data_27170 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27170 _Entry.Title ; Sequence specific 1H, 13C and 15N resonance assignments of a cataract-related variant G57W of human Gamma S-Crystallin ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-07-10 _Entry.Accession_date 2017-07-10 _Entry.Last_release_date 2017-07-10 _Entry.Original_release_date 2017-07-10 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Jishan 'Khandekar Bari' . . . . 27170 2 Shrikant Sharma . . . . 27170 3 'Kandala V.R.' Chary . . . . 27170 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27170 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 630 27170 '15N chemical shifts' 177 27170 '1H chemical shifts' 1139 27170 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 4 . . 2018-11-27 2017-07-10 update author 'update assignments' 27170 3 . . 2018-04-06 2017-07-10 update BMRB 'update entry citation' 27170 2 . . 2017-08-30 2017-07-10 update author 'update assignments, etc.' 27170 1 . . 2017-08-04 2017-07-10 original author 'original release' 27170 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27170 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 28936763 _Citation.Full_citation . _Citation.Title ; Sequence specific 1H, 13C and 15N resonance assignments of a cataract-related variant G57W of human Gamma S-Crystallin ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 12 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 51 _Citation.Page_last 55 _Citation.Year 2018 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Jishan 'Khandekar Bari' . . . . 27170 1 2 Shrikant Sharma . . . . 27170 1 3 'Kandala V.R.' Chary . . . . 27170 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27170 _Assembly.ID 1 _Assembly.Name 'Polypeptide chain' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Polypeptide chain' 1 $G57W_mutant_of_human_Gamma_S-Crystallin A . yes native no no . . . 27170 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_G57W_mutant_of_human_Gamma_S-Crystallin _Entity.Sf_category entity _Entity.Sf_framecode G57W_mutant_of_human_Gamma_S-Crystallin _Entity.Entry_ID 27170 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name G57W_mutant_of_human_Gamma_S-Crystallin _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 ; MSKTGTKITFYEDKNFQGRR YDCDCDCADFHTYLSRCNSI KVEGGTWAVYERPNFAWYMY ILPQGEYPEYQRWMGLNDRL SSCRAVHLPSGGQYKIQIFE KGDFSGQMYETTEDCPSIME QFHMREIHSCKVLEGVWIFY ELPNYRGRQYLLDKKEYRKP IDWGAASPAVQSFRRIVE ; _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 184 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _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 1 MET . 27170 1 2 2 SER . 27170 1 3 3 LYS . 27170 1 4 4 THR . 27170 1 5 5 GLY . 27170 1 6 6 THR . 27170 1 7 7 LYS . 27170 1 8 8 ILE . 27170 1 9 9 THR . 27170 1 10 10 PHE . 27170 1 11 11 TYR . 27170 1 12 12 GLU . 27170 1 13 13 ASP . 27170 1 14 14 LYS . 27170 1 15 15 ASN . 27170 1 16 16 PHE . 27170 1 17 17 GLN . 27170 1 18 18 GLY . 27170 1 19 19 ARG . 27170 1 20 20 ARG . 27170 1 21 21 TYR . 27170 1 22 22 ASP . 27170 1 23 23 CYS . 27170 1 24 24 ASP . 27170 1 25 25 CYS . 27170 1 26 26 ASP . 27170 1 27 27 CYS . 27170 1 28 28 ALA . 27170 1 29 29 ASP . 27170 1 30 30 PHE . 27170 1 31 31 HIS . 27170 1 32 32 THR . 27170 1 33 33 TYR . 27170 1 34 34 LEU . 27170 1 35 35 SER . 27170 1 36 36 ARG . 27170 1 37 37 CYS . 27170 1 38 38 ASN . 27170 1 39 39 SER . 27170 1 40 40 ILE . 27170 1 41 41 LYS . 27170 1 42 42 VAL . 27170 1 43 43 GLU . 27170 1 44 44 GLY . 27170 1 45 45 GLY . 27170 1 46 46 THR . 27170 1 47 47 TRP . 27170 1 48 48 ALA . 27170 1 49 49 VAL . 27170 1 50 50 TYR . 27170 1 51 51 GLU . 27170 1 52 52 ARG . 27170 1 53 53 PRO . 27170 1 54 54 ASN . 27170 1 55 55 PHE . 27170 1 56 56 ALA . 27170 1 57 57 TRP . 27170 1 58 58 TYR . 27170 1 59 59 MET . 27170 1 60 60 TYR . 27170 1 61 61 ILE . 27170 1 62 62 LEU . 27170 1 63 63 PRO . 27170 1 64 64 GLN . 27170 1 65 65 GLY . 27170 1 66 66 GLU . 27170 1 67 67 TYR . 27170 1 68 68 PRO . 27170 1 69 69 GLU . 27170 1 70 70 TYR . 27170 1 71 71 GLN . 27170 1 72 72 ARG . 27170 1 73 73 TRP . 27170 1 74 74 MET . 27170 1 75 75 GLY . 27170 1 76 76 LEU . 27170 1 77 77 ASN . 27170 1 78 78 ASP . 27170 1 79 79 ARG . 27170 1 80 80 LEU . 27170 1 81 81 SER . 27170 1 82 82 SER . 27170 1 83 83 CYS . 27170 1 84 84 ARG . 27170 1 85 85 ALA . 27170 1 86 86 VAL . 27170 1 87 87 HIS . 27170 1 88 88 LEU . 27170 1 89 89 PRO . 27170 1 90 90 SER . 27170 1 91 91 GLY . 27170 1 92 92 GLY . 27170 1 93 93 GLN . 27170 1 94 94 TYR . 27170 1 95 95 LYS . 27170 1 96 96 ILE . 27170 1 97 97 GLN . 27170 1 98 98 ILE . 27170 1 99 99 PHE . 27170 1 100 100 GLU . 27170 1 101 101 LYS . 27170 1 102 102 GLY . 27170 1 103 103 ASP . 27170 1 104 104 PHE . 27170 1 105 105 SER . 27170 1 106 106 GLY . 27170 1 107 107 GLN . 27170 1 108 108 MET . 27170 1 109 109 TYR . 27170 1 110 110 GLU . 27170 1 111 111 THR . 27170 1 112 112 THR . 27170 1 113 113 GLU . 27170 1 114 114 ASP . 27170 1 115 115 CYS . 27170 1 116 116 PRO . 27170 1 117 117 SER . 27170 1 118 118 ILE . 27170 1 119 119 MET . 27170 1 120 120 GLU . 27170 1 121 121 GLN . 27170 1 122 122 PHE . 27170 1 123 123 HIS . 27170 1 124 124 MET . 27170 1 125 125 ARG . 27170 1 126 126 GLU . 27170 1 127 127 ILE . 27170 1 128 128 HIS . 27170 1 129 129 SER . 27170 1 130 130 CYS . 27170 1 131 131 LYS . 27170 1 132 132 VAL . 27170 1 133 133 LEU . 27170 1 134 134 GLU . 27170 1 135 135 GLY . 27170 1 136 136 VAL . 27170 1 137 137 TRP . 27170 1 138 138 ILE . 27170 1 139 139 PHE . 27170 1 140 140 TYR . 27170 1 141 141 GLU . 27170 1 142 142 LEU . 27170 1 143 143 PRO . 27170 1 144 144 ASN . 27170 1 145 145 TYR . 27170 1 146 146 ARG . 27170 1 147 147 GLY . 27170 1 148 148 ARG . 27170 1 149 149 GLN . 27170 1 150 150 TYR . 27170 1 151 151 LEU . 27170 1 152 152 LEU . 27170 1 153 153 ASP . 27170 1 154 154 LYS . 27170 1 155 155 LYS . 27170 1 156 156 GLU . 27170 1 157 157 TYR . 27170 1 158 158 ARG . 27170 1 159 159 LYS . 27170 1 160 160 PRO . 27170 1 161 161 ILE . 27170 1 162 162 ASP . 27170 1 163 163 TRP . 27170 1 164 164 GLY . 27170 1 165 165 ALA . 27170 1 166 166 ALA . 27170 1 167 167 SER . 27170 1 168 168 PRO . 27170 1 169 169 ALA . 27170 1 170 170 VAL . 27170 1 171 171 GLN . 27170 1 172 172 SER . 27170 1 173 173 PHE . 27170 1 174 174 ARG . 27170 1 175 175 ARG . 27170 1 176 176 ILE . 27170 1 177 177 VAL . 27170 1 178 178 GLU . 27170 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 27170 1 . SER 2 2 27170 1 . LYS 3 3 27170 1 . THR 4 4 27170 1 . GLY 5 5 27170 1 . THR 6 6 27170 1 . LYS 7 7 27170 1 . ILE 8 8 27170 1 . THR 9 9 27170 1 . PHE 10 10 27170 1 . TYR 11 11 27170 1 . GLU 12 12 27170 1 . ASP 13 13 27170 1 . LYS 14 14 27170 1 . ASN 15 15 27170 1 . PHE 16 16 27170 1 . GLN 17 17 27170 1 . GLY 18 18 27170 1 . ARG 19 19 27170 1 . ARG 20 20 27170 1 . TYR 21 21 27170 1 . ASP 22 22 27170 1 . CYS 23 23 27170 1 . ASP 24 24 27170 1 . CYS 25 25 27170 1 . ASP 26 26 27170 1 . CYS 27 27 27170 1 . ALA 28 28 27170 1 . ASP 29 29 27170 1 . PHE 30 30 27170 1 . HIS 31 31 27170 1 . THR 32 32 27170 1 . TYR 33 33 27170 1 . LEU 34 34 27170 1 . SER 35 35 27170 1 . ARG 36 36 27170 1 . CYS 37 37 27170 1 . ASN 38 38 27170 1 . SER 39 39 27170 1 . ILE 40 40 27170 1 . LYS 41 41 27170 1 . VAL 42 42 27170 1 . GLU 43 43 27170 1 . GLY 44 44 27170 1 . GLY 45 45 27170 1 . THR 46 46 27170 1 . TRP 47 47 27170 1 . ALA 48 48 27170 1 . VAL 49 49 27170 1 . TYR 50 50 27170 1 . GLU 51 51 27170 1 . ARG 52 52 27170 1 . PRO 53 53 27170 1 . ASN 54 54 27170 1 . PHE 55 55 27170 1 . ALA 56 56 27170 1 . TRP 57 57 27170 1 . TYR 58 58 27170 1 . MET 59 59 27170 1 . TYR 60 60 27170 1 . ILE 61 61 27170 1 . LEU 62 62 27170 1 . PRO 63 63 27170 1 . GLN 64 64 27170 1 . GLY 65 65 27170 1 . GLU 66 66 27170 1 . TYR 67 67 27170 1 . PRO 68 68 27170 1 . GLU 69 69 27170 1 . TYR 70 70 27170 1 . GLN 71 71 27170 1 . ARG 72 72 27170 1 . TRP 73 73 27170 1 . MET 74 74 27170 1 . GLY 75 75 27170 1 . LEU 76 76 27170 1 . ASN 77 77 27170 1 . ASP 78 78 27170 1 . ARG 79 79 27170 1 . LEU 80 80 27170 1 . SER 81 81 27170 1 . SER 82 82 27170 1 . CYS 83 83 27170 1 . ARG 84 84 27170 1 . ALA 85 85 27170 1 . VAL 86 86 27170 1 . HIS 87 87 27170 1 . LEU 88 88 27170 1 . PRO 89 89 27170 1 . SER 90 90 27170 1 . GLY 91 91 27170 1 . GLY 92 92 27170 1 . GLN 93 93 27170 1 . TYR 94 94 27170 1 . LYS 95 95 27170 1 . ILE 96 96 27170 1 . GLN 97 97 27170 1 . ILE 98 98 27170 1 . PHE 99 99 27170 1 . GLU 100 100 27170 1 . LYS 101 101 27170 1 . GLY 102 102 27170 1 . ASP 103 103 27170 1 . PHE 104 104 27170 1 . SER 105 105 27170 1 . GLY 106 106 27170 1 . GLN 107 107 27170 1 . MET 108 108 27170 1 . TYR 109 109 27170 1 . GLU 110 110 27170 1 . THR 111 111 27170 1 . THR 112 112 27170 1 . GLU 113 113 27170 1 . ASP 114 114 27170 1 . CYS 115 115 27170 1 . PRO 116 116 27170 1 . SER 117 117 27170 1 . ILE 118 118 27170 1 . MET 119 119 27170 1 . GLU 120 120 27170 1 . GLN 121 121 27170 1 . PHE 122 122 27170 1 . HIS 123 123 27170 1 . MET 124 124 27170 1 . ARG 125 125 27170 1 . GLU 126 126 27170 1 . ILE 127 127 27170 1 . HIS 128 128 27170 1 . SER 129 129 27170 1 . CYS 130 130 27170 1 . LYS 131 131 27170 1 . VAL 132 132 27170 1 . LEU 133 133 27170 1 . GLU 134 134 27170 1 . GLY 135 135 27170 1 . VAL 136 136 27170 1 . TRP 137 137 27170 1 . ILE 138 138 27170 1 . PHE 139 139 27170 1 . TYR 140 140 27170 1 . GLU 141 141 27170 1 . LEU 142 142 27170 1 . PRO 143 143 27170 1 . ASN 144 144 27170 1 . TYR 145 145 27170 1 . ARG 146 146 27170 1 . GLY 147 147 27170 1 . ARG 148 148 27170 1 . GLN 149 149 27170 1 . TYR 150 150 27170 1 . LEU 151 151 27170 1 . LEU 152 152 27170 1 . ASP 153 153 27170 1 . LYS 154 154 27170 1 . LYS 155 155 27170 1 . GLU 156 156 27170 1 . TYR 157 157 27170 1 . ARG 158 158 27170 1 . LYS 159 159 27170 1 . PRO 160 160 27170 1 . ILE 161 161 27170 1 . ASP 162 162 27170 1 . TRP 163 163 27170 1 . GLY 164 164 27170 1 . ALA 165 165 27170 1 . ALA 166 166 27170 1 . SER 167 167 27170 1 . PRO 168 168 27170 1 . ALA 169 169 27170 1 . VAL 170 170 27170 1 . GLN 171 171 27170 1 . SER 172 172 27170 1 . PHE 173 173 27170 1 . ARG 174 174 27170 1 . ARG 175 175 27170 1 . ILE 176 176 27170 1 . VAL 177 177 27170 1 . GLU 178 178 27170 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 27170 _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 $G57W_mutant_of_human_Gamma_S-Crystallin . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . 27170 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 27170 _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 $G57W_mutant_of_human_Gamma_S-Crystallin . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET28a . . . 27170 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27170 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'G57W mutant of human Gamma S-Crystallin' '[U-100% 13C; U-100% 15N]' . . 1 $G57W_mutant_of_human_Gamma_S-Crystallin . . 1.2 . . mM . . . . 27170 1 2 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 27170 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 27170 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 77 . mM 27170 1 pH 7.4 . pH 27170 1 pressure 1 . atm 27170 1 temperature 298 . K 27170 1 stop_ save_ ############################ # Computer software used # ############################ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 27170 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 27170 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27170 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27170 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Ascend _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27170 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Ascend . 700 . . . 27170 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 27170 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27170 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27170 1 3 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27170 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27170 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27170 1 6 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27170 1 7 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27170 1 8 '3D 15N-1H HSQC-NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27170 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27170 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27170 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27170 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27170 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27170 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27170 1 2 '3D HNCO' . . . 27170 1 3 '3D HNCA' . . . 27170 1 4 '3D HNCACB' . . . 27170 1 5 '3D CBCA(CO)NH' . . . 27170 1 6 '3D H(CCO)NH' . . . 27170 1 7 '3D C(CO)NH' . . . 27170 1 8 '3D 15N-1H HSQC-NOESY' . . . 27170 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 1 1 MET HA H 1 4.116 0.020 . 1 . . . . . 1 MET HA . 27170 1 2 . 1 1 1 1 MET C C 13 176.400 0.3 . 1 . . . . . 1 MET C . 27170 1 3 . 1 1 1 1 MET CA C 13 52.383 0.3 . 1 . . . . . 1 MET CA . 27170 1 4 . 1 1 1 1 MET CB C 13 25.817 0.3 . 1 . . . . . 1 MET CB . 27170 1 5 . 1 1 1 1 MET CG C 13 32.873 0.3 . 1 . . . . . 1 MET CG . 27170 1 6 . 1 1 2 2 SER H H 1 7.548 0.020 . 1 . . . . . 2 SER H . 27170 1 7 . 1 1 2 2 SER HA H 1 4.704 0.020 . 1 . . . . . 2 SER HA . 27170 1 8 . 1 1 2 2 SER HB2 H 1 3.651 0.020 . 1 . . . . . 2 SER HB2 . 27170 1 9 . 1 1 2 2 SER HB3 H 1 3.553 0.020 . 1 . . . . . 2 SER HB3 . 27170 1 10 . 1 1 2 2 SER C C 13 175.827 0.3 . 1 . . . . . 2 SER C . 27170 1 11 . 1 1 2 2 SER CA C 13 56.005 0.3 . 1 . . . . . 2 SER CA . 27170 1 12 . 1 1 2 2 SER CB C 13 65.803 0.3 . 1 . . . . . 2 SER CB . 27170 1 13 . 1 1 2 2 SER N N 15 114.211 0.3 . 1 . . . . . 2 SER N . 27170 1 14 . 1 1 3 3 LYS H H 1 8.884 0.020 . 1 . . . . . 3 LYS H . 27170 1 15 . 1 1 3 3 LYS HA H 1 4.349 0.020 . 1 . . . . . 3 LYS HA . 27170 1 16 . 1 1 3 3 LYS HB2 H 1 1.801 0.020 . 1 . . . . . 3 LYS HB2 . 27170 1 17 . 1 1 3 3 LYS HB3 H 1 1.777 0.020 . 1 . . . . . 3 LYS HB3 . 27170 1 18 . 1 1 3 3 LYS HG2 H 1 1.607 0.020 . 1 . . . . . 3 LYS HG2 . 27170 1 19 . 1 1 3 3 LYS HG3 H 1 1.583 0.020 . 1 . . . . . 3 LYS HG3 . 27170 1 20 . 1 1 3 3 LYS HD2 H 1 1.692 0.020 . 1 . . . . . 3 LYS HD2 . 27170 1 21 . 1 1 3 3 LYS HE2 H 1 2.904 0.020 . 1 . . . . . 3 LYS HE2 . 27170 1 22 . 1 1 3 3 LYS C C 13 177.310 0.3 . 1 . . . . . 3 LYS C . 27170 1 23 . 1 1 3 3 LYS CA C 13 58.830 0.3 . 1 . . . . . 3 LYS CA . 27170 1 24 . 1 1 3 3 LYS CB C 13 34.997 0.3 . 1 . . . . . 3 LYS CB . 27170 1 25 . 1 1 3 3 LYS CG C 13 25.431 0.3 . 1 . . . . . 3 LYS CG . 27170 1 26 . 1 1 3 3 LYS CD C 13 29.764 0.3 . 1 . . . . . 3 LYS CD . 27170 1 27 . 1 1 3 3 LYS CE C 13 42.954 0.3 . 1 . . . . . 3 LYS CE . 27170 1 28 . 1 1 3 3 LYS N N 15 122.987 0.3 . 1 . . . . . 3 LYS N . 27170 1 29 . 1 1 4 4 THR H H 1 8.203 0.020 . 1 . . . . . 4 THR H . 27170 1 30 . 1 1 4 4 THR HA H 1 4.287 0.020 . 1 . . . . . 4 THR HA . 27170 1 31 . 1 1 4 4 THR HB H 1 4.196 0.020 . 1 . . . . . 4 THR HB . 27170 1 32 . 1 1 4 4 THR HG21 H 1 1.128 0.020 . 1 . . . . . 4 THR HG2 . 27170 1 33 . 1 1 4 4 THR HG22 H 1 1.128 0.020 . 1 . . . . . 4 THR HG2 . 27170 1 34 . 1 1 4 4 THR HG23 H 1 1.128 0.020 . 1 . . . . . 4 THR HG2 . 27170 1 35 . 1 1 4 4 THR C C 13 175.490 0.3 . 1 . . . . . 4 THR C . 27170 1 36 . 1 1 4 4 THR CA C 13 62.625 0.3 . 1 . . . . . 4 THR CA . 27170 1 37 . 1 1 4 4 THR CB C 13 70.746 0.3 . 1 . . . . . 4 THR CB . 27170 1 38 . 1 1 4 4 THR CG2 C 13 22.322 0.3 . 1 . . . . . 4 THR CG2 . 27170 1 39 . 1 1 4 4 THR N N 15 114.279 0.3 . 1 . . . . . 4 THR N . 27170 1 40 . 1 1 5 5 GLY H H 1 8.286 0.020 . 1 . . . . . 5 GLY H . 27170 1 41 . 1 1 5 5 GLY HA2 H 1 3.949 0.020 . 1 . . . . . 5 GLY HA2 . 27170 1 42 . 1 1 5 5 GLY HA3 H 1 3.900 0.020 . 1 . . . . . 5 GLY HA3 . 27170 1 43 . 1 1 5 5 GLY C C 13 173.771 0.3 . 1 . . . . . 5 GLY C . 27170 1 44 . 1 1 5 5 GLY CA C 13 45.939 0.3 . 1 . . . . . 5 GLY CA . 27170 1 45 . 1 1 5 5 GLY N N 15 110.967 0.3 . 1 . . . . . 5 GLY N . 27170 1 46 . 1 1 6 6 THR H H 1 7.966 0.020 . 1 . . . . . 6 THR H . 27170 1 47 . 1 1 6 6 THR HA H 1 4.483 0.020 . 1 . . . . . 6 THR HA . 27170 1 48 . 1 1 6 6 THR HB H 1 4.018 0.020 . 1 . . . . . 6 THR HB . 27170 1 49 . 1 1 6 6 THR HG21 H 1 0.920 0.020 . 1 . . . . . 6 THR HG2 . 27170 1 50 . 1 1 6 6 THR HG22 H 1 0.920 0.020 . 1 . . . . . 6 THR HG2 . 27170 1 51 . 1 1 6 6 THR HG23 H 1 0.920 0.020 . 1 . . . . . 6 THR HG2 . 27170 1 52 . 1 1 6 6 THR C C 13 173.568 0.3 . 1 . . . . . 6 THR C . 27170 1 53 . 1 1 6 6 THR CA C 13 60.856 0.3 . 1 . . . . . 6 THR CA . 27170 1 54 . 1 1 6 6 THR CB C 13 70.654 0.3 . 1 . . . . . 6 THR CB . 27170 1 55 . 1 1 6 6 THR CG2 C 13 21.191 0.3 . 1 . . . . . 6 THR CG2 . 27170 1 56 . 1 1 6 6 THR N N 15 114.118 0.3 . 1 . . . . . 6 THR N . 27170 1 57 . 1 1 7 7 LYS H H 1 8.465 0.020 . 1 . . . . . 7 LYS H . 27170 1 58 . 1 1 7 7 LYS HA H 1 4.924 0.020 . 1 . . . . . 7 LYS HA . 27170 1 59 . 1 1 7 7 LYS HB2 H 1 1.647 0.020 . 1 . . . . . 7 LYS HB2 . 27170 1 60 . 1 1 7 7 LYS HB3 H 1 1.616 0.020 . 1 . . . . . 7 LYS HB3 . 27170 1 61 . 1 1 7 7 LYS HG2 H 1 1.143 0.020 . 1 . . . . . 7 LYS HG2 . 27170 1 62 . 1 1 7 7 LYS HG3 H 1 1.122 0.020 . 1 . . . . . 7 LYS HG3 . 27170 1 63 . 1 1 7 7 LYS HD2 H 1 1.545 0.020 . 1 . . . . . 7 LYS HD2 . 27170 1 64 . 1 1 7 7 LYS HD3 H 1 1.510 0.020 . 1 . . . . . 7 LYS HD3 . 27170 1 65 . 1 1 7 7 LYS HE2 H 1 2.928 0.020 . 1 . . . . . 7 LYS HE2 . 27170 1 66 . 1 1 7 7 LYS C C 13 172.557 0.3 . 1 . . . . . 7 LYS C . 27170 1 67 . 1 1 7 7 LYS CA C 13 57.149 0.3 . 1 . . . . . 7 LYS CA . 27170 1 68 . 1 1 7 7 LYS CB C 13 36.406 0.3 . 1 . . . . . 7 LYS CB . 27170 1 69 . 1 1 7 7 LYS CG C 13 24.960 0.3 . 1 . . . . . 7 LYS CG . 27170 1 70 . 1 1 7 7 LYS CD C 13 31.366 0.3 . 1 . . . . . 7 LYS CD . 27170 1 71 . 1 1 7 7 LYS N N 15 124.876 0.3 . 1 . . . . . 7 LYS N . 27170 1 72 . 1 1 8 8 ILE H H 1 8.351 0.020 . 1 . . . . . 8 ILE H . 27170 1 73 . 1 1 8 8 ILE HA H 1 4.495 0.020 . 1 . . . . . 8 ILE HA . 27170 1 74 . 1 1 8 8 ILE HB H 1 1.045 0.020 . 1 . . . . . 8 ILE HB . 27170 1 75 . 1 1 8 8 ILE HG12 H 1 1.177 0.020 . 1 . . . . . 8 ILE HG12 . 27170 1 76 . 1 1 8 8 ILE HG13 H 1 1.161 0.020 . 1 . . . . . 8 ILE HG13 . 27170 1 77 . 1 1 8 8 ILE C C 13 171.343 0.3 . 1 . . . . . 8 ILE C . 27170 1 78 . 1 1 8 8 ILE CA C 13 59.797 0.3 . 1 . . . . . 8 ILE CA . 27170 1 79 . 1 1 8 8 ILE CB C 13 41.879 0.3 . 1 . . . . . 8 ILE CB . 27170 1 80 . 1 1 8 8 ILE CG1 C 13 25.054 0.3 . 1 . . . . . 8 ILE CG1 . 27170 1 81 . 1 1 8 8 ILE CG2 C 13 16.104 0.3 . 1 . . . . . 8 ILE CG2 . 27170 1 82 . 1 1 8 8 ILE CD1 C 13 14.597 0.3 . 1 . . . . . 8 ILE CD1 . 27170 1 83 . 1 1 8 8 ILE N N 15 125.257 0.3 . 1 . . . . . 8 ILE N . 27170 1 84 . 1 1 9 9 THR H H 1 8.249 0.020 . 1 . . . . . 9 THR H . 27170 1 85 . 1 1 9 9 THR HA H 1 4.520 0.020 . 1 . . . . . 9 THR HA . 27170 1 86 . 1 1 9 9 THR HB H 1 3.418 0.020 . 1 . . . . . 9 THR HB . 27170 1 87 . 1 1 9 9 THR HG21 H 1 1.043 0.020 . 1 . . . . . 9 THR HG2 . 27170 1 88 . 1 1 9 9 THR HG22 H 1 1.043 0.020 . 1 . . . . . 9 THR HG2 . 27170 1 89 . 1 1 9 9 THR HG23 H 1 1.043 0.020 . 1 . . . . . 9 THR HG2 . 27170 1 90 . 1 1 9 9 THR C C 13 171.984 0.3 . 1 . . . . . 9 THR C . 27170 1 91 . 1 1 9 9 THR CA C 13 62.180 0.3 . 1 . . . . . 9 THR CA . 27170 1 92 . 1 1 9 9 THR CB C 13 71.890 0.3 . 1 . . . . . 9 THR CB . 27170 1 93 . 1 1 9 9 THR CG2 C 13 22.510 0.3 . 1 . . . . . 9 THR CG2 . 27170 1 94 . 1 1 9 9 THR N N 15 121.557 0.3 . 1 . . . . . 9 THR N . 27170 1 95 . 1 1 10 10 PHE H H 1 8.613 0.020 . 1 . . . . . 10 PHE H . 27170 1 96 . 1 1 10 10 PHE HA H 1 4.581 0.020 . 1 . . . . . 10 PHE HA . 27170 1 97 . 1 1 10 10 PHE HB2 H 1 3.075 0.020 . 1 . . . . . 10 PHE HB2 . 27170 1 98 . 1 1 10 10 PHE HB3 H 1 2.512 0.020 . 1 . . . . . 10 PHE HB3 . 27170 1 99 . 1 1 10 10 PHE HD1 H 1 6.717 0.020 . 1 . . . . . 10 PHE HD1 . 27170 1 100 . 1 1 10 10 PHE HE1 H 1 7.061 0.020 . 1 . . . . . 10 PHE HE1 . 27170 1 101 . 1 1 10 10 PHE HZ H 1 6.980 0.020 . 1 . . . . . 10 PHE HZ . 27170 1 102 . 1 1 10 10 PHE C C 13 174.512 0.3 . 1 . . . . . 10 PHE C . 27170 1 103 . 1 1 10 10 PHE CA C 13 57.237 0.3 . 