data_34461 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34461 _Entry.Title ; Solution structure and 1H, 13C and 15N chemical shift assignments for the complex of VPS29 with VARP 687-747 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-11-29 _Entry.Accession_date 2019-11-29 _Entry.Last_release_date 2020-01-07 _Entry.Original_release_date 2020-01-07 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _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_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 34461 stop_ 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 D. Owen D. J. . . 34461 2 D. Neuhaus D. . . . 34461 3 J.C. Yang J. . . . 34461 4 H. Crawley-Snowdon H. . . . 34461 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'INTRACELLULAR VESICLE TRAFFICKING' . 34461 'NMR complex structure' . 34461 VARP . 34461 'Zinc finger' . 34461 endosome . 34461 retromer . 34461 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34461 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 749 34461 '15N chemical shifts' 239 34461 '1H chemical shifts' 1447 34461 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2020-10-16 . original BMRB . 34461 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6TL0 . 34461 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34461 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 33024112 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Mechanism and evolution of the Zn-fingernail required for interaction of VARP with VPS29 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 11 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _Citation.Journal_CSD 0353 _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 5031 _Citation.Page_last 5031 _Citation.Year 2020 _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 Harriet Crawley-Snowdon H. . . . 34461 1 2 Ji-Chun Yang J. C. . . 34461 1 3 Nathan Zaccai N. R. . . 34461 1 4 Luther Davis L. J. . . 34461 1 5 Lena Wartosch L. . . . 34461 1 6 Emily Herman E. K. . . 34461 1 7 Nicholas Bright N. A. . . 34461 1 8 James Swarbrick J. S. . . 34461 1 9 Brett Collins B. M. . . 34461 1 10 Lauren Jackson L. P. . . 34461 1 11 Matthew Seaman . . . . 34461 1 12 'J Paul' Luzio J. P. . . 34461 1 13 Joel Dacks J. B. . . 34461 1 14 David Neuhaus D. . . . 34461 1 15 David Owen D. J. . . 34461 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34461 _Assembly.ID 1 _Assembly.Name 'Vacuolar protein sorting-associated protein 29, Ankyrin repeat domain-containing protein 27' _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 entity_1 1 $entity_1 A A yes . . . . . . 34461 1 2 entity_2 2 $entity_2 B B yes . . . . . . 34461 1 3 entity_3 3 $entity_ZN C C no . . . . . . 34461 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 coordination single . 2 . 2 CYS 25 25 SG . 3 . 3 ZN 1 1 ZN . . . . . . . . . . . . 34461 1 2 coordination single . 2 . 2 CYS 29 29 SG . 3 . 3 ZN 1 1 ZN . . . . . . . . . . . . 34461 1 3 coordination single . 2 . 2 CYS 31 31 SG . 3 . 3 ZN 1 1 ZN . . . . . . . . . . . . 34461 1 4 coordination single . 2 . 2 CYS 34 34 SG . 3 . 3 ZN 1 1 ZN . . . . . . . . . . . . 34461 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34461 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSPEFGTRDRMLVLVLGDLH IPHRCNSLPAKFKKLLVPGK IQHILCTGNLCTKESYDYLK TLAGDVHIVRGDFDENLNYP EQKVVTVGQFKIGLIHGHQV IPWGDMASLALLQRQFDVDI LISGHTHKFEAFEHENKFYI NPGSATGAYNALETNIIPSF VLMDIQASTVVTYVYQLIGD DVKVERIEYKKS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 192 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 21626.832 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Vesicle protein sorting 29' na 34461 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -9 GLY . 34461 1 2 -8 SER . 34461 1 3 -7 PRO . 34461 1 4 -6 GLU . 34461 1 5 -5 PHE . 34461 1 6 -4 GLY . 34461 1 7 -3 THR . 34461 1 8 -2 ARG . 34461 1 9 -1 ASP . 34461 1 10 0 ARG . 34461 1 11 1 MET . 34461 1 12 2 LEU . 34461 1 13 3 VAL . 34461 1 14 4 LEU . 34461 1 15 5 VAL . 34461 1 16 6 LEU . 34461 1 17 7 GLY . 34461 1 18 8 ASP . 34461 1 19 9 LEU . 34461 1 20 10 HIS . 34461 1 21 11 ILE . 34461 1 22 12 PRO . 34461 1 23 13 HIS . 34461 1 24 14 ARG . 34461 1 25 15 CYS . 34461 1 26 16 ASN . 34461 1 27 17 SER . 34461 1 28 18 LEU . 34461 1 29 19 PRO . 34461 1 30 20 ALA . 34461 1 31 21 LYS . 34461 1 32 22 PHE . 34461 1 33 23 LYS . 34461 1 34 24 LYS . 34461 1 35 25 LEU . 34461 1 36 26 LEU . 34461 1 37 27 VAL . 34461 1 38 28 PRO . 34461 1 39 29 GLY . 34461 1 40 30 LYS . 34461 1 41 31 ILE . 34461 1 42 32 GLN . 34461 1 43 33 HIS . 34461 1 44 34 ILE . 34461 1 45 35 LEU . 34461 1 46 36 CYS . 34461 1 47 37 THR . 34461 1 48 38 GLY . 34461 1 49 39 ASN . 34461 1 50 40 LEU . 34461 1 51 41 CYS . 34461 1 52 42 THR . 34461 1 53 43 LYS . 34461 1 54 44 GLU . 34461 1 55 45 SER . 34461 1 56 46 TYR . 34461 1 57 47 ASP . 34461 1 58 48 TYR . 34461 1 59 49 LEU . 34461 1 60 50 LYS . 34461 1 61 51 THR . 34461 1 62 52 LEU . 34461 1 63 53 ALA . 34461 1 64 54 GLY . 34461 1 65 55 ASP . 34461 1 66 56 VAL . 34461 1 67 57 HIS . 34461 1 68 58 ILE . 34461 1 69 59 VAL . 34461 1 70 60 ARG . 34461 1 71 61 GLY . 34461 1 72 62 ASP . 34461 1 73 63 PHE . 34461 1 74 64 ASP . 34461 1 75 65 GLU . 34461 1 76 66 ASN . 34461 1 77 67 LEU . 34461 1 78 68 ASN . 34461 1 79 69 TYR . 34461 1 80 70 PRO . 34461 1 81 71 GLU . 34461 1 82 72 GLN . 34461 1 83 73 LYS . 34461 1 84 74 VAL . 34461 1 85 75 VAL . 34461 1 86 76 THR . 34461 1 87 77 VAL . 34461 1 88 78 GLY . 34461 1 89 79 GLN . 34461 1 90 80 PHE . 34461 1 91 81 LYS . 34461 1 92 82 ILE . 34461 1 93 83 GLY . 34461 1 94 84 LEU . 34461 1 95 85 ILE . 34461 1 96 86 HIS . 34461 1 97 87 GLY . 34461 1 98 88 HIS . 34461 1 99 89 GLN . 34461 1 100 90 VAL . 34461 1 101 91 ILE . 34461 1 102 92 PRO . 34461 1 103 93 TRP . 34461 1 104 94 GLY . 34461 1 105 95 ASP . 34461 1 106 96 MET . 34461 1 107 97 ALA . 34461 1 108 98 SER . 34461 1 109 99 LEU . 34461 1 110 100 ALA . 34461 1 111 101 LEU . 34461 1 112 102 LEU . 34461 1 113 103 GLN . 34461 1 114 104 ARG . 34461 1 115 105 GLN . 34461 1 116 106 PHE . 34461 1 117 107 ASP . 34461 1 118 108 VAL . 34461 1 119 109 ASP . 34461 1 120 110 ILE . 34461 1 121 111 LEU . 34461 1 122 112 ILE . 34461 1 123 113 SER . 34461 1 124 114 GLY . 34461 1 125 115 HIS . 34461 1 126 116 THR . 34461 1 127 117 HIS . 34461 1 128 118 LYS . 34461 1 129 119 PHE . 34461 1 130 120 GLU . 34461 1 131 121 ALA . 34461 1 132 122 PHE . 34461 1 133 123 GLU . 34461 1 134 124 HIS . 34461 1 135 125 GLU . 34461 1 136 126 ASN . 34461 1 137 127 LYS . 34461 1 138 128 PHE . 34461 1 139 129 TYR . 34461 1 140 130 ILE . 34461 1 141 131 ASN . 34461 1 142 132 PRO . 34461 1 143 133 GLY . 34461 1 144 134 SER . 34461 1 145 135 ALA . 34461 1 146 136 THR . 34461 1 147 137 GLY . 34461 1 148 138 ALA . 34461 1 149 139 TYR . 34461 1 150 140 ASN . 34461 1 151 141 ALA . 34461 1 152 142 LEU . 34461 1 153 143 GLU . 34461 1 154 144 THR . 34461 1 155 145 ASN . 34461 1 156 146 ILE . 34461 1 157 147 ILE . 34461 1 158 148 PRO . 34461 1 159 149 SER . 34461 1 160 150 PHE . 34461 1 161 151 VAL . 34461 1 162 152 LEU . 34461 1 163 153 MET . 34461 1 164 154 ASP . 34461 1 165 155 ILE . 34461 1 166 156 GLN . 34461 1 167 157 ALA . 34461 1 168 158 SER . 34461 1 169 159 THR . 34461 1 170 160 VAL . 34461 1 171 161 VAL . 34461 1 172 162 THR . 34461 1 173 163 TYR . 34461 1 174 164 VAL . 34461 1 175 165 TYR . 34461 1 176 166 GLN . 34461 1 177 167 LEU . 34461 1 178 168 ILE . 34461 1 179 169 GLY . 34461 1 180 170 ASP . 34461 1 181 171 ASP . 34461 1 182 172 VAL . 34461 1 183 173 LYS . 34461 1 184 174 VAL . 34461 1 185 175 GLU . 34461 1 186 176 ARG . 34461 1 187 177 ILE . 34461 1 188 178 GLU . 34461 1 189 179 TYR . 34461 1 190 180 LYS . 34461 1 191 181 LYS . 34461 1 192 182 SER . 34461 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 . GLY 1 1 34461 1 . SER 2 2 34461 1 . PRO 3 3 34461 1 . GLU 4 4 34461 1 . PHE 5 5 34461 1 . GLY 6 6 34461 1 . THR 7 7 34461 1 . ARG 8 8 34461 1 . ASP 9 9 34461 1 . ARG 10 10 34461 1 . MET 11 11 34461 1 . LEU 12 12 34461 1 . VAL 13 13 34461 1 . LEU 14 14 34461 1 . VAL 15 15 34461 1 . LEU 16 16 34461 1 . GLY 17 17 34461 1 . ASP 18 18 34461 1 . LEU 19 19 34461 1 . HIS 20 20 34461 1 . ILE 21 21 34461 1 . PRO 22 22 34461 1 . HIS 23 23 34461 1 . ARG 24 24 34461 1 . CYS 25 25 34461 1 . ASN 26 26 34461 1 . SER 27 27 34461 1 . LEU 28 28 34461 1 . PRO 29 29 34461 1 . ALA 30 30 34461 1 . LYS 31 31 34461 1 . PHE 32 32 34461 1 . LYS 33 33 34461 1 . LYS 34 34 34461 1 . LEU 35 35 34461 1 . LEU 36 36 34461 1 . VAL 37 37 34461 1 . PRO 38 38 34461 1 . GLY 39 39 34461 1 . LYS 40 40 34461 1 . ILE 41 41 34461 1 . GLN 42 42 34461 1 . HIS 43 43 34461 1 . ILE 44 44 34461 1 . LEU 45 45 34461 1 . CYS 46 46 34461 1 . THR 47 47 34461 1 . GLY 48 48 34461 1 . ASN 49 49 34461 1 . LEU 50 50 34461 1 . CYS 51 51 34461 1 . THR 52 52 34461 1 . LYS 53 53 34461 1 . GLU 54 54 34461 1 . SER 55 55 34461 1 . TYR 56 56 34461 1 . ASP 57 57 34461 1 . TYR 58 58 34461 1 . LEU 59 59 34461 1 . LYS 60 60 34461 1 . THR 61 61 34461 1 . LEU 62 62 34461 1 . ALA 63 63 34461 1 . GLY 64 64 34461 1 . ASP 65 65 34461 1 . VAL 66 66 34461 1 . HIS 67 67 34461 1 . ILE 68 68 34461 1 . VAL 69 69 34461 1 . ARG 70 70 34461 1 . GLY 71 71 34461 1 . ASP 72 72 34461 1 . PHE 73 73 34461 1 . ASP 74 74 34461 1 . GLU 75 75 34461 1 . ASN 76 76 34461 1 . LEU 77 77 34461 1 . ASN 78 78 34461 1 . TYR 79 79 34461 1 . PRO 80 80 34461 1 . GLU 81 81 34461 1 . GLN 82 82 34461 1 . LYS 83 83 34461 1 . VAL 84 84 34461 1 . VAL 85 85 34461 1 . THR 86 86 34461 1 . VAL 87 87 34461 1 . GLY 88 88 34461 1 . GLN 89 89 34461 1 . PHE 90 90 34461 1 . LYS 91 91 34461 1 . ILE 92 92 34461 1 . GLY 93 93 34461 1 . LEU 94 94 34461 1 . ILE 95 95 34461 1 . HIS 96 96 34461 1 . GLY 97 97 34461 1 . HIS 98 98 34461 1 . GLN 99 99 34461 1 . VAL 100 100 34461 1 . ILE 101 101 34461 1 . PRO 102 102 34461 1 . TRP 103 103 34461 1 . GLY 104 104 34461 1 . ASP 105 105 34461 1 . MET 106 106 34461 1 . ALA 107 107 34461 1 . SER 108 108 34461 1 . LEU 109 109 34461 1 . ALA 110 110 34461 1 . LEU 111 111 34461 1 . LEU 112 112 34461 1 . GLN 113 113 34461 1 . ARG 114 114 34461 1 . GLN 115 115 34461 1 . PHE 116 116 34461 1 . ASP 117 117 34461 1 . VAL 118 118 34461 1 . ASP 119 119 34461 1 . ILE 120 120 34461 1 . LEU 121 121 34461 1 . ILE 122 122 34461 1 . SER 123 123 34461 1 . GLY 124 124 34461 1 . HIS 125 125 34461 1 . THR 126 126 34461 1 . HIS 127 127 34461 1 . LYS 128 128 34461 1 . PHE 129 129 34461 1 . GLU 130 130 34461 1 . ALA 131 131 34461 1 . PHE 132 132 34461 1 . GLU 133 133 34461 1 . HIS 134 134 34461 1 . GLU 135 135 34461 1 . ASN 136 136 34461 1 . LYS 137 137 34461 1 . PHE 138 138 34461 1 . TYR 139 139 34461 1 . ILE 140 140 34461 1 . ASN 141 141 34461 1 . PRO 142 142 34461 1 . GLY 143 143 34461 1 . SER 144 144 34461 1 . ALA 145 145 34461 1 . THR 146 146 34461 1 . GLY 147 147 34461 1 . ALA 148 148 34461 1 . TYR 149 149 34461 1 . ASN 150 150 34461 1 . ALA 151 151 34461 1 . LEU 152 152 34461 1 . GLU 153 153 34461 1 . THR 154 154 34461 1 . ASN 155 155 34461 1 . ILE 156 156 34461 1 . ILE 157 157 34461 1 . PRO 158 158 34461 1 . SER 159 159 34461 1 . PHE 160 160 34461 1 . VAL 161 161 34461 1 . LEU 162 162 34461 1 . MET 163 163 34461 1 . ASP 164 164 34461 1 . ILE 165 165 34461 1 . GLN 166 166 34461 1 . ALA 167 167 34461 1 . SER 168 168 34461 1 . THR 169 169 34461 1 . VAL 170 170 34461 1 . VAL 171 171 34461 1 . THR 172 172 34461 1 . TYR 173 173 34461 1 . VAL 174 174 34461 1 . TYR 175 175 34461 1 . GLN 176 176 34461 1 . LEU 177 177 34461 1 . ILE 178 178 34461 1 . GLY 179 179 34461 1 . ASP 180 180 34461 1 . ASP 181 181 34461 1 . VAL 182 182 34461 1 . LYS 183 183 34461 1 . VAL 184 184 34461 1 . GLU 185 185 34461 1 . ARG 186 186 34461 1 . ILE 187 187 34461 1 . GLU 188 188 34461 1 . TYR 189 189 34461 1 . LYS 190 190 34461 1 . LYS 191 191 34461 1 . SER 192 192 34461 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 34461 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPLGSTEEDLEDAEDTVSAA DPEFCHPLCQCPKCAPAQKR LAKVPASGLGVNVTSQDGSS W ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 61 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all other bound' _Entity.Src_method man _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 6319.927 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'VPS9 domain-containing protein' na 34461 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 687 GLY . 34461 2 2 688 PRO . 34461 2 3 689 LEU . 34461 2 4 690 GLY . 34461 2 5 691 SER . 34461 2 6 692 THR . 34461 2 7 693 GLU . 34461 2 8 694 GLU . 34461 2 9 695 ASP . 34461 2 10 696 LEU . 34461 2 11 697 GLU . 34461 2 12 698 ASP . 34461 2 13 699 ALA . 34461 2 14 700 GLU . 34461 2 15 701 ASP . 34461 2 16 702 THR . 34461 2 17 703 VAL . 34461 2 18 704 SER . 34461 2 19 705 ALA . 34461 2 20 706 ALA . 34461 2 21 707 ASP . 34461 2 22 708 PRO . 34461 2 23 709 GLU . 34461 2 24 710 PHE . 34461 2 25 711 CYS . 34461 2 26 712 HIS . 34461 2 27 713 PRO . 34461 2 28 714 LEU . 34461 2 29 715 CYS . 34461 2 30 716 GLN . 34461 2 31 717 CYS . 34461 2 32 718 PRO . 34461 2 33 719 LYS . 34461 2 34 720 CYS . 34461 2 35 721 ALA . 34461 2 36 722 PRO . 34461 2 37 723 ALA . 34461 2 38 724 GLN . 34461 2 39 725 LYS . 34461 2 40 726 ARG . 34461 2 41 727 LEU . 34461 2 42 728 ALA . 34461 2 43 729 LYS . 34461 2 44 730 VAL . 34461 2 45 731 PRO . 34461 2 46 732 ALA . 34461 2 47 733 SER . 34461 2 48 734 GLY . 34461 2 49 735 LEU . 34461 2 50 736 GLY . 34461 2 51 737 VAL . 34461 2 52 738 ASN . 34461 2 53 739 VAL . 34461 2 54 740 THR . 34461 2 55 741 SER . 34461 2 56 742 GLN . 34461 2 57 743 ASP . 34461 2 58 744 GLY . 34461 2 59 745 SER . 34461 2 60 746 SER . 34461 2 61 747 TRP . 34461 2 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 . GLY 1 1 34461 2 . PRO 2 2 34461 2 . LEU 3 3 34461 2 . GLY 4 4 34461 2 . SER 5 5 34461 2 . THR 6 6 34461 2 . GLU 7 7 34461 2 . GLU 8 8 34461 2 . ASP 9 9 34461 2 . LEU 10 10 34461 2 . GLU 11 11 34461 2 . ASP 12 12 34461 2 . ALA 13 13 34461 2 . GLU 14 14 34461 2 . ASP 15 15 34461 2 . THR 16 16 34461 2 . VAL 17 17 34461 2 . SER 18 18 34461 2 . ALA 19 19 34461 2 . ALA 20 20 34461 2 . ASP 21 21 34461 2 . PRO 22 22 34461 2 . GLU 23 23 34461 2 . PHE 24 24 34461 2 . CYS 25 25 34461 2 . HIS 26 26 34461 2 . PRO 27 27 34461 2 . LEU 28 28 34461 2 . CYS 29 29 34461 2 . GLN 30 30 34461 2 . CYS 31 31 34461 2 . PRO 32 32 34461 2 . LYS 33 33 34461 2 . CYS 34 34 34461 2 . ALA 35 35 34461 2 . PRO 36 36 34461 2 . ALA 37 37 34461 2 . GLN 38 38 34461 2 . LYS 39 39 34461 2 . ARG 40 40 34461 2 . LEU 41 41 34461 2 . ALA 42 42 34461 2 . LYS 43 43 34461 2 . VAL 44 44 34461 2 . PRO 45 45 34461 2 . ALA 46 46 34461 2 . SER 47 47 34461 2 . GLY 48 48 34461 2 . LEU 49 49 34461 2 . GLY 50 50 34461 2 . VAL 51 51 34461 2 . ASN 52 52 34461 2 . VAL 53 53 34461 2 . THR 54 54 34461 2 . SER 55 55 34461 2 . GLN 56 56 34461 2 . ASP 57 57 34461 2 . GLY 58 58 34461 2 . SER 59 59 34461 2 . SER 60 60 34461 2 . TRP 61 61 34461 2 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 34461 _Entity.ID 3 _Entity.BMRB_code ZN _Entity.Name entity_ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 3 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB 34461 3 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB 34461 3 ZN 'Three letter code' 34461 3 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 ZN $chem_comp_ZN 34461 3 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 34461 _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 $entity_1 . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . Vps29 . 34461 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'ANKRD27, PP12899' . 34461 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 34461 _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 $entity_1 . 'recombinant technology' 'Escherichia coli BL21' . 'cDNA Cloned EcoRI into pGEX4T1' 511693 . . . 'DE3 pLysS' . . . . pGEXVPS29 . . . 34461 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli BL21' . 'cDNA clone BamHI/NotI pGEX6P1' 511693 . . . 'DE3 pLysS' . . . . pGEXVARPfingernail2 . . . 34461 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 34461 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 34461 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 34461 ZN [Zn++] SMILES CACTVS 3.341 34461 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 34461 ZN [Zn+2] SMILES ACDLabs 10.04 34461 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 34461 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 34461 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 34461 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 34461 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 34461 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34461 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.45 mM [U-98% 13C; U-98% 15N] VPS29, 0.45 mM VARP 692-746, 20 mM [U-2H] TRIS, 200 mM sodium chloride, 1 mM [U-2H] DTT, 95% H2O/5% D2O ; _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 VPS29 '[U-98% 13C; U-98% 15N]' . . 1 $entity_1 . . 0.45 . . mM 0.15 . . . 34461 1 2 'VARP 692-746' 'natural abundance' . . 2 $entity_2 . . 0.45 . . mM 0.15 . . . 34461 1 3 TRIS [U-2H] . . . . . . 20 . . mM . . . . 34461 1 4 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 34461 1 5 DTT [U-2H] . . . . . . 1 . . mM . . . . 34461 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 34461 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.45 mM [U-98% 13C; U-98% 15N] VPS29, 0.45 mM VARP 692-746, 20 mM [U-2H] TRIS, 200 mM sodium chloride, 1 mM [U-2H] DTT, 100% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 VPS29 '[U-98% 13C; U-98% 15N]' . . 1 $entity_1 . . 0.45 . . mM 0.15 . . . 34461 2 2 'VARP 692-746' 'natural abundance' . . 2 $entity_2 . . 0.45 . . mM 0.15 . . . 34461 2 3 TRIS [U-2H] . . . . . . 20 . . mM . . . . 34461 2 4 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 34461 2 5 DTT [U-2H] . . . . . . 1 . . mM . . . . 34461 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 34461 _Sample.ID 3 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.45 mM VPS29, 0.45 mM [U-98% 13C; U-98% 15N] VARP 692-746, 20 mM [U-2H] TRIS, 200 mM sodium chloride, 1 mM [U-2H] DTT, 95% H2O/5% D2O ; _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 VPS29 'natural abundance' . . 1 $entity_1 . . 0.45 . . mM 0.15 . . . 34461 3 2 'VARP 692-746' '[U-98% 13C; U-98% 15N]' . . 2 $entity_2 . . 0.45 . . mM 0.15 . . . 34461 3 3 TRIS [U-2H] . . . . . . 20 . . mM . . . . 34461 3 4 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 34461 3 5 DTT [U-2H] . . . . . . 1 . . mM . . . . 34461 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 34461 _Sample.ID 4 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.45 mM VPS29, 0.45 mM [U-98% 13C; U-98% 15N] VARP 692-746, 20 mM [U-2H] TRIS, 200 mM sodium chloride, 1 mM [U-2H] DTT, 100% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 VPS29 'natural abundance' . . 1 $entity_1 . . 0.45 . . mM 0.15 . . . 34461 4 2 'VARP 692-746' '[U-98% 13C; U-98% 15N]' . . 2 $entity_2 . . 0.45 . . mM 0.15 . . . 34461 4 3 TRIS [U-2H] . . . . . . 20 . . mM . . . . 34461 4 4 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 34461 4 5 DTT [U-2H] . . . . . . 1 . . mM . . . . 34461 4 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 34461 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 200 . mM 34461 1 pH 7.0 . pH 34461 1 pressure 1 . atm 34461 1 temperature 298 . K 34461 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 34461 _Sample_condition_list.ID 2 _Sample_condition_list.Name . _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' 200 . mM 34461 2 pH 7.0 . pH 34461 2 pressure 1 . atm 34461 2 temperature 283 . K 34461 2 stop_ save_ save_sample_conditions_3 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_3 _Sample_condition_list.Entry_ID 34461 _Sample_condition_list.ID 3 _Sample_condition_list.Name . _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' 200 . mM 34461 3 pH 7.0 . pH 34461 3 pressure 1 . atm 34461 3 temperature 275 . K 34461 3 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34461 _Software.ID 1 _Software.Type . _Software.Name TopSpin _Software.Version 3.5 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 34461 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 34461 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34461 _Software.ID 2 _Software.Type . _Software.Name 'CcpNmr Analysis' _Software.Version 2.4.2 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 34461 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 34461 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34461 _Software.ID 3 _Software.Type . _Software.Name 'X-PLOR NIH' _Software.Version 2.28 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 34461 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure calculation' 34461 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 34461 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 34461 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 34461 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . 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 NMR_spectrometer_1 Bruker 'AVANCE III' . 800 . . . 34461 1 2 NMR_spectrometer_2 Bruker AVANCE . 600 . . . 34461 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 34461 _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 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 4 '2D 1H-13C HSQC aliphatic constant-time' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 5 '2D 1H-1H NOESY (150ms mixing time) filtered to reject 13C-1 and 15N-coupled 1H in F1 and to accept 13C- and 15N-coupled 1H in F2' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 6 '3D 13C NOESY-HSQC aromatic (150ms mixing time)' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 7 '3D 13C NOESY-HSQC aliphatic (150ms mixing time)' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 8 '3D 15N NOESY-HSQC (150ms mixing time)' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 9 '3D HCCH-TOCSY [13C-13C-1H]' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 10 '3D HCCH-TOCSY [1H-13C-1H]' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 11 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 12 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 13 '3D CBCANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 14 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 15 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 16 '2D 1H-1H NOESY (150ms mixing time) filtered to reject 13C-1 and 15N-coupled 1H in F1 and to accept 13C- and 15N-coupled 1H in F2' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 17 '2D 1H-13C HSQC aliphatic constant-time' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 18 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 19 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 20 '2D 1H-1H NOESY (70ms mixing time) filtered to reject 13C-1 and 15N-coupled 1H in F1 and to accept 13C- and 15N-coupled 1H in F2' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 21 '3D 13C NOESY-HSQC (120ms mixing time) aromatic, filtered to reject 13C-1 and 15N-coupled 1H in F1' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 22 '3D 13C NOESY-HSQC (50ms mixing time) aromatic, filtered to reject 13C-1 and 15N-coupled 1H in F1' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 23 '3D 13C NOESY-HSQC (120ms mixing time) aliphatic, filtered to reject 13C-1 and 15N-coupled 1H in F1' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 24 '3D 13C NOESY-HSQC (50ms mixing time) aliphatic, filtered to reject 13C-1 and 15N-coupled 1H in F1' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 25 '3D 13C NOESY-HSQC (120ms mixing time) aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 26 '3D 13C NOESY-HSQC (50ms mixing time) aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 27 '3D 13C NOESY-HSQC (120ms mixing time) aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 28 '3D 13C NOESY-HSQC (50ms mixing time) aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 29 '3D HCCH-TOCSY [13C-13C-1H]' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 30 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 31 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 32 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 3 $sample_conditions_3 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 33 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 34 '3D CBCA(CO)NH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 35 '3D HNCA' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 36 '3D HN(CO)CA' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 37 '3D HBHA(CO)NH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 38 '3D HNHA' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 39 '3D HCCH-TOCSY [1H-13C-1H]' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 40 '3D HCCH-TOCSY [13C-13C-1H]' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 41 '3D 1H-15N NOESY-HSQC (70ms mixing time)' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 42 '3D 1H-15N NOESY-HSQC (150ms mixing time)' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 43 '3D 1H-15N NOESY-HSQC (50ms mixing time)' no . . . . . . . . . . 3 $sample_3 isotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 44 '3D 1H-15N NOESY-HSQC (50ms mixing time)' no . . . . . . . . . . 3 $sample_3 isotropic . . 3 $sample_conditions_3 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 45 '3D 1H-13C NOESY (70ms mixing time) aliphatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 46 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 47 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 48 '3D HCCH-TOCSY [1H-13C-1H]' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 49 '3D HCCH-TOCSY [13C-13C-1H]' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 50 '3D 13C NOESY-HSQC aliphatic (50ms mixing time)' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 51 '3D 13C NOESY-HSQC aliphatic (70ms mixing time)' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 52 '3D 13C NOESY-HSQC aliphatic (120ms mixing time)' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 53 '3D 13C NOESY-HSQC aromatic (70ms mixing time)' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34461 1 54 '2D 1H-13C HSQC aromatic constant-time' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34461 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 34461 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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 TSP 'methyl protons' . . . . ppm 0.0 external indirect 0.251449530 'separate tube (no insert) similar to the experimental sample tube' cylindrical parallel . . 34461 1 H 1 TSP 'methyl protons' . . . . ppm 0.0 external direct 1.0 'separate tube (no insert) similar to the experimental sample tube' cylindrical parallel . . 34461 1 N 15 TSP 'methyl protons' . . . . ppm 0.0 external indirect 0.101329118 'separate tube (no insert) similar to the experimental sample tube' cylindrical parallel . . 