1 1 88 88 LEU CB C 13 42.2050 . . . . . . . . 172 LEU CB . 6759 1 911 . 1 1 88 88 LEU CG C 13 27.9880 . . . . . . . . 172 LEU CG . 6759 1 912 . 1 1 88 88 LEU CD1 C 13 27.7450 . . . . . . . . 172 LEU CD1 . 6759 1 913 . 1 1 88 88 LEU CD2 C 13 27.2440 . . . . . . . . 172 LEU CD2 . 6759 1 914 . 1 1 88 88 LEU N N 15 125.9530 . . . . . . . . 172 LEU N . 6759 1 915 . 1 1 89 89 VAL H H 1 8.8020 . . . . . . . . 173 VAL HN . 6759 1 916 . 1 1 89 89 VAL HA H 1 4.4660 . . . . . . . . 173 VAL HA . 6759 1 917 . 1 1 89 89 VAL HB H 1 2.1390 . . . . . . . . 173 VAL HB . 6759 1 918 . 1 1 89 89 VAL HG11 H 1 0.7240 . . . . . . . . 173 VAL HG1# . 6759 1 919 . 1 1 89 89 VAL HG12 H 1 0.7240 . . . . . . . . 173 VAL HG1# . 6759 1 920 . 1 1 89 89 VAL HG13 H 1 0.7240 . . . . . . . . 173 VAL HG1# . 6759 1 921 . 1 1 89 89 VAL HG21 H 1 0.5700 . . . . . . . . 173 VAL HG2# . 6759 1 922 . 1 1 89 89 VAL HG22 H 1 0.5700 . . . . . . . . 173 VAL HG2# . 6759 1 923 . 1 1 89 89 VAL HG23 H 1 0.5700 . . . . . . . . 173 VAL HG2# . 6759 1 924 . 1 1 89 89 VAL C C 13 175.8420 . . . . . . . . 173 VAL C . 6759 1 925 . 1 1 89 89 VAL CA C 13 60.8690 . . . . . . . . 173 VAL CA . 6759 1 926 . 1 1 89 89 VAL CB C 13 32.1180 . . . . . . . . 173 VAL CB . 6759 1 927 . 1 1 89 89 VAL CG1 C 13 21.2030 . . . . . . . . 173 VAL CG1 . 6759 1 928 . 1 1 89 89 VAL CG2 C 13 18.9620 . . . . . . . . 173 VAL CG2 . 6759 1 929 . 1 1 89 89 VAL N N 15 117.0180 . . . . . . . . 173 VAL N . 6759 1 930 . 1 1 90 90 SER H H 1 7.3050 . . . . . . . . 174 SER HN . 6759 1 931 . 1 1 90 90 SER HA H 1 4.6890 . . . . . . . . 174 SER HA . 6759 1 932 . 1 1 90 90 SER HB2 H 1 3.7560 . . . . . . . . 174 SER HB1|HB2 . 6759 1 933 . 1 1 90 90 SER HB3 H 1 2.6690 . . . . . . . . 174 SER HB2|HB1 . 6759 1 934 . 1 1 90 90 SER C C 13 171.6460 . . . . . . . . 174 SER C . 6759 1 935 . 1 1 90 90 SER CA C 13 57.8650 . . . . . . . . 174 SER CA . 6759 1 936 . 1 1 90 90 SER CB C 13 61.4270 . . . . . . . . 174 SER CB . 6759 1 937 . 1 1 90 90 SER N N 15 110.7510 . . . . . . . . 174 SER N . 6759 1 938 . 1 1 91 91 TYR H H 1 8.2930 . . . . . . . . 175 TYR HN . 6759 1 939 . 1 1 91 91 TYR HA H 1 5.5180 . . . . . . . . 175 TYR HA . 6759 1 940 . 1 1 91 91 TYR HB2 H 1 2.9070 . . . . . . . . 175 TYR HB1|HB2 . 6759 1 941 . 1 1 91 91 TYR HB3 H 1 2.7510 . . . . . . . . 175 TYR HB2|HB1 . 6759 1 942 . 1 1 91 91 TYR HD1 H 1 6.9700 . . . . . . . . 175 TYR HD1|HD2 . 6759 1 943 . 1 1 91 91 TYR HE1 H 1 6.6790 . . . . . . . . 175 TYR HE1|HE2 . 6759 1 944 . 1 1 91 91 TYR C C 13 173.8420 . . . . . . . . 175 TYR C . 6759 1 945 . 1 1 91 91 TYR CA C 13 55.9450 . . . . . . . . 175 TYR CA . 6759 1 946 . 1 1 91 91 TYR CB C 13 41.4110 . . . . . . . . 175 TYR CB . 6759 1 947 . 1 1 91 91 TYR CD1 C 13 132.7590 . . . . . . . . 175 TYR CD1|CD2 . 6759 1 948 . 1 1 91 91 TYR CE1 C 13 117.3000 . . . . . . . . 175 TYR CE1|CE2 . 6759 1 949 . 1 1 91 91 TYR N N 15 125.1150 . . . . . . . . 175 TYR N . 6759 1 950 . 1 1 92 92 SER H H 1 9.0850 . . . . . . . . 176 SER HN . 6759 1 951 . 1 1 92 92 SER HA H 1 5.0610 . . . . . . . . 176 SER HA . 6759 1 952 . 1 1 92 92 SER HB2 H 1 3.9410 . . . . . . . . 176 SER HB1|HB2 . 6759 1 953 . 1 1 92 92 SER HB3 H 1 3.7530 . . . . . . . . 176 SER HB2|HB1 . 6759 1 954 . 1 1 92 92 SER CA C 13 53.3000 . . . . . . . . 176 SER CA . 6759 1 955 . 1 1 92 92 SER CB C 13 63.9520 . . . . . . . . 176 SER CB . 6759 1 956 . 1 1 92 92 SER N N 15 126.3250 . . . . . . . . 176 SER N . 6759 1 957 . 1 1 93 93 PRO HA H 1 4.2700 . . . . . . . . 177 PRO HA . 6759 1 958 . 1 1 93 93 PRO HB2 H 1 2.4190 . . . . . . . . 177 PRO HB1|HB2 . 6759 1 959 . 1 1 93 93 PRO HB3 H 1 2.0710 . . . . . . . . 177 PRO HB2|HB1 . 6759 1 960 . 1 1 93 93 PRO HG2 H 1 1.9070 . . . . . . . . 177 PRO HG1|HG2 . 6759 1 961 . 1 1 93 93 PRO HD2 H 1 3.7140 . . . . . . . . 177 PRO HD1|HD2 . 6759 1 962 . 1 1 93 93 PRO HD3 H 1 3.7680 . . . . . . . . 177 PRO HD2|HD1 . 6759 1 963 . 1 1 93 93 PRO C C 13 178.3230 . . . . . . . . 177 PRO C . 6759 1 964 . 1 1 93 93 PRO CA C 13 62.0030 . . . . . . . . 177 PRO CA . 6759 1 965 . 1 1 93 93 PRO CB C 13 33.2370 . . . . . . . . 177 PRO CB . 6759 1 966 . 1 1 93 93 PRO CG C 13 27.2230 . . . . . . . . 177 PRO CG . 6759 1 967 . 1 1 93 93 PRO CD C 13 51.9580 . . . . . . . . 177 PRO CD . 6759 1 968 . 1 1 94 94 VAL H H 1 8.3740 . . . . . . . . 178 VAL HN . 6759 1 969 . 1 1 94 94 VAL HA H 1 3.6190 . . . . . . . . 178 VAL HA . 6759 1 970 . 1 1 94 94 VAL HB H 1 2.0820 . . . . . . . . 178 VAL HB . 6759 1 971 . 1 1 94 94 VAL HG11 H 1 1.0570 . . . . . . . . 178 VAL HG1# . 6759 1 972 . 1 1 94 94 VAL HG12 H 1 1.0570 . . . . . . . . 178 VAL HG1# . 6759 1 973 . 1 1 94 94 VAL HG13 H 1 1.0570 . . . . . . . . 178 VAL HG1# . 6759 1 974 . 1 1 94 94 VAL HG21 H 1 0.9980 . . . . . . . . 178 VAL HG2# . 6759 1 975 . 1 1 94 94 VAL HG22 H 1 0.9980 . . . . . . . . 178 VAL HG2# . 6759 1 976 . 1 1 94 94 VAL HG23 H 1 0.9980 . . . . . . . . 178 VAL HG2# . 6759 1 977 . 1 1 94 94 VAL CA C 13 62.6210 . . . . . . . . 178 VAL CA . 6759 1 978 . 1 1 94 94 VAL CB C 13 32.6350 . . . . . . . . 178 VAL CB . 6759 1 979 . 1 1 94 94 VAL CG1 C 13 20.2960 . . . . . . . . 178 VAL CG1 . 6759 1 980 . 1 1 94 94 VAL CG2 C 13 19.7090 . . . . . . . . 178 VAL CG2 . 6759 1 981 . 1 1 94 94 VAL N N 15 122.5710 . . . . . . . . 178 VAL N . 6759 1 982 . 1 1 95 95 PRO HA H 1 4.5960 . . . . . . . . 179 PRO HA . 6759 1 983 . 1 1 95 95 PRO HB2 H 1 2.3060 . . . . . . . . 179 PRO HB1|HB2 . 6759 1 984 . 1 1 95 95 PRO HB3 H 1 2.2210 . . . . . . . . 179 PRO HB2|HB1 . 6759 1 985 . 1 1 95 95 PRO HG2 H 1 1.9410 . . . . . . . . 179 PRO HG1|HG2 . 6759 1 986 . 1 1 95 95 PRO HG3 H 1 1.7410 . . . . . . . . 179 PRO HG2|HG1 . 6759 1 987 . 1 1 95 95 PRO HD2 H 1 3.5000 . . . . . . . . 