1 . . . . . 10 PHE CA . 27170 1 104 . 1 1 10 10 PHE CB C 13 42.938 0.3 . 1 . . . . . 10 PHE CB . 27170 1 105 . 1 1 10 10 PHE N N 15 125.100 0.3 . 1 . . . . . 10 PHE N . 27170 1 106 . 1 1 11 11 TYR H H 1 8.953 0.020 . 1 . . . . . 11 TYR H . 27170 1 107 . 1 1 11 11 TYR HA H 1 5.377 0.020 . 1 . . . . . 11 TYR HA . 27170 1 108 . 1 1 11 11 TYR HB2 H 1 3.320 0.020 . 1 . . . . . 11 TYR HB2 . 27170 1 109 . 1 1 11 11 TYR HB3 H 1 3.124 0.020 . 1 . . . . . 11 TYR HB3 . 27170 1 110 . 1 1 11 11 TYR HD1 H 1 6.666 0.020 . 1 . . . . . 11 TYR HD1 . 27170 1 111 . 1 1 11 11 TYR HE1 H 1 6.951 0.020 . 1 . . . . . 11 TYR HE1 . 27170 1 112 . 1 1 11 11 TYR C C 13 178.220 0.3 . 1 . . . . . 11 TYR C . 27170 1 113 . 1 1 11 11 TYR CA C 13 57.326 0.3 . 1 . . . . . 11 TYR CA . 27170 1 114 . 1 1 11 11 TYR CB C 13 40.290 0.3 . 1 . . . . . 11 TYR CB . 27170 1 115 . 1 1 11 11 TYR N N 15 117.887 0.3 . 1 . . . . . 11 TYR N . 27170 1 116 . 1 1 12 12 GLU H H 1 9.097 0.020 . 1 . . . . . 12 GLU H . 27170 1 117 . 1 1 12 12 GLU HA H 1 4.606 0.020 . 1 . . . . . 12 GLU HA . 27170 1 118 . 1 1 12 12 GLU HB2 H 1 2.136 0.020 . 1 . . . . . 12 GLU HB2 . 27170 1 119 . 1 1 12 12 GLU HB3 H 1 2.041 0.020 . 1 . . . . . 12 GLU HB3 . 27170 1 120 . 1 1 12 12 GLU HG2 H 1 2.675 0.020 . 1 . . . . . 12 GLU HG2 . 27170 1 121 . 1 1 12 12 GLU HG3 H 1 2.653 0.020 . 1 . . . . . 12 GLU HG3 . 27170 1 122 . 1 1 12 12 GLU C C 13 176.939 0.3 . 1 . . . . . 12 GLU C . 27170 1 123 . 1 1 12 12 GLU CA C 13 59.621 0.3 . 1 . . . . . 12 GLU CA . 27170 1 124 . 1 1 12 12 GLU CB C 13 32.346 0.3 . 1 . . . . . 12 GLU CB . 27170 1 125 . 1 1 12 12 GLU CG C 13 39.091 0.3 . 1 . . . . . 12 GLU CG . 27170 1 126 . 1 1 12 12 GLU N N 15 120.609 0.3 . 1 . . . . . 12 GLU N . 27170 1 127 . 1 1 13 13 ASP H H 1 7.989 0.020 . 1 . . . . . 13 ASP H . 27170 1 128 . 1 1 13 13 ASP HA H 1 5.328 0.020 . 1 . . . . . 13 ASP HA . 27170 1 129 . 1 1 13 13 ASP HB2 H 1 2.671 0.020 . 1 . . . . . 13 ASP HB2 . 27170 1 130 . 1 1 13 13 ASP HB3 H 1 2.243 0.020 . 1 . . . . . 13 ASP HB3 . 27170 1 131 . 1 1 13 13 ASP C C 13 176.029 0.3 . 1 . . . . . 13 ASP C . 27170 1 132 . 1 1 13 13 ASP CA C 13 53.177 0.3 . 1 . . . . . 13 ASP CA . 27170 1 133 . 1 1 13 13 ASP CB C 13 44.615 0.3 . 1 . . . . . 13 ASP CB . 27170 1 134 . 1 1 13 13 ASP N N 15 115.168 0.3 . 1 . . . . . 13 ASP N . 27170 1 135 . 1 1 14 14 LYS H H 1 8.516 0.020 . 1 . . . . . 14 LYS H . 27170 1 136 . 1 1 14 14 LYS HA H 1 3.785 0.020 . 1 . . . . . 14 LYS HA . 27170 1 137 . 1 1 14 14 LYS HB2 H 1 1.779 0.020 . 1 . . . . . 14 LYS HB2 . 27170 1 138 . 1 1 14 14 LYS HB3 H 1 1.726 0.020 . 1 . . . . . 14 LYS HB3 . 27170 1 139 . 1 1 14 14 LYS HG2 H 1 1.755 0.020 . 1 . . . . . 14 LYS HG2 . 27170 1 140 . 1 1 14 14 LYS HG3 H 1 1.573 0.020 . 1 . . . . . 14 LYS HG3 . 27170 1 141 . 1 1 14 14 LYS HD2 H 1 1.632 0.020 . 1 . . . . . 14 LYS HD2 . 27170 1 142 . 1 1 14 14 LYS HD3 H 1 1.600 0.020 . 1 . . . . . 14 LYS HD3 . 27170 1 143 . 1 1 14 14 LYS HE2 H 1 2.982 0.020 . 1 . . . . . 14 LYS HE2 . 27170 1 144 . 1 1 14 14 LYS C C 13 177.141 0.3 . 1 . . . . . 14 LYS C . 27170 1 145 . 1 1 14 14 LYS CA C 13 57.590 0.3 . 1 . . . . . 14 LYS CA . 27170 1 146 . 1 1 14 14 LYS CB C 13 34.641 0.3 . 1 . . . . . 14 LYS CB . 27170 1 147 . 1 1 14 14 LYS CG C 13 23.735 0.3 . 1 . . . . . 14 LYS CG . 27170 1 148 . 1 1 14 14 LYS CD C 13 26.844 0.3 . 1 . . . . . 14 LYS CD . 27170 1 149 . 1 1 14 14 LYS N N 15 117.984 0.3 . 1 . . . . . 14 LYS N . 27170 1 150 . 1 1 15 15 ASN H H 1 9.199 0.020 . 1 . . . . . 15 ASN H . 27170 1 151 . 1 1 15 15 ASN HA H 1 3.075 0.020 . 1 . . . . . 15 ASN HA . 27170 1 152 . 1 1 15 15 ASN HB2 H 1 2.745 0.020 . 1 . . . . . 15 ASN HB2 . 27170 1 153 . 1 1 15 15 ASN HB3 H 1 2.438 0.020 . 1 . . . . . 15 ASN HB3 . 27170 1 154 . 1 1 15 15 ASN HD21 H 1 7.402 0.020 . 1 . . . . . 15 ASN HD21 . 27170 1 155 . 1 1 15 15 ASN HD22 H 1 6.693 0.020 . 1 . . . . . 15 ASN HD22 . 27170 1 156 . 1 1 15 15 ASN C C 13 173.804 0.3 . 1 . . . . . 15 ASN C . 27170 1 157 . 1 1 15 15 ASN CA C 13 57.590 0.3 . 1 . . . . . 15 ASN CA . 27170 1 158 . 1 1 15 15 ASN CB C 13 37.377 0.3 . 1 . . . . . 15 ASN CB . 27170 1 159 . 1 1 15 15 ASN N N 15 113.050 0.3 . 1 . . . . . 15 ASN N . 27170 1 160 . 1 1 15 15 ASN ND2 N 15 112.761 0.3 . 1 . . . . . 15 ASN ND2 . 27170 1 161 . 1 1 16 16 PHE H H 1 7.897 0.020 . 1 . . . . . 16 PHE H . 27170 1 162 . 1 1 16 16 PHE HA H 1 3.467 0.020 . 1 . . . . . 16 PHE HA . 27170 1 163 . 1 1 16 16 PHE HB2 H 1 2.867 0.020 . 1 . . . . . 16 PHE HB2 . 27170 1 164 . 1 1 16 16 PHE HB3 H 1 2.745 0.020 . 1 . . . . . 16 PHE HB3 . 27170 1 165 . 1 1 16 16 PHE HD1 H 1 6.667 0.020 . 1 . . . . . 16 PHE HD1 . 27170 1 166 . 1 1 16 16 PHE HE1 H 1 6.806 0.020 . 1 . . . . . 16 PHE HE1 . 27170 1 167 . 1 1 16 16 PHE HZ H 1 6.744 0.020 . 1 . . . . . 16 PHE HZ . 27170 1 168 . 1 1 16 16 PHE C C 13 174.917 0.3 . 1 . . . . . 16 PHE C . 27170 1 169 . 1 1 16 16 PHE CA C 13 56.531 0.3 . 1 . . . . . 16 PHE CA . 27170 1 170 . 1 1 16 16 PHE CB C 13 35.435 0.3 . 1 . . . . . 16 PHE CB . 27170 1 171 . 1 1 16 16 PHE N N 15 112.202 0.3 . 1 . . . . . 16 PHE N . 27170 1 172 . 1 1 17 17 GLN H H 1 6.181 0.020 . 1 . . . . . 17 GLN H . 27170 1 173 . 1 1 17 17 GLN HA H 1 4.557 0.020 . 1 . . . . . 17 GLN HA . 27170 1 174 . 1 1 17 17 GLN HB2 H 1 2.250 0.020 . 1 . . . . . 17 GLN HB2 . 27170 1 175 . 1 1 17 17 GLN HB3 H 1 1.703 0.020 . 1 . . . . . 17 GLN HB3 . 27170 1 176 . 1 1 17 17 GLN HG2 H 1 2.196 0.020 . 1 . . . . . 17 GLN HG2 . 27170 1 177 . 1 1 17 17 GLN HG3 H 1 2.165 0.020 . 1 . . . . . 17 GLN HG3 . 27170 1 178 . 1 1 17 17 GLN HE21 H 1 7.130 0.020 . 1 . . . . . 17 GLN HE21 . 27170 1 179 . 1 1 17 17 GLN HE22 H 1 6.819 0.020 . 1 . . . . . 17 GLN HE22 . 27170 1 180 . 1 1 17 17 GLN C C 13 174.714 0.3 . 1 . . . . . 17 GLN C . 27170 1 181 . 1 1 17 17 GLN CA C 13 54.236 0.3 . 1 . . . . . 17 GLN CA . 27170 1 182 . 1 1 17 17 GLN CB C 13 32.699 0.3 . 1 . . . . . 17 GLN CB . 27170 1 183 . 1 1 17 17 GLN CG C 13 34.569 0.3 . 1 . . . . . 17 GLN CG . 27170 1 184 . 1 1 17 17 GLN N N 15 116.698 0.3 . 1 . . . . . 17 GLN N . 27170 1 185 . 1 1 17 17 GLN NE2 N 15 112.960 0.3 . 1 . . . . . 17 GLN NE2 . 27170 1 186 . 1 1 18 18 GLY H H 1 8.279 0.020 . 1 . . . . . 18 GLY H . 27170 1 187 . 1 1 18 18 GLY HA2 H 1 4.422 0.020 . 1 . . . . . 18 GLY HA2 . 27170 1 188 . 1 1 18 18 GLY HA3 H 1 3.773 0.020 . 1 . . . . . 18 GLY HA3 . 27170 1 189 . 1 1 18 18 GLY C C 13 174.748 0.3 . 1 . . . . . 18 GLY C . 27170 1 190 . 1 1 18 18 GLY CA C 13 44.880 0.3 . 1 . . . . . 18 GLY CA . 27170 1 191 . 1 1 18 18 GLY N N 15 105.201 0.3 . 1 . . . . . 18 GLY N . 27170 1 192 . 1 1 19 19 ARG H H 1 8.455 0.020 . 1 . . . . . 19 ARG H . 27170 1 193 . 1 1 19 19 ARG HA H 1 4.544 0.020 . 1 . . . . . 19 ARG HA . 27170 1 194 . 1 1 19 19 ARG HB2 H 1 1.935 0.020 . 1 . . . . . 19 ARG HB2 . 27170 1 195 . 1 1 19 19 ARG HB3 H 1 1.910 0.020 . 1 . . . . . 19 ARG HB3 . 27170 1 196 . 1 1 19 19 ARG HG2 H 1 2.014 0.020 . 1 . . . . . 19 ARG HG2 . 27170 1 197 . 1 1 19 19 ARG HG3 H 1 1.874 0.020 . 1 . . . . . 19 ARG HG3 . 27170 1 198 . 1 1 19 19 ARG HD2 H 1 3.037 0.020 . 1 . . . . . 19 ARG HD2 . 27170 1 199 . 1 1 19 19 ARG HD3 H 1 3.015 0.020 . 1 . . . . . 19 ARG HD3 . 27170 1 200 . 1 1 19 19 ARG C C 13 174.849 0.3 . 1 . . . . . 19 ARG C . 27170 1 201 . 1 1 19 19 ARG CA C 13 58.826 0.3 . 1 . . . . . 19 ARG CA . 27170 1 202 . 1 1 19 19 ARG CB C 13 31.640 0.3 . 1 . . . . . 19 ARG CB . 27170 1 203 . 1 1 19 19 ARG CG C 13 28.728 0.3 . 1 . . . . . 19 ARG CG . 27170 1 204 . 1 1 19 19 ARG CD C 13 46.063 0.3 . 1 . . . . . 19 ARG CD . 27170 1 205 . 1 1 19 19 ARG N N 15 119.461 0.3 . 1 . . . . . 19 ARG N . 27170 1 206 . 1 1 20 20 ARG H H 1 8.065 0.020 . 1 . . . . . 20 ARG H . 27170 1 207 . 1 1 20 20 ARG HA H 1 5.646 0.020 . 1 . . . . . 20 ARG HA . 27170 1 208 . 1 1 20 20 ARG HB2 H 1 1.300 0.020 . 1 . . . . . 20 ARG HB2 . 27170 1 209 . 1 1 20 20 ARG HB3 H 1 1.165 0.020 . 1 . . . . . 20 ARG HB3 . 27170 1 210 . 1 1 20 20 ARG HG2 H 1 1.416 0.020 . 1 . . . . . 20 ARG HG2 . 27170 1 211 . 1 1 20 20 ARG HG3 H 1 1.018 0.020 . 1 . . . . . 20 ARG HG3 . 27170 1 212 . 1 1 20 20 ARG HD2 H 1 2.916 0.020 . 1 . . . . . 20 ARG HD2 . 27170 1 213 . 1 1 20 20 ARG HD3 H 1 2.860 0.020 . 1 . . . . . 20 ARG HD3 . 27170 1 214 . 1 1 20 20 ARG C C 13 175.827 0.3 . 1 . . . . . 20 ARG C . 27170 1 215 . 1 1 20 20 ARG CA C 13 54.942 0.3 . 1 . . . . . 20 ARG CA . 27170 1 216 . 1 1 20 20 ARG CB C 13 35.259 0.3 . 1 . . . . . 20 ARG CB . 27170 1 217 . 1 1 20 20 ARG CG C 13 26.090 0.3 . 1 . . . . . 20 ARG CG . 27170 1 218 . 1 1 20 20 ARG CD C 13 44.744 0.3 . 1 . . . . . 20 ARG CD . 27170 1 219 . 1 1 20 20 ARG N N 15 119.112 0.3 . 1 . . . . . 20 ARG N . 27170 1 220 . 1 1 21 21 TYR H H 1 8.873 0.020 . 1 . . . . . 21 TYR H . 27170 1 221 . 1 1 21 21 TYR HA H 1 4.581 0.020 . 1 . . . . . 21 TYR HA . 27170 1 222 . 1 1 21 21 TYR HB2 H 1 2.732 0.020 . 1 . . . . . 21 TYR HB2 . 27170 1 223 . 1 1 21 21 TYR HB3 H 1 2.353 0.020 . 1 . . . . . 21 TYR HB3 . 27170 1 224 . 1 1 21 21 TYR HD1 H 1 6.750 0.020 . 1 . . . . . 21 TYR HD1 . 27170 1 225 . 1 1 21 21 TYR HE1 H 1 6.941 0.020 . 1 . . . . . 21 TYR HE1 . 27170 1 226 . 1 1 21 21 TYR C C 13 172.759 0.3 . 1 . . . . . 21 TYR C . 27170 1 227 . 1 1 21 21 TYR CA C 13 59.003 0.3 . 1 . . . . . 21 TYR CA . 27170 1 228 . 1 1 21 21 TYR CB C 13 43.203 0.3 . 1 . . . . . 21 TYR CB . 27170 1 229 . 1 1 21 21 TYR N N 15 122.931 0.3 . 1 . . . . . 21 TYR N . 27170 1 230 . 1 1 22 22 ASP H H 1 7.477 0.020 . 1 . . . . . 22 ASP H . 27170 1 231 . 1 1 22 22 ASP HA H 1 4.912 0.020 . 1 . . . . . 22 ASP HA . 27170 1 232 . 1 1 22 22 ASP HB2 H 1 2.111 0.020 . 1 . . . . . 22 ASP HB2 . 27170 1 233 . 1 1 22 22 ASP HB3 H 1 2.094 0.020 . 1 . . . . . 22 ASP HB3 . 27170 1 234 . 1 1 22 22 ASP C C 13 174.175 0.3 . 1 . . . . . 22 ASP C . 27170 1 235 . 1 1 22 22 ASP CA C 13 53.442 0.3 . 1 . . . . . 22 ASP CA . 27170 1 236 . 1 1 22 22 ASP CB C 13 44.527 0.3 . 1 . . . . . 22 ASP CB . 27170 1 237 . 1 1 22 22 ASP N N 15 126.547 0.3 . 1 . . . . . 22 ASP N . 27170 1 238 . 1 1 23 23 CYS H H 1 8.653 0.020 . 1 . . . . . 23 CYS H . 27170 1 239 . 1 1 23 23 CYS HA H 1 4.397 0.020 . 1 . . . . . 23 CYS HA . 27170 1 240 . 1 1 23 23 CYS HB2 H 1 3.014 0.020 . 1 . . . . . 23 CYS HB2 . 27170 1 241 . 1 1 23 23 CYS HB3 H 1 2.892 0.020 . 1 . . . . . 23 CYS HB3 . 27170 1 242 . 1 1 23 23 CYS C C 13 174.445 0.3 . 1 . . . . . 23 CYS C . 27170 1 243 . 1 1 23 23 CYS CA C 13 59.003 0.3 . 1 . . . . . 23 CYS CA . 27170 1 244 . 1 1 23 23 CYS CB C 13 30.669 0.3 . 1 . . . . . 23 CYS CB . 27170 1 245 . 1 1 23 23 CYS N N 15 118.723 0.3 . 1 . . . . . 23 CYS N . 27170 1 246 . 1 1 24 24 ASP H H 1 8.256 0.020 . 1 . . . . . 24 ASP H . 27170 1 247 . 1 1 24 24 ASP HA H 1 5.157 0.020 . 1 . . . . . 24 ASP HA . 27170 1 248 . 1 1 24 24 ASP HB2 H 1 3.185 0.020 . 1 . . . . . 24 ASP HB2 . 27170 1 249 . 1 1 24 24 ASP HB3 H 1 2.438 0.020 . 1 . . . . . 24 ASP HB3 . 27170 1 250 . 1 1 24 24 ASP C C 13 175.759 0.3 . 1 . . . . . 24 ASP C . 27170 1 251 . 1 1 24 24 ASP CA C 13 57.061 0.3 . 1 . . . . . 24 ASP CA . 27170 1 252 . 1 1 24 24 ASP CB C 13 41.437 0.3 . 1 . . . . . 24 ASP CB . 27170 1 253 . 1 1 24 24 ASP N N 15 118.818 0.3 . 1 . . . . . 24 ASP N . 27170 1 254 . 1 1 25 25 CYS H H 1 8.169 0.020 . 1 . . . . . 25 CYS H . 27170 1 255 . 1 1 25 25 CYS HA H 1 4.863 0.020 . 1 . . . . . 25 CYS HA . 27170 1 256 . 1 1 25 25 CYS HB2 H 1 3.173 0.020 . 1 . . . . . 25 CYS HB2 . 27170 1 257 . 1 1 25 25 CYS HB3 H 1 3.075 0.020 . 1 . . . . . 25 CYS HB3 . 27170 1 258 . 1 1 25 25 CYS C C 13 172.085 0.3 . 1 . . . . . 25 CYS C . 27170 1 259 . 1 1 25 25 CYS CA C 13 56.531 0.3 . 1 . . . . . 25 CYS CA . 27170 1 260 . 1 1 25 25 CYS CB C 13 30.845 0.3 . 1 . . . . . 25 CYS CB . 27170 1 261 . 1 1 25 25 CYS N N 15 115.587 0.3 . 1 . . . . . 25 CYS N . 27170 1 262 . 1 1 26 26 ASP H H 1 8.084 0.020 . 1 . . . . . 26 ASP H . 27170 1 263 . 1 1 26 26 ASP HA H 1 4.826 0.020 . 1 . . . . . 26 ASP HA . 27170 1 264 . 1 1 26 26 ASP HB2 H 1 2.826 0.020 . 1 . . . . . 26 ASP HB2 . 27170 1 265 . 1 1 26 26 ASP HB3 H 1 2.789 0.020 . 1 . . . . . 26 ASP HB3 . 27170 1 266 . 1 1 26 26 ASP C C 13 176.771 0.3 . 1 . . . . . 26 ASP C . 27170 1 267 . 1 1 26 26 ASP CA C 13 56.884 0.3 . 1 . . . . . 26 ASP CA . 27170 1 268 . 1 1 26 26 ASP CB C 13 41.084 0.3 . 1 . . . . . 26 ASP CB . 27170 1 269 . 1 1 26 26 ASP N N 15 118.337 0.3 . 1 . . . . . 26 ASP N . 27170 1 270 . 1 1 27 27 CYS H H 1 9.396 0.020 . 1 . . . . . 27 CYS H . 27170 1 271 . 1 1 27 27 CYS HA H 1 4.936 0.020 . 1 . . . . . 27 CYS HA . 27170 1 272 . 1 1 27 27 CYS HB2 H 1 3.377 0.020 . 1 . . . . . 27 CYS HB2 . 27170 1 273 . 1 1 27 27 CYS HB3 H 1 3.351 0.020 . 1 . . . . . 27 CYS HB3 . 27170 1 274 . 1 1 27 27 CYS C C 13 174.242 0.3 . 1 . . . . . 27 CYS C . 27170 1 275 . 1 1 27 27 CYS CA C 13 59.444 0.3 . 1 . . . . . 27 CYS CA . 27170 1 276 . 1 1 27 27 CYS CB C 13 30.404 0.3 . 1 . . . . . 27 CYS CB . 27170 1 277 . 1 1 27 27 CYS N N 15 122.921 0.3 . 1 . . . . . 27 CYS N . 27170 1 278 . 1 1 28 28 ALA H H 1 9.136 0.020 . 1 . . . . . 28 ALA H . 27170 1 279 . 1 1 28 28 ALA HA H 1 3.467 0.020 . 1 . . . . . 28 ALA HA . 27170 1 280 . 1 1 28 28 ALA HB1 H 1 1.312 0.020 . 1 . . . . . 28 ALA HB . 27170 1 281 . 1 1 28 28 ALA HB2 H 1 1.312 0.020 . 1 . . . . . 28 ALA HB . 27170 1 282 . 1 1 28 28 ALA HB3 H 1 1.312 0.020 . 1 . . . . . 28 ALA HB . 27170 1 283 . 1 1 28 28 ALA C C 13 176.400 0.3 . 1 . . . . . 28 ALA C . 27170 1 284 . 1 1 28 28 ALA CA C 13 55.119 0.3 . 1 . . . . . 28 ALA CA . 27170 1 285 . 1 1 28 28 ALA CB C 13 18.539 0.3 . 1 . . . . . 28 ALA CB . 27170 1 286 . 1 1 28 28 ALA N N 15 130.758 0.3 . 1 . . . . . 28 ALA N . 27170 1 287 . 1 1 29 29 ASP H H 1 7.522 0.020 . 1 . . . . . 29 ASP H . 27170 1 288 . 1 1 29 29 ASP HA H 1 4.948 0.020 . 1 . . . . . 29 ASP HA . 27170 1 289 . 1 1 29 29 ASP HB2 H 1 2.855 0.020 . 1 . . . . . 29 ASP HB2 . 27170 1 290 . 1 1 29 29 ASP HB3 H 1 2.524 0.020 . 1 . . . . . 29 ASP HB3 . 27170 1 291 . 1 1 29 29 ASP C C 13 177.681 0.3 . 1 . . . . . 29 ASP C . 27170 1 292 . 1 1 29 29 ASP CA C 13 55.472 0.3 . 1 . . . . . 29 ASP CA . 27170 1 293 . 1 1 29 29 ASP CB C 13 41.526 0.3 . 1 . . . . . 29 ASP CB . 27170 1 294 . 1 1 29 29 ASP N N 15 113.264 0.3 . 1 . . . . . 29 ASP N . 27170 1 295 . 1 1 30 30 PHE H H 1 8.685 0.020 . 1 . . . . . 30 PHE H . 27170 1 296 . 1 1 30 30 PHE HA H 1 4.973 0.020 . 1 . . . . . 30 PHE HA . 27170 1 297 . 1 1 30 30 PHE HB2 H 1 2.867 0.020 . 1 . . . . . 30 PHE HB2 . 27170 1 298 . 1 1 30 30 PHE HB3 H 1 2.659 0.020 . 1 . . . . . 30 PHE HB3 . 27170 1 299 . 1 1 30 30 PHE HD1 H 1 6.797 0.020 . 1 . . . . . 30 PHE HD1 . 27170 1 300 . 1 1 30 30 PHE HE1 H 1 6.947 0.020 . 1 . . . . . 30 PHE HE1 . 27170 1 301 . 1 1 30 30 PHE HZ H 1 6.870 0.020 . 1 . . . . . 30 PHE HZ . 27170 1 302 . 1 1 30 30 PHE C C 13 177.681 0.3 . 1 . . . . . 30 PHE C . 27170 1 303 . 1 1 30 30 PHE CA C 13 54.501 0.3 . 1 . . . . . 30 PHE CA . 27170 1 304 . 1 1 30 30 PHE CB C 13 34.729 0.3 . 1 . . . . . 30 PHE CB . 27170 1 305 . 1 1 30 30 PHE N N 15 123.074 0.3 . 1 . . . . . 30 PHE N . 27170 1 306 . 1 1 31 31 HIS H H 1 8.674 0.020 . 1 . . . . . 31 HIS H . 27170 1 307 . 1 1 31 31 HIS HA H 1 4.667 0.020 . 1 . . . . . 31 HIS HA . 27170 1 308 . 1 1 31 31 HIS HB2 H 1 3.369 0.020 . 1 . . . . . 31 HIS HB2 . 27170 1 309 . 1 1 31 31 HIS HB3 H 1 2.965 0.020 . 1 . . . . . 31 HIS HB3 . 27170 1 310 . 1 1 31 31 HIS HD2 H 1 6.885 0.020 . 1 . . . . . 31 HIS HD2 . 27170 1 311 . 1 1 31 31 HIS HE1 H 1 8.674 0.020 . 1 . . . . . 31 HIS HE1 . 27170 1 312 . 1 1 31 31 HIS C C 13 175.658 0.3 . 1 . . . . . 31 HIS C . 27170 1 313 . 1 1 31 31 HIS CA C 13 59.797 0.3 . 1 . . . . . 31 HIS CA . 27170 1 314 . 1 1 31 31 HIS CB C 13 28.285 0.3 . 1 . . . . . 31 HIS CB . 27170 1 315 . 1 1 31 31 HIS N N 15 122.979 0.3 . 1 . . . . . 31 HIS N . 27170 1 316 . 1 1 32 32 THR H H 1 7.468 0.020 . 1 . . . . . 32 THR H . 27170 1 317 . 1 1 32 32 THR HA H 1 3.579 0.020 . 1 . . . . . 32 THR HA . 27170 1 318 . 1 1 32 32 THR HB H 1 3.564 0.020 . 1 . . . . . 32 THR HB . 27170 1 319 . 1 1 32 32 THR HG21 H 1 0.859 0.020 . 1 . . . . . 32 THR HG2 . 27170 1 320 . 1 1 32 32 THR HG22 H 1 0.859 0.020 . 1 . . . . . 32 THR HG2 . 27170 1 321 . 1 1 32 32 THR HG23 H 1 0.859 0.020 . 1 . . . . . 32 THR HG2 . 27170 1 322 . 1 1 32 32 THR C C 13 174.816 0.3 . 1 . . . . . 32 THR C . 27170 1 323 . 1 1 32 32 THR CA C 13 64.122 0.3 . 1 . . . . . 32 THR CA . 27170 1 324 . 1 1 32 32 THR CB C 13 68.889 0.3 . 1 . . . . . 32 THR CB . 27170 1 325 . 1 1 32 32 THR CG2 C 13 21.662 0.3 . 1 . . . . . 32 THR CG2 . 27170 1 326 . 1 1 32 32 THR N N 15 109.933 0.3 . 1 . . . . . 32 THR N . 27170 1 327 . 1 1 33 33 TYR H H 1 7.216 0.020 . 1 . . . . . 33 TYR H . 27170 1 328 . 1 1 33 33 TYR HA H 1 4.336 0.020 . 1 . . . . . 33 TYR HA . 27170 1 329 . 1 1 33 33 TYR HB2 H 1 2.989 0.020 . 1 . . . . . 33 TYR HB2 . 27170 1 330 . 1 1 33 33 TYR HB3 H 1 2.169 0.020 . 1 . . . . . 33 TYR HB3 . 27170 1 331 . 1 1 33 33 TYR HD1 H 1 6.700 0.020 . 1 . . . . . 33 TYR HD1 . 27170 1 332 . 1 1 33 33 TYR HE1 H 1 7.190 0.020 . 1 . . . . . 33 TYR HE1 . 27170 1 333 . 1 1 33 33 TYR C C 13 175.220 0.3 . 1 . . . . . 33 TYR C . 27170 1 334 . 1 1 33 33 TYR CA C 13 59.091 0.3 . 1 . . . . . 33 TYR CA . 27170 1 335 . 1 1 33 33 TYR CB C 13 40.202 0.3 . 1 . . . . . 33 TYR CB . 27170 1 336 . 1 1 33 33 TYR N N 15 119.613 0.3 . 1 . . . . . 33 TYR N . 27170 1 337 . 1 1 34 34 LEU H H 1 7.276 0.020 . 1 . . . . . 34 LEU H . 27170 1 338 . 1 1 34 34 LEU HA H 1 4.520 0.020 . 1 . . . . . 34 LEU HA . 27170 1 339 . 1 1 34 34 LEU HB2 H 1 1.790 0.020 . 1 . . . . . 34 LEU HB2 . 27170 1 340 . 1 1 34 34 LEU HB3 H 1 1.202 0.020 . 1 . . . . . 34 LEU HB3 . 27170 1 341 . 1 1 34 34 LEU HG H 1 1.820 0.020 . 1 . . . . . 34 LEU HG . 27170 1 342 . 1 1 34 34 LEU HD11 H 1 0.798 0.020 . 1 . . . . . 34 LEU HD1 . 27170 1 343 . 1 1 34 34 LEU HD12 H 1 0.798 0.020 . 1 . . . . . 34 LEU HD1 . 27170 1 344 . 1 1 34 34 LEU HD13 H 1 0.798 0.020 . 1 . . . . . 34 LEU HD1 . 27170 1 345 . 1 1 34 34 LEU HD21 H 1 0.712 0.020 . 1 . . . . . 34 LEU HD2 . 27170 1 346 . 1 1 34 34 LEU HD22 H 1 0.712 0.020 . 1 . . . . . 34 LEU HD2 . 27170 1 347 . 1 1 34 34 LEU HD23 H 1 0.712 0.020 . 1 . . . . . 34 LEU HD2 . 27170 1 348 . 1 1 34 34 LEU C C 13 175.995 0.3 . 1 . . . . . 34 LEU C . 27170 1 349 . 1 1 34 34 LEU CA C 13 55.652 0.3 . 1 . . . . . 34 LEU CA . 27170 1 350 . 1 1 34 34 LEU CB C 13 46.031 0.3 . 1 . . . . . 34 LEU CB . 27170 1 351 . 1 1 34 34 LEU CG C 13 27.815 0.3 . 1 . . . . . 34 LEU CG . 27170 1 352 . 1 1 34 34 LEU CD1 C 13 27.914 0.3 . 1 . . . . . 34 LEU CD1 . 27170 1 353 . 1 1 34 34 LEU CD2 C 13 26.823 0.3 . 1 . . . . . 34 LEU CD2 . 27170 1 354 . 1 1 34 34 LEU N N 15 118.862 0.3 . 1 . . . . . 34 LEU N . 27170 1 355 . 1 1 35 35 SER H H 1 9.380 0.020 . 1 . . . . . 35 SER H . 27170 1 356 . 1 1 35 35 SER HA H 1 4.367 0.020 . 1 . . . . . 35 SER HA . 27170 1 357 . 1 1 35 35 SER HB2 H 1 3.856 0.020 . 1 . . . . . 35 SER HB2 . 27170 1 358 . 1 1 35 35 SER HB3 H 1 3.839 0.020 . 1 . . . . . 35 SER HB3 . 27170 1 359 . 1 1 35 35 SER C C 13 173.602 0.3 . 1 . . . . . 35 SER C . 27170 1 360 . 1 1 35 35 SER CA C 13 60.768 0.3 . 1 . . . . . 35 SER CA . 27170 1 361 . 1 1 35 35 SER CB C 13 65.093 0.3 . 1 . . . . . 35 SER CB . 27170 1 362 . 1 1 35 35 SER N N 15 120.588 0.3 . 1 . . . . . 35 SER N . 27170 1 363 . 1 1 36 36 ARG H H 1 7.830 0.020 . 1 . . . . . 36 ARG H . 27170 1 364 . 1 1 36 36 ARG HA H 1 4.740 0.020 . 1 . . . . . 36 ARG HA . 27170 1 365 . 1 1 36 36 ARG HB2 H 1 1.998 0.020 . 1 . . . . . 36 ARG HB2 . 27170 1 366 . 1 1 36 36 ARG HB3 H 1 1.729 0.020 . 1 . . . . . 36 ARG HB3 . 27170 1 367 . 1 1 36 36 ARG HG2 H 1 1.744 0.020 . 1 . . . . . 36 ARG HG2 . 27170 1 368 . 1 1 36 36 ARG HG3 H 1 1.671 0.020 . 1 . . . . . 36 ARG HG3 . 27170 1 369 . 1 1 36 36 ARG HD2 H 1 3.100 0.020 . 1 . . . . . 36 ARG HD2 . 27170 1 370 . 1 1 36 36 ARG HD3 H 1 3.038 0.020 . 1 . . . . . 36 ARG HD3 . 27170 1 371 . 1 1 36 36 ARG C C 13 173.265 0.3 . 1 . . . . . 36 ARG C . 27170 1 372 . 1 1 36 36 ARG CA C 13 55.472 0.3 . 1 . . . . . 36 ARG CA . 27170 1 373 . 1 1 36 36 ARG CB C 13 31.816 0.3 . 1 . . . . . 36 ARG CB . 27170 1 374 . 1 1 36 36 ARG CG C 13 26.090 0.3 . 