34461 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34461 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_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' . . . 34461 1 2 '2D 1H-13C HSQC aliphatic' . . . 34461 1 3 '2D 1H-13C HSQC aromatic' . . . 34461 1 4 '2D 1H-13C HSQC aliphatic constant-time' . . . 34461 1 6 '3D 13C NOESY-HSQC aromatic (150ms mixing time)' . . . 34461 1 7 '3D 13C NOESY-HSQC aliphatic (150ms mixing time)' . . . 34461 1 8 '3D 15N NOESY-HSQC (150ms mixing time)' . . . 34461 1 9 '3D HCCH-TOCSY [13C-13C-1H]' . . . 34461 1 10 '3D HCCH-TOCSY [1H-13C-1H]' . . . 34461 1 11 '3D HBHA(CO)NH' . . . 34461 1 12 '3D CBCA(CO)NH' . . . 34461 1 13 '3D CBCANH' . . . 34461 1 14 '3D HN(CO)CA' . . . 34461 1 15 '3D HNCA' . . . 34461 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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 3 3 PRO HA H 1 4.422 0.02 . 1 . . . . A -7 PRO HA . 34461 1 2 . 1 . 1 3 3 PRO HB2 H 1 1.817 0.02 . 2 . . . . A -7 PRO HB1 . 34461 1 3 . 1 . 1 3 3 PRO HB3 H 1 2.244 0.02 . 2 . . . . A -7 PRO HB2 . 34461 1 4 . 1 . 1 3 3 PRO HG3 H 1 2.016 0.02 . 2 . . . . A -7 PRO HG2 . 34461 1 5 . 1 . 1 3 3 PRO HD2 H 1 3.741 0.02 . 2 . . . . A -7 PRO HD1 . 34461 1 6 . 1 . 1 3 3 PRO HD3 H 1 3.852 0.02 . 2 . . . . A -7 PRO HD2 . 34461 1 7 . 1 . 1 3 3 PRO CA C 13 63.485 0.1 . 1 . . . . A -7 PRO CA . 34461 1 8 . 1 . 1 3 3 PRO CB C 13 32.042 0.1 . 1 . . . . A -7 PRO CB . 34461 1 9 . 1 . 1 3 3 PRO CG C 13 27.313 0.1 . 1 . . . . A -7 PRO CG . 34461 1 10 . 1 . 1 3 3 PRO CD C 13 50.743 0.1 . 1 . . . . A -7 PRO CD . 34461 1 11 . 1 . 1 4 4 GLU H H 1 8.487 0.02 . 1 . . . . A -6 GLU H . 34461 1 12 . 1 . 1 4 4 GLU HA H 1 4.197 0.02 . 1 . . . . A -6 GLU HA . 34461 1 13 . 1 . 1 4 4 GLU HB2 H 1 1.842 0.02 . 2 . . . . A -6 GLU HB1 . 34461 1 14 . 1 . 1 4 4 GLU HB3 H 1 1.935 0.02 . 2 . . . . A -6 GLU HB2 . 34461 1 15 . 1 . 1 4 4 GLU HG2 H 1 2.138 0.02 . 2 . . . . A -6 GLU HG1 . 34461 1 16 . 1 . 1 4 4 GLU HG3 H 1 2.233 0.02 . 2 . . . . A -6 GLU HG2 . 34461 1 17 . 1 . 1 4 4 GLU CA C 13 56.827 0.1 . 1 . . . . A -6 GLU CA . 34461 1 18 . 1 . 1 4 4 GLU CB C 13 30.227 0.1 . 1 . . . . A -6 GLU CB . 34461 1 19 . 1 . 1 4 4 GLU CG C 13 36.289 0.1 . 1 . . . . A -6 GLU CG . 34461 1 20 . 1 . 1 4 4 GLU N N 15 121.004 0.1 . 1 . . . . A -6 GLU N . 34461 1 21 . 1 . 1 5 5 PHE H H 1 8.215 0.02 . 1 . . . . A -5 PHE H . 34461 1 22 . 1 . 1 5 5 PHE HA H 1 4.657 0.02 . 1 . . . . A -5 PHE HA . 34461 1 23 . 1 . 1 5 5 PHE HB2 H 1 3.043 0.02 . 2 . . . . A -5 PHE HB1 . 34461 1 24 . 1 . 1 5 5 PHE HB3 H 1 3.253 0.02 . 2 . . . . A -5 PHE HB2 . 34461 1 25 . 1 . 1 5 5 PHE HD1 H 1 7.273 0.02 . 1 . . . . A -5 PHE HD1 . 34461 1 26 . 1 . 1 5 5 PHE HD2 H 1 7.273 0.02 . 1 . . . . A -5 PHE HD2 . 34461 1 27 . 1 . 1 5 5 PHE HE1 H 1 7.324 0.02 . 1 . . . . A -5 PHE HE1 . 34461 1 28 . 1 . 1 5 5 PHE HE2 H 1 7.324 0.02 . 1 . . . . A -5 PHE HE2 . 34461 1 29 . 1 . 1 5 5 PHE CA C 13 57.936 0.1 . 1 . . . . A -5 PHE CA . 34461 1 30 . 1 . 1 5 5 PHE CB C 13 39.721 0.1 . 1 . . . . A -5 PHE CB . 34461 1 31 . 1 . 1 5 5 PHE CD1 C 13 131.897 0.1 . 1 . . . . A -5 PHE CD1 . 34461 1 32 . 1 . 1 5 5 PHE CE1 C 13 131.528 0.1 . 1 . . . . A -5 PHE CE1 . 34461 1 33 . 1 . 1 5 5 PHE N N 15 120.610 0.1 . 1 . . . . A -5 PHE N . 34461 1 34 . 1 . 1 6 6 GLY H H 1 8.444 0.02 . 1 . . . . A -4 GLY H . 34461 1 35 . 1 . 1 6 6 GLY HA2 H 1 4.067 0.02 . 2 . . . . A -4 GLY HA1 . 34461 1 36 . 1 . 1 6 6 GLY HA3 H 1 4.006 0.02 . 2 . . . . A -4 GLY HA2 . 34461 1 37 . 1 . 1 6 6 GLY CA C 13 45.518 0.1 . 1 . . . . A -4 GLY CA . 34461 1 38 . 1 . 1 6 6 GLY N N 15 110.337 0.1 . 1 . . . . A -4 GLY N . 34461 1 39 . 1 . 1 7 7 THR H H 1 8.103 0.02 . 1 . . . . A -3 THR H . 34461 1 40 . 1 . 1 7 7 THR HA H 1 4.405 0.02 . 1 . . . . A -3 THR HA . 34461 1 41 . 1 . 1 7 7 THR HB H 1 4.266 0.02 . 1 . . . . A -3 THR HB . 34461 1 42 . 1 . 1 7 7 THR CA C 13 62.009 0.1 . 1 . . . . A -3 THR CA . 34461 1 43 . 1 . 1 7 7 THR CB C 13 69.982 0.1 . 1 . . . . A -3 THR CB . 34461 1 44 . 1 . 1 7 7 THR CG2 C 13 21.708 0.1 . 1 . . . . A -3 THR CG2 . 34461 1 45 . 1 . 1 7 7 THR N N 15 113.450 0.1 . 1 . . . . A -3 THR N . 34461 1 46 . 1 . 1 8 8 ARG H H 1 8.472 0.02 . 1 . . . . A -2 ARG H . 34461 1 47 . 1 . 1 8 8 ARG HA H 1 4.420 0.02 . 1 . . . . A -2 ARG HA . 34461 1 48 . 1 . 1 8 8 ARG HB2 H 1 1.837 0.02 . 2 . . . . A -2 ARG HB1 . 34461 1 49 . 1 . 1 8 8 ARG HB3 H 1 1.943 0.02 . 2 . . . . A -2 ARG HB2 . 34461 1 50 . 1 . 1 8 8 ARG HD3 H 1 3.247 0.02 . 2 . . . . A -2 ARG HD2 . 34461 1 51 . 1 . 1 8 8 ARG CA C 13 56.331 0.1 . 1 . . . . A -2 ARG CA . 34461 1 52 . 1 . 1 8 8 ARG CB C 13 30.824 0.1 . 1 . . . . A -2 ARG CB . 34461 1 53 . 1 . 1 8 8 ARG CG C 13 26.902 0.1 . 1 . . . . A -2 ARG CG . 34461 1 54 . 1 . 1 8 8 ARG CD C 13 43.409 0.1 . 1 . . . . A -2 ARG CD . 34461 1 55 . 1 . 1 8 8 ARG N N 15 122.555 0.1 . 1 . . . . A -2 ARG N . 34461 1 56 . 1 . 1 9 9 ASP H H 1 8.345 0.02 . 1 . . . . A -1 ASP H . 34461 1 57 . 1 . 1 9 9 ASP HA H 1 4.637 0.02 . 1 . . . . A -1 ASP HA . 34461 1 58 . 1 . 1 9 9 ASP HB2 H 1 2.662 0.02 . 2 . . . . A -1 ASP HB1 . 34461 1 59 . 1 . 1 9 9 ASP HB3 H 1 2.781 0.02 . 2 . . . . A -1 ASP HB2 . 34461 1 60 . 1 . 1 9 9 ASP CA C 13 54.627 0.1 . 1 . . . . A -1 ASP CA . 34461 1 61 . 1 . 1 9 9 ASP CB C 13 41.308 0.1 . 1 . . . . A -1 ASP CB . 34461 1 62 . 1 . 1 9 9 ASP N N 15 120.847 0.1 . 1 . . . . A -1 ASP N . 34461 1 63 . 1 . 1 10 10 ARG H H 1 7.947 0.02 . 1 . . . . A 0 ARG H . 34461 1 64 . 1 . 1 10 10 ARG HA H 1 5.033 0.02 . 1 . . . . A 0 ARG HA . 34461 1 65 . 1 . 1 10 10 ARG HB3 H 1 1.746 0.02 . 2 . . . . A 0 ARG HB2 . 34461 1 66 . 1 . 1 10 10 ARG HD2 H 1 3.156 0.02 . 2 . . . . A 0 ARG HD1 . 34461 1 67 . 1 . 1 10 10 ARG HD3 H 1 3.127 0.02 . 2 . . . . A 0 ARG HD2 . 34461 1 68 . 1 . 1 10 10 ARG CA C 13 55.571 0.1 . 1 . . . . A 0 ARG CA . 34461 1 69 . 1 . 1 10 10 ARG CB C 13 32.405 0.1 . 1 . . . . A 0 ARG CB . 34461 1 70 . 1 . 1 10 10 ARG CG C 13 26.333 0.1 . 1 . . . . A 0 ARG CG . 34461 1 71 . 1 . 1 10 10 ARG CD C 13 44.103 0.1 . 1 . . . . A 0 ARG CD . 34461 1 72 . 1 . 1 10 10 ARG N N 15 121.240 0.1 . 1 . . . . A 0 ARG N . 34461 1 73 . 1 . 1 11 11 MET H H 1 9.132 0.02 . 1 . . . . A 1 MET H . 34461 1 74 . 1 . 1 11 11 MET HA H 1 4.951 0.02 . 1 . . . . A 1 MET HA . 34461 1 75 . 1 . 1 11 11 MET HB2 H 1 2.043 0.02 . 2 . . . . A 1 MET HB1 . 34461 1 76 . 1 . 1 11 11 MET HB3 H 1 2.175 0.02 . 2 . . . . A 1 MET HB2 . 34461 1 77 . 1 . 1 11 11 MET HG2 H 1 2.668 0.02 . 2 . . . . A 1 MET HG1 . 34461 1 78 . 1 . 1 11 11 MET HG3 H 1 2.592 0.02 . 2 . . . . A 1 MET HG2 . 34461 1 79 . 1 . 1 11 11 MET CA C 13 54.893 0.1 . 1 . . . . A 1 MET CA . 34461 1 80 . 1 . 1 11 11 MET CB C 13 34.928 0.1 . 1 . . . . A 1 MET CB . 34461 1 81 . 1 . 1 11 11 MET CG C 13 32.404 0.1 . 1 . . . . A 1 MET CG . 34461 1 82 . 1 . 1 11 11 MET N N 15 124.799 0.1 . 1 . . . . A 1 MET N . 34461 1 83 . 1 . 1 12 12 LEU HA H 1 5.615 0.02 . 1 . . . . A 2 LEU HA . 34461 1 84 . 1 . 1 12 12 LEU HB2 H 1 2.140 0.02 . 2 . . . . A 2 LEU HB1 . 34461 1 85 . 1 . 1 12 12 LEU HB3 H 1 1.451 0.02 . 2 . . . . A 2 LEU HB2 . 34461 1 86 . 1 . 1 12 12 LEU HG H 1 1.815 0.02 . 1 . . . . A 2 LEU HG . 34461 1 87 . 1 . 1 12 12 LEU HD11 H 1 0.962 0.02 . 2 . . . . A 2 LEU HD11 . 34461 1 88 . 1 . 1 12 12 LEU HD12 H 1 0.962 0.02 . 2 . . . . A 2 LEU HD12 . 34461 1 89 . 1 . 1 12 12 LEU HD13 H 1 0.962 0.02 . 2 . . . . A 2 LEU HD13 . 34461 1 90 . 1 . 1 12 12 LEU HD21 H 1 0.942 0.02 . 2 . . . . A 2 LEU HD21 . 34461 1 91 . 1 . 1 12 12 LEU HD22 H 1 0.942 0.02 . 2 . . . . A 2 LEU HD22 . 34461 1 92 . 1 . 1 12 12 LEU HD23 H 1 0.942 0.02 . 2 . . . . A 2 LEU HD23 . 34461 1 93 . 1 . 1 12 12 LEU CA C 13 53.577 0.1 . 1 . . . . A 2 LEU CA . 34461 1 94 . 1 . 1 12 12 LEU CB C 13 43.838 0.1 . 1 . . . . A 2 LEU CB . 34461 1 95 . 1 . 1 12 12 LEU CG C 13 27.128 0.1 . 1 . . . . A 2 LEU CG . 34461 1 96 . 1 . 1 12 12 LEU CD1 C 13 23.864 0.1 . 2 . . . . A 2 LEU CD1 . 34461 1 97 . 1 . 1 12 12 LEU CD2 C 13 23.864 0.1 . 2 . . . . A 2 LEU CD2 . 34461 1 98 . 1 . 1 13 13 VAL H H 1 9.468 0.02 . 1 . . . . A 3 VAL H . 34461 1 99 . 1 . 1 13 13 VAL HA H 1 5.111 0.02 . 1 . . . . A 3 VAL HA . 34461 1 100 . 1 . 1 13 13 VAL HB H 1 2.158 0.02 . 1 . . . . A 3 VAL HB . 34461 1 101 . 1 . 1 13 13 VAL HG11 H 1 0.783 0.02 . 2 . . . . A 3 VAL HG11 . 34461 1 102 . 1 . 1 13 13 VAL HG12 H 1 0.783 0.02 . 2 . . . . A 3 VAL HG12 . 34461 1 103 . 1 . 1 13 13 VAL HG13 H 1 0.783 0.02 . 2 . . . . A 3 VAL HG13 . 34461 1 104 . 1 . 1 13 13 VAL HG21 H 1 0.929 0.02 . 2 . . . . A 3 VAL HG21 . 34461 1 105 . 1 . 1 13 13 VAL HG22 H 1 0.929 0.02 . 2 . . . . A 3 VAL HG22 . 34461 1 106 . 1 . 1 13 13 VAL HG23 H 1 0.929 0.02 . 2 . . . . A 3 VAL HG23 . 34461 1 107 . 1 . 1 13 13 VAL CA C 13 59.963 0.1 . 1 . . . . A 3 VAL CA . 34461 1 108 . 1 . 1 13 13 VAL CB C 13 34.641 0.1 . 1 . . . . A 3 VAL CB . 34461 1 109 . 1 . 1 13 13 VAL CG1 C 13 21.772 0.1 . 2 . . . . A 3 VAL CG1 . 34461 1 110 . 1 . 1 13 13 VAL CG2 C 13 21.744 0.1 . 2 . . . . A 3 VAL CG2 . 34461 1 111 . 1 . 1 13 13 VAL N N 15 124.362 0.1 . 1 . . . . A 3 VAL N . 34461 1 112 . 1 . 1 14 14 LEU H H 1 8.842 0.02 . 1 . . . . A 4 LEU H . 34461 1 113 . 1 . 1 14 14 LEU HA H 1 5.022 0.02 . 1 . . . . A 4 LEU HA . 34461 1 114 . 1 . 1 14 14 LEU HB2 H 1 1.460 0.02 . 2 . . . . A 4 LEU HB1 . 34461 1 115 . 1 . 1 14 14 LEU HB3 H 1 1.339 0.02 . 2 . . . . A 4 LEU HB2 . 34461 1 116 . 1 . 1 14 14 LEU HD11 H 1 0.769 0.02 . 2 . . . . A 4 LEU HD11 . 34461 1 117 . 1 . 1 14 14 LEU HD12 H 1 0.769 0.02 . 2 . . . . A 4 LEU HD12 . 34461 1 118 . 1 . 1 14 14 LEU HD13 H 1 0.769 0.02 . 2 . . . . A 4 LEU HD13 . 34461 1 119 . 1 . 1 14 14 LEU HD21 H 1 0.609 0.02 . 2 . . . . A 4 LEU HD21 . 34461 1 120 . 1 . 1 14 14 LEU HD22 H 1 0.609 0.02 . 2 . . . . A 4 LEU HD22 . 34461 1 121 . 1 . 1 14 14 LEU HD23 H 1 0.609 0.02 . 2 . . . . A 4 LEU HD23 . 34461 1 122 . 1 . 1 14 14 LEU CA C 13 54.621 0.1 . 1 . . . . A 4 LEU CA . 34461 1 123 . 1 . 1 14 14 LEU CB C 13 44.809 0.1 . 1 . . . . A 4 LEU CB . 34461 1 124 . 1 . 1 14 14 LEU CG C 13 27.397 0.1 . 1 . . . . A 4 LEU CG . 34461 1 125 . 1 . 1 14 14 LEU CD1 C 13 24.947 0.1 . 2 . . . . A 4 LEU CD1 . 34461 1 126 . 1 . 1 14 14 LEU CD2 C 13 26.136 0.1 . 2 . . . . A 4 LEU CD2 . 34461 1 127 . 1 . 1 14 14 LEU N N 15 130.249 0.1 . 1 . . . . A 4 LEU N . 34461 1 128 . 1 . 1 15 15 VAL H H 1 9.723 0.02 . 1 . . . . A 5 VAL H . 34461 1 129 . 1 . 1 15 15 VAL HA H 1 5.473 0.02 . 1 . . . . A 5 VAL HA . 34461 1 130 . 1 . 1 15 15 VAL HB H 1 2.133 0.02 . 1 . . . . A 5 VAL HB . 34461 1 131 . 1 . 1 15 15 VAL HG11 H 1 0.992 0.02 . 2 . . . . A 5 VAL HG11 . 34461 1 132 . 1 . 1 15 15 VAL HG12 H 1 0.992 0.02 . 2 . . . . A 5 VAL HG12 . 34461 1 133 . 1 . 1 15 15 VAL HG13 H 1 0.992 0.02 . 2 . . . . A 5 VAL HG13 . 34461 1 134 . 1 . 1 15 15 VAL HG21 H 1 0.966 0.02 . 2 . . . . A 5 VAL HG21 . 34461 1 135 . 1 . 1 15 15 VAL HG22 H 1 0.966 0.02 . 2 . . . . A 5 VAL HG22 . 34461 1 136 . 1 . 1 15 15 VAL HG23 H 1 0.966 0.02 . 2 . . . . A 5 VAL HG23 . 34461 1 137 . 1 . 1 15 15 VAL CA C 13 60.672 0.1 . 1 . . . . A 5 VAL CA . 34461 1 138 . 1 . 1 15 15 VAL CB C 13 33.310 0.1 . 1 . . . . A 5 VAL CB . 34461 1 139 . 1 . 1 15 15 VAL CG1 C 13 21.752 0.1 . 2 . . . . A 5 VAL CG1 . 34461 1 140 . 1 . 1 15 15 VAL CG2 C 13 22.003 0.1 . 2 . . . . A 5 VAL CG2 . 34461 1 141 . 1 . 1 15 15 VAL N N 15 128.731 0.1 . 1 . . . . A 5 VAL N . 34461 1 142 . 1 . 1 16 16 LEU H H 1 8.351 0.02 . 1 . . . . A 6 LEU H . 34461 1 143 . 1 . 1 16 16 LEU HA H 1 5.631 0.02 . 1 . . . . A 6 LEU HA . 34461 1 144 . 1 . 1 16 16 LEU HB2 H 1 2.033 0.02 . 2 . . . . A 6 LEU HB1 . 34461 1 145 . 1 . 1 16 16 LEU HB3 H 1 1.775 0.02 . 2 . . . . A 6 LEU HB2 . 34461 1 146 . 1 . 1 16 16 LEU HD11 H 1 0.790 0.02 . 2 . . . . A 6 LEU HD11 . 34461 1 147 . 1 . 1 16 16 LEU HD12 H 1 0.790 0.02 . 2 . . . . A 6 LEU HD12 . 34461 1 148 . 1 . 1 16 16 LEU HD13 H 1 0.790 0.02 . 2 . . . . A 6 LEU HD13 . 34461 1 149 . 1 . 1 16 16 LEU HD21 H 1 0.663 0.02 . 2 . . . . A 6 LEU HD21 . 34461 1 150 . 1 . 1 16 16 LEU HD22 H 1 0.663 0.02 . 2 . . . . A 6 LEU HD22 . 34461 1 151 . 1 . 1 16 16 LEU HD23 H 1 0.663 0.02 . 2 . . . . A 6 LEU HD23 . 34461 1 152 . 1 . 1 16 16 LEU CA C 13 53.632 0.1 . 1 . . . . A 6 LEU CA . 34461 1 153 . 1 . 1 16 16 LEU CB C 13 44.882 0.1 . 1 . . . . A 6 LEU CB . 34461 1 154 . 1 . 1 16 16 LEU CD1 C 13 24.487 0.1 . 2 . . . . A 6 LEU CD1 . 34461 1 155 . 1 . 1 16 16 LEU CD2 C 13 24.907 0.1 . 2 . . . . A 6 LEU CD2 . 34461 1 156 . 1 . 1 16 16 LEU N N 15 123.499 0.1 . 1 . . . . A 6 LEU N . 34461 1 157 . 1 . 1 17 17 GLY H H 1 8.189 0.02 . 1 . . . . A 7 GLY H . 34461 1 158 . 1 . 1 17 17 GLY HA2 H 1 5.528 0.02 . 2 . . . . A 7 GLY HA1 . 34461 1 159 . 1 . 1 17 17 GLY HA3 H 1 3.554 0.02 . 2 . . . . A 7 GLY HA2 . 34461 1 160 . 1 . 1 17 17 GLY CA C 13 45.995 0.1 . 1 . . . . A 7 GLY CA . 34461 1 161 . 1 . 1 17 17 GLY N N 15 103.610 0.1 . 1 . . . . A 7 GLY N . 34461 1 162 . 1 . 1 18 18 ASP H H 1 9.485 0.02 . 1 . . . . A 8 ASP H . 34461 1 163 . 1 . 1 18 18 ASP HA H 1 4.341 0.02 . 1 . . . . A 8 ASP HA . 34461 1 164 . 1 . 1 18 18 ASP CA C 13 56.814 0.1 . 1 . . . . A 8 ASP CA . 34461 1 165 . 1 . 1 18 18 ASP CB C 13 36.287 0.1 . 1 . . . . A 8 ASP CB . 34461 1 166 . 1 . 1 18 18 ASP N N 15 116.766 0.1 . 1 . . . . A 8 ASP N . 34461 1 167 . 1 . 1 19 19 LEU H H 1 7.288 0.02 . 1 . . . . A 9 LEU H . 34461 1 168 . 1 . 1 19 19 LEU HA H 1 4.270 0.02 . 1 . . . . A 9 LEU HA . 34461 1 169 . 1 . 1 19 19 LEU HB3 H 1 1.484 0.02 . 2 . . . . A 9 LEU HB2 . 34461 1 170 . 1 . 1 19 19 LEU HG H 1 1.583 0.02 . 1 . . . . A 9 LEU HG . 34461 1 171 . 1 . 1 19 19 LEU HD11 H 1 0.936 0.02 . 2 . . . . A 9 LEU HD11 . 34461 1 172 . 1 . 1 19 19 LEU HD12 H 1 0.936 0.02 . 2 . . . . A 9 LEU HD12 . 34461 1 173 . 1 . 1 19 19 LEU HD13 H 1 0.936 0.02 . 2 . . . . A 9 LEU HD13 . 34461 1 174 . 1 . 1 19 19 LEU CA C 13 57.368 0.1 . 1 . . . . A 9 LEU CA . 34461 1 175 . 1 . 1 19 19 LEU CB C 13 39.935 0.1 . 1 . . . . A 9 LEU CB . 34461 1 176 . 1 . 1 19 19 LEU CG C 13 29.582 0.1 . 1 . . . . A 9 LEU CG . 34461 1 177 . 1 . 1 19 19 LEU CD1 C 13 25.273 0.1 . 2 . . . . A 9 LEU CD1 . 34461 1 178 . 1 . 1 19 19 LEU N N 15 118.896 0.1 . 1 . . . . A 9 LEU N . 34461 1 179 . 1 . 1 20 20 HIS H H 1 8.372 0.02 . 1 . . . . A 10 HIS H . 34461 1 180 . 1 . 1 20 20 HIS HA H 1 4.032 0.02 . 1 . . . . A 10 HIS HA . 34461 1 181 . 1 . 1 20 20 HIS HB2 H 1 3.015 0.02 . 2 . . . . A 10 HIS HB1 . 34461 1 182 . 1 . 1 20 20 HIS HB3 H 1 2.780 0.02 . 2 . . . . A 10 HIS HB2 . 34461 1 183 . 1 . 1 20 20 HIS CA C 13 57.984 0.1 . 1 . . . . A 10 HIS CA . 34461 1 184 . 1 . 1 20 20 HIS CB C 13 28.321 0.1 . 1 . . . . A 10 HIS CB . 34461 1 185 . 1 . 1 20 20 HIS N N 15 110.009 0.1 . 1 . . . . A 10 HIS N . 34461 1 186 . 1 . 1 21 21 ILE H H 1 8.081 0.02 . 1 . . . . A 11 ILE H . 34461 1 187 . 1 . 1 21 21 ILE HA H 1 5.260 0.02 . 1 . . . . A 11 ILE HA . 34461 1 188 . 1 . 1 21 21 ILE HB H 1 1.657 0.02 . 1 . . . . A 11 ILE HB . 34461 1 189 . 1 . 1 21 21 ILE HG13 H 1 1.364 0.02 . 2 . . . . A 11 ILE HG12 . 34461 1 190 . 1 . 1 21 21 ILE HG21 H 1 0.700 0.02 . 1 . . . . A 11 ILE HG21 . 34461 1 191 . 1 . 1 21 21 ILE HG22 H 1 0.700 0.02 . 1 . . . . A 11 ILE HG22 . 34461 1 192 . 1 . 1 21 21 ILE HG23 H 1 0.700 0.02 . 1 . . . . A 11 ILE HG23 . 34461 1 193 . 1 . 1 21 21 ILE HD11 H 1 0.645 0.02 . 1 . . . . A 11 ILE HD11 . 34461 1 194 . 1 . 1 21 21 ILE HD12 H 1 0.645 0.02 . 1 . . . . A 11 ILE HD12 . 34461 1 195 . 1 . 1 21 21 ILE HD13 H 1 0.645 0.02 . 1 . . . . A 11 ILE HD13 . 34461 1 196 . 1 . 1 21 21 ILE CA C 13 57.883 0.1 . 1 . . . . A 11 ILE CA . 34461 1 197 . 1 . 1 21 21 ILE CB C 13 40.316 0.1 . 1 . . . . A 11 ILE CB . 34461 1 198 . 1 . 1 21 21 ILE CG1 C 13 27.711 0.1 . 1 . . . . A 11 ILE CG1 . 34461 1 199 . 1 . 1 21 21 ILE CG2 C 13 15.923 0.1 . 1 . . . . A 11 ILE CG2 . 34461 1 200 . 1 . 1 21 21 ILE CD1 C 13 13.789 0.1 . 1 . . . . A 11 ILE CD1 . 34461 1 201 . 1 . 1 21 21 ILE N N 15 119.932 0.1 . 1 . . . . A 11 ILE N . 34461 1 202 . 1 . 1 22 22 PRO HA H 1 5.578 0.02 . 1 . . . . A 12 PRO HA . 34461 1 203 . 1 . 1 22 22 PRO HB3 H 1 2.274 0.02 . 2 . . . . A 12 PRO HB2 . 34461 1 204 . 1 . 1 22 22 PRO HG3 H 1 1.980 0.02 . 2 . . . . A 12 PRO HG2 . 34461 1 205 . 1 . 1 22 22 PRO CA C 13 64.189 0.1 . 1 . . . . A 12 PRO CA . 34461 1 206 . 1 . 1 22 22 PRO CB C 13 33.774 0.1 . 1 . . . . A 12 PRO CB . 34461 1 207 . 1 . 1 22 22 PRO CG C 13 23.891 0.1 . 1 . . . . A 12 PRO CG . 34461 1 208 . 1 . 1 23 23 HIS H H 1 7.970 0.02 . 1 . . . . A 13 HIS H . 34461 1 209 . 1 . 1 23 23 HIS HA H 1 4.357 0.02 . 1 . . . . A 13 HIS HA . 34461 1 210 . 1 . 1 23 23 HIS HB2 H 1 3.068 0.02 . 2 . . . . A 13 HIS HB1 . 34461 1 211 . 1 . 1 23 23 HIS HB3 H 1 3.200 0.02 . 2 . . . . A 13 HIS HB2 . 34461 1 212 . 1 . 1 23 23 HIS CA C 13 59.919 0.1 . 1 . . . . A 13 HIS CA . 34461 1 213 . 1 . 1 23 23 HIS CB C 13 31.447 0.1 . 1 . . . . A 13 HIS CB . 34461 1 214 . 1 . 1 23 23 HIS N N 15 123.349 0.1 . 1 . . . . A 13 HIS N . 34461 1 215 . 1 . 1 24 24 ARG H H 1 8.593 0.02 . 1 . . . . A 14 ARG H . 34461 1 216 . 1 . 1 24 24 ARG HA H 1 4.728 0.02 . 1 . . . . A 14 ARG HA . 34461 1 217 . 1 . 1 24 24 ARG CA C 13 56.860 0.1 . 1 . . . . A 14 ARG CA . 34461 1 218 . 1 . 1 24 24 ARG CB C 13 31.324 0.1 . 1 . . . . A 14 ARG CB . 34461 1 219 . 1 . 1 24 24 ARG CD C 13 43.354 0.1 . 1 . . . . A 14 ARG CD . 34461 1 220 . 1 . 1 24 24 ARG N N 15 112.598 0.1 . 1 . . . . A 14 ARG N . 34461 1 221 . 1 . 1 25 25 CYS H H 1 7.579 0.02 . 1 . . . . A 15 CYS H . 34461 1 222 . 1 . 1 25 25 CYS HA H 1 4.722 0.02 . 1 . . . . A 15 CYS HA . 34461 1 223 . 1 . 1 25 25 CYS CB C 13 30.647 0.1 . 1 . . . . A 15 CYS CB . 34461 1 224 . 1 . 1 25 25 CYS N N 15 116.176 0.1 . 1 . . . . A 15 CYS N . 34461 1 225 . 1 . 1 26 26 ASN HA H 1 4.782 0.02 . 1 . . . . A 16 ASN HA . 34461 1 226 . 1 . 1 26 26 ASN HB3 H 1 2.805 0.02 . 2 . . . . A 16 ASN HB2 . 34461 1 227 . 1 . 1 26 26 ASN CA C 13 54.652 0.1 . 1 . . . . A 16 ASN CA . 34461 1 228 . 1 . 1 26 26 ASN CB C 13 40.064 0.1 . 1 . . . . A 16 ASN CB . 34461 1 229 . 1 . 1 27 27 SER H H 1 7.438 0.02 . 1 . . . . A 17 SER H . 34461 1 230 . 1 . 1 27 27 SER HA H 1 4.435 0.02 . 1 . . . . A 17 SER HA . 34461 1 231 . 1 . 1 27 27 SER HB2 H 1 3.769 0.02 . 2 . . . . A 17 SER HB1 . 34461 1 232 . 1 . 1 27 27 SER HB3 H 1 3.566 0.02 . 2 . . . . A 17 SER HB2 . 34461 1 233 . 1 . 1 27 27 SER CA C 13 57.195 0.1 . 1 . . . . A 17 SER CA . 34461 1 234 . 1 . 1 27 27 SER CB C 13 64.834 0.1 . 1 . . . . A 17 SER CB . 34461 1 235 . 1 . 1 27 27 SER N N 15 109.944 0.1 . 1 . . . . A 17 SER N . 34461 1 236 . 1 . 1 28 28 LEU H H 1 8.540 0.02 . 1 . . . . A 18 LEU H . 34461 1 237 . 1 . 1 28 28 LEU HA H 1 4.373 0.02 . 1 . . . . A 18 LEU HA . 34461 1 238 . 1 . 1 28 28 LEU HB2 H 1 1.363 0.02 . 2 . . . . A 18 LEU HB1 . 34461 1 239 . 1 . 1 28 28 LEU HB3 H 1 1.460 0.02 . 2 . . . . A 18 LEU HB2 . 34461 1 240 . 1 . 1 28 28 LEU HD11 H 1 0.759 0.02 . 2 . . . . A 18 LEU HD11 . 34461 1 241 . 1 . 1 28 28 LEU HD12 H 1 0.759 0.02 . 2 . . . . A 18 LEU HD12 . 34461 1 242 . 1 . 1 28 28 LEU HD13 H 1 0.759 0.02 . 2 . . . . A 18 LEU HD13 . 34461 1 243 . 1 . 1 28 28 LEU HD21 H 1 0.829 0.02 . 2 . . . . A 18 LEU HD21 . 34461 1 244 . 1 . 1 28 28 LEU HD22 H 1 0.829 0.02 . 2 . . . . A 18 LEU HD22 . 34461 1 245 . 1 . 1 28 28 LEU HD23 H 1 0.829 0.02 . 2 . . . . A 18 LEU HD23 . 34461 1 246 . 1 . 1 28 28 LEU CA C 13 55.360 0.1 . 1 . . . . A 18 LEU CA . 34461 1 247 . 1 . 1 28 28 LEU CB C 13 42.436 0.1 . 1 . . . . A 18 LEU CB . 34461 1 248 . 1 . 1 28 28 LEU CD1 C 13 25.716 0.1 . 2 . . . . A 18 LEU CD1 . 34461 1 249 . 1 . 1 28 28 LEU CD2 C 13 25.676 0.1 . 2 . . . . A 18 LEU CD2 . 34461 1 250 . 1 . 1 28 28 LEU N N 15 122.924 0.1 . 1 . . . . A 18 LEU N . 34461 1 251 . 1 . 1 30 30 ALA HA H 1 3.944 0.02 . 1 . . . . A 20 ALA HA . 34461 1 252 . 1 . 1 30 30 ALA HB1 H 1 1.501 0.02 . 1 . . . . A 20 ALA HB1 . 34461 1 253 . 1 . 1 30 30 ALA HB2 H 1 1.501 0.02 . 1 . . . . A 20 ALA HB2 . 34461 1 254 . 1 . 1 30 30 ALA HB3 H 1 1.501 0.02 . 1 . . . . A 20 ALA HB3 . 34461 1 255 . 1 . 1 30 30 ALA CA C 13 56.303 0.1 . 1 . . . . A 20 ALA CA . 34461 1 256 . 1 . 1 30 30 ALA CB C 13 18.214 0.1 . 1 . . . . A 20 ALA CB . 34461 1 257 . 1 . 1 31 31 LYS H H 1 9.144 0.02 . 1 . . . . A 21 LYS H . 34461 1 258 . 1 . 1 31 31 LYS HA H 1 4.005 0.02 . 1 . . . . A 21 LYS HA . 34461 1 259 . 1 . 1 31 31 LYS HB3 H 1 1.741 0.02 . 2 . . . . A 21 LYS HB2 . 34461 1 260 . 1 . 1 31 31 LYS HG2 H 1 1.449 0.02 . 2 . . . . A 21 LYS HG1 . 34461 1 261 . 1 . 1 31 31 LYS HG3 H 1 1.658 0.02 . 2 . . . . A 21 LYS HG2 . 34461 1 262 . 1 . 1 31 31 LYS HE3 H 1 3.079 0.02 . 1 . . . . A 21 LYS HE2 . 34461 1 263 . 1 . 1 31 31 LYS CA C 13 59.936 0.1 . 1 . . . . A 21 LYS CA . 34461 1 264 . 1 . 1 31 31 LYS CB C 13 32.686 0.1 . 1 . . . . A 21 LYS CB . 34461 1 265 . 1 . 1 31 31 LYS CG C 13 27.193 0.1 . 1 . . . . A 21 LYS CG . 34461 1 266 . 1 . 1 31 31 LYS CD C 13 29.427 0.1 . 1 . . . . A 21 LYS CD . 34461 1 267 . 1 . 1 31 31 LYS CE C 13 43.461 0.1 . 1 . . . . A 21 LYS CE . 34461 1 268 . 1 . 1 31 31 LYS N N 15 114.713 0.1 . 1 . . . . A 21 LYS N . 34461 1 269 . 1 . 1 32 32 PHE H H 1 7.199 0.02 . 1 . . . . A 22 PHE H . 34461 1 270 . 1 . 1 32 32 PHE HA H 1 4.857 0.02 . 1 . . . . A 22 PHE HA . 34461 1 271 . 1 . 1 32 32 PHE HB3 H 1 2.994 0.02 . 2 . . . . A 22 PHE HB2 . 34461 1 272 . 1 . 1 32 32 PHE HD1 H 1 6.974 0.02 . 1 . . . . A 22 PHE HD1 . 34461 1 273 . 1 . 1 32 32 PHE HD2 H 1 6.974 0.02 . 1 . . . . A 22 PHE HD2 . 34461 1 274 . 1 . 1 32 32 PHE HE1 H 1 7.123 0.02 . 1 . . . . A 22 PHE HE1 . 34461 1 275 . 1 . 1 32 32 PHE HE2 H 1 7.123 0.02 . 1 . . . . A 22 PHE HE2 . 34461 1 276 . 1 . 1 32 32 PHE HZ H 1 6.611 0.02 . 1 . . . . A 22 PHE HZ . 34461 1 277 . 1 . 1 32 32 PHE CA C 13 56.245 0.1 . 1 . . . . A 22 PHE CA . 34461 1 278 . 1 . 1 32 32 PHE CB C 13 36.662 0.1 . 1 . . . . A 22 PHE CB . 34461 1 279 . 1 . 1 32 32 PHE CD2 C 13 129.764 0.1 . 1 . . . . A 22 PHE CD2 . 34461 1 280 . 1 . 1 32 32 PHE CE2 C 13 130.722 0.1 . 1 . . . . A 22 PHE CE2 . 34461 1 281 . 1 . 1 32 32 PHE CZ C 13 130.742 0.1 . 1 . . . . A 22 PHE CZ . 34461 1 282 . 1 . 1 32 32 PHE N N 15 113.988 0.1 . 1 . . . . A 22 PHE N . 34461 1 283 . 1 . 1 33 33 LYS H H 1 8.101 0.02 . 1 . . . . A 23 LYS H . 34461 1 284 . 1 . 1 33 33 LYS HA H 1 3.865 0.02 . 1 . . . . A 23 LYS HA . 34461 1 285 . 1 . 1 33 33 LYS HB2 H 1 1.756 0.02 . 2 . . . . A 23 LYS HB1 . 34461 1 286 . 1 . 1 33 33 LYS HB3 H 1 1.914 0.02 . 2 . . . . A 23 LYS HB2 . 34461 1 287 . 1 . 1 33 33 LYS HG2 H 1 1.435 0.02 . 2 . . . . A 23 LYS HG1 . 34461 1 288 . 1 . 1 33 33 LYS HG3 H 1 1.296 0.02 . 2 . . . . A 23 LYS HG2 . 34461 1 289 . 1 . 1 33 33 LYS HD3 H 1 1.603 0.02 . 2 . . . . A 23 LYS HD2 . 34461 1 290 . 1 . 1 33 33 LYS CA C 13 60.427 0.1 . 1 . . . . A 23 LYS CA . 34461 1 291 . 1 . 1 33 33 LYS CB C 13 31.943 0.1 . 1 . . . . A 23 LYS CB . 34461 1 292 . 1 . 1 33 33 LYS CG C 13 26.122 0.1 . 1 . . . . A 23 LYS CG . 34461 1 293 . 1 . 1 33 33 LYS CD C 13 29.293 0.1 . 1 . . . . A 23 LYS CD . 34461 1 294 . 1 . 1 33 33 LYS N N 15 119.332 0.1 . 1 . . . . A 23 LYS N . 34461 1 295 . 1 . 1 34 34 LYS H H 1 7.652 0.02 . 1 . . . . A 24 LYS H . 34461 1 296 . 1 . 1 34 34 LYS HA H 1 4.032 0.02 . 1 . . . . A 24 LYS HA . 34461 1 297 . 1 . 1 34 34 LYS HB2 H 1 1.462 0.02 . 2 . . . . A 24 LYS HB1 . 34461 1 298 . 1 . 1 34 34 LYS HB3 H 1 1.867 0.02 . 2 . . . . A 24 LYS HB2 . 34461 1 299 . 1 . 1 34 34 LYS HG3 H 1 1.548 0.02 . 2 . . . . A 24 LYS HG2 . 34461 1 300 . 1 . 1 34 34 LYS HD3 H 1 1.742 0.02 . 2 . . . . A 24 LYS HD2 . 34461 1 301 . 1 . 1 34 34 LYS HE3 H 1 3.029 0.02 . 1 . . . . A 24 LYS HE2 . 34461 1 302 . 1 . 1 34 34 LYS CA C 13 58.048 0.1 . 1 . . . . A 24 LYS CA . 34461 1 303 . 1 . 1 34 34 LYS CB C 13 32.946 0.1 . 1 . . . . A 24 LYS CB . 34461 1 304 . 1 . 1 34 34 LYS CG C 13 24.794 0.1 . 1 . . . . A 24 LYS CG . 34461 1 305 . 1 . 1 34 34 LYS CD C 13 29.069 0.1 . 1 . . . . A 24 LYS CD . 34461 1 306 . 1 . 1 34 34 LYS CE C 13 41.529 0.1 . 1 . . . . A 24 LYS CE . 34461 1 307 . 1 . 1 34 34 LYS N N 15 114.675 0.1 . 1 . . . . A 24 LYS N . 34461 1 308 . 1 . 1 35 35 LEU H H 1 6.937 0.02 . 1 . . . . A 25 LEU H . 34461 1 309 . 1 . 1 35 35 LEU HA H 1 4.281 0.02 . 1 . . . . A 25 LEU HA . 34461 1 310 . 1 . 1 35 35 LEU HB2 H 1 1.982 0.02 . 2 . . . . A 25 LEU HB1 . 34461 1 311 . 1 . 1 35 35 LEU HB3 H 1 1.494 0.02 . 2 . . . . A 25 LEU HB2 . 34461 1 312 . 1 . 1 35 35 LEU HD11 H 1 1.039 0.02 . 2 . . . . A 25 LEU HD11 . 34461 1 313 . 1 . 1 35 35 LEU HD12 H 1 1.039 0.02 . 2 . . . . A 25 LEU HD12 . 34461 1 314 . 1 . 1 35 35 LEU HD13 H 1 1.039 0.02 . 2 . . . . A 25 LEU HD13 . 34461 1 315 . 1 . 1 35 35 LEU HD21 H 1 1.041 0.02 . 2 . . . . A 25 LEU HD21 . 34461 1 316 . 1 . 1 35 35 LEU HD22 H 1 1.041 0.02 . 2 . . . . A 25 LEU HD22 . 34461 1 317 . 1 . 1 35 35 LEU HD23 H 1 1.041 0.02 . 2 . . . . A 25 LEU HD23 . 34461 1 318 . 1 . 1 35 35 LEU CA C 13 55.845 0.1 . 1 . . . . A 25 LEU CA . 34461 1 319 . 1 . 1 35 35 LEU CB C 13 43.882 0.1 . 1 . . . . A 25 LEU CB . 34461 1 320 . 1 . 1 35 35 LEU CD1 C 13 22.823 0.1 . 2 . . . . A 25 LEU CD1 . 34461 1 321 . 1 . 1 35 35 LEU CD2 C 13 26.599 0.1 . 2 . . . . A 25 LEU CD2 . 34461 1 322 . 1 . 1 35 35 LEU N N 15 114.898 0.1 . 1 . . . . A 25 LEU N . 34461 1 323 . 1 . 1 36 36 LEU H H 1 7.197 0.02 . 1 . . . . A 26 LEU H . 34461 1 324 . 1 . 1 36 36 LEU HA H 1 4.029 0.02 . 1 . . . . A 26 LEU HA . 34461 1 325 . 1 . 1 36 36 LEU HB3 H 1 1.773 0.02 . 2 . . . . A 26 LEU HB2 . 34461 1 326 . 1 . 1 36 36 LEU HD11 H 1 0.169 0.02 . 2 . . . . A 26 LEU HD11 . 34461 1 327 . 1 . 1 36 36 LEU HD12 H 1 0.169 0.02 . 2 . . . . A 26 LEU HD12 . 34461 1 328 . 1 . 1 36 36 LEU HD13 H 1 0.169 0.02 . 2 . . . . A 26 LEU HD13 . 34461 1 329 . 1 . 1 36 36 LEU HD21 H 1 0.166 0.02 . 2 . . . . A 26 LEU HD21 . 34461 1 330 . 1 . 1 36 36 LEU HD22 H 1 0.166 0.02 . 2 . . . . A 26 LEU HD22 . 34461 1 331 . 1 . 1 36 36 LEU HD23 H 1 0.166 0.02 . 2 . . . . A 26 LEU HD23 . 34461 1 332 . 1 . 1 36 36 LEU CA C 13 53.724 0.1 . 1 . . . . A 26 LEU CA . 34461 1 333 . 1 . 1 36 36 LEU CB C 13 40.141 0.1 . 1 . . . . A 26 LEU CB . 34461 1 334 . 1 . 1 36 36 LEU CG C 13 25.142 0.1 . 1 . . . . A 26 LEU CG . 34461 1 335 . 1 . 1 36 36 LEU CD1 C 13 24.158 0.1 . 2 . . . . A 26 LEU CD1 . 34461 1 336 . 1 . 1 36 36 LEU CD2 C 13 22.960 0.1 . 2 . . . . A 26 LEU CD2 . 34461 1 337 . 1 . 1 36 36 LEU N N 15 120.327 0.1 . 1 . . . . A 26 LEU N . 34461 1 338 . 1 . 1 37 37 VAL H H 1 6.848 0.02 . 1 . . . . A 27 VAL H . 34461 1 339 . 1 . 1 37 37 VAL HA H 1 4.579 0.02 . 1 . . . . A 27 VAL HA . 34461 1 340 . 1 . 1 37 37 VAL HB H 1 2.079 0.02 . 1 . . . . A 27 VAL HB . 34461 1 341 . 1 . 1 37 37 VAL HG11 H 1 0.849 0.02 . 2 . . . . A 27 VAL HG11 . 34461 1 342 . 1 . 1 37 37 VAL HG12 H 1 0.849 0.02 . 2 . . . . A 27 VAL HG12 . 34461 1 343 . 1 . 1 37 37 VAL HG13 H 1 0.849 0.02 . 2 . . . . A 27 VAL HG13 . 34461 1 344 . 1 . 1 37 37 VAL HG21 H 1 0.939 0.02 . 2 . . . . A 27 VAL HG21 . 34461 1 345 . 1 . 1 37 37 VAL HG22 H 1 0.939 0.02 . 2 . . . . A 27 VAL HG22 . 34461 1 346 . 1 . 1 37 37 VAL HG23 H 1 0.939 0.02 . 2 . . . . A 27 VAL HG23 . 34461 1 347 . 1 . 1 37 37 VAL CA C 13 57.953 0.1 . 1 . . . . A 27 VAL CA . 34461 1 348 . 1 . 1 37 37 VAL CB C 13 32.852 0.1 . 1 . . . . A 27 VAL CB . 34461 1 349 . 1 . 1 37 37 VAL CG1 C 13 18.647 0.1 . 2 . . . . A 27 VAL CG1 . 34461 1 350 . 1 . 1 37 37 VAL CG2 C 13 21.248 0.1 . 2 . . . . A 27 VAL CG2 . 34461 1 351 . 1 . 1 37 37 VAL N N 15 118.641 0.1 . 1 . . . . A 27 VAL N . 34461 1 352 . 