179 PRO HD1|HD2 . 6759 1 988 . 1 1 95 95 PRO HD3 H 1 3.5750 . . . . . . . . 179 PRO HD2|HD1 . 6759 1 989 . 1 1 95 95 PRO CA C 13 63.7520 . . . . . . . . 179 PRO CA . 6759 1 990 . 1 1 95 95 PRO CB C 13 33.8390 . . . . . . . . 179 PRO CB . 6759 1 991 . 1 1 95 95 PRO CG C 13 24.1670 . . . . . . . . 179 PRO CG . 6759 1 992 . 1 1 95 95 PRO CD C 13 50.2210 . . . . . . . . 179 PRO CD . 6759 1 993 . 1 1 96 96 GLU H H 1 8.5510 . . . . . . . . 180 GLU HN . 6759 1 994 . 1 1 96 96 GLU HA H 1 4.2880 . . . . . . . . 180 GLU HA . 6759 1 995 . 1 1 96 96 GLU HB2 H 1 1.8900 . . . . . . . . 180 GLU HB1|HB2 . 6759 1 996 . 1 1 96 96 GLU HG2 H 1 2.2220 . . . . . . . . 180 GLU HG1|HG2 . 6759 1 997 . 1 1 96 96 GLU HG3 H 1 2.1400 . . . . . . . . 180 GLU HG2|HG1 . 6759 1 998 . 1 1 96 96 GLU C C 13 176.2240 . . . . . . . . 180 GLU C . 6759 1 999 . 1 1 96 96 GLU CA C 13 59.1220 . . . . . . . . 180 GLU CA . 6759 1 1000 . 1 1 96 96 GLU CB C 13 28.7030 . . . . . . . . 180 GLU CB . 6759 1 1001 . 1 1 96 96 GLU CG C 13 36.1620 . . . . . . . . 180 GLU CG . 6759 1 1002 . 1 1 96 96 GLU N N 15 126.9390 . . . . . . . . 180 GLU N . 6759 1 1003 . 1 1 97 97 ASP H H 1 7.3020 . . . . . . . . 181 ASP HN . 6759 1 1004 . 1 1 97 97 ASP HA H 1 4.4270 . . . . . . . . 181 ASP HA . 6759 1 1005 . 1 1 97 97 ASP HB2 H 1 3.4910 . . . . . . . . 181 ASP HB1|HB2 . 6759 1 1006 . 1 1 97 97 ASP HB3 H 1 2.0270 . . . . . . . . 181 ASP HB2|HB1 . 6759 1 1007 . 1 1 97 97 ASP C C 13 175.7700 . . . . . . . . 181 ASP C . 6759 1 1008 . 1 1 97 97 ASP CA C 13 54.7540 . . . . . . . . 181 ASP CA . 6759 1 1009 . 1 1 97 97 ASP CB C 13 39.9010 . . . . . . . . 181 ASP CB . 6759 1 1010 . 1 1 97 97 ASP N N 15 119.2230 . . . . . . . . 181 ASP N . 6759 1 1011 . 1 1 98 98 HIS H H 1 7.5580 . . . . . . . . 182 HIS HN . 6759 1 1012 . 1 1 98 98 HIS HA H 1 5.6110 . . . . . . . . 182 HIS HA . 6759 1 1013 . 1 1 98 98 HIS HB2 H 1 2.8250 . . . . . . . . 182 HIS HB1|HB2 . 6759 1 1014 . 1 1 98 98 HIS HB3 H 1 2.3560 . . . . . . . . 182 HIS HB2|HB1 . 6759 1 1015 . 1 1 98 98 HIS C C 13 173.2800 . . . . . . . . 182 HIS C . 6759 1 1016 . 1 1 98 98 HIS CA C 13 53.5840 . . . . . . . . 182 HIS CA . 6759 1 1017 . 1 1 98 98 HIS CB C 13 31.2400 . . . . . . . . 182 HIS CB . 6759 1 1018 . 1 1 98 98 HIS N N 15 113.7640 . . . . . . . . 182 HIS N . 6759 1 1019 . 1 1 99 99 ALA H H 1 9.0670 . . . . . . . . 183 ALA HN . 6759 1 1020 . 1 1 99 99 ALA HA H 1 4.8900 . . . . . . . . 183 ALA HA . 6759 1 1021 . 1 1 99 99 ALA HB1 H 1 1.1150 . . . . . . . . 183 ALA HB# . 6759 1 1022 . 1 1 99 99 ALA HB2 H 1 1.1150 . . . . . . . . 183 ALA HB# . 6759 1 1023 . 1 1 99 99 ALA HB3 H 1 1.1150 . . . . . . . . 183 ALA HB# . 6759 1 1024 . 1 1 99 99 ALA C C 13 173.5100 . . . . . . . . 183 ALA C . 6759 1 1025 . 1 1 99 99 ALA CA C 13 49.3640 . . . . . . . . 183 ALA CA . 6759 1 1026 . 1 1 99 99 ALA CB C 13 22.4190 . . . . . . . . 183 ALA CB . 6759 1 1027 . 1 1 99 99 ALA N N 15 122.6890 . . . . . . . . 183 ALA N . 6759 1 1028 . 1 1 100 100 TYR H H 1 7.8960 . . . . . . . . 184 TYR HN . 6759 1 1029 . 1 1 100 100 TYR HA H 1 5.4330 . . . . . . . . 184 TYR HA . 6759 1 1030 . 1 1 100 100 TYR HB2 H 1 2.1440 . . . . . . . . 184 TYR HB1|HB2 . 6759 1 1031 . 1 1 100 100 TYR HB3 H 1 2.1060 . . . . . . . . 184 TYR HB2|HB1 . 6759 1 1032 . 1 1 100 100 TYR HD1 H 1 6.6590 . . . . . . . . 184 TYR HD1|HD2 . 6759 1 1033 . 1 1 100 100 TYR HE1 H 1 6.1040 . . . . . . . . 184 TYR HE1|HE2 . 6759 1 1034 . 1 1 100 100 TYR C C 13 175.6550 . . . . . . . . 184 TYR C . 6759 1 1035 . 1 1 100 100 TYR CA C 13 55.6300 . . . . . . . . 184 TYR CA . 6759 1 1036 . 1 1 100 100 TYR CB C 13 38.0060 . . . . . . . . 184 TYR CB . 6759 1 1037 . 1 1 100 100 TYR CD1 C 13 131.8000 . . . . . . . . 184 TYR CD1|CD2 . 6759 1 1038 . 1 1 100 100 TYR CE1 C 13 117.3200 . . . . . . . . 184 TYR CE1|CE2 . 6759 1 1039 . 1 1 100 100 TYR N N 15 117.7230 . . . . . . . . 184 TYR N . 6759 1 1040 . 1 1 101 101 ILE H H 1 8.5610 . . . . . . . . 185 ILE HN . 6759 1 1041 . 1 1 101 101 ILE HA H 1 5.5160 . . . . . . . . 185 ILE HA . 6759 1 1042 . 1 1 101 101 ILE HB H 1 1.6750 . . . . . . . . 185 ILE HB . 6759 1 1043 . 1 1 101 101 ILE HG12 H 1 1.4410 . . . . . . . . 185 ILE HG11|HG12 . 6759 1 1044 . 1 1 101 101 ILE HG13 H 1 0.7960 . . . . . . . . 185 ILE HG12|HG11 . 6759 1 1045 . 1 1 101 101 ILE HG21 H 1 0.5690 . . . . . . . . 185 ILE HG2# . 6759 1 1046 . 1 1 101 101 ILE HG22 H 1 0.5690 . . . . . . . . 185 ILE HG2# . 6759 1 1047 . 1 1 101 101 ILE HG23 H 1 0.5690 . . . . . . . . 185 ILE HG2# . 6759 1 1048 . 1 1 101 101 ILE HD11 H 1 0.4960 . . . . . . . . 185 ILE HD1# . 6759 1 1049 . 1 1 101 101 ILE HD12 H 1 0.4960 . . . . . . . . 185 ILE HD1# . 6759 1 1050 . 1 1 101 101 ILE HD13 H 1 0.4960 . . . . . . . . 185 ILE HD1# . 6759 1 1051 . 1 1 101 101 ILE C C 13 174.6480 . . . . . . . . 185 ILE C . 6759 1 1052 . 1 1 101 101 ILE CA C 13 57.5100 . . . . . . . . 185 ILE CA . 6759 1 1053 . 1 1 101 101 ILE CB C 13 40.7480 . . . . . . . . 185 ILE CB . 6759 1 1054 . 1 1 101 101 ILE CG1 C 13 25.4050 . . . . . . . . 185 ILE CG1 . 6759 1 1055 . 1 1 101 101 ILE CG2 C 13 17.1380 . . . . . . . . 185 ILE CG2 . 6759 1 1056 . 1 1 101 101 ILE CD1 C 13 14.2300 . . . . . . . . 185 ILE CD1 . 6759 1 1057 . 1 1 101 101 ILE N N 15 118.0440 . . . . . . . . 185 ILE N . 6759 1 1058 . 1 1 102 102 ARG H H 1 9.0990 . . . . . . . . 186 ARG HN . 6759 1 1059 . 1 1 102 102 ARG HA H 1 6.0650 . . . . . . . . 186 ARG HA . 6759 1 1060 . 1 1 102 102 ARG HB2 H 1 1.3800 . . . . . . . . 186 ARG HB1|HB2 . 6759 1 1061 . 1 1 102 102 ARG HG2 H 1 1.5800 . . . . . . . . 186 ARG HG1|HG2 . 6759 1 1062 . 1 1 102 102 ARG HG3 H 1 1.4680 . . . . . . . . 186 ARG HG2|HG1 . 6759 1 1063 . 