data_4716 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4716 _Entry.Title ; 1H, 15N, and 13C NMR Backbone Assignments and Secondary Structure of the C-terminal Recombinant Fragment of Auxilin Including the J-domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2000-04-11 _Entry.Accession_date 2000-04-17 _Entry.Last_release_date 2000-07-24 _Entry.Original_release_date 2000-07-24 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Chae Han . J . 4716 2 James Gruschus . M . 4716 3 Tsvika Greener . . . 4716 4 Lois Greene . E . 4716 5 James Ferretti . . . 4716 6 Evan Eisenberg . . . 4716 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4716 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 651 4716 '13C chemical shifts' 361 4716 '15N chemical shifts' 154 4716 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 . . 2000-07-24 2000-04-11 original author . 4716 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4716 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Letter to the Editor: 1H, 15N, and 13C NMR backbone assignments and secondary structure of the C-terminal recombinant fragment of auxilin including the J-domain ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 17 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 281 _Citation.Page_last 282 _Citation.Year 2000 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Chae Han . J . 4716 1 2 James Gruschus . M . 4716 1 3 Tsvika Greener . . . 4716 1 4 Lois Greene . E . 4716 1 5 James Ferretti . . . 4716 1 6 Evan Eisenberg . . . 4716 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID Auxilin 4716 1 J-domain 4716 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_auxilin _Assembly.Sf_category assembly _Assembly.Sf_framecode system_auxilin _Assembly.Entry_ID 4716 _Assembly.ID 1 _Assembly.Name auxilin _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 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4716 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 auxilin 1 $auxilin . . . native . . . . . 4716 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID auxilin system 4716 1 auxilin abbreviation 4716 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID endocytosis 4716 1 'molecular chaperone' 4716 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_auxilin _Entity.Sf_category entity _Entity.Sf_framecode auxilin _Entity.Entry_ID 4716 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name auxilin _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPLGSPEFSMPHSSPQNRPN YNVSFSSMPGGQNERGKAAA NLEGKQKAADFEDLLSGQGF NAHKDKKGPRTIAEMRKEEM AKEMDPEKLKILEWIEGKER NIRALLSTMHTVLWAGETKW KPVGMADLVTPEQVKKVYRK AVLVVHPDKATGQPYEQYAK MIFMELNDAWSEFENQGQKP LY ; _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 . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 182 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 20563 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-24 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1N4C . "Nmr Structure Of The J-Domain And Clathrin Substrate Binding Domain Of Bovine Auxilin" . . . . . 99.45 182 100.00 100.00 1.15e-129 . . . . 4716 1 2 no PDB 1XI5 . "Clathrin D6 Coat With Auxilin J-Domain" . . . . . 62.64 114 100.00 100.00 2.75e-76 . . . . 4716 1 3 no PDB 2QWN . "Crystal Structure Of Disulfide-Bond-Crosslinked Complex Of Bovine Hsc70 (1-386aa)r171c And Bovine Auxilin (810-910aa)d876c In T" . . . . . 51.65 94 98.94 98.94 3.58e-60 . . . . 4716 1 4 no PDB 2QWO . "Crystal Structure Of Disulfide-Bond-Crosslinked Complex Of Bovine Hsc70 (1-394aa)r171c And Bovine Auxilin (810-910aa)d876c In T" . . . . . 50.55 92 98.91 98.91 1.53e-58 . . . . 4716 1 5 no PDB 2QWP . "Crystal Structure Of Disulfide-Bond-Crosslinked Complex Of Bovine Hsc70 (1-394aa)r171c And Bovine Auxilin (810-910aa)d876c In T" . . . . . 50.55 92 98.91 98.91 1.53e-58 . . . . 4716 1 6 no PDB 2QWQ . "Crystal Structure Of Disulfide-Bond-Crosslinked Complex Of Bovine Hsc70 (1-394aa)r171c And Bovine Auxilin (810-910aa)d876c In T" . . . . . 50.55 92 98.91 98.91 1.53e-58 . . . . 4716 1 7 no PDB 2QWR . "Crystal Structure Of Disulfide-Bond-Crosslinked Complex Of Bovine Hsc70 (1-394aa)r171c And Bovine Auxilin (810-910aa)d876c In T" . . . . . 50.55 92 98.91 98.91 1.53e-58 . . . . 