1 . 1 38 38 PRO HA H 1 4.386 0.02 . 1 . . . . A 28 PRO HA . 34461 1 353 . 1 . 1 38 38 PRO HB2 H 1 1.855 0.02 . 2 . . . . A 28 PRO HB1 . 34461 1 354 . 1 . 1 38 38 PRO HB3 H 1 2.502 0.02 . 2 . . . . A 28 PRO HB2 . 34461 1 355 . 1 . 1 38 38 PRO HG3 H 1 2.017 0.02 . 2 . . . . A 28 PRO HG2 . 34461 1 356 . 1 . 1 38 38 PRO HD2 H 1 3.740 0.02 . 2 . . . . A 28 PRO HD1 . 34461 1 357 . 1 . 1 38 38 PRO HD3 H 1 3.858 0.02 . 2 . . . . A 28 PRO HD2 . 34461 1 358 . 1 . 1 38 38 PRO CA C 13 63.520 0.1 . 1 . . . . A 28 PRO CA . 34461 1 359 . 1 . 1 38 38 PRO CB C 13 32.698 0.1 . 1 . . . . A 28 PRO CB . 34461 1 360 . 1 . 1 38 38 PRO CG C 13 27.435 0.1 . 1 . . . . A 28 PRO CG . 34461 1 361 . 1 . 1 38 38 PRO CD C 13 50.975 0.1 . 1 . . . . A 28 PRO CD . 34461 1 362 . 1 . 1 39 39 GLY H H 1 8.333 0.02 . 1 . . . . A 29 GLY H . 34461 1 363 . 1 . 1 39 39 GLY HA2 H 1 4.168 0.02 . 2 . . . . A 29 GLY HA1 . 34461 1 364 . 1 . 1 39 39 GLY HA3 H 1 3.773 0.02 . 2 . . . . A 29 GLY HA2 . 34461 1 365 . 1 . 1 39 39 GLY CA C 13 46.176 0.1 . 1 . . . . A 29 GLY CA . 34461 1 366 . 1 . 1 39 39 GLY N N 15 108.624 0.1 . 1 . . . . A 29 GLY N . 34461 1 367 . 1 . 1 40 40 LYS H H 1 8.394 0.02 . 1 . . . . A 30 LYS H . 34461 1 368 . 1 . 1 40 40 LYS HA H 1 4.494 0.02 . 1 . . . . A 30 LYS HA . 34461 1 369 . 1 . 1 40 40 LYS HB3 H 1 1.651 0.02 . 2 . . . . A 30 LYS HB2 . 34461 1 370 . 1 . 1 40 40 LYS HG3 H 1 1.351 0.02 . 2 . . . . A 30 LYS HG2 . 34461 1 371 . 1 . 1 40 40 LYS HE2 H 1 2.956 0.02 . 1 . . . . A 30 LYS HE1 . 34461 1 372 . 1 . 1 40 40 LYS HE3 H 1 2.960 0.02 . 1 . . . . A 30 LYS HE2 . 34461 1 373 . 1 . 1 40 40 LYS CA C 13 56.695 0.1 . 1 . . . . A 30 LYS CA . 34461 1 374 . 1 . 1 40 40 LYS CB C 13 35.417 0.1 . 1 . . . . A 30 LYS CB . 34461 1 375 . 1 . 1 40 40 LYS CG C 13 24.966 0.1 . 1 . . . . A 30 LYS CG . 34461 1 376 . 1 . 1 40 40 LYS CE C 13 41.850 0.1 . 1 . . . . A 30 LYS CE . 34461 1 377 . 1 . 1 40 40 LYS N N 15 119.629 0.1 . 1 . . . . A 30 LYS N . 34461 1 378 . 1 . 1 41 41 ILE H H 1 8.608 0.02 . 1 . . . . A 31 ILE H . 34461 1 379 . 1 . 1 41 41 ILE HA H 1 3.874 0.02 . 1 . . . . A 31 ILE HA . 34461 1 380 . 1 . 1 41 41 ILE HB H 1 1.977 0.02 . 1 . . . . A 31 ILE HB . 34461 1 381 . 1 . 1 41 41 ILE HG12 H 1 1.253 0.02 . 2 . . . . A 31 ILE HG11 . 34461 1 382 . 1 . 1 41 41 ILE HG13 H 1 1.701 0.02 . 2 . . . . A 31 ILE HG12 . 34461 1 383 . 1 . 1 41 41 ILE HG21 H 1 0.862 0.02 . 1 . . . . A 31 ILE HG21 . 34461 1 384 . 1 . 1 41 41 ILE HG22 H 1 0.862 0.02 . 1 . . . . A 31 ILE HG22 . 34461 1 385 . 1 . 1 41 41 ILE HG23 H 1 0.862 0.02 . 1 . . . . A 31 ILE HG23 . 34461 1 386 . 1 . 1 41 41 ILE HD11 H 1 0.795 0.02 . 1 . . . . A 31 ILE HD11 . 34461 1 387 . 1 . 1 41 41 ILE HD12 H 1 0.795 0.02 . 1 . . . . A 31 ILE HD12 . 34461 1 388 . 1 . 1 41 41 ILE HD13 H 1 0.795 0.02 . 1 . . . . A 31 ILE HD13 . 34461 1 389 . 1 . 1 41 41 ILE CA C 13 61.120 0.1 . 1 . . . . A 31 ILE CA . 34461 1 390 . 1 . 1 41 41 ILE CB C 13 39.453 0.1 . 1 . . . . A 31 ILE CB . 34461 1 391 . 1 . 1 41 41 ILE CG1 C 13 26.890 0.1 . 1 . . . . A 31 ILE CG1 . 34461 1 392 . 1 . 1 41 41 ILE CG2 C 13 20.351 0.1 . 1 . . . . A 31 ILE CG2 . 34461 1 393 . 1 . 1 41 41 ILE CD1 C 13 14.063 0.1 . 1 . . . . A 31 ILE CD1 . 34461 1 394 . 1 . 1 41 41 ILE N N 15 119.923 0.1 . 1 . . . . A 31 ILE N . 34461 1 395 . 1 . 1 42 42 GLN H H 1 8.187 0.02 . 1 . . . . A 32 GLN H . 34461 1 396 . 1 . 1 42 42 GLN HA H 1 4.385 0.02 . 1 . . . . A 32 GLN HA . 34461 1 397 . 1 . 1 42 42 GLN HB2 H 1 1.734 0.02 . 2 . . . . A 32 GLN HB1 . 34461 1 398 . 1 . 1 42 42 GLN HB3 H 1 2.286 0.02 . 2 . . . . A 32 GLN HB2 . 34461 1 399 . 1 . 1 42 42 GLN HG2 H 1 2.283 0.02 . 2 . . . . A 32 GLN HG1 . 34461 1 400 . 1 . 1 42 42 GLN HG3 H 1 2.544 0.02 . 2 . . . . A 32 GLN HG2 . 34461 1 401 . 1 . 1 42 42 GLN HE21 H 1 6.455 0.02 . 1 . . . . A 32 GLN HE21 . 34461 1 402 . 1 . 1 42 42 GLN HE22 H 1 7.572 0.02 . 1 . . . . A 32 GLN HE22 . 34461 1 403 . 1 . 1 42 42 GLN CA C 13 59.114 0.1 . 1 . . . . A 32 GLN CA . 34461 1 404 . 1 . 1 42 42 GLN CB C 13 31.270 0.1 . 1 . . . . A 32 GLN CB . 34461 1 405 . 1 . 1 42 42 GLN CG C 13 36.447 0.1 . 1 . . . . A 32 GLN CG . 34461 1 406 . 1 . 1 42 42 GLN N N 15 123.588 0.1 . 1 . . . . A 32 GLN N . 34461 1 407 . 1 . 1 42 42 GLN NE2 N 15 113.403 0.1 . 1 . . . . A 32 GLN NE2 . 34461 1 408 . 1 . 1 43 43 HIS H H 1 7.568 0.02 . 1 . . . . A 33 HIS H . 34461 1 409 . 1 . 1 43 43 HIS HA H 1 5.480 0.02 . 1 . . . . A 33 HIS HA . 34461 1 410 . 1 . 1 43 43 HIS HB3 H 1 2.932 0.02 . 2 . . . . A 33 HIS HB2 . 34461 1 411 . 1 . 1 43 43 HIS CA C 13 53.956 0.1 . 1 . . . . A 33 HIS CA . 34461 1 412 . 1 . 1 43 43 HIS N N 15 114.572 0.1 . 1 . . . . A 33 HIS N . 34461 1 413 . 1 . 1 44 44 ILE H H 1 8.887 0.02 . 1 . . . . A 34 ILE H . 34461 1 414 . 1 . 1 44 44 ILE HA H 1 5.081 0.02 . 1 . . . . A 34 ILE HA . 34461 1 415 . 1 . 1 44 44 ILE HB H 1 1.639 0.02 . 1 . . . . A 34 ILE HB . 34461 1 416 . 1 . 1 44 44 ILE HG12 H 1 1.096 0.02 . 2 . . . . A 34 ILE HG11 . 34461 1 417 . 1 . 1 44 44 ILE HG13 H 1 0.496 0.02 . 2 . . . . A 34 ILE HG12 . 34461 1 418 . 1 . 1 44 44 ILE HG21 H 1 0.736 0.02 . 1 . . . . A 34 ILE HG21 . 34461 1 419 . 1 . 1 44 44 ILE HG22 H 1 0.736 0.02 . 1 . . . . A 34 ILE HG22 . 34461 1 420 . 1 . 1 44 44 ILE HG23 H 1 0.736 0.02 . 1 . . . . A 34 ILE HG23 . 34461 1 421 . 1 . 1 44 44 ILE HD11 H 1 0.763 0.02 . 1 . . . . A 34 ILE HD11 . 34461 1 422 . 1 . 1 44 44 ILE HD12 H 1 0.763 0.02 . 1 . . . . A 34 ILE HD12 . 34461 1 423 . 1 . 1 44 44 ILE HD13 H 1 0.763 0.02 . 1 . . . . A 34 ILE HD13 . 34461 1 424 . 1 . 1 44 44 ILE CA C 13 60.438 0.1 . 1 . . . . A 34 ILE CA . 34461 1 425 . 1 . 1 44 44 ILE CB C 13 40.934 0.1 . 1 . . . . A 34 ILE CB . 34461 1 426 . 1 . 1 44 44 ILE CG1 C 13 27.588 0.1 . 1 . . . . A 34 ILE CG1 . 34461 1 427 . 1 . 1 44 44 ILE CG2 C 13 16.951 0.1 . 1 . . . . A 34 ILE CG2 . 34461 1 428 . 1 . 1 44 44 ILE CD1 C 13 15.788 0.1 . 1 . . . . A 34 ILE CD1 . 34461 1 429 . 1 . 1 44 44 ILE N N 15 121.316 0.1 . 1 . . . . A 34 ILE N . 34461 1 430 . 1 . 1 45 45 LEU H H 1 9.463 0.02 . 1 . . . . A 35 LEU H . 34461 1 431 . 1 . 1 45 45 LEU HA H 1 4.928 0.02 . 1 . . . . A 35 LEU HA . 34461 1 432 . 1 . 1 45 45 LEU HB2 H 1 1.837 0.02 . 2 . . . . A 35 LEU HB1 . 34461 1 433 . 1 . 1 45 45 LEU HB3 H 1 1.343 0.02 . 2 . . . . A 35 LEU HB2 . 34461 1 434 . 1 . 1 45 45 LEU HD11 H 1 0.714 0.02 . 2 . . . . A 35 LEU HD11 . 34461 1 435 . 1 . 1 45 45 LEU HD12 H 1 0.714 0.02 . 2 . . . . A 35 LEU HD12 . 34461 1 436 . 1 . 1 45 45 LEU HD13 H 1 0.714 0.02 . 2 . . . . A 35 LEU HD13 . 34461 1 437 . 1 . 1 45 45 LEU HD21 H 1 0.702 0.02 . 2 . . . . A 35 LEU HD21 . 34461 1 438 . 1 . 1 45 45 LEU HD22 H 1 0.702 0.02 . 2 . . . . A 35 LEU HD22 . 34461 1 439 . 1 . 1 45 45 LEU HD23 H 1 0.702 0.02 . 2 . . . . A 35 LEU HD23 . 34461 1 440 . 1 . 1 45 45 LEU CA C 13 53.751 0.1 . 1 . . . . A 35 LEU CA . 34461 1 441 . 1 . 1 45 45 LEU CB C 13 42.455 0.1 . 1 . . . . A 35 LEU CB . 34461 1 442 . 1 . 1 45 45 LEU CG C 13 27.714 0.1 . 1 . . . . A 35 LEU CG . 34461 1 443 . 1 . 1 45 45 LEU CD1 C 13 26.502 0.1 . 2 . . . . A 35 LEU CD1 . 34461 1 444 . 1 . 1 45 45 LEU CD2 C 13 24.852 0.1 . 2 . . . . A 35 LEU CD2 . 34461 1 445 . 1 . 1 45 45 LEU N N 15 128.756 0.1 . 1 . . . . A 35 LEU N . 34461 1 446 . 1 . 1 46 46 CYS H H 1 9.128 0.02 . 1 . . . . A 36 CYS H . 34461 1 447 . 1 . 1 46 46 CYS HA H 1 6.179 0.02 . 1 . . . . A 36 CYS HA . 34461 1 448 . 1 . 1 46 46 CYS HB2 H 1 2.487 0.02 . 2 . . . . A 36 CYS HB1 . 34461 1 449 . 1 . 1 46 46 CYS HB3 H 1 2.779 0.02 . 2 . . . . A 36 CYS HB2 . 34461 1 450 . 1 . 1 46 46 CYS CA C 13 54.816 0.1 . 1 . . . . A 36 CYS CA . 34461 1 451 . 1 . 1 46 46 CYS CB C 13 29.024 0.1 . 1 . . . . A 36 CYS CB . 34461 1 452 . 1 . 1 46 46 CYS N N 15 122.851 0.1 . 1 . . . . A 36 CYS N . 34461 1 453 . 1 . 1 47 47 THR H H 1 8.552 0.02 . 1 . . . . A 37 THR H . 34461 1 454 . 1 . 1 47 47 THR HB H 1 4.103 0.02 . 1 . . . . A 37 THR HB . 34461 1 455 . 1 . 1 47 47 THR HG21 H 1 1.313 0.02 . 1 . . . . A 37 THR HG21 . 34461 1 456 . 1 . 1 47 47 THR HG22 H 1 1.313 0.02 . 1 . . . . A 37 THR HG22 . 34461 1 457 . 1 . 1 47 47 THR HG23 H 1 1.313 0.02 . 1 . . . . A 37 THR HG23 . 34461 1 458 . 1 . 1 47 47 THR CA C 13 63.297 0.1 . 1 . . . . A 37 THR CA . 34461 1 459 . 1 . 1 47 47 THR CB C 13 69.206 0.1 . 1 . . . . A 37 THR CB . 34461 1 460 . 1 . 1 47 47 THR CG2 C 13 21.731 0.1 . 1 . . . . A 37 THR CG2 . 34461 1 461 . 1 . 1 47 47 THR N N 15 117.215 0.1 . 1 . . . . A 37 THR N . 34461 1 462 . 1 . 1 48 48 GLY H H 1 7.588 0.02 . 1 . . . . A 38 GLY H . 34461 1 463 . 1 . 1 48 48 GLY HA2 H 1 3.535 0.02 . 2 . . . . A 38 GLY HA1 . 34461 1 464 . 1 . 1 48 48 GLY CA C 13 43.651 0.1 . 1 . . . . A 38 GLY CA . 34461 1 465 . 1 . 1 48 48 GLY N N 15 104.266 0.1 . 1 . . . . A 38 GLY N . 34461 1 466 . 1 . 1 49 49 ASN H H 1 10.733 0.02 . 1 . . . . A 39 ASN H . 34461 1 467 . 1 . 1 49 49 ASN HA H 1 4.331 0.02 . 1 . . . . A 39 ASN HA . 34461 1 468 . 1 . 1 49 49 ASN HB3 H 1 3.125 0.02 . 2 . . . . A 39 ASN HB2 . 34461 1 469 . 1 . 1 49 49 ASN CA C 13 53.006 0.1 . 1 . . . . A 39 ASN CA . 34461 1 470 . 1 . 1 49 49 ASN CB C 13 34.773 0.1 . 1 . . . . A 39 ASN CB . 34461 1 471 . 1 . 1 49 49 ASN N N 15 117.764 0.1 . 1 . . . . A 39 ASN N . 34461 1 472 . 1 . 1 50 50 LEU H H 1 10.224 0.02 . 1 . . . . A 40 LEU H . 34461 1 473 . 1 . 1 50 50 LEU HA H 1 4.141 0.02 . 1 . . . . A 40 LEU HA . 34461 1 474 . 1 . 1 50 50 LEU HG H 1 1.775 0.02 . 1 . . . . A 40 LEU HG . 34461 1 475 . 1 . 1 50 50 LEU HD11 H 1 1.033 0.02 . 2 . . . . A 40 LEU HD11 . 34461 1 476 . 1 . 1 50 50 LEU HD12 H 1 1.033 0.02 . 2 . . . . A 40 LEU HD12 . 34461 1 477 . 1 . 1 50 50 LEU HD13 H 1 1.033 0.02 . 2 . . . . A 40 LEU HD13 . 34461 1 478 . 1 . 1 50 50 LEU HD21 H 1 0.877 0.02 . 2 . . . . A 40 LEU HD21 . 34461 1 479 . 1 . 1 50 50 LEU HD22 H 1 0.877 0.02 . 2 . . . . A 40 LEU HD22 . 34461 1 480 . 1 . 1 50 50 LEU HD23 H 1 0.877 0.02 . 2 . . . . A 40 LEU HD23 . 34461 1 481 . 1 . 1 50 50 LEU CA C 13 59.412 0.1 . 1 . . . . A 40 LEU CA . 34461 1 482 . 1 . 1 50 50 LEU CB C 13 41.330 0.1 . 1 . . . . A 40 LEU CB . 34461 1 483 . 1 . 1 50 50 LEU CG C 13 28.268 0.1 . 1 . . . . A 40 LEU CG . 34461 1 484 . 1 . 1 50 50 LEU CD1 C 13 26.767 0.1 . 2 . . . . A 40 LEU CD1 . 34461 1 485 . 1 . 1 50 50 LEU CD2 C 13 24.239 0.1 . 2 . . . . A 40 LEU CD2 . 34461 1 486 . 1 . 1 50 50 LEU N N 15 124.900 0.1 . 1 . . . . A 40 LEU N . 34461 1 487 . 1 . 1 51 51 CYS H H 1 8.119 0.02 . 1 . . . . A 41 CYS H . 34461 1 488 . 1 . 1 51 51 CYS HA H 1 5.061 0.02 . 1 . . . . A 41 CYS HA . 34461 1 489 . 1 . 1 51 51 CYS HB2 H 1 2.573 0.02 . 2 . . . . A 41 CYS HB1 . 34461 1 490 . 1 . 1 51 51 CYS HB3 H 1 3.769 0.02 . 2 . . . . A 41 CYS HB2 . 34461 1 491 . 1 . 1 51 51 CYS CA C 13 60.183 0.1 . 1 . . . . A 41 CYS CA . 34461 1 492 . 1 . 1 51 51 CYS CB C 13 31.596 0.1 . 1 . . . . A 41 CYS CB . 34461 1 493 . 1 . 1 51 51 CYS N N 15 116.297 0.1 . 1 . . . . A 41 CYS N . 34461 1 494 . 1 . 1 52 52 THR H H 1 8.548 0.02 . 1 . . . . A 42 THR H . 34461 1 495 . 1 . 1 52 52 THR HA H 1 5.166 0.02 . 1 . . . . A 42 THR HA . 34461 1 496 . 1 . 1 52 52 THR HG21 H 1 1.253 0.02 . 1 . . . . A 42 THR HG21 . 34461 1 497 . 1 . 1 52 52 THR HG22 H 1 1.253 0.02 . 1 . . . . A 42 THR HG22 . 34461 1 498 . 1 . 1 52 52 THR HG23 H 1 1.253 0.02 . 1 . . . . A 42 THR HG23 . 34461 1 499 . 1 . 1 52 52 THR CA C 13 59.644 0.1 . 1 . . . . A 42 THR CA . 34461 1 500 . 1 . 1 52 52 THR CB C 13 72.832 0.1 . 1 . . . . A 42 THR CB . 34461 1 501 . 1 . 1 52 52 THR CG2 C 13 21.687 0.1 . 1 . . . . A 42 THR CG2 . 34461 1 502 . 1 . 1 52 52 THR N N 15 112.079 0.1 . 1 . . . . A 42 THR N . 34461 1 503 . 1 . 1 53 53 LYS H H 1 8.760 0.02 . 1 . . . . A 43 LYS H . 34461 1 504 . 1 . 1 53 53 LYS HA H 1 4.142 0.02 . 1 . . . . A 43 LYS HA . 34461 1 505 . 1 . 1 53 53 LYS HB2 H 1 1.882 0.02 . 2 . . . . A 43 LYS HB1 . 34461 1 506 . 1 . 1 53 53 LYS HB3 H 1 2.026 0.02 . 2 . . . . A 43 LYS HB2 . 34461 1 507 . 1 . 1 53 53 LYS HG3 H 1 1.679 0.02 . 2 . . . . A 43 LYS HG2 . 34461 1 508 . 1 . 1 53 53 LYS HD3 H 1 1.791 0.02 . 2 . . . . A 43 LYS HD2 . 34461 1 509 . 1 . 1 53 53 LYS HE2 H 1 3.028 0.02 . 1 . . . . A 43 LYS HE1 . 34461 1 510 . 1 . 1 53 53 LYS HE3 H 1 3.083 0.02 . 1 . . . . A 43 LYS HE2 . 34461 1 511 . 1 . 1 53 53 LYS CA C 13 58.974 0.1 . 1 . . . . A 43 LYS CA . 34461 1 512 . 1 . 1 53 53 LYS CB C 13 32.774 0.1 . 1 . . . . A 43 LYS CB . 34461 1 513 . 1 . 1 53 53 LYS CG C 13 24.687 0.1 . 1 . . . . A 43 LYS CG . 34461 1 514 . 1 . 1 53 53 LYS CD C 13 29.309 0.1 . 1 . . . . A 43 LYS CD . 34461 1 515 . 1 . 1 53 53 LYS CE C 13 42.175 0.1 . 1 . . . . A 43 LYS CE . 34461 1 516 . 1 . 1 53 53 LYS N N 15 120.618 0.1 . 1 . . . . A 43 LYS N . 34461 1 517 . 1 . 1 54 54 GLU H H 1 8.403 0.02 . 1 . . . . A 44 GLU H . 34461 1 518 . 1 . 1 54 54 GLU HA H 1 4.205 0.02 . 1 . . . . A 44 GLU HA . 34461 1 519 . 1 . 1 54 54 GLU HB2 H 1 1.939 0.02 . 2 . . . . A 44 GLU HB1 . 34461 1 520 . 1 . 1 54 54 GLU HB3 H 1 2.032 0.02 . 2 . . . . A 44 GLU HB2 . 34461 1 521 . 1 . 1 54 54 GLU HG3 H 1 2.334 0.02 . 2 . . . . A 44 GLU HG2 . 34461 1 522 . 1 . 1 54 54 GLU CA C 13 60.458 0.1 . 1 . . . . A 44 GLU CA . 34461 1 523 . 1 . 1 54 54 GLU CB C 13 29.594 0.1 . 1 . . . . A 44 GLU CB . 34461 1 524 . 1 . 1 54 54 GLU CG C 13 36.939 0.1 . 1 . . . . A 44 GLU CG . 34461 1 525 . 1 . 1 54 54 GLU N N 15 118.377 0.1 . 1 . . . . A 44 GLU N . 34461 1 526 . 1 . 1 55 55 SER H H 1 7.478 0.02 . 1 . . . . A 45 SER H . 34461 1 527 . 1 . 1 55 55 SER HA H 1 4.562 0.02 . 1 . . . . A 45 SER HA . 34461 1 528 . 1 . 1 55 55 SER HB2 H 1 4.055 0.02 . 2 . . . . A 45 SER HB1 . 34461 1 529 . 1 . 1 55 55 SER HB3 H 1 3.680 0.02 . 2 . . . . A 45 SER HB2 . 34461 1 530 . 1 . 1 55 55 SER CA C 13 62.310 0.1 . 1 . . . . A 45 SER CA . 34461 1 531 . 1 . 1 55 55 SER CB C 13 63.514 0.1 . 1 . . . . A 45 SER CB . 34461 1 532 . 1 . 1 55 55 SER N N 15 113.841 0.1 . 1 . . . . A 45 SER N . 34461 1 533 . 1 . 1 56 56 TYR H H 1 7.340 0.02 . 1 . . . . A 46 TYR H . 34461 1 534 . 1 . 1 56 56 TYR HA H 1 3.965 0.02 . 1 . . . . A 46 TYR HA . 34461 1 535 . 1 . 1 56 56 TYR HB2 H 1 3.057 0.02 . 2 . . . . A 46 TYR HB1 . 34461 1 536 . 1 . 1 56 56 TYR HB3 H 1 3.407 0.02 . 2 . . . . A 46 TYR HB2 . 34461 1 537 . 1 . 1 56 56 TYR HD1 H 1 7.102 0.02 . 1 . . . . A 46 TYR HD1 . 34461 1 538 . 1 . 1 56 56 TYR HD2 H 1 7.102 0.02 . 1 . . . . A 46 TYR HD2 . 34461 1 539 . 1 . 1 56 56 TYR HE1 H 1 6.737 0.02 . 1 . . . . A 46 TYR HE1 . 34461 1 540 . 1 . 1 56 56 TYR HE2 H 1 6.737 0.02 . 1 . . . . A 46 TYR HE2 . 34461 1 541 . 1 . 1 56 56 TYR CA C 13 62.128 0.1 . 1 . . . . A 46 TYR CA . 34461 1 542 . 1 . 1 56 56 TYR CB C 13 37.699 0.1 . 1 . . . . A 46 TYR CB . 34461 1 543 . 1 . 1 56 56 TYR CD1 C 13 133.406 0.1 . 1 . . . . A 46 TYR CD1 . 34461 1 544 . 1 . 1 56 56 TYR CE1 C 13 117.690 0.1 . 1 . . . . A 46 TYR CE1 . 34461 1 545 . 1 . 1 56 56 TYR N N 15 124.844 0.1 . 1 . . . . A 46 TYR N . 34461 1 546 . 1 . 1 57 57 ASP H H 1 8.715 0.02 . 1 . . . . A 47 ASP H . 34461 1 547 . 1 . 1 57 57 ASP HA H 1 4.113 0.02 . 1 . . . . A 47 ASP HA . 34461 1 548 . 1 . 1 57 57 ASP HB2 H 1 2.612 0.02 . 2 . . . . A 47 ASP HB1 . 34461 1 549 . 1 . 1 57 57 ASP HB3 H 1 2.765 0.02 . 2 . . . . A 47 ASP HB2 . 34461 1 550 . 1 . 1 57 57 ASP CA C 13 57.390 0.1 . 1 . . . . A 47 ASP CA . 34461 1 551 . 1 . 1 57 57 ASP CB C 13 39.530 0.1 . 1 . . . . A 47 ASP CB . 34461 1 552 . 1 . 1 57 57 ASP N N 15 118.533 0.1 . 1 . . . . A 47 ASP N . 34461 1 553 . 1 . 1 58 58 TYR H H 1 7.378 0.02 . 1 . . . . A 48 TYR H . 34461 1 554 . 1 . 1 58 58 TYR HA H 1 4.419 0.02 . 1 . . . . A 48 TYR HA . 34461 1 555 . 1 . 1 58 58 TYR HB2 H 1 3.322 0.02 . 2 . . . . A 48 TYR HB1 . 34461 1 556 . 1 . 1 58 58 TYR HB3 H 1 3.058 0.02 . 2 . . . . A 48 TYR HB2 . 34461 1 557 . 1 . 1 58 58 TYR HD1 H 1 6.931 0.02 . 1 . . . . A 48 TYR HD1 . 34461 1 558 . 1 . 1 58 58 TYR HD2 H 1 6.931 0.02 . 1 . . . . A 48 TYR HD2 . 34461 1 559 . 1 . 1 58 58 TYR HE1 H 1 6.490 0.02 . 1 . . . . A 48 TYR HE1 . 34461 1 560 . 1 . 1 58 58 TYR HE2 H 1 6.490 0.02 . 1 . . . . A 48 TYR HE2 . 34461 1 561 . 1 . 1 58 58 TYR CA C 13 60.598 0.1 . 1 . . . . A 48 TYR CA . 34461 1 562 . 1 . 1 58 58 TYR CB C 13 37.644 0.1 . 1 . . . . A 48 TYR CB . 34461 1 563 . 1 . 1 58 58 TYR CD2 C 13 132.728 0.1 . 1 . . . . A 48 TYR CD2 . 34461 1 564 . 1 . 1 58 58 TYR CE2 C 13 117.625 0.1 . 1 . . . . A 48 TYR CE2 . 34461 1 565 . 1 . 1 58 58 TYR N N 15 118.964 0.1 . 1 . . . . A 48 TYR N . 34461 1 566 . 1 . 1 59 59 LEU H H 1 7.908 0.02 . 1 . . . . A 49 LEU H . 34461 1 567 . 1 . 1 59 59 LEU HA H 1 3.407 0.02 . 1 . . . . A 49 LEU HA . 34461 1 568 . 1 . 1 59 59 LEU HB2 H 1 1.095 0.02 . 2 . . . . A 49 LEU HB1 . 34461 1 569 . 1 . 1 59 59 LEU HB3 H 1 1.950 0.02 . 2 . . . . A 49 LEU HB2 . 34461 1 570 . 1 . 1 59 59 LEU HG H 1 2.258 0.02 . 1 . . . . A 49 LEU HG . 34461 1 571 . 1 . 1 59 59 LEU HD11 H 1 0.805 0.02 . 2 . . . . A 49 LEU HD11 . 34461 1 572 . 1 . 1 59 59 LEU HD12 H 1 0.805 0.02 . 2 . . . . A 49 LEU HD12 . 34461 1 573 . 1 . 1 59 59 LEU HD13 H 1 0.805 0.02 . 2 . . . . A 49 LEU HD13 . 34461 1 574 . 1 . 1 59 59 LEU HD21 H 1 0.757 0.02 . 2 . . . . A 49 LEU HD21 . 34461 1 575 . 1 . 1 59 59 LEU HD22 H 1 0.757 0.02 . 2 . . . . A 49 LEU HD22 . 34461 1 576 . 1 . 1 59 59 LEU HD23 H 1 0.757 0.02 . 2 . . . . A 49 LEU HD23 . 34461 1 577 . 1 . 1 59 59 LEU CA C 13 58.407 0.1 . 1 . . . . A 49 LEU CA . 34461 1 578 . 1 . 1 59 59 LEU CB C 13 40.517 0.1 . 1 . . . . A 49 LEU CB . 34461 1 579 . 1 . 1 59 59 LEU CG C 13 26.265 0.1 . 1 . . . . A 49 LEU CG . 34461 1 580 . 1 . 1 59 59 LEU CD1 C 13 25.657 0.1 . 2 . . . . A 49 LEU CD1 . 34461 1 581 . 1 . 1 59 59 LEU CD2 C 13 22.213 0.1 . 2 . . . . A 49 LEU CD2 . 34461 1 582 . 1 . 1 59 59 LEU N N 15 121.680 0.1 . 1 . . . . A 49 LEU N . 34461 1 583 . 1 . 1 60 60 LYS H H 1 7.704 0.02 . 1 . . . . A 50 LYS H . 34461 1 584 . 1 . 1 60 60 LYS HA H 1 4.144 0.02 . 1 . . . . A 50 LYS HA . 34461 1 585 . 1 . 1 60 60 LYS HB2 H 1 1.637 0.02 . 2 . . . . A 50 LYS HB1 . 34461 1 586 . 1 . 1 60 60 LYS HB3 H 1 1.707 0.02 . 2 . . . . A 50 LYS HB2 . 34461 1 587 . 1 . 1 60 60 LYS HG2 H 1 1.206 0.02 . 2 . . . . A 50 LYS HG1 . 34461 1 588 . 1 . 1 60 60 LYS HG3 H 1 1.074 0.02 . 2 . . . . A 50 LYS HG2 . 34461 1 589 . 1 . 1 60 60 LYS HD3 H 1 1.574 0.02 . 2 . . . . A 50 LYS HD2 . 34461 1 590 . 1 . 1 60 60 LYS HE3 H 1 2.911 0.02 . 1 . . . . A 50 LYS HE2 . 34461 1 591 . 1 . 1 60 60 LYS CA C 13 57.093 0.1 . 1 . . . . A 50 LYS CA . 34461 1 592 . 1 . 1 60 60 LYS CB C 13 31.046 0.1 . 1 . . . . A 50 LYS CB . 34461 1 593 . 1 . 1 60 60 LYS CG C 13 24.481 0.1 . 1 . . . . A 50 LYS CG . 34461 1 594 . 1 . 1 60 60 LYS CD C 13 28.436 0.1 . 1 . . . . A 50 LYS CD . 34461 1 595 . 1 . 1 60 60 LYS CE C 13 41.798 0.1 . 1 . . . . A 50 LYS CE . 34461 1 596 . 1 . 1 60 60 LYS N N 15 114.896 0.1 . 1 . . . . A 50 LYS N . 34461 1 597 . 1 . 1 61 61 THR H H 1 7.487 0.02 . 1 . . . . A 51 THR H . 34461 1 598 . 1 . 1 61 61 THR HA H 1 4.165 0.02 . 1 . . . . A 51 THR HA . 34461 1 599 . 1 . 1 61 61 THR HB H 1 4.150 0.02 . 1 . . . . A 51 THR HB . 34461 1 600 . 1 . 1 61 61 THR HG21 H 1 1.370 0.02 . 1 . . . . A 51 THR HG21 . 34461 1 601 . 1 . 1 61 61 THR HG22 H 1 1.370 0.02 . 1 . . . . A 51 THR HG22 . 34461 1 602 . 1 . 1 61 61 THR HG23 H 1 1.370 0.02 . 1 . . . . A 51 THR HG23 . 34461 1 603 . 1 . 1 61 61 THR CA C 13 63.690 0.1 . 1 . . . . A 51 THR CA . 34461 1 604 . 1 . 1 61 61 THR CB C 13 69.843 0.1 . 1 . . . . A 51 THR CB . 34461 1 605 . 1 . 1 61 61 THR CG2 C 13 21.547 0.1 . 1 . . . . A 51 THR CG2 . 34461 1 606 . 1 . 1 61 61 THR N N 15 109.206 0.1 . 1 . . . . A 51 THR N . 34461 1 607 . 1 . 1 62 62 LEU H H 1 7.317 0.02 . 1 . . . . A 52 LEU H . 34461 1 608 . 1 . 1 62 62 LEU HA H 1 3.950 0.02 . 1 . . . . A 52 LEU HA . 34461 1 609 . 1 . 1 62 62 LEU HB3 H 1 1.897 0.02 . 2 . . . . A 52 LEU HB2 . 34461 1 610 . 1 . 1 62 62 LEU HD11 H 1 0.350 0.02 . 2 . . . . A 52 LEU HD11 . 34461 1 611 . 1 . 1 62 62 LEU HD12 H 1 0.350 0.02 . 2 . . . . A 52 LEU HD12 . 34461 1 612 . 1 . 1 62 62 LEU HD13 H 1 0.350 0.02 . 2 . . . . A 52 LEU HD13 . 34461 1 613 . 1 . 1 62 62 LEU HD21 H 1 0.269 0.02 . 2 . . . . A 52 LEU HD21 . 34461 1 614 . 1 . 1 62 62 LEU HD22 H 1 0.269 0.02 . 2 . . . . A 52 LEU HD22 . 34461 1 615 . 1 . 1 62 62 LEU HD23 H 1 0.269 0.02 . 2 . . . . A 52 LEU HD23 . 34461 1 616 . 1 . 1 62 62 LEU CA C 13 55.974 0.1 . 1 . . . . A 52 LEU CA . 34461 1 617 . 1 . 1 62 62 LEU CB C 13 43.451 0.1 . 1 . . . . A 52 LEU CB . 34461 1 618 . 1 . 1 62 62 LEU CD1 C 13 25.485 0.1 . 2 . . . . A 52 LEU CD1 . 34461 1 619 . 1 . 1 62 62 LEU CD2 C 13 21.513 0.1 . 2 . . . . A 52 LEU CD2 . 34461 1 620 . 1 . 1 62 62 LEU N N 15 120.181 0.1 . 1 . . . . A 52 LEU N . 34461 1 621 . 1 . 1 63 63 ALA H H 1 7.289 0.02 . 1 . . . . A 53 ALA H . 34461 1 622 . 1 . 1 63 63 ALA HA H 1 4.438 0.02 . 1 . . . . A 53 ALA HA . 34461 1 623 . 1 . 1 63 63 ALA HB1 H 1 0.941 0.02 . 1 . . . . A 53 ALA HB1 . 34461 1 624 . 1 . 1 63 63 ALA HB2 H 1 0.941 0.02 . 1 . . . . A 53 ALA HB2 . 34461 1 625 . 1 . 1 63 63 ALA HB3 H 1 0.941 0.02 . 1 . . . . A 53 ALA HB3 . 34461 1 626 . 1 . 1 63 63 ALA CA C 13 51.366 0.1 . 1 . . . . A 53 ALA CA . 34461 1 627 . 1 . 1 63 63 ALA CB C 13 22.575 0.1 . 1 . . . . A 53 ALA CB . 34461 1 628 . 1 . 1 63 63 ALA N N 15 117.648 0.1 . 1 . . . . A 53 ALA N . 34461 1 629 . 1 . 1 64 64 GLY H H 1 8.111 0.02 . 1 . . . . A 54 GLY H . 34461 1 630 . 1 . 1 64 64 GLY HA2 H 1 4.053 0.02 . 2 . . . . A 54 GLY HA1 . 34461 1 631 . 1 . 1 64 64 GLY HA3 H 1 3.724 0.02 . 2 . . . . A 54 GLY HA2 . 34461 1 632 . 1 . 1 64 64 GLY CA C 13 46.030 0.1 . 1 . . . . A 54 GLY CA . 34461 1 633 . 1 . 1 64 64 GLY N N 15 103.096 0.1 . 1 . . . . A 54 GLY N . 34461 1 634 . 1 . 1 65 65 ASP H H 1 6.961 0.02 . 1 . . . . A 55 ASP H . 34461 1 635 . 1 . 1 65 65 ASP HA H 1 4.909 0.02 . 1 . . . . A 55 ASP HA . 34461 1 636 . 1 . 1 65 65 ASP HB3 H 1 2.595 0.02 . 2 . . . . A 55 ASP HB2 . 34461 1 637 . 1 . 1 65 65 ASP CA C 13 54.099 0.1 . 1 . . . . A 55 ASP CA . 34461 1 638 . 1 . 1 65 65 ASP CB C 13 42.163 0.1 . 1 . . . . A 55 ASP CB . 34461 1 639 . 1 . 1 65 65 ASP N N 15 119.370 0.1 . 1 . . . . A 55 ASP N . 34461 1 640 . 1 . 1 66 66 VAL H H 1 8.067 0.02 . 1 . . . . A 56 VAL H . 34461 1 641 . 1 . 1 66 66 VAL HA H 1 4.400 0.02 . 1 . . . . A 56 VAL HA . 34461 1 642 . 1 . 1 66 66 VAL HB H 1 1.788 0.02 . 1 . . . . A 56 VAL HB . 34461 1 643 . 1 . 1 66 66 VAL HG11 H 1 0.620 0.02 . 2 . . . . A 56 VAL HG11 . 34461 1 644 . 1 . 1 66 66 VAL HG12 H 1 0.620 0.02 . 2 . . . . A 56 VAL HG12 . 34461 1 645 . 1 . 1 66 66 VAL HG13 H 1 0.620 0.02 . 2 . . . . A 56 VAL HG13 . 34461 1 646 . 1 . 1 66 66 VAL HG21 H 1 0.592 0.02 . 2 . . . . A 56 VAL HG21 . 34461 1 647 . 1 . 1 66 66 VAL HG22 H 1 0.592 0.02 . 2 . . . . A 56 VAL HG22 . 34461 1 648 . 1 . 1 66 66 VAL HG23 H 1 0.592 0.02 . 2 . . . . A 56 VAL HG23 . 34461 1 649 . 1 . 1 66 66 VAL CA C 13 61.781 0.1 . 1 . . . . A 56 VAL CA . 34461 1 650 . 1 . 1 66 66 VAL CB C 13 34.110 0.1 . 1 . . . . A 56 VAL CB . 34461 1 651 . 1 . 1 66 66 VAL CG1 C 13 21.468 0.1 . 2 . . . . A 56 VAL CG1 . 34461 1 652 . 1 . 1 66 66 VAL CG2 C 13 21.693 0.1 . 2 . . . . A 56 VAL CG2 . 34461 1 653 . 1 . 1 66 66 VAL N N 15 124.687 0.1 . 1 . . . . A 56 VAL N . 34461 1 654 . 1 . 1 67 67 HIS H H 1 9.124 0.02 . 1 . . . . A 57 HIS H . 34461 1 655 . 1 . 1 67 67 HIS HA H 1 4.544 0.02 . 1 . . . . A 57 HIS HA . 34461 1 656 . 1 . 1 67 67 HIS HB3 H 1 3.153 0.02 . 2 . . . . A 57 HIS HB2 . 34461 1 657 . 1 . 1 67 67 HIS CA C 13 55.731 0.1 . 1 . . . . A 57 HIS CA . 34461 1 658 . 1 . 1 67 67 HIS CB C 13 33.389 0.1 . 1 . . . . A 57 HIS CB . 34461 1 659 . 1 . 1 67 67 HIS N N 15 128.817 0.1 . 1 . . . . A 57 HIS N . 34461 1 660 . 1 . 1 68 68 ILE H H 1 8.083 0.02 . 1 . . . . A 58 ILE H . 34461 1 661 . 1 . 1 68 68 ILE HA H 1 4.925 0.02 . 1 . . . . A 58 ILE HA . 34461 1 662 . 1 . 1 68 68 ILE HB H 1 0.915 0.02 . 1 . . . . A 58 ILE HB . 34461 1 663 . 1 . 1 68 68 ILE HG12 H 1 1.168 0.02 . 2 . . . . A 58 ILE HG11 . 34461 1 664 . 1 . 1 68 68 ILE HG13 H 1 0.767 0.02 . 2 . . . . A 58 ILE HG12 . 34461 1 665 . 1 . 1 68 68 ILE HG21 H 1 0.238 0.02 . 1 . . . . A 58 ILE HG21 . 34461 1 666 . 1 . 1 68 68 ILE HG22 H 1 0.238 0.02 . 1 . . . . A 58 ILE HG22 . 34461 1 667 . 1 . 1 68 68 ILE HG23 H 1 0.238 0.02 . 1 . . . . A 58 ILE HG23 . 34461 1 668 . 1 . 1 68 68 ILE HD11 H 1 0.677 0.02 . 1 . . . . A 58 ILE HD11 . 34461 1 669 . 1 . 1 68 68 ILE HD12 H 1 0.677 0.02 . 1 . . . . A 58 ILE HD12 . 34461 1 670 . 1 . 1 68 68 ILE HD13 H 1 0.677 0.02 . 1 . . . . A 58 ILE HD13 . 34461 1 671 . 1 . 1 68 68 ILE CA C 13 59.532 0.1 . 1 . . . . A 58 ILE CA . 34461 1 672 . 1 . 1 68 68 ILE CB C 13 41.372 0.1 . 1 . . . . A 58 ILE CB . 34461 1 673 . 1 . 1 68 68 ILE CG1 C 13 28.137 0.1 . 1 . . . . A 58 ILE CG1 . 34461 1 674 . 1 . 1 68 68 ILE CG2 C 13 17.188 0.1 . 1 . . . . A 58 ILE CG2 . 34461 1 675 . 1 . 1 68 68 ILE CD1 C 13 15.334 0.1 . 1 . . . . A 58 ILE CD1 . 34461 1 676 . 1 . 1 68 68 ILE N N 15 122.981 0.1 . 1 . . . . A 58 ILE N . 34461 1 677 . 1 . 1 69 69 VAL H H 1 6.898 0.02 . 1 . . . . A 59 VAL H . 34461 1 678 . 1 . 1 69 69 VAL HA H 1 5.041 0.02 . 1 . . . . A 59 VAL HA . 34461 1 679 . 1 . 1 69 69 VAL HB H 1 1.444 0.02 . 1 . . . . A 59 VAL HB . 34461 1 680 . 1 . 1 69 69 VAL HG11 H 1 0.682 0.02 . 2 . . . . A 59 VAL HG11 . 34461 1 681 . 1 . 1 69 69 VAL HG12 H 1 0.682 0.02 . 2 . . . . A 59 VAL HG12 . 34461 1 682 . 1 . 1 69 69 VAL HG13 H 1 0.682 0.02 . 2 . . . . A 59 VAL HG13 . 34461 1 683 . 1 . 1 69 69 VAL HG21 H 1 0.649 0.02 . 2 . . . . A 59 VAL HG21 . 34461 1 684 . 1 . 1 69 69 VAL HG22 H 1 0.649 0.02 . 2 . . . . A 59 VAL HG22 . 34461 1 685 . 1 . 1 69 69 VAL HG23 H 1 0.649 0.02 . 2 . . . . A 59 VAL HG23 . 34461 1 686 . 1 . 1 69 69 VAL CA C 13 58.358 0.1 . 1 . . . . A 59 VAL CA . 34461 1 687 . 1 . 1 69 69 VAL CB C 13 34.223 0.1 . 1 . . . . A 59 VAL CB . 34461 1 688 . 1 . 1 69 69 VAL CG1 C 13 17.727 0.1 . 2 . . . . A 59 VAL CG1 . 34461 1 689 . 1 . 1 69 69 VAL CG2 C 13 22.321 0.1 . 2 . . . . A 59 VAL CG2 . 34461 1 690 . 1 . 1 69 69 VAL N N 15 116.150 0.1 . 1 . . . . A 59 VAL N . 34461 1 691 . 1 . 1 70 70 ARG H H 1 7.827 0.02 . 1 . . . . A 60 ARG H . 34461 1 692 . 1 . 1 70 70 ARG HA H 1 4.183 0.02 . 1 . . . . A 60 ARG HA . 34461 1 693 . 1 . 1 70 70 ARG HB2 H 1 1.756 0.02 . 2 . . . . A 60 ARG HB1 . 34461 1 694 . 1 . 1 70 70 ARG HB3 H 1 1.721 0.02 . 2 . . . . A 60 ARG HB2 . 34461 1 695 . 1 . 1 70 70 ARG HD2 H 1 3.217 0.02 . 2 . . . . A 60 ARG HD1 . 34461 1 696 . 1 . 1 70 70 ARG HD3 H 1 3.135 0.02 . 2 . . . . A 60 ARG HD2 . 34461 1 697 . 1 . 1 70 70 ARG CA C 13 57.850 0.1 . 1 . . . . A 60 ARG CA . 34461 1 698 . 1 . 1 70 70 ARG CB C 13 32.119 0.1 . 1 . . . . A 60 ARG CB . 34461 1 699 . 1 . 1 70 70 ARG CG C 13 27.232 0.1 . 1 . . . . A 60 ARG CG . 34461 1 700 . 1 . 1 70 70 ARG CD C 13 43.427 0.1 . 1 . . . . A 60 ARG CD . 34461 1 701 . 1 . 1 70 70 ARG N N 15 115.968 0.1 . 1 . . . . A 60 ARG N . 34461 1 702 . 1 . 1 71 71 GLY H H 1 10.684 0.02 . 1 . . . . A 61 GLY H . 34461 1 703 . 1 . 1 71 71 GLY CA C 13 43.357 0.1 . 1 . . . . A 61 GLY CA . 34461 1 704 . 1 . 1 71 71 GLY N N 15 118.298 0.1 . 1 . . . . A 61 GLY N . 34461 1 705 . 1 . 1 72 72 ASP H H 1 9.095 0.02 . 1 . . . . A 62 ASP H . 34461 1 706 . 1 . 1 72 72 ASP HA H 1 3.833 0.02 . 1 . . . . A 62 ASP HA . 34461 1 707 . 1 . 1 72 72 ASP HB2 H 1 2.132 0.02 . 2 . . . . A 62 ASP HB1 . 34461 1 708 . 1 . 1 72 72 ASP HB3 H 1 2.074 0.02 . 2 . . . . A 62 ASP HB2 . 34461 1 709 . 