1 1 102 102 ARG HD2 H 1 2.8170 . . . . . . . . 186 ARG HD1|HD2 . 6759 1 1064 . 1 1 102 102 ARG HD3 H 1 2.6920 . . . . . . . . 186 ARG HD2|HD1 . 6759 1 1065 . 1 1 102 102 ARG C C 13 176.0800 . . . . . . . . 186 ARG C . 6759 1 1066 . 1 1 102 102 ARG CA C 13 53.4370 . . . . . . . . 186 ARG CA . 6759 1 1067 . 1 1 102 102 ARG CB C 13 36.3610 . . . . . . . . 186 ARG CB . 6759 1 1068 . 1 1 102 102 ARG CG C 13 27.9200 . . . . . . . . 186 ARG CG . 6759 1 1069 . 1 1 102 102 ARG CD C 13 43.3600 . . . . . . . . 186 ARG CD . 6759 1 1070 . 1 1 102 102 ARG N N 15 118.0890 . . . . . . . . 186 ARG N . 6759 1 1071 . 1 1 103 103 PHE H H 1 7.4310 . . . . . . . . 187 PHE HN . 6759 1 1072 . 1 1 103 103 PHE HA H 1 5.1440 . . . . . . . . 187 PHE HA . 6759 1 1073 . 1 1 103 103 PHE HB2 H 1 3.1930 . . . . . . . . 187 PHE HB1 . 6759 1 1074 . 1 1 103 103 PHE HB3 H 1 2.7370 . . . . . . . . 187 PHE HB2 . 6759 1 1075 . 1 1 103 103 PHE HD1 H 1 6.7940 . . . . . . . . 187 PHE HD1|HD2 . 6759 1 1076 . 1 1 103 103 PHE HE1 H 1 6.3110 . . . . . . . . 187 PHE HE1 . 6759 1 1077 . 1 1 103 103 PHE C C 13 171.4160 . . . . . . . . 187 PHE C . 6759 1 1078 . 1 1 103 103 PHE CA C 13 53.0450 . . . . . . . . 187 PHE CA . 6759 1 1079 . 1 1 103 103 PHE CB C 13 38.1630 . . . . . . . . 187 PHE CB . 6759 1 1080 . 1 1 103 103 PHE CD1 C 13 133.2090 . . . . . . . . 187 PHE CD1|CD2 . 6759 1 1081 . 1 1 103 103 PHE CE1 C 13 117.3380 . . . . . . . . 187 PHE CE1 . 6759 1 1082 . 1 1 103 103 PHE N N 15 114.1140 . . . . . . . . 187 PHE N . 6759 1 1083 . 1 1 104 104 PRO HA H 1 5.3540 . . . . . . . . 188 PRO HA . 6759 1 1084 . 1 1 104 104 PRO HB2 H 1 2.2060 . . . . . . . . 188 PRO HB1|HB2 . 6759 1 1085 . 1 1 104 104 PRO HB3 H 1 1.7010 . . . . . . . . 188 PRO HB2|HB1 . 6759 1 1086 . 1 1 104 104 PRO HG2 H 1 2.2680 . . . . . . . . 188 PRO HG1|HG2 . 6759 1 1087 . 1 1 104 104 PRO HG3 H 1 2.1430 . . . . . . . . 188 PRO HG2|HG1 . 6759 1 1088 . 1 1 104 104 PRO HD2 H 1 3.7910 . . . . . . . . 188 PRO HD1|HD2 . 6759 1 1089 . 1 1 104 104 PRO HD3 H 1 3.4840 . . . . . . . . 188 PRO HD2|HD1 . 6759 1 1090 . 1 1 104 104 PRO C C 13 171.4160 . . . . . . . . 188 PRO C . 6759 1 1091 . 1 1 104 104 PRO CA C 13 61.0740 . . . . . . . . 188 PRO CA . 6759 1 1092 . 1 1 104 104 PRO CB C 13 32.3430 . . . . . . . . 188 PRO CB . 6759 1 1093 . 1 1 104 104 PRO CG C 13 26.2700 . . . . . . . . 188 PRO CG . 6759 1 1094 . 1 1 104 104 PRO CD C 13 49.5600 . . . . . . . . 188 PRO CD . 6759 1 1095 . 1 1 105 105 VAL H H 1 8.4580 . . . . . . . . 189 VAL HN . 6759 1 1096 . 1 1 105 105 VAL HA H 1 4.6350 . . . . . . . . 189 VAL HA . 6759 1 1097 . 1 1 105 105 VAL HB H 1 1.8530 . . . . . . . . 189 VAL HB . 6759 1 1098 . 1 1 105 105 VAL HG11 H 1 1.0050 . . . . . . . . 189 VAL HG1# . 6759 1 1099 . 1 1 105 105 VAL HG12 H 1 1.0050 . . . . . . . . 189 VAL HG1# . 6759 1 1100 . 1 1 105 105 VAL HG13 H 1 1.0050 . . . . . . . . 189 VAL HG1# . 6759 1 1101 . 1 1 105 105 VAL HG21 H 1 0.7980 . . . . . . . . 189 VAL HG2# . 6759 1 1102 . 1 1 105 105 VAL HG22 H 1 0.7980 . . . . . . . . 189 VAL HG2# . 6759 1 1103 . 1 1 105 105 VAL HG23 H 1 0.7980 . . . . . . . . 189 VAL HG2# . 6759 1 1104 . 1 1 105 105 VAL C C 13 174.8400 . . . . . . . . 189 VAL C . 6759 1 1105 . 1 1 105 105 VAL CA C 13 59.4670 . . . . . . . . 189 VAL CA . 6759 1 1106 . 1 1 105 105 VAL CB C 13 35.3320 . . . . . . . . 189 VAL CB . 6759 1 1107 . 1 1 105 105 VAL CG1 C 13 22.5540 . . . . . . . . 189 VAL CG1 . 6759 1 1108 . 1 1 105 105 VAL CG2 C 13 20.9750 . . . . . . . . 189 VAL CG2 . 6759 1 1109 . 1 1 105 105 VAL N N 15 115.1290 . . . . . . . . 189 VAL N . 6759 1 1110 . 1 1 106 106 SER H H 1 9.9470 . . . . . . . . 190 SER HN . 6759 1 1111 . 1 1 106 106 SER HA H 1 4.3300 . . . . . . . . 190 SER HA . 6759 1 1112 . 1 1 106 106 SER HB2 H 1 3.7850 . . . . . . . . 190 SER HB1|HB2 . 6759 1 1113 . 1 1 106 106 SER HB3 H 1 3.6620 . . . . . . . . 190 SER HB2|HB1 . 6759 1 1114 . 1 1 106 106 SER C C 13 173.7900 . . . . . . . . 190 SER C . 6759 1 1115 . 1 1 106 106 SER CA C 13 59.1260 . . . . . . . . 190 SER CA . 6759 1 1116 . 1 1 106 106 SER CB C 13 62.6890 . . . . . . . . 190 SER CB . 6759 1 1117 . 1 1 106 106 SER N N 15 122.3050 . . . . . . . . 190 SER N . 6759 1 1118 . 1 1 107 107 ASP H H 1 8.8750 . . . . . . . . 191 ASP HN . 6759 1 1119 . 1 1 107 107 ASP HA H 1 4.6190 . . . . . . . . 191 ASP HA . 6759 1 1120 . 1 1 107 107 ASP HB2 H 1 2.6390 . . . . . . . . 191 ASP HB1|HB2 . 6759 1 1121 . 1 1 107 107 ASP C C 13 178.5910 . . . . . . . . 191 ASP C . 6759 1 1122 . 1 1 107 107 ASP CA C 13 54.8210 . . . . . . . . 191 ASP CA . 6759 1 1123 . 1 1 107 107 ASP CB C 13 39.3860 . . . . . . . . 191 ASP CB . 6759 1 1124 . 1 1 107 107 ASP N N 15 123.9980 . . . . . . . . 191 ASP N . 6759 1 1125 . 1 1 108 108 GLY H H 1 8.7140 . . . . . . . . 192 GLY HN . 6759 1 1126 . 1 1 108 108 GLY HA2 H 1 4.2000 . . . . . . . . 192 GLY HA1|HA2 . 6759 1 1127 . 1 1 108 108 GLY HA3 H 1 2.8890 . . . . . . . . 192 GLY HA2|HA1 . 6759 1 1128 . 1 1 108 108 GLY C C 13 174.2500 . . . . . . . . 192 GLY C . 6759 1 1129 . 1 1 108 108 GLY CA C 13 44.1570 . . . . . . . . 192 GLY CA . 6759 1 1130 . 1 1 108 108 GLY N N 15 112.3450 . . . . . . . . 192 GLY N . 6759 1 1131 . 1 1 109 109 THR H H 1 7.8120 . . . . . . . . 193 THR HN . 6759 1 1132 . 1 1 109 109 THR HA H 1 3.8940 . . . . . . . . 193 THR HA . 6759 1 1133 . 1 1 109 109 THR HB H 1 4.1530 . . . . . . . . 193 THR HB . 6759 1 1134 . 1 1 109 109 THR HG21 H 1 1.3390 . . . . . . . . 193 THR HG2# . 6759 1 1135 . 1 1 109 109 THR HG22 H 1 1.3390 . . . . . . . . 193 THR HG2# . 6759 1 1136 . 1 1 109 109 THR HG23 H 1 1.3390 . . . . . . . . 193 THR HG2# . 6759 1 1137 . 1 1 109 109 THR C C 13 172.9740 . . . . . . . . 193 THR C . 