4716 1 8 no DBJ BAA32318 . "KIAA0473 protein [Homo sapiens]" . . . . . 95.60 913 97.70 99.43 2.04e-114 . . . . 4716 1 9 no DBJ BAG11195 . "DnaJ homolog, subfamily C, member 6 [synthetic construct]" . . . . . 95.60 913 97.70 99.43 2.04e-114 . . . . 4716 1 10 no DBJ BAH12344 . "unnamed protein product [Homo sapiens]" . . . . . 95.60 900 97.70 99.43 1.71e-114 . . . . 4716 1 11 no GB AAA79037 . "auxilin [Bos taurus]" . . . . . 97.25 910 98.87 99.44 2.10e-117 . . . . 4716 1 12 no GB AAI09280 . "DNAJC6 protein [Homo sapiens]" . . . . . 95.60 970 97.70 99.43 3.40e-114 . . . . 4716 1 13 no GB AAI09281 . "DNAJC6 protein [Homo sapiens]" . . . . . 95.60 970 97.70 99.43 3.40e-114 . . . . 4716 1 14 no GB AIC59549 . "DNAJC6, partial [synthetic construct]" . . . . . 95.60 970 97.70 99.43 3.40e-114 . . . . 4716 1 15 no GB EAX06533 . "DnaJ (Hsp40) homolog, subfamily C, member 6, isoform CRA_a [Homo sapiens]" . . . . . 95.60 913 97.70 99.43 2.04e-114 . . . . 4716 1 16 no REF NP_001243793 . "putative tyrosine-protein phosphatase auxilin isoform 1 [Homo sapiens]" . . . . . 95.60 970 97.70 99.43 3.40e-114 . . . . 4716 1 17 no REF NP_001243794 . "putative tyrosine-protein phosphatase auxilin isoform 3 [Homo sapiens]" . . . . . 95.60 900 97.70 99.43 1.88e-114 . . . . 4716 1 18 no REF NP_055602 . "putative tyrosine-protein phosphatase auxilin isoform 2 [Homo sapiens]" . . . . . 95.60 913 97.70 99.43 2.04e-114 . . . . 4716 1 19 no REF NP_777261 . "putative tyrosine-protein phosphatase auxilin [Bos taurus]" . . . . . 97.25 910 98.87 99.44 2.10e-117 . . . . 4716 1 20 no REF XP_001089936 . "PREDICTED: putative tyrosine-protein phosphatase auxilin isoform 2 [Macaca mulatta]" . . . . . 95.60 900 97.70 99.43 1.90e-114 . . . . 4716 1 21 no SP O75061 . "RecName: Full=Putative tyrosine-protein phosphatase auxilin; AltName: Full=DnaJ homolog subfamily C member 6" . . . . . 95.60 913 97.70 99.43 2.04e-114 . . . . 4716 1 22 no SP Q27974 . "RecName: Full=Putative tyrosine-protein phosphatase auxilin; AltName: Full=DnaJ homolog subfamily C member 6" . . . . . 97.25 910 98.87 99.44 2.10e-117 . . . . 4716 1 23 no TPG DAA31275 . "TPA: DnaJ (Hsp40) homolog, subfamily C, member 6 [Bos taurus]" . . . . . 97.25 910 98.87 99.44 2.10e-117 . . . . 4716 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID auxilin common 4716 1 auxilin abbreviation 4716 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 . GLY . 4716 1 2 . PRO . 4716 1 3 . LEU . 4716 1 4 . GLY . 4716 1 5 . SER . 4716 1 6 . PRO . 4716 1 7 . GLU . 4716 1 8 . PHE . 4716 1 9 . SER . 4716 1 10 . MET . 4716 1 11 . PRO . 4716 1 12 . HIS . 4716 1 13 . SER . 4716 1 14 . SER . 4716 1 15 . PRO . 4716 1 16 . GLN . 4716 1 17 . ASN . 4716 1 18 . ARG . 4716 1 19 . PRO . 4716 1 20 . ASN . 4716 1 21 . TYR . 4716 1 22 . ASN . 4716 1 23 . VAL . 4716 1 24 . SER . 4716 1 25 . PHE . 4716 1 26 . SER . 4716 1 27 . SER . 4716 1 28 . MET . 4716 1 29 . PRO . 4716 1 30 . GLY . 4716 1 31 . GLY . 4716 1 32 . GLN . 4716 1 33 . ASN . 4716 1 34 . GLU . 4716 1 35 . ARG . 4716 1 36 . GLY . 4716 1 37 . LYS . 4716 1 38 . ALA . 4716 1 39 . ALA . 4716 1 40 . ALA . 4716 1 41 . ASN . 4716 1 42 . LEU . 4716 1 43 . GLU . 4716 1 44 . GLY . 4716 1 45 . LYS . 4716 1 46 . GLN . 4716 1 47 . LYS . 4716 1 48 . ALA . 4716 1 49 . ALA . 4716 1 50 . ASP . 4716 1 51 . PHE . 4716 1 52 . GLU . 4716 1 53 . ASP . 4716 1 54 . LEU . 4716 1 55 . LEU . 4716 1 56 . SER . 4716 1 57 . GLY . 4716 1 58 . GLN . 4716 1 59 . GLY . 4716 1 60 . PHE . 4716 1 61 . ASN . 4716 1 62 . ALA . 4716 1 63 . HIS . 4716 1 64 . LYS . 4716 1 65 . ASP . 4716 1 66 . LYS . 4716 1 67 . LYS . 4716 1 68 . GLY . 4716 1 69 . PRO . 4716 1 70 . ARG . 4716 1 71 . THR . 4716 1 72 . ILE . 4716 1 73 . ALA . 4716 1 74 . GLU . 4716 1 75 . MET . 4716 1 76 . ARG . 4716 1 77 . LYS . 4716 1 78 . GLU . 4716 1 79 . GLU . 4716 1 80 . MET . 4716 1 81 . ALA . 4716 1 82 . LYS . 4716 1 83 . GLU . 4716 1 84 . MET . 4716 1 85 . ASP . 4716 1 86 . PRO . 4716 1 87 . GLU . 4716 1 88 . LYS . 4716 1 89 . LEU . 4716 1 90 . LYS . 4716 1 91 . ILE . 4716 1 92 . LEU . 4716 1 93 . GLU . 4716 1 94 . TRP . 4716 1 95 . ILE . 4716 1 96 . GLU . 4716 1 97 . GLY . 4716 1 98 . LYS . 4716 1 99 . GLU . 4716 1 100 . ARG . 4716 1 101 . ASN . 4716 1 102 . ILE . 4716 1 103 . ARG . 