1 . 1 72 72 ASP CA C 13 55.039 0.1 . 1 . . . . A 62 ASP CA . 34461 1 710 . 1 . 1 72 72 ASP CB C 13 36.498 0.1 . 1 . . . . A 62 ASP CB . 34461 1 711 . 1 . 1 72 72 ASP N N 15 115.759 0.1 . 1 . . . . A 62 ASP N . 34461 1 712 . 1 . 1 73 73 PHE H H 1 9.517 0.02 . 1 . . . . A 63 PHE H . 34461 1 713 . 1 . 1 73 73 PHE HA H 1 4.560 0.02 . 1 . . . . A 63 PHE HA . 34461 1 714 . 1 . 1 73 73 PHE HB2 H 1 2.336 0.02 . 2 . . . . A 63 PHE HB1 . 34461 1 715 . 1 . 1 73 73 PHE HB3 H 1 3.507 0.02 . 2 . . . . A 63 PHE HB2 . 34461 1 716 . 1 . 1 73 73 PHE CA C 13 58.444 0.1 . 1 . . . . A 63 PHE CA . 34461 1 717 . 1 . 1 73 73 PHE CB C 13 41.476 0.1 . 1 . . . . A 63 PHE CB . 34461 1 718 . 1 . 1 73 73 PHE N N 15 117.496 0.1 . 1 . . . . A 63 PHE N . 34461 1 719 . 1 . 1 74 74 ASP H H 1 6.818 0.02 . 1 . . . . A 64 ASP H . 34461 1 720 . 1 . 1 74 74 ASP HA H 1 4.849 0.02 . 1 . . . . A 64 ASP HA . 34461 1 721 . 1 . 1 74 74 ASP CA C 13 57.664 0.1 . 1 . . . . A 64 ASP CA . 34461 1 722 . 1 . 1 74 74 ASP CB C 13 42.491 0.1 . 1 . . . . A 64 ASP CB . 34461 1 723 . 1 . 1 74 74 ASP N N 15 120.545 0.1 . 1 . . . . A 64 ASP N . 34461 1 724 . 1 . 1 75 75 GLU H H 1 8.360 0.02 . 1 . . . . A 65 GLU H . 34461 1 725 . 1 . 1 75 75 GLU HA H 1 4.221 0.02 . 1 . . . . A 65 GLU HA . 34461 1 726 . 1 . 1 75 75 GLU HB2 H 1 2.084 0.02 . 2 . . . . A 65 GLU HB1 . 34461 1 727 . 1 . 1 75 75 GLU HB3 H 1 2.148 0.02 . 2 . . . . A 65 GLU HB2 . 34461 1 728 . 1 . 1 75 75 GLU HG3 H 1 2.432 0.02 . 2 . . . . A 65 GLU HG2 . 34461 1 729 . 1 . 1 75 75 GLU CA C 13 57.108 0.1 . 1 . . . . A 65 GLU CA . 34461 1 730 . 1 . 1 75 75 GLU CB C 13 30.114 0.1 . 1 . . . . A 65 GLU CB . 34461 1 731 . 1 . 1 75 75 GLU CG C 13 36.550 0.1 . 1 . . . . A 65 GLU CG . 34461 1 732 . 1 . 1 75 75 GLU N N 15 120.504 0.1 . 1 . . . . A 65 GLU N . 34461 1 733 . 1 . 1 76 76 ASN H H 1 8.014 0.02 . 1 . . . . A 66 ASN H . 34461 1 734 . 1 . 1 76 76 ASN HA H 1 4.478 0.02 . 1 . . . . A 66 ASN HA . 34461 1 735 . 1 . 1 76 76 ASN HB2 H 1 2.596 0.02 . 2 . . . . A 66 ASN HB1 . 34461 1 736 . 1 . 1 76 76 ASN HB3 H 1 2.497 0.02 . 2 . . . . A 66 ASN HB2 . 34461 1 737 . 1 . 1 76 76 ASN HD21 H 1 6.713 0.02 . 2 . . . . A 66 ASN HD21 . 34461 1 738 . 1 . 1 76 76 ASN HD22 H 1 6.923 0.02 . 2 . . . . A 66 ASN HD22 . 34461 1 739 . 1 . 1 76 76 ASN CA C 13 53.078 0.1 . 1 . . . . A 66 ASN CA . 34461 1 740 . 1 . 1 76 76 ASN CB C 13 37.658 0.1 . 1 . . . . A 66 ASN CB . 34461 1 741 . 1 . 1 76 76 ASN N N 15 117.519 0.1 . 1 . . . . A 66 ASN N . 34461 1 742 . 1 . 1 76 76 ASN ND2 N 15 111.497 0.1 . 1 . . . . A 66 ASN ND2 . 34461 1 743 . 1 . 1 77 77 LEU H H 1 7.942 0.02 . 1 . . . . A 67 LEU H . 34461 1 744 . 1 . 1 77 77 LEU HA H 1 4.151 0.02 . 1 . . . . A 67 LEU HA . 34461 1 745 . 1 . 1 77 77 LEU HB2 H 1 1.383 0.02 . 2 . . . . A 67 LEU HB1 . 34461 1 746 . 1 . 1 77 77 LEU HB3 H 1 1.478 0.02 . 2 . . . . A 67 LEU HB2 . 34461 1 747 . 1 . 1 77 77 LEU HG H 1 1.577 0.02 . 1 . . . . A 67 LEU HG . 34461 1 748 . 1 . 1 77 77 LEU HD11 H 1 0.869 0.02 . 2 . . . . A 67 LEU HD11 . 34461 1 749 . 1 . 1 77 77 LEU HD12 H 1 0.869 0.02 . 2 . . . . A 67 LEU HD12 . 34461 1 750 . 1 . 1 77 77 LEU HD13 H 1 0.869 0.02 . 2 . . . . A 67 LEU HD13 . 34461 1 751 . 1 . 1 77 77 LEU HD21 H 1 0.765 0.02 . 2 . . . . A 67 LEU HD21 . 34461 1 752 . 1 . 1 77 77 LEU HD22 H 1 0.765 0.02 . 2 . . . . A 67 LEU HD22 . 34461 1 753 . 1 . 1 77 77 LEU HD23 H 1 0.765 0.02 . 2 . . . . A 67 LEU HD23 . 34461 1 754 . 1 . 1 77 77 LEU CA C 13 54.717 0.1 . 1 . . . . A 67 LEU CA . 34461 1 755 . 1 . 1 77 77 LEU CB C 13 41.287 0.1 . 1 . . . . A 67 LEU CB . 34461 1 756 . 1 . 1 77 77 LEU CG C 13 27.159 0.1 . 1 . . . . A 67 LEU CG . 34461 1 757 . 1 . 1 77 77 LEU CD1 C 13 25.220 0.1 . 2 . . . . A 67 LEU CD1 . 34461 1 758 . 1 . 1 77 77 LEU CD2 C 13 22.601 0.1 . 2 . . . . A 67 LEU CD2 . 34461 1 759 . 1 . 1 77 77 LEU N N 15 122.006 0.1 . 1 . . . . A 67 LEU N . 34461 1 760 . 1 . 1 78 78 ASN H H 1 8.270 0.02 . 1 . . . . A 68 ASN H . 34461 1 761 . 1 . 1 78 78 ASN HA H 1 4.590 0.02 . 1 . . . . A 68 ASN HA . 34461 1 762 . 1 . 1 78 78 ASN HB2 H 1 2.602 0.02 . 2 . . . . A 68 ASN HB1 . 34461 1 763 . 1 . 1 78 78 ASN HB3 H 1 2.752 0.02 . 2 . . . . A 68 ASN HB2 . 34461 1 764 . 1 . 1 78 78 ASN HD21 H 1 6.868 0.02 . 2 . . . . A 68 ASN HD21 . 34461 1 765 . 1 . 1 78 78 ASN HD22 H 1 7.457 0.02 . 2 . . . . A 68 ASN HD22 . 34461 1 766 . 1 . 1 78 78 ASN CA C 13 53.477 0.1 . 1 . . . . A 68 ASN CA . 34461 1 767 . 1 . 1 78 78 ASN CB C 13 38.318 0.1 . 1 . . . . A 68 ASN CB . 34461 1 768 . 1 . 1 78 78 ASN N N 15 115.941 0.1 . 1 . . . . A 68 ASN N . 34461 1 769 . 1 . 1 78 78 ASN ND2 N 15 113.372 0.1 . 1 . . . . A 68 ASN ND2 . 34461 1 770 . 1 . 1 79 79 TYR H H 1 7.005 0.02 . 1 . . . . A 69 TYR H . 34461 1 771 . 1 . 1 79 79 TYR HA H 1 4.953 0.02 . 1 . . . . A 69 TYR HA . 34461 1 772 . 1 . 1 79 79 TYR HB2 H 1 2.376 0.02 . 2 . . . . A 69 TYR HB1 . 34461 1 773 . 1 . 1 79 79 TYR HB3 H 1 3.084 0.02 . 2 . . . . A 69 TYR HB2 . 34461 1 774 . 1 . 1 79 79 TYR HD1 H 1 6.915 0.02 . 1 . . . . A 69 TYR HD1 . 34461 1 775 . 1 . 1 79 79 TYR HD2 H 1 6.915 0.02 . 1 . . . . A 69 TYR HD2 . 34461 1 776 . 1 . 1 79 79 TYR HE1 H 1 6.605 0.02 . 1 . . . . A 69 TYR HE1 . 34461 1 777 . 1 . 1 79 79 TYR HE2 H 1 6.605 0.02 . 1 . . . . A 69 TYR HE2 . 34461 1 778 . 1 . 1 79 79 TYR CA C 13 54.707 0.1 . 1 . . . . A 69 TYR CA . 34461 1 779 . 1 . 1 79 79 TYR CB C 13 36.532 0.1 . 1 . . . . A 69 TYR CB . 34461 1 780 . 1 . 1 79 79 TYR CD2 C 13 132.039 0.1 . 1 . . . . A 69 TYR CD2 . 34461 1 781 . 1 . 1 79 79 TYR CE2 C 13 118.402 0.1 . 1 . . . . A 69 TYR CE2 . 34461 1 782 . 1 . 1 79 79 TYR N N 15 120.469 0.1 . 1 . . . . A 69 TYR N . 34461 1 783 . 1 . 1 80 80 PRO HA H 1 4.698 0.02 . 1 . . . . A 70 PRO HA . 34461 1 784 . 1 . 1 80 80 PRO HB2 H 1 2.284 0.02 . 2 . . . . A 70 PRO HB1 . 34461 1 785 . 1 . 1 80 80 PRO HB3 H 1 2.501 0.02 . 2 . . . . A 70 PRO HB2 . 34461 1 786 . 1 . 1 80 80 PRO HG2 H 1 2.151 0.02 . 2 . . . . A 70 PRO HG1 . 34461 1 787 . 1 . 1 80 80 PRO HG3 H 1 2.235 0.02 . 2 . . . . A 70 PRO HG2 . 34461 1 788 . 1 . 1 80 80 PRO CA C 13 62.384 0.1 . 1 . . . . A 70 PRO CA . 34461 1 789 . 1 . 1 80 80 PRO CB C 13 32.114 0.1 . 1 . . . . A 70 PRO CB . 34461 1 790 . 1 . 1 80 80 PRO CG C 13 27.409 0.1 . 1 . . . . A 70 PRO CG . 34461 1 791 . 1 . 1 80 80 PRO CD C 13 49.879 0.1 . 1 . . . . A 70 PRO CD . 34461 1 792 . 1 . 1 81 81 GLU H H 1 9.054 0.02 . 1 . . . . A 71 GLU H . 34461 1 793 . 1 . 1 81 81 GLU HA H 1 4.072 0.02 . 1 . . . . A 71 GLU HA . 34461 1 794 . 1 . 1 81 81 GLU HB3 H 1 2.145 0.02 . 2 . . . . A 71 GLU HB2 . 34461 1 795 . 1 . 1 81 81 GLU HG2 H 1 2.391 0.02 . 2 . . . . A 71 GLU HG1 . 34461 1 796 . 1 . 1 81 81 GLU HG3 H 1 2.498 0.02 . 2 . . . . A 71 GLU HG2 . 34461 1 797 . 1 . 1 81 81 GLU CA C 13 59.572 0.1 . 1 . . . . A 71 GLU CA . 34461 1 798 . 1 . 1 81 81 GLU CB C 13 30.649 0.1 . 1 . . . . A 71 GLU CB . 34461 1 799 . 1 . 1 81 81 GLU CG C 13 37.322 0.1 . 1 . . . . A 71 GLU CG . 34461 1 800 . 1 . 1 81 81 GLU N N 15 119.723 0.1 . 1 . . . . A 71 GLU N . 34461 1 801 . 1 . 1 82 82 GLN H H 1 7.563 0.02 . 1 . . . . A 72 GLN H . 34461 1 802 . 1 . 1 82 82 GLN HA H 1 5.334 0.02 . 1 . . . . A 72 GLN HA . 34461 1 803 . 1 . 1 82 82 GLN HB2 H 1 2.074 0.02 . 2 . . . . A 72 GLN HB1 . 34461 1 804 . 1 . 1 82 82 GLN HB3 H 1 2.132 0.02 . 2 . . . . A 72 GLN HB2 . 34461 1 805 . 1 . 1 82 82 GLN HG2 H 1 2.262 0.02 . 2 . . . . A 72 GLN HG1 . 34461 1 806 . 1 . 1 82 82 GLN HG3 H 1 2.291 0.02 . 2 . . . . A 72 GLN HG2 . 34461 1 807 . 1 . 1 82 82 GLN CA C 13 53.684 0.1 . 1 . . . . A 72 GLN CA . 34461 1 808 . 1 . 1 82 82 GLN CB C 13 31.164 0.1 . 1 . . . . A 72 GLN CB . 34461 1 809 . 1 . 1 82 82 GLN CG C 13 31.975 0.1 . 1 . . . . A 72 GLN CG . 34461 1 810 . 1 . 1 82 82 GLN N N 15 109.806 0.1 . 1 . . . . A 72 GLN N . 34461 1 811 . 1 . 1 83 83 LYS H H 1 8.470 0.02 . 1 . . . . A 73 LYS H . 34461 1 812 . 1 . 1 83 83 LYS HA H 1 4.476 0.02 . 1 . . . . A 73 LYS HA . 34461 1 813 . 1 . 1 83 83 LYS HB3 H 1 1.523 0.02 . 2 . . . . A 73 LYS HB2 . 34461 1 814 . 1 . 1 83 83 LYS HG3 H 1 1.353 0.02 . 2 . . . . A 73 LYS HG2 . 34461 1 815 . 1 . 1 83 83 LYS HE3 H 1 3.240 0.02 . 1 . . . . A 73 LYS HE2 . 34461 1 816 . 1 . 1 83 83 LYS CA C 13 56.054 0.1 . 1 . . . . A 73 LYS CA . 34461 1 817 . 1 . 1 83 83 LYS CB C 13 37.735 0.1 . 1 . . . . A 73 LYS CB . 34461 1 818 . 1 . 1 83 83 LYS CG C 13 25.427 0.1 . 1 . . . . A 73 LYS CG . 34461 1 819 . 1 . 1 83 83 LYS CD C 13 29.565 0.1 . 1 . . . . A 73 LYS CD . 34461 1 820 . 1 . 1 83 83 LYS CE C 13 43.414 0.1 . 1 . . . . A 73 LYS CE . 34461 1 821 . 1 . 1 83 83 LYS N N 15 119.199 0.1 . 1 . . . . A 73 LYS N . 34461 1 822 . 1 . 1 84 84 VAL H H 1 8.113 0.02 . 1 . . . . A 74 VAL H . 34461 1 823 . 1 . 1 84 84 VAL HA H 1 4.877 0.02 . 1 . . . . A 74 VAL HA . 34461 1 824 . 1 . 1 84 84 VAL HB H 1 1.789 0.02 . 1 . . . . A 74 VAL HB . 34461 1 825 . 1 . 1 84 84 VAL HG11 H 1 0.677 0.02 . 2 . . . . A 74 VAL HG11 . 34461 1 826 . 1 . 1 84 84 VAL HG12 H 1 0.677 0.02 . 2 . . . . A 74 VAL HG12 . 34461 1 827 . 1 . 1 84 84 VAL HG13 H 1 0.677 0.02 . 2 . . . . A 74 VAL HG13 . 34461 1 828 . 1 . 1 84 84 VAL HG21 H 1 0.704 0.02 . 2 . . . . A 74 VAL HG21 . 34461 1 829 . 1 . 1 84 84 VAL HG22 H 1 0.704 0.02 . 2 . . . . A 74 VAL HG22 . 34461 1 830 . 1 . 1 84 84 VAL HG23 H 1 0.704 0.02 . 2 . . . . A 74 VAL HG23 . 34461 1 831 . 1 . 1 84 84 VAL CA C 13 61.287 0.1 . 1 . . . . A 74 VAL CA . 34461 1 832 . 1 . 1 84 84 VAL CB C 13 33.521 0.1 . 1 . . . . A 74 VAL CB . 34461 1 833 . 1 . 1 84 84 VAL CG1 C 13 21.294 0.1 . 2 . . . . A 74 VAL CG1 . 34461 1 834 . 1 . 1 84 84 VAL CG2 C 13 21.161 0.1 . 2 . . . . A 74 VAL CG2 . 34461 1 835 . 1 . 1 84 84 VAL N N 15 122.153 0.1 . 1 . . . . A 74 VAL N . 34461 1 836 . 1 . 1 85 85 VAL H H 1 9.380 0.02 . 1 . . . . A 75 VAL H . 34461 1 837 . 1 . 1 85 85 VAL HA H 1 4.309 0.02 . 1 . . . . A 75 VAL HA . 34461 1 838 . 1 . 1 85 85 VAL HB H 1 1.563 0.02 . 1 . . . . A 75 VAL HB . 34461 1 839 . 1 . 1 85 85 VAL HG11 H 1 0.253 0.02 . 2 . . . . A 75 VAL HG11 . 34461 1 840 . 1 . 1 85 85 VAL HG12 H 1 0.253 0.02 . 2 . . . . A 75 VAL HG12 . 34461 1 841 . 1 . 1 85 85 VAL HG13 H 1 0.253 0.02 . 2 . . . . A 75 VAL HG13 . 34461 1 842 . 1 . 1 85 85 VAL HG21 H 1 0.295 0.02 . 2 . . . . A 75 VAL HG21 . 34461 1 843 . 1 . 1 85 85 VAL HG22 H 1 0.295 0.02 . 2 . . . . A 75 VAL HG22 . 34461 1 844 . 1 . 1 85 85 VAL HG23 H 1 0.295 0.02 . 2 . . . . A 75 VAL HG23 . 34461 1 845 . 1 . 1 85 85 VAL CA C 13 59.896 0.1 . 1 . . . . A 75 VAL CA . 34461 1 846 . 1 . 1 85 85 VAL CB C 13 34.958 0.1 . 1 . . . . A 75 VAL CB . 34461 1 847 . 1 . 1 85 85 VAL CG1 C 13 19.833 0.1 . 2 . . . . A 75 VAL CG1 . 34461 1 848 . 1 . 1 85 85 VAL CG2 C 13 19.320 0.1 . 2 . . . . A 75 VAL CG2 . 34461 1 849 . 1 . 1 85 85 VAL N N 15 126.308 0.1 . 1 . . . . A 75 VAL N . 34461 1 850 . 1 . 1 86 86 THR H H 1 8.469 0.02 . 1 . . . . A 76 THR H . 34461 1 851 . 1 . 1 86 86 THR HA H 1 5.123 0.02 . 1 . . . . A 76 THR HA . 34461 1 852 . 1 . 1 86 86 THR HB H 1 3.944 0.02 . 1 . . . . A 76 THR HB . 34461 1 853 . 1 . 1 86 86 THR HG21 H 1 1.048 0.02 . 1 . . . . A 76 THR HG21 . 34461 1 854 . 1 . 1 86 86 THR HG22 H 1 1.048 0.02 . 1 . . . . A 76 THR HG22 . 34461 1 855 . 1 . 1 86 86 THR HG23 H 1 1.048 0.02 . 1 . . . . A 76 THR HG23 . 34461 1 856 . 1 . 1 86 86 THR CA C 13 61.757 0.1 . 1 . . . . A 76 THR CA . 34461 1 857 . 1 . 1 86 86 THR CB C 13 69.573 0.1 . 1 . . . . A 76 THR CB . 34461 1 858 . 1 . 1 86 86 THR CG2 C 13 21.190 0.1 . 1 . . . . A 76 THR CG2 . 34461 1 859 . 1 . 1 86 86 THR N N 15 121.750 0.1 . 1 . . . . A 76 THR N . 34461 1 860 . 1 . 1 87 87 VAL H H 1 8.768 0.02 . 1 . . . . A 77 VAL H . 34461 1 861 . 1 . 1 87 87 VAL HA H 1 3.964 0.02 . 1 . . . . A 77 VAL HA . 34461 1 862 . 1 . 1 87 87 VAL HB H 1 1.751 0.02 . 1 . . . . A 77 VAL HB . 34461 1 863 . 1 . 1 87 87 VAL HG11 H 1 0.670 0.02 . 2 . . . . A 77 VAL HG11 . 34461 1 864 . 1 . 1 87 87 VAL HG12 H 1 0.670 0.02 . 2 . . . . A 77 VAL HG12 . 34461 1 865 . 1 . 1 87 87 VAL HG13 H 1 0.670 0.02 . 2 . . . . A 77 VAL HG13 . 34461 1 866 . 1 . 1 87 87 VAL HG21 H 1 0.320 0.02 . 2 . . . . A 77 VAL HG21 . 34461 1 867 . 1 . 1 87 87 VAL HG22 H 1 0.320 0.02 . 2 . . . . A 77 VAL HG22 . 34461 1 868 . 1 . 1 87 87 VAL HG23 H 1 0.320 0.02 . 2 . . . . A 77 VAL HG23 . 34461 1 869 . 1 . 1 87 87 VAL CA C 13 61.321 0.1 . 1 . . . . A 77 VAL CA . 34461 1 870 . 1 . 1 87 87 VAL CB C 13 33.435 0.1 . 1 . . . . A 77 VAL CB . 34461 1 871 . 1 . 1 87 87 VAL CG1 C 13 22.000 0.1 . 2 . . . . A 77 VAL CG1 . 34461 1 872 . 1 . 1 87 87 VAL CG2 C 13 19.613 0.1 . 2 . . . . A 77 VAL CG2 . 34461 1 873 . 1 . 1 87 87 VAL N N 15 127.764 0.1 . 1 . . . . A 77 VAL N . 34461 1 874 . 1 . 1 88 88 GLY H H 1 8.860 0.02 . 1 . . . . A 78 GLY H . 34461 1 875 . 1 . 1 88 88 GLY HA2 H 1 3.648 0.02 . 2 . . . . A 78 GLY HA1 . 34461 1 876 . 1 . 1 88 88 GLY HA3 H 1 4.041 0.02 . 2 . . . . A 78 GLY HA2 . 34461 1 877 . 1 . 1 88 88 GLY CA C 13 46.601 0.1 . 1 . . . . A 78 GLY CA . 34461 1 878 . 1 . 1 88 88 GLY N N 15 115.229 0.1 . 1 . . . . A 78 GLY N . 34461 1 879 . 1 . 1 89 89 GLN H H 1 9.274 0.02 . 1 . . . . A 79 GLN H . 34461 1 880 . 1 . 1 89 89 GLN HA H 1 4.114 0.02 . 1 . . . . A 79 GLN HA . 34461 1 881 . 1 . 1 89 89 GLN HB2 H 1 1.954 0.02 . 2 . . . . A 79 GLN HB1 . 34461 1 882 . 1 . 1 89 89 GLN HB3 H 1 1.440 0.02 . 2 . . . . A 79 GLN HB2 . 34461 1 883 . 1 . 1 89 89 GLN HG2 H 1 2.177 0.02 . 2 . . . . A 79 GLN HG1 . 34461 1 884 . 1 . 1 89 89 GLN HG3 H 1 2.096 0.02 . 2 . . . . A 79 GLN HG2 . 34461 1 885 . 1 . 1 89 89 GLN CA C 13 56.062 0.1 . 1 . . . . A 79 GLN CA . 34461 1 886 . 1 . 1 89 89 GLN CB C 13 28.639 0.1 . 1 . . . . A 79 GLN CB . 34461 1 887 . 1 . 1 89 89 GLN CG C 13 34.117 0.1 . 1 . . . . A 79 GLN CG . 34461 1 888 . 1 . 1 89 89 GLN N N 15 124.924 0.1 . 1 . . . . A 79 GLN N . 34461 1 889 . 1 . 1 90 90 PHE H H 1 8.398 0.02 . 1 . . . . A 80 PHE H . 34461 1 890 . 1 . 1 90 90 PHE HA H 1 4.570 0.02 . 1 . . . . A 80 PHE HA . 34461 1 891 . 1 . 1 90 90 PHE HB2 H 1 2.632 0.02 . 2 . . . . A 80 PHE HB1 . 34461 1 892 . 1 . 1 90 90 PHE HB3 H 1 3.193 0.02 . 2 . . . . A 80 PHE HB2 . 34461 1 893 . 1 . 1 90 90 PHE HD1 H 1 7.204 0.02 . 1 . . . . A 80 PHE HD1 . 34461 1 894 . 1 . 1 90 90 PHE HD2 H 1 7.204 0.02 . 1 . . . . A 80 PHE HD2 . 34461 1 895 . 1 . 1 90 90 PHE HE1 H 1 7.351 0.02 . 1 . . . . A 80 PHE HE1 . 34461 1 896 . 1 . 1 90 90 PHE HE2 H 1 7.351 0.02 . 1 . . . . A 80 PHE HE2 . 34461 1 897 . 1 . 1 90 90 PHE CA C 13 58.843 0.1 . 1 . . . . A 80 PHE CA . 34461 1 898 . 1 . 1 90 90 PHE CB C 13 41.577 0.1 . 1 . . . . A 80 PHE CB . 34461 1 899 . 1 . 1 90 90 PHE CD2 C 13 131.254 0.1 . 1 . . . . A 80 PHE CD2 . 34461 1 900 . 1 . 1 90 90 PHE CE2 C 13 131.793 0.1 . 1 . . . . A 80 PHE CE2 . 34461 1 901 . 1 . 1 90 90 PHE N N 15 118.373 0.1 . 1 . . . . A 80 PHE N . 34461 1 902 . 1 . 1 91 91 LYS H H 1 9.451 0.02 . 1 . . . . A 81 LYS H . 34461 1 903 . 1 . 1 91 91 LYS HA H 1 4.769 0.02 . 1 . . . . A 81 LYS HA . 34461 1 904 . 1 . 1 91 91 LYS HB2 H 1 1.603 0.02 . 2 . . . . A 81 LYS HB1 . 34461 1 905 . 1 . 1 91 91 LYS HB3 H 1 1.867 0.02 . 2 . . . . A 81 LYS HB2 . 34461 1 906 . 1 . 1 91 91 LYS HG2 H 1 1.378 0.02 . 2 . . . . A 81 LYS HG1 . 34461 1 907 . 1 . 1 91 91 LYS HG3 H 1 1.293 0.02 . 2 . . . . A 81 LYS HG2 . 34461 1 908 . 1 . 1 91 91 LYS HE2 H 1 2.911 0.02 . 1 . . . . A 81 LYS HE1 . 34461 1 909 . 1 . 1 91 91 LYS HE3 H 1 2.972 0.02 . 1 . . . . A 81 LYS HE2 . 34461 1 910 . 1 . 1 91 91 LYS CA C 13 56.043 0.1 . 1 . . . . A 81 LYS CA . 34461 1 911 . 1 . 1 91 91 LYS CB C 13 34.326 0.1 . 1 . . . . A 81 LYS CB . 34461 1 912 . 1 . 1 91 91 LYS CG C 13 24.955 0.1 . 1 . . . . A 81 LYS CG . 34461 1 913 . 1 . 1 91 91 LYS CD C 13 29.437 0.1 . 1 . . . . A 81 LYS CD . 34461 1 914 . 1 . 1 91 91 LYS CE C 13 41.988 0.1 . 1 . . . . A 81 LYS CE . 34461 1 915 . 1 . 1 91 91 LYS N N 15 123.498 0.1 . 1 . . . . A 81 LYS N . 34461 1 916 . 1 . 1 92 92 ILE H H 1 9.424 0.02 . 1 . . . . A 82 ILE H . 34461 1 917 . 1 . 1 92 92 ILE HA H 1 5.078 0.02 . 1 . . . . A 82 ILE HA . 34461 1 918 . 1 . 1 92 92 ILE HB H 1 1.651 0.02 . 1 . . . . A 82 ILE HB . 34461 1 919 . 1 . 1 92 92 ILE HG21 H 1 0.668 0.02 . 1 . . . . A 82 ILE HG21 . 34461 1 920 . 1 . 1 92 92 ILE HG22 H 1 0.668 0.02 . 1 . . . . A 82 ILE HG22 . 34461 1 921 . 1 . 1 92 92 ILE HG23 H 1 0.668 0.02 . 1 . . . . A 82 ILE HG23 . 34461 1 922 . 1 . 1 92 92 ILE HD11 H 1 0.596 0.02 . 1 . . . . A 82 ILE HD11 . 34461 1 923 . 1 . 1 92 92 ILE HD12 H 1 0.596 0.02 . 1 . . . . A 82 ILE HD12 . 34461 1 924 . 1 . 1 92 92 ILE HD13 H 1 0.596 0.02 . 1 . . . . A 82 ILE HD13 . 34461 1 925 . 1 . 1 92 92 ILE CA C 13 60.379 0.1 . 1 . . . . A 82 ILE CA . 34461 1 926 . 1 . 1 92 92 ILE CB C 13 40.274 0.1 . 1 . . . . A 82 ILE CB . 34461 1 927 . 1 . 1 92 92 ILE CG1 C 13 27.427 0.1 . 1 . . . . A 82 ILE CG1 . 34461 1 928 . 1 . 1 92 92 ILE CG2 C 13 17.901 0.1 . 1 . . . . A 82 ILE CG2 . 34461 1 929 . 1 . 1 92 92 ILE CD1 C 13 13.574 0.1 . 1 . . . . A 82 ILE CD1 . 34461 1 930 . 1 . 1 92 92 ILE N N 15 126.770 0.1 . 1 . . . . A 82 ILE N . 34461 1 931 . 1 . 1 93 93 GLY H H 1 9.599 0.02 . 1 . . . . A 83 GLY H . 34461 1 932 . 1 . 1 93 93 GLY HA2 H 1 5.053 0.02 . 2 . . . . A 83 GLY HA1 . 34461 1 933 . 1 . 1 93 93 GLY HA3 H 1 3.143 0.02 . 2 . . . . A 83 GLY HA2 . 34461 1 934 . 1 . 1 93 93 GLY CA C 13 44.411 0.1 . 1 . . . . A 83 GLY CA . 34461 1 935 . 1 . 1 93 93 GLY N N 15 113.610 0.1 . 1 . . . . A 83 GLY N . 34461 1 936 . 1 . 1 94 94 LEU H H 1 8.663 0.02 . 1 . . . . A 84 LEU H . 34461 1 937 . 1 . 1 94 94 LEU HA H 1 5.350 0.02 . 1 . . . . A 84 LEU HA . 34461 1 938 . 1 . 1 94 94 LEU HB2 H 1 1.038 0.02 . 2 . . . . A 84 LEU HB1 . 34461 1 939 . 1 . 1 94 94 LEU HB3 H 1 1.605 0.02 . 2 . . . . A 84 LEU HB2 . 34461 1 940 . 1 . 1 94 94 LEU HG H 1 1.433 0.02 . 1 . . . . A 84 LEU HG . 34461 1 941 . 1 . 1 94 94 LEU HD11 H 1 0.613 0.02 . 2 . . . . A 84 LEU HD11 . 34461 1 942 . 1 . 1 94 94 LEU HD12 H 1 0.613 0.02 . 2 . . . . A 84 LEU HD12 . 34461 1 943 . 1 . 1 94 94 LEU HD13 H 1 0.613 0.02 . 2 . . . . A 84 LEU HD13 . 34461 1 944 . 1 . 1 94 94 LEU HD21 H 1 0.643 0.02 . 2 . . . . A 84 LEU HD21 . 34461 1 945 . 1 . 1 94 94 LEU HD22 H 1 0.643 0.02 . 2 . . . . A 84 LEU HD22 . 34461 1 946 . 1 . 1 94 94 LEU HD23 H 1 0.643 0.02 . 2 . . . . A 84 LEU HD23 . 34461 1 947 . 1 . 1 94 94 LEU CA C 13 54.175 0.1 . 1 . . . . A 84 LEU CA . 34461 1 948 . 1 . 1 94 94 LEU CB C 13 47.322 0.1 . 1 . . . . A 84 LEU CB . 34461 1 949 . 1 . 1 94 94 LEU CG C 13 26.844 0.1 . 1 . . . . A 84 LEU CG . 34461 1 950 . 1 . 1 94 94 LEU CD1 C 13 24.172 0.1 . 2 . . . . A 84 LEU CD1 . 34461 1 951 . 1 . 1 94 94 LEU CD2 C 13 25.715 0.1 . 2 . . . . A 84 LEU CD2 . 34461 1 952 . 1 . 1 94 94 LEU N N 15 124.964 0.1 . 1 . . . . A 84 LEU N . 34461 1 953 . 1 . 1 95 95 ILE H H 1 8.392 0.02 . 1 . . . . A 85 ILE H . 34461 1 954 . 1 . 1 95 95 ILE HA H 1 4.688 0.02 . 1 . . . . A 85 ILE HA . 34461 1 955 . 1 . 1 95 95 ILE HB H 1 1.977 0.02 . 1 . . . . A 85 ILE HB . 34461 1 956 . 1 . 1 95 95 ILE HG21 H 1 0.886 0.02 . 1 . . . . A 85 ILE HG21 . 34461 1 957 . 1 . 1 95 95 ILE HG22 H 1 0.886 0.02 . 1 . . . . A 85 ILE HG22 . 34461 1 958 . 1 . 1 95 95 ILE HG23 H 1 0.886 0.02 . 1 . . . . A 85 ILE HG23 . 34461 1 959 . 1 . 1 95 95 ILE HD11 H 1 0.825 0.02 . 1 . . . . A 85 ILE HD11 . 34461 1 960 . 1 . 1 95 95 ILE HD12 H 1 0.825 0.02 . 1 . . . . A 85 ILE HD12 . 34461 1 961 . 1 . 1 95 95 ILE HD13 H 1 0.825 0.02 . 1 . . . . A 85 ILE HD13 . 34461 1 962 . 1 . 1 95 95 ILE CA C 13 61.441 0.1 . 1 . . . . A 85 ILE CA . 34461 1 963 . 1 . 1 95 95 ILE CB C 13 41.990 0.1 . 1 . . . . A 85 ILE CB . 34461 1 964 . 1 . 1 95 95 ILE CG1 C 13 28.547 0.1 . 1 . . . . A 85 ILE CG1 . 34461 1 965 . 1 . 1 95 95 ILE CG2 C 13 14.670 0.1 . 1 . . . . A 85 ILE CG2 . 34461 1 966 . 1 . 1 95 95 ILE CD1 C 13 14.658 0.1 . 1 . . . . A 85 ILE CD1 . 34461 1 967 . 1 . 1 95 95 ILE N N 15 121.700 0.1 . 1 . . . . A 85 ILE N . 34461 1 968 . 1 . 1 96 96 HIS H H 1 9.618 0.02 . 1 . . . . A 86 HIS H . 34461 1 969 . 1 . 1 96 96 HIS HA H 1 4.830 0.02 . 1 . . . . A 86 HIS HA . 34461 1 970 . 1 . 1 96 96 HIS CA C 13 62.233 0.1 . 1 . . . . A 86 HIS CA . 34461 1 971 . 1 . 1 96 96 HIS N N 15 124.078 0.1 . 1 . . . . A 86 HIS N . 34461 1 972 . 1 . 1 97 97 GLY H H 1 7.999 0.02 . 1 . . . . A 87 GLY H . 34461 1 973 . 1 . 1 97 97 GLY HA2 H 1 3.340 0.02 . 2 . . . . A 87 GLY HA1 . 34461 1 974 . 1 . 1 97 97 GLY HA3 H 1 4.552 0.02 . 2 . . . . A 87 GLY HA2 . 34461 1 975 . 1 . 1 97 97 GLY CA C 13 45.194 0.1 . 1 . . . . A 87 GLY CA . 34461 1 976 . 1 . 1 97 97 GLY N N 15 100.660 0.1 . 1 . . . . A 87 GLY N . 34461 1 977 . 1 . 1 98 98 HIS HA H 1 3.567 0.02 . 1 . . . . A 88 HIS HA . 34461 1 978 . 1 . 1 98 98 HIS HB2 H 1 2.961 0.02 . 2 . . . . A 88 HIS HB1 . 34461 1 979 . 1 . 1 98 98 HIS HB3 H 1 3.013 0.02 . 2 . . . . A 88 HIS HB2 . 34461 1 980 . 1 . 1 98 98 HIS CA C 13 58.492 0.1 . 1 . . . . A 88 HIS CA . 34461 1 981 . 1 . 1 98 98 HIS CB C 13 28.358 0.1 . 1 . . . . A 88 HIS CB . 34461 1 982 . 1 . 1 99 99 GLN H H 1 9.114 0.02 . 1 . . . . A 89 GLN H . 34461 1 983 . 1 . 1 99 99 GLN HA H 1 4.229 0.02 . 1 . . . . A 89 GLN HA . 34461 1 984 . 1 . 1 99 99 GLN CA C 13 56.671 0.1 . 1 . . . . A 89 GLN CA . 34461 1 985 . 1 . 1 99 99 GLN N N 15 120.139 0.1 . 1 . . . . A 89 GLN N . 34461 1 986 . 1 . 1 100 100 VAL H H 1 7.084 0.02 . 1 . . . . A 90 VAL H . 34461 1 987 . 1 . 1 100 100 VAL HA H 1 3.886 0.02 . 1 . . . . A 90 VAL HA . 34461 1 988 . 1 . 1 100 100 VAL HB H 1 2.361 0.02 . 1 . . . . A 90 VAL HB . 34461 1 989 . 1 . 1 100 100 VAL HG11 H 1 0.955 0.02 . 2 . . . . A 90 VAL HG11 . 34461 1 990 . 1 . 1 100 100 VAL HG12 H 1 0.955 0.02 . 2 . . . . A 90 VAL HG12 . 34461 1 991 . 1 . 1 100 100 VAL HG13 H 1 0.955 0.02 . 2 . . . . A 90 VAL HG13 . 34461 1 992 . 1 . 1 100 100 VAL HG21 H 1 0.821 0.02 . 2 . . . . A 90 VAL HG21 . 34461 1 993 . 1 . 1 100 100 VAL HG22 H 1 0.821 0.02 . 2 . . . . A 90 VAL HG22 . 34461 1 994 . 1 . 1 100 100 VAL HG23 H 1 0.821 0.02 . 2 . . . . A 90 VAL HG23 . 34461 1 995 . 1 . 1 100 100 VAL CA C 13 62.526 0.1 . 1 . . . . A 90 VAL CA . 34461 1 996 . 1 . 1 100 100 VAL CB C 13 31.887 0.1 . 1 . . . . A 90 VAL CB . 34461 1 997 . 1 . 1 100 100 VAL CG1 C 13 21.129 0.1 . 2 . . . . A 90 VAL CG1 . 34461 1 998 . 1 . 1 100 100 VAL CG2 C 13 21.067 0.1 . 2 . . . . A 90 VAL CG2 . 34461 1 999 . 1 . 1 100 100 VAL N N 15 123.774 0.1 . 1 . . . . A 90 VAL N . 34461 1 1000 . 1 . 1 101 101 ILE H H 1 7.912 0.02 . 1 . . . . A 91 ILE H . 34461 1 1001 . 1 . 1 101 101 ILE HA H 1 4.363 0.02 . 1 . . . . A 91 ILE HA . 34461 1 1002 . 1 . 1 101 101 ILE HB H 1 1.699 0.02 . 1 . . . . A 91 ILE HB . 34461 1 1003 . 1 . 1 101 101 ILE HG12 H 1 1.112 0.02 . 2 . . . . A 91 ILE HG11 . 34461 1 1004 . 1 . 1 101 101 ILE HG13 H 1 1.382 0.02 . 2 . . . . A 91 ILE HG12 . 34461 1 1005 . 1 . 1 101 101 ILE HG21 H 1 0.742 0.02 . 1 . . . . A 91 ILE HG21 . 34461 1 1006 . 1 . 1 101 101 ILE HG22 H 1 0.742 0.02 . 1 . . . . A 91 ILE HG22 . 34461 1 1007 . 1 . 1 101 101 ILE HG23 H 1 0.742 0.02 . 1 . . . . A 91 ILE HG23 . 34461 1 1008 . 1 . 1 101 101 ILE HD11 H 1 0.796 0.02 . 1 . . . . A 91 ILE HD11 . 34461 1 1009 . 1 . 1 101 101 ILE HD12 H 1 0.796 0.02 . 1 . . . . A 91 ILE HD12 . 34461 1 1010 . 1 . 1 101 101 ILE HD13 H 1 0.796 0.02 . 1 . . . . A 91 ILE HD13 . 34461 1 1011 . 1 . 1 101 101 ILE CA C 13 56.593 0.1 . 1 . . . . A 91 ILE CA . 34461 1 1012 . 1 . 1 101 101 ILE CB C 13 41.281 0.1 . 1 . . . . A 91 ILE CB . 34461 1 1013 . 1 . 1 101 101 ILE CG1 C 13 26.767 0.1 . 1 . . . . A 91 ILE CG1 . 34461 1 1014 . 1 . 1 101 101 ILE CG2 C 13 16.622 0.1 . 1 . . . . A 91 ILE CG2 . 34461 1 1015 . 1 . 1 101 101 ILE CD1 C 13 12.219 0.1 . 1 . . . . A 91 ILE CD1 . 34461 1 1016 . 1 . 1 101 101 ILE N N 15 124.100 0.1 . 1 . . . . A 91 ILE N . 34461 1 1017 . 1 . 1 102 102 PRO HA H 1 4.582 0.02 . 1 . . . . A 92 PRO HA . 34461 1 1018 . 1 . 1 102 102 PRO HB2 H 1 1.982 0.02 . 2 . . . . A 92 PRO HB1 . 34461 1 1019 . 1 . 1 102 102 PRO HB3 H 1 2.327 0.02 . 2 . . . . A 92 PRO HB2 . 34461 1 1020 . 1 . 1 102 102 PRO HG3 H 1 1.856 0.02 . 2 . . . . A 92 PRO HG2 . 34461 1 1021 . 1 . 1 102 102 PRO HD2 H 1 3.527 0.02 . 2 . . . . A 92 PRO HD1 . 34461 1 1022 . 1 . 1 102 102 PRO HD3 H 1 3.408 0.02 . 2 . . . . A 92 PRO HD2 . 34461 1 1023 . 1 . 1 102 102 PRO CA C 13 62.894 0.1 . 1 . . . . A 92 PRO CA . 34461 1 1024 . 1 . 1 102 102 PRO CB C 13 34.098 0.1 . 1 . . . . A 92 PRO CB . 34461 1 1025 . 1 . 1 102 102 PRO CG C 13 25.587 0.1 . 1 . . . . A 92 PRO CG . 34461 1 1026 . 1 . 1 102 102 PRO CD C 13 49.890 0.1 . 1 . . . . A 92 PRO CD . 34461 1 1027 . 1 . 1 103 103 TRP H H 1 7.919 0.02 . 1 . . . . A 93 TRP H . 34461 1 1028 . 1 . 1 103 103 TRP HD1 H 1 7.908 0.02 . 1 . . . . A 93 TRP HD1 . 34461 1 1029 . 1 . 1 103 103 TRP HE1 H 1 10.291 0.02 . 1 . . . . A 93 TRP HE1 . 34461 1 1030 . 1 . 1 103 103 TRP HE3 H 1 7.662 0.02 . 1 . . . . A 93 TRP HE3 . 34461 1 1031 . 1 . 1 103 103 TRP HZ2 H 1 7.688 0.02 . 1 . . . . A 93 TRP HZ2 . 34461 1 1032 . 1 . 1 103 103 TRP HZ3 H 1 7.152 0.02 . 1 . . . . A 93 TRP HZ3 . 34461 1 1033 . 1 . 1 103 103 TRP HH2 H 1 7.296 0.02 . 1 . . . . A 93 TRP HH2 . 34461 1 1034 . 1 . 1 103 103 TRP CA C 13 57.309 0.1 . 1 . . . . A 93 TRP CA . 34461 1 1035 . 1 . 1 103 103 TRP CD1 C 13 128.162 0.1 . 1 . . . . A 93 TRP CD1 . 34461 1 1036 . 1 . 1 103 103 TRP CE3 C 13 121.069 0.1 . 1 . . . . A 93 TRP CE3 . 34461 1 1037 . 1 . 1 103 103 TRP CZ2 C 13 114.598 0.1 . 1 . . . . A 93 TRP CZ2 . 34461 1 1038 . 1 . 1 103 103 TRP CZ3 C 13 122.266 0.1 . 1 . . . . A 93 TRP CZ3 . 34461 1 1039 . 1 . 1 103 103 TRP CH2 C 13 124.772 0.1 . 1 . . . . A 93 TRP CH2 . 34461 1 1040 . 1 . 1 103 103 TRP N N 15 119.983 0.1 . 1 . . . . A 93 TRP N . 34461 1 1041 . 1 . 1 103 103 TRP NE1 N 15 129.803 0.1 . 1 . . . . A 93 TRP NE1 . 34461 1 1042 . 1 . 1 104 104 GLY HA2 H 1 3.975 0.02 . 2 . . . . A 94 GLY HA1 . 34461 1 1043 . 1 . 1 104 104 GLY HA3 H 1 3.543 0.02 . 2 . . . . A 94 GLY HA2 . 34461 1 1044 . 1 . 1 104 104 GLY CA C 13 45.637 0.1 . 1 . . . . A 94 GLY CA . 34461 1 1045 . 1 . 1 105 105 ASP H H 1 7.509 0.02 . 1 . . . . A 95 ASP H . 34461 1 1046 . 1 . 1 105 105 ASP HA H 1 4.284 0.02 . 1 . . . . A 95 ASP HA . 34461 1 1047 . 1 . 1 105 105 ASP HB2 H 1 2.538 0.02 . 2 . . . . A 95 ASP HB1 . 34461 1 1048 . 1 . 1 105 105 ASP HB3 H 1 2.732 0.02 . 2 . . . . A 95 ASP HB2 . 34461 1 1049 . 1 . 1 105 105 ASP CA C 13 55.109 0.1 . 1 . . . . A 95 ASP CA . 34461 1 1050 . 1 . 1 105 105 ASP CB C 13 43.806 0.1 . 1 . . . . A 95 ASP CB . 34461 1 1051 . 1 . 1 105 105 ASP N N 15 119.753 0.1 . 1 . . . . A 95 ASP N . 34461 1 1052 . 1 . 1 106 106 MET H H 1 8.635 0.02 . 1 . . . . A 96 MET H . 34461 1 1053 . 1 . 1 106 106 MET HA H 1 3.872 0.02 . 1 . . . . A 96 MET HA . 34461 1 1054 . 1 . 1 106 106 MET HB3 H 1 1.772 0.02 . 2 . . . . A 96 MET HB2 . 34461 1 1055 . 1 . 1 106 106 MET CA C 13 58.946 0.1 . 1 . . . . A 96 MET CA . 34461 1 1056 . 1 . 1 106 106 MET N N 15 127.918 0.1 . 1 . . . . A 96 MET N . 34461 1 1057 . 1 . 1 107 107 ALA H H 1 8.296 0.02 . 1 . . . . A 97 ALA H . 34461 1 1058 . 1 . 1 107 107 ALA HA H 1 4.040 0.02 . 1 . . . . A 97 ALA HA . 34461 1 1059 . 1 . 1 107 107 ALA HB1 H 1 1.440 0.02 . 1 . . . . A 97 ALA HB1 . 34461 1 1060 . 1 . 1 107 107 ALA HB2 H 1 1.440 0.02 . 1 . . . . A 97 ALA HB2 . 34461 1 1061 . 1 . 1 107 107 ALA HB3 H 1 1.440 0.02 . 1 . . . . A 97 ALA HB3 . 34461 1 1062 . 1 . 1 107 107 ALA CA C 13 55.246 0.1 . 1 . . . . A 97 ALA CA . 34461 1 1063 . 