6759 1 1138 . 1 1 109 109 THR CA C 13 64.9110 . . . . . . . . 193 THR CA . 6759 1 1139 . 1 1 109 109 THR CB C 13 68.9110 . . . . . . . . 193 THR CB . 6759 1 1140 . 1 1 109 109 THR CG2 C 13 22.2380 . . . . . . . . 193 THR CG2 . 6759 1 1141 . 1 1 109 109 THR N N 15 120.6570 . . . . . . . . 193 THR N . 6759 1 1142 . 1 1 110 110 GLN H H 1 9.3760 . . . . . . . . 194 GLN HN . 6759 1 1143 . 1 1 110 110 GLN HA H 1 4.7620 . . . . . . . . 194 GLN HA . 6759 1 1144 . 1 1 110 110 GLN HB2 H 1 2.0730 . . . . . . . . 194 GLN HB1|HB2 . 6759 1 1145 . 1 1 110 110 GLN HB3 H 1 1.6590 . . . . . . . . 194 GLN HB2|HB1 . 6759 1 1146 . 1 1 110 110 GLN HG2 H 1 2.8610 . . . . . . . . 194 GLN HG1|HG2 . 6759 1 1147 . 1 1 110 110 GLN HG3 H 1 2.2570 . . . . . . . . 194 GLN HG2|HG1 . 6759 1 1148 . 1 1 110 110 GLN C C 13 173.3580 . . . . . . . . 194 GLN C . 6759 1 1149 . 1 1 110 110 GLN CA C 13 55.4480 . . . . . . . . 194 GLN CA . 6759 1 1150 . 1 1 110 110 GLN CB C 13 32.0700 . . . . . . . . 194 GLN CB . 6759 1 1151 . 1 1 110 110 GLN CG C 13 34.4190 . . . . . . . . 194 GLN CG . 6759 1 1152 . 1 1 110 110 GLN N N 15 126.3440 . . . . . . . . 194 GLN N . 6759 1 1153 . 1 1 111 111 GLU H H 1 8.0670 . . . . . . . . 195 GLU HN . 6759 1 1154 . 1 1 111 111 GLU HA H 1 5.7240 . . . . . . . . 195 GLU HA . 6759 1 1155 . 1 1 111 111 GLU HB2 H 1 1.9550 . . . . . . . . 195 GLU HB1|HB2 . 6759 1 1156 . 1 1 111 111 GLU HG2 H 1 2.1610 . . . . . . . . 195 GLU HG1|HG2 . 6759 1 1157 . 1 1 111 111 GLU C C 13 174.6840 . . . . . . . . 195 GLU C . 6759 1 1158 . 1 1 111 111 GLU CA C 13 53.7260 . . . . . . . . 195 GLU CA . 6759 1 1159 . 1 1 111 111 GLU CB C 13 33.1240 . . . . . . . . 195 GLU CB . 6759 1 1160 . 1 1 111 111 GLU CG C 13 35.9440 . . . . . . . . 195 GLU CG . 6759 1 1161 . 1 1 111 111 GLU N N 15 118.2730 . . . . . . . . 195 GLU N . 6759 1 1162 . 1 1 112 112 LEU H H 1 9.0780 . . . . . . . . 196 LEU HN . 6759 1 1163 . 1 1 112 112 LEU HA H 1 4.9480 . . . . . . . . 196 LEU HA . 6759 1 1164 . 1 1 112 112 LEU HB2 H 1 1.3430 . . . . . . . . 196 LEU HB1|HB2 . 6759 1 1165 . 1 1 112 112 LEU HG H 1 1.5550 . . . . . . . . 196 LEU HG . 6759 1 1166 . 1 1 112 112 LEU HD11 H 1 0.9560 . . . . . . . . 196 LEU HD1#|HD2# . 6759 1 1167 . 1 1 112 112 LEU HD12 H 1 0.9560 . . . . . . . . 196 LEU HD1#|HD2# . 6759 1 1168 . 1 1 112 112 LEU HD13 H 1 0.9560 . . . . . . . . 196 LEU HD1#|HD2# . 6759 1 1169 . 1 1 112 112 LEU HD21 H 1 1.0540 . . . . . . . . 196 LEU HD2#|HD1# . 6759 1 1170 . 1 1 112 112 LEU HD22 H 1 1.0540 . . . . . . . . 196 LEU HD2#|HD1# . 6759 1 1171 . 1 1 112 112 LEU HD23 H 1 1.0540 . . . . . . . . 196 LEU HD2#|HD1# . 6759 1 1172 . 1 1 112 112 LEU C C 13 175.2210 . . . . . . . . 196 LEU C . 6759 1 1173 . 1 1 112 112 LEU CA C 13 52.5210 . . . . . . . . 196 LEU CA . 6759 1 1174 . 1 1 112 112 LEU CB C 13 46.2860 . . . . . . . . 196 LEU CB . 6759 1 1175 . 1 1 112 112 LEU CG C 13 26.6460 . . . . . . . . 196 LEU CG . 6759 1 1176 . 1 1 112 112 LEU CD1 C 13 27.2540 . . . . . . . . 196 LEU CD1 . 6759 1 1177 . 1 1 112 112 LEU CD2 C 13 24.1310 . . . . . . . . 196 LEU CD2 . 6759 1 1178 . 1 1 112 112 LEU N N 15 122.0190 . . . . . . . . 196 LEU N . 6759 1 1179 . 1 1 113 113 LYS H H 1 8.4200 . . . . . . . . 197 LYS HN . 6759 1 1180 . 1 1 113 113 LYS HA H 1 4.8110 . . . . . . . . 197 LYS HA . 6759 1 1181 . 1 1 113 113 LYS HB2 H 1 1.6690 . . . . . . . . 197 LYS HB1|HB2 . 6759 1 1182 . 1 1 113 113 LYS HB3 H 1 1.6010 . . . . . . . . 197 LYS HB2|HB1 . 6759 1 1183 . 1 1 113 113 LYS HG2 H 1 1.0270 . . . . . . . . 197 LYS HG1|HG2 . 6759 1 1184 . 1 1 113 113 LYS HG3 H 1 0.7990 . . . . . . . . 197 LYS HG2|HG1 . 6759 1 1185 . 1 1 113 113 LYS HE2 H 1 2.8360 . . . . . . . . 197 LYS HE1 . 6759 1 1186 . 1 1 113 113 LYS C C 13 174.4800 . . . . . . . . 197 LYS C . 6759 1 1187 . 1 1 113 113 LYS CA C 13 54.3020 . . . . . . . . 197 LYS CA . 6759 1 1188 . 1 1 113 113 LYS CB C 13 34.6330 . . . . . . . . 197 LYS CB . 6759 1 1189 . 1 1 113 113 LYS CG C 13 24.7500 . . . . . . . . 197 LYS CG . 6759 1 1190 . 1 1 113 113 LYS CE C 13 40.6800 . . . . . . . . 197 LYS CE . 6759 1 1191 . 1 1 113 113 LYS N N 15 121.9300 . . . . . . . . 197 LYS N . 6759 1 1192 . 1 1 114 114 ILE H H 1 9.1780 . . . . . . . . 198 ILE HN . 6759 1 1193 . 1 1 114 114 ILE HA H 1 5.0730 . . . . . . . . 198 ILE HA . 6759 1 1194 . 1 1 114 114 ILE HB H 1 1.0250 . . . . . . . . 198 ILE HB . 6759 1 1195 . 1 1 114 114 ILE HG12 H 1 1.1390 . . . . . . . . 198 ILE HG11|HG12 . 6759 1 1196 . 1 1 114 114 ILE HG13 H 1 0.5670 . . . . . . . . 198 ILE HG12|HG11 . 6759 1 1197 . 1 1 114 114 ILE HG21 H 1 -0.0110 . . . . . . . . 198 ILE HG2# . 6759 1 1198 . 1 1 114 114 ILE HG22 H 1 -0.0110 . . . . . . . . 198 ILE HG2# . 6759 1 1199 . 1 1 114 114 ILE HG23 H 1 -0.0110 . . . . . . . . 198 ILE HG2# . 6759 1 1200 . 1 1 114 114 ILE HD11 H 1 0.4400 . . . . . . . . 198 ILE HD1# . 6759 1 1201 . 1 1 114 114 ILE HD12 H 1 0.4400 . . . . . . . . 198 ILE HD1# . 6759 1 1202 . 1 1 114 114 ILE HD13 H 1 0.4400 . . . . . . . . 198 ILE HD1# . 6759 1 1203 . 1 1 114 114 ILE CA C 13 58.7550 . . . . . . . . 198 ILE CA . 6759 1 1204 . 1 1 114 114 ILE CB C 13 40.9400 . . . . . . . . 198 ILE CB . 6759 1 1205 . 1 1 114 114 ILE CG1 C 13 26.9230 . . . . . . . . 198 ILE CG1 . 6759 1 1206 . 1 1 114 114 ILE CG2 C 13 15.4620 . . . . . . . . 198 ILE CG2 . 6759 1 1207 . 1 1 114 114 ILE CD1 C 13 13.6300 . . . . . . . . 198 ILE CD1 . 6759 1 1208 . 1 1 114 114 ILE N N 15 125.7430 . . . . . . . . 198 ILE N . 6759 1 1209 . 1 1 115 115 VAL H H 1 8.9350 . . . . . . . . 199 VAL HN . 6759 1 1210 . 1 1 115 115 VAL HA H 1 4.1360 . . . . . . . . 199 VAL HA . 6759 1 1211 . 1 1 115 115 VAL HB H 1 2.1500 . . . . . . . . 199 VAL HB . 6759 1 1212 . 