1 . . . . . 36 ARG CG . 27170 1 375 . 1 1 36 36 ARG CD C 13 44.273 0.3 . 1 . . . . . 36 ARG CD . 27170 1 376 . 1 1 36 36 ARG N N 15 117.493 0.3 . 1 . . . . . 36 ARG N . 27170 1 377 . 1 1 37 37 CYS H H 1 9.711 0.020 . 1 . . . . . 37 CYS H . 27170 1 378 . 1 1 37 37 CYS HA H 1 5.255 0.020 . 1 . . . . . 37 CYS HA . 27170 1 379 . 1 1 37 37 CYS HB2 H 1 2.940 0.020 . 1 . . . . . 37 CYS HB2 . 27170 1 380 . 1 1 37 37 CYS HB3 H 1 2.855 0.020 . 1 . . . . . 37 CYS HB3 . 27170 1 381 . 1 1 37 37 CYS C C 13 171.343 0.3 . 1 . . . . . 37 CYS C . 27170 1 382 . 1 1 37 37 CYS CA C 13 59.179 0.3 . 1 . . . . . 37 CYS CA . 27170 1 383 . 1 1 37 37 CYS CB C 13 29.345 0.3 . 1 . . . . . 37 CYS CB . 27170 1 384 . 1 1 37 37 CYS N N 15 117.811 0.3 . 1 . . . . . 37 CYS N . 27170 1 385 . 1 1 38 38 ASN H H 1 8.233 0.020 . 1 . . . . . 38 ASN H . 27170 1 386 . 1 1 38 38 ASN HA H 1 5.218 0.020 . 1 . . . . . 38 ASN HA . 27170 1 387 . 1 1 38 38 ASN HB2 H 1 2.683 0.020 . 1 . . . . . 38 ASN HB2 . 27170 1 388 . 1 1 38 38 ASN HB3 H 1 2.255 0.020 . 1 . . . . . 38 ASN HB3 . 27170 1 389 . 1 1 38 38 ASN HD21 H 1 8.557 0.020 . 1 . . . . . 38 ASN HD21 . 27170 1 390 . 1 1 38 38 ASN HD22 H 1 8.075 0.020 . 1 . . . . . 38 ASN HD22 . 27170 1 391 . 1 1 38 38 ASN C C 13 174.007 0.3 . 1 . . . . . 38 ASN C . 27170 1 392 . 1 1 38 38 ASN CA C 13 58.915 0.3 . 1 . . . . . 38 ASN CA . 27170 1 393 . 1 1 38 38 ASN CB C 13 39.142 0.3 . 1 . . . . . 38 ASN CB . 27170 1 394 . 1 1 38 38 ASN N N 15 121.379 0.3 . 1 . . . . . 38 ASN N . 27170 1 395 . 1 1 38 38 ASN ND2 N 15 116.350 0.3 . 1 . . . . . 38 ASN ND2 . 27170 1 396 . 1 1 39 39 SER H H 1 8.312 0.020 . 1 . . . . . 39 SER H . 27170 1 397 . 1 1 39 39 SER HA H 1 4.924 0.020 . 1 . . . . . 39 SER HA . 27170 1 398 . 1 1 39 39 SER HB2 H 1 4.238 0.020 . 1 . . . . . 39 SER HB2 . 27170 1 399 . 1 1 39 39 SER HB3 H 1 3.785 0.020 . 1 . . . . . 39 SER HB3 . 27170 1 400 . 1 1 39 39 SER C C 13 173.130 0.3 . 1 . . . . . 39 SER C . 27170 1 401 . 1 1 39 39 SER CA C 13 60.768 0.3 . 1 . . . . . 39 SER CA . 27170 1 402 . 1 1 39 39 SER CB C 13 65.446 0.3 . 1 . . . . . 39 SER CB . 27170 1 403 . 1 1 39 39 SER N N 15 108.644 0.3 . 1 . . . . . 39 SER N . 27170 1 404 . 1 1 40 40 ILE H H 1 8.990 0.020 . 1 . . . . . 40 ILE H . 27170 1 405 . 1 1 40 40 ILE HA H 1 5.328 0.020 . 1 . . . . . 40 ILE HA . 27170 1 406 . 1 1 40 40 ILE HB H 1 1.373 0.020 . 1 . . . . . 40 ILE HB . 27170 1 407 . 1 1 40 40 ILE HG12 H 1 1.263 0.020 . 1 . . . . . 40 ILE HG12 . 27170 1 408 . 1 1 40 40 ILE HG13 H 1 1.190 0.020 . 1 . . . . . 40 ILE HG13 . 27170 1 409 . 1 1 40 40 ILE HG21 H 1 1.062 0.020 . 1 . . . . . 40 ILE HG2 . 27170 1 410 . 1 1 40 40 ILE HG22 H 1 1.062 0.020 . 1 . . . . . 40 ILE HG2 . 27170 1 411 . 1 1 40 40 ILE HG23 H 1 1.062 0.020 . 1 . . . . . 40 ILE HG2 . 27170 1 412 . 1 1 40 40 ILE HD11 H 1 0.730 0.020 . 1 . . . . . 40 ILE HD1 . 27170 1 413 . 1 1 40 40 ILE HD12 H 1 0.730 0.020 . 1 . . . . . 40 ILE HD1 . 27170 1 414 . 1 1 40 40 ILE HD13 H 1 0.730 0.020 . 1 . . . . . 40 ILE HD1 . 27170 1 415 . 1 1 40 40 ILE C C 13 176.265 0.3 . 1 . . . . . 40 ILE C . 27170 1 416 . 1 1 40 40 ILE CA C 13 61.209 0.3 . 1 . . . . . 40 ILE CA . 27170 1 417 . 1 1 40 40 ILE CB C 13 46.027 0.3 . 1 . . . . . 40 ILE CB . 27170 1 418 . 1 1 40 40 ILE CG1 C 13 31.083 0.3 . 1 . . . . . 40 ILE CG1 . 27170 1 419 . 1 1 40 40 ILE CG2 C 13 19.059 0.3 . 1 . . . . . 40 ILE CG2 . 27170 1 420 . 1 1 40 40 ILE CD1 C 13 13.448 0.3 . 1 . . . . . 40 ILE CD1 . 27170 1 421 . 1 1 40 40 ILE N N 15 118.879 0.3 . 1 . . . . . 40 ILE N . 27170 1 422 . 1 1 41 41 LYS H H 1 8.946 0.020 . 1 . . . . . 41 LYS H . 27170 1 423 . 1 1 41 41 LYS HA H 1 4.948 0.020 . 1 . . . . . 41 LYS HA . 27170 1 424 . 1 1 41 41 LYS HB2 H 1 1.720 0.020 . 1 . . . . . 41 LYS HB2 . 27170 1 425 . 1 1 41 41 LYS HB3 H 1 1.663 0.020 . 1 . . . . . 41 LYS HB3 . 27170 1 426 . 1 1 41 41 LYS HG2 H 1 1.553 0.020 . 1 . . . . . 41 LYS HG2 . 27170 1 427 . 1 1 41 41 LYS HG3 H 1 1.542 0.020 . 1 . . . . . 41 LYS HG3 . 27170 1 428 . 1 1 41 41 LYS HD2 H 1 1.598 0.020 . 1 . . . . . 41 LYS HD2 . 27170 1 429 . 1 1 41 41 LYS HD3 H 1 1.570 0.020 . 1 . . . . . 41 LYS HD3 . 27170 1 430 . 1 1 41 41 LYS HE2 H 1 3.124 0.020 . 1 . . . . . 41 LYS HE2 . 27170 1 431 . 1 1 41 41 LYS HE3 H 1 3.036 0.020 . 1 . . . . . 41 LYS HE3 . 27170 1 432 . 1 1 41 41 LYS C C 13 174.917 0.3 . 1 . . . . . 41 LYS C . 27170 1 433 . 1 1 41 41 LYS CA C 13 57.414 0.3 . 1 . . . . . 41 LYS CA . 27170 1 434 . 1 1 41 41 LYS CB C 13 36.583 0.3 . 1 . . . . . 41 LYS CB . 27170 1 435 . 1 1 41 41 LYS CG C 13 24.677 0.3 . 1 . . . . . 41 LYS CG . 27170 1 436 . 1 1 41 41 LYS CD C 13 27.974 0.3 . 1 . . . . . 41 LYS CD . 27170 1 437 . 1 1 41 41 LYS N N 15 125.028 0.3 . 1 . . . . . 41 LYS N . 27170 1 438 . 1 1 42 42 VAL H H 1 9.226 0.020 . 1 . . . . . 42 VAL H . 27170 1 439 . 1 1 42 42 VAL HA H 1 3.651 0.020 . 1 . . . . . 42 VAL HA . 27170 1 440 . 1 1 42 42 VAL HB H 1 2.487 0.020 . 1 . . . . . 42 VAL HB . 27170 1 441 . 1 1 42 42 VAL HG11 H 1 1.447 0.020 . 1 . . . . . 42 VAL HG1 . 27170 1 442 . 1 1 42 42 VAL HG12 H 1 1.447 0.020 . 1 . . . . . 42 VAL HG1 . 27170 1 443 . 1 1 42 42 VAL HG13 H 1 1.447 0.020 . 1 . . . . . 42 VAL HG1 . 27170 1 444 . 1 1 42 42 VAL HG21 H 1 0.626 0.020 . 1 . . . . . 42 VAL HG2 . 27170 1 445 . 1 1 42 42 VAL HG22 H 1 0.626 0.020 . 1 . . . . . 42 VAL HG2 . 27170 1 446 . 1 1 42 42 VAL HG23 H 1 0.626 0.020 . 1 . . . . . 42 VAL HG2 . 27170 1 447 . 1 1 42 42 VAL C C 13 174.782 0.3 . 1 . . . . . 42 VAL C . 27170 1 448 . 1 1 42 42 VAL CA C 13 63.063 0.3 . 1 . . . . . 42 VAL CA . 27170 1 449 . 1 1 42 42 VAL CB C 13 33.758 0.3 . 1 . . . . . 42 VAL CB . 27170 1 450 . 1 1 42 42 VAL CG1 C 13 22.275 0.3 . 1 . . . . . 42 VAL CG1 . 27170 1 451 . 1 1 42 42 VAL CG2 C 13 22.039 0.3 . 1 . . . . . 42 VAL CG2 . 27170 1 452 . 1 1 42 42 VAL N N 15 125.774 0.3 . 1 . . . . . 42 VAL N . 27170 1 453 . 1 1 43 43 GLU H H 1 8.340 0.020 . 1 . . . . . 43 GLU H . 27170 1 454 . 1 1 43 43 GLU HA H 1 4.397 0.020 . 1 . . . . . 43 GLU HA . 27170 1 455 . 1 1 43 43 GLU HB2 H 1 1.805 0.020 . 1 . . . . . 43 GLU HB2 . 27170 1 456 . 1 1 43 43 GLU HB3 H 1 1.777 0.020 . 1 . . . . . 43 GLU HB3 . 27170 1 457 . 1 1 43 43 GLU HG2 H 1 1.965 0.020 . 1 . . . . . 43 GLU HG2 . 27170 1 458 . 1 1 43 43 GLU HG3 H 1 1.944 0.020 . 1 . . . . . 43 GLU HG3 . 27170 1 459 . 1 1 43 43 GLU C C 13 177.344 0.3 . 1 . . . . . 43 GLU C . 27170 1 460 . 1 1 43 43 GLU CA C 13 56.002 0.3 . 1 . . . . . 43 GLU CA . 27170 1 461 . 1 1 43 43 GLU CB C 13 30.934 0.3 . 1 . . . . . 43 GLU CB . 27170 1 462 . 1 1 43 43 GLU CG C 13 37.031 0.3 . 1 . . . . . 43 GLU CG . 27170 1 463 . 1 1 43 43 GLU N N 15 127.279 0.3 . 1 . . . . . 43 GLU N . 27170 1 464 . 1 1 44 44 GLY H H 1 8.310 0.020 . 1 . . . . . 44 GLY H . 27170 1 465 . 1 1 44 44 GLY HA2 H 1 4.140 0.020 . 1 . . . . . 44 GLY HA2 . 27170 1 466 . 1 1 44 44 GLY HA3 H 1 3.969 0.020 . 1 . . . . . 44 GLY HA3 . 27170 1 467 . 1 1 44 44 GLY C C 13 173.197 0.3 . 1 . . . . . 44 GLY C . 27170 1 468 . 1 1 44 44 GLY CA C 13 47.351 0.3 . 1 . . . . . 44 GLY CA . 27170 1 469 . 1 1 44 44 GLY N N 15 108.062 0.3 . 1 . . . . . 44 GLY N . 27170 1 470 . 1 1 45 45 GLY H H 1 7.961 0.020 . 1 . . . . . 45 GLY H . 27170 1 471 . 1 1 45 45 GLY HA2 H 1 3.981 0.020 . 1 . . . . . 45 GLY HA2 . 27170 1 472 . 1 1 45 45 GLY HA3 H 1 3.736 0.020 . 1 . . . . . 45 GLY HA3 . 27170 1 473 . 1 1 45 45 GLY C C 13 170.400 0.3 . 1 . . . . . 45 GLY C . 27170 1 474 . 1 1 45 45 GLY CA C 13 45.321 0.3 . 1 . . . . . 45 GLY CA . 27170 1 475 . 1 1 45 45 GLY N N 15 110.720 0.3 . 1 . . . . . 45 GLY N . 27170 1 476 . 1 1 46 46 THR H H 1 7.904 0.020 . 1 . . . . . 46 THR H . 27170 1 477 . 1 1 46 46 THR HA H 1 4.483 0.020 . 1 . . . . . 46 THR HA . 27170 1 478 . 1 1 46 46 THR HB H 1 3.565 0.020 . 1 . . . . . 46 THR HB . 27170 1 479 . 1 1 46 46 THR HG21 H 1 0.798 0.020 . 1 . . . . . 46 THR HG2 . 27170 1 480 . 1 1 46 46 THR HG22 H 1 0.798 0.020 . 1 . . . . . 46 THR HG2 . 27170 1 481 . 1 1 46 46 THR HG23 H 1 0.798 0.020 . 1 . . . . . 46 THR HG2 . 27170 1 482 . 1 1 46 46 THR C C 13 173.703 0.3 . 1 . . . . . 46 THR C . 27170 1 483 . 1 1 46 46 THR CA C 13 63.151 0.3 . 1 . . . . . 46 THR CA . 27170 1 484 . 1 1 46 46 THR CB C 13 71.095 0.3 . 1 . . . . . 46 THR CB . 27170 1 485 . 1 1 46 46 THR CG2 C 13 22.416 0.3 . 1 . . . . . 46 THR CG2 . 27170 1 486 . 1 1 46 46 THR N N 15 113.472 0.3 . 1 . . . . . 46 THR N . 27170 1 487 . 1 1 47 47 TRP H H 1 8.425 0.020 . 1 . . . . . 47 TRP H . 27170 1 488 . 1 1 47 47 TRP HA H 1 4.814 0.020 . 1 . . . . . 47 TRP HA . 27170 1 489 . 1 1 47 47 TRP HB2 H 1 2.855 0.020 . 1 . . . . . 47 TRP HB2 . 27170 1 490 . 1 1 47 47 TRP HB3 H 1 2.561 0.020 . 1 . . . . . 47 TRP HB3 . 27170 1 491 . 1 1 47 47 TRP HD1 H 1 6.867 0.020 . 1 . . . . . 47 TRP HD1 . 27170 1 492 . 1 1 47 47 TRP HE1 H 1 9.348 0.020 . 1 . . . . . 47 TRP HE1 . 27170 1 493 . 1 1 47 47 TRP HE3 H 1 6.834 0.020 . 1 . . . . . 47 TRP HE3 . 27170 1 494 . 1 1 47 47 TRP HZ2 H 1 6.800 0.020 . 1 . . . . . 47 TRP HZ2 . 27170 1 495 . 1 1 47 47 TRP HZ3 H 1 6.756 0.020 . 1 . . . . . 47 TRP HZ3 . 27170 1 496 . 1 1 47 47 TRP HH2 H 1 6.712 0.020 . 1 . . . . . 47 TRP HH2 . 27170 1 497 . 1 1 47 47 TRP C C 13 173.602 0.3 . 1 . . . . . 47 TRP C . 27170 1 498 . 1 1 47 47 TRP CA C 13 56.973 0.3 . 1 . . . . . 47 TRP CA . 27170 1 499 . 1 1 47 47 TRP CB C 13 33.228 0.3 . 1 . . . . . 47 TRP CB . 27170 1 500 . 1 1 47 47 TRP N N 15 126.532 0.3 . 1 . . . . . 47 TRP N . 27170 1 501 . 1 1 47 47 TRP NE1 N 15 127.228 0.3 . 1 . . . . . 47 TRP NE1 . 27170 1 502 . 1 1 48 48 ALA H H 1 9.450 0.020 . 1 . . . . . 48 ALA H . 27170 1 503 . 1 1 48 48 ALA HA H 1 5.132 0.020 . 1 . . . . . 48 ALA HA . 27170 1 504 . 1 1 48 48 ALA HB1 H 1 1.030 0.020 . 1 . . . . . 48 ALA HB . 27170 1 505 . 1 1 48 48 ALA HB2 H 1 1.030 0.020 . 1 . . . . . 48 ALA HB . 27170 1 506 . 1 1 48 48 ALA HB3 H 1 1.030 0.020 . 1 . . . . . 48 ALA HB . 27170 1 507 . 1 1 48 48 ALA C C 13 176.602 0.3 . 1 . . . . . 48 ALA C . 27170 1 508 . 1 1 48 48 ALA CA C 13 51.059 0.3 . 1 . . . . . 48 ALA CA . 27170 1 509 . 1 1 48 48 ALA CB C 13 20.658 0.3 . 1 . . . . . 48 ALA CB . 27170 1 510 . 1 1 48 48 ALA N N 15 124.783 0.3 . 1 . . . . . 48 ALA N . 27170 1 511 . 1 1 49 49 VAL H H 1 8.915 0.020 . 1 . . . . . 49 VAL H . 27170 1 512 . 1 1 49 49 VAL HA H 1 5.340 0.020 . 1 . . . . . 49 VAL HA . 27170 1 513 . 1 1 49 49 VAL HB H 1 2.255 0.020 . 1 . . . . . 49 VAL HB . 27170 1 514 . 1 1 49 49 VAL HG11 H 1 0.994 0.020 . 1 . . . . . 49 VAL HG1 . 27170 1 515 . 1 1 49 49 VAL HG12 H 1 0.994 0.020 . 1 . . . . . 49 VAL HG1 . 27170 1 516 . 1 1 49 49 VAL HG13 H 1 0.994 0.020 . 1 . . . . . 49 VAL HG1 . 27170 1 517 . 1 1 49 49 VAL HG21 H 1 0.749 0.020 . 1 . . . . . 49 VAL HG2 . 27170 1 518 . 1 1 49 49 VAL HG22 H 1 0.749 0.020 . 1 . . . . . 49 VAL HG2 . 27170 1 519 . 1 1 49 49 VAL HG23 H 1 0.749 0.020 . 1 . . . . . 49 VAL HG2 . 27170 1 520 . 1 1 49 49 VAL C C 13 173.905 0.3 . 1 . . . . . 49 VAL C . 27170 1 521 . 1 1 49 49 VAL CA C 13 59.709 0.3 . 1 . . . . . 49 VAL CA . 27170 1 522 . 1 1 49 49 VAL CB C 13 34.641 0.3 . 1 . . . . . 49 VAL CB . 27170 1 523 . 1 1 49 49 VAL CG1 C 13 23.170 0.3 . 1 . . . . . 49 VAL CG1 . 27170 1 524 . 1 1 49 49 VAL CG2 C 13 22.039 0.3 . 1 . . . . . 49 VAL CG2 . 27170 1 525 . 1 1 49 49 VAL N N 15 116.973 0.3 . 1 . . . . . 49 VAL N . 27170 1 526 . 1 1 50 50 TYR H H 1 8.732 0.020 . 1 . . . . . 50 TYR H . 27170 1 527 . 1 1 50 50 TYR HA H 1 5.671 0.020 . 1 . . . . . 50 TYR HA . 27170 1 528 . 1 1 50 50 TYR HB2 H 1 3.33 0.020 . 1 . . . . . 50 TYR HB2 . 27170 1 529 . 1 1 50 50 TYR HB3 H 1 3.21 0.020 . 1 . . . . . 50 TYR HB3 . 27170 1 530 . 1 1 50 50 TYR HD1 H 1 6.766 0.020 . 1 . . . . . 50 TYR HD1 . 27170 1 531 . 1 1 50 50 TYR HE1 H 1 7.016 0.020 . 1 . . . . . 50 TYR HE1 . 27170 1 532 . 1 1 50 50 TYR C C 13 177.748 0.3 . 1 . . . . . 50 TYR C . 27170 1 533 . 1 1 50 50 TYR CA C 13 57.149 0.3 . 1 . . . . . 50 TYR CA . 27170 1 534 . 1 1 50 50 TYR CB C 13 41.084 0.3 . 1 . . . . . 50 TYR CB . 27170 1 535 . 1 1 50 50 TYR N N 15 119.287 0.3 . 1 . . . . . 50 TYR N . 27170 1 536 . 1 1 51 51 GLU H H 1 9.532 0.020 . 1 . . . . . 51 GLU H . 27170 1 537 . 1 1 51 51 GLU HA H 1 4.74 0.020 . 1 . . . . . 51 GLU HA . 27170 1 538 . 1 1 51 51 GLU HB2 H 1 2.637 0.020 . 1 . . . . . 51 GLU HB2 . 27170 1 539 . 1 1 51 51 GLU HB3 H 1 2.47 0.020 . 1 . . . . . 51 GLU HB3 . 27170 1 540 . 1 1 51 51 GLU HG2 H 1 2.683 0.020 . 1 . . . . . 51 GLU HG2 . 27170 1 541 . 1 1 51 51 GLU HG3 H 1 2.022 0.020 . 1 . . . . . 51 GLU HG3 . 27170 1 542 . 1 1 51 51 GLU C C 13 176.905 0.3 . 1 . . . . . 51 GLU C . 27170 1 543 . 1 1 51 51 GLU CA C 13 60.327 0.3 . 1 . . . . . 51 GLU CA . 27170 1 544 . 1 1 51 51 GLU CB C 13 32.434 0.3 . 1 . . . . . 51 GLU CB . 27170 1 545 . 1 1 51 51 GLU CG C 13 39.091 0.3 . 1 . . . . . 51 GLU CG . 27170 1 546 . 1 1 51 51 GLU N N 15 121.983 0.3 . 1 . . . . . 51 GLU N . 27170 1 547 . 1 1 52 52 ARG H H 1 7.994 0.020 . 1 . . . . . 52 ARG H . 27170 1 548 . 1 1 52 52 ARG HA H 1 4.501 0.020 . 1 . . . . . 52 ARG HA . 27170 1 549 . 1 1 52 52 ARG HB2 H 1 1.83 0.020 . 1 . . . . . 52 ARG HB2 . 27170 1 550 . 1 1 52 52 ARG HB3 H 1 1.23 0.020 . 1 . . . . . 52 ARG HB3 . 27170 1 551 . 1 1 52 52 ARG HG2 H 1 1.751 0.020 . 1 . . . . . 52 ARG HG2 . 27170 1 552 . 1 1 52 52 ARG HG3 H 1 1.699 0.020 . 1 . . . . . 52 ARG HG3 . 27170 1 553 . 1 1 52 52 ARG HD2 H 1 3.290 0.020 . 1 . . . . . 52 ARG HD2 . 27170 1 554 . 1 1 52 52 ARG HD3 H 1 3.107 0.020 . 1 . . . . . 52 ARG HD3 . 27170 1 555 . 1 1 52 52 ARG CA C 13 53.177 0.3 . 1 . . . . . 52 ARG CA . 27170 1 556 . 1 1 52 52 ARG CB C 13 32.875 0.3 . 1 . . . . . 52 ARG CB . 27170 1 557 . 1 1 52 52 ARG N N 15 115.044 0.3 . 1 . . . . . 52 ARG N . 27170 1 558 . 1 1 53 53 PRO HA H 1 3.871 0.020 . 1 . . . . . 53 PRO HA . 27170 1 559 . 1 1 53 53 PRO HB2 H 1 2.132 0.020 . 1 . . . . . 53 PRO HB2 . 27170 1 560 . 1 1 53 53 PRO HB3 H 1 1.545 0.020 . 1 . . . . . 53 PRO HB3 . 27170 1 561 . 1 1 53 53 PRO HG2 H 1 1.592 0.020 . 1 . . . . . 53 PRO HG2 . 27170 1 562 . 1 1 53 53 PRO HG3 H 1 1.572 0.020 . 1 . . . . . 53 PRO HG3 . 27170 1 563 . 1 1 53 53 PRO HD2 H 1 3.264 0.020 . 1 . . . . . 53 PRO HD2 . 27170 1 564 . 1 1 53 53 PRO HD3 H 1 3.241 0.020 . 1 . . . . . 53 PRO HD3 . 27170 1 565 . 1 1 53 53 PRO C C 13 175.287 0.3 . 1 . . . . . 53 PRO C . 27170 1 566 . 1 1 53 53 PRO CA C 13 63.204 0.3 . 1 . . . . . 53 PRO CA . 27170 1 567 . 1 1 53 53 PRO CB C 13 33.405 0.3 . 1 . . . . . 53 PRO CB . 27170 1 568 . 1 1 53 53 PRO CG C 13 27.221 0.3 . 1 . . . . . 53 PRO CG . 27170 1 569 . 1 1 53 53 PRO CD C 13 53.034 0.3 . 1 . . . . . 53 PRO CD . 27170 1 570 . 1 1 54 54 ASN H H 1 9.877 0.020 . 1 . . . . . 54 ASN H . 27170 1 571 . 1 1 54 54 ASN HA H 1 3.22 0.020 . 1 . . . . . 54 ASN HA . 27170 1 572 . 1 1 54 54 ASN HB2 H 1 2.69 0.020 . 1 . . . . . 54 ASN HB2 . 27170 1 573 . 1 1 54 54 ASN HB3 H 1 2.63 0.020 . 1 . . . . . 54 ASN HB3 . 27170 1 574 . 1 1 54 54 ASN HD21 H 1 7.293 0.020 . 1 . . . . . 54 ASN HD21 . 27170 1 575 . 1 1 54 54 ASN HD22 H 1 6.703 0.020 . 1 . . . . . 54 ASN HD22 . 27170 1 576 . 1 1 54 54 ASN C C 13 177.141 0.3 . 1 . . . . . 54 ASN C . 27170 1 577 . 1 1 54 54 ASN CA C 13 54.678 0.3 . 1 . . . . . 54 ASN CA . 27170 1 578 . 1 1 54 54 ASN CB C 13 36.936 0.3 . 1 . . . . . 54 ASN CB . 27170 1 579 . 1 1 54 54 ASN N N 15 113.419 0.3 . 1 . . . . . 54 ASN N . 27170 1 580 . 1 1 54 54 ASN ND2 N 15 113.376 0.3 . 1 . . . . . 54 ASN ND2 . 27170 1 581 . 1 1 55 55 PHE H H 1 7.155 0.020 . 1 . . . . . 55 PHE H . 27170 1 582 . 1 1 55 55 PHE HA H 1 3.02 0.020 . 1 . . . . . 55 PHE HA . 27170 1 583 . 1 1 55 55 PHE HB2 H 1 1.78 0.020 . 1 . . . . . 55 PHE HB2 . 27170 1 584 . 1 1 55 55 PHE HB3 H 1 1.82 0.020 . 1 . . . . . 55 PHE HB3 . 27170 1 585 . 1 1 55 55 PHE HD1 H 1 6.816 0.020 . 1 . . . . . 55 PHE HD1 . 27170 1 586 . 1 1 55 55 PHE C C 13 174.580 0.3 . 1 . . . . . 55 PHE C . 27170 1 587 . 1 1 55 55 PHE CA C 13 55.71 0.3 . 1 . . . . . 55 PHE CA . 27170 1 588 . 1 1 55 55 PHE CB C 13 35.01 0.3 . 1 . . . . . 55 PHE CB . 27170 1 589 . 1 1 55 55 PHE N N 15 112.139 0.3 . 1 . . . . . 55 PHE N . 27170 1 590 . 1 1 56 56 ALA H H 1 6.209 0.020 . 1 . . . . . 56 ALA H . 27170 1 591 . 1 1 56 56 ALA HA H 1 4.777 0.020 . 1 . . . . . 56 ALA HA . 27170 1 592 . 1 1 56 56 ALA HB1 H 1 1.251 0.020 . 1 . . . . . 56 ALA HB . 27170 1 593 . 1 1 56 56 ALA HB2 H 1 1.251 0.020 . 1 . . . . . 56 ALA HB . 27170 1 594 . 1 1 56 56 ALA HB3 H 1 1.251 0.020 . 1 . . . . . 56 ALA HB . 27170 1 595 . 1 1 56 56 ALA C C 13 175.692 0.3 . 1 . . . . . 56 ALA C . 27170 1 596 . 1 1 56 56 ALA CA C 13 51.235 0.3 . 1 . . . . . 56 ALA CA . 27170 1 597 . 1 1 56 56 ALA CB C 13 23.607 0.3 . 1 . . . . . 56 ALA CB . 27170 1 598 . 1 1 56 56 ALA N N 15 120.960 0.3 . 1 . . . . . 56 ALA N . 27170 1 599 . 1 1 57 57 TRP H H 1 8.774 0.020 . 1 . . . . . 57 TRP H . 27170 1 600 . 1 1 57 57 TRP HA H 1 4.373 0.020 . 1 . . . . . 57 TRP HA . 27170 1 601 . 1 1 57 57 TRP HB2 H 1 2.940 0.020 . 1 . . . . . 57 TRP HB2 . 27170 1 602 . 1 1 57 57 TRP HD1 H 1 7.184 0.020 . 1 . . . . . 57 TRP HD1 . 27170 1 603 . 1 1 57 57 TRP HE1 H 1 9.590 0.020 . 1 . . . . . 57 TRP HE1 . 27170 1 604 . 1 1 57 57 TRP HE3 H 1 7.106 0.020 . 1 . . . . . 57 TRP HE3 . 27170 1 605 . 1 1 57 57 TRP HZ2 H 1 7.066 0.020 . 1 . . . . . 57 TRP HZ2 . 27170 1 606 . 1 1 57 57 TRP HZ3 H 1 7.006 0.020 . 1 . . . . . 57 TRP HZ3 . 27170 1 607 . 1 1 57 57 TRP HH2 H 1 6.897 0.020 . 1 . . . . . 57 TRP HH2 . 27170 1 608 . 1 1 57 57 TRP C C 13 171.310 0.3 . 1 . . . . . 57 TRP C . 27170 1 609 . 1 1 57 57 TRP CA C 13 57.326 0.3 . 1 . . . . . 57 TRP CA . 27170 1 610 . 1 1 57 57 TRP CB C 13 31.463 0.3 . 1 . . . . . 57 TRP CB . 27170 1 611 . 1 1 57 57 TRP N N 15 117.459 0.3 . 1 . . . . . 57 TRP N . 27170 1 612 . 1 1 57 57 TRP NE1 N 15 130.219 0.3 . 1 . . . . . 57 TRP NE1 . 27170 1 613 . 1 1 58 58 TYR H H 1 8.237 0.020 . 1 . . . . . 58 TYR H . 27170 1 614 . 1 1 58 58 TYR HA H 1 4.22 0.020 . 1 . . . . . 58 TYR HA . 27170 1 615 . 1 1 58 58 TYR HB2 H 1 3.002 0.020 . 1 . . . . . 58 TYR HB2 . 27170 1 616 . 1 1 58 58 TYR HD1 H 1 6.795 0.020 . 1 . . . . . 58 TYR HD1 . 27170 1 617 . 1 1 58 58 TYR HE1 H 1 6.864 0.020 . 1 . . . . . 58 TYR HE1 . 27170 1 618 . 1 1 58 58 TYR C C 13 177.478 0.3 . 1 . . . . . 58 TYR C . 27170 1 619 . 1 1 58 58 TYR CA C 13 59.356 0.3 . 1 . . . . . 58 TYR CA . 27170 1 620 . 1 1 58 58 TYR CB C 13 39.319 0.3 . 1 . . . . . 58 TYR CB . 27170 1 621 . 1 1 58 58 TYR N N 15 121.681 0.3 . 1 . . . . . 58 TYR N . 27170 1 622 . 1 1 59 59 MET H H 1 9.063 0.020 . 1 . . . . . 59 MET H . 27170 1 623 . 1 1 59 59 MET HA H 1 4.434 0.020 . 1 . . . . . 59 MET HA . 27170 1 624 . 1 1 59 59 MET HB2 H 1 1.496 0.020 . 1 . . . . . 59 MET HB2 . 27170 1 625 . 1 1 59 59 MET HB3 H 1 1.373 0.020 . 1 . . . . . 59 MET HB3 . 27170 1 626 . 1 1 59 59 MET HG2 H 1 2.487 0.020 . 1 . . . . . 59 MET HG2 . 27170 1 627 . 1 1 59 59 MET HG3 H 1 2.267 0.020 . 1 . . . . . 59 MET HG3 . 27170 1 628 . 1 1 59 59 MET C C 13 175.490 0.3 . 1 . . . . . 59 MET C . 27170 1 629 . 1 1 59 59 MET CA C 13 57.590 0.3 . 1 . . . . . 59 MET CA . 27170 1 630 . 1 1 59 59 MET CB C 13 34.199 0.3 . 1 . . . . . 59 MET CB . 27170 1 631 . 1 1 59 59 MET N N 15 122.014 0.3 . 1 . . . . . 59 MET N . 27170 1 632 . 1 1 60 60 TYR H H 1 8.695 0.020 . 1 . . . . . 60 TYR H . 27170 1 633 . 1 1 60 60 TYR HA H 1 4.532 0.020 . 1 . . . . . 60 TYR HA . 27170 1 634 . 1 1 60 60 TYR HB2 H 1 3.100 0.020 . 1 . . . . . 60 TYR HB2 . 27170 1 635 . 1 1 60 60 TYR HB3 H 1 2.255 0.020 . 1 . . . . . 60 TYR HB3 . 27170 1 636 . 1 1 60 60 TYR HD1 H 1 7.000 0.020 . 1 . . . . . 60 TYR HD1 . 27170 1 637 . 1 1 60 60 TYR HE1 H 1 7.095 0.020 . 1 . . . . . 60 TYR HE1 . 27170 1 638 . 1 1 60 60 TYR C C 13 174.950 0.3 . 1 . . . . . 60 TYR C . 27170 1 639 . 1 1 60 60 TYR CA C 13 56.708 0.3 . 1 . . . . . 60 TYR CA . 27170 1 640 . 1 1 60 60 TYR CB C 13 41.790 0.3 . 1 . . . . . 60 TYR CB . 27170 1 641 . 1 1 60 60 TYR N N 15 116.914 0.3 . 1 . . . . . 60 TYR N . 27170 1 642 . 1 1 61 61 ILE H H 1 8.103 0.020 . 1 . . . . . 61 ILE H . 27170 1 643 . 1 1 61 61 ILE HA H 1 4.850 0.020 . 1 . . . . . 61 ILE HA . 27170 1 644 . 1 1 61 61 ILE HB H 1 1.912 0.020 . 1 . . . . . 