1 . 1 107 107 ALA CB C 13 17.616 0.1 . 1 . . . . A 97 ALA CB . 34461 1 1064 . 1 . 1 107 107 ALA N N 15 120.877 0.1 . 1 . . . . A 97 ALA N . 34461 1 1065 . 1 . 1 108 108 SER H H 1 8.005 0.02 . 1 . . . . A 98 SER H . 34461 1 1066 . 1 . 1 108 108 SER CA C 13 62.156 0.1 . 1 . . . . A 98 SER CA . 34461 1 1067 . 1 . 1 108 108 SER N N 15 115.633 0.1 . 1 . . . . A 98 SER N . 34461 1 1068 . 1 . 1 109 109 LEU H H 1 8.259 0.02 . 1 . . . . A 99 LEU H . 34461 1 1069 . 1 . 1 109 109 LEU HA H 1 4.290 0.02 . 1 . . . . A 99 LEU HA . 34461 1 1070 . 1 . 1 109 109 LEU HB2 H 1 0.824 0.02 . 2 . . . . A 99 LEU HB1 . 34461 1 1071 . 1 . 1 109 109 LEU HB3 H 1 1.128 0.02 . 2 . . . . A 99 LEU HB2 . 34461 1 1072 . 1 . 1 109 109 LEU HD11 H 1 0.856 0.02 . 2 . . . . A 99 LEU HD11 . 34461 1 1073 . 1 . 1 109 109 LEU HD12 H 1 0.856 0.02 . 2 . . . . A 99 LEU HD12 . 34461 1 1074 . 1 . 1 109 109 LEU HD13 H 1 0.856 0.02 . 2 . . . . A 99 LEU HD13 . 34461 1 1075 . 1 . 1 109 109 LEU HD21 H 1 0.744 0.02 . 2 . . . . A 99 LEU HD21 . 34461 1 1076 . 1 . 1 109 109 LEU HD22 H 1 0.744 0.02 . 2 . . . . A 99 LEU HD22 . 34461 1 1077 . 1 . 1 109 109 LEU HD23 H 1 0.744 0.02 . 2 . . . . A 99 LEU HD23 . 34461 1 1078 . 1 . 1 109 109 LEU CA C 13 58.342 0.1 . 1 . . . . A 99 LEU CA . 34461 1 1079 . 1 . 1 109 109 LEU CB C 13 41.295 0.1 . 1 . . . . A 99 LEU CB . 34461 1 1080 . 1 . 1 109 109 LEU CD1 C 13 22.509 0.1 . 2 . . . . A 99 LEU CD1 . 34461 1 1081 . 1 . 1 109 109 LEU CD2 C 13 25.266 0.1 . 2 . . . . A 99 LEU CD2 . 34461 1 1082 . 1 . 1 109 109 LEU N N 15 124.188 0.1 . 1 . . . . A 99 LEU N . 34461 1 1083 . 1 . 1 110 110 ALA H H 1 8.475 0.02 . 1 . . . . A 100 ALA H . 34461 1 1084 . 1 . 1 110 110 ALA HA H 1 4.888 0.02 . 1 . . . . A 100 ALA HA . 34461 1 1085 . 1 . 1 110 110 ALA HB1 H 1 1.478 0.02 . 1 . . . . A 100 ALA HB1 . 34461 1 1086 . 1 . 1 110 110 ALA HB2 H 1 1.478 0.02 . 1 . . . . A 100 ALA HB2 . 34461 1 1087 . 1 . 1 110 110 ALA HB3 H 1 1.478 0.02 . 1 . . . . A 100 ALA HB3 . 34461 1 1088 . 1 . 1 110 110 ALA CA C 13 54.538 0.1 . 1 . . . . A 100 ALA CA . 34461 1 1089 . 1 . 1 110 110 ALA CB C 13 17.602 0.1 . 1 . . . . A 100 ALA CB . 34461 1 1090 . 1 . 1 110 110 ALA N N 15 122.392 0.1 . 1 . . . . A 100 ALA N . 34461 1 1091 . 1 . 1 111 111 LEU H H 1 7.570 0.02 . 1 . . . . A 101 LEU H . 34461 1 1092 . 1 . 1 111 111 LEU HA H 1 4.121 0.02 . 1 . . . . A 101 LEU HA . 34461 1 1093 . 1 . 1 111 111 LEU HB2 H 1 1.859 0.02 . 2 . . . . A 101 LEU HB1 . 34461 1 1094 . 1 . 1 111 111 LEU HB3 H 1 1.684 0.02 . 2 . . . . A 101 LEU HB2 . 34461 1 1095 . 1 . 1 111 111 LEU HG H 1 1.763 0.02 . 1 . . . . A 101 LEU HG . 34461 1 1096 . 1 . 1 111 111 LEU HD11 H 1 0.895 0.02 . 2 . . . . A 101 LEU HD11 . 34461 1 1097 . 1 . 1 111 111 LEU HD12 H 1 0.895 0.02 . 2 . . . . A 101 LEU HD12 . 34461 1 1098 . 1 . 1 111 111 LEU HD13 H 1 0.895 0.02 . 2 . . . . A 101 LEU HD13 . 34461 1 1099 . 1 . 1 111 111 LEU HD21 H 1 0.956 0.02 . 2 . . . . A 101 LEU HD21 . 34461 1 1100 . 1 . 1 111 111 LEU HD22 H 1 0.956 0.02 . 2 . . . . A 101 LEU HD22 . 34461 1 1101 . 1 . 1 111 111 LEU HD23 H 1 0.956 0.02 . 2 . . . . A 101 LEU HD23 . 34461 1 1102 . 1 . 1 111 111 LEU CA C 13 58.180 0.1 . 1 . . . . A 101 LEU CA . 34461 1 1103 . 1 . 1 111 111 LEU CB C 13 41.534 0.1 . 1 . . . . A 101 LEU CB . 34461 1 1104 . 1 . 1 111 111 LEU CG C 13 26.906 0.1 . 1 . . . . A 101 LEU CG . 34461 1 1105 . 1 . 1 111 111 LEU CD1 C 13 23.842 0.1 . 2 . . . . A 101 LEU CD1 . 34461 1 1106 . 1 . 1 111 111 LEU CD2 C 13 24.798 0.1 . 2 . . . . A 101 LEU CD2 . 34461 1 1107 . 1 . 1 111 111 LEU N N 15 119.226 0.1 . 1 . . . . A 101 LEU N . 34461 1 1108 . 1 . 1 112 112 LEU H H 1 7.440 0.02 . 1 . . . . A 102 LEU H . 34461 1 1109 . 1 . 1 112 112 LEU HA H 1 3.775 0.02 . 1 . . . . A 102 LEU HA . 34461 1 1110 . 1 . 1 112 112 LEU HB2 H 1 1.034 0.02 . 2 . . . . A 102 LEU HB1 . 34461 1 1111 . 1 . 1 112 112 LEU HB3 H 1 1.917 0.02 . 2 . . . . A 102 LEU HB2 . 34461 1 1112 . 1 . 1 112 112 LEU HG H 1 1.593 0.02 . 1 . . . . A 102 LEU HG . 34461 1 1113 . 1 . 1 112 112 LEU HD11 H 1 0.688 0.02 . 2 . . . . A 102 LEU HD11 . 34461 1 1114 . 1 . 1 112 112 LEU HD12 H 1 0.688 0.02 . 2 . . . . A 102 LEU HD12 . 34461 1 1115 . 1 . 1 112 112 LEU HD13 H 1 0.688 0.02 . 2 . . . . A 102 LEU HD13 . 34461 1 1116 . 1 . 1 112 112 LEU HD21 H 1 0.801 0.02 . 2 . . . . A 102 LEU HD21 . 34461 1 1117 . 1 . 1 112 112 LEU HD22 H 1 0.801 0.02 . 2 . . . . A 102 LEU HD22 . 34461 1 1118 . 1 . 1 112 112 LEU HD23 H 1 0.801 0.02 . 2 . . . . A 102 LEU HD23 . 34461 1 1119 . 1 . 1 112 112 LEU CA C 13 57.497 0.1 . 1 . . . . A 102 LEU CA . 34461 1 1120 . 1 . 1 112 112 LEU CB C 13 41.312 0.1 . 1 . . . . A 102 LEU CB . 34461 1 1121 . 1 . 1 112 112 LEU CG C 13 26.846 0.1 . 1 . . . . A 102 LEU CG . 34461 1 1122 . 1 . 1 112 112 LEU CD1 C 13 23.199 0.1 . 2 . . . . A 102 LEU CD1 . 34461 1 1123 . 1 . 1 112 112 LEU CD2 C 13 25.955 0.1 . 2 . . . . A 102 LEU CD2 . 34461 1 1124 . 1 . 1 112 112 LEU N N 15 120.724 0.1 . 1 . . . . A 102 LEU N . 34461 1 1125 . 1 . 1 113 113 GLN H H 1 8.448 0.02 . 1 . . . . A 103 GLN H . 34461 1 1126 . 1 . 1 113 113 GLN HA H 1 3.678 0.02 . 1 . . . . A 103 GLN HA . 34461 1 1127 . 1 . 1 113 113 GLN HB2 H 1 2.377 0.02 . 2 . . . . A 103 GLN HB1 . 34461 1 1128 . 1 . 1 113 113 GLN HB3 H 1 2.234 0.02 . 2 . . . . A 103 GLN HB2 . 34461 1 1129 . 1 . 1 113 113 GLN CA C 13 60.675 0.1 . 1 . . . . A 103 GLN CA . 34461 1 1130 . 1 . 1 113 113 GLN CB C 13 27.962 0.1 . 1 . . . . A 103 GLN CB . 34461 1 1131 . 1 . 1 113 113 GLN CG C 13 33.419 0.1 . 1 . . . . A 103 GLN CG . 34461 1 1132 . 1 . 1 113 113 GLN N N 15 120.109 0.1 . 1 . . . . A 103 GLN N . 34461 1 1133 . 1 . 1 114 114 ARG H H 1 7.654 0.02 . 1 . . . . A 104 ARG H . 34461 1 1134 . 1 . 1 114 114 ARG HA H 1 4.018 0.02 . 1 . . . . A 104 ARG HA . 34461 1 1135 . 1 . 1 114 114 ARG HB2 H 1 1.887 0.02 . 2 . . . . A 104 ARG HB1 . 34461 1 1136 . 1 . 1 114 114 ARG HB3 H 1 1.959 0.02 . 2 . . . . A 104 ARG HB2 . 34461 1 1137 . 1 . 1 114 114 ARG HD2 H 1 3.243 0.02 . 2 . . . . A 104 ARG HD1 . 34461 1 1138 . 1 . 1 114 114 ARG HD3 H 1 3.317 0.02 . 2 . . . . A 104 ARG HD2 . 34461 1 1139 . 1 . 1 114 114 ARG CA C 13 58.862 0.1 . 1 . . . . A 104 ARG CA . 34461 1 1140 . 1 . 1 114 114 ARG CB C 13 30.384 0.1 . 1 . . . . A 104 ARG CB . 34461 1 1141 . 1 . 1 114 114 ARG CG C 13 27.232 0.1 . 1 . . . . A 104 ARG CG . 34461 1 1142 . 1 . 1 114 114 ARG CD C 13 43.842 0.1 . 1 . . . . A 104 ARG CD . 34461 1 1143 . 1 . 1 114 114 ARG N N 15 118.170 0.1 . 1 . . . . A 104 ARG N . 34461 1 1144 . 1 . 1 115 115 GLN H H 1 8.144 0.02 . 1 . . . . A 105 GLN H . 34461 1 1145 . 1 . 1 115 115 GLN HA H 1 4.009 0.02 . 1 . . . . A 105 GLN HA . 34461 1 1146 . 1 . 1 115 115 GLN HB2 H 1 2.117 0.02 . 2 . . . . A 105 GLN HB1 . 34461 1 1147 . 1 . 1 115 115 GLN HB3 H 1 1.903 0.02 . 2 . . . . A 105 GLN HB2 . 34461 1 1148 . 1 . 1 115 115 GLN HG2 H 1 2.426 0.02 . 2 . . . . A 105 GLN HG1 . 34461 1 1149 . 1 . 1 115 115 GLN HG3 H 1 2.184 0.02 . 2 . . . . A 105 GLN HG2 . 34461 1 1150 . 1 . 1 115 115 GLN CA C 13 58.738 0.1 . 1 . . . . A 105 GLN CA . 34461 1 1151 . 1 . 1 115 115 GLN CB C 13 28.790 0.1 . 1 . . . . A 105 GLN CB . 34461 1 1152 . 1 . 1 115 115 GLN CG C 13 33.781 0.1 . 1 . . . . A 105 GLN CG . 34461 1 1153 . 1 . 1 115 115 GLN N N 15 120.320 0.1 . 1 . . . . A 105 GLN N . 34461 1 1154 . 1 . 1 116 116 PHE H H 1 8.523 0.02 . 1 . . . . A 106 PHE H . 34461 1 1155 . 1 . 1 116 116 PHE HA H 1 4.587 0.02 . 1 . . . . A 106 PHE HA . 34461 1 1156 . 1 . 1 116 116 PHE HB2 H 1 2.959 0.02 . 2 . . . . A 106 PHE HB1 . 34461 1 1157 . 1 . 1 116 116 PHE HB3 H 1 3.207 0.02 . 2 . . . . A 106 PHE HB2 . 34461 1 1158 . 1 . 1 116 116 PHE CA C 13 56.461 0.1 . 1 . . . . A 106 PHE CA . 34461 1 1159 . 1 . 1 116 116 PHE CB C 13 39.812 0.1 . 1 . . . . A 106 PHE CB . 34461 1 1160 . 1 . 1 116 116 PHE N N 15 116.499 0.1 . 1 . . . . A 106 PHE N . 34461 1 1161 . 1 . 1 117 117 ASP H H 1 8.370 0.02 . 1 . . . . A 107 ASP H . 34461 1 1162 . 1 . 1 117 117 ASP HA H 1 4.310 0.02 . 1 . . . . A 107 ASP HA . 34461 1 1163 . 1 . 1 117 117 ASP HB2 H 1 2.338 0.02 . 2 . . . . A 107 ASP HB1 . 34461 1 1164 . 1 . 1 117 117 ASP HB3 H 1 3.240 0.02 . 2 . . . . A 107 ASP HB2 . 34461 1 1165 . 1 . 1 117 117 ASP CA C 13 55.019 0.1 . 1 . . . . A 107 ASP CA . 34461 1 1166 . 1 . 1 117 117 ASP CB C 13 39.384 0.1 . 1 . . . . A 107 ASP CB . 34461 1 1167 . 1 . 1 117 117 ASP N N 15 120.099 0.1 . 1 . . . . A 107 ASP N . 34461 1 1168 . 1 . 1 118 118 VAL H H 1 6.960 0.02 . 1 . . . . A 108 VAL H . 34461 1 1169 . 1 . 1 118 118 VAL HA H 1 4.556 0.02 . 1 . . . . A 108 VAL HA . 34461 1 1170 . 1 . 1 118 118 VAL HB H 1 2.516 0.02 . 1 . . . . A 108 VAL HB . 34461 1 1171 . 1 . 1 118 118 VAL HG11 H 1 0.799 0.02 . 2 . . . . A 108 VAL HG11 . 34461 1 1172 . 1 . 1 118 118 VAL HG12 H 1 0.799 0.02 . 2 . . . . A 108 VAL HG12 . 34461 1 1173 . 1 . 1 118 118 VAL HG13 H 1 0.799 0.02 . 2 . . . . A 108 VAL HG13 . 34461 1 1174 . 1 . 1 118 118 VAL HG21 H 1 0.860 0.02 . 2 . . . . A 108 VAL HG21 . 34461 1 1175 . 1 . 1 118 118 VAL HG22 H 1 0.860 0.02 . 2 . . . . A 108 VAL HG22 . 34461 1 1176 . 1 . 1 118 118 VAL HG23 H 1 0.860 0.02 . 2 . . . . A 108 VAL HG23 . 34461 1 1177 . 1 . 1 118 118 VAL CA C 13 58.609 0.1 . 1 . . . . A 108 VAL CA . 34461 1 1178 . 1 . 1 118 118 VAL CB C 13 33.474 0.1 . 1 . . . . A 108 VAL CB . 34461 1 1179 . 1 . 1 118 118 VAL CG1 C 13 23.936 0.1 . 2 . . . . A 108 VAL CG1 . 34461 1 1180 . 1 . 1 118 118 VAL CG2 C 13 18.818 0.1 . 2 . . . . A 108 VAL CG2 . 34461 1 1181 . 1 . 1 118 118 VAL N N 15 105.637 0.1 . 1 . . . . A 108 VAL N . 34461 1 1182 . 1 . 1 119 119 ASP H H 1 8.801 0.02 . 1 . . . . A 109 ASP H . 34461 1 1183 . 1 . 1 119 119 ASP HA H 1 4.689 0.02 . 1 . . . . A 109 ASP HA . 34461 1 1184 . 1 . 1 119 119 ASP CA C 13 57.468 0.1 . 1 . . . . A 109 ASP CA . 34461 1 1185 . 1 . 1 119 119 ASP N N 15 119.627 0.1 . 1 . . . . A 109 ASP N . 34461 1 1186 . 1 . 1 120 120 ILE H H 1 7.376 0.02 . 1 . . . . A 110 ILE H . 34461 1 1187 . 1 . 1 120 120 ILE HA H 1 5.198 0.02 . 1 . . . . A 110 ILE HA . 34461 1 1188 . 1 . 1 120 120 ILE HB H 1 1.582 0.02 . 1 . . . . A 110 ILE HB . 34461 1 1189 . 1 . 1 120 120 ILE HG21 H 1 0.658 0.02 . 1 . . . . A 110 ILE HG21 . 34461 1 1190 . 1 . 1 120 120 ILE HG22 H 1 0.658 0.02 . 1 . . . . A 110 ILE HG22 . 34461 1 1191 . 1 . 1 120 120 ILE HG23 H 1 0.658 0.02 . 1 . . . . A 110 ILE HG23 . 34461 1 1192 . 1 . 1 120 120 ILE HD11 H 1 0.582 0.02 . 1 . . . . A 110 ILE HD11 . 34461 1 1193 . 1 . 1 120 120 ILE HD12 H 1 0.582 0.02 . 1 . . . . A 110 ILE HD12 . 34461 1 1194 . 1 . 1 120 120 ILE HD13 H 1 0.582 0.02 . 1 . . . . A 110 ILE HD13 . 34461 1 1195 . 1 . 1 120 120 ILE CA C 13 58.191 0.1 . 1 . . . . A 110 ILE CA . 34461 1 1196 . 1 . 1 120 120 ILE CB C 13 42.558 0.1 . 1 . . . . A 110 ILE CB . 34461 1 1197 . 1 . 1 120 120 ILE CG1 C 13 27.345 0.1 . 1 . . . . A 110 ILE CG1 . 34461 1 1198 . 1 . 1 120 120 ILE CG2 C 13 16.282 0.1 . 1 . . . . A 110 ILE CG2 . 34461 1 1199 . 1 . 1 120 120 ILE CD1 C 13 13.845 0.1 . 1 . . . . A 110 ILE CD1 . 34461 1 1200 . 1 . 1 120 120 ILE N N 15 113.893 0.1 . 1 . . . . A 110 ILE N . 34461 1 1201 . 1 . 1 121 121 LEU H H 1 8.654 0.02 . 1 . . . . A 111 LEU H . 34461 1 1202 . 1 . 1 121 121 LEU HA H 1 4.801 0.02 . 1 . . . . A 111 LEU HA . 34461 1 1203 . 1 . 1 121 121 LEU HD11 H 1 0.970 0.02 . 2 . . . . A 111 LEU HD11 . 34461 1 1204 . 1 . 1 121 121 LEU HD12 H 1 0.970 0.02 . 2 . . . . A 111 LEU HD12 . 34461 1 1205 . 1 . 1 121 121 LEU HD13 H 1 0.970 0.02 . 2 . . . . A 111 LEU HD13 . 34461 1 1206 . 1 . 1 121 121 LEU HD21 H 1 0.774 0.02 . 2 . . . . A 111 LEU HD21 . 34461 1 1207 . 1 . 1 121 121 LEU HD22 H 1 0.774 0.02 . 2 . . . . A 111 LEU HD22 . 34461 1 1208 . 1 . 1 121 121 LEU HD23 H 1 0.774 0.02 . 2 . . . . A 111 LEU HD23 . 34461 1 1209 . 1 . 1 121 121 LEU CA C 13 53.212 0.1 . 1 . . . . A 111 LEU CA . 34461 1 1210 . 1 . 1 121 121 LEU CB C 13 44.503 0.1 . 1 . . . . A 111 LEU CB . 34461 1 1211 . 1 . 1 121 121 LEU CD1 C 13 27.885 0.1 . 2 . . . . A 111 LEU CD1 . 34461 1 1212 . 1 . 1 121 121 LEU CD2 C 13 23.626 0.1 . 2 . . . . A 111 LEU CD2 . 34461 1 1213 . 1 . 1 121 121 LEU N N 15 129.131 0.1 . 1 . . . . A 111 LEU N . 34461 1 1214 . 1 . 1 122 122 ILE H H 1 9.020 0.02 . 1 . . . . A 112 ILE H . 34461 1 1215 . 1 . 1 122 122 ILE HA H 1 5.396 0.02 . 1 . . . . A 112 ILE HA . 34461 1 1216 . 1 . 1 122 122 ILE HB H 1 1.867 0.02 . 1 . . . . A 112 ILE HB . 34461 1 1217 . 1 . 1 122 122 ILE HG13 H 1 1.502 0.02 . 2 . . . . A 112 ILE HG12 . 34461 1 1218 . 1 . 1 122 122 ILE HG21 H 1 0.632 0.02 . 1 . . . . A 112 ILE HG21 . 34461 1 1219 . 1 . 1 122 122 ILE HG22 H 1 0.632 0.02 . 1 . . . . A 112 ILE HG22 . 34461 1 1220 . 1 . 1 122 122 ILE HG23 H 1 0.632 0.02 . 1 . . . . A 112 ILE HG23 . 34461 1 1221 . 1 . 1 122 122 ILE HD11 H 1 0.699 0.02 . 1 . . . . A 112 ILE HD11 . 34461 1 1222 . 1 . 1 122 122 ILE HD12 H 1 0.699 0.02 . 1 . . . . A 112 ILE HD12 . 34461 1 1223 . 1 . 1 122 122 ILE HD13 H 1 0.699 0.02 . 1 . . . . A 112 ILE HD13 . 34461 1 1224 . 1 . 1 122 122 ILE CA C 13 59.274 0.1 . 1 . . . . A 112 ILE CA . 34461 1 1225 . 1 . 1 122 122 ILE CB C 13 38.609 0.1 . 1 . . . . A 112 ILE CB . 34461 1 1226 . 1 . 1 122 122 ILE CG1 C 13 27.987 0.1 . 1 . . . . A 112 ILE CG1 . 34461 1 1227 . 1 . 1 122 122 ILE CG2 C 13 18.453 0.1 . 1 . . . . A 112 ILE CG2 . 34461 1 1228 . 1 . 1 122 122 ILE CD1 C 13 15.798 0.1 . 1 . . . . A 112 ILE CD1 . 34461 1 1229 . 1 . 1 122 122 ILE N N 15 129.972 0.1 . 1 . . . . A 112 ILE N . 34461 1 1230 . 1 . 1 123 123 SER H H 1 8.604 0.02 . 1 . . . . A 113 SER H . 34461 1 1231 . 1 . 1 123 123 SER HA H 1 5.745 0.02 . 1 . . . . A 113 SER HA . 34461 1 1232 . 1 . 1 123 123 SER HB2 H 1 3.584 0.02 . 2 . . . . A 113 SER HB1 . 34461 1 1233 . 1 . 1 123 123 SER HB3 H 1 4.063 0.02 . 2 . . . . A 113 SER HB2 . 34461 1 1234 . 1 . 1 123 123 SER CA C 13 56.906 0.1 . 1 . . . . A 113 SER CA . 34461 1 1235 . 1 . 1 123 123 SER CB C 13 66.476 0.1 . 1 . . . . A 113 SER CB . 34461 1 1236 . 1 . 1 123 123 SER N N 15 119.936 0.1 . 1 . . . . A 113 SER N . 34461 1 1237 . 1 . 1 124 124 GLY H H 1 7.263 0.02 . 1 . . . . A 114 GLY H . 34461 1 1238 . 1 . 1 124 124 GLY HA2 H 1 3.616 0.02 . 2 . . . . A 114 GLY HA1 . 34461 1 1239 . 1 . 1 124 124 GLY HA3 H 1 4.955 0.02 . 2 . . . . A 114 GLY HA2 . 34461 1 1240 . 1 . 1 124 124 GLY CA C 13 46.635 0.1 . 1 . . . . A 114 GLY CA . 34461 1 1241 . 1 . 1 124 124 GLY N N 15 104.797 0.1 . 1 . . . . A 114 GLY N . 34461 1 1242 . 1 . 1 125 125 HIS H H 1 9.714 0.02 . 1 . . . . A 115 HIS H . 34461 1 1243 . 1 . 1 125 125 HIS HA H 1 4.332 0.02 . 1 . . . . A 115 HIS HA . 34461 1 1244 . 1 . 1 125 125 HIS N N 15 125.687 0.1 . 1 . . . . A 115 HIS N . 34461 1 1245 . 1 . 1 126 126 THR H H 1 8.256 0.02 . 1 . . . . A 116 THR H . 34461 1 1246 . 1 . 1 126 126 THR HA H 1 3.561 0.02 . 1 . . . . A 116 THR HA . 34461 1 1247 . 1 . 1 126 126 THR HB H 1 4.180 0.02 . 1 . . . . A 116 THR HB . 34461 1 1248 . 1 . 1 126 126 THR HG21 H 1 1.178 0.02 . 1 . . . . A 116 THR HG21 . 34461 1 1249 . 1 . 1 126 126 THR HG22 H 1 1.178 0.02 . 1 . . . . A 116 THR HG22 . 34461 1 1250 . 1 . 1 126 126 THR HG23 H 1 1.178 0.02 . 1 . . . . A 116 THR HG23 . 34461 1 1251 . 1 . 1 126 126 THR CA C 13 62.873 0.1 . 1 . . . . A 116 THR CA . 34461 1 1252 . 1 . 1 126 126 THR CB C 13 69.101 0.1 . 1 . . . . A 116 THR CB . 34461 1 1253 . 1 . 1 126 126 THR CG2 C 13 21.998 0.1 . 1 . . . . A 116 THR CG2 . 34461 1 1254 . 1 . 1 126 126 THR N N 15 109.900 0.1 . 1 . . . . A 116 THR N . 34461 1 1255 . 1 . 1 127 127 HIS H H 1 9.194 0.02 . 1 . . . . A 117 HIS H . 34461 1 1256 . 1 . 1 127 127 HIS HA H 1 3.931 0.02 . 1 . . . . A 117 HIS HA . 34461 1 1257 . 1 . 1 127 127 HIS HB2 H 1 3.485 0.02 . 2 . . . . A 117 HIS HB1 . 34461 1 1258 . 1 . 1 127 127 HIS HB3 H 1 3.631 0.02 . 2 . . . . A 117 HIS HB2 . 34461 1 1259 . 1 . 1 127 127 HIS HE1 H 1 8.363 0.02 . 1 . . . . A 117 HIS HE1 . 34461 1 1260 . 1 . 1 127 127 HIS CA C 13 56.305 0.1 . 1 . . . . A 117 HIS CA . 34461 1 1261 . 1 . 1 127 127 HIS CB C 13 26.403 0.1 . 1 . . . . A 117 HIS CB . 34461 1 1262 . 1 . 1 127 127 HIS CE1 C 13 139.327 0.1 . 1 . . . . A 117 HIS CE1 . 34461 1 1263 . 1 . 1 127 127 HIS N N 15 113.602 0.1 . 1 . . . . A 117 HIS N . 34461 1 1264 . 1 . 1 128 128 LYS H H 1 7.587 0.02 . 1 . . . . A 118 LYS H . 34461 1 1265 . 1 . 1 128 128 LYS HA H 1 4.687 0.02 . 1 . . . . A 118 LYS HA . 34461 1 1266 . 1 . 1 128 128 LYS HB2 H 1 1.650 0.02 . 2 . . . . A 118 LYS HB1 . 34461 1 1267 . 1 . 1 128 128 LYS HB3 H 1 1.506 0.02 . 2 . . . . A 118 LYS HB2 . 34461 1 1268 . 1 . 1 128 128 LYS HG2 H 1 1.273 0.02 . 2 . . . . A 118 LYS HG1 . 34461 1 1269 . 1 . 1 128 128 LYS HG3 H 1 1.381 0.02 . 2 . . . . A 118 LYS HG2 . 34461 1 1270 . 1 . 1 128 128 LYS HD3 H 1 1.655 0.02 . 2 . . . . A 118 LYS HD2 . 34461 1 1271 . 1 . 1 128 128 LYS HE3 H 1 2.943 0.02 . 1 . . . . A 118 LYS HE2 . 34461 1 1272 . 1 . 1 128 128 LYS CA C 13 55.120 0.1 . 1 . . . . A 118 LYS CA . 34461 1 1273 . 1 . 1 128 128 LYS CB C 13 34.296 0.1 . 1 . . . . A 118 LYS CB . 34461 1 1274 . 1 . 1 128 128 LYS CG C 13 24.345 0.1 . 1 . . . . A 118 LYS CG . 34461 1 1275 . 1 . 1 128 128 LYS CD C 13 28.989 0.1 . 1 . . . . A 118 LYS CD . 34461 1 1276 . 1 . 1 128 128 LYS CE C 13 42.132 0.1 . 1 . . . . A 118 LYS CE . 34461 1 1277 . 1 . 1 128 128 LYS N N 15 119.587 0.1 . 1 . . . . A 118 LYS N . 34461 1 1278 . 1 . 1 129 129 PHE H H 1 8.408 0.02 . 1 . . . . A 119 PHE H . 34461 1 1279 . 1 . 1 129 129 PHE HA H 1 4.692 0.02 . 1 . . . . A 119 PHE HA . 34461 1 1280 . 1 . 1 129 129 PHE HB2 H 1 2.561 0.02 . 2 . . . . A 119 PHE HB1 . 34461 1 1281 . 1 . 1 129 129 PHE HB3 H 1 3.043 0.02 . 2 . . . . A 119 PHE HB2 . 34461 1 1282 . 1 . 1 129 129 PHE HD1 H 1 7.143 0.02 . 1 . . . . A 119 PHE HD1 . 34461 1 1283 . 1 . 1 129 129 PHE HD2 H 1 7.143 0.02 . 1 . . . . A 119 PHE HD2 . 34461 1 1284 . 1 . 1 129 129 PHE HE1 H 1 7.061 0.02 . 1 . . . . A 119 PHE HE1 . 34461 1 1285 . 1 . 1 129 129 PHE HE2 H 1 7.061 0.02 . 1 . . . . A 119 PHE HE2 . 34461 1 1286 . 1 . 1 129 129 PHE CA C 13 57.543 0.1 . 1 . . . . A 119 PHE CA . 34461 1 1287 . 1 . 1 129 129 PHE CB C 13 38.761 0.1 . 1 . . . . A 119 PHE CB . 34461 1 1288 . 1 . 1 129 129 PHE CD1 C 13 132.577 0.1 . 1 . . . . A 119 PHE CD1 . 34461 1 1289 . 1 . 1 129 129 PHE CE2 C 13 130.672 0.1 . 1 . . . . A 119 PHE CE2 . 34461 1 1290 . 1 . 1 129 129 PHE N N 15 125.291 0.1 . 1 . . . . A 119 PHE N . 34461 1 1291 . 1 . 1 130 130 GLU H H 1 8.376 0.02 . 1 . . . . A 120 GLU H . 34461 1 1292 . 1 . 1 130 130 GLU HA H 1 3.703 0.02 . 1 . . . . A 120 GLU HA . 34461 1 1293 . 1 . 1 130 130 GLU HB2 H 1 1.695 0.02 . 2 . . . . A 120 GLU HB1 . 34461 1 1294 . 1 . 1 130 130 GLU HB3 H 1 1.970 0.02 . 2 . . . . A 120 GLU HB2 . 34461 1 1295 . 1 . 1 130 130 GLU HG2 H 1 2.348 0.02 . 2 . . . . A 120 GLU HG1 . 34461 1 1296 . 1 . 1 130 130 GLU HG3 H 1 2.070 0.02 . 2 . . . . A 120 GLU HG2 . 34461 1 1297 . 1 . 1 130 130 GLU CA C 13 55.764 0.1 . 1 . . . . A 120 GLU CA . 34461 1 1298 . 1 . 1 130 130 GLU CB C 13 34.262 0.1 . 1 . . . . A 120 GLU CB . 34461 1 1299 . 1 . 1 130 130 GLU CG C 13 36.064 0.1 . 1 . . . . A 120 GLU CG . 34461 1 1300 . 1 . 1 130 130 GLU N N 15 126.012 0.1 . 1 . . . . A 120 GLU N . 34461 1 1301 . 1 . 1 131 131 ALA H H 1 8.167 0.02 . 1 . . . . A 121 ALA H . 34461 1 1302 . 1 . 1 131 131 ALA HA H 1 5.134 0.02 . 1 . . . . A 121 ALA HA . 34461 1 1303 . 1 . 1 131 131 ALA HB1 H 1 1.262 0.02 . 1 . . . . A 121 ALA HB1 . 34461 1 1304 . 1 . 1 131 131 ALA HB2 H 1 1.262 0.02 . 1 . . . . A 121 ALA HB2 . 34461 1 1305 . 1 . 1 131 131 ALA HB3 H 1 1.262 0.02 . 1 . . . . A 121 ALA HB3 . 34461 1 1306 . 1 . 1 131 131 ALA CA C 13 51.525 0.1 . 1 . . . . A 121 ALA CA . 34461 1 1307 . 1 . 1 131 131 ALA CB C 13 20.811 0.1 . 1 . . . . A 121 ALA CB . 34461 1 1308 . 1 . 1 131 131 ALA N N 15 122.689 0.1 . 1 . . . . A 121 ALA N . 34461 1 1309 . 1 . 1 132 132 PHE H H 1 8.201 0.02 . 1 . . . . A 122 PHE H . 34461 1 1310 . 1 . 1 132 132 PHE HA H 1 4.924 0.02 . 1 . . . . A 122 PHE HA . 34461 1 1311 . 1 . 1 132 132 PHE HB2 H 1 3.067 0.02 . 2 . . . . A 122 PHE HB1 . 34461 1 1312 . 1 . 1 132 132 PHE HB3 H 1 3.258 0.02 . 2 . . . . A 122 PHE HB2 . 34461 1 1313 . 1 . 1 132 132 PHE HD1 H 1 6.766 0.02 . 1 . . . . A 122 PHE HD1 . 34461 1 1314 . 1 . 1 132 132 PHE HD2 H 1 6.766 0.02 . 1 . . . . A 122 PHE HD2 . 34461 1 1315 . 1 . 1 132 132 PHE HE1 H 1 6.779 0.02 . 1 . . . . A 122 PHE HE1 . 34461 1 1316 . 1 . 1 132 132 PHE HE2 H 1 6.779 0.02 . 1 . . . . A 122 PHE HE2 . 34461 1 1317 . 1 . 1 132 132 PHE HZ H 1 6.674 0.02 . 1 . . . . A 122 PHE HZ . 34461 1 1318 . 1 . 1 132 132 PHE CA C 13 56.335 0.1 . 1 . . . . A 122 PHE CA . 34461 1 1319 . 1 . 1 132 132 PHE CB C 13 40.654 0.1 . 1 . . . . A 122 PHE CB . 34461 1 1320 . 1 . 1 132 132 PHE CD2 C 13 132.147 0.1 . 1 . . . . A 122 PHE CD2 . 34461 1 1321 . 1 . 1 132 132 PHE CE2 C 13 131.046 0.1 . 1 . . . . A 122 PHE CE2 . 34461 1 1322 . 1 . 1 132 132 PHE CZ C 13 129.487 0.1 . 1 . . . . A 122 PHE CZ . 34461 1 1323 . 1 . 1 132 132 PHE N N 15 117.901 0.1 . 1 . . . . A 122 PHE N . 34461 1 1324 . 1 . 1 133 133 GLU H H 1 8.932 0.02 . 1 . . . . A 123 GLU H . 34461 1 1325 . 1 . 1 133 133 GLU HA H 1 5.687 0.02 . 1 . . . . A 123 GLU HA . 34461 1 1326 . 1 . 1 133 133 GLU HB2 H 1 2.391 0.02 . 2 . . . . A 123 GLU HB1 . 34461 1 1327 . 1 . 1 133 133 GLU HB3 H 1 2.293 0.02 . 2 . . . . A 123 GLU HB2 . 34461 1 1328 . 1 . 1 133 133 GLU HG2 H 1 2.416 0.02 . 2 . . . . A 123 GLU HG1 . 34461 1 1329 . 1 . 1 133 133 GLU HG3 H 1 2.554 0.02 . 2 . . . . A 123 GLU HG2 . 34461 1 1330 . 1 . 1 133 133 GLU CA C 13 54.197 0.1 . 1 . . . . A 123 GLU CA . 34461 1 1331 . 1 . 1 133 133 GLU CB C 13 32.671 0.1 . 1 . . . . A 123 GLU CB . 34461 1 1332 . 1 . 1 133 133 GLU CG C 13 36.958 0.1 . 1 . . . . A 123 GLU CG . 34461 1 1333 . 1 . 1 133 133 GLU N N 15 121.169 0.1 . 1 . . . . A 123 GLU N . 34461 1 1334 . 1 . 1 134 134 HIS H H 1 9.398 0.02 . 1 . . . . A 124 HIS H . 34461 1 1335 . 1 . 1 134 134 HIS CA C 13 56.999 0.1 . 1 . . . . A 124 HIS CA . 34461 1 1336 . 1 . 1 134 134 HIS CB C 13 33.098 0.1 . 1 . . . . A 124 HIS CB . 34461 1 1337 . 1 . 1 134 134 HIS N N 15 125.076 0.1 . 1 . . . . A 124 HIS N . 34461 1 1338 . 1 . 1 135 135 GLU HA H 1 3.744 0.02 . 1 . . . . A 125 GLU HA . 34461 1 1339 . 1 . 1 135 135 GLU HB2 H 1 1.755 0.02 . 2 . . . . A 125 GLU HB1 . 34461 1 1340 . 1 . 1 135 135 GLU HB3 H 1 2.084 0.02 . 2 . . . . A 125 GLU HB2 . 34461 1 1341 . 1 . 1 135 135 GLU CA C 13 57.575 0.1 . 1 . . . . A 125 GLU CA . 34461 1 1342 . 1 . 1 135 135 GLU CB C 13 27.468 0.1 . 1 . . . . A 125 GLU CB . 34461 1 1343 . 1 . 1 135 135 GLU CG C 13 35.849 0.1 . 1 . . . . A 125 GLU CG . 34461 1 1344 . 1 . 1 136 136 ASN H H 1 9.178 0.02 . 1 . . . . A 126 ASN H . 34461 1 1345 . 1 . 1 136 136 ASN HA H 1 4.809 0.02 . 1 . . . . A 126 ASN HA . 34461 1 1346 . 1 . 1 136 136 ASN HB2 H 1 3.135 0.02 . 2 . . . . A 126 ASN HB1 . 34461 1 1347 . 1 . 1 136 136 ASN HB3 H 1 3.282 0.02 . 2 . . . . A 126 ASN HB2 . 34461 1 1348 . 1 . 1 136 136 ASN HD21 H 1 7.032 0.02 . 2 . . . . A 126 ASN HD21 . 34461 1 1349 . 1 . 1 136 136 ASN HD22 H 1 7.685 0.02 . 2 . . . . A 126 ASN HD22 . 34461 1 1350 . 1 . 1 136 136 ASN CA C 13 55.595 0.1 . 1 . . . . A 126 ASN CA . 34461 1 1351 . 1 . 1 136 136 ASN CB C 13 38.131 0.1 . 1 . . . . A 126 ASN CB . 34461 1 1352 . 1 . 1 136 136 ASN N N 15 108.482 0.1 . 1 . . . . A 126 ASN N . 34461 1 1353 . 1 . 1 136 136 ASN ND2 N 15 111.949 0.1 . 1 . . . . A 126 ASN ND2 . 34461 1 1354 . 1 . 1 137 137 LYS H H 1 8.158 0.02 . 1 . . . . A 127 LYS H . 34461 1 1355 . 1 . 1 137 137 LYS CA C 13 53.664 0.1 . 1 . . . . A 127 LYS CA . 34461 1 1356 . 1 . 1 137 137 LYS CB C 13 33.374 0.1 . 1 . . . . A 127 LYS CB . 34461 1 1357 . 1 . 1 137 137 LYS N N 15 121.541 0.1 . 1 . . . . A 127 LYS N . 34461 1 1358 . 1 . 1 138 138 PHE H H 1 7.991 0.02 . 1 . . . . A 128 PHE H . 34461 1 1359 . 1 . 1 138 138 PHE HA H 1 5.069 0.02 . 1 . . . . A 128 PHE HA . 34461 1 1360 . 1 . 1 138 138 PHE HD1 H 1 7.180 0.02 . 1 . . . . A 128 PHE HD1 . 34461 1 1361 . 1 . 1 138 138 PHE HD2 H 1 7.180 0.02 . 1 . . . . A 128 PHE HD2 . 34461 1 1362 . 1 . 1 138 138 PHE HE1 H 1 7.071 0.02 . 1 . . . . A 128 PHE HE1 . 34461 1 1363 . 1 . 1 138 138 PHE HE2 H 1 7.071 0.02 . 1 . . . . A 128 PHE HE2 . 34461 1 1364 . 1 . 1 138 138 PHE CA C 13 55.557 0.1 . 1 . . . . A 128 PHE CA . 34461 1 1365 . 1 . 1 138 138 PHE CD2 C 13 128.976 0.1 . 1 . . . . A 128 PHE CD2 . 34461 1 1366 . 1 . 1 138 138 PHE CE2 C 13 129.234 0.1 . 1 . . . . A 128 PHE CE2 . 34461 1 1367 . 1 . 1 138 138 PHE N N 15 123.215 0.1 . 1 . . . . A 128 PHE N . 34461 1 1368 . 1 . 1 139 139 TYR H H 1 8.087 0.02 . 1 . . . . A 129 TYR H . 34461 1 1369 . 1 . 1 139 139 TYR HA H 1 5.171 0.02 . 1 . . . . A 129 TYR HA . 34461 1 1370 . 1 . 1 139 139 TYR HB2 H 1 3.194 0.02 . 2 . . . . A 129 TYR HB1 . 34461 1 1371 . 1 . 1 139 139 TYR HB3 H 1 2.481 0.02 . 2 . . . . A 129 TYR HB2 . 34461 1 1372 . 1 . 1 139 139 TYR HD1 H 1 6.757 0.02 . 1 . . . . A 129 TYR HD1 . 34461 1 1373 . 1 . 1 139 139 TYR HD2 H 1 6.757 0.02 . 1 . . . . A 129 TYR HD2 . 34461 1 1374 . 1 . 1 139 139 TYR HE1 H 1 6.614 0.02 . 1 . . . . A 129 TYR HE1 . 34461 1 1375 . 1 . 1 139 139 TYR HE2 H 1 6.614 0.02 . 1 . . . . A 129 TYR HE2 . 34461 1 1376 . 1 . 1 139 139 TYR CA C 13 56.649 0.1 . 1 . . . . A 129 TYR CA . 34461 1 1377 . 1 . 1 139 139 TYR CB C 13 40.529 0.1 . 1 . . . . A 129 TYR CB . 34461 1 1378 . 1 . 1 139 139 TYR CD1 C 13 133.636 0.1 . 1 . . . . A 129 TYR CD1 . 34461 1 1379 . 1 . 1 139 139 TYR CE1 C 13 116.753 0.1 . 1 . . . . A 129 TYR CE1 . 34461 1 1380 . 1 . 1 139 139 TYR N N 15 126.029 0.1 . 1 . . . . A 129 TYR N . 34461 1 1381 . 1 . 1 140 140 ILE HA H 1 4.455 0.02 . 1 . . . . A 130 ILE HA . 34461 1 1382 . 1 . 1 140 140 ILE HB H 1 1.325 0.02 . 1 . . . . A 130 ILE HB . 34461 1 1383 . 1 . 1 140 140 ILE HG13 H 1 0.469 0.02 . 2 . . . . A 130 ILE HG12 . 34461 1 1384 . 1 . 1 140 140 ILE HG21 H 1 0.715 0.02 . 1 . . . . A 130 ILE HG21 . 34461 1 1385 . 1 . 1 140 140 ILE HG22 H 1 0.715 0.02 . 1 . . . . A 130 ILE HG22 . 34461 1 1386 . 1 . 1 140 140 ILE HG23 H 1 0.715 0.02 . 1 . . . . A 130 ILE HG23 . 34461 1 1387 . 1 . 1 140 140 ILE HD11 H 1 0.801 0.02 . 1 . . . . A 130 ILE HD11 . 34461 1 1388 . 1 . 1 140 140 ILE HD12 H 1 0.801 0.02 . 1 . . . . A 130 ILE HD12 . 34461 1 1389 . 1 . 1 140 140 ILE HD13 H 1 0.801 0.02 . 1 . . . . A 130 ILE HD13 . 34461 1 1390 . 1 . 1 140 140 ILE CA C 13 58.904 0.1 . 1 . . . . A 130 ILE CA . 34461 1 1391 . 1 . 1 140 140 ILE CB C 13 43.034 0.1 . 1 . . . . A 130 ILE CB . 34461 1 1392 . 1 . 1 140 140 ILE CG1 C 13 27.625 0.1 . 1 . . . . A 130 ILE CG1 . 34461 1 1393 . 1 . 1 140 140 ILE CG2 C 13 17.487 0.1 . 1 . . . . A 130 ILE CG2 . 34461 1 1394 . 1 . 1 140 140 ILE CD1 C 13 15.464 0.1 . 1 . . . . A 130 ILE CD1 . 34461 1 1395 . 1 . 1 141 141 ASN H H 1 8.866 0.02 . 1 . . . . A 131 ASN H . 34461 1 1396 . 1 . 1 141 141 ASN HA H 1 6.273 0.02 . 1 . . . . A 131 ASN HA . 34461 1 1397 . 1 . 1 141 141 ASN HB2 H 1 2.659 0.02 . 2 . . . . A 131 ASN HB1 . 34461 1 1398 . 1 . 1 141 141 ASN HB3 H 1 3.009 0.02 . 2 . . . . A 131 ASN HB2 . 34461 1 1399 . 1 . 1 141 141 ASN CA C 13 48.672 0.1 . 1 . . . . A 131 ASN CA . 34461 1 1400 . 1 . 1 141 141 ASN CB C 13 41.236 0.1 . 1 . . . . A 131 ASN CB . 34461 1 1401 . 1 . 1 141 141 ASN N N 15 126.013 0.1 . 1 . . . . A 131 ASN N . 34461 1 1402 . 1 . 1 142 142 PRO HA H 1 4.553 0.02 . 