4716 1 104 . ALA . 4716 1 105 . LEU . 4716 1 106 . LEU . 4716 1 107 . SER . 4716 1 108 . THR . 4716 1 109 . MET . 4716 1 110 . HIS . 4716 1 111 . THR . 4716 1 112 . VAL . 4716 1 113 . LEU . 4716 1 114 . TRP . 4716 1 115 . ALA . 4716 1 116 . GLY . 4716 1 117 . GLU . 4716 1 118 . THR . 4716 1 119 . LYS . 4716 1 120 . TRP . 4716 1 121 . LYS . 4716 1 122 . PRO . 4716 1 123 . VAL . 4716 1 124 . GLY . 4716 1 125 . MET . 4716 1 126 . ALA . 4716 1 127 . ASP . 4716 1 128 . LEU . 4716 1 129 . VAL . 4716 1 130 . THR . 4716 1 131 . PRO . 4716 1 132 . GLU . 4716 1 133 . GLN . 4716 1 134 . VAL . 4716 1 135 . LYS . 4716 1 136 . LYS . 4716 1 137 . VAL . 4716 1 138 . TYR . 4716 1 139 . ARG . 4716 1 140 . LYS . 4716 1 141 . ALA . 4716 1 142 . VAL . 4716 1 143 . LEU . 4716 1 144 . VAL . 4716 1 145 . VAL . 4716 1 146 . HIS . 4716 1 147 . PRO . 4716 1 148 . ASP . 4716 1 149 . LYS . 4716 1 150 . ALA . 4716 1 151 . THR . 4716 1 152 . GLY . 4716 1 153 . GLN . 4716 1 154 . PRO . 4716 1 155 . TYR . 4716 1 156 . GLU . 4716 1 157 . GLN . 4716 1 158 . TYR . 4716 1 159 . ALA . 4716 1 160 . LYS . 4716 1 161 . MET . 4716 1 162 . ILE . 4716 1 163 . PHE . 4716 1 164 . MET . 4716 1 165 . GLU . 4716 1 166 . LEU . 4716 1 167 . ASN . 4716 1 168 . ASP . 4716 1 169 . ALA . 4716 1 170 . TRP . 4716 1 171 . SER . 4716 1 172 . GLU . 4716 1 173 . PHE . 4716 1 174 . GLU . 4716 1 175 . ASN . 4716 1 176 . GLN . 4716 1 177 . GLY . 4716 1 178 . GLN . 4716 1 179 . LYS . 4716 1 180 . PRO . 4716 1 181 . LEU . 4716 1 182 . TYR . 4716 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 4716 1 . PRO 2 2 4716 1 . LEU 3 3 4716 1 . GLY 4 4 4716 1 . SER 5 5 4716 1 . PRO 6 6 4716 1 . GLU 7 7 4716 1 . PHE 8 8 4716 1 . SER 9 9 4716 1 . MET 10 10 4716 1 . PRO 11 11 4716 1 . HIS 12 12 4716 1 . SER 13 13 4716 1 . SER 14 14 4716 1 . PRO 15 15 4716 1 . GLN 16 16 4716 1 . ASN 17 17 4716 1 . ARG 18 18 4716 1 . PRO 19 19 4716 1 . ASN 20 20 4716 1 . TYR 21 21 4716 1 . ASN 22 22 4716 1 . VAL 23 23 4716 1 . SER 24 24 4716 1 . PHE 25 25 4716 1 . SER 26 26 4716 1 . SER 27 27 4716 1 . MET 28 28 4716 1 . PRO 29 29 4716 1 . GLY 30 30 4716 1 . GLY 31 31 4716 1 . GLN 32 32 4716 1 . ASN 33 33 4716 1 . GLU 34 34 4716 1 . ARG 35 35 4716 1 . GLY 36 36 4716 1 . LYS 37 37 4716 1 . ALA 38 38 4716 1 . ALA 39 39 4716 1 . ALA 40 40 4716 1 . ASN 41 41 4716 1 . LEU 42 42 4716 1 . GLU 43 43 4716 1 . GLY 44 44 4716 1 . LYS 45 45 4716 1 . GLN 46 46 4716 1 . LYS 47 47 4716 1 . ALA 48 48 4716 1 . ALA 49 49 4716 1 . ASP 50 50 4716 1 . PHE 51 51 4716 1 . GLU 52 52 4716 1 . ASP 53 53 4716 1 . LEU 54 54 4716 1 . LEU 55 55 4716 1 . SER 56 56 4716 1 . GLY 57 57 4716 1 . GLN 58 58 4716 1 . GLY 59 59 4716 1 . PHE 60 60 4716 1 . ASN 61 61 4716 1 . ALA 62 62 4716 1 . HIS 63 63 4716 1 . LYS 64 64 4716 1 . ASP 65 65 4716 1 . LYS 66 66 4716 1 . LYS 67 67 4716 1 . GLY 68 68 4716 1 . PRO 69 69 4716 1 . ARG 70 70 4716 1 . THR 71 71 4716 1 . ILE 72 72 4716 1 . ALA 73 73 4716 1 . GLU 74 74 4716 1 . MET 75 75 4716 1 . ARG 76 76 4716 1 . LYS 77 77 4716 1 . GLU 78 78 4716 1 . GLU 79 79 4716 1 . MET 80 80 4716 1 . ALA 81 81 4716 1 . LYS 82 82 4716 1 . GLU 83 83 4716 1 . MET 84 84 4716 1 . ASP 85 85 4716 1 . PRO 86 86 4716 1 . GLU 87 87 4716 1 . LYS 88 88 4716 1 . LEU 89 89 4716 1 . LYS 90 90 4716 1 . ILE 91 91 4716 1 . LEU 92 92 4716 1 . GLU 93 93 4716 1 . TRP 94 94 4716 1 . ILE 95 95 4716 1 . GLU 96 96 4716 1 . GLY 97 97 4716 1 . LYS 98 98 4716 1 . GLU 99 99 4716 1 . ARG 100 100 4716 1 . ASN 101 101 4716 1 . ILE 102 102 4716 1 . ARG 103 103 4716 1 . ALA 104 104 4716 1 . LEU 105 105 4716 1 . LEU 106 106 4716 1 . SER 107 107 4716 1 . THR 108 108 4716 1 . MET 109 109 4716 1 . HIS 110 110 4716 1 . THR 111 111 4716 1 . VAL 112 112 4716 1 . LEU 113 113 4716 1 . TRP 114 114 4716 1 . ALA 115 115 4716 1 . GLY 116 116 4716 1 . GLU 117 117 4716 1 . THR 118 118 4716 1 . LYS 119 119 4716 1 . TRP 120 120 4716 1 . LYS 121 121 4716 1 . PRO 122 122 4716 1 . VAL 123 123 4716 1 . GLY 124 124 4716 1 . MET 125 125 4716 1 . ALA 126 126 4716 1 . ASP 127 127 4716 1 . LEU 128 128 4716 1 . VAL 129 129 4716 1 . THR 130 130 4716 1 . PRO 131 131 4716 1 . GLU 132 132 4716 1 . GLN 133 133 4716 1 . VAL 134 134 4716 1 . LYS 135 135 4716 1 . LYS 136 136 4716 1 . VAL 137 137 4716 1 . TYR 138 138 4716 1 . ARG 139 