1 1 115 115 VAL HG11 H 1 0.9910 . . . . . . . . 199 VAL HG1# . 6759 1 1213 . 1 1 115 115 VAL HG12 H 1 0.9910 . . . . . . . . 199 VAL HG1# . 6759 1 1214 . 1 1 115 115 VAL HG13 H 1 0.9910 . . . . . . . . 199 VAL HG1# . 6759 1 1215 . 1 1 115 115 VAL HG21 H 1 0.8310 . . . . . . . . 199 VAL HG2# . 6759 1 1216 . 1 1 115 115 VAL HG22 H 1 0.8310 . . . . . . . . 199 VAL HG2# . 6759 1 1217 . 1 1 115 115 VAL HG23 H 1 0.8310 . . . . . . . . 199 VAL HG2# . 6759 1 1218 . 1 1 115 115 VAL CA C 13 62.3180 . . . . . . . . 199 VAL CA . 6759 1 1219 . 1 1 115 115 VAL CB C 13 33.2230 . . . . . . . . 199 VAL CB . 6759 1 1220 . 1 1 115 115 VAL CG1 C 13 20.9370 . . . . . . . . 199 VAL CG1 . 6759 1 1221 . 1 1 115 115 VAL CG2 C 13 20.2560 . . . . . . . . 199 VAL CG2 . 6759 1 1222 . 1 1 115 115 VAL N N 15 112.0010 . . . . . . . . 199 VAL N . 6759 1 1223 . 1 1 116 116 SER HA H 1 5.2190 . . . . . . . . 200 SER HA . 6759 1 1224 . 1 1 116 116 SER HB2 H 1 4.5650 . . . . . . . . 200 SER HB1|HB2 . 6759 1 1225 . 1 1 116 116 SER HB3 H 1 3.5650 . . . . . . . . 200 SER HB2|HB1 . 6759 1 1226 . 1 1 116 116 SER C C 13 173.2650 . . . . . . . . 200 SER C . 6759 1 1227 . 1 1 116 116 SER CA C 13 56.3940 . . . . . . . . 200 SER CA . 6759 1 1228 . 1 1 116 116 SER CB C 13 68.6530 . . . . . . . . 200 SER CB . 6759 1 1229 . 1 1 117 117 SER H H 1 9.7870 . . . . . . . . 201 SER HN . 6759 1 1230 . 1 1 117 117 SER HA H 1 5.6630 . . . . . . . . 201 SER HA . 6759 1 1231 . 1 1 117 117 SER HB2 H 1 3.9900 . . . . . . . . 201 SER HB1|HB2 . 6759 1 1232 . 1 1 117 117 SER C C 13 172.7640 . . . . . . . . 201 SER C . 6759 1 1233 . 1 1 117 117 SER CA C 13 57.1970 . . . . . . . . 201 SER CA . 6759 1 1234 . 1 1 117 117 SER CB C 13 66.7710 . . . . . . . . 201 SER CB . 6759 1 1235 . 1 1 117 117 SER N N 15 116.5000 . . . . . . . . 201 SER N . 6759 1 1236 . 1 1 118 118 THR H H 1 8.8520 . . . . . . . . 202 THR HN . 6759 1 1237 . 1 1 118 118 THR HA H 1 5.0930 . . . . . . . . 202 THR HA . 6759 1 1238 . 1 1 118 118 THR C C 13 173.7900 . . . . . . . . 202 THR C . 6759 1 1239 . 1 1 118 118 THR CA C 13 58.4110 . . . . . . . . 202 THR CA . 6759 1 1240 . 1 1 118 118 THR CB C 13 71.5920 . . . . . . . . 202 THR CB . 6759 1 1241 . 1 1 118 118 THR CG2 C 13 21.2100 . . . . . . . . 202 THR CG2 . 6759 1 1242 . 1 1 118 118 THR N N 15 109.5310 . . . . . . . . 202 THR N . 6759 1 1243 . 1 1 119 119 GLN H H 1 8.8630 . . . . . . . . 203 GLN HN . 6759 1 1244 . 1 1 119 119 GLN HA H 1 4.2110 . . . . . . . . 203 GLN HA . 6759 1 1245 . 1 1 119 119 GLN HB2 H 1 1.6340 . . . . . . . . 203 GLN HB1|HB2 . 6759 1 1246 . 1 1 119 119 GLN CA C 13 56.5010 . . . . . . . . 203 GLN CA . 6759 1 1247 . 1 1 119 119 GLN CB C 13 31.4820 . . . . . . . . 203 GLN CB . 6759 1 1248 . 1 1 119 119 GLN N N 15 120.0680 . . . . . . . . 203 GLN N . 6759 1 1249 . 1 1 120 120 ILE H H 1 8.8760 . . . . . . . . 204 ILE HN . 6759 1 1250 . 1 1 120 120 ILE HA H 1 4.0310 . . . . . . . . 204 ILE HA . 6759 1 1251 . 1 1 120 120 ILE HB H 1 1.6690 . . . . . . . . 204 ILE HB . 6759 1 1252 . 1 1 120 120 ILE HG12 H 1 1.3980 . . . . . . . . 204 ILE HG11|HG12 . 6759 1 1253 . 1 1 120 120 ILE HG13 H 1 1.0080 . . . . . . . . 204 ILE HG12|HG11 . 6759 1 1254 . 1 1 120 120 ILE HG21 H 1 0.8060 . . . . . . . . 204 ILE HG2# . 6759 1 1255 . 1 1 120 120 ILE HG22 H 1 0.8060 . . . . . . . . 204 ILE HG2# . 6759 1 1256 . 1 1 120 120 ILE HG23 H 1 0.8060 . . . . . . . . 204 ILE HG2# . 6759 1 1257 . 1 1 120 120 ILE HD11 H 1 0.7790 . . . . . . . . 204 ILE HD1# . 6759 1 1258 . 1 1 120 120 ILE HD12 H 1 0.7790 . . . . . . . . 204 ILE HD1# . 6759 1 1259 . 1 1 120 120 ILE HD13 H 1 0.7790 . . . . . . . . 204 ILE HD1# . 6759 1 1260 . 1 1 120 120 ILE CA C 13 60.5140 . . . . . . . . 204 ILE CA . 6759 1 1261 . 1 1 120 120 ILE CB C 13 37.5390 . . . . . . . . 204 ILE CB . 6759 1 1262 . 1 1 120 120 ILE CG1 C 13 26.6790 . . . . . . . . 204 ILE CG1 . 6759 1 1263 . 1 1 120 120 ILE CG2 C 13 17.1180 . . . . . . . . 204 ILE CG2 . 6759 1 1264 . 1 1 120 120 ILE CD1 C 13 12.4500 . . . . . . . . 204 ILE CD1 . 6759 1 1265 . 1 1 120 120 ILE N N 15 108.7990 . . . . . . . . 204 ILE N . 6759 1 1266 . 1 1 121 121 ASP CA C 13 54.9330 . . . . . . . . 205 ASP CA . 6759 1 1267 . 1 1 121 121 ASP CB C 13 37.9500 . . . . . . . . 205 ASP CB . 6759 1 1268 . 1 1 122 122 ASP H H 1 8.1520 . . . . . . . . 206 ASP HN . 6759 1 1269 . 1 1 122 122 ASP HA H 1 4.5660 . . . . . . . . 206 ASP HA . 6759 1 1270 . 1 1 122 122 ASP HB2 H 1 2.0800 . . . . . . . . 206 ASP HB1|HB2 . 6759 1 1271 . 1 1 122 122 ASP C C 13 176.9010 . . . . . . . . 206 ASP C . 6759 1 1272 . 1 1 122 122 ASP CA C 13 53.4110 . . . . . . . . 206 ASP CA . 6759 1 1273 . 1 1 122 122 ASP CB C 13 39.5320 . . . . . . . . 206 ASP CB . 6759 1 1274 . 1 1 122 122 ASP N N 15 120.4450 . . . . . . . . 206 ASP N . 6759 1 1275 . 1 1 123 123 GLY H H 1 8.0120 . . . . . . . . 207 GLY HN . 6759 1 1276 . 1 1 123 123 GLY HA2 H 1 3.7630 . . . . . . . . 207 GLY HA1|HA2 . 6759 1 1277 . 1 1 123 123 GLY HA3 H 1 4.1990 . . . . . . . . 207 GLY HA2|HA1 . 6759 1 1278 . 1 1 123 123 GLY C C 13 175.8440 . . . . . . . . 207 GLY C . 6759 1 1279 . 1 1 123 123 GLY CA C 13 44.1900 . . . . . . . . 207 GLY CA . 6759 1 1280 . 1 1 123 123 GLY N N 15 128.5170 . . . . . . . . 207 GLY N . 6759 1 1281 . 1 1 124 124 GLU H H 1 8.3270 . . . . . . . . 208 GLU HN . 6759 1 1282 . 1 1 124 124 GLU HA H 1 4.0920 . . . . . . . . 208 GLU HA . 6759 1 1283 . 1 1 124 124 GLU HB2 H 1 1.3270 . . . . . . . . 208 GLU HB1|HB2 . 6759 1 1284 . 1 1 124 124 GLU C C 13 176.6770 . . . . . . . . 208 GLU C . 6759 1 1285 . 1 1 124 124 GLU CA C 13 56.3800 . . . . . . . . 208 GLU CA . 6759 1 1286 . 1 1 124 124 GLU CB C 13 29.7340 . . . . . . . . 208 GLU CB . 