1 . . . . A 132 PRO HA . 34461 1 1403 . 1 . 1 143 143 GLY H H 1 8.674 0.02 . 1 . . . . A 133 GLY H . 34461 1 1404 . 1 . 1 143 143 GLY HA2 H 1 3.163 0.02 . 2 . . . . A 133 GLY HA1 . 34461 1 1405 . 1 . 1 143 143 GLY HA3 H 1 4.077 0.02 . 2 . . . . A 133 GLY HA2 . 34461 1 1406 . 1 . 1 143 143 GLY CA C 13 44.342 0.1 . 1 . . . . A 133 GLY CA . 34461 1 1407 . 1 . 1 143 143 GLY N N 15 107.243 0.1 . 1 . . . . A 133 GLY N . 34461 1 1408 . 1 . 1 144 144 SER H H 1 10.173 0.02 . 1 . . . . A 134 SER H . 34461 1 1409 . 1 . 1 144 144 SER HA H 1 5.407 0.02 . 1 . . . . A 134 SER HA . 34461 1 1410 . 1 . 1 144 144 SER HB2 H 1 3.170 0.02 . 2 . . . . A 134 SER HB1 . 34461 1 1411 . 1 . 1 144 144 SER HB3 H 1 3.670 0.02 . 2 . . . . A 134 SER HB2 . 34461 1 1412 . 1 . 1 144 144 SER CA C 13 55.583 0.1 . 1 . . . . A 134 SER CA . 34461 1 1413 . 1 . 1 144 144 SER CB C 13 63.684 0.1 . 1 . . . . A 134 SER CB . 34461 1 1414 . 1 . 1 144 144 SER N N 15 118.056 0.1 . 1 . . . . A 134 SER N . 34461 1 1415 . 1 . 1 145 145 ALA H H 1 8.013 0.02 . 1 . . . . A 135 ALA H . 34461 1 1416 . 1 . 1 145 145 ALA HA H 1 5.185 0.02 . 1 . . . . A 135 ALA HA . 34461 1 1417 . 1 . 1 145 145 ALA HB1 H 1 1.600 0.02 . 1 . . . . A 135 ALA HB1 . 34461 1 1418 . 1 . 1 145 145 ALA HB2 H 1 1.600 0.02 . 1 . . . . A 135 ALA HB2 . 34461 1 1419 . 1 . 1 145 145 ALA HB3 H 1 1.600 0.02 . 1 . . . . A 135 ALA HB3 . 34461 1 1420 . 1 . 1 145 145 ALA CA C 13 54.906 0.1 . 1 . . . . A 135 ALA CA . 34461 1 1421 . 1 . 1 145 145 ALA CB C 13 19.251 0.1 . 1 . . . . A 135 ALA CB . 34461 1 1422 . 1 . 1 145 145 ALA N N 15 133.414 0.1 . 1 . . . . A 135 ALA N . 34461 1 1423 . 1 . 1 146 146 THR H H 1 7.550 0.02 . 1 . . . . A 136 THR H . 34461 1 1424 . 1 . 1 146 146 THR HA H 1 4.751 0.02 . 1 . . . . A 136 THR HA . 34461 1 1425 . 1 . 1 146 146 THR HB H 1 4.371 0.02 . 1 . . . . A 136 THR HB . 34461 1 1426 . 1 . 1 146 146 THR HG21 H 1 1.170 0.02 . 1 . . . . A 136 THR HG21 . 34461 1 1427 . 1 . 1 146 146 THR HG22 H 1 1.170 0.02 . 1 . . . . A 136 THR HG22 . 34461 1 1428 . 1 . 1 146 146 THR HG23 H 1 1.170 0.02 . 1 . . . . A 136 THR HG23 . 34461 1 1429 . 1 . 1 146 146 THR CA C 13 59.584 0.1 . 1 . . . . A 136 THR CA . 34461 1 1430 . 1 . 1 146 146 THR CB C 13 69.746 0.1 . 1 . . . . A 136 THR CB . 34461 1 1431 . 1 . 1 146 146 THR CG2 C 13 23.698 0.1 . 1 . . . . A 136 THR CG2 . 34461 1 1432 . 1 . 1 146 146 THR N N 15 97.590 0.1 . 1 . . . . A 136 THR N . 34461 1 1433 . 1 . 1 147 147 GLY H H 1 7.883 0.02 . 1 . . . . A 137 GLY H . 34461 1 1434 . 1 . 1 147 147 GLY HA2 H 1 3.961 0.02 . 2 . . . . A 137 GLY HA1 . 34461 1 1435 . 1 . 1 147 147 GLY HA3 H 1 3.399 0.02 . 2 . . . . A 137 GLY HA2 . 34461 1 1436 . 1 . 1 147 147 GLY CA C 13 46.652 0.1 . 1 . . . . A 137 GLY CA . 34461 1 1437 . 1 . 1 147 147 GLY N N 15 110.228 0.1 . 1 . . . . A 137 GLY N . 34461 1 1438 . 1 . 1 148 148 ALA H H 1 7.783 0.02 . 1 . . . . A 138 ALA H . 34461 1 1439 . 1 . 1 148 148 ALA HA H 1 4.047 0.02 . 1 . . . . A 138 ALA HA . 34461 1 1440 . 1 . 1 148 148 ALA HB1 H 1 1.072 0.02 . 1 . . . . A 138 ALA HB1 . 34461 1 1441 . 1 . 1 148 148 ALA HB2 H 1 1.072 0.02 . 1 . . . . A 138 ALA HB2 . 34461 1 1442 . 1 . 1 148 148 ALA HB3 H 1 1.072 0.02 . 1 . . . . A 138 ALA HB3 . 34461 1 1443 . 1 . 1 148 148 ALA CA C 13 52.344 0.1 . 1 . . . . A 138 ALA CA . 34461 1 1444 . 1 . 1 148 148 ALA CB C 13 19.813 0.1 . 1 . . . . A 138 ALA CB . 34461 1 1445 . 1 . 1 148 148 ALA N N 15 122.860 0.1 . 1 . . . . A 138 ALA N . 34461 1 1446 . 1 . 1 149 149 TYR H H 1 7.271 0.02 . 1 . . . . A 139 TYR H . 34461 1 1447 . 1 . 1 149 149 TYR HA H 1 4.531 0.02 . 1 . . . . A 139 TYR HA . 34461 1 1448 . 1 . 1 149 149 TYR HB2 H 1 3.227 0.02 . 2 . . . . A 139 TYR HB1 . 34461 1 1449 . 1 . 1 149 149 TYR HB3 H 1 3.069 0.02 . 2 . . . . A 139 TYR HB2 . 34461 1 1450 . 1 . 1 149 149 TYR HD1 H 1 7.110 0.02 . 1 . . . . A 139 TYR HD1 . 34461 1 1451 . 1 . 1 149 149 TYR HD2 H 1 7.110 0.02 . 1 . . . . A 139 TYR HD2 . 34461 1 1452 . 1 . 1 149 149 TYR HE1 H 1 6.757 0.02 . 1 . . . . A 139 TYR HE1 . 34461 1 1453 . 1 . 1 149 149 TYR HE2 H 1 6.757 0.02 . 1 . . . . A 139 TYR HE2 . 34461 1 1454 . 1 . 1 149 149 TYR CA C 13 57.079 0.1 . 1 . . . . A 139 TYR CA . 34461 1 1455 . 1 . 1 149 149 TYR CB C 13 38.054 0.1 . 1 . . . . A 139 TYR CB . 34461 1 1456 . 1 . 1 149 149 TYR CD1 C 13 134.104 0.1 . 1 . . . . A 139 TYR CD1 . 34461 1 1457 . 1 . 1 149 149 TYR CE1 C 13 117.544 0.1 . 1 . . . . A 139 TYR CE1 . 34461 1 1458 . 1 . 1 149 149 TYR N N 15 117.929 0.1 . 1 . . . . A 139 TYR N . 34461 1 1459 . 1 . 1 150 150 ASN H H 1 8.174 0.02 . 1 . . . . A 140 ASN H . 34461 1 1460 . 1 . 1 150 150 ASN HA H 1 4.250 0.02 . 1 . . . . A 140 ASN HA . 34461 1 1461 . 1 . 1 150 150 ASN HB2 H 1 1.709 0.02 . 2 . . . . A 140 ASN HB1 . 34461 1 1462 . 1 . 1 150 150 ASN HB3 H 1 2.683 0.02 . 2 . . . . A 140 ASN HB2 . 34461 1 1463 . 1 . 1 150 150 ASN HD21 H 1 6.645 0.02 . 2 . . . . A 140 ASN HD21 . 34461 1 1464 . 1 . 1 150 150 ASN HD22 H 1 6.002 0.02 . 2 . . . . A 140 ASN HD22 . 34461 1 1465 . 1 . 1 150 150 ASN CA C 13 51.342 0.1 . 1 . . . . A 140 ASN CA . 34461 1 1466 . 1 . 1 150 150 ASN CB C 13 39.003 0.1 . 1 . . . . A 140 ASN CB . 34461 1 1467 . 1 . 1 150 150 ASN N N 15 117.065 0.1 . 1 . . . . A 140 ASN N . 34461 1 1468 . 1 . 1 150 150 ASN ND2 N 15 109.956 0.1 . 1 . . . . A 140 ASN ND2 . 34461 1 1469 . 1 . 1 151 151 ALA H H 1 8.101 0.02 . 1 . . . . A 141 ALA H . 34461 1 1470 . 1 . 1 151 151 ALA HA H 1 4.168 0.02 . 1 . . . . A 141 ALA HA . 34461 1 1471 . 1 . 1 151 151 ALA HB1 H 1 1.486 0.02 . 1 . . . . A 141 ALA HB1 . 34461 1 1472 . 1 . 1 151 151 ALA HB2 H 1 1.486 0.02 . 1 . . . . A 141 ALA HB2 . 34461 1 1473 . 1 . 1 151 151 ALA HB3 H 1 1.486 0.02 . 1 . . . . A 141 ALA HB3 . 34461 1 1474 . 1 . 1 151 151 ALA CA C 13 54.341 0.1 . 1 . . . . A 141 ALA CA . 34461 1 1475 . 1 . 1 151 151 ALA CB C 13 18.667 0.1 . 1 . . . . A 141 ALA CB . 34461 1 1476 . 1 . 1 151 151 ALA N N 15 118.730 0.1 . 1 . . . . A 141 ALA N . 34461 1 1477 . 1 . 1 152 152 LEU H H 1 7.832 0.02 . 1 . . . . A 142 LEU H . 34461 1 1478 . 1 . 1 152 152 LEU HA H 1 4.464 0.02 . 1 . . . . A 142 LEU HA . 34461 1 1479 . 1 . 1 152 152 LEU HB2 H 1 1.639 0.02 . 2 . . . . A 142 LEU HB1 . 34461 1 1480 . 1 . 1 152 152 LEU HB3 H 1 1.728 0.02 . 2 . . . . A 142 LEU HB2 . 34461 1 1481 . 1 . 1 152 152 LEU HD11 H 1 0.867 0.02 . 2 . . . . A 142 LEU HD11 . 34461 1 1482 . 1 . 1 152 152 LEU HD12 H 1 0.867 0.02 . 2 . . . . A 142 LEU HD12 . 34461 1 1483 . 1 . 1 152 152 LEU HD13 H 1 0.867 0.02 . 2 . . . . A 142 LEU HD13 . 34461 1 1484 . 1 . 1 152 152 LEU HD21 H 1 0.953 0.02 . 2 . . . . A 142 LEU HD21 . 34461 1 1485 . 1 . 1 152 152 LEU HD22 H 1 0.953 0.02 . 2 . . . . A 142 LEU HD22 . 34461 1 1486 . 1 . 1 152 152 LEU HD23 H 1 0.953 0.02 . 2 . . . . A 142 LEU HD23 . 34461 1 1487 . 1 . 1 152 152 LEU CA C 13 55.454 0.1 . 1 . . . . A 142 LEU CA . 34461 1 1488 . 1 . 1 152 152 LEU CB C 13 44.026 0.1 . 1 . . . . A 142 LEU CB . 34461 1 1489 . 1 . 1 152 152 LEU CG C 13 27.099 0.1 . 1 . . . . A 142 LEU CG . 34461 1 1490 . 1 . 1 152 152 LEU CD1 C 13 23.089 0.1 . 2 . . . . A 142 LEU CD1 . 34461 1 1491 . 1 . 1 152 152 LEU CD2 C 13 25.030 0.1 . 2 . . . . A 142 LEU CD2 . 34461 1 1492 . 1 . 1 152 152 LEU N N 15 116.317 0.1 . 1 . . . . A 142 LEU N . 34461 1 1493 . 1 . 1 153 153 GLU H H 1 8.276 0.02 . 1 . . . . A 143 GLU H . 34461 1 1494 . 1 . 1 153 153 GLU HA H 1 4.631 0.02 . 1 . . . . A 143 GLU HA . 34461 1 1495 . 1 . 1 153 153 GLU HB3 H 1 1.998 0.02 . 2 . . . . A 143 GLU HB2 . 34461 1 1496 . 1 . 1 153 153 GLU HG2 H 1 2.273 0.02 . 2 . . . . A 143 GLU HG1 . 34461 1 1497 . 1 . 1 153 153 GLU HG3 H 1 2.168 0.02 . 2 . . . . A 143 GLU HG2 . 34461 1 1498 . 1 . 1 153 153 GLU CA C 13 55.882 0.1 . 1 . . . . A 143 GLU CA . 34461 1 1499 . 1 . 1 153 153 GLU CB C 13 32.731 0.1 . 1 . . . . A 143 GLU CB . 34461 1 1500 . 1 . 1 153 153 GLU CG C 13 36.172 0.1 . 1 . . . . A 143 GLU CG . 34461 1 1501 . 1 . 1 153 153 GLU N N 15 119.793 0.1 . 1 . . . . A 143 GLU N . 34461 1 1502 . 1 . 1 154 154 THR H H 1 8.145 0.02 . 1 . . . . A 144 THR H . 34461 1 1503 . 1 . 1 154 154 THR HA H 1 4.569 0.02 . 1 . . . . A 144 THR HA . 34461 1 1504 . 1 . 1 154 154 THR HB H 1 4.310 0.02 . 1 . . . . A 144 THR HB . 34461 1 1505 . 1 . 1 154 154 THR HG21 H 1 1.143 0.02 . 1 . . . . A 144 THR HG21 . 34461 1 1506 . 1 . 1 154 154 THR HG22 H 1 1.143 0.02 . 1 . . . . A 144 THR HG22 . 34461 1 1507 . 1 . 1 154 154 THR HG23 H 1 1.143 0.02 . 1 . . . . A 144 THR HG23 . 34461 1 1508 . 1 . 1 154 154 THR CA C 13 61.293 0.1 . 1 . . . . A 144 THR CA . 34461 1 1509 . 1 . 1 154 154 THR CB C 13 69.941 0.1 . 1 . . . . A 144 THR CB . 34461 1 1510 . 1 . 1 154 154 THR CG2 C 13 21.494 0.1 . 1 . . . . A 144 THR CG2 . 34461 1 1511 . 1 . 1 154 154 THR N N 15 111.291 0.1 . 1 . . . . A 144 THR N . 34461 1 1512 . 1 . 1 155 155 ASN H H 1 8.878 0.02 . 1 . . . . A 145 ASN H . 34461 1 1513 . 1 . 1 155 155 ASN HA H 1 4.918 0.02 . 1 . . . . A 145 ASN HA . 34461 1 1514 . 1 . 1 155 155 ASN HB2 H 1 2.809 0.02 . 2 . . . . A 145 ASN HB1 . 34461 1 1515 . 1 . 1 155 155 ASN HB3 H 1 2.906 0.02 . 2 . . . . A 145 ASN HB2 . 34461 1 1516 . 1 . 1 155 155 ASN HD21 H 1 6.895 0.02 . 2 . . . . A 145 ASN HD21 . 34461 1 1517 . 1 . 1 155 155 ASN HD22 H 1 7.693 0.02 . 2 . . . . A 145 ASN HD22 . 34461 1 1518 . 1 . 1 155 155 ASN CA C 13 53.118 0.1 . 1 . . . . A 145 ASN CA . 34461 1 1519 . 1 . 1 155 155 ASN CB C 13 37.565 0.1 . 1 . . . . A 145 ASN CB . 34461 1 1520 . 1 . 1 155 155 ASN N N 15 123.336 0.1 . 1 . . . . A 145 ASN N . 34461 1 1521 . 1 . 1 155 155 ASN ND2 N 15 112.950 0.1 . 1 . . . . A 145 ASN ND2 . 34461 1 1522 . 1 . 1 156 156 ILE H H 1 7.976 0.02 . 1 . . . . A 146 ILE H . 34461 1 1523 . 1 . 1 156 156 ILE HA H 1 4.268 0.02 . 1 . . . . A 146 ILE HA . 34461 1 1524 . 1 . 1 156 156 ILE HB H 1 1.758 0.02 . 1 . . . . A 146 ILE HB . 34461 1 1525 . 1 . 1 156 156 ILE HG21 H 1 1.146 0.02 . 1 . . . . A 146 ILE HG21 . 34461 1 1526 . 1 . 1 156 156 ILE HG22 H 1 1.146 0.02 . 1 . . . . A 146 ILE HG22 . 34461 1 1527 . 1 . 1 156 156 ILE HG23 H 1 1.146 0.02 . 1 . . . . A 146 ILE HG23 . 34461 1 1528 . 1 . 1 156 156 ILE HD11 H 1 0.847 0.02 . 1 . . . . A 146 ILE HD11 . 34461 1 1529 . 1 . 1 156 156 ILE HD12 H 1 0.847 0.02 . 1 . . . . A 146 ILE HD12 . 34461 1 1530 . 1 . 1 156 156 ILE HD13 H 1 0.847 0.02 . 1 . . . . A 146 ILE HD13 . 34461 1 1531 . 1 . 1 156 156 ILE CA C 13 58.382 0.1 . 1 . . . . A 146 ILE CA . 34461 1 1532 . 1 . 1 156 156 ILE CB C 13 38.354 0.1 . 1 . . . . A 146 ILE CB . 34461 1 1533 . 1 . 1 156 156 ILE CG1 C 13 26.450 0.1 . 1 . . . . A 146 ILE CG1 . 34461 1 1534 . 1 . 1 156 156 ILE CG2 C 13 18.751 0.1 . 1 . . . . A 146 ILE CG2 . 34461 1 1535 . 1 . 1 156 156 ILE CD1 C 13 10.161 0.1 . 1 . . . . A 146 ILE CD1 . 34461 1 1536 . 1 . 1 156 156 ILE N N 15 123.901 0.1 . 1 . . . . A 146 ILE N . 34461 1 1537 . 1 . 1 157 157 ILE H H 1 8.774 0.02 . 1 . . . . A 147 ILE H . 34461 1 1538 . 1 . 1 157 157 ILE HA H 1 4.575 0.02 . 1 . . . . A 147 ILE HA . 34461 1 1539 . 1 . 1 157 157 ILE HB H 1 1.982 0.02 . 1 . . . . A 147 ILE HB . 34461 1 1540 . 1 . 1 157 157 ILE HG21 H 1 1.049 0.02 . 1 . . . . A 147 ILE HG21 . 34461 1 1541 . 1 . 1 157 157 ILE HG22 H 1 1.049 0.02 . 1 . . . . A 147 ILE HG22 . 34461 1 1542 . 1 . 1 157 157 ILE HG23 H 1 1.049 0.02 . 1 . . . . A 147 ILE HG23 . 34461 1 1543 . 1 . 1 157 157 ILE HD11 H 1 0.964 0.02 . 1 . . . . A 147 ILE HD11 . 34461 1 1544 . 1 . 1 157 157 ILE HD12 H 1 0.964 0.02 . 1 . . . . A 147 ILE HD12 . 34461 1 1545 . 1 . 1 157 157 ILE HD13 H 1 0.964 0.02 . 1 . . . . A 147 ILE HD13 . 34461 1 1546 . 1 . 1 157 157 ILE CA C 13 58.318 0.1 . 1 . . . . A 147 ILE CA . 34461 1 1547 . 1 . 1 157 157 ILE CB C 13 40.081 0.1 . 1 . . . . A 147 ILE CB . 34461 1 1548 . 1 . 1 157 157 ILE CG1 C 13 27.685 0.1 . 1 . . . . A 147 ILE CG1 . 34461 1 1549 . 1 . 1 157 157 ILE CG2 C 13 17.321 0.1 . 1 . . . . A 147 ILE CG2 . 34461 1 1550 . 1 . 1 157 157 ILE CD1 C 13 12.839 0.1 . 1 . . . . A 147 ILE CD1 . 34461 1 1551 . 1 . 1 157 157 ILE N N 15 130.363 0.1 . 1 . . . . A 147 ILE N . 34461 1 1552 . 1 . 1 158 158 PRO HA H 1 4.470 0.02 . 1 . . . . A 148 PRO HA . 34461 1 1553 . 1 . 1 158 158 PRO HB3 H 1 1.867 0.02 . 2 . . . . A 148 PRO HB2 . 34461 1 1554 . 1 . 1 158 158 PRO HG3 H 1 2.030 0.02 . 2 . . . . A 148 PRO HG2 . 34461 1 1555 . 1 . 1 158 158 PRO HD3 H 1 3.672 0.02 . 2 . . . . A 148 PRO HD2 . 34461 1 1556 . 1 . 1 158 158 PRO CA C 13 63.079 0.1 . 1 . . . . A 148 PRO CA . 34461 1 1557 . 1 . 1 158 158 PRO CB C 13 32.037 0.1 . 1 . . . . A 148 PRO CB . 34461 1 1558 . 1 . 1 158 158 PRO CG C 13 27.399 0.1 . 1 . . . . A 148 PRO CG . 34461 1 1559 . 1 . 1 158 158 PRO CD C 13 50.606 0.1 . 1 . . . . A 148 PRO CD . 34461 1 1560 . 1 . 1 159 159 SER H H 1 8.544 0.02 . 1 . . . . A 149 SER H . 34461 1 1561 . 1 . 1 159 159 SER HA H 1 6.053 0.02 . 1 . . . . A 149 SER HA . 34461 1 1562 . 1 . 1 159 159 SER HB2 H 1 3.804 0.02 . 2 . . . . A 149 SER HB1 . 34461 1 1563 . 1 . 1 159 159 SER HB3 H 1 3.935 0.02 . 2 . . . . A 149 SER HB2 . 34461 1 1564 . 1 . 1 159 159 SER CA C 13 57.651 0.1 . 1 . . . . A 149 SER CA . 34461 1 1565 . 1 . 1 159 159 SER CB C 13 67.629 0.1 . 1 . . . . A 149 SER CB . 34461 1 1566 . 1 . 1 159 159 SER N N 15 117.227 0.1 . 1 . . . . A 149 SER N . 34461 1 1567 . 1 . 1 160 160 PHE H H 1 8.454 0.02 . 1 . . . . A 150 PHE H . 34461 1 1568 . 1 . 1 160 160 PHE HA H 1 5.055 0.02 . 1 . . . . A 150 PHE HA . 34461 1 1569 . 1 . 1 160 160 PHE HB2 H 1 3.066 0.02 . 2 . . . . A 150 PHE HB1 . 34461 1 1570 . 1 . 1 160 160 PHE HB3 H 1 3.446 0.02 . 2 . . . . A 150 PHE HB2 . 34461 1 1571 . 1 . 1 160 160 PHE HD1 H 1 6.426 0.02 . 1 . . . . A 150 PHE HD1 . 34461 1 1572 . 1 . 1 160 160 PHE HD2 H 1 6.426 0.02 . 1 . . . . A 150 PHE HD2 . 34461 1 1573 . 1 . 1 160 160 PHE HE1 H 1 5.699 0.02 . 1 . . . . A 150 PHE HE1 . 34461 1 1574 . 1 . 1 160 160 PHE HE2 H 1 5.699 0.02 . 1 . . . . A 150 PHE HE2 . 34461 1 1575 . 1 . 1 160 160 PHE HZ H 1 5.762 0.02 . 1 . . . . A 150 PHE HZ . 34461 1 1576 . 1 . 1 160 160 PHE CA C 13 57.662 0.1 . 1 . . . . A 150 PHE CA . 34461 1 1577 . 1 . 1 160 160 PHE CB C 13 40.039 0.1 . 1 . . . . A 150 PHE CB . 34461 1 1578 . 1 . 1 160 160 PHE CD2 C 13 131.943 0.1 . 1 . . . . A 150 PHE CD2 . 34461 1 1579 . 1 . 1 160 160 PHE CE2 C 13 129.871 0.1 . 1 . . . . A 150 PHE CE2 . 34461 1 1580 . 1 . 1 160 160 PHE CZ C 13 128.202 0.1 . 1 . . . . A 150 PHE CZ . 34461 1 1581 . 1 . 1 160 160 PHE N N 15 113.489 0.1 . 1 . . . . A 150 PHE N . 34461 1 1582 . 1 . 1 161 161 VAL H H 1 8.968 0.02 . 1 . . . . A 151 VAL H . 34461 1 1583 . 1 . 1 161 161 VAL HA H 1 5.440 0.02 . 1 . . . . A 151 VAL HA . 34461 1 1584 . 1 . 1 161 161 VAL HB H 1 2.022 0.02 . 1 . . . . A 151 VAL HB . 34461 1 1585 . 1 . 1 161 161 VAL HG11 H 1 1.036 0.02 . 2 . . . . A 151 VAL HG11 . 34461 1 1586 . 1 . 1 161 161 VAL HG12 H 1 1.036 0.02 . 2 . . . . A 151 VAL HG12 . 34461 1 1587 . 1 . 1 161 161 VAL HG13 H 1 1.036 0.02 . 2 . . . . A 151 VAL HG13 . 34461 1 1588 . 1 . 1 161 161 VAL HG21 H 1 1.041 0.02 . 2 . . . . A 151 VAL HG21 . 34461 1 1589 . 1 . 1 161 161 VAL HG22 H 1 1.041 0.02 . 2 . . . . A 151 VAL HG22 . 34461 1 1590 . 1 . 1 161 161 VAL HG23 H 1 1.041 0.02 . 2 . . . . A 151 VAL HG23 . 34461 1 1591 . 1 . 1 161 161 VAL CA C 13 59.813 0.1 . 1 . . . . A 151 VAL CA . 34461 1 1592 . 1 . 1 161 161 VAL CB C 13 37.295 0.1 . 1 . . . . A 151 VAL CB . 34461 1 1593 . 1 . 1 161 161 VAL CG1 C 13 22.662 0.1 . 2 . . . . A 151 VAL CG1 . 34461 1 1594 . 1 . 1 161 161 VAL CG2 C 13 22.676 0.1 . 2 . . . . A 151 VAL CG2 . 34461 1 1595 . 1 . 1 161 161 VAL N N 15 118.371 0.1 . 1 . . . . A 151 VAL N . 34461 1 1596 . 1 . 1 162 162 LEU H H 1 9.797 0.02 . 1 . . . . A 152 LEU H . 34461 1 1597 . 1 . 1 162 162 LEU HA H 1 5.654 0.02 . 1 . . . . A 152 LEU HA . 34461 1 1598 . 1 . 1 162 162 LEU HB2 H 1 1.695 0.02 . 2 . . . . A 152 LEU HB1 . 34461 1 1599 . 1 . 1 162 162 LEU HB3 H 1 2.243 0.02 . 2 . . . . A 152 LEU HB2 . 34461 1 1600 . 1 . 1 162 162 LEU HG H 1 1.762 0.02 . 1 . . . . A 152 LEU HG . 34461 1 1601 . 1 . 1 162 162 LEU HD11 H 1 1.014 0.02 . 2 . . . . A 152 LEU HD11 . 34461 1 1602 . 1 . 1 162 162 LEU HD12 H 1 1.014 0.02 . 2 . . . . A 152 LEU HD12 . 34461 1 1603 . 1 . 1 162 162 LEU HD13 H 1 1.014 0.02 . 2 . . . . A 152 LEU HD13 . 34461 1 1604 . 1 . 1 162 162 LEU HD21 H 1 1.022 0.02 . 2 . . . . A 152 LEU HD21 . 34461 1 1605 . 1 . 1 162 162 LEU HD22 H 1 1.022 0.02 . 2 . . . . A 152 LEU HD22 . 34461 1 1606 . 1 . 1 162 162 LEU HD23 H 1 1.022 0.02 . 2 . . . . A 152 LEU HD23 . 34461 1 1607 . 1 . 1 162 162 LEU CA C 13 53.129 0.1 . 1 . . . . A 152 LEU CA . 34461 1 1608 . 1 . 1 162 162 LEU CB C 13 48.058 0.1 . 1 . . . . A 152 LEU CB . 34461 1 1609 . 1 . 1 162 162 LEU CG C 13 27.595 0.1 . 1 . . . . A 152 LEU CG . 34461 1 1610 . 1 . 1 162 162 LEU CD1 C 13 25.456 0.1 . 2 . . . . A 152 LEU CD1 . 34461 1 1611 . 1 . 1 162 162 LEU CD2 C 13 26.674 0.1 . 2 . . . . A 152 LEU CD2 . 34461 1 1612 . 1 . 1 162 162 LEU N N 15 127.565 0.1 . 1 . . . . A 152 LEU N . 34461 1 1613 . 1 . 1 163 163 MET H H 1 9.928 0.02 . 1 . . . . A 153 MET H . 34461 1 1614 . 1 . 1 163 163 MET HA H 1 5.132 0.02 . 1 . . . . A 153 MET HA . 34461 1 1615 . 1 . 1 163 163 MET HB2 H 1 2.424 0.02 . 2 . . . . A 153 MET HB1 . 34461 1 1616 . 1 . 1 163 163 MET HB3 H 1 1.730 0.02 . 2 . . . . A 153 MET HB2 . 34461 1 1617 . 1 . 1 163 163 MET CA C 13 55.435 0.1 . 1 . . . . A 153 MET CA . 34461 1 1618 . 1 . 1 163 163 MET CB C 13 31.494 0.1 . 1 . . . . A 153 MET CB . 34461 1 1619 . 1 . 1 163 163 MET N N 15 123.883 0.1 . 1 . . . . A 153 MET N . 34461 1 1620 . 1 . 1 164 164 ASP H H 1 9.593 0.02 . 1 . . . . A 154 ASP H . 34461 1 1621 . 1 . 1 164 164 ASP HA H 1 5.293 0.02 . 1 . . . . A 154 ASP HA . 34461 1 1622 . 1 . 1 164 164 ASP HB2 H 1 2.289 0.02 . 2 . . . . A 154 ASP HB1 . 34461 1 1623 . 1 . 1 164 164 ASP HB3 H 1 2.410 0.02 . 2 . . . . A 154 ASP HB2 . 34461 1 1624 . 1 . 1 164 164 ASP CA C 13 52.999 0.1 . 1 . . . . A 154 ASP CA . 34461 1 1625 . 1 . 1 164 164 ASP CB C 13 42.667 0.1 . 1 . . . . A 154 ASP CB . 34461 1 1626 . 1 . 1 164 164 ASP N N 15 125.721 0.1 . 1 . . . . A 154 ASP N . 34461 1 1627 . 1 . 1 165 165 ILE H H 1 9.035 0.02 . 1 . . . . A 155 ILE H . 34461 1 1628 . 1 . 1 165 165 ILE HA H 1 4.337 0.02 . 1 . . . . A 155 ILE HA . 34461 1 1629 . 1 . 1 165 165 ILE HB H 1 1.986 0.02 . 1 . . . . A 155 ILE HB . 34461 1 1630 . 1 . 1 165 165 ILE HG13 H 1 1.585 0.02 . 2 . . . . A 155 ILE HG12 . 34461 1 1631 . 1 . 1 165 165 ILE HG21 H 1 1.055 0.02 . 1 . . . . A 155 ILE HG21 . 34461 1 1632 . 1 . 1 165 165 ILE HG22 H 1 1.055 0.02 . 1 . . . . A 155 ILE HG22 . 34461 1 1633 . 1 . 1 165 165 ILE HG23 H 1 1.055 0.02 . 1 . . . . A 155 ILE HG23 . 34461 1 1634 . 1 . 1 165 165 ILE HD11 H 1 0.654 0.02 . 1 . . . . A 155 ILE HD11 . 34461 1 1635 . 1 . 1 165 165 ILE HD12 H 1 0.654 0.02 . 1 . . . . A 155 ILE HD12 . 34461 1 1636 . 1 . 1 165 165 ILE HD13 H 1 0.654 0.02 . 1 . . . . A 155 ILE HD13 . 34461 1 1637 . 1 . 1 165 165 ILE CA C 13 62.643 0.1 . 1 . . . . A 155 ILE CA . 34461 1 1638 . 1 . 1 165 165 ILE CB C 13 38.603 0.1 . 1 . . . . A 155 ILE CB . 34461 1 1639 . 1 . 1 165 165 ILE CG1 C 13 27.936 0.1 . 1 . . . . A 155 ILE CG1 . 34461 1 1640 . 1 . 1 165 165 ILE CG2 C 13 17.932 0.1 . 1 . . . . A 155 ILE CG2 . 34461 1 1641 . 1 . 1 165 165 ILE CD1 C 13 12.936 0.1 . 1 . . . . A 155 ILE CD1 . 34461 1 1642 . 1 . 1 165 165 ILE N N 15 126.726 0.1 . 1 . . . . A 155 ILE N . 34461 1 1643 . 1 . 1 166 166 GLN H H 1 8.727 0.02 . 1 . . . . A 156 GLN H . 34461 1 1644 . 1 . 1 166 166 GLN HA H 1 4.766 0.02 . 1 . . . . A 156 GLN HA . 34461 1 1645 . 1 . 1 166 166 GLN HB2 H 1 1.961 0.02 . 2 . . . . A 156 GLN HB1 . 34461 1 1646 . 1 . 1 166 166 GLN HB3 H 1 2.149 0.02 . 2 . . . . A 156 GLN HB2 . 34461 1 1647 . 1 . 1 166 166 GLN HG3 H 1 2.248 0.02 . 2 . . . . A 156 GLN HG2 . 34461 1 1648 . 1 . 1 166 166 GLN CA C 13 55.116 0.1 . 1 . . . . A 156 GLN CA . 34461 1 1649 . 1 . 1 166 166 GLN CB C 13 30.741 0.1 . 1 . . . . A 156 GLN CB . 34461 1 1650 . 1 . 1 166 166 GLN CG C 13 36.290 0.1 . 1 . . . . A 156 GLN CG . 34461 1 1651 . 1 . 1 166 166 GLN N N 15 128.130 0.1 . 1 . . . . A 156 GLN N . 34461 1 1652 . 1 . 1 167 167 ALA H H 1 9.016 0.02 . 1 . . . . A 157 ALA H . 34461 1 1653 . 1 . 1 167 167 ALA HA H 1 3.992 0.02 . 1 . . . . A 157 ALA HA . 34461 1 1654 . 1 . 1 167 167 ALA HB1 H 1 1.616 0.02 . 1 . . . . A 157 ALA HB1 . 34461 1 1655 . 1 . 1 167 167 ALA HB2 H 1 1.616 0.02 . 1 . . . . A 157 ALA HB2 . 34461 1 1656 . 1 . 1 167 167 ALA HB3 H 1 1.616 0.02 . 1 . . . . A 157 ALA HB3 . 34461 1 1657 . 1 . 1 167 167 ALA CA C 13 54.779 0.1 . 1 . . . . A 157 ALA CA . 34461 1 1658 . 1 . 1 167 167 ALA CB C 13 17.131 0.1 . 1 . . . . A 157 ALA CB . 34461 1 1659 . 1 . 1 167 167 ALA N N 15 127.702 0.1 . 1 . . . . A 157 ALA N . 34461 1 1660 . 1 . 1 168 168 SER H H 1 8.029 0.02 . 1 . . . . A 158 SER H . 34461 1 1661 . 1 . 1 168 168 SER HA H 1 4.508 0.02 . 1 . . . . A 158 SER HA . 34461 1 1662 . 1 . 1 168 168 SER HB2 H 1 3.958 0.02 . 2 . . . . A 158 SER HB1 . 34461 1 1663 . 1 . 1 168 168 SER HB3 H 1 4.095 0.02 . 2 . . . . A 158 SER HB2 . 34461 1 1664 . 1 . 1 168 168 SER CA C 13 58.418 0.1 . 1 . . . . A 158 SER CA . 34461 1 1665 . 1 . 1 168 168 SER CB C 13 63.715 0.1 . 1 . . . . A 158 SER CB . 34461 1 1666 . 1 . 1 168 168 SER N N 15 114.366 0.1 . 1 . . . . A 158 SER N . 34461 1 1667 . 1 . 1 169 169 THR H H 1 8.295 0.02 . 1 . . . . A 159 THR H . 34461 1 1668 . 1 . 1 169 169 THR HA H 1 4.971 0.02 . 1 . . . . A 159 THR HA . 34461 1 1669 . 1 . 1 169 169 THR HB H 1 4.102 0.02 . 1 . . . . A 159 THR HB . 34461 1 1670 . 1 . 1 169 169 THR HG21 H 1 1.078 0.02 . 1 . . . . A 159 THR HG21 . 34461 1 1671 . 1 . 1 169 169 THR HG22 H 1 1.078 0.02 . 1 . . . . A 159 THR HG22 . 34461 1 1672 . 1 . 1 169 169 THR HG23 H 1 1.078 0.02 . 1 . . . . A 159 THR HG23 . 34461 1 1673 . 1 . 1 169 169 THR CA C 13 62.128 0.1 . 1 . . . . A 159 THR CA . 34461 1 1674 . 1 . 1 169 169 THR CB C 13 71.573 0.1 . 1 . . . . A 159 THR CB . 34461 1 1675 . 1 . 1 169 169 THR CG2 C 13 21.785 0.1 . 1 . . . . A 159 THR CG2 . 34461 1 1676 . 1 . 1 169 169 THR N N 15 117.739 0.1 . 1 . . . . A 159 THR N . 34461 1 1677 . 1 . 1 170 170 VAL H H 1 9.294 0.02 . 1 . . . . A 160 VAL H . 34461 1 1678 . 1 . 1 170 170 VAL HA H 1 4.479 0.02 . 1 . . . . A 160 VAL HA . 34461 1 1679 . 1 . 1 170 170 VAL HB H 1 1.647 0.02 . 1 . . . . A 160 VAL HB . 34461 1 1680 . 1 . 1 170 170 VAL HG11 H 1 0.625 0.02 . 2 . . . . A 160 VAL HG11 . 34461 1 1681 . 1 . 1 170 170 VAL HG12 H 1 0.625 0.02 . 2 . . . . A 160 VAL HG12 . 34461 1 1682 . 1 . 1 170 170 VAL HG13 H 1 0.625 0.02 . 2 . . . . A 160 VAL HG13 . 34461 1 1683 . 1 . 1 170 170 VAL HG21 H 1 0.228 0.02 . 2 . . . . A 160 VAL HG21 . 34461 1 1684 . 1 . 1 170 170 VAL HG22 H 1 0.228 0.02 . 2 . . . . A 160 VAL HG22 . 34461 1 1685 . 1 . 1 170 170 VAL HG23 H 1 0.228 0.02 . 2 . . . . A 160 VAL HG23 . 34461 1 1686 . 1 . 1 170 170 VAL CA C 13 60.836 0.1 . 1 . . . . A 160 VAL CA . 34461 1 1687 . 1 . 1 170 170 VAL CB C 13 33.970 0.1 . 1 . . . . A 160 VAL CB . 34461 1 1688 . 1 . 1 170 170 VAL CG1 C 13 21.573 0.1 . 2 . . . . A 160 VAL CG1 . 34461 1 1689 . 1 . 1 170 170 VAL CG2 C 13 21.661 0.1 . 2 . . . . A 160 VAL CG2 . 34461 1 1690 . 1 . 1 170 170 VAL N N 15 124.927 0.1 . 1 . . . . A 160 VAL N . 34461 1 1691 . 1 . 1 171 171 VAL H H 1 8.764 0.02 . 1 . . . . A 161 VAL H . 34461 1 1692 . 1 . 1 171 171 VAL HA H 1 4.256 0.02 . 1 . . . . A 161 VAL HA . 34461 1 1693 . 1 . 1 171 171 VAL HB H 1 2.213 0.02 . 1 . . . . A 161 VAL HB . 34461 1 1694 . 1 . 1 171 171 VAL HG11 H 1 0.906 0.02 . 2 . . . . A 161 VAL HG11 . 34461 1 1695 . 1 . 1 171 171 VAL HG12 H 1 0.906 0.02 . 2 . . . . A 161 VAL HG12 . 34461 1 1696 . 1 . 1 171 171 VAL HG13 H 1 0.906 0.02 . 2 . . . . A 161 VAL HG13 . 34461 1 1697 . 1 . 1 171 171 VAL HG21 H 1 0.461 0.02 . 2 . . . . A 161 VAL HG21 . 34461 1 1698 . 1 . 1 171 171 VAL HG22 H 1 0.461 0.02 . 2 . . . . A 161 VAL HG22 . 34461 1 1699 . 1 . 1 171 171 VAL HG23 H 1 0.461 0.02 . 2 . . . . A 161 VAL HG23 . 34461 1 1700 . 1 . 1 171 171 VAL CA C 13 62.581 0.1 . 1 . . . . A 161 VAL CA . 34461 1 1701 . 1 . 1 171 171 VAL CB C 13 31.967 0.1 . 1 . . . . A 161 VAL CB . 34461 1 1702 . 1 . 1 171 171 VAL CG1 C 13 21.260 0.1 . 2 . . . . A 161 VAL CG1 . 34461 1 1703 . 1 . 1 171 171 VAL CG2 C 13 22.142 0.1 . 2 . . . . A 161 VAL CG2 . 34461 1 1704 . 1 . 1 171 171 VAL N N 15 129.821 0.1 . 1 . . . . A 161 VAL N . 34461 1 1705 . 1 . 1 172 172 THR H H 1 9.224 0.02 . 1 . . . . A 162 THR H . 34461 1 1706 . 1 . 1 172 172 THR HA H 1 4.595 0.02 . 1 . . . . A 162 THR HA . 34461 1 1707 . 1 . 1 172 172 THR HB H 1 4.107 0.02 . 1 . . . . A 162 THR HB . 34461 1 1708 . 1 . 1 172 172 THR CA C 13 63.403 0.1 . 1 . . . . A 162 THR CA . 34461 1 1709 . 1 . 1 172 172 THR N N 15 126.197 0.1 . 1 . . . . A 162 THR N . 34461 1 1710 . 1 . 1 173 173 TYR H H 1 9.627 0.02 . 1 . . . . A 163 TYR H . 34461 1 1711 . 1 . 1 173 173 TYR HA H 1 5.171 0.02 . 1 . . . . A 163 TYR HA . 34461 1 1712 . 1 . 1 173 173 TYR HB2 H 1 3.207 0.02 . 2 . . . . A 163 TYR HB1 . 34461 1 1713 . 1 . 1 173 173 TYR HB3 H 1 2.485 0.02 . 2 . . . . A 163 TYR HB2 . 34461 1 1714 . 1 . 1 173 173 TYR HD1 H 1 7.057 0.02 . 1 . . . . A 163 TYR HD1 . 34461 1 1715 . 1 . 1 173 173 TYR HD2 H 1 7.057 0.02 . 1 . . . . A 163 TYR HD2 . 34461 1 1716 . 1 . 1 173 173 TYR HE1 H 1 6.855 0.02 . 1 . . . . A 163 TYR HE1 . 34461 1 1717 . 1 . 1 173 173 TYR HE2 H 1 6.855 0.02 . 1 . . . . A 163 TYR HE2 . 34461 1 1718 . 1 . 1 173 173 TYR CA C 13 56.923 0.1 . 1 . . . . A 163 TYR CA . 34461 1 1719 . 1 . 1 173 173 TYR CB C 13 40.608 0.1 . 1 . . . . A 163 TYR CB . 34461 1 1720 . 1 . 1 173 173 TYR CD2 C 13 133.288 0.1 . 1 . . . . A 163 TYR CD2 . 34461 1 1721 . 1 . 1 173 173 TYR CE2 C 13 118.275 0.1 . 1 . . . . A 163 TYR CE2 . 34461 1 1722 . 1 . 1 173 173 TYR N N 15 125.723 0.1 . 1 . . . . A 163 TYR N . 34461 1 1723 . 1 . 1 174 174 VAL H H 1 8.998 0.02 . 1 . . . . A 164 VAL H . 34461 1 1724 . 1 . 1 174 174 VAL HA H 1 4.252 0.02 . 1 . . . . A 164 VAL HA . 34461 1 1725 . 1 . 1 174 174 VAL HB H 1 1.404 0.02 . 1 . . . . A 164 VAL HB . 34461 1 1726 . 1 . 1 174 174 VAL HG11 H 1 0.342 0.02 . 2 . . . . A 164 VAL HG11 . 34461 1 1727 . 1 . 1 174 174 VAL HG12 H 1 0.342 0.02 . 2 . . . . A 164 VAL HG12 . 34461 1 1728 . 1 . 1 174 174 VAL HG13 H 1 0.342 0.02 . 2 . . . . A 164 VAL HG13 . 34461 1 1729 . 1 . 1 174 174 VAL HG21 H 1 -0.064 0.02 . 2 . . . . A 164 VAL HG21 . 34461 1 1730 . 1 . 1 174 174 VAL HG22 H 1 -0.064 0.02 . 2 . . . . A 164 VAL HG22 . 34461 1 1731 . 1 . 1 174 174 VAL HG23 H 1 -0.064 0.02 . 2 . . . . A 164 VAL HG23 . 34461 1 1732 . 1 . 1 174 174 VAL CA C 13 60.627 0.1 . 1 . . . . A 164 VAL CA . 34461 1 1733 . 1 . 1 174 174 VAL CB C 13 33.073 0.1 . 1 . . . . A 164 VAL CB . 34461 1 1734 . 1 . 1 174 174 VAL CG1 C 13 20.168 0.1 . 2 . . . . A 164 VAL CG1 . 34461 1 1735 . 1 . 1 174 174 VAL CG2 C 13 18.199 0.1 . 2 . . . . A 164 VAL CG2 . 34461 1 1736 . 1 . 1 174 174 VAL N N 15 123.934 0.1 . 1 . . . . A 164 VAL N . 34461 1 1737 . 1 . 1 175 175 TYR H H 1 8.418 0.02 . 1 . . . . A 165 TYR H . 34461 1 1738 . 1 . 1 175 175 TYR HA H 1 4.469 0.02 . 1 . . . . A 165 TYR HA . 34461 1 1739 . 1 . 1 175 175 TYR HD1 H 1 6.266 0.02 . 1 . . . . A 165 TYR HD1 . 34461 1 1740 . 1 . 1 175 175 TYR HD2 H 1 6.266 0.02 . 1 . . . . A 165 TYR HD2 . 34461 1 1741 . 1 . 1 175 175 TYR HE1 H 1 6.089 0.02 . 