61 ILE HB . 27170 1 645 . 1 1 61 61 ILE HG12 H 1 1.405 0.020 . 1 . . . . . 61 ILE HG12 . 27170 1 646 . 1 1 61 61 ILE HG13 H 1 1.375 0.020 . 1 . . . . . 61 ILE HG13 . 27170 1 647 . 1 1 61 61 ILE HG21 H 1 0.647 0.020 . 1 . . . . . 61 ILE HG2 . 27170 1 648 . 1 1 61 61 ILE HG22 H 1 0.647 0.020 . 1 . . . . . 61 ILE HG2 . 27170 1 649 . 1 1 61 61 ILE HG23 H 1 0.647 0.020 . 1 . . . . . 61 ILE HG2 . 27170 1 650 . 1 1 61 61 ILE HD11 H 1 0.706 0.020 . 1 . . . . . 61 ILE HD1 . 27170 1 651 . 1 1 61 61 ILE HD12 H 1 0.706 0.020 . 1 . . . . . 61 ILE HD1 . 27170 1 652 . 1 1 61 61 ILE HD13 H 1 0.706 0.020 . 1 . . . . . 61 ILE HD1 . 27170 1 653 . 1 1 61 61 ILE C C 13 176.029 0.3 . 1 . . . . . 61 ILE C . 27170 1 654 . 1 1 61 61 ILE CA C 13 59.532 0.3 . 1 . . . . . 61 ILE CA . 27170 1 655 . 1 1 61 61 ILE CB C 13 37.024 0.3 . 1 . . . . . 61 ILE CB . 27170 1 656 . 1 1 61 61 ILE CG1 C 13 27.974 0.3 . 1 . . . . . 61 ILE CG1 . 27170 1 657 . 1 1 61 61 ILE CG2 C 13 18.648 0.3 . 1 . . . . . 61 ILE CG2 . 27170 1 658 . 1 1 61 61 ILE CD1 C 13 16.481 0.3 . 1 . . . . . 61 ILE CD1 . 27170 1 659 . 1 1 61 61 ILE N N 15 122.546 0.3 . 1 . . . . . 61 ILE N . 27170 1 660 . 1 1 62 62 LEU H H 1 9.566 0.020 . 1 . . . . . 62 LEU H . 27170 1 661 . 1 1 62 62 LEU HA H 1 4.927 0.020 . 1 . . . . . 62 LEU HA . 27170 1 662 . 1 1 62 62 LEU HB2 H 1 1.403 0.020 . 1 . . . . . 62 LEU HB2 . 27170 1 663 . 1 1 62 62 LEU HB3 H 1 1.354 0.020 . 1 . . . . . 62 LEU HB3 . 27170 1 664 . 1 1 62 62 LEU HG H 1 1.107 0.020 . 1 . . . . . 62 LEU HG . 27170 1 665 . 1 1 62 62 LEU HD11 H 1 0.761 0.020 . 1 . . . . . 62 LEU HD1 . 27170 1 666 . 1 1 62 62 LEU HD12 H 1 0.761 0.020 . 1 . . . . . 62 LEU HD1 . 27170 1 667 . 1 1 62 62 LEU HD13 H 1 0.761 0.020 . 1 . . . . . 62 LEU HD1 . 27170 1 668 . 1 1 62 62 LEU HD21 H 1 0.590 0.020 . 1 . . . . . 62 LEU HD2 . 27170 1 669 . 1 1 62 62 LEU HD22 H 1 0.590 0.020 . 1 . . . . . 62 LEU HD2 . 27170 1 670 . 1 1 62 62 LEU HD23 H 1 0.590 0.020 . 1 . . . . . 62 LEU HD2 . 27170 1 671 . 1 1 62 62 LEU CA C 13 53.618 0.3 . 1 . . . . . 62 LEU CA . 27170 1 672 . 1 1 62 62 LEU CB C 13 45.145 0.3 . 1 . . . . . 62 LEU CB . 27170 1 673 . 1 1 62 62 LEU N N 15 131.506 0.3 . 1 . . . . . 62 LEU N . 27170 1 674 . 1 1 63 63 PRO HA H 1 4.936 0.020 . 1 . . . . . 63 PRO HA . 27170 1 675 . 1 1 63 63 PRO HB2 H 1 2.376 0.020 . 1 . . . . . 63 PRO HB2 . 27170 1 676 . 1 1 63 63 PRO HB3 H 1 2.343 0.020 . 1 . . . . . 63 PRO HB3 . 27170 1 677 . 1 1 63 63 PRO HG2 H 1 1.985 0.020 . 1 . . . . . 63 PRO HG2 . 27170 1 678 . 1 1 63 63 PRO HG3 H 1 1.967 0.020 . 1 . . . . . 63 PRO HG3 . 27170 1 679 . 1 1 63 63 PRO HD2 H 1 3.675 0.020 . 1 . . . . . 63 PRO HD2 . 27170 1 680 . 1 1 63 63 PRO HD3 H 1 3.663 0.020 . 1 . . . . . 63 PRO HD3 . 27170 1 681 . 1 1 63 63 PRO C C 13 176.703 0.3 . 1 . . . . . 63 PRO C . 27170 1 682 . 1 1 63 63 PRO CA C 13 62.004 0.3 . 1 . . . . . 63 PRO CA . 27170 1 683 . 1 1 63 63 PRO CB C 13 34.199 0.3 . 1 . . . . . 63 PRO CB . 27170 1 684 . 1 1 63 63 PRO CG C 13 27.880 0.3 . 1 . . . . . 63 PRO CG . 27170 1 685 . 1 1 63 63 PRO CD C 13 56.991 0.3 . 1 . . . . . 63 PRO CD . 27170 1 686 . 1 1 64 64 GLN H H 1 8.326 0.020 . 1 . . . . . 64 GLN H . 27170 1 687 . 1 1 64 64 GLN HA H 1 3.920 0.020 . 1 . . . . . 64 GLN HA . 27170 1 688 . 1 1 64 64 GLN HB2 H 1 1.926 0.020 . 1 . . . . . 64 GLN HB2 . 27170 1 689 . 1 1 64 64 GLN HB3 H 1 1.873 0.020 . 1 . . . . . 64 GLN HB3 . 27170 1 690 . 1 1 64 64 GLN HG2 H 1 2.036 0.020 . 1 . . . . . 64 GLN HG2 . 27170 1 691 . 1 1 64 64 GLN HG3 H 1 2.005 0.020 . 1 . . . . . 64 GLN HG3 . 27170 1 692 . 1 1 64 64 GLN HE21 H 1 7.438 0.020 . 1 . . . . . 64 GLN HE21 . 27170 1 693 . 1 1 64 64 GLN HE22 H 1 6.780 0.020 . 1 . . . . . 64 GLN HE22 . 27170 1 694 . 1 1 64 64 GLN C C 13 175.523 0.3 . 1 . . . . . 64 GLN C . 27170 1 695 . 1 1 64 64 GLN CA C 13 58.208 0.3 . 1 . . . . . 64 GLN CA . 27170 1 696 . 1 1 64 64 GLN CB C 13 29.963 0.3 . 1 . . . . . 64 GLN CB . 27170 1 697 . 1 1 64 64 GLN CG C 13 34.475 0.3 . 1 . . . . . 64 GLN CG . 27170 1 698 . 1 1 64 64 GLN N N 15 120.608 0.3 . 1 . . . . . 64 GLN N . 27170 1 699 . 1 1 64 64 GLN NE2 N 15 111.924 0.3 . 1 . . . . . 64 GLN NE2 . 27170 1 700 . 1 1 65 65 GLY H H 1 8.554 0.020 . 1 . . . . . 65 GLY H . 27170 1 701 . 1 1 65 65 GLY HA2 H 1 4.177 0.020 . 1 . . . . . 65 GLY HA2 . 27170 1 702 . 1 1 65 65 GLY HA3 H 1 3.798 0.020 . 1 . . . . . 65 GLY HA3 . 27170 1 703 . 1 1 65 65 GLY C C 13 171.209 0.3 . 1 . . . . . 65 GLY C . 27170 1 704 . 1 1 65 65 GLY CA C 13 45.321 0.3 . 1 . . . . . 65 GLY CA . 27170 1 705 . 1 1 65 65 GLY N N 15 111.606 0.3 . 1 . . . . . 65 GLY N . 27170 1 706 . 1 1 66 66 GLU H H 1 8.203 0.020 . 1 . . . . . 66 GLU H . 27170 1 707 . 1 1 66 66 GLU HA H 1 4.740 0.020 . 1 . . . . . 66 GLU HA . 27170 1 708 . 1 1 66 66 GLU HB2 H 1 1.913 0.020 . 1 . . . . . 66 GLU HB2 . 27170 1 709 . 1 1 66 66 GLU HB3 H 1 1.883 0.020 . 1 . . . . . 66 GLU HB3 . 27170 1 710 . 1 1 66 66 GLU HG2 H 1 2.078 0.020 . 1 . . . . . 66 GLU HG2 . 27170 1 711 . 1 1 66 66 GLU HG3 H 1 1.958 0.020 . 1 . . . . . 66 GLU HG3 . 27170 1 712 . 1 1 66 66 GLU C C 13 175.995 0.3 . 1 . . . . . 66 GLU C . 27170 1 713 . 1 1 66 66 GLU CA C 13 56.443 0.3 . 1 . . . . . 66 GLU CA . 27170 1 714 . 1 1 66 66 GLU CB C 13 32.699 0.3 . 1 . . . . . 66 GLU CB . 27170 1 715 . 1 1 66 66 GLU CG C 13 38.997 0.3 . 1 . . . . . 66 GLU CG . 27170 1 716 . 1 1 66 66 GLU N N 15 117.265 0.3 . 1 . . . . . 66 GLU N . 27170 1 717 . 1 1 67 67 TYR H H 1 9.172 0.020 . 1 . . . . . 67 TYR H . 27170 1 718 . 1 1 67 67 TYR HA H 1 5.012 0.020 . 1 . . . . . 67 TYR HA . 27170 1 719 . 1 1 67 67 TYR HB2 H 1 3.817 0.020 . 1 . . . . . 67 TYR HB2 . 27170 1 720 . 1 1 67 67 TYR HB3 H 1 3.238 0.020 . 1 . . . . . 67 TYR HB3 . 27170 1 721 . 1 1 67 67 TYR HD1 H 1 6.953 0.020 . 1 . . . . . 67 TYR HD1 . 27170 1 722 . 1 1 67 67 TYR HE1 H 1 7.176 0.020 . 1 . . . . . 67 TYR HE1 . 27170 1 723 . 1 1 67 67 TYR CA C 13 55.913 0.3 . 1 . . . . . 67 TYR CA . 27170 1 724 . 1 1 67 67 TYR CB C 13 40.820 0.3 . 1 . . . . . 67 TYR CB . 27170 1 725 . 1 1 67 67 TYR N N 15 118.740 0.3 . 1 . . . . . 67 TYR N . 27170 1 726 . 1 1 68 68 PRO HA H 1 3.631 0.020 . 1 . . . . . 68 PRO HA . 27170 1 727 . 1 1 68 68 PRO HB2 H 1 2.212 0.020 . 1 . . . . . 68 PRO HB2 . 27170 1 728 . 1 1 68 68 PRO HB3 H 1 2.052 0.020 . 1 . . . . . 68 PRO HB3 . 27170 1 729 . 1 1 68 68 PRO HG2 H 1 2.266 0.020 . 1 . . . . . 68 PRO HG2 . 27170 1 730 . 1 1 68 68 PRO HG3 H 1 2.023 0.020 . 1 . . . . . 68 PRO HG3 . 27170 1 731 . 1 1 68 68 PRO HD2 H 1 3.610 0.020 . 1 . . . . . 68 PRO HD2 . 27170 1 732 . 1 1 68 68 PRO HD3 H 1 3.569 0.020 . 1 . . . . . 68 PRO HD3 . 27170 1 733 . 1 1 68 68 PRO C C 13 173.669 0.3 . 1 . . . . . 68 PRO C . 27170 1 734 . 1 1 68 68 PRO CA C 13 65.803 0.3 . 1 . . . . . 68 PRO CA . 27170 1 735 . 1 1 68 68 PRO CB C 13 32.879 0.3 . 1 . . . . . 68 PRO CB . 27170 1 736 . 1 1 68 68 PRO CG C 13 29.576 0.3 . 1 . . . . . 68 PRO CG . 27170 1 737 . 1 1 68 68 PRO CD C 13 54.353 0.3 . 1 . . . . . 68 PRO CD . 27170 1 738 . 1 1 69 69 GLU H H 1 6.832 0.020 . 1 . . . . . 69 GLU H . 27170 1 739 . 1 1 69 69 GLU HA H 1 5.267 0.020 . 1 . . . . . 69 GLU HA . 27170 1 740 . 1 1 69 69 GLU HB2 H 1 2.089 0.020 . 1 . . . . . 69 GLU HB2 . 27170 1 741 . 1 1 69 69 GLU HB3 H 1 1.662 0.020 . 1 . . . . . 69 GLU HB3 . 27170 1 742 . 1 1 69 69 GLU HG2 H 1 1.962 0.020 . 1 . . . . . 69 GLU HG2 . 27170 1 743 . 1 1 69 69 GLU HG3 H 1 1.940 0.020 . 1 . . . . . 69 GLU HG3 . 27170 1 744 . 1 1 69 69 GLU C C 13 177.748 0.3 . 1 . . . . . 69 GLU C . 27170 1 745 . 1 1 69 69 GLU CA C 13 55.387 0.3 . 1 . . . . . 69 GLU CA . 27170 1 746 . 1 1 69 69 GLU CB C 13 33.497 0.3 . 1 . . . . . 69 GLU CB . 27170 1 747 . 1 1 69 69 GLU CG C 13 33.721 0.3 . 1 . . . . . 69 GLU CG . 27170 1 748 . 1 1 69 69 GLU N N 15 112.449 0.3 . 1 . . . . . 69 GLU N . 27170 1 749 . 1 1 70 70 TYR H H 1 8.223 0.020 . 1 . . . . . 70 TYR H . 27170 1 750 . 1 1 70 70 TYR HA H 1 4.802 0.020 . 1 . . . . . 70 TYR HA . 27170 1 751 . 1 1 70 70 TYR HB2 H 1 2.561 0.020 . 1 . . . . . 70 TYR HB2 . 27170 1 752 . 1 1 70 70 TYR HB3 H 1 2.475 0.020 . 1 . . . . . 70 TYR HB3 . 27170 1 753 . 1 1 70 70 TYR HD1 H 1 6.795 0.020 . 1 . . . . . 70 TYR HD1 . 27170 1 754 . 1 1 70 70 TYR HE1 H 1 7.198 0.020 . 1 . . . . . 70 TYR HE1 . 27170 1 755 . 1 1 70 70 TYR C C 13 175.860 0.3 . 1 . . . . . 70 TYR C . 27170 1 756 . 1 1 70 70 TYR CA C 13 59.183 0.3 . 1 . . . . . 70 TYR CA . 27170 1 757 . 1 1 70 70 TYR CB C 13 39.234 0.3 . 1 . . . . . 70 TYR CB . 27170 1 758 . 1 1 70 70 TYR N N 15 121.560 0.3 . 1 . . . . . 70 TYR N . 27170 1 759 . 1 1 71 71 GLN H H 1 8.077 0.020 . 1 . . . . . 71 GLN H . 27170 1 760 . 1 1 71 71 GLN HA H 1 3.700 0.020 . 1 . . . . . 71 GLN HA . 27170 1 761 . 1 1 71 71 GLN HB2 H 1 1.651 0.020 . 1 . . . . . 71 GLN HB2 . 27170 1 762 . 1 1 71 71 GLN HB3 H 1 1.614 0.020 . 1 . . . . . 71 GLN HB3 . 27170 1 763 . 1 1 71 71 GLN HG2 H 1 1.773 0.020 . 1 . . . . . 71 GLN HG2 . 27170 1 764 . 1 1 71 71 GLN HG3 H 1 1.742 0.020 . 1 . . . . . 71 GLN HG3 . 27170 1 765 . 1 1 71 71 GLN HE21 H 1 7.074 0.020 . 1 . . . . . 71 GLN HE21 . 27170 1 766 . 1 1 71 71 GLN HE22 H 1 6.149 0.020 . 1 . . . . . 71 GLN HE22 . 27170 1 767 . 1 1 71 71 GLN C C 13 180.175 0.3 . 1 . . . . . 71 GLN C . 27170 1 768 . 1 1 71 71 GLN CA C 13 62.184 0.3 . 1 . . . . . 71 GLN CA . 27170 1 769 . 1 1 71 71 GLN CB C 13 31.113 0.3 . 1 . . . . . 71 GLN CB . 27170 1 770 . 1 1 71 71 GLN CG C 13 34.946 0.3 . 1 . . . . . 71 GLN CG . 27170 1 771 . 1 1 71 71 GLN N N 15 119.566 0.3 . 1 . . . . . 71 GLN N . 27170 1 772 . 1 1 71 71 GLN NE2 N 15 109.337 0.3 . 1 . . . . . 71 GLN NE2 . 27170 1 773 . 1 1 72 72 ARG H H 1 7.932 0.020 . 1 . . . . . 72 ARG H . 27170 1 774 . 1 1 72 72 ARG HA H 1 4.116 0.020 . 1 . . . . . 72 ARG HA . 27170 1 775 . 1 1 72 72 ARG HB2 H 1 2.447 0.020 . 1 . . . . . 72 ARG HB2 . 27170 1 776 . 1 1 72 72 ARG HB3 H 1 2.417 0.020 . 1 . . . . . 72 ARG HB3 . 27170 1 777 . 1 1 72 72 ARG HG2 H 1 1.744 0.020 . 1 . . . . . 72 ARG HG2 . 27170 1 778 . 1 1 72 72 ARG HG3 H 1 1.670 0.020 . 1 . . . . . 72 ARG HG3 . 27170 1 779 . 1 1 72 72 ARG HD2 H 1 3.173 0.020 . 1 . . . . . 72 ARG HD2 . 27170 1 780 . 1 1 72 72 ARG HD3 H 1 3.076 0.020 . 1 . . . . . 72 ARG HD3 . 27170 1 781 . 1 1 72 72 ARG HE H 1 7.715 0.020 . 1 . . . . . 72 ARG HE . 27170 1 782 . 1 1 72 72 ARG C C 13 174.040 0.3 . 1 . . . . . 72 ARG C . 27170 1 783 . 1 1 72 72 ARG CA C 13 56.973 0.3 . 1 . . . . . 72 ARG CA . 27170 1 784 . 1 1 72 72 ARG CB C 13 30.051 0.3 . 1 . . . . . 72 ARG CB . 27170 1 785 . 1 1 72 72 ARG CG C 13 28.634 0.3 . 1 . . . . . 72 ARG CG . 27170 1 786 . 1 1 72 72 ARG CD C 13 44.084 0.3 . 1 . . . . . 72 ARG CD . 27170 1 787 . 1 1 72 72 ARG N N 15 117.294 0.3 . 1 . . . . . 72 ARG N . 27170 1 788 . 1 1 73 73 TRP H H 1 8.071 0.020 . 1 . . . . . 73 TRP H . 27170 1 789 . 1 1 73 73 TRP HA H 1 5.169 0.020 . 1 . . . . . 73 TRP HA . 27170 1 790 . 1 1 73 73 TRP HB2 H 1 3.381 0.020 . 1 . . . . . 73 TRP HB2 . 27170 1 791 . 1 1 73 73 TRP HB3 H 1 2.463 0.020 . 1 . . . . . 73 TRP HB3 . 27170 1 792 . 1 1 73 73 TRP HD1 H 1 7.113 0.020 . 1 . . . . . 73 TRP HD1 . 27170 1 793 . 1 1 73 73 TRP HE1 H 1 10.050 0.020 . 1 . . . . . 73 TRP HE1 . 27170 1 794 . 1 1 73 73 TRP HE3 H 1 6.987 0.020 . 1 . . . . . 73 TRP HE3 . 27170 1 795 . 1 1 73 73 TRP HZ2 H 1 6.841 0.020 . 1 . . . . . 73 TRP HZ2 . 27170 1 796 . 1 1 73 73 TRP HZ3 H 1 6.764 0.020 . 1 . . . . . 73 TRP HZ3 . 27170 1 797 . 1 1 73 73 TRP HH2 H 1 6.606 0.020 . 1 . . . . . 73 TRP HH2 . 27170 1 798 . 1 1 73 73 TRP C C 13 175.816 0.3 . 1 . . . . . 73 TRP C . 27170 1 799 . 1 1 73 73 TRP CA C 13 57.064 0.3 . 1 . . . . . 73 TRP CA . 27170 1 800 . 1 1 73 73 TRP CB C 13 31.378 0.3 . 1 . . . . . 73 TRP CB . 27170 1 801 . 1 1 73 73 TRP N N 15 118.244 0.3 . 1 . . . . . 73 TRP N . 27170 1 802 . 1 1 73 73 TRP NE1 N 15 130.459 0.3 . 1 . . . . . 73 TRP NE1 . 27170 1 803 . 1 1 74 74 MET H H 1 7.558 0.020 . 1 . . . . . 74 MET H . 27170 1 804 . 1 1 74 74 MET HA H 1 3.957 0.020 . 1 . . . . . 74 MET HA . 27170 1 805 . 1 1 74 74 MET HB2 H 1 2.720 0.020 . 1 . . . . . 74 MET HB2 . 27170 1 806 . 1 1 74 74 MET HB3 H 1 2.341 0.020 . 1 . . . . . 74 MET HB3 . 27170 1 807 . 1 1 74 74 MET HG2 H 1 2.692 0.020 . 1 . . . . . 74 MET HG2 . 27170 1 808 . 1 1 74 74 MET HG3 H 1 2.669 0.020 . 1 . . . . . 74 MET HG3 . 27170 1 809 . 1 1 74 74 MET C C 13 176.029 0.3 . 1 . . . . . 74 MET C . 27170 1 810 . 1 1 74 74 MET CA C 13 57.414 0.3 . 1 . . . . . 74 MET CA . 27170 1 811 . 1 1 74 74 MET CB C 13 29.963 0.3 . 1 . . . . . 74 MET CB . 27170 1 812 . 1 1 74 74 MET CG C 13 33.344 0.3 . 1 . . . . . 74 MET CG . 27170 1 813 . 1 1 74 74 MET N N 15 113.027 0.3 . 1 . . . . . 74 MET N . 27170 1 814 . 1 1 75 75 GLY H H 1 7.376 0.020 . 1 . . . . . 75 GLY H . 27170 1 815 . 1 1 75 75 GLY HA2 H 1 3.528 0.020 . 1 . . . . . 75 GLY HA2 . 27170 1 816 . 1 1 75 75 GLY HA3 H 1 2.855 0.020 . 1 . . . . . 75 GLY HA3 . 27170 1 817 . 1 1 75 75 GLY C C 13 174.209 0.3 . 1 . . . . . 75 GLY C . 27170 1 818 . 1 1 75 75 GLY CA C 13 46.469 0.3 . 1 . . . . . 75 GLY CA . 27170 1 819 . 1 1 75 75 GLY N N 15 105.244 0.3 . 1 . . . . . 75 GLY N . 27170 1 820 . 1 1 76 76 LEU H H 1 7.312 0.020 . 1 . . . . . 76 LEU H . 27170 1 821 . 1 1 76 76 LEU HA H 1 4.287 0.020 . 1 . . . . . 76 LEU HA . 27170 1 822 . 1 1 76 76 LEU HB2 H 1 1.498 0.020 . 1 . . . . . 76 LEU HB2 . 27170 1 823 . 1 1 76 76 LEU HB3 H 1 1.470 0.020 . 1 . . . . . 76 LEU HB3 . 27170 1 824 . 1 1 76 76 LEU HG H 1 1.721 0.020 . 1 . . . . . 76 LEU HG . 27170 1 825 . 1 1 76 76 LEU HD11 H 1 0.798 0.020 . 1 . . . . . 76 LEU HD1 . 27170 1 826 . 1 1 76 76 LEU HD12 H 1 0.798 0.020 . 1 . . . . . 76 LEU HD1 . 27170 1 827 . 1 1 76 76 LEU HD13 H 1 0.798 0.020 . 1 . . . . . 76 LEU HD1 . 27170 1 828 . 1 1 76 76 LEU HD21 H 1 0.639 0.020 . 1 . . . . . 76 LEU HD2 . 27170 1 829 . 1 1 76 76 LEU HD22 H 1 0.639 0.020 . 1 . . . . . 76 LEU HD2 . 27170 1 830 . 1 1 76 76 LEU HD23 H 1 0.639 0.020 . 1 . . . . . 76 LEU HD2 . 27170 1 831 . 1 1 76 76 LEU C C 13 177.209 0.3 . 1 . . . . . 76 LEU C . 27170 1 832 . 1 1 76 76 LEU CA C 13 56.002 0.3 . 1 . . . . . 76 LEU CA . 27170 1 833 . 1 1 76 76 LEU CB C 13 44.174 0.3 . 1 . . . . . 76 LEU CB . 27170 1 834 . 1 1 76 76 LEU CG C 13 28.163 0.3 . 1 . . . . . 76 LEU CG . 27170 1 835 . 1 1 76 76 LEU CD1 C 13 25.431 0.3 . 1 . . . . . 76 LEU CD1 . 27170 1 836 . 1 1 76 76 LEU CD2 C 13 23.829 0.3 . 1 . . . . . 76 LEU CD2 . 27170 1 837 . 1 1 76 76 LEU N N 15 119.304 0.3 . 1 . . . . . 76 LEU N . 27170 1 838 . 1 1 77 77 ASN H H 1 7.146 0.020 . 1 . . . . . 77 ASN H . 27170 1 839 . 1 1 77 77 ASN HA H 1 4.104 0.020 . 1 . . . . . 77 ASN HA . 27170 1 840 . 1 1 77 77 ASN HB2 H 1 3.553 0.020 . 1 . . . . . 77 ASN HB2 . 27170 1 841 . 1 1 77 77 ASN HB3 H 1 3.479 0.020 . 1 . . . . . 77 ASN HB3 . 27170 1 842 . 1 1 77 77 ASN HD21 H 1 7.753 0.020 . 1 . . . . . 77 ASN HD21 . 27170 1 843 . 1 1 77 77 ASN HD22 H 1 7.391 0.020 . 1 . . . . . 77 ASN HD22 . 27170 1 844 . 1 1 77 77 ASN C C 13 175.220 0.3 . 1 . . . . . 77 ASN C . 27170 1 845 . 1 1 77 77 ASN CA C 13 52.206 0.3 . 1 . . . . . 77 ASN CA . 27170 1 846 . 1 1 77 77 ASN CB C 13 38.878 0.3 . 1 . . . . . 77 ASN CB . 27170 1 847 . 1 1 77 77 ASN N N 15 112.096 0.3 . 1 . . . . . 77 ASN N . 27170 1 848 . 1 1 77 77 ASN ND2 N 15 115.060 0.3 . 1 . . . . . 77 ASN ND2 . 27170 1 849 . 1 1 78 78 ASP H H 1 7.526 0.020 . 1 . . . . . 78 ASP H . 27170 1 850 . 1 1 78 78 ASP HA H 1 4.664 0.020 . 1 . . . . . 78 ASP HA . 27170 1 851 . 1 1 78 78 ASP HB2 H 1 2.152 0.020 . 1 . . . . . 78 ASP HB2 . 27170 1 852 . 1 1 78 78 ASP HB3 H 1 2.100 0.020 . 1 . . . . . 78 ASP HB3 . 27170 1 853 . 1 1 78 78 ASP C C 13 173.501 0.3 . 1 . . . . . 78 ASP C . 27170 1 854 . 1 1 78 78 ASP CA C 13 55.296 0.3 . 1 . . . . . 78 ASP CA . 27170 1 855 . 1 1 78 78 ASP CB C 13 41.349 0.3 . 1 . . . . . 78 ASP CB . 27170 1 856 . 1 1 78 78 ASP N N 15 113.410 0.3 . 1 . . . . . 78 ASP N . 27170 1 857 . 1 1 79 79 ARG H H 1 7.987 0.020 . 1 . . . . . 79 ARG H . 27170 1 858 . 1 1 79 79 ARG HA H 1 4.642 0.020 . 1 . . . . . 79 ARG HA . 27170 1 859 . 1 1 79 79 ARG HB2 H 1 1.839 0.020 . 1 . . . . . 79 ARG HB2 . 27170 1 860 . 1 1 79 79 ARG HB3 H 1 1.753 0.020 . 1 . . . . . 79 ARG HB3 . 27170 1 861 . 1 1 79 79 ARG HG2 H 1 1.679 0.020 . 1 . . . . . 79 ARG HG2 . 27170 1 862 . 1 1 79 79 ARG HG3 H 1 1.618 0.020 . 1 . . . . . 79 ARG HG3 . 27170 1 863 . 1 1 79 79 ARG HD2 H 1 3.332 0.020 . 1 . . . . . 79 ARG HD2 . 27170 1 864 . 1 1 79 79 ARG HD3 H 1 3.259 0.020 . 1 . . . . . 79 ARG HD3 . 27170 1 865 . 1 1 79 79 ARG C C 13 175.051 0.3 . 1 . . . . . 79 ARG C . 27170 1 866 . 1 1 79 79 ARG CA C 13 57.417 0.3 . 1 . . . . . 79 ARG CA . 27170 1 867 . 1 1 79 79 ARG CB C 13 29.966 0.3 . 1 . . . . . 79 ARG CB . 27170 1 868 . 1 1 79 79 ARG CG C 13 27.692 0.3 . 1 . . . . . 79 ARG CG . 27170 1 869 . 1 1 79 79 ARG CD C 13 44.367 0.3 . 1 . . . . . 79 ARG CD . 27170 1 870 . 1 1 79 79 ARG N N 15 117.168 0.3 . 1 . . . . . 79 ARG N . 27170 1 871 . 1 1 80 80 LEU H H 1 6.947 0.020 . 1 . . . . . 80 LEU H . 27170 1 872 . 1 1 80 80 LEU HA H 1 4.899 0.020 . 1 . . . . . 80 LEU HA . 27170 1 873 . 1 1 80 80 LEU HB2 H 1 1.532 0.020 . 1 . . . . . 80 LEU HB2 . 27170 1 874 . 1 1 80 80 LEU HB3 H 1 1.300 0.020 . 1 . . . . . 80 LEU HB3 . 27170 1 875 . 1 1 80 80 LEU HG H 1 1.728 0.020 . 1 . . . . . 80 LEU HG . 27170 1 876 . 1 1 80 80 LEU HD11 H 1 1.055 0.020 . 1 . . . . . 80 LEU HD1 . 27170 1 877 . 1 1 80 80 LEU HD12 H 1 1.055 0.020 . 1 . . . . . 80 LEU HD1 . 27170 1 878 . 1 1 80 80 LEU HD13 H 1 1.055 0.020 . 1 . . . . . 80 LEU HD1 . 27170 1 879 . 1 1 80 80 LEU HD21 H 1 0.822 0.020 . 1 . . . . . 80 LEU HD2 . 27170 1 880 . 1 1 80 80 LEU HD22 H 1 0.822 0.020 . 1 . . . . . 80 LEU HD2 . 27170 1 881 . 1 1 80 80 LEU HD23 H 1 0.822 0.020 . 1 . . . . . 80 LEU HD2 . 27170 1 882 . 1 1 80 80 LEU C C 13 176.400 0.3 . 1 . . . . . 80 LEU C . 27170 1 883 . 1 1 80 80 LEU CA C 13 55.564 0.3 . 1 . . . . . 80 LEU CA . 27170 1 884 . 1 1 80 80 LEU CB C 13 48.767 0.3 . 1 . . . . . 80 LEU CB . 27170 1 885 . 1 1 80 80 LEU CG C 13 27.786 0.3 . 1 . . . . . 80 LEU CG . 27170 1 886 . 1 1 80 80 LEU CD1 C 13 28.351 0.3 . 1 . . . . . 80 LEU CD1 . 27170 1 887 . 1 1 80 80 LEU CD2 C 13 24.992 0.3 . 1 . . . . . 80 LEU CD2 . 27170 1 888 . 1 1 80 80 LEU N N 15 121.165 0.3 . 1 . . . . . 80 LEU N . 27170 1 889 . 1 1 81 81 SER H H 1 8.381 0.020 . 1 . . . . . 81 SER H . 27170 1 890 . 1 1 81 81 SER HA H 1 3.357 0.020 . 1 . . . . . 81 SER HA . 27170 1 891 . 1 1 81 81 SER HB2 H 1 3.283 0.020 . 1 . . . . . 81 SER HB2 . 27170 1 892 . 1 1 81 81 SER HB3 H 1 2.904 0.020 . 1 . . . . . 81 SER HB3 . 27170 1 893 . 1 1 81 81 SER C C 13 171.377 0.3 . 1 . . . . . 81 SER C . 27170 1 894 . 1 1 81 81 SER CA C 13 58.830 0.3 . 1 . . . . . 81 SER CA . 27170 1 895 . 1 1 81 81 SER CB C 13 67.392 0.3 . 1 . . . . . 81 SER CB . 27170 1 896 . 1 1 81 81 SER N N 15 108.569 0.3 . 1 . . . . . 81 SER N . 27170 1 897 . 1 1 82 82 SER H H 1 7.510 0.020 . 1 . . . . . 82 SER H . 27170 1 898 . 1 1 82 82 SER HA H 1 4.544 0.020 . 1 . . . . . 82 SER HA . 27170 1 899 . 1 1 82 82 SER HB2 H 1 4.030 0.020 . 1 . . . . . 82 SER HB2 . 27170 1 900 . 1 1 82 82 SER HB3 H 1 3.871 0.020 . 1 . . . . . 82 SER HB3 . 27170 1 901 . 1 1 82 82 SER C C 13 174.242 0.3 . 1 . . . . . 82 SER C . 27170 1 902 . 1 1 82 82 SER CA C 13 59.444 0.3 . 1 . . . . . 82 SER CA . 27170 1 903 . 1 1 82 82 SER CB C 13 66.859 0.3 . 1 . . . . . 82 SER CB . 27170 1 904 . 1 1 82 82 SER N N 15 109.380 0.3 . 1 . . . . . 82 SER N . 27170 1 905 . 1 1 83 83 CYS H H 1 9.624 0.020 . 1 . . . . . 83 CYS H . 27170 1 906 . 1 1 83 83 CYS HA H 1 6.442 0.020 . 1 . . . . . 83 CYS HA . 27170 1 907 . 1 1 83 83 CYS HB2 H 1 3.553 0.020 . 1 . . . . . 83 CYS HB2 . 27170 1 908 . 1 1 83 83 CYS HB3 H 1 3.406 0.020 . 1 . . . . . 83 CYS HB3 . 27170 1 909 . 1 1 83 83 CYS C C 13 172.153 0.3 . 1 . . . . . 83 CYS C . 27170 1 910 . 1 1 83 83 CYS CA C 13 57.149 0.3 . 1 . . . . . 83 CYS CA . 27170 1 911 . 1 1 83 83 CYS CB C 13 33.582 0.3 . 1 . . . . . 83 CYS CB . 27170 1 912 . 1 1 83 83 CYS N N 15 112.988 0.3 . 1 . . . . . 83 CYS N . 27170 1 913 . 1 1 84 84 ARG H H 1 9.999 0.020 . 1 . . . . . 84 ARG H . 27170 1 914 . 1 1 84 84 ARG HA H 1 4.887 0.020 . 