139 4716 1 . LYS 140 140 4716 1 . ALA 141 141 4716 1 . VAL 142 142 4716 1 . LEU 143 143 4716 1 . VAL 144 144 4716 1 . VAL 145 145 4716 1 . HIS 146 146 4716 1 . PRO 147 147 4716 1 . ASP 148 148 4716 1 . LYS 149 149 4716 1 . ALA 150 150 4716 1 . THR 151 151 4716 1 . GLY 152 152 4716 1 . GLN 153 153 4716 1 . PRO 154 154 4716 1 . TYR 155 155 4716 1 . GLU 156 156 4716 1 . GLN 157 157 4716 1 . TYR 158 158 4716 1 . ALA 159 159 4716 1 . LYS 160 160 4716 1 . MET 161 161 4716 1 . ILE 162 162 4716 1 . PHE 163 163 4716 1 . MET 164 164 4716 1 . GLU 165 165 4716 1 . LEU 166 166 4716 1 . ASN 167 167 4716 1 . ASP 168 168 4716 1 . ALA 169 169 4716 1 . TRP 170 170 4716 1 . SER 171 171 4716 1 . GLU 172 172 4716 1 . PHE 173 173 4716 1 . GLU 174 174 4716 1 . ASN 175 175 4716 1 . GLN 176 176 4716 1 . GLY 177 177 4716 1 . GLN 178 178 4716 1 . LYS 179 179 4716 1 . PRO 180 180 4716 1 . LEU 181 181 4716 1 . TYR 182 182 4716 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 4716 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $auxilin . 9913 . . 'Bos taurus' cow . . Eukaryota Metazoa Bos taurus . . . . . . . . . . . . . . . . . . . . . 4716 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 4716 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $auxilin . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4716 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_auxilin_1 _Sample.Sf_category sample _Sample.Sf_framecode auxilin_1 _Sample.Entry_ID 4716 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 auxilin . . . 1 $auxilin . . . 1.0 2.0 mM . . . . 4716 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 4716 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 0.2 n/a 4716 1 temperature 298 1 K 4716 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 4716 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 4716 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 4716 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer Bruker DRX . 600 . . . 4716 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 4716 _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 '15N-HSQC NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4716 1 2 '15N-HSQC TOCSY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4716 1 3 CBCACONH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4716 1 4 CBCANH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4716 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 4716 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '15N-HSQC NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 4716 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '15N-HSQC TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 4716 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name CBCACONH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 4716 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name CBCANH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 4716 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 TSP 'methyl protons' . . . . ppm 0.00 internal direct . internal cylindrical parallel_to_Bo . . . . . . 4716 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 4716 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 4716 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_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_1 _Assigned_chem_shift_list.Entry_ID 4716 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 $auxilin_1 . 4716 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 PRO CA C 13 62.3 0.2 . 1 . . . . . . . . 4716 1 2 . 1 1 2 2 PRO CB C 13 32.5 0.2 . 1 . . . . . . . . 4716 1 3 . 1 1 3 3 LEU H H 1 8.50 0.01 . 1 . . . . . . . . 4716 1 4 . 1 1 3 3 LEU CA C 13 55.5 0.2 . 1 . . . . . . . . 4716 1 5 . 1 1 3 3 LEU CB C 13 42.1 0.2 . 1 . . . . . . . . 4716 1 6 . 1 1 3 3 LEU N N 15 123.6 0.2 . 1 . . . . . . . . 4716 1 7 . 1 1 4 4 GLY H H 1 8.38 0.01 . 1 . . . . . . . . 4716 1 8 . 1 1 4 4 GLY CA C 13 45.1 0.2 . 1 . . . . . . . . 4716 1 9 . 1 1 4 4 GLY N N 15 110.6 0.2 . 1 . . . . . . . . 4716 1 10 . 1 1 5 5 SER H H 1 8.10 0.01 . 1 . . . . . . . . 4716 1 11 . 1 1 5 5 SER CA C 13 56.4 0.2 . 1 . . . . . . . . 4716 1 12 . 1 1 5 5 SER CB C 13 63.4 0.2 . 1 . . . . . . . . 4716 1 13 . 1 1 5 5 SER N N 15 117.8 0.2 . 