1 . . . . A 165 TYR HE1 . 34461 1 1742 . 1 . 1 175 175 TYR HE2 H 1 6.089 0.02 . 1 . . . . A 165 TYR HE2 . 34461 1 1743 . 1 . 1 175 175 TYR CA C 13 56.803 0.1 . 1 . . . . A 165 TYR CA . 34461 1 1744 . 1 . 1 175 175 TYR CB C 13 39.264 0.1 . 1 . . . . A 165 TYR CB . 34461 1 1745 . 1 . 1 175 175 TYR CD2 C 13 133.201 0.1 . 1 . . . . A 165 TYR CD2 . 34461 1 1746 . 1 . 1 175 175 TYR CE2 C 13 116.786 0.1 . 1 . . . . A 165 TYR CE2 . 34461 1 1747 . 1 . 1 175 175 TYR N N 15 127.830 0.1 . 1 . . . . A 165 TYR N . 34461 1 1748 . 1 . 1 176 176 GLN H H 1 8.675 0.02 . 1 . . . . A 166 GLN H . 34461 1 1749 . 1 . 1 176 176 GLN HA H 1 5.511 0.02 . 1 . . . . A 166 GLN HA . 34461 1 1750 . 1 . 1 176 176 GLN CA C 13 53.983 0.1 . 1 . . . . A 166 GLN CA . 34461 1 1751 . 1 . 1 176 176 GLN CB C 13 34.156 0.1 . 1 . . . . A 166 GLN CB . 34461 1 1752 . 1 . 1 176 176 GLN CG C 13 35.447 0.1 . 1 . . . . A 166 GLN CG . 34461 1 1753 . 1 . 1 176 176 GLN N N 15 117.726 0.1 . 1 . . . . A 166 GLN N . 34461 1 1754 . 1 . 1 177 177 LEU H H 1 8.178 0.02 . 1 . . . . A 167 LEU H . 34461 1 1755 . 1 . 1 177 177 LEU HA H 1 4.938 0.02 . 1 . . . . A 167 LEU HA . 34461 1 1756 . 1 . 1 177 177 LEU HB2 H 1 0.814 0.02 . 2 . . . . A 167 LEU HB1 . 34461 1 1757 . 1 . 1 177 177 LEU HB3 H 1 1.656 0.02 . 2 . . . . A 167 LEU HB2 . 34461 1 1758 . 1 . 1 177 177 LEU HG H 1 0.631 0.02 . 1 . . . . A 167 LEU HG . 34461 1 1759 . 1 . 1 177 177 LEU HD11 H 1 0.473 0.02 . 2 . . . . A 167 LEU HD11 . 34461 1 1760 . 1 . 1 177 177 LEU HD12 H 1 0.473 0.02 . 2 . . . . A 167 LEU HD12 . 34461 1 1761 . 1 . 1 177 177 LEU HD13 H 1 0.473 0.02 . 2 . . . . A 167 LEU HD13 . 34461 1 1762 . 1 . 1 177 177 LEU HD21 H 1 0.622 0.02 . 2 . . . . A 167 LEU HD21 . 34461 1 1763 . 1 . 1 177 177 LEU HD22 H 1 0.622 0.02 . 2 . . . . A 167 LEU HD22 . 34461 1 1764 . 1 . 1 177 177 LEU HD23 H 1 0.622 0.02 . 2 . . . . A 167 LEU HD23 . 34461 1 1765 . 1 . 1 177 177 LEU CA C 13 53.912 0.1 . 1 . . . . A 167 LEU CA . 34461 1 1766 . 1 . 1 177 177 LEU CB C 13 42.823 0.1 . 1 . . . . A 167 LEU CB . 34461 1 1767 . 1 . 1 177 177 LEU CD1 C 13 24.103 0.1 . 2 . . . . A 167 LEU CD1 . 34461 1 1768 . 1 . 1 177 177 LEU CD2 C 13 26.592 0.1 . 2 . . . . A 167 LEU CD2 . 34461 1 1769 . 1 . 1 177 177 LEU N N 15 124.708 0.1 . 1 . . . . A 167 LEU N . 34461 1 1770 . 1 . 1 178 178 ILE H H 1 8.543 0.02 . 1 . . . . A 168 ILE H . 34461 1 1771 . 1 . 1 178 178 ILE HA H 1 4.281 0.02 . 1 . . . . A 168 ILE HA . 34461 1 1772 . 1 . 1 178 178 ILE HB H 1 1.818 0.02 . 1 . . . . A 168 ILE HB . 34461 1 1773 . 1 . 1 178 178 ILE HG12 H 1 1.402 0.02 . 2 . . . . A 168 ILE HG11 . 34461 1 1774 . 1 . 1 178 178 ILE HG13 H 1 1.132 0.02 . 2 . . . . A 168 ILE HG12 . 34461 1 1775 . 1 . 1 178 178 ILE HG21 H 1 0.911 0.02 . 1 . . . . A 168 ILE HG21 . 34461 1 1776 . 1 . 1 178 178 ILE HG22 H 1 0.911 0.02 . 1 . . . . A 168 ILE HG22 . 34461 1 1777 . 1 . 1 178 178 ILE HG23 H 1 0.911 0.02 . 1 . . . . A 168 ILE HG23 . 34461 1 1778 . 1 . 1 178 178 ILE HD11 H 1 0.841 0.02 . 1 . . . . A 168 ILE HD11 . 34461 1 1779 . 1 . 1 178 178 ILE HD12 H 1 0.841 0.02 . 1 . . . . A 168 ILE HD12 . 34461 1 1780 . 1 . 1 178 178 ILE HD13 H 1 0.841 0.02 . 1 . . . . A 168 ILE HD13 . 34461 1 1781 . 1 . 1 178 178 ILE CA C 13 59.788 0.1 . 1 . . . . A 168 ILE CA . 34461 1 1782 . 1 . 1 178 178 ILE CB C 13 38.592 0.1 . 1 . . . . A 168 ILE CB . 34461 1 1783 . 1 . 1 178 178 ILE CG1 C 13 27.274 0.1 . 1 . . . . A 168 ILE CG1 . 34461 1 1784 . 1 . 1 178 178 ILE CG2 C 13 17.222 0.1 . 1 . . . . A 168 ILE CG2 . 34461 1 1785 . 1 . 1 178 178 ILE CD1 C 13 12.627 0.1 . 1 . . . . A 168 ILE CD1 . 34461 1 1786 . 1 . 1 178 178 ILE N N 15 127.999 0.1 . 1 . . . . A 168 ILE N . 34461 1 1787 . 1 . 1 179 179 GLY H H 1 8.862 0.02 . 1 . . . . A 169 GLY H . 34461 1 1788 . 1 . 1 179 179 GLY HA2 H 1 3.969 0.02 . 2 . . . . A 169 GLY HA1 . 34461 1 1789 . 1 . 1 179 179 GLY HA3 H 1 3.693 0.02 . 2 . . . . A 169 GLY HA2 . 34461 1 1790 . 1 . 1 179 179 GLY CA C 13 47.350 0.1 . 1 . . . . A 169 GLY CA . 34461 1 1791 . 1 . 1 179 179 GLY N N 15 118.462 0.1 . 1 . . . . A 169 GLY N . 34461 1 1792 . 1 . 1 180 180 ASP H H 1 8.849 0.02 . 1 . . . . A 170 ASP H . 34461 1 1793 . 1 . 1 180 180 ASP HA H 1 4.612 0.02 . 1 . . . . A 170 ASP HA . 34461 1 1794 . 1 . 1 180 180 ASP HB2 H 1 2.488 0.02 . 2 . . . . A 170 ASP HB1 . 34461 1 1795 . 1 . 1 180 180 ASP HB3 H 1 2.823 0.02 . 2 . . . . A 170 ASP HB2 . 34461 1 1796 . 1 . 1 180 180 ASP CA C 13 54.536 0.1 . 1 . . . . A 170 ASP CA . 34461 1 1797 . 1 . 1 180 180 ASP CB C 13 42.128 0.1 . 1 . . . . A 170 ASP CB . 34461 1 1798 . 1 . 1 180 180 ASP N N 15 123.502 0.1 . 1 . . . . A 170 ASP N . 34461 1 1799 . 1 . 1 181 181 ASP H H 1 7.801 0.02 . 1 . . . . A 171 ASP H . 34461 1 1800 . 1 . 1 181 181 ASP HA H 1 4.945 0.02 . 1 . . . . A 171 ASP HA . 34461 1 1801 . 1 . 1 181 181 ASP HB3 H 1 2.633 0.02 . 2 . . . . A 171 ASP HB2 . 34461 1 1802 . 1 . 1 181 181 ASP CA C 13 53.323 0.1 . 1 . . . . A 171 ASP CA . 34461 1 1803 . 1 . 1 181 181 ASP CB C 13 44.331 0.1 . 1 . . . . A 171 ASP CB . 34461 1 1804 . 1 . 1 181 181 ASP N N 15 118.485 0.1 . 1 . . . . A 171 ASP N . 34461 1 1805 . 1 . 1 182 182 VAL H H 1 8.528 0.02 . 1 . . . . A 172 VAL H . 34461 1 1806 . 1 . 1 182 182 VAL HA H 1 4.691 0.02 . 1 . . . . A 172 VAL HA . 34461 1 1807 . 1 . 1 182 182 VAL HB H 1 2.139 0.02 . 1 . . . . A 172 VAL HB . 34461 1 1808 . 1 . 1 182 182 VAL HG11 H 1 0.942 0.02 . 2 . . . . A 172 VAL HG11 . 34461 1 1809 . 1 . 1 182 182 VAL HG12 H 1 0.942 0.02 . 2 . . . . A 172 VAL HG12 . 34461 1 1810 . 1 . 1 182 182 VAL HG13 H 1 0.942 0.02 . 2 . . . . A 172 VAL HG13 . 34461 1 1811 . 1 . 1 182 182 VAL HG21 H 1 1.055 0.02 . 2 . . . . A 172 VAL HG21 . 34461 1 1812 . 1 . 1 182 182 VAL HG22 H 1 1.055 0.02 . 2 . . . . A 172 VAL HG22 . 34461 1 1813 . 1 . 1 182 182 VAL HG23 H 1 1.055 0.02 . 2 . . . . A 172 VAL HG23 . 34461 1 1814 . 1 . 1 182 182 VAL CA C 13 62.134 0.1 . 1 . . . . A 172 VAL CA . 34461 1 1815 . 1 . 1 182 182 VAL CB C 13 32.103 0.1 . 1 . . . . A 172 VAL CB . 34461 1 1816 . 1 . 1 182 182 VAL CG1 C 13 21.728 0.1 . 2 . . . . A 172 VAL CG1 . 34461 1 1817 . 1 . 1 182 182 VAL CG2 C 13 22.848 0.1 . 2 . . . . A 172 VAL CG2 . 34461 1 1818 . 1 . 1 182 182 VAL N N 15 121.608 0.1 . 1 . . . . A 172 VAL N . 34461 1 1819 . 1 . 1 183 183 LYS H H 1 9.415 0.02 . 1 . . . . A 173 LYS H . 34461 1 1820 . 1 . 1 183 183 LYS HA H 1 4.599 0.02 . 1 . . . . A 173 LYS HA . 34461 1 1821 . 1 . 1 183 183 LYS HB3 H 1 1.750 0.02 . 2 . . . . A 173 LYS HB2 . 34461 1 1822 . 1 . 1 183 183 LYS HG2 H 1 1.343 0.02 . 2 . . . . A 173 LYS HG1 . 34461 1 1823 . 1 . 1 183 183 LYS HG3 H 1 1.456 0.02 . 2 . . . . A 173 LYS HG2 . 34461 1 1824 . 1 . 1 183 183 LYS HD3 H 1 1.639 0.02 . 2 . . . . A 173 LYS HD2 . 34461 1 1825 . 1 . 1 183 183 LYS CA C 13 54.531 0.1 . 1 . . . . A 173 LYS CA . 34461 1 1826 . 1 . 1 183 183 LYS CB C 13 34.354 0.1 . 1 . . . . A 173 LYS CB . 34461 1 1827 . 1 . 1 183 183 LYS CG C 13 24.944 0.1 . 1 . . . . A 173 LYS CG . 34461 1 1828 . 1 . 1 183 183 LYS CD C 13 29.079 0.1 . 1 . . . . A 173 LYS CD . 34461 1 1829 . 1 . 1 183 183 LYS CE C 13 42.189 0.1 . 1 . . . . A 173 LYS CE . 34461 1 1830 . 1 . 1 183 183 LYS N N 15 131.301 0.1 . 1 . . . . A 173 LYS N . 34461 1 1831 . 1 . 1 184 184 VAL H H 1 8.405 0.02 . 1 . . . . A 174 VAL H . 34461 1 1832 . 1 . 1 184 184 VAL HA H 1 5.060 0.02 . 1 . . . . A 174 VAL HA . 34461 1 1833 . 1 . 1 184 184 VAL HB H 1 1.616 0.02 . 1 . . . . A 174 VAL HB . 34461 1 1834 . 1 . 1 184 184 VAL HG11 H 1 0.343 0.02 . 2 . . . . A 174 VAL HG11 . 34461 1 1835 . 1 . 1 184 184 VAL HG12 H 1 0.343 0.02 . 2 . . . . A 174 VAL HG12 . 34461 1 1836 . 1 . 1 184 184 VAL HG13 H 1 0.343 0.02 . 2 . . . . A 174 VAL HG13 . 34461 1 1837 . 1 . 1 184 184 VAL HG21 H 1 0.109 0.02 . 2 . . . . A 174 VAL HG21 . 34461 1 1838 . 1 . 1 184 184 VAL HG22 H 1 0.109 0.02 . 2 . . . . A 174 VAL HG22 . 34461 1 1839 . 1 . 1 184 184 VAL HG23 H 1 0.109 0.02 . 2 . . . . A 174 VAL HG23 . 34461 1 1840 . 1 . 1 184 184 VAL CA C 13 60.266 0.1 . 1 . . . . A 174 VAL CA . 34461 1 1841 . 1 . 1 184 184 VAL CB C 13 33.831 0.1 . 1 . . . . A 174 VAL CB . 34461 1 1842 . 1 . 1 184 184 VAL CG1 C 13 21.087 0.1 . 2 . . . . A 174 VAL CG1 . 34461 1 1843 . 1 . 1 184 184 VAL CG2 C 13 21.513 0.1 . 2 . . . . A 174 VAL CG2 . 34461 1 1844 . 1 . 1 184 184 VAL N N 15 124.874 0.1 . 1 . . . . A 174 VAL N . 34461 1 1845 . 1 . 1 185 185 GLU H H 1 8.281 0.02 . 1 . . . . A 175 GLU H . 34461 1 1846 . 1 . 1 185 185 GLU HA H 1 4.758 0.02 . 1 . . . . A 175 GLU HA . 34461 1 1847 . 1 . 1 185 185 GLU HB2 H 1 1.639 0.02 . 2 . . . . A 175 GLU HB1 . 34461 1 1848 . 1 . 1 185 185 GLU HB3 H 1 1.959 0.02 . 2 . . . . A 175 GLU HB2 . 34461 1 1849 . 1 . 1 185 185 GLU HG3 H 1 2.175 0.02 . 2 . . . . A 175 GLU HG2 . 34461 1 1850 . 1 . 1 185 185 GLU CA C 13 54.465 0.1 . 1 . . . . A 175 GLU CA . 34461 1 1851 . 1 . 1 185 185 GLU CB C 13 33.287 0.1 . 1 . . . . A 175 GLU CB . 34461 1 1852 . 1 . 1 185 185 GLU CG C 13 36.179 0.1 . 1 . . . . A 175 GLU CG . 34461 1 1853 . 1 . 1 185 185 GLU N N 15 127.135 0.1 . 1 . . . . A 175 GLU N . 34461 1 1854 . 1 . 1 186 186 ARG H H 1 8.603 0.02 . 1 . . . . A 176 ARG H . 34461 1 1855 . 1 . 1 186 186 ARG HA H 1 5.233 0.02 . 1 . . . . A 176 ARG HA . 34461 1 1856 . 1 . 1 186 186 ARG HD3 H 1 2.793 0.02 . 2 . . . . A 176 ARG HD2 . 34461 1 1857 . 1 . 1 186 186 ARG CA C 13 54.512 0.1 . 1 . . . . A 176 ARG CA . 34461 1 1858 . 1 . 1 186 186 ARG CB C 13 33.551 0.1 . 1 . . . . A 176 ARG CB . 34461 1 1859 . 1 . 1 186 186 ARG CG C 13 26.414 0.1 . 1 . . . . A 176 ARG CG . 34461 1 1860 . 1 . 1 186 186 ARG CD C 13 43.573 0.1 . 1 . . . . A 176 ARG CD . 34461 1 1861 . 1 . 1 186 186 ARG N N 15 122.289 0.1 . 1 . . . . A 176 ARG N . 34461 1 1862 . 1 . 1 187 187 ILE H H 1 9.181 0.02 . 1 . . . . A 177 ILE H . 34461 1 1863 . 1 . 1 187 187 ILE HA H 1 4.409 0.02 . 1 . . . . A 177 ILE HA . 34461 1 1864 . 1 . 1 187 187 ILE HB H 1 1.686 0.02 . 1 . . . . A 177 ILE HB . 34461 1 1865 . 1 . 1 187 187 ILE HG13 H 1 1.215 0.02 . 2 . . . . A 177 ILE HG12 . 34461 1 1866 . 1 . 1 187 187 ILE HG21 H 1 1.071 0.02 . 1 . . . . A 177 ILE HG21 . 34461 1 1867 . 1 . 1 187 187 ILE HG22 H 1 1.071 0.02 . 1 . . . . A 177 ILE HG22 . 34461 1 1868 . 1 . 1 187 187 ILE HG23 H 1 1.071 0.02 . 1 . . . . A 177 ILE HG23 . 34461 1 1869 . 1 . 1 187 187 ILE HD11 H 1 1.057 0.02 . 1 . . . . A 177 ILE HD11 . 34461 1 1870 . 1 . 1 187 187 ILE HD12 H 1 1.057 0.02 . 1 . . . . A 177 ILE HD12 . 34461 1 1871 . 1 . 1 187 187 ILE HD13 H 1 1.057 0.02 . 1 . . . . A 177 ILE HD13 . 34461 1 1872 . 1 . 1 187 187 ILE CA C 13 60.961 0.1 . 1 . . . . A 177 ILE CA . 34461 1 1873 . 1 . 1 187 187 ILE CB C 13 42.896 0.1 . 1 . . . . A 177 ILE CB . 34461 1 1874 . 1 . 1 187 187 ILE CG1 C 13 27.977 0.1 . 1 . . . . A 177 ILE CG1 . 34461 1 1875 . 1 . 1 187 187 ILE CG2 C 13 18.148 0.1 . 1 . . . . A 177 ILE CG2 . 34461 1 1876 . 1 . 1 187 187 ILE CD1 C 13 15.328 0.1 . 1 . . . . A 177 ILE CD1 . 34461 1 1877 . 1 . 1 187 187 ILE N N 15 126.588 0.1 . 1 . . . . A 177 ILE N . 34461 1 1878 . 1 . 1 188 188 GLU H H 1 8.866 0.02 . 1 . . . . A 178 GLU H . 34461 1 1879 . 1 . 1 188 188 GLU HA H 1 4.975 0.02 . 1 . . . . A 178 GLU HA . 34461 1 1880 . 1 . 1 188 188 GLU HB3 H 1 1.885 0.02 . 2 . . . . A 178 GLU HB2 . 34461 1 1881 . 1 . 1 188 188 GLU HG2 H 1 1.987 0.02 . 2 . . . . A 178 GLU HG1 . 34461 1 1882 . 1 . 1 188 188 GLU HG3 H 1 2.102 0.02 . 2 . . . . A 178 GLU HG2 . 34461 1 1883 . 1 . 1 188 188 GLU CA C 13 55.718 0.1 . 1 . . . . A 178 GLU CA . 34461 1 1884 . 1 . 1 188 188 GLU CB C 13 32.772 0.1 . 1 . . . . A 178 GLU CB . 34461 1 1885 . 1 . 1 188 188 GLU CG C 13 37.353 0.1 . 1 . . . . A 178 GLU CG . 34461 1 1886 . 1 . 1 188 188 GLU N N 15 127.032 0.1 . 1 . . . . A 178 GLU N . 34461 1 1887 . 1 . 1 189 189 TYR H H 1 8.629 0.02 . 1 . . . . A 179 TYR H . 34461 1 1888 . 1 . 1 189 189 TYR HA H 1 4.527 0.02 . 1 . . . . A 179 TYR HA . 34461 1 1889 . 1 . 1 189 189 TYR HB3 H 1 1.703 0.02 . 2 . . . . A 179 TYR HB2 . 34461 1 1890 . 1 . 1 189 189 TYR HD1 H 1 6.626 0.02 . 1 . . . . A 179 TYR HD1 . 34461 1 1891 . 1 . 1 189 189 TYR HD2 H 1 6.626 0.02 . 1 . . . . A 179 TYR HD2 . 34461 1 1892 . 1 . 1 189 189 TYR HE1 H 1 6.505 0.02 . 1 . . . . A 179 TYR HE1 . 34461 1 1893 . 1 . 1 189 189 TYR HE2 H 1 6.505 0.02 . 1 . . . . A 179 TYR HE2 . 34461 1 1894 . 1 . 1 189 189 TYR CA C 13 56.673 0.1 . 1 . . . . A 179 TYR CA . 34461 1 1895 . 1 . 1 189 189 TYR CB C 13 40.443 0.1 . 1 . . . . A 179 TYR CB . 34461 1 1896 . 1 . 1 189 189 TYR CD2 C 13 132.593 0.1 . 1 . . . . A 179 TYR CD2 . 34461 1 1897 . 1 . 1 189 189 TYR CE2 C 13 117.331 0.1 . 1 . . . . A 179 TYR CE2 . 34461 1 1898 . 1 . 1 189 189 TYR N N 15 125.272 0.1 . 1 . . . . A 179 TYR N . 34461 1 1899 . 1 . 1 190 190 LYS H H 1 7.826 0.02 . 1 . . . . A 180 LYS H . 34461 1 1900 . 1 . 1 190 190 LYS HA H 1 4.794 0.02 . 1 . . . . A 180 LYS HA . 34461 1 1901 . 1 . 1 190 190 LYS HB2 H 1 1.613 0.02 . 2 . . . . A 180 LYS HB1 . 34461 1 1902 . 1 . 1 190 190 LYS HB3 H 1 1.464 0.02 . 2 . . . . A 180 LYS HB2 . 34461 1 1903 . 1 . 1 190 190 LYS HG2 H 1 1.225 0.02 . 2 . . . . A 180 LYS HG1 . 34461 1 1904 . 1 . 1 190 190 LYS HG3 H 1 1.308 0.02 . 2 . . . . A 180 LYS HG2 . 34461 1 1905 . 1 . 1 190 190 LYS HD2 H 1 1.561 0.02 . 2 . . . . A 180 LYS HD1 . 34461 1 1906 . 1 . 1 190 190 LYS HD3 H 1 1.561 0.02 . 2 . . . . A 180 LYS HD2 . 34461 1 1907 . 1 . 1 190 190 LYS HE2 H 1 2.882 0.02 . 1 . . . . A 180 LYS HE1 . 34461 1 1908 . 1 . 1 190 190 LYS HE3 H 1 2.882 0.02 . 1 . . . . A 180 LYS HE2 . 34461 1 1909 . 1 . 1 190 190 LYS CA C 13 54.016 0.1 . 1 . . . . A 180 LYS CA . 34461 1 1910 . 1 . 1 190 190 LYS CB C 13 34.914 0.1 . 1 . . . . A 180 LYS CB . 34461 1 1911 . 1 . 1 190 190 LYS CG C 13 24.371 0.1 . 1 . . . . A 180 LYS CG . 34461 1 1912 . 1 . 1 190 190 LYS CD C 13 29.222 0.1 . 1 . . . . A 180 LYS CD . 34461 1 1913 . 1 . 1 190 190 LYS CE C 13 41.998 0.1 . 1 . . . . A 180 LYS CE . 34461 1 1914 . 1 . 1 190 190 LYS N N 15 127.219 0.1 . 1 . . . . A 180 LYS N . 34461 1 1915 . 1 . 1 191 191 LYS H H 1 8.052 0.02 . 1 . . . . A 181 LYS H . 34461 1 1916 . 1 . 1 191 191 LYS HA H 1 4.156 0.02 . 1 . . . . A 181 LYS HA . 34461 1 1917 . 1 . 1 191 191 LYS HB2 H 1 1.721 0.02 . 2 . . . . A 181 LYS HB1 . 34461 1 1918 . 1 . 1 191 191 LYS HB3 H 1 1.641 0.02 . 2 . . . . A 181 LYS HB2 . 34461 1 1919 . 1 . 1 191 191 LYS HG3 H 1 1.389 0.02 . 2 . . . . A 181 LYS HG2 . 34461 1 1920 . 1 . 1 191 191 LYS HD3 H 1 1.119 0.02 . 2 . . . . A 181 LYS HD2 . 34461 1 1921 . 1 . 1 191 191 LYS HE3 H 1 2.742 0.02 . 1 . . . . A 181 LYS HE2 . 34461 1 1922 . 1 . 1 191 191 LYS CA C 13 56.504 0.1 . 1 . . . . A 181 LYS CA . 34461 1 1923 . 1 . 1 191 191 LYS CB C 13 33.665 0.1 . 1 . . . . A 181 LYS CB . 34461 1 1924 . 1 . 1 191 191 LYS CG C 13 24.720 0.1 . 1 . . . . A 181 LYS CG . 34461 1 1925 . 1 . 1 191 191 LYS CD C 13 29.104 0.1 . 1 . . . . A 181 LYS CD . 34461 1 1926 . 1 . 1 191 191 LYS CE C 13 41.963 0.1 . 1 . . . . A 181 LYS CE . 34461 1 1927 . 1 . 1 191 191 LYS N N 15 122.707 0.1 . 1 . . . . A 181 LYS N . 34461 1 1928 . 1 . 1 192 192 SER H H 1 8.429 0.02 . 1 . . . . A 182 SER H . 34461 1 1929 . 1 . 1 192 192 SER HA H 1 4.264 0.02 . 1 . . . . A 182 SER HA . 34461 1 1930 . 1 . 1 192 192 SER HB2 H 1 3.850 0.02 . 2 . . . . A 182 SER HB1 . 34461 1 1931 . 1 . 1 192 192 SER HB3 H 1 3.854 0.02 . 2 . . . . A 182 SER HB2 . 34461 1 1932 . 1 . 1 192 192 SER CA C 13 60.235 0.1 . 1 . . . . A 182 SER CA . 34461 1 1933 . 1 . 1 192 192 SER CB C 13 65.080 0.1 . 1 . . . . A 182 SER CB . 34461 1 1934 . 1 . 1 192 192 SER N N 15 126.186 0.1 . 1 . . . . A 182 SER N . 34461 1 1935 . 2 . 2 2 2 PRO HA H 1 4.503 0.02 . 1 . . . . B 688 PRO HA . 34461 1 1936 . 2 . 2 2 2 PRO HB2 H 1 1.981 0.02 . 2 . . . . B 688 PRO HB1 . 34461 1 1937 . 2 . 2 2 2 PRO HB3 H 1 2.352 0.02 . 2 . . . . B 688 PRO HB2 . 34461 1 1938 . 2 . 2 2 2 PRO HG3 H 1 2.053 0.02 . 2 . . . . B 688 PRO HG2 . 34461 1 1939 . 2 . 2 2 2 PRO HD3 H 1 3.609 0.02 . 2 . . . . B 688 PRO HD2 . 34461 1 1940 . 2 . 2 2 2 PRO CA C 13 63.199 0.1 . 1 . . . . B 688 PRO CA . 34461 1 1941 . 2 . 2 2 2 PRO CB C 13 32.378 0.1 . 1 . . . . B 688 PRO CB . 34461 1 1942 . 2 . 2 2 2 PRO CG C 13 27.127 0.1 . 1 . . . . B 688 PRO CG . 34461 1 1943 . 2 . 2 2 2 PRO CD C 13 49.705 0.1 . 1 . . . . B 688 PRO CD . 34461 1 1944 . 2 . 2 3 3 LEU H H 1 8.594 0.02 . 1 . . . . B 689 LEU H . 34461 1 1945 . 2 . 2 3 3 LEU HA H 1 4.381 0.02 . 1 . . . . B 689 LEU HA . 34461 1 1946 . 2 . 2 3 3 LEU HB2 H 1 1.715 0.02 . 2 . . . . B 689 LEU HB1 . 34461 1 1947 . 2 . 2 3 3 LEU HB3 H 1 1.645 0.02 . 2 . . . . B 689 LEU HB2 . 34461 1 1948 . 2 . 2 3 3 LEU HG H 1 1.688 0.02 . 1 . . . . B 689 LEU HG . 34461 1 1949 . 2 . 2 3 3 LEU HD11 H 1 0.924 0.02 . 2 . . . . B 689 LEU HD11 . 34461 1 1950 . 2 . 2 3 3 LEU HD12 H 1 0.924 0.02 . 2 . . . . B 689 LEU HD12 . 34461 1 1951 . 2 . 2 3 3 LEU HD13 H 1 0.924 0.02 . 2 . . . . B 689 LEU HD13 . 34461 1 1952 . 2 . 2 3 3 LEU HD21 H 1 0.972 0.02 . 2 . . . . B 689 LEU HD21 . 34461 1 1953 . 2 . 2 3 3 LEU HD22 H 1 0.972 0.02 . 2 . . . . B 689 LEU HD22 . 34461 1 1954 . 2 . 2 3 3 LEU HD23 H 1 0.972 0.02 . 2 . . . . B 689 LEU HD23 . 34461 1 1955 . 2 . 2 3 3 LEU CA C 13 55.505 0.1 . 1 . . . . B 689 LEU CA . 34461 1 1956 . 2 . 2 3 3 LEU CB C 13 42.092 0.1 . 1 . . . . B 689 LEU CB . 34461 1 1957 . 2 . 2 3 3 LEU CG C 13 27.054 0.1 . 1 . . . . B 689 LEU CG . 34461 1 1958 . 2 . 2 3 3 LEU CD1 C 13 23.486 0.1 . 2 . . . . B 689 LEU CD1 . 34461 1 1959 . 2 . 2 3 3 LEU CD2 C 13 24.843 0.1 . 2 . . . . B 689 LEU CD2 . 34461 1 1960 . 2 . 2 3 3 LEU N N 15 122.268 0.1 . 1 . . . . B 689 LEU N . 34461 1 1961 . 2 . 2 4 4 GLY H H 1 8.476 0.02 . 1 . . . . B 690 GLY H . 34461 1 1962 . 2 . 2 4 4 GLY HA2 H 1 4.074 0.02 . 2 . . . . B 690 GLY HA1 . 34461 1 1963 . 2 . 2 4 4 GLY HA3 H 1 3.981 0.02 . 2 . . . . B 690 GLY HA2 . 34461 1 1964 . 2 . 2 4 4 GLY CA C 13 45.279 0.1 . 1 . . . . B 690 GLY CA . 34461 1 1965 . 2 . 2 4 4 GLY N N 15 110.289 0.1 . 1 . . . . B 690 GLY N . 34461 1 1966 . 2 . 2 5 5 SER H H 1 8.240 0.02 . 1 . . . . B 691 SER H . 34461 1 1967 . 2 . 2 5 5 SER HA H 1 4.600 0.02 . 1 . . . . B 691 SER HA . 34461 1 1968 . 2 . 2 5 5 SER HB2 H 1 3.908 0.02 . 2 . . . . B 691 SER HB1 . 34461 1 1969 . 2 . 2 5 5 SER HB3 H 1 3.963 0.02 . 2 . . . . B 691 SER HB2 . 34461 1 1970 . 2 . 2 5 5 SER CA C 13 58.257 0.1 . 1 . . . . B 691 SER CA . 34461 1 1971 . 2 . 2 5 5 SER CB C 13 64.116 0.1 . 1 . . . . B 691 SER CB . 34461 1 1972 . 2 . 2 5 5 SER N N 15 115.788 0.1 . 1 . . . . B 691 SER N . 34461 1 1973 . 2 . 2 6 6 THR H H 1 8.395 0.02 . 1 . . . . B 692 THR H . 34461 1 1974 . 2 . 2 6 6 THR HA H 1 4.451 0.02 . 1 . . . . B 692 THR HA . 34461 1 1975 . 2 . 2 6 6 THR HB H 1 4.350 0.02 . 1 . . . . B 692 THR HB . 34461 1 1976 . 2 . 2 6 6 THR HG21 H 1 1.240 0.02 . 1 . . . . B 692 THR HG21 . 34461 1 1977 . 2 . 2 6 6 THR HG22 H 1 1.240 0.02 . 1 . . . . B 692 THR HG22 . 34461 1 1978 . 2 . 2 6 6 THR HG23 H 1 1.240 0.02 . 1 . . . . B 692 THR HG23 . 34461 1 1979 . 2 . 2 6 6 THR CA C 13 61.890 0.1 . 1 . . . . B 692 THR CA . 34461 1 1980 . 2 . 2 6 6 THR CB C 13 69.814 0.1 . 1 . . . . B 692 THR CB . 34461 1 1981 . 2 . 2 6 6 THR CG2 C 13 21.579 0.1 . 1 . . . . B 692 THR CG2 . 34461 1 1982 . 2 . 2 6 6 THR N N 15 115.594 0.1 . 1 . . . . B 692 THR N . 34461 1 1983 . 2 . 2 7 7 GLU H H 1 8.480 0.02 . 1 . . . . B 693 GLU H . 34461 1 1984 . 2 . 2 7 7 GLU HA H 1 4.319 0.02 . 1 . . . . B 693 GLU HA . 34461 1 1985 . 2 . 2 7 7 GLU HB2 H 1 1.965 0.02 . 2 . . . . B 693 GLU HB1 . 34461 1 1986 . 2 . 2 7 7 GLU HB3 H 1 2.101 0.02 . 2 . . . . B 693 GLU HB2 . 34461 1 1987 . 2 . 2 7 7 GLU HG2 H 1 2.294 0.02 . 2 . . . . B 693 GLU HG1 . 34461 1 1988 . 2 . 2 7 7 GLU HG3 H 1 2.114 0.02 . 2 . . . . B 693 GLU HG2 . 34461 1 1989 . 2 . 2 7 7 GLU CA C 13 56.940 0.1 . 1 . . . . B 693 GLU CA . 34461 1 1990 . 2 . 2 7 7 GLU CB C 13 30.173 0.1 . 1 . . . . B 693 GLU CB . 34461 1 1991 . 2 . 2 7 7 GLU CG C 13 36.335 0.1 . 1 . . . . B 693 GLU CG . 34461 1 1992 . 2 . 2 7 7 GLU N N 15 122.506 0.1 . 1 . . . . B 693 GLU N . 34461 1 1993 . 2 . 2 8 8 GLU H H 1 8.355 0.02 . 1 . . . . B 694 GLU H . 34461 1 1994 . 2 . 2 8 8 GLU HA H 1 4.284 0.02 . 1 . . . . B 694 GLU HA . 34461 1 1995 . 2 . 2 8 8 GLU HB2 H 1 1.925 0.02 . 2 . . . . B 694 GLU HB1 . 34461 1 1996 . 2 . 2 8 8 GLU HB3 H 1 2.060 0.02 . 2 . . . . B 694 GLU HB2 . 34461 1 1997 . 2 . 2 8 8 GLU CA C 13 56.731 0.1 . 1 . . . . B 694 GLU CA . 34461 1 1998 . 2 . 2 8 8 GLU CB C 13 30.588 0.1 . 1 . . . . B 694 GLU CB . 34461 1 1999 . 2 . 2 8 8 GLU CG C 13 36.392 0.1 . 1 . . . . B 694 GLU CG . 34461 1 2000 . 2 . 2 8 8 GLU N N 15 121.117 0.1 . 1 . . . . B 694 GLU N . 34461 1 2001 . 2 . 2 9 9 ASP H H 1 8.363 0.02 . 1 . . . . B 695 ASP H . 34461 1 2002 . 2 . 2 9 9 ASP HA H 1 4.632 0.02 . 1 . . . . B 695 ASP HA . 34461 1 2003 . 2 . 2 9 9 ASP HB2 H 1 2.628 0.02 . 2 . . . . B 695 ASP HB1 . 34461 1 2004 . 2 . 2 9 9 ASP HB3 H 1 2.762 0.02 . 2 . . . . B 695 ASP HB2 . 34461 1 2005 . 2 . 2 9 9 ASP CA C 13 54.313 0.1 . 1 . . . . B 695 ASP CA . 34461 1 2006 . 2 . 2 9 9 ASP CB C 13 41.206 0.1 . 1 . . . . B 695 ASP CB . 34461 1 2007 . 2 . 2 9 9 ASP N N 15 121.382 0.1 . 1 . . . . B 695 ASP N . 34461 1 2008 . 2 . 2 10 10 LEU H H 1 8.183 0.02 . 1 . . . . B 696 LEU H . 34461 1 2009 . 2 . 2 10 10 LEU HA H 1 4.382 0.02 . 1 . . . . B 696 LEU HA . 34461 1 2010 . 2 . 2 10 10 LEU HB2 H 1 1.616 0.02 . 2 . . . . B 696 LEU HB1 . 34461 1 2011 . 2 . 2 10 10 LEU HB3 H 1 1.677 0.02 . 2 . . . . B 696 LEU HB2 . 34461 1 2012 . 2 . 2 10 10 LEU HG H 1 1.652 0.02 . 1 . . . . B 696 LEU HG . 34461 1 2013 . 2 . 2 10 10 LEU HD11 H 1 0.894 0.02 . 2 . . . . B 696 LEU HD11 . 34461 1 2014 . 2 . 2 10 10 LEU HD12 H 1 0.894 0.02 . 2 . . . . B 696 LEU HD12 . 34461 1 2015 . 2 . 2 10 10 LEU HD13 H 1 0.894 0.02 . 2 . . . . B 696 LEU HD13 . 34461 1 2016 . 2 . 2 10 10 LEU HD21 H 1 0.953 0.02 . 2 . . . . B 696 LEU HD21 . 34461 1 2017 . 2 . 2 10 10 LEU HD22 H 1 0.953 0.02 . 2 . . . . B 696 LEU HD22 . 34461 1 2018 . 2 . 2 10 10 LEU HD23 H 1 0.953 0.02 . 2 . . . . B 696 LEU HD23 . 34461 1 2019 . 2 . 2 10 10 LEU CA C 13 55.161 0.1 . 1 . . . . B 696 LEU CA . 34461 1 2020 . 2 . 2 10 10 LEU CB C 13 42.549 0.1 . 1 . . . . B 696 LEU CB . 34461 1 2021 . 2 . 2 10 10 LEU CG C 13 26.959 0.1 . 1 . . . . B 696 LEU CG . 34461 1 2022 . 2 . 2 10 10 LEU CD1 C 13 23.477 0.1 . 2 . . . . B 696 LEU CD1 . 34461 1 2023 . 2 . 2 10 10 LEU CD2 C 13 24.950 0.1 . 2 . . . . B 696 LEU CD2 . 34461 1 2024 . 2 . 2 10 10 LEU N N 15 122.673 0.1 . 1 . . . . B 696 LEU N . 34461 1 2025 . 2 . 2 11 11 GLU H H 1 8.404 0.02 . 1 . . . . B 697 GLU H . 34461 1 2026 . 2 . 2 11 11 GLU HA H 1 4.272 0.02 . 1 . . . . B 697 GLU HA . 34461 1 2027 . 2 . 2 11 11 GLU HB2 H 1 1.976 0.02 . 2 . . . . B 697 GLU HB1 . 34461 1 2028 . 2 . 2 11 11 GLU HB3 H 1 2.074 0.02 . 2 . . . . B 697 GLU HB2 . 34461 1 2029 . 2 . 2 11 11 GLU CA C 13 56.656 0.1 . 1 . . . . B 697 GLU CA . 34461 1 2030 . 2 . 2 11 11 GLU CB C 13 30.465 0.1 . 1 . . . . B 697 GLU CB . 34461 1 2031 . 2 . 2 11 11 GLU N N 15 121.893 0.1 . 1 . . . . B 697 GLU N . 34461 1 2032 . 2 . 2 12 12 ASP H H 1 8.394 0.02 . 1 . . . . B 698 ASP H . 34461 1 2033 . 2 . 2 12 12 ASP HA H 1 4.610 0.02 . 1 . . . . B 698 ASP HA . 34461 1 2034 . 2 . 2 12 12 ASP HB2 H 1 2.608 0.02 . 2 . . . . B 698 ASP HB1 . 34461 1 2035 . 2 . 2 12 12 ASP HB3 H 1 2.741 0.02 . 2 . . . . B 698 ASP HB2 . 34461 1 2036 . 2 . 2 12 12 ASP CA C 13 54.224 0.1 . 1 . . . . B 698 ASP CA . 34461 1 2037 . 2 . 2 12 12 ASP CB C 13 41.213 0.1 . 1 . . . . B 698 ASP CB . 34461 1 2038 . 2 . 2 12 12 ASP N N 15 121.777 0.1 . 1 . . . . B 698 ASP N . 34461 1 2039 . 2 . 2 13 13 ALA H H 1 8.242 0.02 . 1 . . . . B 699 ALA H . 34461 1 2040 . 2 . 2 13 13 ALA HA H 1 4.342 0.02 . 1 . . . . B 699 ALA HA . 34461 1 2041 . 2 . 2 13 13 ALA HB1 H 1 1.429 0.02 . 1 . . . . B 699 ALA HB1 . 34461 1 2042 . 2 . 2 13 13 ALA HB2 H 1 1.429 0.02 . 1 . . . . B 699 ALA HB2 . 34461 1 2043 . 2 . 2 13 13 ALA HB3 H 1 1.429 0.02 . 1 . . . . B 699 ALA HB3 . 34461 1 2044 . 2 . 2 13 13 ALA CA C 13 52.471 0.1 . 1 . . . . B 699 ALA CA . 34461 1 2045 . 2 . 2 13 13 ALA CB C 13 19.614 0.1 . 1 . . . . B 699 ALA CB . 34461 1 2046 . 2 . 2 13 13 ALA N N 15 124.776 0.1 . 1 . . . . B 699 ALA N . 34461 1 2047 . 2 . 2 14 14 GLU H H 1 8.454 0.02 . 1 . . . . B 700 GLU H . 34461 1 2048 . 2 . 2 14 14 GLU HA H 1 4.282 0.02 . 1 . . . . B 700 GLU HA . 34461 1 2049 . 2 . 2 14 14 GLU HB2 H 1 2.084 0.02 . 2 . . . . B 700 GLU HB1 . 34461 1 2050 . 2 . 2 14 14 GLU HB3 H 1 1.979 0.02 . 2 . . . . B 700 GLU HB2 . 34461 1 2051 . 2 . 2 14 14 GLU CA C 13 56.582 0.1 . 1 . . . . B 700 GLU CA . 34461 1 2052 . 2 . 2 14 14 GLU CB C 13 30.421 0.1 . 1 . . . . B 700 GLU CB . 34461 1 2053 . 2 . 2 14 14 GLU N N 15 120.214 0.1 . 1 . . . . B 700 GLU N . 34461 1 2054 . 2 . 2 15 15 ASP H H 1 8.424 0.02 . 1 . . . . B 701 ASP H . 34461 1 2055 . 2 . 2 15 15 ASP HA H 1 4.685 0.02 . 1 . . . . B 701 ASP HA . 34461 1 2056 . 2 . 2 15 15 ASP HB2 H 1 2.668 0.02 . 2 . . . . B 701 ASP HB1 . 34461 1 2057 . 2 . 2 15 15 ASP HB3 H 1 2.749 0.02 . 2 . . . . B 701 ASP HB2 . 34461 1 2058 . 2 . 2 15 15 ASP CA C 13 54.319 0.1 . 1 . . . . B 701 ASP CA . 34461 1 2059 . 2 . 2 15 15 ASP CB C 13 41.116 0.1 . 1 . . . . B 701 ASP CB . 34461 1 2060 . 2 . 2 15 15 ASP N N 15 121.476 0.1 . 1 . . . . B 701 ASP N . 34461 1 2061 . 2 . 2 16 16 THR H H 1 8.147 0.02 . 1 . . . . B 702 THR H . 34461 1 2062 . 2 . 2 16 16 THR HA H 1 4.355 0.02 . 1 . . . . B 702 THR HA . 34461 1 2063 . 2 . 2 16 16 THR HB H 1 4.237 0.02 . 1 . . . . B 702 THR HB . 34461 1 2064 . 2 . 2 16 16 THR HG21 H 1 1.235 0.02 . 1 . . . . B 702 THR HG21 . 34461 1 2065 . 2 . 2 16 16 THR HG22 H 1 1.235 0.02 . 1 . . . . B 702 THR HG22 . 34461 1 2066 . 2 . 2 16 16 THR HG23 H 1 1.235 0.02 . 1 . . . . B 702 THR HG23 . 34461 1 2067 . 2 . 2 16 16 THR CA C 13 62.099 0.1 . 1 . . . . B 702 THR CA . 34461 1 2068 . 2 . 2 16 16 THR CB C 13 69.833 0.1 . 1 . . . . B 702 THR CB . 34461 1 2069 . 2 . 2 16 16 THR CG2 C 13 21.606 0.1 . 1 . . . . B 702 THR CG2 . 34461 1 2070 . 2 . 2 16 16 THR N N 15 114.856 0.1 . 1 . . . . B 702 THR N . 34461 1 2071 . 2 . 2 17 17 VAL H H 1 8.194 0.02 . 1 . . . . B 703 VAL H . 34461 1 2072 . 2 . 2 17 17 VAL HA H 1 4.164 0.02 . 1 . . . . B 703 VAL HA . 34461 1 2073 . 2 . 2 17 17 VAL HB H 1 2.127 0.02 . 1 . . . . B 703 VAL HB . 34461 1 2074 . 2 . 2 17 17 VAL HG11 H 1 0.963 0.02 . 2 . . . . B 703 VAL HG11 . 34461 1 2075 . 2 . 2 17 17 VAL HG12 H 1 0.963 0.02 . 2 . . . . B 703 VAL HG12 . 34461 1 2076 . 2 . 2 17 17 VAL HG13 H 1 0.963 0.02 . 2 . . . . B 703 VAL HG13 . 34461 1 2077 . 2 . 2 17 17 VAL HG21 H 1 0.955 0.02 . 2 . . . . B 703 VAL HG21 . 34461 1 2078 . 2 . 2 17 17 VAL HG22 H 1 0.955 0.02 . 2 . . . . B 703 VAL HG22 . 34461 1 2079 . 2 . 2 17 17 VAL HG23 H 1 0.955 0.02 . 2 . . . . B 703 VAL HG23 . 34461 1 2080 . 2 . 2 17 17 VAL CA C 13 62.577 0.1 . 1 . . . . B 703 VAL CA . 34461 1 2081 . 2 . 2 17 17 VAL CB C 13 32.690 0.1 . 1 . . . . B 703 VAL CB . 34461 1 2082 . 2 . 2 17 17 VAL CG1 C 13 21.051 0.1 . 2 . . . . B 703 VAL CG1 . 34461 1 2083 . 2 . 2 17 17 VAL CG2 C 13 20.298 0.1 . 2 . . . . B 703 VAL CG2 . 34461 1 2084 . 2 . 2 17 17 VAL N N 15 122.776 0.1 . 1 . . . . B 703 VAL N . 34461 1 2085 . 2 . 2 18 18 SER H H 1 8.446 0.02 . 1 . . . . B 704 SER H . 34461 1 2086 . 2 . 2 18 18 SER HA H 1 4.473 0.02 . 1 . . . . B 704 SER HA . 