6759 1 1287 . 1 1 124 124 GLU CG C 13 35.8390 . . . . . . . . 208 GLU CG . 6759 1 1288 . 1 1 124 124 GLU N N 15 119.5570 . . . . . . . . 208 GLU N . 6759 1 1289 . 1 1 125 125 GLU H H 1 8.7160 . . . . . . . . 209 GLU HN . 6759 1 1290 . 1 1 125 125 GLU HA H 1 4.8220 . . . . . . . . 209 GLU HA . 6759 1 1291 . 1 1 125 125 GLU HB2 H 1 1.8910 . . . . . . . . 209 GLU HB1|HB2 . 6759 1 1292 . 1 1 125 125 GLU HB3 H 1 1.7710 . . . . . . . . 209 GLU HB2|HB1 . 6759 1 1293 . 1 1 125 125 GLU HG2 H 1 2.0830 . . . . . . . . 209 GLU HG1|HG2 . 6759 1 1294 . 1 1 125 125 GLU HG3 H 1 2.0050 . . . . . . . . 209 GLU HG2|HG1 . 6759 1 1295 . 1 1 125 125 GLU C C 13 176.3910 . . . . . . . . 209 GLU C . 6759 1 1296 . 1 1 125 125 GLU CA C 13 55.0440 . . . . . . . . 209 GLU CA . 6759 1 1297 . 1 1 125 125 GLU CB C 13 30.4770 . . . . . . . . 209 GLU CB . 6759 1 1298 . 1 1 125 125 GLU CG C 13 35.8880 . . . . . . . . 209 GLU CG . 6759 1 1299 . 1 1 125 125 GLU N N 15 126.3120 . . . . . . . . 209 GLU N . 6759 1 1300 . 1 1 126 126 THR H H 1 8.9630 . . . . . . . . 210 THR HN . 6759 1 1301 . 1 1 126 126 THR HA H 1 4.1500 . . . . . . . . 210 THR HA . 6759 1 1302 . 1 1 126 126 THR HB H 1 3.8450 . . . . . . . . 210 THR HB . 6759 1 1303 . 1 1 126 126 THR HG21 H 1 0.5910 . . . . . . . . 210 THR HG2# . 6759 1 1304 . 1 1 126 126 THR HG22 H 1 0.5910 . . . . . . . . 210 THR HG2# . 6759 1 1305 . 1 1 126 126 THR HG23 H 1 0.5910 . . . . . . . . 210 THR HG2# . 6759 1 1306 . 1 1 126 126 THR C C 13 173.0460 . . . . . . . . 210 THR C . 6759 1 1307 . 1 1 126 126 THR CA C 13 61.7980 . . . . . . . . 210 THR CA . 6759 1 1308 . 1 1 126 126 THR CB C 13 68.4780 . . . . . . . . 210 THR CB . 6759 1 1309 . 1 1 126 126 THR CG2 C 13 20.2060 . . . . . . . . 210 THR CG2 . 6759 1 1310 . 1 1 126 126 THR N N 15 123.9720 . . . . . . . . 210 THR N . 6759 1 1311 . 1 1 127 127 ASN H H 1 8.6820 . . . . . . . . 211 ASN HN . 6759 1 1312 . 1 1 127 127 ASN HA H 1 4.5370 . . . . . . . . 211 ASN HA . 6759 1 1313 . 1 1 127 127 ASN HB2 H 1 2.5650 . . . . . . . . 211 ASN HB1|HB2 . 6759 1 1314 . 1 1 127 127 ASN CA C 13 53.7080 . . . . . . . . 211 ASN CA . 6759 1 1315 . 1 1 127 127 ASN CB C 13 39.9300 . . . . . . . . 211 ASN CB . 6759 1 1316 . 1 1 127 127 ASN N N 15 124.4190 . . . . . . . . 211 ASN N . 6759 1 1317 . 1 1 130 130 TYR HA H 1 4.2730 . . . . . . . . 214 TYR HA . 6759 1 1318 . 1 1 130 130 TYR HB2 H 1 2.8960 . . . . . . . . 214 TYR HB1|HB2 . 6759 1 1319 . 1 1 130 130 TYR HB3 H 1 2.7990 . . . . . . . . 214 TYR HB2|HB1 . 6759 1 1320 . 1 1 130 130 TYR HD1 H 1 6.8610 . . . . . . . . 214 TYR HD1|HD2 . 6759 1 1321 . 1 1 130 130 TYR HE1 H 1 6.5850 . . . . . . . . 214 TYR HE1|HE2 . 6759 1 1322 . 1 1 130 130 TYR C C 13 173.7180 . . . . . . . . 214 TYR C . 6759 1 1323 . 1 1 130 130 TYR CA C 13 59.3850 . . . . . . . . 214 TYR CA . 6759 1 1324 . 1 1 130 130 TYR CB C 13 40.0130 . . . . . . . . 214 TYR CB . 6759 1 1325 . 1 1 130 130 TYR CD1 C 13 131.8310 . . . . . . . . 214 TYR CD1|CD2 . 6759 1 1326 . 1 1 130 130 TYR CE1 C 13 117.7800 . . . . . . . . 214 TYR CE1|CE2 . 6759 1 1327 . 1 1 131 131 THR H H 1 7.3510 . . . . . . . . 215 THR HN . 6759 1 1328 . 1 1 131 131 THR HA H 1 4.2740 . . . . . . . . 215 THR HA . 6759 1 1329 . 1 1 131 131 THR HB H 1 3.1840 . . . . . . . . 215 THR HB . 6759 1 1330 . 1 1 131 131 THR C C 13 171.3350 . . . . . . . . 215 THR C . 6759 1 1331 . 1 1 131 131 THR CA C 13 58.9690 . . . . . . . . 215 THR CA . 6759 1 1332 . 1 1 131 131 THR CB C 13 70.4310 . . . . . . . . 215 THR CB . 6759 1 1333 . 1 1 131 131 THR CG2 C 13 20.0000 . . . . . . . . 215 THR CG2 . 6759 1 1334 . 1 1 131 131 THR N N 15 125.9410 . . . . . . . . 215 THR N . 6759 1 1335 . 1 1 132 132 LYS H H 1 9.7200 . . . . . . . . 216 LYS HN . 6759 1 1336 . 1 1 132 132 LYS HA H 1 4.6260 . . . . . . . . 216 LYS HA . 6759 1 1337 . 1 1 132 132 LYS HB2 H 1 1.5730 . . . . . . . . 216 LYS HB1|HB2 . 6759 1 1338 . 1 1 132 132 LYS HG2 H 1 0.8640 . . . . . . . . 216 LYS HG1|HG2 . 6759 1 1339 . 1 1 132 132 LYS HG3 H 1 1.1290 . . . . . . . . 216 LYS HG2|HG1 . 6759 1 1340 . 1 1 132 132 LYS HD2 H 1 0.7580 . . . . . . . . 216 LYS HD1|HD2 . 6759 1 1341 . 1 1 132 132 LYS HD3 H 1 0.6150 . . . . . . . . 216 LYS HD2|HD1 . 6759 1 1342 . 1 1 132 132 LYS HE2 H 1 2.6600 . . . . . . . . 216 LYS HE1|HE2 . 6759 1 1343 . 1 1 132 132 LYS HE3 H 1 2.5190 . . . . . . . . 216 LYS HE2|HE1 . 6759 1 1344 . 1 1 132 132 LYS C C 13 173.6330 . . . . . . . . 216 LYS C . 6759 1 1345 . 1 1 132 132 LYS CA C 13 54.3840 . . . . . . . . 216 LYS CA . 6759 1 1346 . 1 1 132 132 LYS CB C 13 33.7650 . . . . . . . . 216 LYS CB . 6759 1 1347 . 1 1 132 132 LYS CG C 13 24.6780 . . . . . . . . 216 LYS CG . 6759 1 1348 . 1 1 132 132 LYS CD C 13 31.8380 . . . . . . . . 216 LYS CD . 6759 1 1349 . 1 1 132 132 LYS CE C 13 42.9580 . . . . . . . . 216 LYS CE . 6759 1 1350 . 1 1 132 132 LYS N N 15 128.6890 . . . . . . . . 216 LYS N . 6759 1 1351 . 1 1 133 133 LEU H H 1 8.5780 . . . . . . . . 217 LEU HN . 6759 1 1352 . 1 1 133 133 LEU HA H 1 5.0460 . . . . . . . . 217 LEU HA . 6759 1 1353 . 1 1 133 133 LEU HB2 H 1 1.2140 . . . . . . . . 217 LEU HB1|HB2 . 6759 1 1354 . 1 1 133 133 LEU HB3 H 1 0.9490 . . . . . . . . 217 LEU HB2|HB1 . 6759 1 1355 . 1 1 133 133 LEU HG H 1 0.9070 . . . . . . . . 217 LEU HG . 6759 1 1356 . 1 1 133 133 LEU HD11 H 1 -0.0600 . . . . . . . . 217 LEU HD1#|HD2#| . 6759 1 1357 . 1 1 133 133 LEU HD12 H 1 -0.0600 . . . . . . . . 217 LEU HD1#|HD2#| . 6759 1 1358 . 1 1 133 133 LEU HD13 H 1 -0.0600 . . . . . . . . 217 LEU HD1#|HD2#| . 6759 1 1359 . 1 1 133 133 LEU HD21 H 1 -0.2610 . . . . . . . . 217 LEU HD2#|HD1# . 6759 1 1360 . 1 1 133 133 LEU HD22 H 1 -0.2610 . . . . . . . . 217 LEU HD2#|HD1# . 