1 . . . . . . . . 4716 1 14 . 1 1 7 7 GLU CA C 13 57.1 0.2 . 1 . . . . . . . . 4716 1 15 . 1 1 7 7 GLU CB C 13 30.2 0.2 . 1 . . . . . . . . 4716 1 16 . 1 1 8 8 PHE H H 1 8.09 0.01 . 1 . . . . . . . . 4716 1 17 . 1 1 8 8 PHE CA C 13 57.7 0.2 . 1 . . . . . . . . 4716 1 18 . 1 1 8 8 PHE CB C 13 39.6 0.2 . 1 . . . . . . . . 4716 1 19 . 1 1 8 8 PHE N N 15 121.3 0.2 . 1 . . . . . . . . 4716 1 20 . 1 1 9 9 SER H H 1 8.18 0.01 . 1 . . . . . . . . 4716 1 21 . 1 1 9 9 SER CA C 13 58.2 0.2 . 1 . . . . . . . . 4716 1 22 . 1 1 9 9 SER CB C 13 63.9 0.2 . 1 . . . . . . . . 4716 1 23 . 1 1 9 9 SER N N 15 117.3 0.2 . 1 . . . . . . . . 4716 1 24 . 1 1 10 10 MET H H 1 8.25 0.01 . 1 . . . . . . . . 4716 1 25 . 1 1 10 10 MET CA C 13 53.5 0.2 . 1 . . . . . . . . 4716 1 26 . 1 1 10 10 MET CB C 13 32.5 0.2 . 1 . . . . . . . . 4716 1 27 . 1 1 10 10 MET N N 15 124.0 0.2 . 1 . . . . . . . . 4716 1 28 . 1 1 11 11 PRO CA C 13 63.7 0.2 . 1 . . . . . . . . 4716 1 29 . 1 1 11 11 PRO CB C 13 32.0 0.2 . 1 . . . . . . . . 4716 1 30 . 1 1 12 12 HIS H H 1 8.39 0.02 . 1 . . . . . . . . 4716 1 31 . 1 1 12 12 HIS CA C 13 56.0 0.2 . 1 . . . . . . . . 4716 1 32 . 1 1 12 12 HIS CB C 13 29.3 0.2 . 1 . . . . . . . . 4716 1 33 . 1 1 12 12 HIS N N 15 119.9 0.2 . 1 . . . . . . . . 4716 1 34 . 1 1 13 13 SER H H 1 8.15 0.01 . 1 . . . . . . . . 4716 1 35 . 1 1 13 13 SER CA C 13 58.3 0.2 . 1 . . . . . . . . 4716 1 36 . 1 1 13 13 SER CB C 13 63.7 0.2 . 1 . . . . . . . . 4716 1 37 . 1 1 13 13 SER N N 15 117.6 0.2 . 1 . . . . . . . . 4716 1 38 . 1 1 14 14 SER H H 1 8.21 0.01 . 1 . . . . . . . . 4716 1 39 . 1 1 14 14 SER CA C 13 58.2 0.2 . 1 . . . . . . . . 4716 1 40 . 1 1 14 14 SER CB C 13 63.8 0.2 . 1 . . . . . . . . 4716 1 41 . 1 1 14 14 SER N N 15 118.4 0.2 . 1 . . . . . . . . 4716 1 42 . 1 1 16 16 GLN CA C 13 56.3 0.2 . 1 . . . . . . . . 4716 1 43 . 1 1 16 16 GLN CB C 13 29.4 0.2 . 1 . . . . . . . . 4716 1 44 . 1 1 17 17 ASN H H 1 8.50 0.01 . 1 . . . . . . . . 4716 1 45 . 1 1 17 17 ASN CA C 13 53.5 0.2 . 1 . . . . . . . . 4716 1 46 . 1 1 17 17 ASN CB C 13 38.9 0.2 . 1 . . . . . . . . 4716 1 47 . 1 1 17 17 ASN N N 15 120.0 0.2 . 1 . . . . . . . . 4716 1 48 . 1 1 18 18 ARG H H 1 8.39 0.01 . 1 . . . . . . . . 4716 1 49 . 1 1 18 18 ARG CA C 13 57.0 0.2 . 1 . . . . . . . . 4716 1 50 . 1 1 18 18 ARG CB C 13 30.0 0.2 . 1 . . . . . . . . 4716 1 51 . 1 1 18 18 ARG N N 15 122.4 0.2 . 1 . . . . . . . . 4716 1 52 . 1 1 19 19 PRO CA C 13 63.2 0.2 . 1 . . . . . . . . 4716 1 53 . 1 1 19 19 PRO CB C 13 32.0 0.2 . 1 . . . . . . . . 4716 1 54 . 1 1 20 20 ASN H H 1 8.41 0.01 . 1 . . . . . . . . 4716 1 55 . 1 1 20 20 ASN CA C 13 53.0 0.2 . 1 . . . . . . . . 4716 1 56 . 1 1 20 20 ASN CB C 13 38.7 0.2 . 1 . . . . . . . . 4716 1 57 . 1 1 20 20 ASN N N 15 119.1 0.2 . 1 . . . . . . . . 4716 1 58 . 1 1 26 26 SER CA C 13 58.2 0.2 . 1 . . . . . . . . 4716 1 59 . 1 1 26 26 SER CB C 13 64.1 0.2 . 1 . . . . . . . . 4716 1 60 . 1 1 27 27 SER H H 1 8.38 0.01 . 1 . . . . . . . . 4716 1 61 . 1 1 27 27 SER CA C 13 56.5 0.2 . 1 . . . . . . . . 4716 1 62 . 1 1 27 27 SER CB C 13 63.5 0.2 . 1 . . . . . . . . 4716 1 63 . 1 1 27 27 SER N N 15 119.8 0.2 . 1 . . . . . . . . 4716 1 64 . 1 1 29 29 PRO CA C 13 63.6 0.2 . 1 . . . . . . . . 4716 1 65 . 1 1 29 29 PRO CB C 13 32.0 0.2 . 1 . . . . . . . . 4716 1 66 . 1 1 30 30 GLY H H 1 8.55 0.01 . 1 . . . . . . . . 4716 1 67 . 1 1 30 30 GLY CA C 13 45.4 0.2 . 1 . . . . . . . . 4716 1 68 . 1 1 30 30 GLY N N 15 110.9 0.2 . 1 . . . . . . . . 4716 1 69 . 1 1 31 31 GLY H H 1 8.30 0.01 . 1 . . . . . . . . 4716 1 70 . 1 1 31 31 GLY CA C 13 45.3 0.2 . 1 . . . . . . . . 4716 1 71 . 1 1 31 31 GLY N N 15 109.5 0.2 . 1 . . . . . . . . 4716 1 72 . 1 1 32 32 GLN H H 1 8.38 0.01 . 1 . . . . . . . . 4716 1 73 . 1 1 32 32 GLN CA C 13 56.2 0.2 . 1 . . . . . . . . 4716 1 74 . 1 1 32 32 GLN CB C 13 29.3 0.2 . 1 . . . . . . . . 4716 1 75 . 1 1 32 32 GLN N N 15 120.6 0.2 . 1 . . . . . . . . 4716 1 76 . 1 1 34 34 GLU H H 1 8.13 0.01 . 1 . . . . . . . . 4716 1 77 . 1 1 34 34 GLU CA C 13 54.0 0.2 . 1 . . . . . . . . 4716 1 78 . 1 1 34 34 GLU CB C 13 30.3 0.2 . 1 . . . . . . . . 4716 1 79 . 1 1 34 34 GLU N N 15 122.9 0.2 . 1 . . . . . . . . 4716 1 80 . 1 1 35 35 ARG CA C 13 57.0 0.2 . 1 . . . . . . . . 4716 1 81 . 1 1 35 35 ARG CB C 13 30.6 0.2 . 