1 . . . . . 84 ARG HA . 27170 1 915 . 1 1 84 84 ARG HB2 H 1 1.600 0.020 . 1 . . . . . 84 ARG HB2 . 27170 1 916 . 1 1 84 84 ARG HB3 H 1 1.542 0.020 . 1 . . . . . 84 ARG HB3 . 27170 1 917 . 1 1 84 84 ARG HG2 H 1 1.496 0.020 . 1 . . . . . 84 ARG HG2 . 27170 1 918 . 1 1 84 84 ARG HG3 H 1 1.477 0.020 . 1 . . . . . 84 ARG HG3 . 27170 1 919 . 1 1 84 84 ARG HD2 H 1 3.122 0.020 . 1 . . . . . 84 ARG HD2 . 27170 1 920 . 1 1 84 84 ARG HD3 H 1 2.833 0.020 . 1 . . . . . 84 ARG HD3 . 27170 1 921 . 1 1 84 84 ARG C C 13 173.535 0.3 . 1 . . . . . 84 ARG C . 27170 1 922 . 1 1 84 84 ARG CA C 13 55.649 0.3 . 1 . . . . . 84 ARG CA . 27170 1 923 . 1 1 84 84 ARG CB C 13 34.906 0.3 . 1 . . . . . 84 ARG CB . 27170 1 924 . 1 1 84 84 ARG CG C 13 26.467 0.3 . 1 . . . . . 84 ARG CG . 27170 1 925 . 1 1 84 84 ARG CD C 13 45.215 0.3 . 1 . . . . . 84 ARG CD . 27170 1 926 . 1 1 84 84 ARG N N 15 119.421 0.3 . 1 . . . . . 84 ARG N . 27170 1 927 . 1 1 85 85 ALA H H 1 8.148 0.020 . 1 . . . . . 85 ALA H . 27170 1 928 . 1 1 85 85 ALA HA H 1 3.075 0.020 . 1 . . . . . 85 ALA HA . 27170 1 929 . 1 1 85 85 ALA HB1 H 1 1.202 0.020 . 1 . . . . . 85 ALA HB . 27170 1 930 . 1 1 85 85 ALA HB2 H 1 1.202 0.020 . 1 . . . . . 85 ALA HB . 27170 1 931 . 1 1 85 85 ALA HB3 H 1 1.202 0.020 . 1 . . . . . 85 ALA HB . 27170 1 932 . 1 1 85 85 ALA C C 13 177.108 0.3 . 1 . . . . . 85 ALA C . 27170 1 933 . 1 1 85 85 ALA CA C 13 52.206 0.3 . 1 . . . . . 85 ALA CA . 27170 1 934 . 1 1 85 85 ALA CB C 13 17.215 0.3 . 1 . . . . . 85 ALA CB . 27170 1 935 . 1 1 85 85 ALA N N 15 127.361 0.3 . 1 . . . . . 85 ALA N . 27170 1 936 . 1 1 86 86 VAL H H 1 7.963 0.020 . 1 . . . . . 86 VAL H . 27170 1 937 . 1 1 86 86 VAL HA H 1 3.565 0.020 . 1 . . . . . 86 VAL HA . 27170 1 938 . 1 1 86 86 VAL HB H 1 2.830 0.020 . 1 . . . . . 86 VAL HB . 27170 1 939 . 1 1 86 86 VAL HG11 H 1 0.802 0.020 . 1 . . . . . 86 VAL HG1 . 27170 1 940 . 1 1 86 86 VAL HG12 H 1 0.802 0.020 . 1 . . . . . 86 VAL HG1 . 27170 1 941 . 1 1 86 86 VAL HG13 H 1 0.802 0.020 . 1 . . . . . 86 VAL HG1 . 27170 1 942 . 1 1 86 86 VAL HG21 H 1 0.773 0.020 . 1 . . . . . 86 VAL HG2 . 27170 1 943 . 1 1 86 86 VAL HG22 H 1 0.773 0.020 . 1 . . . . . 86 VAL HG2 . 27170 1 944 . 1 1 86 86 VAL HG23 H 1 0.773 0.020 . 1 . . . . . 86 VAL HG2 . 27170 1 945 . 1 1 86 86 VAL C C 13 174.782 0.3 . 1 . . . . . 86 VAL C . 27170 1 946 . 1 1 86 86 VAL CA C 13 62.449 0.3 . 1 . . . . . 86 VAL CA . 27170 1 947 . 1 1 86 86 VAL CB C 13 32.614 0.3 . 1 . . . . . 86 VAL CB . 27170 1 948 . 1 1 86 86 VAL CG1 C 13 22.464 0.3 . 1 . . . . . 86 VAL CG1 . 27170 1 949 . 1 1 86 86 VAL CG2 C 13 22.228 0.3 . 1 . . . . . 86 VAL CG2 . 27170 1 950 . 1 1 86 86 VAL N N 15 123.003 0.3 . 1 . . . . . 86 VAL N . 27170 1 951 . 1 1 87 87 HIS H H 1 8.420 0.020 . 1 . . . . . 87 HIS H . 27170 1 952 . 1 1 87 87 HIS HA H 1 4.483 0.020 . 1 . . . . . 87 HIS HA . 27170 1 953 . 1 1 87 87 HIS HB2 H 1 2.857 0.020 . 1 . . . . . 87 HIS HB2 . 27170 1 954 . 1 1 87 87 HIS HB3 H 1 2.800 0.020 . 1 . . . . . 87 HIS HB3 . 27170 1 955 . 1 1 87 87 HIS HD2 H 1 6.834 0.020 . 1 . . . . . 87 HIS HD2 . 27170 1 956 . 1 1 87 87 HIS HE1 H 1 8.264 0.020 . 1 . . . . . 87 HIS HE1 . 27170 1 957 . 1 1 87 87 HIS C C 13 173.703 0.3 . 1 . . . . . 87 HIS C . 27170 1 958 . 1 1 87 87 HIS CA C 13 57.061 0.3 . 1 . . . . . 87 HIS CA . 27170 1 959 . 1 1 87 87 HIS CB C 13 31.022 0.3 . 1 . . . . . 87 HIS CB . 27170 1 960 . 1 1 87 87 HIS N N 15 126.189 0.3 . 1 . . . . . 87 HIS N . 27170 1 961 . 1 1 88 88 LEU H H 1 8.420 0.020 . 1 . . . . . 88 LEU H . 27170 1 962 . 1 1 88 88 LEU HA H 1 4.449 0.020 . 1 . . . . . 88 LEU HA . 27170 1 963 . 1 1 88 88 LEU HB2 H 1 1.603 0.020 . 1 . . . . . 88 LEU HB2 . 27170 1 964 . 1 1 88 88 LEU HB3 H 1 1.474 0.020 . 1 . . . . . 88 LEU HB3 . 27170 1 965 . 1 1 88 88 LEU HG H 1 1.590 0.020 . 1 . . . . . 88 LEU HG . 27170 1 966 . 1 1 88 88 LEU HD11 H 1 0.793 0.020 . 1 . . . . . 88 LEU HD1 . 27170 1 967 . 1 1 88 88 LEU HD12 H 1 0.793 0.020 . 1 . . . . . 88 LEU HD1 . 27170 1 968 . 1 1 88 88 LEU HD13 H 1 0.793 0.020 . 1 . . . . . 88 LEU HD1 . 27170 1 969 . 1 1 88 88 LEU HD21 H 1 0.734 0.020 . 1 . . . . . 88 LEU HD2 . 27170 1 970 . 1 1 88 88 LEU HD22 H 1 0.734 0.020 . 1 . . . . . 88 LEU HD2 . 27170 1 971 . 1 1 88 88 LEU HD23 H 1 0.734 0.020 . 1 . . . . . 88 LEU HD2 . 27170 1 972 . 1 1 88 88 LEU CA C 13 52.912 0.3 . 1 . . . . . 88 LEU CA . 27170 1 973 . 1 1 88 88 LEU CB C 13 41.790 0.3 . 1 . . . . . 88 LEU CB . 27170 1 974 . 1 1 88 88 LEU N N 15 126.394 0.3 . 1 . . . . . 88 LEU N . 27170 1 975 . 1 1 89 89 PRO HA H 1 4.642 0.020 . 1 . . . . . 89 PRO HA . 27170 1 976 . 1 1 89 89 PRO HB2 H 1 2.475 0.020 . 1 . . . . . 89 PRO HB2 . 27170 1 977 . 1 1 89 89 PRO HB3 H 1 2.414 0.020 . 1 . . . . . 89 PRO HB3 . 27170 1 978 . 1 1 89 89 PRO HG2 H 1 1.373 0.020 . 1 . . . . . 89 PRO HG2 . 27170 1 979 . 1 1 89 89 PRO HG3 H 1 1.324 0.020 . 1 . . . . . 89 PRO HG3 . 27170 1 980 . 1 1 89 89 PRO HD2 H 1 4.153 0.020 . 1 . . . . . 89 PRO HD2 . 27170 1 981 . 1 1 89 89 PRO HD3 H 1 4.104 0.020 . 1 . . . . . 89 PRO HD3 . 27170 1 982 . 1 1 89 89 PRO C C 13 176.400 0.3 . 1 . . . . . 89 PRO C . 27170 1 983 . 1 1 89 89 PRO CA C 13 62.269 0.3 . 1 . . . . . 89 PRO CA . 27170 1 984 . 1 1 89 89 PRO CB C 13 34.464 0.3 . 1 . . . . . 89 PRO CB . 27170 1 985 . 1 1 89 89 PRO CG C 13 28.540 0.3 . 1 . . . . . 89 PRO CG . 27170 1 986 . 1 1 89 89 PRO CD C 13 51.998 0.3 . 1 . . . . . 89 PRO CD . 27170 1 987 . 1 1 90 90 SER H H 1 7.575 0.020 . 1 . . . . . 90 SER H . 27170 1 988 . 1 1 90 90 SER HA H 1 4.814 0.020 . 1 . . . . . 90 SER HA . 27170 1 989 . 1 1 90 90 SER HB2 H 1 3.700 0.020 . 1 . . . . . 90 SER HB2 . 27170 1 990 . 1 1 90 90 SER HB3 H 1 3.626 0.020 . 1 . . . . . 90 SER HB3 . 27170 1 991 . 1 1 90 90 SER C C 13 174.681 0.3 . 1 . . . . . 90 SER C . 27170 1 992 . 1 1 90 90 SER CA C 13 56.178 0.3 . 1 . . . . . 90 SER CA . 27170 1 993 . 1 1 90 90 SER CB C 13 65.799 0.3 . 1 . . . . . 90 SER CB . 27170 1 994 . 1 1 90 90 SER N N 15 114.246 0.3 . 1 . . . . . 90 SER N . 27170 1 995 . 1 1 91 91 GLY H H 1 8.235 0.020 . 1 . . . . . 91 GLY H . 27170 1 996 . 1 1 91 91 GLY HA2 H 1 4.030 0.020 . 1 . . . . . 91 GLY HA2 . 27170 1 997 . 1 1 91 91 GLY HA3 H 1 3.834 0.020 . 1 . . . . . 91 GLY HA3 . 27170 1 998 . 1 1 91 91 GLY C C 13 175.759 0.3 . 1 . . . . . 91 GLY C . 27170 1 999 . 1 1 91 91 GLY CA C 13 44.795 0.3 . 1 . . . . . 91 GLY CA . 27170 1 1000 . 1 1 91 91 GLY N N 15 105.696 0.3 . 1 . . . . . 91 GLY N . 27170 1 1001 . 1 1 92 92 GLY H H 1 7.904 0.020 . 1 . . . . . 92 GLY H . 27170 1 1002 . 1 1 92 92 GLY HA2 H 1 3.871 0.020 . 1 . . . . . 92 GLY HA2 . 27170 1 1003 . 1 1 92 92 GLY HA3 H 1 3.798 0.020 . 1 . . . . . 92 GLY HA3 . 27170 1 1004 . 1 1 92 92 GLY C C 13 173.602 0.3 . 1 . . . . . 92 GLY C . 27170 1 1005 . 1 1 92 92 GLY CA C 13 46.734 0.3 . 1 . . . . . 92 GLY CA . 27170 1 1006 . 1 1 92 92 GLY N N 15 107.075 0.3 . 1 . . . . . 92 GLY N . 27170 1 1007 . 1 1 93 93 GLN H H 1 7.806 0.020 . 1 . . . . . 93 GLN H . 27170 1 1008 . 1 1 93 93 GLN HA H 1 4.630 0.020 . 1 . . . . . 93 GLN HA . 27170 1 1009 . 1 1 93 93 GLN HB2 H 1 1.833 0.020 . 1 . . . . . 93 GLN HB2 . 27170 1 1010 . 1 1 93 93 GLN HB3 H 1 1.712 0.020 . 1 . . . . . 93 GLN HB3 . 27170 1 1011 . 1 1 93 93 GLN HG2 H 1 2.276 0.020 . 1 . . . . . 93 GLN HG2 . 27170 1 1012 . 1 1 93 93 GLN HG3 H 1 2.250 0.020 . 1 . . . . . 93 GLN HG3 . 27170 1 1013 . 1 1 93 93 GLN HE21 H 1 7.558 0.020 . 1 . . . . . 93 GLN HE21 . 27170 1 1014 . 1 1 93 93 GLN HE22 H 1 6.819 0.020 . 1 . . . . . 93 GLN HE22 . 27170 1 1015 . 1 1 93 93 GLN C C 13 174.478 0.3 . 1 . . . . . 93 GLN C . 27170 1 1016 . 1 1 93 93 GLN CA C 13 55.737 0.3 . 1 . . . . . 93 GLN CA . 27170 1 1017 . 1 1 93 93 GLN CB C 13 30.757 0.3 . 1 . . . . . 93 GLN CB . 27170 1 1018 . 1 1 93 93 GLN CG C 13 37.207 0.3 . 1 . . . . . 93 GLN CG . 27170 1 1019 . 1 1 93 93 GLN N N 15 118.332 0.3 . 1 . . . . . 93 GLN N . 27170 1 1020 . 1 1 93 93 GLN NE2 N 15 112.955 0.3 . 1 . . . . . 93 GLN NE2 . 27170 1 1021 . 1 1 94 94 TYR H H 1 8.198 0.020 . 1 . . . . . 94 TYR H . 27170 1 1022 . 1 1 94 94 TYR HA H 1 4.705 0.020 . 1 . . . . . 94 TYR HA . 27170 1 1023 . 1 1 94 94 TYR HB2 H 1 3.241 0.020 . 1 . . . . . 94 TYR HB2 . 27170 1 1024 . 1 1 94 94 TYR HB3 H 1 3.156 0.020 . 1 . . . . . 94 TYR HB3 . 27170 1 1025 . 1 1 94 94 TYR HD1 H 1 6.767 0.020 . 1 . . . . . 94 TYR HD1 . 27170 1 1026 . 1 1 94 94 TYR HE1 H 1 6.881 0.020 . 1 . . . . . 94 TYR HE1 . 27170 1 1027 . 1 1 94 94 TYR CA C 13 56.443 0.3 . 1 . . . . . 94 TYR CA . 27170 1 1028 . 1 1 94 94 TYR CB C 13 41.702 0.3 . 1 . . . . . 94 TYR CB . 27170 1 1029 . 1 1 94 94 TYR N N 15 118.567 0.3 . 1 . . . . . 94 TYR N . 27170 1 1030 . 1 1 95 95 LYS HA H 1 4.936 0.020 . 1 . . . . . 95 LYS HA . 27170 1 1031 . 1 1 95 95 LYS HB2 H 1 1.981 0.020 . 1 . . . . . 95 LYS HB2 . 27170 1 1032 . 1 1 95 95 LYS HB3 H 1 1.463 0.020 . 1 . . . . . 95 LYS HB3 . 27170 1 1033 . 1 1 95 95 LYS HG2 H 1 1.340 0.020 . 1 . . . . . 95 LYS HG2 . 27170 1 1034 . 1 1 95 95 LYS HG3 H 1 1.306 0.020 . 1 . . . . . 95 LYS HG3 . 27170 1 1035 . 1 1 95 95 LYS HD2 H 1 1.510 0.020 . 1 . . . . . 95 LYS HD2 . 27170 1 1036 . 1 1 95 95 LYS HD3 H 1 1.463 0.020 . 1 . . . . . 95 LYS HD3 . 27170 1 1037 . 1 1 95 95 LYS HE2 H 1 2.928 0.020 . 1 . . . . . 95 LYS HE2 . 27170 1 1038 . 1 1 95 95 LYS C C 13 173.063 0.3 . 1 . . . . . 95 LYS C . 27170 1 1039 . 1 1 95 95 LYS CA C 13 58.826 0.3 . 1 . . . . . 95 LYS CA . 27170 1 1040 . 1 1 95 95 LYS CB C 13 35.700 0.3 . 1 . . . . . 95 LYS CB . 27170 1 1041 . 1 1 95 95 LYS CG C 13 23.829 0.3 . 1 . . . . . 95 LYS CG . 27170 1 1042 . 1 1 95 95 LYS CD C 13 30.235 0.3 . 1 . . . . . 95 LYS CD . 27170 1 1043 . 1 1 95 95 LYS CE C 13 41.164 0.3 . 1 . . . . . 95 LYS CE . 27170 1 1044 . 1 1 96 96 ILE H H 1 8.954 0.020 . 1 . . . . . 96 ILE H . 27170 1 1045 . 1 1 96 96 ILE HA H 1 3.638 0.020 . 1 . . . . . 96 ILE HA . 27170 1 1046 . 1 1 96 96 ILE HB H 1 1.165 0.020 . 1 . . . . . 96 ILE HB . 27170 1 1047 . 1 1 96 96 ILE HG12 H 1 1.390 0.020 . 1 . . . . . 96 ILE HG12 . 27170 1 1048 . 1 1 96 96 ILE HG13 H 1 1.205 0.020 . 1 . . . . . 96 ILE HG13 . 27170 1 1049 . 1 1 96 96 ILE HG21 H 1 1.089 0.020 . 1 . . . . . 96 ILE HG2 . 27170 1 1050 . 1 1 96 96 ILE HG22 H 1 1.089 0.020 . 1 . . . . . 96 ILE HG2 . 27170 1 1051 . 1 1 96 96 ILE HG23 H 1 1.089 0.020 . 1 . . . . . 96 ILE HG2 . 27170 1 1052 . 1 1 96 96 ILE HD11 H 1 0.710 0.020 . 1 . . . . . 96 ILE HD1 . 27170 1 1053 . 1 1 96 96 ILE HD12 H 1 0.710 0.020 . 1 . . . . . 96 ILE HD1 . 27170 1 1054 . 1 1 96 96 ILE HD13 H 1 0.710 0.020 . 1 . . . . . 96 ILE HD1 . 27170 1 1055 . 1 1 96 96 ILE C C 13 176.366 0.3 . 1 . . . . . 96 ILE C . 27170 1 1056 . 1 1 96 96 ILE CA C 13 59.974 0.3 . 1 . . . . . 96 ILE CA . 27170 1 1057 . 1 1 96 96 ILE CB C 13 43.556 0.3 . 1 . . . . . 96 ILE CB . 27170 1 1058 . 1 1 96 96 ILE CG1 C 13 27.786 0.3 . 1 . . . . . 96 ILE CG1 . 27170 1 1059 . 1 1 96 96 ILE CG2 C 13 17.235 0.3 . 1 . . . . . 96 ILE CG2 . 27170 1 1060 . 1 1 96 96 ILE CD1 C 13 14.503 0.3 . 1 . . . . . 96 ILE CD1 . 27170 1 1061 . 1 1 96 96 ILE N N 15 128.714 0.3 . 1 . . . . . 96 ILE N . 27170 1 1062 . 1 1 97 97 GLN H H 1 7.625 0.020 . 1 . . . . . 97 GLN H . 27170 1 1063 . 1 1 97 97 GLN HA H 1 5.21 0.020 . 1 . . . . . 97 GLN HA . 27170 1 1064 . 1 1 97 97 GLN HB2 H 1 2.438 0.020 . 1 . . . . . 97 GLN HB2 . 27170 1 1065 . 1 1 97 97 GLN HB3 H 1 1.741 0.020 . 1 . . . . . 97 GLN HB3 . 27170 1 1066 . 1 1 97 97 GLN HG2 H 1 2.683 0.020 . 1 . . . . . 97 GLN HG2 . 27170 1 1067 . 1 1 97 97 GLN HG3 H 1 2.536 0.020 . 1 . . . . . 97 GLN HG3 . 27170 1 1068 . 1 1 97 97 GLN HE21 H 1 7.883 0.020 . 1 . . . . . 97 GLN HE21 . 27170 1 1069 . 1 1 97 97 GLN HE22 H 1 6.289 0.020 . 1 . . . . . 97 GLN HE22 . 27170 1 1070 . 1 1 97 97 GLN C C 13 177.950 0.3 . 1 . . . . . 97 GLN C . 27170 1 1071 . 1 1 97 97 GLN CA C 13 53.089 0.3 . 1 . . . . . 97 GLN CA . 27170 1 1072 . 1 1 97 97 GLN CB C 13 32.31 0.3 . 1 . . . . . 97 GLN CB . 27170 1 1073 . 1 1 97 97 GLN CG C 13 33.93 0.3 . 1 . . . . . 97 GLN CG . 27170 1 1074 . 1 1 97 97 GLN N N 15 114.349 0.3 . 1 . . . . . 97 GLN N . 27170 1 1075 . 1 1 97 97 GLN NE2 N 15 109.266 0.3 . 1 . . . . . 97 GLN NE2 . 27170 1 1076 . 1 1 98 98 ILE H H 1 6.987 0.020 . 1 . . . . . 98 ILE H . 27170 1 1077 . 1 1 98 98 ILE HA H 1 4.667 0.020 . 1 . . . . . 98 ILE HA . 27170 1 1078 . 1 1 98 98 ILE HB H 1 1.618 0.020 . 1 . . . . . 98 ILE HB . 27170 1 1079 . 1 1 98 98 ILE HG12 H 1 1.496 0.020 . 1 . . . . . 98 ILE HG12 . 27170 1 1080 . 1 1 98 98 ILE HG13 H 1 1.288 0.020 . 1 . . . . . 98 ILE HG13 . 27170 1 1081 . 1 1 98 98 ILE HG21 H 1 0.940 0.020 . 1 . . . . . 98 ILE HG2 . 27170 1 1082 . 1 1 98 98 ILE HG22 H 1 0.940 0.020 . 1 . . . . . 98 ILE HG2 . 27170 1 1083 . 1 1 98 98 ILE HG23 H 1 0.940 0.020 . 1 . . . . . 98 ILE HG2 . 27170 1 1084 . 1 1 98 98 ILE HD11 H 1 0.884 0.020 . 1 . . . . . 98 ILE HD1 . 27170 1 1085 . 1 1 98 98 ILE HD12 H 1 0.884 0.020 . 1 . . . . . 98 ILE HD1 . 27170 1 1086 . 1 1 98 98 ILE HD13 H 1 0.884 0.020 . 1 . . . . . 98 ILE HD1 . 27170 1 1087 . 1 1 98 98 ILE C C 13 173.433 0.3 . 1 . . . . . 98 ILE C . 27170 1 1088 . 1 1 98 98 ILE CA C 13 61.651 0.3 . 1 . . . . . 98 ILE CA . 27170 1 1089 . 1 1 98 98 ILE CB C 13 38.172 0.3 . 1 . . . . . 98 ILE CB . 27170 1 1090 . 1 1 98 98 ILE CG1 C 13 25.996 0.3 . 1 . . . . . 98 ILE CG1 . 27170 1 1091 . 1 1 98 98 ILE CG2 C 13 18.648 0.3 . 1 . . . . . 98 ILE CG2 . 27170 1 1092 . 1 1 98 98 ILE CD1 C 13 13.937 0.3 . 1 . . . . . 98 ILE CD1 . 27170 1 1093 . 1 1 98 98 ILE N N 15 114.259 0.3 . 1 . . . . . 98 ILE N . 27170 1 1094 . 1 1 99 99 PHE H H 1 7.980 0.020 . 1 . . . . . 99 PHE H . 27170 1 1095 . 1 1 99 99 PHE HA H 1 5.401 0.020 . 1 . . . . . 99 PHE HA . 27170 1 1096 . 1 1 99 99 PHE HB2 H 1 3.345 0.020 . 1 . . . . . 99 PHE HB2 . 27170 1 1097 . 1 1 99 99 PHE HB3 H 1 3.234 0.020 . 1 . . . . . 99 PHE HB3 . 27170 1 1098 . 1 1 99 99 PHE HD1 H 1 6.819 0.020 . 1 . . . . . 99 PHE HD1 . 27170 1 1099 . 1 1 99 99 PHE HE1 H 1 7.206 0.020 . 1 . . . . . 99 PHE HE1 . 27170 1 1100 . 1 1 99 99 PHE HZ H 1 7.095 0.020 . 1 . . . . . 99 PHE HZ . 27170 1 1101 . 1 1 99 99 PHE C C 13 176.501 0.3 . 1 . . . . . 99 PHE C . 27170 1 1102 . 1 1 99 99 PHE CA C 13 57.502 0.3 . 1 . . . . . 99 PHE CA . 27170 1 1103 . 1 1 99 99 PHE CB C 13 41.967 0.3 . 1 . . . . . 99 PHE CB . 27170 1 1104 . 1 1 99 99 PHE N N 15 117.250 0.3 . 1 . . . . . 99 PHE N . 27170 1 1105 . 1 1 100 100 GLU H H 1 8.702 0.020 . 1 . . . . . 100 GLU H . 27170 1 1106 . 1 1 100 100 GLU HA H 1 4.263 0.020 . 1 . . . . . 100 GLU HA . 27170 1 1107 . 1 1 100 100 GLU HB2 H 1 2.221 0.020 . 1 . . . . . 100 GLU HB2 . 27170 1 1108 . 1 1 100 100 GLU HB3 H 1 2.192 0.020 . 1 . . . . . 100 GLU HB3 . 27170 1 1109 . 1 1 100 100 GLU HG2 H 1 2.368 0.020 . 1 . . . . . 100 GLU HG2 . 27170 1 1110 . 1 1 100 100 GLU HG3 H 1 2.336 0.020 . 1 . . . . . 100 GLU HG3 . 27170 1 1111 . 1 1 100 100 GLU C C 13 175.995 0.3 . 1 . . . . . 100 GLU C . 27170 1 1112 . 1 1 100 100 GLU CA C 13 58.300 0.3 . 1 . . . . . 100 GLU CA . 27170 1 1113 . 1 1 100 100 GLU CB C 13 33.761 0.3 . 1 . . . . . 100 GLU CB . 27170 1 1114 . 1 1 100 100 GLU CG C 13 36.076 0.3 . 1 . . . . . 100 GLU CG . 27170 1 1115 . 1 1 100 100 GLU N N 15 120.502 0.3 . 1 . . . . . 100 GLU N . 27170 1 1116 . 1 1 101 101 LYS H H 1 7.743 0.020 . 1 . . . . . 101 LYS H . 27170 1 1117 . 1 1 101 101 LYS HA H 1 4.422 0.020 . 1 . . . . . 101 LYS HA . 27170 1 1118 . 1 1 101 101 LYS HB2 H 1 1.692 0.020 . 1 . . . . . 101 LYS HB2 . 27170 1 1119 . 1 1 101 101 LYS HB3 H 1 1.643 0.020 . 1 . . . . . 101 LYS HB3 . 27170 1 1120 . 1 1 101 101 LYS HG2 H 1 1.361 0.020 . 1 . . . . . 101 LYS HG2 . 27170 1 1121 . 1 1 101 101 LYS HG3 H 1 1.300 0.020 . 1 . . . . . 101 LYS HG3 . 27170 1 1122 . 1 1 101 101 LYS HD2 H 1 1.422 0.020 . 1 . . . . . 101 LYS HD2 . 27170 1 1123 . 1 1 101 101 LYS HD3 H 1 1.394 0.020 . 1 . . . . . 101 LYS HD3 . 27170 1 1124 . 1 1 101 101 LYS HE2 H 1 3.345 0.020 . 1 . . . . . 101 LYS HE2 . 27170 1 1125 . 1 1 101 101 LYS HE3 H 1 3.234 0.020 . 1 . . . . . 101 LYS HE3 . 27170 1 1126 . 1 1 101 101 LYS C C 13 176.332 0.3 . 1 . . . . . 101 LYS C . 27170 1 1127 . 1 1 101 101 LYS CA C 13 54.593 0.3 . 1 . . . . . 101 LYS CA . 27170 1 1128 . 1 1 101 101 LYS CB C 13 36.763 0.3 . 1 . . . . . 101 LYS CB . 27170 1 1129 . 1 1 101 101 LYS CG C 13 26.184 0.3 . 1 . . . . . 101 LYS CG . 27170 1 1130 . 1 1 101 101 LYS CD C 13 31.743 0.3 . 1 . . . . . 101 LYS CD . 27170 1 1131 . 1 1 101 101 LYS N N 15 112.531 0.3 . 1 . . . . . 101 LYS N . 27170 1 1132 . 1 1 102 102 GLY H H 1 8.500 0.020 . 1 . . . . . 102 GLY H . 27170 1 1133 . 1 1 102 102 GLY HA2 H 1 4.395 0.020 . 1 . . . . . 102 GLY HA2 . 27170 1 1134 . 1 1 102 102 GLY HA3 H 1 3.710 0.020 . 1 . . . . . 102 GLY HA3 . 27170 1 1135 . 1 1 102 102 GLY CA C 13 45.586 0.3 . 1 . . . . . 102 GLY CA . 27170 1 1136 . 1 1 102 102 GLY N N 15 106.484 0.3 . 1 . . . . . 102 GLY N . 27170 1 1137 . 1 1 103 103 ASP HA H 1 3.063 0.020 . 1 . . . . . 103 ASP HA . 27170 1 1138 . 1 1 103 103 ASP HB2 H 1 2.622 0.020 . 1 . . . . . 103 ASP HB2 . 27170 1 1139 . 1 1 103 103 ASP HB3 H 1 2.475 0.020 . 1 . . . . . 103 ASP HB3 . 27170 1 1140 . 1 1 103 103 ASP C C 13 173.467 0.3 . 1 . . . . . 103 ASP C . 27170 1 1141 . 1 1 103 103 ASP CA C 13 55.649 0.3 . 1 . . . . . 103 ASP CA . 27170 1 1142 . 1 1 103 103 ASP CB C 13 36.759 0.3 . 1 . . . . . 103 ASP CB . 27170 1 1143 . 1 1 104 104 PHE H H 1 7.762 0.020 . 1 . . . . . 104 PHE H . 27170 1 1144 . 1 1 104 104 PHE HA H 1 4.055 0.020 . 1 . . . . . 104 PHE HA . 27170 1 1145 . 1 1 104 104 PHE HB2 H 1 2.708 0.020 . 1 . . . . . 104 PHE HB2 . 27170 1 1146 . 1 1 104 104 PHE HB3 H 1 2.255 0.020 . 1 . . . . . 104 PHE HB3 . 27170 1 1147 . 1 1 104 104 PHE HD1 H 1 6.591 0.020 . 1 . . . . . 104 PHE HD1 . 27170 1 1148 . 1 1 104 104 PHE HE1 H 1 6.836 0.020 . 1 . . . . . 104 PHE HE1 . 27170 1 1149 . 1 1 104 104 PHE HZ H 1 6.725 0.020 . 1 . . . . . 104 PHE HZ . 27170 1 1150 . 1 1 104 104 PHE C C 13 175.422 0.3 . 1 . . . . . 104 PHE C . 27170 1 1151 . 1 1 104 104 PHE CA C 13 54.678 0.3 . 1 . . . . . 104 PHE CA . 27170 1 1152 . 1 1 104 104 PHE CB C 13 34.288 0.3 . 1 . . . . . 104 PHE CB . 27170 1 1153 . 1 1 104 104 PHE N N 15 111.950 0.3 . 1 . . . . . 104 PHE N . 27170 1 1154 . 1 1 105 105 SER H H 1 6.400 0.020 . 1 . . . . . 105 SER H . 27170 1 1155 . 1 1 105 105 SER HA H 1 4.814 0.020 . 1 . . . . . 105 SER HA . 27170 1 1156 . 1 1 105 105 SER HB2 H 1 3.700 0.020 . 1 . . . . . 105 SER HB2 . 27170 1 1157 . 1 1 105 105 SER HB3 H 1 3.638 0.020 . 1 . . . . . 105 SER HB3 . 27170 1 1158 . 1 1 105 105 SER C C 13 173.063 0.3 . 1 . . . . . 105 SER C . 27170 1 1159 . 1 1 105 105 SER CA C 13 57.767 0.3 . 1 . . . . . 105 SER CA . 27170 1 1160 . 1 1 105 105 SER CB C 13 66.417 0.3 . 1 . . . . . 105 SER CB . 27170 1 1161 . 1 1 105 105 SER N N 15 113.495 0.3 . 1 . . . . . 105 SER N . 27170 1 1162 . 1 1 106 106 GLY H H 1 8.235 0.020 . 1 . . . . . 106 GLY H . 27170 1 1163 . 1 1 106 106 GLY HA2 H 1 4.397 0.020 . 1 . . . . . 106 GLY HA2 . 27170 1 1164 . 1 1 106 106 GLY HA3 H 1 3.773 0.020 . 1 . . . . . 106 GLY HA3 . 27170 1 1165 . 1 1 106 106 GLY C C 13 174.782 0.3 . 1 . . . . . 106 GLY C . 27170 1 1166 . 1 1 106 106 GLY CA C 13 44.792 0.3 . 1 . . . . . 106 GLY CA . 27170 1 1167 . 1 1 106 106 GLY N N 15 105.877 0.3 . 1 . . . . . 106 GLY N . 27170 1 1168 . 1 1 107 107 GLN H H 1 8.453 0.020 . 1 . . . . . 107 GLN H . 27170 1 1169 . 1 1 107 107 GLN HA H 1 3.773 0.020 . 1 . . . . . 107 GLN HA . 27170 1 1170 . 1 1 107 107 GLN HB2 H 1 1.790 0.020 . 1 . . . . . 107 GLN HB2 . 27170 1 1171 . 1 1 107 107 GLN HB3 H 1 1.728 0.020 . 1 . . . . . 107 GLN HB3 . 27170 1 1172 . 1 1 107 107 GLN HG2 H 1 1.998 0.020 . 1 . . . . . 107 GLN HG2 . 27170 1 1173 . 1 1 107 107 GLN HG3 H 1 1.912 0.020 . 1 . . . . . 107 GLN HG3 . 27170 1 1174 . 1 1 107 107 GLN HE21 H 1 6.870 0.020 . 1 . . . . . 107 GLN HE21 . 27170 1 1175 . 1 1 107 107 GLN HE22 H 1 6.806 0.020 . 1 . . . . . 107 GLN HE22 . 27170 1 1176 . 1 1 107 107 GLN C C 13 173.669 0.3 . 1 . . . . . 107 GLN C . 27170 1 1177 . 1 1 107 107 GLN CA C 13 58.915 0.3 . 1 . . . . . 107 GLN CA . 27170 1 1178 . 1 1 107 107 GLN CB C 13 31.728 0.3 . 1 . . . . . 