6759 1 1361 . 1 1 133 133 LEU HD23 H 1 -0.2610 . . . . . . . . 217 LEU HD2#|HD1# . 6759 1 1362 . 1 1 133 133 LEU C C 13 173.7860 . . . . . . . . 217 LEU C . 6759 1 1363 . 1 1 133 133 LEU CA C 13 53.7080 . . . . . . . . 217 LEU CA . 6759 1 1364 . 1 1 133 133 LEU CB C 13 43.4650 . . . . . . . . 217 LEU CB . 6759 1 1365 . 1 1 133 133 LEU CG C 13 27.2610 . . . . . . . . 217 LEU CG . 6759 1 1366 . 1 1 133 133 LEU CD1 C 13 24.9750 . . . . . . . . 217 LEU CD1 . 6759 1 1367 . 1 1 133 133 LEU CD2 C 13 23.7350 . . . . . . . . 217 LEU CD2 . 6759 1 1368 . 1 1 133 133 LEU N N 15 108.8160 . . . . . . . . 217 LEU N . 6759 1 1369 . 1 1 134 134 VAL H H 1 8.7910 . . . . . . . . 218 VAL HN . 6759 1 1370 . 1 1 134 134 VAL HA H 1 4.7640 . . . . . . . . 218 VAL HA . 6759 1 1371 . 1 1 134 134 VAL HB H 1 1.8680 . . . . . . . . 218 VAL HB . 6759 1 1372 . 1 1 134 134 VAL HG11 H 1 0.9320 . . . . . . . . 218 VAL HG1# . 6759 1 1373 . 1 1 134 134 VAL HG12 H 1 0.9320 . . . . . . . . 218 VAL HG1# . 6759 1 1374 . 1 1 134 134 VAL HG13 H 1 0.9320 . . . . . . . . 218 VAL HG1# . 6759 1 1375 . 1 1 134 134 VAL HG21 H 1 0.8560 . . . . . . . . 218 VAL HG2# . 6759 1 1376 . 1 1 134 134 VAL HG22 H 1 0.8560 . . . . . . . . 218 VAL HG2# . 6759 1 1377 . 1 1 134 134 VAL HG23 H 1 0.8560 . . . . . . . . 218 VAL HG2# . 6759 1 1378 . 1 1 134 134 VAL C C 13 177.4120 . . . . . . . . 218 VAL C . 6759 1 1379 . 1 1 134 134 VAL CA C 13 59.7940 . . . . . . . . 218 VAL CA . 6759 1 1380 . 1 1 134 134 VAL CB C 13 33.5200 . . . . . . . . 218 VAL CB . 6759 1 1381 . 1 1 134 134 VAL CG1 C 13 20.4910 . . . . . . . . 218 VAL CG1 . 6759 1 1382 . 1 1 134 134 VAL CG2 C 13 18.3130 . . . . . . . . 218 VAL CG2 . 6759 1 1383 . 1 1 134 134 VAL N N 15 124.6570 . . . . . . . . 218 VAL N . 6759 1 1384 . 1 1 135 135 PHE H H 1 9.3270 . . . . . . . . 219 PHE HN . 6759 1 1385 . 1 1 135 135 PHE HA H 1 5.0100 . . . . . . . . 219 PHE HA . 6759 1 1386 . 1 1 135 135 PHE HB2 H 1 3.0810 . . . . . . . . 219 PHE HB1|HB2 . 6759 1 1387 . 1 1 135 135 PHE HB3 H 1 3.5810 . . . . . . . . 219 PHE HB2|HB1 . 6759 1 1388 . 1 1 135 135 PHE HD1 H 1 7.1710 . . . . . . . . 219 PHE HD1|HD2 . 6759 1 1389 . 1 1 135 135 PHE HE1 H 1 6.8950 . . . . . . . . 219 PHE HE1|HE2 . 6759 1 1390 . 1 1 135 135 PHE C C 13 176.9780 . . . . . . . . 219 PHE C . 6759 1 1391 . 1 1 135 135 PHE CA C 13 58.8500 . . . . . . . . 219 PHE CA . 6759 1 1392 . 1 1 135 135 PHE CB C 13 41.1650 . . . . . . . . 219 PHE CB . 6759 1 1393 . 1 1 135 135 PHE CD1 C 13 131.7280 . . . . . . . . 219 PHE CD1|CD2 . 6759 1 1394 . 1 1 135 135 PHE CE1 C 13 129.7780 . . . . . . . . 219 PHE CE1|CE2 . 6759 1 1395 . 1 1 135 135 PHE N N 15 129.0630 . . . . . . . . 219 PHE N . 6759 1 1396 . 1 1 136 136 ALA H H 1 8.9800 . . . . . . . . 220 ALA HN . 6759 1 1397 . 1 1 136 136 ALA HA H 1 4.0620 . . . . . . . . 220 ALA HA . 6759 1 1398 . 1 1 136 136 ALA HB1 H 1 1.4850 . . . . . . . . 220 ALA HB# . 6759 1 1399 . 1 1 136 136 ALA HB2 H 1 1.4850 . . . . . . . . 220 ALA HB# . 6759 1 1400 . 1 1 136 136 ALA HB3 H 1 1.4850 . . . . . . . . 220 ALA HB# . 6759 1 1401 . 1 1 136 136 ALA C C 13 176.8680 . . . . . . . . 220 ALA C . 6759 1 1402 . 1 1 136 136 ALA CA C 13 53.5930 . . . . . . . . 220 ALA CA . 6759 1 1403 . 1 1 136 136 ALA CB C 13 19.3290 . . . . . . . . 220 ALA CB . 6759 1 1404 . 1 1 136 136 ALA N N 15 121.6530 . . . . . . . . 220 ALA N . 6759 1 1405 . 1 1 137 137 LYS H H 1 7.5250 . . . . . . . . 221 LYS HN . 6759 1 1406 . 1 1 137 137 LYS HA H 1 4.7030 . . . . . . . . 221 LYS HA . 6759 1 1407 . 1 1 137 137 LYS HB2 H 1 1.8810 . . . . . . . . 221 LYS HB1|HB2 . 6759 1 1408 . 1 1 137 137 LYS HB3 H 1 1.7000 . . . . . . . . 221 LYS HB2|HB1 . 6759 1 1409 . 1 1 137 137 LYS HG2 H 1 1.3050 . . . . . . . . 221 LYS HG1|HG2 . 6759 1 1410 . 1 1 137 137 LYS HG3 H 1 1.2020 . . . . . . . . 221 LYS HG2|HG1 . 6759 1 1411 . 1 1 137 137 LYS HD2 H 1 1.6910 . . . . . . . . 221 LYS HD1|HD2 . 6759 1 1412 . 1 1 137 137 LYS HE2 H 1 3.0990 . . . . . . . . 221 LYS HE1|HE2 . 6759 1 1413 . 1 1 137 137 LYS HE3 H 1 3.0320 . . . . . . . . 221 LYS HE2|HE1 . 6759 1 1414 . 1 1 137 137 LYS CA C 13 52.6690 . . . . . . . . 221 LYS CA . 6759 1 1415 . 1 1 137 137 LYS CB C 13 32.6290 . . . . . . . . 221 LYS CB . 6759 1 1416 . 1 1 137 137 LYS CG C 13 22.5180 . . . . . . . . 221 LYS CG . 6759 1 1417 . 1 1 137 137 LYS CD C 13 29.1270 . . . . . . . . 221 LYS CD . 6759 1 1418 . 1 1 137 137 LYS CE C 13 42.9200 . . . . . . . . 221 LYS CE . 6759 1 1419 . 1 1 137 137 LYS N N 15 112.2720 . . . . . . . . 221 LYS N . 6759 1 1420 . 1 1 138 138 PRO HA H 1 4.1710 . . . . . . . . 222 PRO HA . 6759 1 1421 . 1 1 138 138 PRO HB2 H 1 1.9270 . . . . . . . . 222 PRO HB1|HB2 . 6759 1 1422 . 1 1 138 138 PRO HB3 H 1 1.5420 . . . . . . . . 222 PRO HB2|HB1 . 6759 1 1423 . 1 1 138 138 PRO HG2 H 1 2.1680 . . . . . . . . 222 PRO HG1|HG2 . 6759 1 1424 . 1 1 138 138 PRO HG3 H 1 1.9250 . . . . . . . . 222 PRO HG2|HG1 . 6759 1 1425 . 1 1 138 138 PRO HD2 H 1 3.6050 . . . . . . . . 222 PRO HD1|HD2 . 6759 1 1426 . 1 1 138 138 PRO C C 13 175.8290 . . . . . . . . 222 PRO C . 6759 1 1427 . 1 1 138 138 PRO CA C 13 61.5780 . . . . . . . . 222 PRO CA . 6759 1 1428 . 1 1 138 138 PRO CB C 13 31.4910 . . . . . . . . 222 PRO CB . 6759 1 1429 . 1 1 138 138 PRO CG C 13 27.3970 . . . . . . . . 222 PRO CG . 6759 1 1430 . 1 1 138 138 PRO CD C 13 49.6100 . . . . . . . . 222 PRO CD . 6759 1 1431 . 1 1 139 139 ILE H H 1 8.0080 . . . . . . . . 223 ILE HN . 6759 1 1432 . 1 1 139 139 ILE HA H 1 3.6890 . . . . . . . . 223 ILE HA . 6759 1 1433 . 1 1 139 139 ILE HB H 1 1.5930 . . . . . . . . 223 ILE HB . 6759 1 1434 . 1 1 139 139 ILE HG12 H 1 1.0490 . . . . . . . . 223 ILE HG11|HG12 . 6759 1 1435 . 