1 . . . . . . . . 4716 1 82 . 1 1 36 36 GLY H H 1 8.39 0.2 . 1 . . . . . . . . 4716 1 83 . 1 1 36 36 GLY HA2 H 1 3.91 0.03 . 1 . . . . . . . . 4716 1 84 . 1 1 36 36 GLY HA3 H 1 3.91 0.03 . 1 . . . . . . . . 4716 1 85 . 1 1 36 36 GLY CA C 13 45.4 0.2 . 1 . . . . . . . . 4716 1 86 . 1 1 36 36 GLY N N 15 110.2 0.2 . 1 . . . . . . . . 4716 1 87 . 1 1 37 37 LYS H H 1 8.07 0.01 . 1 . . . . . . . . 4716 1 88 . 1 1 37 37 LYS HA H 1 4.14 0.01 . 1 . . . . . . . . 4716 1 89 . 1 1 37 37 LYS CA C 13 56.4 0.2 . 1 . . . . . . . . 4716 1 90 . 1 1 37 37 LYS CB C 13 33.1 0.2 . 1 . . . . . . . . 4716 1 91 . 1 1 37 37 LYS N N 15 121.8 0.2 . 1 . . . . . . . . 4716 1 92 . 1 1 38 38 ALA H H 1 8.27 0.01 . 1 . . . . . . . . 4716 1 93 . 1 1 38 38 ALA HA H 1 4.26 0.02 . 1 . . . . . . . . 4716 1 94 . 1 1 38 38 ALA HB1 H 1 1.40 0.02 . 1 . . . . . . . . 4716 1 95 . 1 1 38 38 ALA HB2 H 1 1.40 0.02 . 1 . . . . . . . . 4716 1 96 . 1 1 38 38 ALA HB3 H 1 1.40 0.02 . 1 . . . . . . . . 4716 1 97 . 1 1 38 38 ALA CA C 13 52.7 0.2 . 1 . . . . . . . . 4716 1 98 . 1 1 38 38 ALA CB C 13 19.3 0.2 . 1 . . . . . . . . 4716 1 99 . 1 1 38 38 ALA N N 15 125.8 0.2 . 1 . . . . . . . . 4716 1 100 . 1 1 39 39 ALA CA C 13 52.7 0.2 . 1 . . . . . . . . 4716 1 101 . 1 1 39 39 ALA CB C 13 20.8 0.2 . 1 . . . . . . . . 4716 1 102 . 1 1 40 40 ALA H H 1 8.19 0.01 . 1 . . . . . . . . 4716 1 103 . 1 1 40 40 ALA HA H 1 4.25 0.02 . 1 . . . . . . . . 4716 1 104 . 1 1 40 40 ALA HB1 H 1 1.37 0.02 . 1 . . . . . . . . 4716 1 105 . 1 1 40 40 ALA HB2 H 1 1.37 0.02 . 1 . . . . . . . . 4716 1 106 . 1 1 40 40 ALA HB3 H 1 1.37 0.02 . 1 . . . . . . . . 4716 1 107 . 1 1 40 40 ALA CA C 13 52.6 0.2 . 1 . . . . . . . . 4716 1 108 . 1 1 40 40 ALA CB C 13 19.3 0.2 . 1 . . . . . . . . 4716 1 109 . 1 1 40 40 ALA N N 15 124.0 0.2 . 1 . . . . . . . . 4716 1 110 . 1 1 41 41 ASN H H 1 8.30 0.01 . 1 . . . . . . . . 4716 1 111 . 1 1 41 41 ASN CA C 13 53.2 0.2 . 1 . . . . . . . . 4716 1 112 . 1 1 41 41 ASN CB C 13 38.7 0.2 . 1 . . . . . . . . 4716 1 113 . 1 1 41 41 ASN N N 15 118.1 0.2 . 1 . . . . . . . . 4716 1 114 . 1 1 42 42 LEU HA H 1 4.28 0.03 . 1 . . . . . . . . 4716 1 115 . 1 1 42 42 LEU CA C 13 55.5 0.2 . 1 . . . . . . . . 4716 1 116 . 1 1 42 42 LEU CB C 13 42.3 0.2 . 1 . . . . . . . . 4716 1 117 . 1 1 43 43 GLU H H 1 8.32 0.01 . 1 . . . . . . . . 4716 1 118 . 1 1 43 43 GLU HA H 1 4.20 0.02 . 1 . . . . . . . . 4716 1 119 . 1 1 43 43 GLU HB2 H 1 1.98 0.02 . 1 . . . . . . . . 4716 1 120 . 1 1 43 43 GLU HB3 H 1 2.09 0.02 . 1 . . . . . . . . 4716 1 121 . 1 1 43 43 GLU HG2 H 1 2.28 0.02 . 1 . . . . . . . . 4716 1 122 . 1 1 43 43 GLU CA C 13 57.1 0.2 . 1 . . . . . . . . 4716 1 123 . 1 1 43 43 GLU CB C 13 30.1 0.2 . 1 . . . . . . . . 4716 1 124 . 1 1 43 43 GLU N N 15 121.6 0.2 . 1 . . . . . . . . 4716 1 125 . 1 1 44 44 GLY H H 1 8.35 0.01 . 1 . . . . . . . . 4716 1 126 . 1 1 44 44 GLY HA2 H 1 3.91 0.02 . 1 . . . . . . . . 4716 1 127 . 1 1 44 44 GLY HA3 H 1 3.91 0.02 . 1 . . . . . . . . 4716 1 128 . 1 1 44 44 GLY CA C 13 45.5 0.2 . 1 . . . . . . . . 4716 1 129 . 1 1 44 44 GLY N N 15 110.4 0.2 . 1 . . . . . . . . 4716 1 130 . 1 1 46 46 GLN CA C 13 56.0 0.2 . 1 . . . . . . . . 4716 1 131 . 1 1 46 46 GLN CB C 13 29.6 0.2 . 1 . . . . . . . . 4716 1 132 . 1 1 47 47 LYS H H 1 8.35 0.01 . 1 . . . . . . . . 4716 1 133 . 1 1 47 47 LYS CA C 13 56.2 0.2 . 1 . . . . . . . . 4716 1 134 . 1 1 47 47 LYS CB C 13 33.2 0.2 . 1 . . . . . . . . 4716 1 135 . 1 1 47 47 LYS N N 15 123.8 0.2 . 1 . . . . . . . . 4716 1 136 . 1 1 48 48 ALA H H 1 8.38 0.01 . 1 . . . . . . . . 4716 1 137 . 1 1 48 48 ALA HA H 1 4.25 0.02 . 1 . . . . . . . . 4716 1 138 . 1 1 48 48 ALA HB1 H 1 1.39 0.02 . 1 . . . . . . . . 4716 1 139 . 1 1 48 48 ALA HB2 H 1 1.39 0.02 . 1 . . . . . . . . 4716 1 140 . 1 1 48 48 ALA HB3 H 1 1.39 0.02 . 1 . . . . . . . . 4716 1 141 . 1 1 48 48 ALA CA C 13 52.7 0.2 . 1 . . . . . . . . 4716 1 142 . 1 1 48 48 ALA CB C 13 19.5 0.2 . 1 . . . . . . . . 4716 1 143 . 1 1 48 48 ALA N N 15 126.9 0.2 . 1 . . . . . . . . 4716 1 144 . 1 1 49 49 ALA H H 1 8.30 0.01 . 1 . . . . . . . . 4716 1 145 . 1 1 49 49 ALA HA H 1 4.24 0.02 . 1 . . . . . . . . 4716 1 146 . 1 1 49 49 ALA HB1 H 1 1.32 0.02 . 1 . . . . . . . . 4716 1 147 . 1 1 49 49 ALA HB2 H 1 1.32 0.02 . 1 . . . . . . . . 