34461 1 2087 . 2 . 2 18 18 SER HB3 H 1 3.865 0.02 . 2 . . . . B 704 SER HB2 . 34461 1 2088 . 2 . 2 18 18 SER CA C 13 58.142 0.1 . 1 . . . . B 704 SER CA . 34461 1 2089 . 2 . 2 18 18 SER CB C 13 63.832 0.1 . 1 . . . . B 704 SER CB . 34461 1 2090 . 2 . 2 18 18 SER N N 15 119.914 0.1 . 1 . . . . B 704 SER N . 34461 1 2091 . 2 . 2 19 19 ALA H H 1 8.350 0.02 . 1 . . . . B 705 ALA H . 34461 1 2092 . 2 . 2 19 19 ALA HA H 1 4.307 0.02 . 1 . . . . B 705 ALA HA . 34461 1 2093 . 2 . 2 19 19 ALA HB1 H 1 1.393 0.02 . 1 . . . . B 705 ALA HB1 . 34461 1 2094 . 2 . 2 19 19 ALA HB2 H 1 1.393 0.02 . 1 . . . . B 705 ALA HB2 . 34461 1 2095 . 2 . 2 19 19 ALA HB3 H 1 1.393 0.02 . 1 . . . . B 705 ALA HB3 . 34461 1 2096 . 2 . 2 19 19 ALA CA C 13 52.376 0.1 . 1 . . . . B 705 ALA CA . 34461 1 2097 . 2 . 2 19 19 ALA CB C 13 19.328 0.1 . 1 . . . . B 705 ALA CB . 34461 1 2098 . 2 . 2 19 19 ALA N N 15 126.563 0.1 . 1 . . . . B 705 ALA N . 34461 1 2099 . 2 . 2 20 20 ALA H H 1 8.181 0.02 . 1 . . . . B 706 ALA H . 34461 1 2100 . 2 . 2 20 20 ALA HA H 1 4.310 0.02 . 1 . . . . B 706 ALA HA . 34461 1 2101 . 2 . 2 20 20 ALA HB1 H 1 1.378 0.02 . 1 . . . . B 706 ALA HB1 . 34461 1 2102 . 2 . 2 20 20 ALA HB2 H 1 1.378 0.02 . 1 . . . . B 706 ALA HB2 . 34461 1 2103 . 2 . 2 20 20 ALA HB3 H 1 1.378 0.02 . 1 . . . . B 706 ALA HB3 . 34461 1 2104 . 2 . 2 20 20 ALA CA C 13 52.132 0.1 . 1 . . . . B 706 ALA CA . 34461 1 2105 . 2 . 2 20 20 ALA CB C 13 19.408 0.1 . 1 . . . . B 706 ALA CB . 34461 1 2106 . 2 . 2 20 20 ALA N N 15 123.207 0.1 . 1 . . . . B 706 ALA N . 34461 1 2107 . 2 . 2 21 21 ASP H H 1 8.272 0.02 . 1 . . . . B 707 ASP H . 34461 1 2108 . 2 . 2 21 21 ASP HA H 1 4.848 0.02 . 1 . . . . B 707 ASP HA . 34461 1 2109 . 2 . 2 21 21 ASP HB2 H 1 2.726 0.02 . 2 . . . . B 707 ASP HB1 . 34461 1 2110 . 2 . 2 21 21 ASP HB3 H 1 2.483 0.02 . 2 . . . . B 707 ASP HB2 . 34461 1 2111 . 2 . 2 21 21 ASP CA C 13 52.676 0.1 . 1 . . . . B 707 ASP CA . 34461 1 2112 . 2 . 2 21 21 ASP CB C 13 40.714 0.1 . 1 . . . . B 707 ASP CB . 34461 1 2113 . 2 . 2 21 21 ASP N N 15 121.474 0.1 . 1 . . . . B 707 ASP N . 34461 1 2114 . 2 . 2 22 22 PRO HA H 1 4.382 0.02 . 1 . . . . B 708 PRO HA . 34461 1 2115 . 2 . 2 22 22 PRO HB2 H 1 1.863 0.02 . 2 . . . . B 708 PRO HB1 . 34461 1 2116 . 2 . 2 22 22 PRO HB3 H 1 2.249 0.02 . 2 . . . . B 708 PRO HB2 . 34461 1 2117 . 2 . 2 22 22 PRO HG3 H 1 2.037 0.02 . 2 . . . . B 708 PRO HG2 . 34461 1 2118 . 2 . 2 22 22 PRO HD2 H 1 3.687 0.02 . 2 . . . . B 708 PRO HD1 . 34461 1 2119 . 2 . 2 22 22 PRO HD3 H 1 3.806 0.02 . 2 . . . . B 708 PRO HD2 . 34461 1 2120 . 2 . 2 22 22 PRO CA C 13 62.957 0.1 . 1 . . . . B 708 PRO CA . 34461 1 2121 . 2 . 2 22 22 PRO CB C 13 32.158 0.1 . 1 . . . . B 708 PRO CB . 34461 1 2122 . 2 . 2 22 22 PRO CG C 13 27.299 0.1 . 1 . . . . B 708 PRO CG . 34461 1 2123 . 2 . 2 22 22 PRO CD C 13 50.591 0.1 . 1 . . . . B 708 PRO CD . 34461 1 2124 . 2 . 2 23 23 GLU H H 1 8.394 0.02 . 1 . . . . B 709 GLU H . 34461 1 2125 . 2 . 2 23 23 GLU HA H 1 4.156 0.02 . 1 . . . . B 709 GLU HA . 34461 1 2126 . 2 . 2 23 23 GLU HB3 H 1 1.865 0.02 . 2 . . . . B 709 GLU HB2 . 34461 1 2127 . 2 . 2 23 23 GLU CA C 13 56.324 0.1 . 1 . . . . B 709 GLU CA . 34461 1 2128 . 2 . 2 23 23 GLU CB C 13 30.215 0.1 . 1 . . . . B 709 GLU CB . 34461 1 2129 . 2 . 2 23 23 GLU CG C 13 36.344 0.1 . 1 . . . . B 709 GLU CG . 34461 1 2130 . 2 . 2 23 23 GLU N N 15 120.830 0.1 . 1 . . . . B 709 GLU N . 34461 1 2131 . 2 . 2 24 24 PHE HA H 1 5.126 0.02 . 1 . . . . B 710 PHE HA . 34461 1 2132 . 2 . 2 24 24 PHE HB2 H 1 3.060 0.02 . 2 . . . . B 710 PHE HB1 . 34461 1 2133 . 2 . 2 24 24 PHE HB3 H 1 3.323 0.02 . 2 . . . . B 710 PHE HB2 . 34461 1 2134 . 2 . 2 24 24 PHE CA C 13 55.947 0.1 . 1 . . . . B 710 PHE CA . 34461 1 2135 . 2 . 2 24 24 PHE CB C 13 40.639 0.1 . 1 . . . . B 710 PHE CB . 34461 1 2136 . 2 . 2 25 25 CYS H H 1 8.384 0.02 . 1 . . . . B 711 CYS H . 34461 1 2137 . 2 . 2 25 25 CYS HA H 1 4.285 0.02 . 1 . . . . B 711 CYS HA . 34461 1 2138 . 2 . 2 25 25 CYS HB2 H 1 2.745 0.02 . 2 . . . . B 711 CYS HB1 . 34461 1 2139 . 2 . 2 25 25 CYS HB3 H 1 3.003 0.02 . 2 . . . . B 711 CYS HB2 . 34461 1 2140 . 2 . 2 25 25 CYS CA C 13 62.064 0.1 . 1 . . . . B 711 CYS CA . 34461 1 2141 . 2 . 2 25 25 CYS CB C 13 31.639 0.1 . 1 . . . . B 711 CYS CB . 34461 1 2142 . 2 . 2 25 25 CYS N N 15 123.980 0.1 . 1 . . . . B 711 CYS N . 34461 1 2143 . 2 . 2 26 26 HIS H H 1 7.204 0.02 . 1 . . . . B 712 HIS H . 34461 1 2144 . 2 . 2 26 26 HIS HB2 H 1 3.136 0.02 . 2 . . . . B 712 HIS HB1 . 34461 1 2145 . 2 . 2 26 26 HIS HB3 H 1 3.298 0.02 . 2 . . . . B 712 HIS HB2 . 34461 1 2146 . 2 . 2 26 26 HIS HD2 H 1 7.283 0.02 . 1 . . . . B 712 HIS HD2 . 34461 1 2147 . 2 . 2 26 26 HIS HE1 H 1 7.464 0.02 . 1 . . . . B 712 HIS HE1 . 34461 1 2148 . 2 . 2 26 26 HIS CD2 C 13 120.566 0.1 . 1 . . . . B 712 HIS CD2 . 34461 1 2149 . 2 . 2 26 26 HIS CE1 C 13 138.122 0.1 . 1 . . . . B 712 HIS CE1 . 34461 1 2150 . 2 . 2 26 26 HIS N N 15 110.598 0.1 . 1 . . . . B 712 HIS N . 34461 1 2151 . 2 . 2 27 27 PRO HA H 1 4.013 0.02 . 1 . . . . B 713 PRO HA . 34461 1 2152 . 2 . 2 27 27 PRO HB2 H 1 1.837 0.02 . 2 . . . . B 713 PRO HB1 . 34461 1 2153 . 2 . 2 27 27 PRO HB3 H 1 2.377 0.02 . 2 . . . . B 713 PRO HB2 . 34461 1 2154 . 2 . 2 27 27 PRO HG2 H 1 1.521 0.02 . 2 . . . . B 713 PRO HG1 . 34461 1 2155 . 2 . 2 27 27 PRO HG3 H 1 1.645 0.02 . 2 . . . . B 713 PRO HG2 . 34461 1 2156 . 2 . 2 27 27 PRO CA C 13 66.074 0.1 . 1 . . . . B 713 PRO CA . 34461 1 2157 . 2 . 2 28 28 LEU H H 1 7.217 0.02 . 1 . . . . B 714 LEU H . 34461 1 2158 . 2 . 2 28 28 LEU HA H 1 4.622 0.02 . 1 . . . . B 714 LEU HA . 34461 1 2159 . 2 . 2 28 28 LEU HB2 H 1 1.686 0.02 . 2 . . . . B 714 LEU HB1 . 34461 1 2160 . 2 . 2 28 28 LEU HB3 H 1 2.044 0.02 . 2 . . . . B 714 LEU HB2 . 34461 1 2161 . 2 . 2 28 28 LEU HG H 1 1.648 0.02 . 1 . . . . B 714 LEU HG . 34461 1 2162 . 2 . 2 28 28 LEU HD11 H 1 0.642 0.02 . 2 . . . . B 714 LEU HD11 . 34461 1 2163 . 2 . 2 28 28 LEU HD12 H 1 0.642 0.02 . 2 . . . . B 714 LEU HD12 . 34461 1 2164 . 2 . 2 28 28 LEU HD13 H 1 0.642 0.02 . 2 . . . . B 714 LEU HD13 . 34461 1 2165 . 2 . 2 28 28 LEU HD21 H 1 0.803 0.02 . 2 . . . . B 714 LEU HD21 . 34461 1 2166 . 2 . 2 28 28 LEU HD22 H 1 0.803 0.02 . 2 . . . . B 714 LEU HD22 . 34461 1 2167 . 2 . 2 28 28 LEU HD23 H 1 0.803 0.02 . 2 . . . . B 714 LEU HD23 . 34461 1 2168 . 2 . 2 28 28 LEU CA C 13 52.115 0.1 . 1 . . . . B 714 LEU CA . 34461 1 2169 . 2 . 2 28 28 LEU CG C 13 27.225 0.1 . 1 . . . . B 714 LEU CG . 34461 1 2170 . 2 . 2 28 28 LEU CD1 C 13 25.596 0.1 . 2 . . . . B 714 LEU CD1 . 34461 1 2171 . 2 . 2 28 28 LEU CD2 C 13 20.410 0.1 . 2 . . . . B 714 LEU CD2 . 34461 1 2172 . 2 . 2 28 28 LEU N N 15 111.119 0.1 . 1 . . . . B 714 LEU N . 34461 1 2173 . 2 . 2 29 29 CYS H H 1 6.859 0.02 . 1 . . . . B 715 CYS H . 34461 1 2174 . 2 . 2 29 29 CYS HA H 1 3.445 0.02 . 1 . . . . B 715 CYS HA . 34461 1 2175 . 2 . 2 29 29 CYS HB2 H 1 1.846 0.02 . 2 . . . . B 715 CYS HB1 . 34461 1 2176 . 2 . 2 29 29 CYS HB3 H 1 3.052 0.02 . 2 . . . . B 715 CYS HB2 . 34461 1 2177 . 2 . 2 29 29 CYS CA C 13 62.150 0.1 . 1 . . . . B 715 CYS CA . 34461 1 2178 . 2 . 2 29 29 CYS CB C 13 30.880 0.1 . 1 . . . . B 715 CYS CB . 34461 1 2179 . 2 . 2 29 29 CYS N N 15 123.868 0.1 . 1 . . . . B 715 CYS N . 34461 1 2180 . 2 . 2 30 30 GLN H H 1 8.494 0.02 . 1 . . . . B 716 GLN H . 34461 1 2181 . 2 . 2 30 30 GLN HA H 1 4.524 0.02 . 1 . . . . B 716 GLN HA . 34461 1 2182 . 2 . 2 30 30 GLN HB2 H 1 1.358 0.02 . 2 . . . . B 716 GLN HB1 . 34461 1 2183 . 2 . 2 30 30 GLN HB3 H 1 1.743 0.02 . 2 . . . . B 716 GLN HB2 . 34461 1 2184 . 2 . 2 30 30 GLN HG3 H 1 2.468 0.02 . 2 . . . . B 716 GLN HG2 . 34461 1 2185 . 2 . 2 30 30 GLN HE21 H 1 7.832 0.02 . 1 . . . . B 716 GLN HE21 . 34461 1 2186 . 2 . 2 30 30 GLN HE22 H 1 6.605 0.02 . 1 . . . . B 716 GLN HE22 . 34461 1 2187 . 2 . 2 30 30 GLN CA C 13 54.662 0.1 . 1 . . . . B 716 GLN CA . 34461 1 2188 . 2 . 2 30 30 GLN N N 15 126.805 0.1 . 1 . . . . B 716 GLN N . 34461 1 2189 . 2 . 2 30 30 GLN NE2 N 15 111.495 0.1 . 1 . . . . B 716 GLN NE2 . 34461 1 2190 . 2 . 2 31 31 CYS H H 1 9.792 0.02 . 1 . . . . B 717 CYS H . 34461 1 2191 . 2 . 2 31 31 CYS HA H 1 4.823 0.02 . 1 . . . . B 717 CYS HA . 34461 1 2192 . 2 . 2 31 31 CYS HB2 H 1 2.970 0.02 . 2 . . . . B 717 CYS HB1 . 34461 1 2193 . 2 . 2 31 31 CYS HB3 H 1 2.970 0.02 . 2 . . . . B 717 CYS HB2 . 34461 1 2194 . 2 . 2 31 31 CYS CA C 13 59.037 0.1 . 1 . . . . B 717 CYS CA . 34461 1 2195 . 2 . 2 31 31 CYS CB C 13 27.425 0.1 . 1 . . . . B 717 CYS CB . 34461 1 2196 . 2 . 2 31 31 CYS N N 15 127.269 0.1 . 1 . . . . B 717 CYS N . 34461 1 2197 . 2 . 2 32 32 PRO HA H 1 4.309 0.02 . 1 . . . . B 718 PRO HA . 34461 1 2198 . 2 . 2 32 32 PRO HB3 H 1 2.463 0.02 . 2 . . . . B 718 PRO HB2 . 34461 1 2199 . 2 . 2 32 32 PRO HG2 H 1 1.929 0.02 . 2 . . . . B 718 PRO HG1 . 34461 1 2200 . 2 . 2 32 32 PRO HG3 H 1 2.135 0.02 . 2 . . . . B 718 PRO HG2 . 34461 1 2201 . 2 . 2 32 32 PRO HD2 H 1 3.950 0.02 . 2 . . . . B 718 PRO HD1 . 34461 1 2202 . 2 . 2 32 32 PRO HD3 H 1 3.701 0.02 . 2 . . . . B 718 PRO HD2 . 34461 1 2203 . 2 . 2 32 32 PRO CA C 13 65.488 0.1 . 1 . . . . B 718 PRO CA . 34461 1 2204 . 2 . 2 32 32 PRO CB C 13 32.194 0.1 . 1 . . . . B 718 PRO CB . 34461 1 2205 . 2 . 2 32 32 PRO CG C 13 28.009 0.1 . 1 . . . . B 718 PRO CG . 34461 1 2206 . 2 . 2 32 32 PRO CD C 13 50.506 0.1 . 1 . . . . B 718 PRO CD . 34461 1 2207 . 2 . 2 33 33 LYS H H 1 8.775 0.02 . 1 . . . . B 719 LYS H . 34461 1 2208 . 2 . 2 33 33 LYS HA H 1 4.215 0.02 . 1 . . . . B 719 LYS HA . 34461 1 2209 . 2 . 2 33 33 LYS HB3 H 1 1.853 0.02 . 2 . . . . B 719 LYS HB2 . 34461 1 2210 . 2 . 2 33 33 LYS CA C 13 58.444 0.1 . 1 . . . . B 719 LYS CA . 34461 1 2211 . 2 . 2 33 33 LYS N N 15 118.232 0.1 . 1 . . . . B 719 LYS N . 34461 1 2212 . 2 . 2 34 34 CYS H H 1 7.912 0.02 . 1 . . . . B 720 CYS H . 34461 1 2213 . 2 . 2 34 34 CYS HA H 1 4.097 0.02 . 1 . . . . B 720 CYS HA . 34461 1 2214 . 2 . 2 34 34 CYS HB2 H 1 2.458 0.02 . 2 . . . . B 720 CYS HB1 . 34461 1 2215 . 2 . 2 34 34 CYS HB3 H 1 2.914 0.02 . 2 . . . . B 720 CYS HB2 . 34461 1 2216 . 2 . 2 34 34 CYS CA C 13 61.982 0.1 . 1 . . . . B 720 CYS CA . 34461 1 2217 . 2 . 2 34 34 CYS CB C 13 31.850 0.1 . 1 . . . . B 720 CYS CB . 34461 1 2218 . 2 . 2 34 34 CYS N N 15 123.189 0.1 . 1 . . . . B 720 CYS N . 34461 1 2219 . 2 . 2 35 35 ALA H H 1 8.465 0.02 . 1 . . . . B 721 ALA H . 34461 1 2220 . 2 . 2 35 35 ALA HA H 1 4.485 0.02 . 1 . . . . B 721 ALA HA . 34461 1 2221 . 2 . 2 35 35 ALA HB1 H 1 1.240 0.02 . 1 . . . . B 721 ALA HB1 . 34461 1 2222 . 2 . 2 35 35 ALA HB2 H 1 1.240 0.02 . 1 . . . . B 721 ALA HB2 . 34461 1 2223 . 2 . 2 35 35 ALA HB3 H 1 1.240 0.02 . 1 . . . . B 721 ALA HB3 . 34461 1 2224 . 2 . 2 35 35 ALA CA C 13 54.483 0.1 . 1 . . . . B 721 ALA CA . 34461 1 2225 . 2 . 2 35 35 ALA CB C 13 17.922 0.1 . 1 . . . . B 721 ALA CB . 34461 1 2226 . 2 . 2 35 35 ALA N N 15 122.907 0.1 . 1 . . . . B 721 ALA N . 34461 1 2227 . 2 . 2 36 36 PRO HA H 1 4.389 0.02 . 1 . . . . B 722 PRO HA . 34461 1 2228 . 2 . 2 36 36 PRO HD3 H 1 3.543 0.02 . 2 . . . . B 722 PRO HD2 . 34461 1 2229 . 2 . 2 36 36 PRO CA C 13 64.570 0.1 . 1 . . . . B 722 PRO CA . 34461 1 2230 . 2 . 2 36 36 PRO CD C 13 50.695 0.1 . 1 . . . . B 722 PRO CD . 34461 1 2231 . 2 . 2 37 37 ALA H H 1 7.994 0.02 . 1 . . . . B 723 ALA H . 34461 1 2232 . 2 . 2 37 37 ALA HA H 1 4.285 0.02 . 1 . . . . B 723 ALA HA . 34461 1 2233 . 2 . 2 37 37 ALA HB1 H 1 1.504 0.02 . 1 . . . . B 723 ALA HB1 . 34461 1 2234 . 2 . 2 37 37 ALA HB2 H 1 1.504 0.02 . 1 . . . . B 723 ALA HB2 . 34461 1 2235 . 2 . 2 37 37 ALA HB3 H 1 1.504 0.02 . 1 . . . . B 723 ALA HB3 . 34461 1 2236 . 2 . 2 37 37 ALA CA C 13 53.351 0.1 . 1 . . . . B 723 ALA CA . 34461 1 2237 . 2 . 2 37 37 ALA CB C 13 19.124 0.1 . 1 . . . . B 723 ALA CB . 34461 1 2238 . 2 . 2 37 37 ALA N N 15 122.099 0.1 . 1 . . . . B 723 ALA N . 34461 1 2239 . 2 . 2 38 38 GLN H H 1 8.278 0.02 . 1 . . . . B 724 GLN H . 34461 1 2240 . 2 . 2 38 38 GLN HA H 1 4.168 0.02 . 1 . . . . B 724 GLN HA . 34461 1 2241 . 2 . 2 38 38 GLN HB2 H 1 1.927 0.02 . 2 . . . . B 724 GLN HB1 . 34461 1 2242 . 2 . 2 38 38 GLN HB3 H 1 1.890 0.02 . 2 . . . . B 724 GLN HB2 . 34461 1 2243 . 2 . 2 38 38 GLN HG2 H 1 2.323 0.02 . 2 . . . . B 724 GLN HG1 . 34461 1 2244 . 2 . 2 38 38 GLN HG3 H 1 2.254 0.02 . 2 . . . . B 724 GLN HG2 . 34461 1 2245 . 2 . 2 38 38 GLN HE21 H 1 7.571 0.02 . 1 . . . . B 724 GLN HE21 . 34461 1 2246 . 2 . 2 38 38 GLN HE22 H 1 6.616 0.02 . 1 . . . . B 724 GLN HE22 . 34461 1 2247 . 2 . 2 38 38 GLN CA C 13 56.938 0.1 . 1 . . . . B 724 GLN CA . 34461 1 2248 . 2 . 2 38 38 GLN CB C 13 30.026 0.1 . 1 . . . . B 724 GLN CB . 34461 1 2249 . 2 . 2 38 38 GLN CG C 13 36.333 0.1 . 1 . . . . B 724 GLN CG . 34461 1 2250 . 2 . 2 38 38 GLN N N 15 118.677 0.1 . 1 . . . . B 724 GLN N . 34461 1 2251 . 2 . 2 38 38 GLN NE2 N 15 111.495 0.1 . 1 . . . . B 724 GLN NE2 . 34461 1 2252 . 2 . 2 39 39 LYS H H 1 8.023 0.02 . 1 . . . . B 725 LYS H . 34461 1 2253 . 2 . 2 39 39 LYS HA H 1 4.590 0.02 . 1 . . . . B 725 LYS HA . 34461 1 2254 . 2 . 2 39 39 LYS CA C 13 57.843 0.1 . 1 . . . . B 725 LYS CA . 34461 1 2255 . 2 . 2 39 39 LYS N N 15 119.999 0.1 . 1 . . . . B 725 LYS N . 34461 1 2256 . 2 . 2 40 40 ARG HA H 1 4.216 0.02 . 1 . . . . B 726 ARG HA . 34461 1 2257 . 2 . 2 40 40 ARG HB2 H 1 1.868 0.02 . 2 . . . . B 726 ARG HB1 . 34461 1 2258 . 2 . 2 40 40 ARG HB3 H 1 1.776 0.02 . 2 . . . . B 726 ARG HB2 . 34461 1 2259 . 2 . 2 40 40 ARG HG2 H 1 1.681 0.02 . 2 . . . . B 726 ARG HG1 . 34461 1 2260 . 2 . 2 40 40 ARG HG3 H 1 1.631 0.02 . 2 . . . . B 726 ARG HG2 . 34461 1 2261 . 2 . 2 40 40 ARG HD3 H 1 3.227 0.02 . 2 . . . . B 726 ARG HD2 . 34461 1 2262 . 2 . 2 40 40 ARG CA C 13 57.222 0.1 . 1 . . . . B 726 ARG CA . 34461 1 2263 . 2 . 2 40 40 ARG CB C 13 30.794 0.1 . 1 . . . . B 726 ARG CB . 34461 1 2264 . 2 . 2 40 40 ARG CG C 13 27.308 0.1 . 1 . . . . B 726 ARG CG . 34461 1 2265 . 2 . 2 40 40 ARG CD C 13 43.432 0.1 . 1 . . . . B 726 ARG CD . 34461 1 2266 . 2 . 2 41 41 LEU H H 1 8.089 0.02 . 1 . . . . B 727 LEU H . 34461 1 2267 . 2 . 2 41 41 LEU CA C 13 55.197 0.1 . 1 . . . . B 727 LEU CA . 34461 1 2268 . 2 . 2 41 41 LEU CB C 13 42.402 0.1 . 1 . . . . B 727 LEU CB . 34461 1 2269 . 2 . 2 41 41 LEU N N 15 122.288 0.1 . 1 . . . . B 727 LEU N . 34461 1 2270 . 2 . 2 42 42 ALA H H 1 8.042 0.02 . 1 . . . . B 728 ALA H . 34461 1 2271 . 2 . 2 42 42 ALA HA H 1 4.311 0.02 . 1 . . . . B 728 ALA HA . 34461 1 2272 . 2 . 2 42 42 ALA CA C 13 52.457 0.1 . 1 . . . . B 728 ALA CA . 34461 1 2273 . 2 . 2 42 42 ALA N N 15 124.081 0.1 . 1 . . . . B 728 ALA N . 34461 1 2274 . 2 . 2 43 43 LYS H H 1 8.185 0.02 . 1 . . . . B 729 LYS H . 34461 1 2275 . 2 . 2 43 43 LYS HA H 1 4.333 0.02 . 1 . . . . B 729 LYS HA . 34461 1 2276 . 2 . 2 43 43 LYS HB2 H 1 1.821 0.02 . 2 . . . . B 729 LYS HB1 . 34461 1 2277 . 2 . 2 43 43 LYS HB3 H 1 1.767 0.02 . 2 . . . . B 729 LYS HB2 . 34461 1 2278 . 2 . 2 43 43 LYS HG2 H 1 1.522 0.02 . 2 . . . . B 729 LYS HG1 . 34461 1 2279 . 2 . 2 43 43 LYS HG3 H 1 1.410 0.02 . 2 . . . . B 729 LYS HG2 . 34461 1 2280 . 2 . 2 43 43 LYS HD2 H 1 1.696 0.02 . 2 . . . . B 729 LYS HD1 . 34461 1 2281 . 2 . 2 43 43 LYS HD3 H 1 1.738 0.02 . 2 . . . . B 729 LYS HD2 . 34461 1 2282 . 2 . 2 43 43 LYS HE3 H 1 3.020 0.02 . 2 . . . . B 729 LYS HE2 . 34461 1 2283 . 2 . 2 43 43 LYS CA C 13 56.133 0.1 . 1 . . . . B 729 LYS CA . 34461 1 2284 . 2 . 2 43 43 LYS CB C 13 33.085 0.1 . 1 . . . . B 729 LYS CB . 34461 1 2285 . 2 . 2 43 43 LYS CG C 13 24.755 0.1 . 1 . . . . B 729 LYS CG . 34461 1 2286 . 2 . 2 43 43 LYS CD C 13 29.162 0.1 . 1 . . . . B 729 LYS CD . 34461 1 2287 . 2 . 2 43 43 LYS CE C 13 42.235 0.1 . 1 . . . . B 729 LYS CE . 34461 1 2288 . 2 . 2 43 43 LYS N N 15 120.684 0.1 . 1 . . . . B 729 LYS N . 34461 1 2289 . 2 . 2 44 44 VAL H H 1 8.189 0.02 . 1 . . . . B 730 VAL H . 34461 1 2290 . 2 . 2 44 44 VAL HA H 1 4.436 0.02 . 1 . . . . B 730 VAL HA . 34461 1 2291 . 2 . 2 44 44 VAL HB H 1 2.111 0.02 . 1 . . . . B 730 VAL HB . 34461 1 2292 . 2 . 2 44 44 VAL HG11 H 1 1.016 0.02 . 2 . . . . B 730 VAL HG11 . 34461 1 2293 . 2 . 2 44 44 VAL HG12 H 1 1.016 0.02 . 2 . . . . B 730 VAL HG12 . 34461 1 2294 . 2 . 2 44 44 VAL HG13 H 1 1.016 0.02 . 2 . . . . B 730 VAL HG13 . 34461 1 2295 . 2 . 2 44 44 VAL HG21 H 1 0.977 0.02 . 2 . . . . B 730 VAL HG21 . 34461 1 2296 . 2 . 2 44 44 VAL HG22 H 1 0.977 0.02 . 2 . . . . B 730 VAL HG22 . 34461 1 2297 . 2 . 2 44 44 VAL HG23 H 1 0.977 0.02 . 2 . . . . B 730 VAL HG23 . 34461 1 2298 . 2 . 2 44 44 VAL CA C 13 59.913 0.1 . 1 . . . . B 730 VAL CA . 34461 1 2299 . 2 . 2 44 44 VAL CB C 13 32.636 0.1 . 1 . . . . B 730 VAL CB . 34461 1 2300 . 2 . 2 44 44 VAL CG1 C 13 21.046 0.1 . 2 . . . . B 730 VAL CG1 . 34461 1 2301 . 2 . 2 44 44 VAL CG2 C 13 20.295 0.1 . 2 . . . . B 730 VAL CG2 . 34461 1 2302 . 2 . 2 44 44 VAL N N 15 123.111 0.1 . 1 . . . . B 730 VAL N . 34461 1 2303 . 2 . 2 45 45 PRO HA H 1 4.429 0.02 . 1 . . . . B 731 PRO HA . 34461 1 2304 . 2 . 2 45 45 PRO HB2 H 1 1.957 0.02 . 2 . . . . B 731 PRO HB1 . 34461 1 2305 . 2 . 2 45 45 PRO HB3 H 1 2.333 0.02 . 2 . . . . B 731 PRO HB2 . 34461 1 2306 . 2 . 2 45 45 PRO HG2 H 1 1.996 0.02 . 2 . . . . B 731 PRO HG1 . 34461 1 2307 . 2 . 2 45 45 PRO HG3 H 1 2.076 0.02 . 2 . . . . B 731 PRO HG2 . 34461 1 2308 . 2 . 2 45 45 PRO HD2 H 1 3.708 0.02 . 2 . . . . B 731 PRO HD1 . 34461 1 2309 . 2 . 2 45 45 PRO HD3 H 1 3.886 0.02 . 2 . . . . B 731 PRO HD2 . 34461 1 2310 . 2 . 2 45 45 PRO CA C 13 63.139 0.1 . 1 . . . . B 731 PRO CA . 34461 1 2311 . 2 . 2 45 45 PRO CB C 13 32.195 0.1 . 1 . . . . B 731 PRO CB . 34461 1 2312 . 2 . 2 45 45 PRO CG C 13 27.425 0.1 . 1 . . . . B 731 PRO CG . 34461 1 2313 . 2 . 2 45 45 PRO CD C 13 51.038 0.1 . 1 . . . . B 731 PRO CD . 34461 1 2314 . 2 . 2 46 46 ALA H H 1 8.472 0.02 . 1 . . . . B 732 ALA H . 34461 1 2315 . 2 . 2 46 46 ALA HA H 1 4.321 0.02 . 1 . . . . B 732 ALA HA . 34461 1 2316 . 2 . 2 46 46 ALA HB1 H 1 1.457 0.02 . 1 . . . . B 732 ALA HB1 . 34461 1 2317 . 2 . 2 46 46 ALA HB2 H 1 1.457 0.02 . 1 . . . . B 732 ALA HB2 . 34461 1 2318 . 2 . 2 46 46 ALA HB3 H 1 1.457 0.02 . 1 . . . . B 732 ALA HB3 . 34461 1 2319 . 2 . 2 46 46 ALA CA C 13 52.707 0.1 . 1 . . . . B 732 ALA CA . 34461 1 2320 . 2 . 2 46 46 ALA CB C 13 19.156 0.1 . 1 . . . . B 732 ALA CB . 34461 1 2321 . 2 . 2 46 46 ALA N N 15 124.684 0.1 . 1 . . . . B 732 ALA N . 34461 1 2322 . 2 . 2 47 47 SER H H 1 8.297 0.02 . 1 . . . . B 733 SER H . 34461 1 2323 . 2 . 2 47 47 SER CA C 13 58.412 0.1 . 1 . . . . B 733 SER CA . 34461 1 2324 . 2 . 2 47 47 SER CB C 13 63.894 0.1 . 1 . . . . B 733 SER CB . 34461 1 2325 . 2 . 2 47 47 SER N N 15 114.435 0.1 . 1 . . . . B 733 SER N . 34461 1 2326 . 2 . 2 48 48 GLY H H 1 8.404 0.02 . 1 . . . . B 734 GLY H . 34461 1 2327 . 2 . 2 48 48 GLY CA C 13 45.316 0.1 . 1 . . . . B 734 GLY CA . 34461 1 2328 . 2 . 2 48 48 GLY N N 15 110.577 0.1 . 1 . . . . B 734 GLY N . 34461 1 2329 . 2 . 2 49 49 LEU H H 1 8.148 0.02 . 1 . . . . B 735 LEU H . 34461 1 2330 . 2 . 2 49 49 LEU CA C 13 55.249 0.1 . 1 . . . . B 735 LEU CA . 34461 1 2331 . 2 . 2 49 49 LEU CB C 13 42.447 0.1 . 1 . . . . B 735 LEU CB . 34461 1 2332 . 2 . 2 49 49 LEU N N 15 121.325 0.1 . 1 . . . . B 735 LEU N . 34461 1 2333 . 2 . 2 50 50 GLY H H 1 8.479 0.02 . 1 . . . . B 736 GLY H . 34461 1 2334 . 2 . 2 50 50 GLY HA2 H 1 3.977 0.02 . 2 . . . . B 736 GLY HA1 . 34461 1 2335 . 2 . 2 50 50 GLY CA C 13 45.306 0.1 . 1 . . . . B 736 GLY CA . 34461 1 2336 . 2 . 2 50 50 GLY N N 15 109.686 0.1 . 1 . . . . B 736 GLY N . 34461 1 2337 . 2 . 2 51 51 VAL H H 1 7.917 0.02 . 1 . . . . B 737 VAL H . 34461 1 2338 . 2 . 2 51 51 VAL HA H 1 4.155 0.02 . 1 . . . . B 737 VAL HA . 34461 1 2339 . 2 . 2 51 51 VAL HB H 1 2.104 0.02 . 1 . . . . B 737 VAL HB . 34461 1 2340 . 2 . 2 51 51 VAL HG11 H 1 0.959 0.02 . 2 . . . . B 737 VAL HG11 . 34461 1 2341 . 2 . 2 51 51 VAL HG12 H 1 0.959 0.02 . 2 . . . . B 737 VAL HG12 . 34461 1 2342 . 2 . 2 51 51 VAL HG13 H 1 0.959 0.02 . 2 . . . . B 737 VAL HG13 . 34461 1 2343 . 2 . 2 51 51 VAL HG21 H 1 0.921 0.02 . 2 . . . . B 737 VAL HG21 . 34461 1 2344 . 2 . 2 51 51 VAL HG22 H 1 0.921 0.02 . 2 . . . . B 737 VAL HG22 . 34461 1 2345 . 2 . 2 51 51 VAL HG23 H 1 0.921 0.02 . 2 . . . . B 737 VAL HG23 . 34461 1 2346 . 2 . 2 51 51 VAL CA C 13 62.242 0.1 . 1 . . . . B 737 VAL CA . 34461 1 2347 . 2 . 2 51 51 VAL CB C 13 32.668 0.1 . 1 . . . . B 737 VAL CB . 34461 1 2348 . 2 . 2 51 51 VAL CG1 C 13 21.121 0.1 . 2 . . . . B 737 VAL CG1 . 34461 1 2349 . 2 . 2 51 51 VAL CG2 C 13 20.267 0.1 . 2 . . . . B 737 VAL CG2 . 34461 1 2350 . 2 . 2 51 51 VAL N N 15 118.662 0.1 . 1 . . . . B 737 VAL N . 34461 1 2351 . 2 . 2 52 52 ASN H H 1 8.581 0.02 . 1 . . . . B 738 ASN H . 34461 1 2352 . 2 . 2 52 52 ASN HA H 1 4.785 0.02 . 1 . . . . B 738 ASN HA . 34461 1 2353 . 2 . 2 52 52 ASN HB2 H 1 2.755 0.02 . 2 . . . . B 738 ASN HB1 . 34461 1 2354 . 2 . 2 52 52 ASN HB3 H 1 2.862 0.02 . 2 . . . . B 738 ASN HB2 . 34461 1 2355 . 2 . 2 52 52 ASN HD21 H 1 6.916 0.02 . 2 . . . . B 738 ASN HD21 . 34461 1 2356 . 2 . 2 52 52 ASN HD22 H 1 7.598 0.02 . 2 . . . . B 738 ASN HD22 . 34461 1 2357 . 2 . 2 52 52 ASN CA C 13 53.236 0.1 . 1 . . . . B 738 ASN CA . 34461 1 2358 . 2 . 2 52 52 ASN CB C 13 38.934 0.1 . 1 . . . . B 738 ASN CB . 34461 1 2359 . 2 . 2 52 52 ASN N N 15 122.402 0.1 . 1 . . . . B 738 ASN N . 34461 1 2360 . 2 . 2 52 52 ASN ND2 N 15 113.046 0.1 . 1 . . . . B 738 ASN ND2 . 34461 1 2361 . 2 . 2 53 53 VAL H H 1 8.162 0.02 . 1 . . . . B 739 VAL H . 34461 1 2362 . 2 . 2 53 53 VAL HA H 1 4.230 0.02 . 1 . . . . B 739 VAL HA . 34461 1 2363 . 2 . 2 53 53 VAL HB H 1 2.156 0.02 . 1 . . . . B 739 VAL HB . 34461 1 2364 . 2 . 2 53 53 VAL HG11 H 1 0.945 0.02 . 2 . . . . B 739 VAL HG11 . 34461 1 2365 . 2 . 2 53 53 VAL HG12 H 1 0.945 0.02 . 2 . . . . B 739 VAL HG12 . 34461 1 2366 . 2 . 2 53 53 VAL HG13 H 1 0.945 0.02 . 2 . . . . B 739 VAL HG13 . 34461 1 2367 . 2 . 2 53 53 VAL HG21 H 1 0.964 0.02 . 2 . . . . B 739 VAL HG21 . 34461 1 2368 . 2 . 2 53 53 VAL HG22 H 1 0.964 0.02 . 2 . . . . B 739 VAL HG22 . 34461 1 2369 . 2 . 2 53 53 VAL HG23 H 1 0.964 0.02 . 2 . . . . B 739 VAL HG23 . 34461 1 2370 . 2 . 2 53 53 VAL CA C 13 62.455 0.1 . 1 . . . . B 739 VAL CA . 34461 1 2371 . 2 . 2 53 53 VAL CB C 13 32.702 0.1 . 1 . . . . B 739 VAL CB . 34461 1 2372 . 2 . 2 53 53 VAL CG1 C 13 20.231 0.1 . 2 . . . . B 739 VAL CG1 . 34461 1 2373 . 2 . 2 53 53 VAL CG2 C 13 21.250 0.1 . 2 . . . . B 739 VAL CG2 . 34461 1 2374 . 2 . 2 53 53 VAL N N 15 120.599 0.1 . 1 . . . . B 739 VAL N . 34461 1 2375 . 2 . 2 54 54 THR H H 1 8.299 0.02 . 1 . . . . B 740 THR H . 34461 1 2376 . 2 . 2 54 54 THR HA H 1 4.435 0.02 . 1 . . . . B 740 THR HA . 34461 1 2377 . 2 . 2 54 54 THR HB H 1 4.253 0.02 . 1 . . . . B 740 THR HB . 34461 1 2378 . 2 . 2 54 54 THR HG21 H 1 1.238 0.02 . 1 . . . . B 740 THR HG21 . 34461 1 2379 . 2 . 2 54 54 THR HG22 H 1 1.238 0.02 . 1 . . . . B 740 THR HG22 . 34461 1 2380 . 2 . 2 54 54 THR HG23 H 1 1.238 0.02 . 1 . . . . B 740 THR HG23 . 34461 1 2381 . 2 . 2 54 54 THR CA C 13 61.737 0.1 . 1 . . . . B 740 THR CA . 34461 1 2382 . 2 . 2 54 54 THR CB C 13 69.967 0.1 . 1 . . . . B 740 THR CB . 34461 1 2383 . 2 . 2 54 54 THR CG2 C 13 21.595 0.1 . 1 . . . . B 740 THR CG2 . 34461 1 2384 . 2 . 2 54 54 THR N N 15 117.331 0.1 . 1 . . . . B 740 THR N . 34461 1 2385 . 2 . 2 55 55 SER H H 1 8.327 0.02 . 1 . . . . B 741 SER H . 34461 1 2386 . 2 . 2 55 55 SER HA H 1 4.486 0.02 . 1 . . . . B 741 SER HA . 34461 1 2387 . 2 . 2 55 55 SER HB2 H 1 3.871 0.02 . 2 . . . . B 741 SER HB1 . 34461 1 2388 . 2 . 2 55 55 SER HB3 H 1 3.927 0.02 . 2 . . . . B 741 SER HB2 . 34461 1 2389 . 2 . 2 55 55 SER CA C 13 58.304 0.1 . 1 . . . . B 741 SER CA . 34461 1 2390 . 2 . 2 55 55 SER CB C 13 63.889 0.1 . 1 . . . . B 741 SER CB . 34461 1 2391 . 2 . 2 55 55 SER N N 15 117.939 0.1 . 1 . . . . B 741 SER N . 34461 1 2392 . 2 . 2 56 56 GLN H H 1 8.522 0.02 . 1 . . . . B 742 GLN H . 34461 1 2393 . 2 . 2 56 56 GLN HA H 1 4.384 0.02 . 1 . . . . B 742 GLN HA . 34461 1 2394 . 2 . 2 56 56 GLN HB2 H 1 1.972 0.02 . 2 . . . . B 742 GLN HB1 . 34461 1 2395 . 2 . 2 56 56 GLN HB3 H 1 2.149 0.02 . 2 . . . . B 742 GLN HB2 . 34461 1 2396 . 2 . 2 56 56 GLN HE21 H 1 6.840 0.02 . 1 . . . . B 742 GLN HE21 . 34461 1 2397 . 2 . 2 56 56 GLN HE22 H 1 7.515 0.02 . 1 . . . . B 742 GLN HE22 . 34461 1 2398 . 2 . 2 56 56 GLN CA C 13 56.116 0.1 . 1 . . . . B 742 GLN CA . 34461 1 2399 . 2 . 2 56 56 GLN CB C 13 29.336 0.1 . 1 . . . . B 742 GLN CB . 34461 1 2400 . 2 . 2 56 56 GLN CG C 13 33.763 0.1 . 1 . . . . B 742 GLN CG . 34461 1 2401 . 2 . 2 56 56 GLN N N 15 122.383 0.1 . 1 . . . . B 742 GLN N . 34461 1 2402 . 2 . 2 56 56 GLN NE2 N 15 112.478 0.1 . 1 . . . . B 742 GLN NE2 . 34461 1 2403 . 2 . 2 57 57 ASP H H 1 8.329 0.02 . 1 . . . . B 743 ASP H . 34461 1 2404 . 2 . 2 57 57 ASP HA H 1 4.627 0.02 . 1 . . . . B 743 ASP HA . 34461 1 2405 . 2 . 2 57 57 ASP HB2 H 1 2.750 0.02 . 2 . . . . B 743 ASP HB1 . 34461 1 2406 . 2 . 2 57 57 ASP HB3 H 1 2.714 0.02 . 2 . . . . B 743 ASP HB2 . 34461 1 2407 . 2 . 2 57 57 ASP CA C 13 54.454 0.1 . 1 . . . . B 743 ASP CA . 34461 1 2408 . 2 . 2 57 57 ASP CB C 13 41.268 0.1 . 1 . . . . B 743 ASP CB . 34461 1 2409 . 2 . 2 57 57 ASP N N 15 120.952 0.1 . 1 . . . . B 743 ASP N . 34461 1 2410 . 2 . 2 58 58 GLY H H 1 8.338 0.02 . 1 . . . . B 744 GLY H . 34461 1 2411 . 2 . 2 58 58 GLY HA2 H 1 3.904 0.02 . 2 . . . . B 744 GLY HA1 . 34461 1 2412 . 2 . 2 58 58 GLY HA3 H 1 4.007 0.02 . 2 . . . . B 744 GLY HA2 . 34461 1 2413 . 2 . 2 58 58 GLY CA C 13 45.458 0.1 . 1 . . . . B 744 GLY CA . 34461 1 2414 . 2 . 2 58 58 GLY N N 15 109.656 0.1 . 1 . . . . B 744 GLY N . 34461 1 2415 . 2 . 2 59 59 SER H H 1 8.195 0.02 . 1 . . . . B 745 SER H . 34461 1 2416 . 2 . 2 59 59 SER HA H 1 4.428 0.02 . 1 . . . . B 745 SER HA . 34461 1 2417 . 2 . 2 59 59 SER HB3 H 1 3.802 0.02 . 2 . . . . B 745 SER HB2 . 34461 1 2418 . 2 . 2 59 59 SER CA C 13 58.573 0.1 . 1 . . . . B 745 SER CA . 34461 1 2419 . 2 . 2 59 59 SER CB C 13 63.955 0.1 . 1 . . . . B 745 SER CB . 34461 1 2420 . 2 . 2 59 59 SER N N 15 115.727 0.1 . 1 . . . . B 745 SER N . 34461 1 2421 . 2 . 2 60 60 SER H H 1 8.177 0.02 . 1 . . . . B 746 SER H . 34461 1 2422 . 2 . 2 60 60 SER HA H 1 4.476 0.02 . 1 . . . . B 746 SER HA . 34461 1 2423 . 2 . 2 60 60 SER HB3 H 1 3.770 0.02 . 2 . . . . B 746 SER HB2 . 34461 1 2424 . 2 . 2 60 60 SER CA C 13 58.313 0.1 . 1 . . . . B 746 SER CA . 34461 1 2425 . 2 . 2 60 60 SER CB C 13 64.000 0.1 . 1 . . . . B 746 SER CB . 34461 1 2426 . 2 . 2 60 60 SER N N 15 117.614 0.1 . 1 . . . . B 746 SER N . 34461 1 2427 . 2 . 2 61 61 TRP H H 1 7.722 0.02 . 1 . . . . B 747 TRP H . 34461 1 2428 . 2 . 2 61 61 TRP HA H 1 4.558 0.02 . 1 . . . . B 747 TRP HA . 34461 1 2429 . 2 . 2 61 61 TRP HB2 H 1 3.195 0.02 . 2 . . . . B 747 TRP HB1 . 34461 1 2430 . 2 . 2 61 61 TRP HB3 H 1 3.364 0.02 . 2 . . . . B 747 TRP HB2 . 34461 1 2431 . 2 . 2 61 61 TRP HE1 H 1 10.036 0.02 . 1 . . . . B 747 TRP HE1 . 34461 1 2432 . 2 . 2 61 61 TRP CA C 13 58.588 0.1 . 1 . . . . B 747 TRP CA . 34461 1 2433 . 2 . 2 61 61 TRP CB C 13 30.070 0.1 . 1 . . . . B 747 TRP CB . 34461 1 2434 . 2 . 2 61 61 TRP N N 15 127.826 0.1 . 1 . . . . B 747 TRP N . 34461 1 2435 . 2 . 2 61 61 TRP NE1 N 15 128.657 0.1 . 1 . . . . B 747 TRP NE1 . 34461 1 stop_ save_