1 1 139 139 ILE HG13 H 1 0.5950 . . . . . . . . 223 ILE HG12|HG11 . 6759 1 1436 . 1 1 139 139 ILE HG21 H 1 0.3800 . . . . . . . . 223 ILE HG2# . 6759 1 1437 . 1 1 139 139 ILE HG22 H 1 0.3800 . . . . . . . . 223 ILE HG2# . 6759 1 1438 . 1 1 139 139 ILE HG23 H 1 0.3800 . . . . . . . . 223 ILE HG2# . 6759 1 1439 . 1 1 139 139 ILE HD11 H 1 -0.2070 . . . . . . . . 223 ILE HD1# . 6759 1 1440 . 1 1 139 139 ILE HD12 H 1 -0.2070 . . . . . . . . 223 ILE HD1# . 6759 1 1441 . 1 1 139 139 ILE HD13 H 1 -0.2070 . . . . . . . . 223 ILE HD1# . 6759 1 1442 . 1 1 139 139 ILE C C 13 174.6840 . . . . . . . . 223 ILE C . 6759 1 1443 . 1 1 139 139 ILE CA C 13 59.0520 . . . . . . . . 223 ILE CA . 6759 1 1444 . 1 1 139 139 ILE CB C 13 36.1920 . . . . . . . . 223 ILE CB . 6759 1 1445 . 1 1 139 139 ILE CG1 C 13 27.2460 . . . . . . . . 223 ILE CG1 . 6759 1 1446 . 1 1 139 139 ILE CG2 C 13 17.5700 . . . . . . . . 223 ILE CG2 . 6759 1 1447 . 1 1 139 139 ILE CD1 C 13 9.0700 . . . . . . . . 223 ILE CD1 . 6759 1 1448 . 1 1 139 139 ILE N N 15 122.5190 . . . . . . . . 223 ILE N . 6759 1 1449 . 1 1 140 140 TYR H H 1 7.9930 . . . . . . . . 224 TYR HN . 6759 1 1450 . 1 1 140 140 TYR HA H 1 4.5980 . . . . . . . . 224 TYR HA . 6759 1 1451 . 1 1 140 140 TYR HB2 H 1 2.7650 . . . . . . . . 224 TYR HB1|HB2 . 6759 1 1452 . 1 1 140 140 TYR HB3 H 1 2.5500 . . . . . . . . 224 TYR HB2|HB1 . 6759 1 1453 . 1 1 140 140 TYR HD1 H 1 6.9730 . . . . . . . . 224 TYR HD1|HD2 . 6759 1 1454 . 1 1 140 140 TYR HE1 H 1 6.6520 . . . . . . . . 224 TYR HE1|HE2 . 6759 1 1455 . 1 1 140 140 TYR C C 13 175.4760 . . . . . . . . 224 TYR C . 6759 1 1456 . 1 1 140 140 TYR CA C 13 57.2710 . . . . . . . . 224 TYR CA . 6759 1 1457 . 1 1 140 140 TYR CB C 13 41.6840 . . . . . . . . 224 TYR CB . 6759 1 1458 . 1 1 140 140 TYR CD1 C 13 132.8820 . . . . . . . . 224 TYR CD1|CD2 . 6759 1 1459 . 1 1 140 140 TYR CE1 C 13 117.3000 . . . . . . . . 224 TYR CE1|CE2 . 6759 1 1460 . 1 1 140 140 TYR N N 15 123.1410 . . . . . . . . 224 TYR N . 6759 1 1461 . 1 1 141 141 ASN H H 1 9.2770 . . . . . . . . 225 ASN HN . 6759 1 1462 . 1 1 141 141 ASN HA H 1 4.5150 . . . . . . . . 225 ASN HA . 6759 1 1463 . 1 1 141 141 ASN HB2 H 1 2.9370 . . . . . . . . 225 ASN HB1|HB2 . 6759 1 1464 . 1 1 141 141 ASN HB3 H 1 2.8760 . . . . . . . . 225 ASN HB2|HB1 . 6759 1 1465 . 1 1 141 141 ASN C C 13 175.0290 . . . . . . . . 225 ASN C . 6759 1 1466 . 1 1 141 141 ASN CA C 13 52.5950 . . . . . . . . 225 ASN CA . 6759 1 1467 . 1 1 141 141 ASN CB C 13 39.2350 . . . . . . . . 225 ASN CB . 6759 1 1468 . 1 1 141 141 ASN N N 15 120.7590 . . . . . . . . 225 ASN N . 6759 1 1469 . 1 1 142 142 ASP HA H 1 4.7530 . . . . . . . . 226 ASP HA . 6759 1 1470 . 1 1 142 142 ASP HB2 H 1 2.0670 . . . . . . . . 226 ASP HB1 . 6759 1 1471 . 1 1 142 142 ASP HB3 H 1 1.7240 . . . . . . . . 226 ASP HB2 . 6759 1 1472 . 1 1 142 142 ASP CA C 13 49.9500 . . . . . . . . 226 ASP CA . 6759 1 1473 . 1 1 142 142 ASP CB C 13 40.2100 . . . . . . . . 226 ASP CB . 6759 1 1474 . 1 1 143 143 PRO HA H 1 4.5020 . . . . . . . . 227 PRO HA . 6759 1 1475 . 1 1 143 143 PRO HB2 H 1 2.0260 . . . . . . . . 227 PRO HB1|HB2 . 6759 1 1476 . 1 1 143 143 PRO HG2 H 1 1.8910 . . . . . . . . 227 PRO HG1|HG2 . 6759 1 1477 . 1 1 143 143 PRO HG3 H 1 1.7880 . . . . . . . . 227 PRO HG2|HG1 . 6759 1 1478 . 1 1 143 143 PRO HD2 H 1 3.7500 . . . . . . . . 227 PRO HD1|HD2 . 6759 1 1479 . 1 1 143 143 PRO HD3 H 1 3.3640 . . . . . . . . 227 PRO HD2|HD1 . 6759 1 1480 . 1 1 143 143 PRO C C 13 176.8760 . . . . . . . . 227 PRO C . 6759 1 1481 . 1 1 143 143 PRO CA C 13 63.2000 . . . . . . . . 227 PRO CA . 6759 1 1482 . 1 1 143 143 PRO CB C 13 32.0130 . . . . . . . . 227 PRO CB . 6759 1 1483 . 1 1 143 143 PRO CG C 13 25.9300 . . . . . . . . 227 PRO CG . 6759 1 1484 . 1 1 143 143 PRO CD C 13 50.0700 . . . . . . . . 227 PRO CD . 6759 1 1485 . 1 1 144 144 SER H H 1 8.1990 . . . . . . . . 228 SER HN . 6759 1 1486 . 1 1 144 144 SER HA H 1 4.2730 . . . . . . . . 228 SER HA . 6759 1 1487 . 1 1 144 144 SER HB2 H 1 3.8170 . . . . . . . . 228 SER HB1|HB2 . 6759 1 1488 . 1 1 144 144 SER HB3 H 1 3.7230 . . . . . . . . 228 SER HB2|HB1 . 6759 1 1489 . 1 1 144 144 SER C C 13 176.5920 . . . . . . . . 228 SER C . 6759 1 1490 . 1 1 144 144 SER CA C 13 58.8840 . . . . . . . . 228 SER CA . 6759 1 1491 . 1 1 144 144 SER CB C 13 63.7290 . . . . . . . . 228 SER CB . 6759 1 1492 . 1 1 144 144 SER N N 15 117.0810 . . . . . . . . 228 SER N . 6759 1 1493 . 1 1 145 145 LEU H H 1 6.9900 . . . . . . . . 229 LEU HN . 6759 1 1494 . 1 1 145 145 LEU HA H 1 4.0130 . . . . . . . . 229 LEU HA . 6759 1 1495 . 1 1 145 145 LEU HB2 H 1 1.4740 . . . . . . . . 229 LEU HB1|HB2 . 6759 1 1496 . 1 1 145 145 LEU HG H 1 1.3870 . . . . . . . . 229 LEU HG . 6759 1 1497 . 1 1 145 145 LEU HD11 H 1 0.8000 . . . . . . . . 229 LEU HD1#|HD2# . 6759 1 1498 . 1 1 145 145 LEU HD12 H 1 0.8000 . . . . . . . . 229 LEU HD1#|HD2# . 6759 1 1499 . 1 1 145 145 LEU HD13 H 1 0.8000 . . . . . . . . 229 LEU HD1#|HD2# . 6759 1 1500 . 1 1 145 145 LEU HD21 H 1 0.7240 . . . . . . . . 229 LEU HD2#|HD1# . 6759 1 1501 . 1 1 145 145 LEU HD22 H 1 0.7240 . . . . . . . . 229 LEU HD2#|HD1# . 6759 1 1502 . 1 1 145 145 LEU HD23 H 1 0.7240 . . . . . . . . 229 LEU HD2#|HD1# . 6759 1 1503 . 1 1 145 145 LEU CA C 13 56.3420 . . . . . . . . 229 LEU CA . 6759 1 1504 . 1 1 145 145 LEU CB C 13 42.6810 . . . . . . . . 229 LEU CB . 6759 1 1505 . 1 1 145 145 LEU CG C 13 26.7070 . . . . . . . . 229 LEU CG . 6759 1 1506 . 1 1 145 145 LEU CD1 C 13 25.3840 . . . . . . . . 229 LEU CD1 . 6759 1 1507 . 1 1 145 145 LEU CD2 C 13 22.8280 . . . . . . . . 229 LEU CD2 . 6759 1 1508 . 1 1 145 145 LEU N N 15 128.6210 . . . . . . . . 229 LEU N . 6759 1 stop_ save_