107 GLN CB . 27170 1 1179 . 1 1 107 107 GLN CG C 13 30.424 0.3 . 1 . . . . . 107 GLN CG . 27170 1 1180 . 1 1 107 107 GLN N N 15 119.580 0.3 . 1 . . . . . 107 GLN N . 27170 1 1181 . 1 1 107 107 GLN NE2 N 15 114.106 0.3 . 1 . . . . . 107 GLN NE2 . 27170 1 1182 . 1 1 108 108 MET H H 1 7.585 0.020 . 1 . . . . . 108 MET H . 27170 1 1183 . 1 1 108 108 MET HA H 1 4.850 0.020 . 1 . . . . . 108 MET HA . 27170 1 1184 . 1 1 108 108 MET HB2 H 1 1.532 0.020 . 1 . . . . . 108 MET HB2 . 27170 1 1185 . 1 1 108 108 MET HB3 H 1 1.471 0.020 . 1 . . . . . 108 MET HB3 . 27170 1 1186 . 1 1 108 108 MET HG2 H 1 1.398 0.020 . 1 . . . . . 108 MET HG2 . 27170 1 1187 . 1 1 108 108 MET HG3 H 1 1.337 0.020 . 1 . . . . . 108 MET HG3 . 27170 1 1188 . 1 1 108 108 MET C C 13 174.950 0.3 . 1 . . . . . 108 MET C . 27170 1 1189 . 1 1 108 108 MET CA C 13 53.618 0.3 . 1 . . . . . 108 MET CA . 27170 1 1190 . 1 1 108 108 MET CB C 13 35.965 0.3 . 1 . . . . . 108 MET CB . 27170 1 1191 . 1 1 108 108 MET CG C 13 31.822 0.3 . 1 . . . . . 108 MET CG . 27170 1 1192 . 1 1 108 108 MET CE C 13 17.175 0.3 . 1 . . . . . 108 MET CE . 27170 1 1193 . 1 1 108 108 MET N N 15 124.178 0.3 . 1 . . . . . 108 MET N . 27170 1 1194 . 1 1 109 109 TYR H H 1 8.146 0.020 . 1 . . . . . 109 TYR H . 27170 1 1195 . 1 1 109 109 TYR HA H 1 4.850 0.020 . 1 . . . . . 109 TYR HA . 27170 1 1196 . 1 1 109 109 TYR HB2 H 1 2.879 0.020 . 1 . . . . . 109 TYR HB2 . 27170 1 1197 . 1 1 109 109 TYR HB3 H 1 1.732 0.020 . 1 . . . . . 109 TYR HB3 . 27170 1 1198 . 1 1 109 109 TYR HD2 H 1 6.900 0.020 . 1 . . . . . 109 TYR HD2 . 27170 1 1199 . 1 1 109 109 TYR HE1 H 1 7.053 0.020 . 1 . . . . . 109 TYR HE1 . 27170 1 1200 . 1 1 109 109 TYR C C 13 176.400 0.3 . 1 . . . . . 109 TYR C . 27170 1 1201 . 1 1 109 109 TYR CA C 13 58.120 0.3 . 1 . . . . . 109 TYR CA . 27170 1 1202 . 1 1 109 109 TYR CB C 13 42.497 0.3 . 1 . . . . . 109 TYR CB . 27170 1 1203 . 1 1 109 109 TYR N N 15 122.198 0.3 . 1 . . . . . 109 TYR N . 27170 1 1204 . 1 1 110 110 GLU H H 1 8.500 0.020 . 1 . . . . . 110 GLU H . 27170 1 1205 . 1 1 110 110 GLU HA H 1 5.352 0.020 . 1 . . . . . 110 GLU HA . 27170 1 1206 . 1 1 110 110 GLU HB2 H 1 1.924 0.020 . 1 . . . . . 110 GLU HB2 . 27170 1 1207 . 1 1 110 110 GLU HB3 H 1 1.790 0.020 . 1 . . . . . 110 GLU HB3 . 27170 1 1208 . 1 1 110 110 GLU HG2 H 1 2.112 0.020 . 1 . . . . . 110 GLU HG2 . 27170 1 1209 . 1 1 110 110 GLU HG3 H 1 2.083 0.020 . 1 . . . . . 110 GLU HG3 . 27170 1 1210 . 1 1 110 110 GLU C C 13 175.557 0.3 . 1 . . . . . 110 GLU C . 27170 1 1211 . 1 1 110 110 GLU CA C 13 56.531 0.3 . 1 . . . . . 110 GLU CA . 27170 1 1212 . 1 1 110 110 GLU CB C 13 36.45 0.3 . 1 . . . . . 110 GLU CB . 27170 1 1213 . 1 1 110 110 GLU CG C 13 38.432 0.3 . 1 . . . . . 110 GLU CG . 27170 1 1214 . 1 1 110 110 GLU N N 15 123.819 0.3 . 1 . . . . . 110 GLU N . 27170 1 1215 . 1 1 111 111 THR H H 1 8.818 0.020 . 1 . . . . . 111 THR H . 27170 1 1216 . 1 1 111 111 THR HA H 1 5.144 0.020 . 1 . . . . . 111 THR HA . 27170 1 1217 . 1 1 111 111 THR HB H 1 4.312 0.020 . 1 . . . . . 111 THR HB . 27170 1 1218 . 1 1 111 111 THR HG21 H 1 1.386 0.020 . 1 . . . . . 111 THR HG2 . 27170 1 1219 . 1 1 111 111 THR HG22 H 1 1.386 0.020 . 1 . . . . . 111 THR HG2 . 27170 1 1220 . 1 1 111 111 THR HG23 H 1 1.386 0.020 . 1 . . . . . 111 THR HG2 . 27170 1 1221 . 1 1 111 111 THR C C 13 171.546 0.3 . 1 . . . . . 111 THR C . 27170 1 1222 . 1 1 111 111 THR CA C 13 60.503 0.3 . 1 . . . . . 111 THR CA . 27170 1 1223 . 1 1 111 111 THR CB C 13 71.537 0.3 . 1 . . . . . 111 THR CB . 27170 1 1224 . 1 1 111 111 THR CG2 C 13 20.626 0.3 . 1 . . . . . 111 THR CG2 . 27170 1 1225 . 1 1 111 111 THR N N 15 118.194 0.3 . 1 . . . . . 111 THR N . 27170 1 1226 . 1 1 112 112 THR H H 1 8.070 0.020 . 1 . . . . . 112 THR H . 27170 1 1227 . 1 1 112 112 THR HA H 1 5.279 0.020 . 1 . . . . . 112 THR HA . 27170 1 1228 . 1 1 112 112 THR HB H 1 4.471 0.020 . 1 . . . . . 112 THR HB . 27170 1 1229 . 1 1 112 112 THR HG21 H 1 1.655 0.020 . 1 . . . . . 112 THR HG2 . 27170 1 1230 . 1 1 112 112 THR HG22 H 1 1.655 0.020 . 1 . . . . . 112 THR HG2 . 27170 1 1231 . 1 1 112 112 THR HG23 H 1 1.655 0.020 . 1 . . . . . 112 THR HG2 . 27170 1 1232 . 1 1 112 112 THR C C 13 177.849 0.3 . 1 . . . . . 112 THR C . 27170 1 1233 . 1 1 112 112 THR CA C 13 61.916 0.3 . 1 . . . . . 112 THR CA . 27170 1 1234 . 1 1 112 112 THR CB C 13 71.272 0.3 . 1 . . . . . 112 THR CB . 27170 1 1235 . 1 1 112 112 THR CG2 C 13 25.148 0.3 . 1 . . . . . 112 THR CG2 . 27170 1 1236 . 1 1 112 112 THR N N 15 114.930 0.3 . 1 . . . . . 112 THR N . 27170 1 1237 . 1 1 113 113 GLU H H 1 8.244 0.020 . 1 . . . . . 113 GLU H . 27170 1 1238 . 1 1 113 113 GLU HA H 1 4.642 0.020 . 1 . . . . . 113 GLU HA . 27170 1 1239 . 1 1 113 113 GLU HB2 H 1 1.843 0.020 . 1 . . . . . 113 GLU HB2 . 27170 1 1240 . 1 1 113 113 GLU HB3 H 1 1.809 0.020 . 1 . . . . . 113 GLU HB3 . 27170 1 1241 . 1 1 113 113 GLU HG2 H 1 2.280 0.020 . 1 . . . . . 113 GLU HG2 . 27170 1 1242 . 1 1 113 113 GLU HG3 H 1 2.243 0.020 . 1 . . . . . 113 GLU HG3 . 27170 1 1243 . 1 1 113 113 GLU C C 13 175.119 0.3 . 1 . . . . . 113 GLU C . 27170 1 1244 . 1 1 113 113 GLU CA C 13 55.119 0.3 . 1 . . . . . 113 GLU CA . 27170 1 1245 . 1 1 113 113 GLU CB C 13 33.582 0.3 . 1 . . . . . 113 GLU CB . 27170 1 1246 . 1 1 113 113 GLU CG C 13 36.924 0.3 . 1 . . . . . 113 GLU CG . 27170 1 1247 . 1 1 113 113 GLU N N 15 121.430 0.3 . 1 . . . . . 113 GLU N . 27170 1 1248 . 1 1 114 114 ASP H H 1 8.200 0.020 . 1 . . . . . 114 ASP H . 27170 1 1249 . 1 1 114 114 ASP HA H 1 4.704 0.020 . 1 . . . . . 114 ASP HA . 27170 1 1250 . 1 1 114 114 ASP HB2 H 1 2.475 0.020 . 1 . . . . . 114 ASP HB2 . 27170 1 1251 . 1 1 114 114 ASP HB3 H 1 2.280 0.020 . 1 . . . . . 114 ASP HB3 . 27170 1 1252 . 1 1 114 114 ASP C C 13 176.501 0.3 . 1 . . . . . 114 ASP C . 27170 1 1253 . 1 1 114 114 ASP CA C 13 56.620 0.3 . 1 . . . . . 114 ASP CA . 27170 1 1254 . 1 1 114 114 ASP CB C 13 41.790 0.3 . 1 . . . . . 114 ASP CB . 27170 1 1255 . 1 1 114 114 ASP N N 15 118.405 0.3 . 1 . . . . . 114 ASP N . 27170 1 1256 . 1 1 115 115 CYS H H 1 8.745 0.020 . 1 . . . . . 115 CYS H . 27170 1 1257 . 1 1 115 115 CYS HA H 1 4.765 0.020 . 1 . . . . . 115 CYS HA . 27170 1 1258 . 1 1 115 115 CYS HB2 H 1 2.598 0.020 . 1 . . . . . 115 CYS HB2 . 27170 1 1259 . 1 1 115 115 CYS HB3 H 1 2.279 0.020 . 1 . . . . . 115 CYS HB3 . 27170 1 1260 . 1 1 115 115 CYS CA C 13 57.855 0.3 . 1 . . . . . 115 CYS CA . 27170 1 1261 . 1 1 115 115 CYS CB C 13 30.051 0.3 . 1 . . . . . 115 CYS CB . 27170 1 1262 . 1 1 115 115 CYS N N 15 120.606 0.3 . 1 . . . . . 115 CYS N . 27170 1 1263 . 1 1 116 116 PRO HA H 1 3.859 0.020 . 1 . . . . . 116 PRO HA . 27170 1 1264 . 1 1 116 116 PRO HB2 H 1 1.790 0.020 . 1 . . . . . 116 PRO HB2 . 27170 1 1265 . 1 1 116 116 PRO HB3 H 1 1.741 0.020 . 1 . . . . . 116 PRO HB3 . 27170 1 1266 . 1 1 116 116 PRO HG2 H 1 1.886 0.020 . 1 . . . . . 116 PRO HG2 . 27170 1 1267 . 1 1 116 116 PRO HG3 H 1 1.851 0.020 . 1 . . . . . 116 PRO HG3 . 27170 1 1268 . 1 1 116 116 PRO HD2 H 1 3.831 0.020 . 1 . . . . . 116 PRO HD2 . 27170 1 1269 . 1 1 116 116 PRO HD3 H 1 3.785 0.020 . 1 . . . . . 116 PRO HD3 . 27170 1 1270 . 1 1 116 116 PRO C C 13 175.894 0.3 . 1 . . . . . 116 PRO C . 27170 1 1271 . 1 1 116 116 PRO CA C 13 64.652 0.3 . 1 . . . . . 116 PRO CA . 27170 1 1272 . 1 1 116 116 PRO CB C 13 32.346 0.3 . 1 . . . . . 116 PRO CB . 27170 1 1273 . 1 1 116 116 PRO CG C 13 26.750 0.3 . 1 . . . . . 116 PRO CG . 27170 1 1274 . 1 1 116 116 PRO CD C 13 51.904 0.3 . 1 . . . . . 116 PRO CD . 27170 1 1275 . 1 1 117 117 SER H H 1 7.065 0.020 . 1 . . . . . 117 SER H . 27170 1 1276 . 1 1 117 117 SER HA H 1 4.826 0.020 . 1 . . . . . 117 SER HA . 27170 1 1277 . 1 1 117 117 SER HB2 H 1 3.859 0.020 . 1 . . . . . 117 SER HB2 . 27170 1 1278 . 1 1 117 117 SER HB3 H 1 3.430 0.020 . 1 . . . . . 117 SER HB3 . 27170 1 1279 . 1 1 117 117 SER C C 13 175.456 0.3 . 1 . . . . . 117 SER C . 27170 1 1280 . 1 1 117 117 SER CA C 13 57.590 0.3 . 1 . . . . . 117 SER CA . 27170 1 1281 . 1 1 117 117 SER CB C 13 63.328 0.3 . 1 . . . . . 117 SER CB . 27170 1 1282 . 1 1 117 117 SER N N 15 111.664 0.3 . 1 . . . . . 117 SER N . 27170 1 1283 . 1 1 118 118 ILE H H 1 8.578 0.020 . 1 . . . . . 118 ILE H . 27170 1 1284 . 1 1 118 118 ILE HA H 1 3.908 0.020 . 1 . . . . . 118 ILE HA . 27170 1 1285 . 1 1 118 118 ILE HB H 1 1.723 0.020 . 1 . . . . . 118 ILE HB . 27170 1 1286 . 1 1 118 118 ILE HG12 H 1 1.705 0.020 . 1 . . . . . 118 ILE HG12 . 27170 1 1287 . 1 1 118 118 ILE HG13 H 1 1.688 0.020 . 1 . . . . . 118 ILE HG13 . 27170 1 1288 . 1 1 118 118 ILE HG21 H 1 0.983 0.020 . 1 . . . . . 118 ILE HG2 . 27170 1 1289 . 1 1 118 118 ILE HG22 H 1 0.983 0.020 . 1 . . . . . 118 ILE HG2 . 27170 1 1290 . 1 1 118 118 ILE HG23 H 1 0.983 0.020 . 1 . . . . . 118 ILE HG2 . 27170 1 1291 . 1 1 118 118 ILE HD11 H 1 0.864 0.020 . 1 . . . . . 118 ILE HD1 . 27170 1 1292 . 1 1 118 118 ILE HD12 H 1 0.864 0.020 . 1 . . . . . 118 ILE HD1 . 27170 1 1293 . 1 1 118 118 ILE HD13 H 1 0.864 0.020 . 1 . . . . . 118 ILE HD1 . 27170 1 1294 . 1 1 118 118 ILE C C 13 178.861 0.3 . 1 . . . . . 118 ILE C . 27170 1 1295 . 1 1 118 118 ILE CA C 13 65.623 0.3 . 1 . . . . . 118 ILE CA . 27170 1 1296 . 1 1 118 118 ILE CB C 13 39.054 0.3 . 1 . . . . . 118 ILE CB . 27170 1 1297 . 1 1 118 118 ILE CG1 C 13 28.634 0.3 . 1 . . . . . 118 ILE CG1 . 27170 1 1298 . 1 1 118 118 ILE CG2 C 13 18.721 0.3 . 1 . . . . . 118 ILE CG2 . 27170 1 1299 . 1 1 118 118 ILE CD1 C 13 15.821 0.3 . 1 . . . . . 118 ILE CD1 . 27170 1 1300 . 1 1 118 118 ILE N N 15 131.563 0.3 . 1 . . . . . 118 ILE N . 27170 1 1301 . 1 1 119 119 MET H H 1 8.818 0.020 . 1 . . . . . 119 MET H . 27170 1 1302 . 1 1 119 119 MET HA H 1 4.202 0.020 . 1 . . . . . 119 MET HA . 27170 1 1303 . 1 1 119 119 MET HB2 H 1 2.022 0.020 . 1 . . . . . 119 MET HB2 . 27170 1 1304 . 1 1 119 119 MET HB3 H 1 1.814 0.020 . 1 . . . . . 119 MET HB3 . 27170 1 1305 . 1 1 119 119 MET HG2 H 1 2.598 0.020 . 1 . . . . . 119 MET HG2 . 27170 1 1306 . 1 1 119 119 MET HG3 H 1 2.536 0.020 . 1 . . . . . 119 MET HG3 . 27170 1 1307 . 1 1 119 119 MET C C 13 178.861 0.3 . 1 . . . . . 119 MET C . 27170 1 1308 . 1 1 119 119 MET CA C 13 59.268 0.3 . 1 . . . . . 119 MET CA . 27170 1 1309 . 1 1 119 119 MET CB C 13 32.081 0.3 . 1 . . . . . 119 MET CB . 27170 1 1310 . 1 1 119 119 MET CG C 13 33.533 0.3 . 1 . . . . . 119 MET CG . 27170 1 1311 . 1 1 119 119 MET N N 15 123.563 0.3 . 1 . . . . . 119 MET N . 27170 1 1312 . 1 1 120 120 GLU H H 1 7.553 0.020 . 1 . . . . . 120 GLU H . 27170 1 1313 . 1 1 120 120 GLU HA H 1 3.798 0.020 . 1 . . . . . 120 GLU HA . 27170 1 1314 . 1 1 120 120 GLU HB2 H 1 1.769 0.020 . 1 . . . . . 120 GLU HB2 . 27170 1 1315 . 1 1 120 120 GLU HB3 H 1 1.734 0.020 . 1 . . . . . 120 GLU HB3 . 27170 1 1316 . 1 1 120 120 GLU HG2 H 1 1.868 0.020 . 1 . . . . . 120 GLU HG2 . 27170 1 1317 . 1 1 120 120 GLU HG3 H 1 1.839 0.020 . 1 . . . . . 120 GLU HG3 . 27170 1 1318 . 1 1 120 120 GLU C C 13 177.613 0.3 . 1 . . . . . 120 GLU C . 27170 1 1319 . 1 1 120 120 GLU CA C 13 59.444 0.3 . 1 . . . . . 120 GLU CA . 27170 1 1320 . 1 1 120 120 GLU CB C 13 30.404 0.3 . 1 . . . . . 120 GLU CB . 27170 1 1321 . 1 1 120 120 GLU CG C 13 36.642 0.3 . 1 . . . . . 120 GLU CG . 27170 1 1322 . 1 1 120 120 GLU N N 15 117.537 0.3 . 1 . . . . . 120 GLU N . 27170 1 1323 . 1 1 121 121 GLN H H 1 7.199 0.020 . 1 . . . . . 121 GLN H . 27170 1 1324 . 1 1 121 121 GLN HA H 1 3.785 0.020 . 1 . . . . . 121 GLN HA . 27170 1 1325 . 1 1 121 121 GLN HB2 H 1 1.386 0.020 . 1 . . . . . 121 GLN HB2 . 27170 1 1326 . 1 1 121 121 GLN HB3 H 1 1.339 0.020 . 1 . . . . . 121 GLN HB3 . 27170 1 1327 . 1 1 121 121 GLN HG2 H 1 1.447 0.020 . 1 . . . . . 121 GLN HG2 . 27170 1 1328 . 1 1 121 121 GLN HG3 H 1 1.315 0.020 . 1 . . . . . 121 GLN HG3 . 27170 1 1329 . 1 1 121 121 GLN HE21 H 1 6.945 0.020 . 1 . . . . . 121 GLN HE21 . 27170 1 1330 . 1 1 121 121 GLN HE22 H 1 6.709 0.020 . 1 . . . . . 121 GLN HE22 . 27170 1 1331 . 1 1 121 121 GLN C C 13 176.602 0.3 . 1 . . . . . 121 GLN C . 27170 1 1332 . 1 1 121 121 GLN CA C 13 58.650 0.3 . 1 . . . . . 121 GLN CA . 27170 1 1333 . 1 1 121 121 GLN CB C 13 30.404 0.3 . 1 . . . . . 121 GLN CB . 27170 1 1334 . 1 1 121 121 GLN CG C 13 33.815 0.3 . 1 . . . . . 121 GLN CG . 27170 1 1335 . 1 1 121 121 GLN N N 15 113.744 0.3 . 1 . . . . . 121 GLN N . 27170 1 1336 . 1 1 121 121 GLN NE2 N 15 111.204 0.3 . 1 . . . . . 121 GLN NE2 . 27170 1 1337 . 1 1 122 122 PHE H H 1 7.742 0.020 . 1 . . . . . 122 PHE H . 27170 1 1338 . 1 1 122 122 PHE HA H 1 4.300 0.020 . 1 . . . . . 122 PHE HA . 27170 1 1339 . 1 1 122 122 PHE HB2 H 1 2.732 0.020 . 1 . . . . . 122 PHE HB2 . 27170 1 1340 . 1 1 122 122 PHE HB3 H 1 2.304 0.020 . 1 . . . . . 122 PHE HB3 . 27170 1 1341 . 1 1 122 122 PHE HD1 H 1 6.853 0.020 . 1 . . . . . 122 PHE HD1 . 27170 1 1342 . 1 1 122 122 PHE HE1 H 1 7.155 0.020 . 1 . . . . . 122 PHE HE1 . 27170 1 1343 . 1 1 122 122 PHE HZ H 1 6.930 0.020 . 1 . . . . . 122 PHE HZ . 27170 1 1344 . 1 1 122 122 PHE C C 13 174.445 0.3 . 1 . . . . . 122 PHE C . 27170 1 1345 . 1 1 122 122 PHE CA C 13 56.973 0.3 . 1 . . . . . 122 PHE CA . 27170 1 1346 . 1 1 122 122 PHE CB C 13 41.084 0.3 . 1 . . . . . 122 PHE CB . 27170 1 1347 . 1 1 122 122 PHE N N 15 113.628 0.3 . 1 . . . . . 122 PHE N . 27170 1 1348 . 1 1 123 123 HIS H H 1 7.391 0.020 . 1 . . . . . 123 HIS H . 27170 1 1349 . 1 1 123 123 HIS HA H 1 4.691 0.020 . 1 . . . . . 123 HIS HA . 27170 1 1350 . 1 1 123 123 HIS HB2 H 1 3.357 0.020 . 1 . . . . . 123 HIS HB2 . 27170 1 1351 . 1 1 123 123 HIS HB3 H 1 3.283 0.020 . 1 . . . . . 123 HIS HB3 . 27170 1 1352 . 1 1 123 123 HIS HD2 H 1 6.851 0.020 . 1 . . . . . 123 HIS HD2 . 27170 1 1353 . 1 1 123 123 HIS HE1 H 1 7.736 0.020 . 1 . . . . . 123 HIS HE1 . 27170 1 1354 . 1 1 123 123 HIS C C 13 174.512 0.3 . 1 . . . . . 123 HIS C . 27170 1 1355 . 1 1 123 123 HIS CA C 13 57.679 0.3 . 1 . . . . . 123 HIS CA . 27170 1 1356 . 1 1 123 123 HIS CB C 13 27.579 0.3 . 1 . . . . . 123 HIS CB . 27170 1 1357 . 1 1 123 123 HIS N N 15 115.083 0.3 . 1 . . . . . 123 HIS N . 27170 1 1358 . 1 1 124 124 MET H H 1 6.867 0.020 . 1 . . . . . 124 MET H . 27170 1 1359 . 1 1 124 124 MET HA H 1 4.716 0.020 . 1 . . . . . 124 MET HA . 27170 1 1360 . 1 1 124 124 MET HB2 H 1 2.108 0.020 . 1 . . . . . 124 MET HB2 . 27170 1 1361 . 1 1 124 124 MET HB3 H 1 1.618 0.020 . 1 . . . . . 124 MET HB3 . 27170 1 1362 . 1 1 124 124 MET HG2 H 1 2.512 0.020 . 1 . . . . . 124 MET HG2 . 27170 1 1363 . 1 1 124 124 MET HG3 H 1 2.451 0.020 . 1 . . . . . 124 MET HG3 . 27170 1 1364 . 1 1 124 124 MET C C 13 174.580 0.3 . 1 . . . . . 124 MET C . 27170 1 1365 . 1 1 124 124 MET CA C 13 55.649 0.3 . 1 . . . . . 124 MET CA . 27170 1 1366 . 1 1 124 124 MET CB C 13 38.436 0.3 . 1 . . . . . 124 MET CB . 27170 1 1367 . 1 1 124 124 MET CG C 13 32.214 0.3 . 1 . . . . . 124 MET CG . 27170 1 1368 . 1 1 124 124 MET N N 15 115.616 0.3 . 1 . . . . . 124 MET N . 27170 1 1369 . 1 1 125 125 ARG H H 1 8.784 0.020 . 1 . . . . . 125 ARG H . 27170 1 1370 . 1 1 125 125 ARG HA H 1 4.324 0.020 . 1 . . . . . 125 ARG HA . 27170 1 1371 . 1 1 125 125 ARG HB2 H 1 1.851 0.020 . 1 . . . . . 125 ARG HB2 . 27170 1 1372 . 1 1 125 125 ARG HB3 H 1 1.777 0.020 . 1 . . . . . 125 ARG HB3 . 27170 1 1373 . 1 1 125 125 ARG HG2 H 1 1.651 0.020 . 1 . . . . . 125 ARG HG2 . 27170 1 1374 . 1 1 125 125 ARG HG3 H 1 1.608 0.020 . 1 . . . . . 125 ARG HG3 . 27170 1 1375 . 1 1 125 125 ARG HE H 1 7.274 0.020 . 1 . . . . . 125 ARG HE . 27170 1 1376 . 1 1 125 125 ARG C C 13 175.591 0.3 . 1 . . . . . 125 ARG C . 27170 1 1377 . 1 1 125 125 ARG CA C 13 57.414 0.3 . 1 . . . . . 125 ARG CA . 27170 1 1378 . 1 1 125 125 ARG CB C 13 32.699 0.3 . 1 . . . . . 125 ARG CB . 27170 1 1379 . 1 1 125 125 ARG CG C 13 28.634 0.3 . 1 . . . . . 125 ARG CG . 27170 1 1380 . 1 1 125 125 ARG CD C 13 44.178 0.3 . 1 . . . . . 125 ARG CD . 27170 1 1381 . 1 1 125 125 ARG N N 15 118.358 0.3 . 1 . . . . . 125 ARG N . 27170 1 1382 . 1 1 126 126 GLU H H 1 7.475 0.020 . 1 . . . . . 126 GLU H . 27170 1 1383 . 1 1 126 126 GLU HA H 1 4.802 0.020 . 1 . . . . . 126 GLU HA . 27170 1 1384 . 1 1 126 126 GLU HB2 H 1 2.034 0.020 . 1 . . . . . 126 GLU HB2 . 27170 1 1385 . 1 1 126 126 GLU HB3 H 1 1.912 0.020 . 1 . . . . . 126 GLU HB3 . 27170 1 1386 . 1 1 126 126 GLU HG2 H 1 2.512 0.020 . 1 . . . . . 126 GLU HG2 . 27170 1 1387 . 1 1 126 126 GLU HG3 H 1 2.488 0.020 . 1 . . . . . 126 GLU HG3 . 27170 1 1388 . 1 1 126 126 GLU C C 13 174.950 0.3 . 1 . . . . . 126 GLU C . 27170 1 1389 . 1 1 126 126 GLU CA C 13 54.942 0.3 . 1 . . . . . 126 GLU CA . 27170 1 1390 . 1 1 126 126 GLU CB C 13 35.170 0.3 . 1 . . . . . 126 GLU CB . 27170 1 1391 . 1 1 126 126 GLU CG C 13 36.830 0.3 . 1 . . . . . 126 GLU CG . 27170 1 1392 . 1 1 126 126 GLU N N 15 115.437 0.3 . 1 . . . . . 126 GLU N . 27170 1 1393 . 1 1 127 127 ILE H H 1 8.069 0.020 . 1 . . . . . 127 ILE H . 27170 1 1394 . 1 1 127 127 ILE HA H 1 4.705 0.020 . 1 . . . . . 127 ILE HA . 27170 1 1395 . 1 1 127 127 ILE HB H 1 1.453 0.020 . 1 . . . . . 127 ILE HB . 27170 1 1396 . 1 1 127 127 ILE HG12 H 1 1.777 0.020 . 1 . . . . . 127 ILE HG12 . 27170 1 1397 . 1 1 127 127 ILE HG13 H 1 1.590 0.020 . 1 . . . . . 127 ILE HG13 . 27170 1 1398 . 1 1 127 127 ILE HG21 H 1 0.874 0.020 . 1 . . . . . 127 ILE HG2 . 27170 1 1399 . 1 1 127 127 ILE HG22 H 1 0.874 0.020 . 1 . . . . . 127 ILE HG2 . 27170 1 1400 . 1 1 127 127 ILE HG23 H 1 0.874 0.020 . 1 . . . . . 127 ILE HG2 . 27170 1 1401 . 1 1 127 127 ILE HD11 H 1 0.738 0.020 . 1 . . . . . 127 ILE HD1 . 27170 1 1402 . 1 1 127 127 ILE HD12 H 1 0.738 0.020 . 1 . . . . . 127 ILE HD1 . 27170 1 1403 . 1 1 127 127 ILE HD13 H 1 0.738 0.020 . 1 . . . . . 127 ILE HD1 . 27170 1 1404 . 1 1 127 127 ILE CA C 13 62.092 0.3 . 1 . . . . . 127 ILE CA . 27170 1 1405 . 1 1 127 127 ILE CB C 13 40.996 0.3 . 1 . . . . . 127 ILE CB . 27170 1 1406 . 1 1 127 127 ILE N N 15 119.145 0.3 . 1 . . . . . 127 ILE N . 27170 1 1407 . 1 1 128 128 HIS HA H 1 4.691 0.020 . 1 . . . . . 128 HIS HA . 27170 1 1408 . 1 1 128 128 HIS HB2 H 1 3.136 0.020 . 1 . . . . . 128 HIS HB2 . 27170 1 1409 . 1 1 128 128 HIS HB3 H 1 2.879 0.020 . 1 . . . . . 128 HIS HB3 . 27170 1 1410 . 1 1 128 128 HIS HD2 H 1 7.191 0.020 . 1 . . . . . 128 HIS HD2 . 27170 1 1411 . 1 1 128 128 HIS HE1 H 1 8.077 0.020 . 1 . . . . . 128 HIS HE1 . 27170 1 1412 . 1 1 128 128 HIS C C 13 174.681 0.3 . 1 . . . . . 128 HIS C . 27170 1 1413 . 1 1 128 128 HIS CA C 13 58.385 0.3 . 1 . . . . . 128 HIS CA . 27170 1 1414 . 1 1 128 128 HIS CB C 13 35.700 0.3 . 1 . . . . . 128 HIS CB . 27170 1 1415 . 1 1 129 129 SER H H 1 7.837 0.020 . 1 . . . . . 129 SER H . 27170 1 1416 . 1 1 129 129 SER HA H 1 4.397 0.020 . 1 . . . . . 129 SER HA . 27170 1 1417 . 1 1 129 129 SER HB2 H 1 3.859 0.020 . 1 . . . . . 129 SER HB2 . 27170 1 1418 . 1 1 129 129 SER HB3 H 1 3.491 0.020 . 1 . . . . . 129 SER HB3 . 27170 1 1419 . 1 1 129 129 SER C C 13 173.771 0.3 . 1 . . . . . 129 SER C . 27170 1 1420 . 1 1 129 129 SER CA C 13 60.150 0.3 . 1 . . . . . 129 SER CA . 27170 1 1421 . 1 1 129 129 SER CB C 13 65.623 0.3 . 1 . . . . . 129 SER CB . 27170 1 1422 . 1 1 129 129 SER N N 15 105.395 0.3 . 1 . . . . . 129 SER N . 27170 1 1423 . 1 1 130 130 CYS H H 1 9.832 0.020 . 1 . . . . . 130 CYS H . 27170 1 1424 . 1 1 130 130 CYS HA H 1 5.732 0.020 . 1 . . . . . 130 CYS HA . 27170 1 1425 . 1 1 130 130 CYS HB2 H 1 3.210 0.020 . 1 . . . . . 130 CYS HB2 . 27170 1 1426 . 1 1 130 130 CYS HB3 H 1 2.965 0.020 . 1 . . . . . 130 CYS HB3 . 27170 1 1427 . 1 1 130 130 CYS CA C 13 58.473 0.3 . 1 . . . . . 130 CYS CA . 27170 1 1428 . 1 1 130 130 CYS CB C 13 30.492 0.3 . 1 . . . . . 130 CYS CB . 27170 1 1429 . 1 1 130 130 CYS N N 15 114.830 0.3 . 1 . . . . . 130 CYS N . 27170 1 1430 . 1 1 132 132 VAL HA H 1 4.495 0.020 . 1 . . . . . 132 VAL HA . 27170 1 1431 . 1 1 132 132 VAL HB H 1 2.341 0.020 . 1 . . . . . 132 VAL HB . 27170 1 1432 . 1 1 132 132 VAL HG11 H 1 1.092 0.020 . 1 . . . . . 132 VAL HG1 . 27170 1 1433 . 1 1 132 132 VAL HG12 H 1 1.092 0.020 . 1 . . . . . 132 VAL HG1 . 27170 1 1434 . 1 1 132 132 VAL HG13 H 1 1.092 0.020 . 1 . . . . . 132 VAL HG1 . 27170 1 1435 . 