4716 1 148 . 1 1 49 49 ALA HB3 H 1 1.32 0.02 . 1 . . . . . . . . 4716 1 149 . 1 1 49 49 ALA CA C 13 52.7 0.2 . 1 . . . . . . . . 4716 1 150 . 1 1 49 49 ALA CB C 13 19.4 0.2 . 1 . . . . . . . . 4716 1 151 . 1 1 49 49 ALA N N 15 124.0 0.2 . 1 . . . . . . . . 4716 1 152 . 1 1 50 50 ASP H H 1 8.19 0.01 . 1 . . . . . . . . 4716 1 153 . 1 1 50 50 ASP HA H 1 4.49 0.02 . 1 . . . . . . . . 4716 1 154 . 1 1 50 50 ASP HB2 H 1 2.56 0.02 . 2 . . . . . . . . 4716 1 155 . 1 1 50 50 ASP CA C 13 54.5 0.2 . 1 . . . . . . . . 4716 1 156 . 1 1 50 50 ASP CB C 13 41.1 0.2 . 1 . . . . . . . . 4716 1 157 . 1 1 50 50 ASP N N 15 120.0 0.2 . 1 . . . . . . . . 4716 1 158 . 1 1 51 51 PHE H H 1 8.02 0.01 . 1 . . . . . . . . 4716 1 159 . 1 1 51 51 PHE HA H 1 4.52 0.02 . 1 . . . . . . . . 4716 1 160 . 1 1 51 51 PHE HB2 H 1 3.10 0.03 . 2 . . . . . . . . 4716 1 161 . 1 1 51 51 PHE HD1 H 1 7.21 0.02 . 2 . . . . . . . . 4716 1 162 . 1 1 51 51 PHE CA C 13 58.3 0.2 . 1 . . . . . . . . 4716 1 163 . 1 1 51 51 PHE CB C 13 39.5 0.2 . 1 . . . . . . . . 4716 1 164 . 1 1 51 51 PHE N N 15 120.7 0.2 . 1 . . . . . . . . 4716 1 165 . 1 1 52 52 GLU H H 1 8.22 0.01 . 1 . . . . . . . . 4716 1 166 . 1 1 52 52 GLU HA H 1 4.13 0.02 . 1 . . . . . . . . 4716 1 167 . 1 1 52 52 GLU HB2 H 1 1.94 0.03 . 2 . . . . . . . . 4716 1 168 . 1 1 52 52 GLU HB3 H 1 2.16 0.03 . 2 . . . . . . . . 4716 1 169 . 1 1 52 52 GLU CA C 13 57.1 0.2 . 1 . . . . . . . . 4716 1 170 . 1 1 52 52 GLU CB C 13 30.4 0.2 . 1 . . . . . . . . 4716 1 171 . 1 1 52 52 GLU N N 15 122.7 0.2 . 1 . . . . . . . . 4716 1 172 . 1 1 53 53 ASP H H 1 8.25 0.01 . 1 . . . . . . . . 4716 1 173 . 1 1 53 53 ASP HA H 1 4.52 0.02 . 1 . . . . . . . . 4716 1 174 . 1 1 53 53 ASP HB2 H 1 2.59 0.02 . 2 . . . . . . . . 4716 1 175 . 1 1 53 53 ASP HB3 H 1 2.71 0.02 . 2 . . . . . . . . 4716 1 176 . 1 1 53 53 ASP CA C 13 54.6 0.2 . 1 . . . . . . . . 4716 1 177 . 1 1 53 53 ASP CB C 13 41.1 0.2 . 1 . . . . . . . . 4716 1 178 . 1 1 53 53 ASP N N 15 122.2 0.2 . 1 . . . . . . . . 4716 1 179 . 1 1 54 54 LEU H H 1 8.16 0.01 . 1 . . . . . . . . 4716 1 180 . 1 1 54 54 LEU HA H 1 4.23 0.02 . 1 . . . . . . . . 4716 1 181 . 1 1 54 54 LEU HB2 H 1 1.64 0.03 . 2 . . . . . . . . 4716 1 182 . 1 1 54 54 LEU CA C 13 56.0 0.2 . 1 . . . . . . . . 4716 1 183 . 1 1 54 54 LEU CB C 13 42.1 0.2 . 1 . . . . . . . . 4716 1 184 . 1 1 54 54 LEU N N 15 123.6 0.2 . 1 . . . . . . . . 4716 1 185 . 1 1 55 55 LEU H H 1 8.14 0.01 . 1 . . . . . . . . 4716 1 186 . 1 1 55 55 LEU HA H 1 4.27 0.02 . 1 . . . . . . . . 4716 1 187 . 1 1 55 55 LEU HB2 H 1 1.57 0.02 . 2 . . . . . . . . 4716 1 188 . 1 1 55 55 LEU HB3 H 1 1.69 0.02 . 2 . . . . . . . . 4716 1 189 . 1 1 55 55 LEU CA C 13 55.7 0.2 . 1 . . . . . . . . 4716 1 190 . 1 1 55 55 LEU CB C 13 42.0 0.2 . 1 . . . . . . . . 4716 1 191 . 1 1 55 55 LEU N N 15 121.6 0.2 . 1 . . . . . . . . 4716 1 192 . 1 1 56 56 SER H H 1 8.05 0.01 . 1 . . . . . . . . 4716 1 193 . 1 1 56 56 SER HA H 1 3.88 0.02 . 4 . . . . . . . . 4716 1 194 . 1 1 56 56 SER HB2 H 1 4.04 0.02 . 4 . . . . . . . . 4716 1 195 . 1 1 56 56 SER CA C 13 59.0 0.2 . 1 . . . . . . . . 4716 1 196 . 1 1 56 56 SER CB C 13 63.7 0.2 . 1 . . . . . . . . 4716 1 197 . 1 1 56 56 SER N N 15 116.2 0.2 . 1 . . . . . . . . 4716 1 198 . 1 1 57 57 GLY H H 1 8.32 0.01 . 1 . . . . . . . . 4716 1 199 . 1 1 57 57 GLY HA2 H 1 3.95 0.03 . 1 . . . . . . . . 4716 1 200 . 1 1 57 57 GLY HA3 H 1 3.95 0.03 . 1 . . . . . . . . 4716 1 201 . 1 1 57 57 GLY CA C 13 45.6 0.2 . 1 . . . . . . . . 4716 1 202 . 1 1 57 57 GLY N N 15 111.3 0.2 . 1 . . . . . . . . 4716 1 203 . 1 1 58 58 GLN H H 1 8.16 0.01 . 1 . . . . . . . . 4716 1 204 . 1 1 58 58 GLN CA C 13 56.0 0.2 . 1 . . . . . . . . 4716 1 205 . 1 1 58 58 GLN CB C 13 29.5 0.2 . 1 . . . . . . . . 4716 1 206 . 1 1 58 58 GLN N N 15 120.2 0.2 . 1 . . . . . . . . 4716 1 207 . 1 1 59 59 GLY H H 1 8.40 0.01 . 1 . . . . . . . . 4716 1 208 . 1 1 59 59 GLY HA2 H 1 3.88 0.02 . 1 . . . . . . . . 4716 1 209 . 1 1 59 59 GLY HA3 H 1 3.88 0.02 . 1 . . . . . . . . 4716 1 210 . 1 1 59 59 GLY CA C 13 45.4 0.2 . 1 . . . . . . . . 4716 1 211 . 1 1 59 59 GLY N N 15 110.2 0.2 . 1 . . . . . . . . 4716 1 212 . 1 1 60 60 PHE H H 1 8.12 0.01 . 1 . . . . . . . . 4716 1 213 . 1 1 60 60 PHE HB2 H 1 3.08 0.03 . 2 . . . . . . . . 4716 1 214 . 