1 1 132 132 VAL C C 13 173.029 0.3 . 1 . . . . . 132 VAL C . 27170 1 1436 . 1 1 132 132 VAL CA C 13 59.003 0.3 . 1 . . . . . 132 VAL CA . 27170 1 1437 . 1 1 132 132 VAL CB C 13 30.757 0.3 . 1 . . . . . 132 VAL CB . 27170 1 1438 . 1 1 133 133 LEU H H 1 8.443 0.020 . 1 . . . . . 133 LEU H . 27170 1 1439 . 1 1 133 133 LEU HA H 1 4.495 0.020 . 1 . . . . . 133 LEU HA . 27170 1 1440 . 1 1 133 133 LEU HB2 H 1 1.697 0.020 . 1 . . . . . 133 LEU HB2 . 27170 1 1441 . 1 1 133 133 LEU HB3 H 1 1.618 0.020 . 1 . . . . . 133 LEU HB3 . 27170 1 1442 . 1 1 133 133 LEU HG H 1 1.645 0.020 . 1 . . . . . 133 LEU HG . 27170 1 1443 . 1 1 133 133 LEU HD11 H 1 0.583 0.020 . 1 . . . . . 133 LEU HD1 . 27170 1 1444 . 1 1 133 133 LEU HD12 H 1 0.583 0.020 . 1 . . . . . 133 LEU HD1 . 27170 1 1445 . 1 1 133 133 LEU HD13 H 1 0.583 0.020 . 1 . . . . . 133 LEU HD1 . 27170 1 1446 . 1 1 133 133 LEU C C 13 173.568 0.3 . 1 . . . . . 133 LEU C . 27170 1 1447 . 1 1 133 133 LEU CA C 13 53.530 0.3 . 1 . . . . . 133 LEU CA . 27170 1 1448 . 1 1 133 133 LEU CB C 13 42.408 0.3 . 1 . . . . . 133 LEU CB . 27170 1 1449 . 1 1 133 133 LEU CG C 13 28.728 0.3 . 1 . . . . . 133 LEU CG . 27170 1 1450 . 1 1 133 133 LEU CD1 C 13 25.404 0.3 . 1 . . . . . 133 LEU CD1 . 27170 1 1451 . 1 1 133 133 LEU CD2 C 13 24.326 0.3 . 1 . . . . . 133 LEU CD2 . 27170 1 1452 . 1 1 133 133 LEU N N 15 122.491 0.3 . 1 . . . . . 133 LEU N . 27170 1 1453 . 1 1 134 134 GLU H H 1 8.686 0.020 . 1 . . . . . 134 GLU H . 27170 1 1454 . 1 1 134 134 GLU HA H 1 4.618 0.020 . 1 . . . . . 134 GLU HA . 27170 1 1455 . 1 1 134 134 GLU HB2 H 1 1.998 0.020 . 1 . . . . . 134 GLU HB2 . 27170 1 1456 . 1 1 134 134 GLU HB3 H 1 1.826 0.020 . 1 . . . . . 134 GLU HB3 . 27170 1 1457 . 1 1 134 134 GLU HG2 H 1 2.536 0.020 . 1 . . . . . 134 GLU HG2 . 27170 1 1458 . 1 1 134 134 GLU HG3 H 1 2.438 0.020 . 1 . . . . . 134 GLU HG3 . 27170 1 1459 . 1 1 134 134 GLU C C 13 175.220 0.3 . 1 . . . . . 134 GLU C . 27170 1 1460 . 1 1 134 134 GLU CA C 13 54.501 0.3 . 1 . . . . . 134 GLU CA . 27170 1 1461 . 1 1 134 134 GLU CB C 13 34.729 0.3 . 1 . . . . . 134 GLU CB . 27170 1 1462 . 1 1 134 134 GLU CG C 13 37.584 0.3 . 1 . . . . . 134 GLU CG . 27170 1 1463 . 1 1 134 134 GLU N N 15 122.772 0.3 . 1 . . . . . 134 GLU N . 27170 1 1464 . 1 1 135 135 GLY H H 1 8.103 0.020 . 1 . . . . . 135 GLY H . 27170 1 1465 . 1 1 135 135 GLY HA2 H 1 4.361 0.020 . 1 . . . . . 135 GLY HA2 . 27170 1 1466 . 1 1 135 135 GLY HA3 H 1 3.847 0.020 . 1 . . . . . 135 GLY HA3 . 27170 1 1467 . 1 1 135 135 GLY CA C 13 46.734 0.3 . 1 . . . . . 135 GLY CA . 27170 1 1468 . 1 1 135 135 GLY N N 15 106.879 0.3 . 1 . . . . . 135 GLY N . 27170 1 1469 . 1 1 137 137 TRP HA H 1 5.193 0.020 . 1 . . . . . 137 TRP HA . 27170 1 1470 . 1 1 137 137 TRP HB2 H 1 2.977 0.020 . 1 . . . . . 137 TRP HB2 . 27170 1 1471 . 1 1 137 137 TRP HB3 H 1 2.218 0.020 . 1 . . . . . 137 TRP HB3 . 27170 1 1472 . 1 1 137 137 TRP HD1 H 1 7.190 0.020 . 1 . . . . . 137 TRP HD1 . 27170 1 1473 . 1 1 137 137 TRP HE1 H 1 8.929 0.020 . 1 . . . . . 137 TRP HE1 . 27170 1 1474 . 1 1 137 137 TRP HE3 H 1 6.862 0.020 . 1 . . . . . 137 TRP HE3 . 27170 1 1475 . 1 1 137 137 TRP HZ2 H 1 6.800 0.020 . 1 . . . . . 137 TRP HZ2 . 27170 1 1476 . 1 1 137 137 TRP HZ3 H 1 6.687 0.020 . 1 . . . . . 137 TRP HZ3 . 27170 1 1477 . 1 1 137 137 TRP HH2 H 1 6.585 0.020 . 1 . . . . . 137 TRP HH2 . 27170 1 1478 . 1 1 137 137 TRP C C 13 173.332 0.3 . 1 . . . . . 137 TRP C . 27170 1 1479 . 1 1 137 137 TRP CA C 13 56.443 0.3 . 1 . . . . . 137 TRP CA . 27170 1 1480 . 1 1 137 137 TRP CB C 13 33.317 0.3 . 1 . . . . . 137 TRP CB . 27170 1 1481 . 1 1 137 137 TRP NE1 N 15 123.489 0.3 . 1 . . . . . 137 TRP NE1 . 27170 1 1482 . 1 1 138 138 ILE H H 1 9.334 0.020 . 1 . . . . . 138 ILE H . 27170 1 1483 . 1 1 138 138 ILE HA H 1 4.508 0.020 . 1 . . . . . 138 ILE HA . 27170 1 1484 . 1 1 138 138 ILE HB H 1 1.471 0.020 . 1 . . . . . 138 ILE HB . 27170 1 1485 . 1 1 138 138 ILE HG12 H 1 1.569 0.020 . 1 . . . . . 138 ILE HG12 . 27170 1 1486 . 1 1 138 138 ILE HG13 H 1 1.349 0.020 . 1 . . . . . 138 ILE HG13 . 27170 1 1487 . 1 1 138 138 ILE HG21 H 1 0.738 0.020 . 1 . . . . . 138 ILE HG2 . 27170 1 1488 . 1 1 138 138 ILE HG22 H 1 0.738 0.020 . 1 . . . . . 138 ILE HG2 . 27170 1 1489 . 1 1 138 138 ILE HG23 H 1 0.738 0.020 . 1 . . . . . 138 ILE HG2 . 27170 1 1490 . 1 1 138 138 ILE HD11 H 1 0.619 0.020 . 1 . . . . . 138 ILE HD1 . 27170 1 1491 . 1 1 138 138 ILE HD12 H 1 0.619 0.020 . 1 . . . . . 138 ILE HD1 . 27170 1 1492 . 1 1 138 138 ILE HD13 H 1 0.619 0.020 . 1 . . . . . 138 ILE HD1 . 27170 1 1493 . 1 1 138 138 ILE C C 13 176.568 0.3 . 1 . . . . . 138 ILE C . 27170 1 1494 . 1 1 138 138 ILE CA C 13 60.062 0.3 . 1 . . . . . 138 ILE CA . 27170 1 1495 . 1 1 138 138 ILE CB C 13 41.261 0.3 . 1 . . . . . 138 ILE CB . 27170 1 1496 . 1 1 138 138 ILE CG1 C 13 31.460 0.3 . 1 . . . . . 138 ILE CG1 . 27170 1 1497 . 1 1 138 138 ILE CG2 C 13 18.836 0.3 . 1 . . . . . 138 ILE CG2 . 27170 1 1498 . 1 1 138 138 ILE CD1 C 13 15.727 0.3 . 1 . . . . . 138 ILE CD1 . 27170 1 1499 . 1 1 138 138 ILE N N 15 119.281 0.3 . 1 . . . . . 138 ILE N . 27170 1 1500 . 1 1 139 139 PHE H H 1 8.816 0.020 . 1 . . . . . 139 PHE H . 27170 1 1501 . 1 1 139 139 PHE HA H 1 5.389 0.020 . 1 . . . . . 139 PHE HA . 27170 1 1502 . 1 1 139 139 PHE HB2 H 1 2.916 0.020 . 1 . . . . . 139 PHE HB2 . 27170 1 1503 . 1 1 139 139 PHE HB3 H 1 2.853 0.020 . 1 . . . . . 139 PHE HB3 . 27170 1 1504 . 1 1 139 139 PHE HD1 H 1 6.976 0.020 . 1 . . . . . 139 PHE HD1 . 27170 1 1505 . 1 1 139 139 PHE HE1 H 1 7.116 0.020 . 1 . . . . . 139 PHE HE1 . 27170 1 1506 . 1 1 139 139 PHE HZ H 1 7.066 0.020 . 1 . . . . . 139 PHE HZ . 27170 1 1507 . 1 1 139 139 PHE C C 13 174.917 0.3 . 1 . . . . . 139 PHE C . 27170 1 1508 . 1 1 139 139 PHE CA C 13 53.707 0.3 . 1 . . . . . 139 PHE CA . 27170 1 1509 . 1 1 139 139 PHE CB C 13 41.790 0.3 . 1 . . . . . 139 PHE CB . 27170 1 1510 . 1 1 139 139 PHE N N 15 125.282 0.3 . 1 . . . . . 139 PHE N . 27170 1 1511 . 1 1 140 140 TYR H H 1 8.850 0.020 . 1 . . . . . 140 TYR H . 27170 1 1512 . 1 1 140 140 TYR HA H 1 5.64 0.020 . 1 . . . . . 140 TYR HA . 27170 1 1513 . 1 1 140 140 TYR HB2 H 1 3.34 0.020 . 1 . . . . . 140 TYR HB2 . 27170 1 1514 . 1 1 140 140 TYR HB3 H 1 3.31 0.020 . 1 . . . . . 140 TYR HB3 . 27170 1 1515 . 1 1 140 140 TYR HD1 H 1 6.639 0.020 . 1 . . . . . 140 TYR HD1 . 27170 1 1516 . 1 1 140 140 TYR HE1 H 1 7.039 0.020 . 1 . . . . . 140 TYR HE1 . 27170 1 1517 . 1 1 140 140 TYR C C 13 178.186 0.3 . 1 . . . . . 140 TYR C . 27170 1 1518 . 1 1 140 140 TYR CA C 13 57.149 0.3 . 1 . . . . . 140 TYR CA . 27170 1 1519 . 1 1 140 140 TYR CB C 13 40.202 0.3 . 1 . . . . . 140 TYR CB . 27170 1 1520 . 1 1 140 140 TYR N N 15 116.558 0.3 . 1 . . . . . 140 TYR N . 27170 1 1521 . 1 1 141 141 GLU H H 1 9.093 0.020 . 1 . . . . . 141 GLU H . 27170 1 1522 . 1 1 141 141 GLU HA H 1 4.58 0.020 . 1 . . . . . 141 GLU HA . 27170 1 1523 . 1 1 141 141 GLU HB2 H 1 2.65 0.020 . 1 . . . . . 141 GLU HB2 . 27170 1 1524 . 1 1 141 141 GLU HB3 H 1 2.41 0.020 . 1 . . . . . 141 GLU HB3 . 27170 1 1525 . 1 1 141 141 GLU HG2 H 1 2.396 0.020 . 1 . . . . . 141 GLU HG2 . 27170 1 1526 . 1 1 141 141 GLU HG3 H 1 2.341 0.020 . 1 . . . . . 141 GLU HG3 . 27170 1 1527 . 1 1 141 141 GLU C C 13 175.389 0.3 . 1 . . . . . 141 GLU C . 27170 1 1528 . 1 1 141 141 GLU CA C 13 59.621 0.3 . 1 . . . . . 141 GLU CA . 27170 1 1529 . 1 1 141 141 GLU CB C 13 32.346 0.3 . 1 . . . . . 141 GLU CB . 27170 1 1530 . 1 1 141 141 GLU CG C 13 36.265 0.3 . 1 . . . . . 141 GLU CG . 27170 1 1531 . 1 1 141 141 GLU N N 15 120.482 0.3 . 1 . . . . . 141 GLU N . 27170 1 1532 . 1 1 142 142 LEU H H 1 7.952 0.020 . 1 . . . . . 142 LEU H . 27170 1 1533 . 1 1 142 142 LEU HA H 1 4.92 0.020 . 1 . . . . . 142 LEU HA . 27170 1 1534 . 1 1 142 142 LEU HB2 H 1 1.487 0.020 . 1 . . . . . 142 LEU HB2 . 27170 1 1535 . 1 1 142 142 LEU HB3 H 1 1.368 0.020 . 1 . . . . . 142 LEU HB3 . 27170 1 1536 . 1 1 142 142 LEU HG H 1 1.590 0.020 . 1 . . . . . 142 LEU HG . 27170 1 1537 . 1 1 142 142 LEU HD11 H 1 0.943 0.020 . 1 . . . . . 142 LEU HD1 . 27170 1 1538 . 1 1 142 142 LEU HD12 H 1 0.943 0.020 . 1 . . . . . 142 LEU HD1 . 27170 1 1539 . 1 1 142 142 LEU HD13 H 1 0.943 0.020 . 1 . . . . . 142 LEU HD1 . 27170 1 1540 . 1 1 142 142 LEU HD21 H 1 0.806 0.020 . 1 . . . . . 142 LEU HD2 . 27170 1 1541 . 1 1 142 142 LEU HD22 H 1 0.806 0.020 . 1 . . . . . 142 LEU HD2 . 27170 1 1542 . 1 1 142 142 LEU HD23 H 1 0.806 0.020 . 1 . . . . . 142 LEU HD2 . 27170 1 1543 . 1 1 142 142 LEU CA C 13 52.647 0.3 . 1 . . . . . 142 LEU CA . 27170 1 1544 . 1 1 142 142 LEU CB C 13 42.497 0.3 . 1 . . . . . 142 LEU CB . 27170 1 1545 . 1 1 142 142 LEU N N 15 113.332 0.3 . 1 . . . . . 142 LEU N . 27170 1 1546 . 1 1 143 143 PRO HA H 1 4.091 0.020 . 1 . . . . . 143 PRO HA . 27170 1 1547 . 1 1 143 143 PRO HB2 H 1 2.365 0.020 . 1 . . . . . 143 PRO HB2 . 27170 1 1548 . 1 1 143 143 PRO HB3 H 1 1.716 0.020 . 1 . . . . . 143 PRO HB3 . 27170 1 1549 . 1 1 143 143 PRO HG2 H 1 1.783 0.020 . 1 . . . . . 143 PRO HG2 . 27170 1 1550 . 1 1 143 143 PRO HG3 H 1 1.754 0.020 . 1 . . . . . 143 PRO HG3 . 27170 1 1551 . 1 1 143 143 PRO HD2 H 1 4.042 0.020 . 1 . . . . . 143 PRO HD2 . 27170 1 1552 . 1 1 143 143 PRO HD3 H 1 3.993 0.020 . 1 . . . . . 143 PRO HD3 . 27170 1 1553 . 1 1 143 143 PRO C C 13 175.692 0.3 . 1 . . . . . 143 PRO C . 27170 1 1554 . 1 1 143 143 PRO CA C 13 63.157 0.3 . 1 . . . . . 143 PRO CA . 27170 1 1555 . 1 1 143 143 PRO CB C 13 32.875 0.3 . 1 . . . . . 143 PRO CB . 27170 1 1556 . 1 1 143 143 PRO CG C 13 27.032 0.3 . 1 . . . . . 143 PRO CG . 27170 1 1557 . 1 1 143 143 PRO CD C 13 52.280 0.3 . 1 . . . . . 143 PRO CD . 27170 1 1558 . 1 1 144 144 ASN H H 1 9.589 0.020 . 1 . . . . . 144 ASN H . 27170 1 1559 . 1 1 144 144 ASN HA H 1 3.20 0.020 . 1 . . . . . 144 ASN HA . 27170 1 1560 . 1 1 144 144 ASN HB2 H 1 2.75 0.020 . 1 . . . . . 144 ASN HB2 . 27170 1 1561 . 1 1 144 144 ASN HB3 H 1 2.52 0.020 . 1 . . . . . 144 ASN HB3 . 27170 1 1562 . 1 1 144 144 ASN HD21 H 1 7.287 0.020 . 1 . . . . . 144 ASN HD21 . 27170 1 1563 . 1 1 144 144 ASN HD22 H 1 6.663 0.020 . 1 . . . . . 144 ASN HD22 . 27170 1 1564 . 1 1 144 144 ASN C C 13 176.063 0.3 . 1 . . . . . 144 ASN C . 27170 1 1565 . 1 1 144 144 ASN CA C 13 54.854 0.3 . 1 . . . . . 144 ASN CA . 27170 1 1566 . 1 1 144 144 ASN CB C 13 37.377 0.3 . 1 . . . . . 144 ASN CB . 27170 1 1567 . 1 1 144 144 ASN N N 15 112.743 0.3 . 1 . . . . . 144 ASN N . 27170 1 1568 . 1 1 144 144 ASN ND2 N 15 112.473 0.3 . 1 . . . . . 144 ASN ND2 . 27170 1 1569 . 1 1 145 145 TYR H H 1 7.737 0.020 . 1 . . . . . 145 TYR H . 27170 1 1570 . 1 1 145 145 TYR HA H 1 2.86 0.020 . 1 . . . . . 145 TYR HA . 27170 1 1571 . 1 1 145 145 TYR HB2 H 1 2.96 0.020 . 1 . . . . . 145 TYR HB2 . 27170 1 1572 . 1 1 145 145 TYR HB3 H 1 1.76 0.020 . 1 . . . . . 145 TYR HB3 . 27170 1 1573 . 1 1 145 145 TYR HD1 H 1 6.759 0.020 . 1 . . . . . 145 TYR HD1 . 27170 1 1574 . 1 1 145 145 TYR HE1 H 1 6.845 0.020 . 1 . . . . . 145 TYR HE1 . 27170 1 1575 . 1 1 145 145 TYR C C 13 175.119 0.3 . 1 . . . . . 145 TYR C . 27170 1 1576 . 1 1 145 145 TYR CA C 13 54.589 0.3 . 1 . . . . . 145 TYR CA . 27170 1 1577 . 1 1 145 145 TYR CB C 13 33.68 0.3 . 1 . . . . . 145 TYR CB . 27170 1 1578 . 1 1 145 145 TYR N N 15 112.415 0.3 . 1 . . . . . 145 TYR N . 27170 1 1579 . 1 1 146 146 ARG H H 1 6.085 0.020 . 1 . . . . . 146 ARG H . 27170 1 1580 . 1 1 146 146 ARG HA H 1 4.740 0.020 . 1 . . . . . 146 ARG HA . 27170 1 1581 . 1 1 146 146 ARG HB2 H 1 1.834 0.020 . 1 . . . . . 146 ARG HB2 . 27170 1 1582 . 1 1 146 146 ARG HB3 H 1 1.819 0.020 . 1 . . . . . 146 ARG HB3 . 27170 1 1583 . 1 1 146 146 ARG HG2 H 1 1.517 0.020 . 1 . . . . . 146 ARG HG2 . 27170 1 1584 . 1 1 146 146 ARG HG3 H 1 1.487 0.020 . 1 . . . . . 146 ARG HG3 . 27170 1 1585 . 1 1 146 146 ARG HD2 H 1 3.149 0.020 . 1 . . . . . 146 ARG HD2 . 27170 1 1586 . 1 1 146 146 ARG HD3 H 1 3.063 0.020 . 1 . . . . . 146 ARG HD3 . 27170 1 1587 . 1 1 146 146 ARG HE H 1 7.047 0.020 . 1 . . . . . 146 ARG HE . 27170 1 1588 . 1 1 146 146 ARG C C 13 175.018 0.3 . 1 . . . . . 146 ARG C . 27170 1 1589 . 1 1 146 146 ARG CA C 13 54.413 0.3 . 1 . . . . . 146 ARG CA . 27170 1 1590 . 1 1 146 146 ARG CB C 13 34.906 0.3 . 1 . . . . . 146 ARG CB . 27170 1 1591 . 1 1 146 146 ARG CG C 13 27.598 0.3 . 1 . . . . . 146 ARG CG . 27170 1 1592 . 1 1 146 146 ARG CD C 13 44.744 0.3 . 1 . . . . . 146 ARG CD . 27170 1 1593 . 1 1 146 146 ARG N N 15 116.830 0.3 . 1 . . . . . 146 ARG N . 27170 1 1594 . 1 1 147 147 GLY H H 1 8.342 0.020 . 1 . . . . . 147 GLY H . 27170 1 1595 . 1 1 147 147 GLY HA2 H 1 4.29 0.020 . 1 . . . . . 147 GLY HA2 . 27170 1 1596 . 1 1 147 147 GLY HA3 H 1 3.810 0.020 . 1 . . . . . 147 GLY HA3 . 27170 1 1597 . 1 1 147 147 GLY C C 13 173.771 0.3 . 1 . . . . . 147 GLY C . 27170 1 1598 . 1 1 147 147 GLY CA C 13 44.792 0.3 . 1 . . . . . 147 GLY CA . 27170 1 1599 . 1 1 147 147 GLY N N 15 105.342 0.3 . 1 . . . . . 147 GLY N . 27170 1 1600 . 1 1 148 148 ARG H H 1 8.420 0.020 . 1 . . . . . 148 ARG H . 27170 1 1601 . 1 1 148 148 ARG HA H 1 4.05 0.020 . 1 . . . . . 148 ARG HA . 27170 1 1602 . 1 1 148 148 ARG HB2 H 1 1.84 0.020 . 1 . . . . . 148 ARG HB2 . 27170 1 1603 . 1 1 148 148 ARG HB3 H 1 1.65 0.020 . 1 . . . . . 148 ARG HB3 . 27170 1 1604 . 1 1 148 148 ARG HG2 H 1 1.924 0.020 . 1 . . . . . 148 ARG HG2 . 27170 1 1605 . 1 1 148 148 ARG HG3 H 1 1.618 0.020 . 1 . . . . . 148 ARG HG3 . 27170 1 1606 . 1 1 148 148 ARG HE H 1 7.539 0.020 . 1 . . . . . 148 ARG HE . 27170 1 1607 . 1 1 148 148 ARG CA C 13 58.650 0.3 . 1 . . . . . 148 ARG CA . 27170 1 1608 . 1 1 148 148 ARG CB C 13 31.287 0.3 . 1 . . . . . 148 ARG CB . 27170 1 1609 . 1 1 148 148 ARG N N 15 120.540 0.3 . 1 . . . . . 148 ARG N . 27170 1 1610 . 1 1 149 149 GLN HA H 1 4.88 0.020 . 1 . . . . . 149 GLN HA . 27170 1 1611 . 1 1 149 149 GLN HB2 H 1 1.75 0.020 . 1 . . . . . 149 GLN HB2 . 27170 1 1612 . 1 1 149 149 GLN HB3 H 1 1.56 0.020 . 1 . . . . . 149 GLN HB3 . 27170 1 1613 . 1 1 149 149 GLN HG2 H 1 2.715 0.020 . 1 . . . . . 149 GLN HG2 . 27170 1 1614 . 1 1 149 149 GLN HG3 H 1 2.694 0.020 . 1 . . . . . 149 GLN HG3 . 27170 1 1615 . 1 1 149 149 GLN HE21 H 1 7.293 0.020 . 1 . . . . . 149 GLN HE21 . 27170 1 1616 . 1 1 149 149 GLN HE22 H 1 6.706 0.020 . 1 . . . . . 149 GLN HE22 . 27170 1 1617 . 1 1 149 149 GLN C C 13 171.579 0.3 . 1 . . . . . 149 GLN C . 27170 1 1618 . 1 1 149 149 GLN CA C 13 53.91 0.3 . 1 . . . . . 149 GLN CA . 27170 1 1619 . 1 1 149 149 GLN CB C 13 32.53 0.3 . 1 . . . . . 149 GLN CB . 27170 1 1620 . 1 1 149 149 GLN CG C 13 35.04 0.3 . 1 . . . . . 149 GLN CG . 27170 1 1621 . 1 1 149 149 GLN NE2 N 15 113.420 0.3 . 1 . . . . . 149 GLN NE2 . 27170 1 1622 . 1 1 150 150 TYR H H 1 7.631 0.020 . 1 . . . . . 150 TYR H . 27170 1 1623 . 1 1 150 150 TYR HA H 1 4.87 0.020 . 1 . . . . . 150 TYR HA . 27170 1 1624 . 1 1 150 150 TYR HB2 H 1 3.49 0.020 . 1 . . . . . 150 TYR HB2 . 27170 1 1625 . 1 1 150 150 TYR HB3 H 1 2.64 0.020 . 1 . . . . . 150 TYR HB3 . 27170 1 1626 . 1 1 150 150 TYR HD1 H 1 6.955 0.020 . 1 . . . . . 150 TYR HD1 . 27170 1 1627 . 1 1 150 150 TYR HE1 H 1 7.066 0.020 . 1 . . . . . 150 TYR HE1 . 27170 1 1628 . 1 1 150 150 TYR C C 13 174.883 0.3 . 1 . . . . . 150 TYR C . 27170 1 1629 . 1 1 150 150 TYR CA C 13 56.23 0.3 . 1 . . . . . 150 TYR CA . 27170 1 1630 . 1 1 150 150 TYR CB C 13 40.24 0.3 . 1 . . . . . 150 TYR CB . 27170 1 1631 . 1 1 150 150 TYR N N 15 114.480 0.3 . 1 . . . . . 150 TYR N . 27170 1 1632 . 1 1 151 151 LEU H H 1 8.148 0.020 . 1 . . . . . 151 LEU H . 27170 1 1633 . 1 1 151 151 LEU HA H 1 4.774 0.020 . 1 . . . . . 151 LEU HA . 27170 1 1634 . 1 1 151 151 LEU HB2 H 1 1.794 0.020 . 1 . . . . . 151 LEU HB2 . 27170 1 1635 . 1 1 151 151 LEU HB3 H 1 1.692 0.020 . 1 . . . . . 151 LEU HB3 . 27170 1 1636 . 1 1 151 151 LEU HG H 1 1.147 0.020 . 1 . . . . . 151 LEU HG . 27170 1 1637 . 1 1 151 151 LEU HD11 H 1 0.687 0.020 . 1 . . . . . 151 LEU HD1 . 27170 1 1638 . 1 1 151 151 LEU HD12 H 1 0.687 0.020 . 1 . . . . . 151 LEU HD1 . 27170 1 1639 . 1 1 151 151 LEU HD13 H 1 0.687 0.020 . 1 . . . . . 151 LEU HD1 . 27170 1 1640 . 1 1 151 151 LEU HD21 H 1 0.551 0.020 . 1 . . . . . 151 LEU HD2 . 27170 1 1641 . 1 1 151 151 LEU HD22 H 1 0.551 0.020 . 1 . . . . . 151 LEU HD2 . 27170 1 1642 . 1 1 151 151 LEU HD23 H 1 0.551 0.020 . 1 . . . . . 151 LEU HD2 . 27170 1 1643 . 1 1 151 151 LEU C C 13 174.074 0.3 . 1 . . . . . 151 LEU C . 27170 1 1644 . 1 1 151 151 LEU CA C 13 53.442 0.3 . 1 . . . . . 151 LEU CA . 27170 1 1645 . 1 1 151 151 LEU CB C 13 42.320 0.3 . 1 . . . . . 151 LEU CB . 27170 1 1646 . 1 1 151 151 LEU CG C 13 30.401 0.3 . 1 . . . . . 151 LEU CG . 27170 1 1647 . 1 1 151 151 LEU CD1 C 13 30.179 0.3 . 1 . . . . . 151 LEU CD1 . 27170 1 1648 . 1 1 151 151 LEU CD2 C 13 28.889 0.3 . 1 . . . . . 151 LEU CD2 . 27170 1 1649 . 1 1 151 151 LEU N N 15 125.221 0.3 . 1 . . . . . 151 LEU N . 27170 1 1650 . 1 1 152 152 LEU H H 1 9.133 0.020 . 1 . . . . . 152 LEU H . 27170 1 1651 . 1 1 152 152 LEU HA H 1 4.722 0.020 . 1 . . . . . 152 LEU HA . 27170 1 1652 . 1 1 152 152 LEU HB2 H 1 1.237 0.020 . 1 . . . . . 152 LEU HB2 . 27170 1 1653 . 1 1 152 152 LEU HB3 H 1 1.180 0.020 . 1 . . . . . 152 LEU HB3 . 27170 1 1654 . 1 1 152 152 LEU HG H 1 1.308 0.020 . 1 . . . . . 152 LEU HG . 27170 1 1655 . 1 1 152 152 LEU HD11 H 1 0.670 0.020 . 1 . . . . . 152 LEU HD1 . 27170 1 1656 . 1 1 152 152 LEU HD12 H 1 0.670 0.020 . 1 . . . . . 152 LEU HD1 . 27170 1 1657 . 1 1 152 152 LEU HD13 H 1 0.670 0.020 . 1 . . . . . 152 LEU HD1 . 27170 1 1658 . 1 1 152 152 LEU HD21 H 1 0.568 0.020 . 1 . . . . . 152 LEU HD2 . 27170 1 1659 . 1 1 152 152 LEU HD22 H 1 0.568 0.020 . 1 . . . . . 152 LEU HD2 . 27170 1 1660 . 1 1 152 152 LEU HD23 H 1 0.568 0.020 . 1 . . . . . 152 LEU HD2 . 27170 1 1661 . 1 1 152 152 LEU CA C 13 55.031 0.3 . 1 . . . . . 152 LEU CA . 27170 1 1662 . 1 1 152 152 LEU CB C 13 43.997 0.3 . 1 . . . . . 152 LEU CB . 27170 1 1663 . 1 1 152 152 LEU N N 15 130.970 0.3 . 1 . . . . . 152 LEU N . 27170 1 1664 . 1 1 153 153 ASP HA H 1 4.410 0.020 . 1 . . . . . 153 ASP HA . 27170 1 1665 . 1 1 153 153 ASP HB2 H 1 3.173 0.020 . 1 . . . . . 153 ASP HB2 . 27170 1 1666 . 1 1 153 153 ASP HB3 H 1 2.647 0.020 . 1 . . . . . 153 ASP HB3 . 27170 1 1667 . 1 1 153 153 ASP C C 13 174.074 0.3 . 1 . . . . . 153 ASP C . 27170 1 1668 . 1 1 153 153 ASP CA C 13 54.766 0.3 . 1 . . . . . 153 ASP CA . 27170 1 1669 . 1 1 153 153 ASP CB C 13 36.847 0.3 . 1 . . . . . 153 ASP CB . 27170 1 1670 . 1 1 154 154 LYS H H 1 7.434 0.020 . 1 . . . . . 154 LYS H . 27170 1 1671 . 1 1 154 154 LYS HA H 1 4.671 0.020 . 1 . . . . . 154 LYS HA . 27170 1 1672 . 1 1 154 154 LYS HB2 H 1 2.203 0.020 . 1 . . . . . 154 LYS HB2 . 27170 1 1673 . 1 1 154 154 LYS HB3 H 1 2.117 0.020 . 1 . . . . . 154 LYS HB3 . 27170 1 1674 . 1 1 154 154 LYS CA C 13 56.178 0.3 . 1 . . . . . 154 LYS CA . 27170 1 1675 . 1 1 154 154 LYS CB C 13 35.435 0.3 . 1 . . . . . 154 LYS CB . 27170 1 1676 . 1 1 154 154 LYS N N 15 112.677 0.3 . 1 . . . . . 154 LYS N . 27170 1 1677 . 1 1 155 155 LYS HA H 1 5.279 0.020 . 1 . . . . . 155 LYS HA . 27170 1 1678 . 1 1 155 155 LYS HB2 H 1 1.952 0.020 . 1 . . . . . 155 LYS HB2 . 27170 1 1679 . 1 1 155 155 LYS HB3 H 1 1.934 0.020 . 1 . . . . . 155 LYS HB3 . 27170 1 1680 . 1 1 155 155 LYS HG2 H 1 1.684 0.020 . 1 . . . . . 155 LYS HG2 . 27170 1 1681 . 1 1 155 155 LYS HG3 H 1 1.649 0.020 . 1 . . . . . 155 LYS HG3 . 27170 1 1682 . 1 1 155 155 LYS HD2 H 1 1.728 0.020 . 1 . . . . . 155 LYS HD2 . 27170 1 1683 . 1 1 155 155 LYS HD3 H 1 1.630 0.020 . 1 . . . . . 155 LYS HD3 . 27170 1 1684 . 1 1 155 155 LYS HE2 H 1 2.953 0.020 . 1 . . . . . 155 LYS HE2 . 27170 1 1685 . 1 1 155 155 LYS HE3 H 1 2.879 0.020 . 1 . . . . . 155 LYS HE3 . 27170 1 1686 . 1 1 155 155 LYS C C 13 177.816 0.3 . 1 . . . . . 155 LYS C . 27170 1 1687 . 1 1 155 155 LYS CA C 13 55.296 0.3 . 1 . . . . . 155 LYS CA . 27170 1 1688 . 1 1 155 155 LYS CB C 13 33.582 0.3 . 1 . . . . . 155 LYS CB . 27170 1 1689 . 1 1 156 156 GLU H H 1 8.235 0.020 . 1 . . . . . 156 GLU H . 27170 1 1690 . 1 1 156 156 GLU HA H 1 3.428 0.020 . 1 . . . . . 156 GLU HA . 27170 1 1691 . 1 1 156 156 GLU HB2 H 1 2.146 0.020 . 1 . . . . . 156 GLU HB2 . 27170 1 1692 . 1 1 156 156 GLU HB3 H 1 2.052 0.020 . 1 . . . . . 156 GLU HB3 . 27170 1 1693 . 1 1 156 156 GLU HG2 H 1 2.305 0.020 . 1 . . . . . 156 GLU HG2 . 27170 1 1694 . 1 1 156 156 GLU HG3 H 1 2.200 0.020 . 1 . . . . . 156 GLU HG3 . 27170 1 1695 . 1 1 156 156 GLU CA C 13 58.915 0.3 . 1 . . . . . 156 GLU CA . 27170 1 1696 . 1 1 156 156 GLU CB C 13 31.287 0.3 . 1 . . . . . 156 GLU CB . 27170 1 1697 . 1 1 156 156 GLU N N 15 121.567 0.3 . 1 . . . . . 156 GLU N . 27170 1 1698 . 1 1 157 157 TYR HA H 1 4.716 0.020 . 1 . . . . . 157 TYR HA . 27170 1 1699 . 1 1 157 157 TYR HB2 H 1 3.369 0.020 . 1 . . . . . 157 TYR HB2 . 27170 1 1700 . 1 1 157 157 TYR C C 13 174.940 0.3 . 1 . . . . . 157 TYR C . 27170 1 1701 . 1 1 157 157 TYR CA C 13 58.032 0.3 . 1 . . . . . 157 TYR CA . 27170 1 1702 . 1 1 157 157 TYR CB C 13 40.290 0.3 . 1 . . . . . 157 TYR CB . 27170 1 1703 . 1 1 158 158 ARG H H 1 8.883 0.020 . 1 . . . . . 158 ARG H . 27170 1 1704 . 1 1 158 158 ARG HA H 1 4.716 0.020 . 1 . . . . . 158 ARG HA . 27170 1 1705 . 1 1 158 158 ARG HB2 H 1 1.839 0.020 . 1 . . . . . 158 ARG HB2 . 27170 1 1706 . 1 1 158 158 ARG HB3 H 1 1.655 0.020 . 1 . . . . . 158 ARG HB3 . 27170 1 1707 . 1 1 158 158 ARG HG2 H 1 1.569 0.020 . 1 . . . . . 158 ARG HG2 . 27170 1 1708 . 1 1 158 158 ARG HG3 H 1 1.474 0.020 . 1 . . . . . 158 ARG HG3 . 27170 1 1709 . 1 1 158 158 ARG HD2 H 1 3.185 0.020 . 1 . . . . . 158 ARG HD2 . 27170 1 1710 . 1 1 158 158 ARG HD3 H 1 3.063 0.020 . 1 . . . . . 158 ARG HD3 . 27170 1 1711 . 1 1 158 158 ARG HE H 1 7.505 0.020 . 1 . . . . . 158 ARG HE . 27170 1 1712 . 1 1 158 158 ARG C C 13 176.568 0.3 . 1 . . . . . 158 ARG C . 27170 1 1713 . 1 1 158 158 ARG CA C 13 60.327 0.3 . 1 . . . . . 158 ARG CA . 27170 1 1714 . 1 1 158 158 ARG CB C 13 31.904 0.3 . 1 . . . . . 158 ARG CB . 27170 1 1715 . 1 1 158 158 ARG N N 15 124.719 0.3 . 1 . . . . . 158 ARG N . 27170 1 1716 . 1 1 159 159 LYS H H 1 7.807 0.020 . 1 . . . . . 159 LYS H . 27170 1 1717 . 1 1 159 159 LYS HA H 1 4.690 0.020 . 1 . . . . . 159 LYS HA . 27170 1 1718 . 1 1 159 159 LYS HB2 H 1 2.186 0.020 . 1 . . . . . 159 LYS HB2 . 27170 1 1719 . 1 1 159 159 LYS HB3 H 1 1.743 0.020 . 1 . . . . . 159 LYS HB3 . 27170 1 1720 . 1 1 159 159 LYS HG2 H 1 1.453 0.020 . 1 . . . . . 159 LYS HG2 . 27170 1 1721 . 1 1 159 159 LYS HG3 H 1 1.300 0.020 . 1 . . . . . 159 LYS HG3 . 27170 1 1722 . 1 1 159 159 LYS HD2 H 1 1.576 0.020 . 1 . . . . . 159 LYS HD2 . 27170 1 1723 . 1 1 159 159 LYS HD3 H 1 1.519 0.020 . 1 . . . . . 159 LYS HD3 . 27170 1 1724 . 1 1 159 159 LYS HE2 H 1 3.173 0.020 . 1 . . . . . 159 LYS HE2 . 27170 1 1725 . 1 1 159 159 LYS HE3 H 1 2.815 0.020 . 1 . . . . . 159 LYS HE3 . 27170 1 1726 . 1 1 159 159 LYS CA C 13 54.501 0.3 . 1 . . . . . 159 LYS CA . 27170 1 1727 . 1 1 159 159 LYS CB C 13 31.375 0.3 . 1 . . . . . 159 LYS CB . 27170 1 1728 . 1 1 159 159 LYS N N 15 113.631 0.3 . 1 . . . . . 159 LYS N . 27170 1 1729 . 1 1 160 160 PRO HA H 1 4.655 0.020 . 1 . . . . . 160 PRO HA . 27170 1 1730 . 1 1 160 160 PRO HB2 H 1 1.640 0.020 . 1 . . . . . 160 PRO HB2 . 27170 1 1731 . 1 1 160 160 PRO HB3 H 1 1.366 0.020 . 1 . . . . . 160 PRO HB3 . 27170 1 1732 . 1 1 160 160 PRO HG2 H 1 1.802 0.020 . 1 . . . . . 160 PRO HG2 . 27170 1 1733 . 1 1 160 160 PRO HG3 H 1 1.667 0.020 . 1 . . . . . 160 PRO HG3 . 27170 1 1734 . 1 1 160 160 PRO C C 13 178.052 0.3 . 1 . . . . . 160 PRO C . 27170 1 1735 . 1 1 160 160 PRO CA C 13 64.384 0.3 . 1 . . . . . 160 PRO CA . 27170 1 1736 . 1 1 160 160 PRO CB C 13 31.993 0.3 . 1 . . . . . 160 PRO CB . 27170 1 1737 . 1 1 160 160 PRO CG C 13 27.127 0.3 . 1 . . . . . 160 PRO CG . 27170 1 1738 . 1 1 160 160 PRO CD C 13 47.570 0.3 . 1 . . . . . 160 PRO CD . 27170 1 1739 . 1 1 161 161 ILE H H 1 6.999 0.020 . 1 . . . . . 161 ILE H . 27170 1 1740 . 1 1 161 161 ILE HA H 1 4.104 0.020 . 1 . . . . . 161 ILE HA . 27170 1 1741 . 1 1 161 161 ILE HB H 1 1.585 0.020 . 1 . . . . . 161 ILE HB . 27170 1 1742 . 1 1 161 161 ILE HG12 H 1 1.571 0.020 . 1 . . . . . 161 ILE HG12 . 27170 1 1743 . 1 1 161 161 ILE HG13 H 1 1.542 0.020 . 1 . . . . . 161 ILE HG13 . 27170 1 1744 . 1 1 161 161 ILE HG21 H 1 0.893 0.020 . 1 . . . . . 161 ILE HG2 . 27170 1 1745 . 1 1 161 161 ILE HG22 H 1 0.893 0.020 . 1 . . . . . 161 ILE HG2 . 27170 1 1746 . 1 1 161 161 ILE HG23 H 1 0.893 0.020 . 1 . . . . . 161 ILE HG2 . 27170 1 1747 . 1 1 161 161 ILE HD11 H 1 0.868 0.020 . 1 . . . . . 161 ILE HD1 . 27170 1 1748 . 1 1 161 161 ILE HD12 H 1 0.868 0.020 . 1 . . . . . 161 ILE HD1 . 27170 1 1749 . 1 1 161 161 ILE HD13 H 1 0.868 0.020 . 1 . . . . . 161 ILE HD1 . 27170 1 1750 . 1 1 161 161 ILE C C 13 178.827 0.3 . 1 . . . . . 161 ILE C . 27170 1 1751 . 1 1 161 161 ILE CA C 13 61.651 0.3 . 1 . . . . . 161 ILE CA . 27170 1 1752 . 1 1 161 161 ILE CB C 13 38.172 0.3 . 1 . . . . . 161 ILE CB . 27170 1 1753 . 1 1 161 161 ILE CG1 C 13 29.670 0.3 . 1 . . . . . 161 ILE CG1 . 27170 1 1754 . 1 1 161 161 ILE CG2 C 13 18.930 0.3 . 1 . . . . . 161 ILE CG2 . 27170 1 1755 . 1 1 161 161 ILE CD1 C 13 15.961 0.3 . 1 . . . . . 161 ILE CD1 . 27170 1 1756 . 1 1 161 161 ILE N N 15 113.858 0.3 . 1 . . . . . 161 ILE N . 27170 1 1757 . 1 1 162 162 ASP H H 1 8.096 0.020 . 1 . . . . . 162 ASP H . 27170 1 1758 . 1 1 162 162 ASP HA H 1 4.495 0.020 . 1 . . . . . 162 ASP HA . 27170 1 1759 . 1 1 162 162 ASP HB2 H 1 3.173 0.020 . 1 . . . . . 162 ASP HB2 . 27170 1 1760 . 1 1 162 162 ASP HB3 H 1 2.989 0.020 . 1 . . . . . 162 ASP HB3 . 27170 1 1761 . 1 1 162 162 ASP C C 13 178.827 0.3 . 1 . . . . . 162 ASP C . 27170 1 1762 . 1 1 162 162 ASP CA C 13 58.120 0.3 . 1 . . . . . 162 ASP CA . 27170 1 1763 . 1 1 162 162 ASP CB C 13 41.967 0.3 . 1 . . . . . 162 ASP CB . 27170 1 1764 . 1 1 162 162 ASP N N 15 123.918 0.3 . 1 . . . . . 162 ASP N . 27170 1 1765 . 1 1 163 163 TRP H H 1 7.535 0.020 . 1 . . . . . 163 TRP H . 27170 1 1766 . 1 1 163 163 TRP HA H 1 5.242 0.020 . 1 . . . . . 163 TRP HA . 27170 1 1767 . 1 1 163 163 TRP HB2 H 1 3.198 0.020 . 1 . . . . . 163 TRP HB2 . 27170 1 1768 . 1 1 163 163 TRP HB3 H 1 2.414 0.020 . 1 . . . . . 163 TRP HB3 . 27170 1 1769 . 1 1 163 163 TRP HD1 H 1 7.066 0.020 . 1 . . . . . 163 TRP HD1 . 27170 1 1770 . 1 1 163 163 TRP HE1 H 1 9.935 0.020 . 1 . . . . . 163 TRP HE1 . 27170 1 1771 . 1 1 163 163 TRP HE3 H 1 7.026 0.020 . 1 . . . . . 163 TRP HE3 . 27170 1 1772 . 1 1 163 163 TRP HZ2 H 1 6.979 0.020 . 1 . . . . . 163 TRP HZ2 . 27170 1 1773 . 1 1 163 163 TRP HZ3 H 1 6.957 0.020 . 1 . . . . . 163 TRP HZ3 . 27170 1 1774 . 1 1 163 163 TRP HH2 H 1 6.891 0.020 . 1 . . . . . 163 TRP HH2 . 27170 1 1775 . 1 1 163 163 TRP C C 13 175.894 0.3 . 1 . . . . . 163 TRP C . 27170 1 1776 . 1 1 163 163 TRP CA C 13 57.944 0.3 . 1 . . . . . 163 TRP CA . 27170 1 1777 . 1 1 163 163 TRP CB C 13 27.579 0.3 . 1 . . . . . 163 TRP CB . 27170 1 1778 . 1 1 163 163 TRP N N 15 116.720 0.3 . 1 . . . . . 163 TRP N . 27170 1 1779 . 1 1 163 163 TRP NE1 N 15 130.322 0.3 . 1 . . . . . 163 TRP NE1 . 27170 1 1780 . 1 1 164 164 GLY H H 1 7.723 0.020 . 1 . . . . . 164 GLY H . 27170 1 1781 . 1 1 164 164 GLY HA2 H 1 4.483 0.020 . 1 . . . . . 164 GLY HA2 . 27170 1 1782 . 1 1 164 164 GLY HA3 H 1 3.700 0.020 . 1 . . . . . 164 GLY HA3 . 27170 1 1783 . 1 1 164 164 GLY C C 13 174.175 0.3 . 1 . . . . . 164 GLY C . 27170 1 1784 . 1 1 164 164 GLY CA C 13 45.939 0.3 . 1 . . . . . 164 GLY CA . 27170 1 1785 . 1 1 164 164 GLY N N 15 107.926 0.3 . 1 . . . . . 164 GLY N . 27170 1 1786 . 1 1 165 165 ALA H H 1 7.024 0.020 . 1 . . . . . 165 ALA H . 27170 1 1787 . 1 1 165 165 ALA HA H 1 4.410 0.020 . 1 . . . . . 165 ALA HA . 27170 1 1788 . 1 1 165 165 ALA HB1 H 1 1.275 0.020 . 1 . . . . . 165 ALA HB . 27170 1 1789 . 1 1 165 165 ALA HB2 H 1 1.275 0.020 . 1 . . . . . 165 ALA HB . 27170 1 1790 . 1 1 165 165 ALA HB3 H 1 1.275 0.020 . 1 . . . . . 165 ALA HB . 27170 1 1791 . 1 1 165 165 ALA C C 13 176.467 0.3 . 1 . . . . . 165 ALA C . 27170 1 1792 . 1 1 165 165 ALA CA C 13 51.853 0.3 . 1 . . . . . 165 ALA CA . 27170 1 1793 . 1 1 165 165 ALA CB C 13 23.607 0.3 . 1 . . . . . 165 ALA CB . 27170 1 1794 . 1 1 165 165 ALA N N 15 123.829 0.3 . 1 . . . . . 165 ALA N . 27170 1 1795 . 1 1 166 166 ALA H H 1 8.540 0.020 . 1 . . . . . 166 ALA H . 27170 1 1796 . 1 1 166 166 ALA HA H 1 4.116 0.020 . 1 . . . . . 166 ALA HA . 27170 1 1797 . 1 1 166 166 ALA HB1 H 1 1.349 0.020 . 1 . . . . . 166 ALA HB . 27170 1 1798 . 1 1 166 166 ALA HB2 H 1 1.349 0.020 . 1 . . . . . 166 ALA HB . 27170 1 1799 . 1 1 166 166 ALA HB3 H 1 1.349 0.020 . 1 . . . . . 166 ALA HB . 27170 1 1800 . 1 1 166 166 ALA C C 13 176.467 0.3 . 1 . . . . . 166 ALA C . 27170 1 1801 . 1 1 166 166 ALA CA C 13 52.471 0.3 . 1 . . . . . 166 ALA CA . 27170 1 1802 . 1 1 166 166 ALA CB C 13 18.157 0.3 . 1 . . . . . 166 ALA CB . 27170 1 1803 . 1 1 166 166 ALA N N 15 121.606 0.3 . 1 . . . . . 166 ALA N . 27170 1 1804 . 1 1 167 167 SER H H 1 7.550 0.020 . 1 . . . . . 167 SER H . 27170 1 1805 . 1 1 167 167 SER HA H 1 4.739 0.020 . 1 . . . . . 167 SER HA . 27170 1 1806 . 1 1 167 167 SER HB2 H 1 3.684 0.020 . 1 . . . . . 167 SER HB2 . 27170 1 1807 . 1 1 167 167 SER HB3 H 1 3.556 0.020 . 1 . . . . . 167 SER HB3 . 27170 1 1808 . 1 1 167 167 SER CA C 13 56.002 0.3 . 1 . . . . . 167 SER CA . 27170 1 1809 . 1 1 167 167 SER CB C 13 65.799 0.3 . 1 . . . . . 167 SER CB . 27170 1 1810 . 1 1 167 167 SER N N 15 113.921 0.3 . 1 . . . . . 167 SER N . 27170 1 1811 . 1 1 168 168 PRO HA H 1 4.508 0.020 . 1 . . . . . 168 PRO HA . 27170 1 1812 . 1 1 168 168 PRO HB2 H 1 1.546 0.020 . 1 . . . . . 168 PRO HB2 . 27170 1 1813 . 1 1 168 168 PRO HB3 H 1 1.087 0.020 . 1 . . . . . 168 PRO HB3 . 27170 1 1814 . 1 1 168 168 PRO HG2 H 1 1.581 0.020 . 1 . . . . . 168 PRO HG2 . 27170 1 1815 . 1 1 168 168 PRO HG3 H 1 1.498 0.020 . 1 . . . . . 168 PRO HG3 . 27170 1 1816 . 1 1 168 168 PRO HD2 H 1 3.993 0.020 . 1 . . . . . 168 PRO HD2 . 27170 1 1817 . 1 1 168 168 PRO HD3 H 1 3.847 0.020 . 1 . . . . . 168 PRO HD3 . 27170 1 1818 . 1 1 168 168 PRO C C 13 174.804 0.3 . 1 . . . . . 168 PRO C . 27170 1 1819 . 1 1 168 168 PRO CA C 13 63.684 0.3 . 1 . . . . . 168 PRO CA . 27170 1 1820 . 1 1 168 168 PRO CB C 13 31.025 0.3 . 1 . . . . . 168 PRO CB . 27170 1 1821 . 1 1 168 168 PRO CG C 13 27.598 0.3 . 1 . . . . . 168 PRO CG . 27170 1 1822 . 1 1 168 168 PRO CD C 13 49.548 0.3 . 1 . . . . . 168 PRO CD . 27170 1 1823 . 1 1 169 169 ALA H H 1 7.337 0.020 . 1 . . . . . 169 ALA H . 27170 1 1824 . 1 1 169 169 ALA HA H 1 4.397 0.020 . 1 . . . . . 169 ALA HA . 27170 1 1825 . 1 1 169 169 ALA HB1 H 1 1.349 0.020 . 1 . . . . . 169 ALA HB . 27170 1 1826 . 1 1 169 169 ALA HB2 H 1 1.349 0.020 . 1 . . . . . 169 ALA HB . 27170 1 1827 . 1 1 169 169 ALA HB3 H 1 1.349 0.020 . 1 . . . . . 169 ALA HB . 27170 1 1828 . 1 1 169 169 ALA C C 13 176.130 0.3 . 1 . . . . . 169 ALA C . 27170 1 1829 . 1 1 169 169 ALA CA C 13 54.416 0.3 . 1 . . . . . 169 ALA CA . 27170 1 1830 . 1 1 169 169 ALA CB C 13 18.745 0.3 . 1 . . . . . 169 ALA CB . 27170 1 1831 . 1 1 169 169 ALA N N 15 123.251 0.3 . 1 . . . . . 169 ALA N . 27170 1 1832 . 1 1 170 170 VAL H H 1 7.211 0.020 . 1 . . . . . 170 VAL H . 27170 1 1833 . 1 1 170 170 VAL HA H 1 4.361 0.020 . 1 . . . . . 170 VAL HA . 27170 1 1834 . 1 1 170 170 VAL HB H 1 1.508 0.020 . 1 . . . . . 170 VAL HB . 27170 1 1835 . 1 1 170 170 VAL HG11 H 1 0.737 0.020 . 1 . . . . . 170 VAL HG1 . 27170 1 1836 . 1 1 170 170 VAL HG12 H 1 0.737 0.020 . 1 . . . . . 170 VAL HG1 . 27170 1 1837 . 1 1 170 170 VAL HG13 H 1 0.737 0.020 . 1 . . . . . 170 VAL HG1 . 27170 1 1838 . 1 1 170 170 VAL HG21 H 1 0.713 0.020 . 1 . . . . . 170 VAL HG2 . 27170 1 1839 . 1 1 170 170 VAL HG22 H 1 0.713 0.020 . 1 . . . . . 170 VAL HG2 . 27170 1 1840 . 1 1 170 170 VAL HG23 H 1 0.713 0.020 . 1 . . . . . 170 VAL HG2 . 27170 1 1841 . 1 1 170 170 VAL C C 13 175.591 0.3 . 1 . . . . . 170 VAL C . 27170 1 1842 . 1 1 170 170 VAL CA C 13 63.063 0.3 . 1 . . . . . 170 VAL CA . 27170 1 1843 . 1 1 170 170 VAL CB C 13 36.406 0.3 . 1 . . . . . 170 VAL CB . 27170 1 1844 . 1 1 170 170 VAL CG1 C 13 22.667 0.3 . 1 . . . . . 170 VAL CG1 . 27170 1 1845 . 1 1 170 170 VAL CG2 C 13 21.567 0.3 . 1 . . . . . 170 VAL CG2 . 27170 1 1846 . 1 1 170 170 VAL N N 15 126.102 0.3 . 1 . . . . . 170 VAL N . 27170 1 1847 . 1 1 171 171 GLN H H 1 8.395 0.020 . 1 . . . . . 171 GLN H . 27170 1 1848 . 1 1 171 171 GLN HA H 1 4.667 0.020 . 1 . . . . . 171 GLN HA . 27170 1 1849 . 1 1 171 171 GLN HB2 H 1 2.324 0.020 . 1 . . . . . 171 GLN HB2 . 27170 1 1850 . 1 1 171 171 GLN HB3 H 1 1.368 0.020 . 1 . . . . . 171 GLN HB3 . 27170 1 1851 . 1 1 171 171 GLN HG2 H 1 2.344 0.020 . 1 . . . . . 171 GLN HG2 . 27170 1 1852 . 1 1 171 171 GLN HG3 H 1 2.285 0.020 . 1 . . . . . 171 GLN HG3 . 27170 1 1853 . 1 1 171 171 GLN HE21 H 1 7.610 0.020 . 1 . . . . . 171 GLN HE21 . 27170 1 1854 . 1 1 171 171 GLN HE22 H 1 6.985 0.020 . 1 . . . . . 171 GLN HE22 . 27170 1 1855 . 1 1 171 171 GLN C C 13 175.523 0.3 . 1 . . . . . 171 GLN C . 27170 1 1856 . 1 1 171 171 GLN CA C 13 56.090 0.3 . 1 . . . . . 171 GLN CA . 27170 1 1857 . 1 1 171 171 GLN CB C 13 34.464 0.3 . 1 . . . . . 171 GLN CB . 27170 1 1858 . 1 1 171 171 GLN CG C 13 34.147 0.3 . 1 . . . . . 171 GLN CG . 27170 1 1859 . 1 1 171 171 GLN N N 15 118.607 0.3 . 1 . . . . . 171 GLN N . 27170 1 1860 . 1 1 171 171 GLN NE2 N 15 114.302 0.3 . 1 . . . . . 171 GLN NE2 . 27170 1 1861 . 1 1 172 172 SER H H 1 8.252 0.020 . 1 . . . . . 172 SER H . 27170 1 1862 . 1 1 172 172 SER HA H 1 4.446 0.020 . 1 . . . . . 172 SER HA . 27170 1 1863 . 1 1 172 172 SER HB2 H 1 4.140 0.020 . 1 . . . . . 172 SER HB2 . 27170 1 1864 . 1 1 172 172 SER HB3 H 1 4.095 0.020 . 1 . . . . . 172 SER HB3 . 27170 1 1865 . 1 1 172 172 SER C C 13 172.827 0.3 . 1 . . . . . 172 SER C . 27170 1 1866 . 1 1 172 172 SER CA C 13 59.709 0.3 . 1 . . . . . 172 SER CA . 27170 1 1867 . 1 1 172 172 SER CB C 13 66.594 0.3 . 1 . . . . . 172 SER CB . 27170 1 1868 . 1 1 172 172 SER N N 15 111.897 0.3 . 1 . . . . . 172 SER N . 27170 1 1869 . 1 1 173 173 PHE H H 1 8.830 0.020 . 1 . . . . . 173 PHE H . 27170 1 1870 . 1 1 173 173 PHE HA H 1 6.283 0.020 . 1 . . . . . 173 PHE HA . 27170 1 1871 . 1 1 173 173 PHE HB2 H 1 3.626 0.020 . 1 . . . . . 173 PHE HB2 . 27170 1 1872 . 1 1 173 173 PHE HB3 H 1 3.418 0.020 . 1 . . . . . 173 PHE HB3 . 27170 1 1873 . 1 1 173 173 PHE HD1 H 1 6.586 0.020 . 1 . . . . . 173 PHE HD1 . 27170 1 1874 . 1 1 173 173 PHE HE1 H 1 7.114 0.020 . 1 . . . . . 173 PHE HE1 . 27170 1 1875 . 1 1 173 173 PHE HZ H 1 6.669 0.020 . 1 . . . . . 173 PHE HZ . 27170 1 1876 . 1 1 173 173 PHE C C 13 174.276 0.3 . 1 . . . . . 173 PHE C . 27170 1 1877 . 1 1 173 173 PHE CA C 13 57.502 0.3 . 1 . . . . . 173 PHE CA . 27170 1 1878 . 1 1 173 173 PHE CB C 13 43.997 0.3 . 1 . . . . . 173 PHE CB . 27170 1 1879 . 1 1 173 173 PHE N N 15 111.583 0.3 . 1 . . . . . 173 PHE N . 27170 1 1880 . 1 1 174 174 ARG H H 1 9.458 0.020 . 1 . . . . . 174 ARG H . 27170 1 1881 . 1 1 174 174 ARG HA H 1 5.132 0.020 . 1 . . . . . 174 ARG HA . 27170 1 1882 . 1 1 174 174 ARG HB2 H 1 1.68 0.020 . 1 . . . . . 174 ARG HB2 . 27170 1 1883 . 1 1 174 174 ARG HB3 H 1 1.60 0.020 . 1 . . . . . 174 ARG HB3 . 27170 1 1884 . 1 1 174 174 ARG HG2 H 1 1.386 0.020 . 1 . . . . . 174 ARG HG2 . 27170 1 1885 . 1 1 174 174 ARG HG3 H 1 1.362 0.020 . 1 . . . . . 174 ARG HG3 . 27170 1 1886 . 1 1 174 174 ARG HD2 H 1 3.308 0.020 . 1 . . . . . 174 ARG HD2 . 27170 1 1887 . 1 1 174 174 ARG HD3 H 1 2.965 0.020 . 1 . . . . . 174 ARG HD3 . 27170 1 1888 . 1 1 174 174 ARG HE H 1 6.689 0.020 . 1 . . . . . 174 ARG HE . 27170 1 1889 . 1 1 174 174 ARG C C 13 173.804 0.3 . 1 . . . . . 174 ARG C . 27170 1 1890 . 1 1 174 174 ARG CA C 13 55.472 0.3 . 1 . . . . . 174 ARG CA . 27170 1 1891 . 1 1 174 174 ARG CB C 13 35.082 0.3 . 1 . . . . . 174 ARG CB . 27170 1 1892 . 1 1 174 174 ARG CG C 13 25.93 0.3 . 1 . . . . . 174 ARG CG . 27170 1 1893 . 1 1 174 174 ARG N N 15 116.041 0.3 . 1 . . . . . 174 ARG N . 27170 1 1894 . 1 1 175 175 ARG H H 1 8.381 0.020 . 1 . . . . . 175 ARG H . 27170 1 1895 . 1 1 175 175 ARG HA H 1 3.479 0.020 . 1 . . . . . 175 ARG HA . 27170 1 1896 . 1 1 175 175 ARG HB2 H 1 1.501 0.020 . 1 . . . . . 175 ARG HB2 . 27170 1 1897 . 1 1 175 175 ARG HB3 H 1 1.392 0.020 . 1 . . . . . 175 ARG HB3 . 27170 1 1898 . 1 1 175 175 ARG HG2 H 1 1.247 0.020 . 1 . . . . . 175 ARG HG2 . 27170 1 1899 . 1 1 175 175 ARG HG3 H 1 1.221 0.020 . 1 . . . . . 175 ARG HG3 . 27170 1 1900 . 1 1 175 175 ARG HE H 1 6.747 0.020 . 1 . . . . . 175 ARG HE . 27170 1 1901 . 1 1 175 175 ARG C C 13 173.804 0.3 . 1 . . . . . 175 ARG C . 27170 1 1902 . 1 1 175 175 ARG CA C 13 54.854 0.3 . 1 . . . . . 175 ARG CA . 27170 1 1903 . 1 1 175 175 ARG CB C 13 34.288 0.3 . 1 . . . . . 175 ARG CB . 27170 1 1904 . 1 1 175 175 ARG CG C 13 24.300 0.3 . 1 . . . . . 175 ARG CG . 27170 1 1905 . 1 1 175 175 ARG CD C 13 41.446 0.3 . 1 . . . . . 175 ARG CD . 27170 1 1906 . 1 1 175 175 ARG N N 15 121.806 0.3 . 1 . . . . . 175 ARG N . 27170 1 1907 . 1 1 176 176 ILE H H 1 7.808 0.020 . 1 . . . . . 176 ILE H . 27170 1 1908 . 1 1 176 176 ILE HA H 1 4.667 0.020 . 1 . . . . . 176 ILE HA . 27170 1 1909 . 1 1 176 176 ILE HB H 1 1.197 0.020 . 1 . . . . . 176 ILE HB . 27170 1 1910 . 1 1 176 176 ILE HG12 H 1 1.343 0.020 . 1 . . . . . 176 ILE HG12 . 27170 1 1911 . 1 1 176 176 ILE HG13 H 1 1.292 0.020 . 1 . . . . . 176 ILE HG13 . 27170 1 1912 . 1 1 176 176 ILE HG21 H 1 0.908 0.020 . 1 . . . . . 176 ILE HG2 . 27170 1 1913 . 1 1 176 176 ILE HG22 H 1 0.908 0.020 . 1 . . . . . 176 ILE HG2 . 27170 1 1914 . 1 1 176 176 ILE HG23 H 1 0.908 0.020 . 1 . . . . . 176 ILE HG2 . 27170 1 1915 . 1 1 176 176 ILE HD11 H 1 0.738 0.020 . 1 . . . . . 176 ILE HD1 . 27170 1 1916 . 1 1 176 176 ILE HD12 H 1 0.738 0.020 . 1 . . . . . 176 ILE HD1 . 27170 1 1917 . 1 1 176 176 ILE HD13 H 1 0.738 0.020 . 1 . . . . . 176 ILE HD1 . 27170 1 1918 . 1 1 176 176 ILE C C 13 174.276 0.3 . 1 . . . . . 176 ILE C . 27170 1 1919 . 1 1 176 176 ILE CA C 13 63.416 0.3 . 1 . . . . . 176 ILE CA . 27170 1 1920 . 1 1 176 176 ILE CB C 13 36.847 0.3 . 1 . . . . . 176 ILE CB . 27170 1 1921 . 1 1 176 176 ILE CG1 C 13 27.786 0.3 . 1 . . . . . 176 ILE CG1 . 27170 1 1922 . 1 1 176 176 ILE N N 15 121.215 0.3 . 1 . . . . . 176 ILE N . 27170 1 1923 . 1 1 177 177 VAL H H 1 7.841 0.020 . 1 . . . . . 177 VAL H . 27170 1 1924 . 1 1 177 177 VAL HA H 1 4.189 0.020 . 1 . . . . . 177 VAL HA . 27170 1 1925 . 1 1 177 177 VAL HB H 1 2.377 0.020 . 1 . . . . . 177 VAL HB . 27170 1 1926 . 1 1 177 177 VAL HG11 H 1 0.651 0.020 . 1 . . . . . 177 VAL HG1 . 27170 1 1927 . 1 1 177 177 VAL HG12 H 1 0.651 0.020 . 1 . . . . . 177 VAL HG1 . 27170 1 1928 . 1 1 177 177 VAL HG13 H 1 0.651 0.020 . 1 . . . . . 177 VAL HG1 . 27170 1 1929 . 1 1 177 177 VAL HG21 H 1 0.577 0.020 . 1 . . . . . 177 VAL HG2 . 27170 1 1930 . 1 1 177 177 VAL HG22 H 1 0.577 0.020 . 1 . . . . . 177 VAL HG2 . 27170 1 1931 . 1 1 177 177 VAL HG23 H 1 0.577 0.020 . 1 . . . . . 177 VAL HG2 . 27170 1 1932 . 1 1 177 177 VAL C C 13 176.434 0.3 . 1 . . . . . 177 VAL C . 27170 1 1933 . 1 1 177 177 VAL CA C 13 58.297 0.3 . 1 . . . . . 177 VAL CA . 27170 1 1934 . 1 1 177 177 VAL CB C 13 31.816 0.3 . 1 . . . . . 177 VAL CB . 27170 1 1935 . 1 1 177 177 VAL CG1 C 13 24.489 0.3 . 1 . . . . . 177 VAL CG1 . 27170 1 1936 . 1 1 177 177 VAL CG2 C 13 22.604 0.3 . 1 . . . . . 177 VAL CG2 . 27170 1 1937 . 1 1 177 177 VAL N N 15 125.681 0.3 . 1 . . . . . 177 VAL N . 27170 1 1938 . 1 1 178 178 GLU H H 1 8.465 0.020 . 1 . . . . . 178 GLU H . 27170 1 1939 . 1 1 178 178 GLU HA H 1 4.165 0.020 . 1 . . . . . 178 GLU HA . 27170 1 1940 . 1 1 178 178 GLU HB2 H 1 1.692 0.020 . 1 . . . . . 178 GLU HB2 . 27170 1 1941 . 1 1 178 178 GLU HB3 H 1 1.504 0.020 . 1 . . . . . 178 GLU HB3 . 27170 1 1942 . 1 1 178 178 GLU HG2 H 1 2.100 0.020 . 1 . . . . . 178 GLU HG2 . 27170 1 1943 . 1 1 178 178 GLU HG3 H 1 1.862 0.020 . 1 . . . . . 178 GLU HG3 . 27170 1 1944 . 1 1 178 178 GLU CA C 13 57.414 0.3 . 1 . . . . . 178 GLU CA . 27170 1 1945 . 1 1 178 178 GLU CB C 13 32.434 0.3 . 1 . . . . . 178 GLU CB . 27170 1 1946 . 1 1 178 178 GLU N N 15 128.140 0.3 . 1 . . . . . 178 GLU N . 27170 1 stop_ save_