1 1 60 60 PHE CA C 13 58.1 0.2 . 1 . . . . . . . . 4716 1 215 . 1 1 60 60 PHE CB C 13 39.5 0.2 . 1 . . . . . . . . 4716 1 216 . 1 1 60 60 PHE N N 15 121.1 0.2 . 1 . . . . . . . . 4716 1 217 . 1 1 61 61 ASN CA C 13 53.2 0.2 . 1 . . . . . . . . 4716 1 218 . 1 1 61 61 ASN CB C 13 39.0 0.2 . 1 . . . . . . . . 4716 1 219 . 1 1 62 62 ALA H H 1 8.09 0.01 . 1 . . . . . . . . 4716 1 220 . 1 1 62 62 ALA HA H 1 4.15 0.02 . 1 . . . . . . . . 4716 1 221 . 1 1 62 62 ALA HB1 H 1 1.28 0.02 . 1 . . . . . . . . 4716 1 222 . 1 1 62 62 ALA HB2 H 1 1.28 0.02 . 1 . . . . . . . . 4716 1 223 . 1 1 62 62 ALA HB3 H 1 1.28 0.02 . 1 . . . . . . . . 4716 1 224 . 1 1 62 62 ALA CA C 13 52.9 0.2 . 1 . . . . . . . . 4716 1 225 . 1 1 62 62 ALA CB C 13 19.5 0.2 . 1 . . . . . . . . 4716 1 226 . 1 1 62 62 ALA N N 15 125.1 0.2 . 1 . . . . . . . . 4716 1 227 . 1 1 63 63 HIS H H 1 8.17 0.01 . 1 . . . . . . . . 4716 1 228 . 1 1 63 63 HIS HA H 1 4.53 0.02 . 1 . . . . . . . . 4716 1 229 . 1 1 63 63 HIS HB2 H 1 3.06 0.02 . 2 . . . . . . . . 4716 1 230 . 1 1 63 63 HIS CA C 13 56.3 0.2 . 1 . . . . . . . . 4716 1 231 . 1 1 63 63 HIS CB C 13 30.5 0.2 . 1 . . . . . . . . 4716 1 232 . 1 1 63 63 HIS N N 15 118.9 0.2 . 1 . . . . . . . . 4716 1 233 . 1 1 64 64 LYS H H 1 8.37 0.01 . 1 . . . . . . . . 4716 1 234 . 1 1 64 64 LYS HA H 1 4.26 0.02 . 1 . . . . . . . . 4716 1 235 . 1 1 64 64 LYS CA C 13 56.7 0.2 . 1 . . . . . . . . 4716 1 236 . 1 1 64 64 LYS CB C 13 30.4 0.2 . 1 . . . . . . . . 4716 1 237 . 1 1 64 64 LYS N N 15 122.7 0.2 . 1 . . . . . . . . 4716 1 238 . 1 1 65 65 ASP HA H 1 4.56 0.02 . 1 . . . . . . . . 4716 1 239 . 1 1 65 65 ASP HB2 H 1 2.56 0.02 . 2 . . . . . . . . 4716 1 240 . 1 1 65 65 ASP CA C 13 54.6 0.2 . 1 . . . . . . . . 4716 1 241 . 1 1 65 65 ASP CB C 13 41.4 0.2 . 1 . . . . . . . . 4716 1 242 . 1 1 66 66 LYS H H 1 8.15 0.01 . 1 . . . . . . . . 4716 1 243 . 1 1 66 66 LYS HA H 1 4.26 0.02 . 1 . . . . . . . . 4716 1 244 . 1 1 66 66 LYS HB2 H 1 1.70 0.02 . 2 . . . . . . . . 4716 1 245 . 1 1 66 66 LYS HB3 H 1 1.72 0.02 . 2 . . . . . . . . 4716 1 246 . 1 1 66 66 LYS CA C 13 56.4 0.02 . 1 . . . . . . . . 4716 1 247 . 1 1 66 66 LYS CB C 13 32.9 0.02 . 1 . . . . . . . . 4716 1 248 . 1 1 66 66 LYS N N 15 122.4 0.2 . 1 . . . . . . . . 4716 1 249 . 1 1 67 67 LYS H H 1 8.34 0.01 . 1 . . . . . . . . 4716 1 250 . 1 1 67 67 LYS HA H 1 4.31 0.02 . 1 . . . . . . . . 4716 1 251 . 1 1 67 67 LYS HB2 H 1 1.71 0.02 . 2 . . . . . . . . 4716 1 252 . 1 1 67 67 LYS HB3 H 1 1.85 0.02 . 2 . . . . . . . . 4716 1 253 . 1 1 67 67 LYS CA C 13 56.3 0.2 . 1 . . . . . . . . 4716 1 254 . 1 1 67 67 LYS CB C 13 33.1 0.2 . 1 . . . . . . . . 4716 1 255 . 1 1 67 67 LYS N N 15 123.1 0.2 . 1 . . . . . . . . 4716 1 256 . 1 1 68 68 GLY H H 1 8.24 0.01 . 1 . . . . . . . . 4716 1 257 . 1 1 68 68 GLY HA2 H 1 4.00 0.02 . 2 . . . . . . . . 4716 1 258 . 1 1 68 68 GLY HA3 H 1 4.12 0.02 . 2 . . . . . . . . 4716 1 259 . 1 1 68 68 GLY CA C 13 44.6 0.2 . 1 . . . . . . . . 4716 1 260 . 1 1 68 68 GLY N N 15 110.9 0.2 . 1 . . . . . . . . 4716 1 261 . 1 1 69 69 PRO HA H 1 4.41 0.02 . 1 . . . . . . . . 4716 1 262 . 1 1 69 69 PRO HD2 H 1 3.61 0.02 . 1 . . . . . . . . 4716 1 263 . 1 1 69 69 PRO HD3 H 1 3.80 0.02 . 1 . . . . . . . . 4716 1 264 . 1 1 69 69 PRO CA C 13 63.4 0.2 . 1 . . . . . . . . 4716 1 265 . 1 1 69 69 PRO CB C 13 32.5 0.2 . 1 . . . . . . . . 4716 1 266 . 1 1 70 70 ARG H H 1 8.50 0.01 . 1 . . . . . . . . 4716 1 267 . 1 1 70 70 ARG HA H 1 4.42 0.02 . 1 . . . . . . . . 4716 1 268 . 1 1 70 70 ARG CA C 13 56.1 0.2 . 1 . . . . . . . . 4716 1 269 . 1 1 70 70 ARG CB C 13 31.4 0.2 . 1 . . . . . . . . 4716 1 270 . 1 1 70 70 ARG N N 15 122.2 0.2 . 1 . . . . . . . . 4716 1 271 . 1 1 71 71 THR H H 1 8.27 0.01 . 1 . . . . . . . . 4716 1 272 . 1 1 71 71 THR HA H 1 4.40 0.02 . 1 . . . . . . . . 4716 1 273 . 1 1 71 71 THR HB H 1 4.41 0.02 . 1 . . . . . . . . 4716 1 274 . 1 1 71 71 THR HG21 H 1 1.23 0.02 . 1 . . . . . . . . 4716 1 275 . 1 1 71 71 THR HG22 H 1 1.23 0.02 . 1 . . . . . . . . 4716 1 276 . 1 1 71 71 THR HG23 H 1 1.23 0.02 . 1 . . . . . . . . 4716 1 277 . 1 1 71 71 THR CA C 13 61.3 0.2 . 1 . . . . . . . . 4716 1 278 . 1 1 71 71 THR CB C 13 70.6 0.2 . 1 . . . . . . . . 4716 1 279 . 1 1 71 71 THR N N 15 115.3 0.2 . 1 . . . . . . . . 4716 1 280 . 1 1 72 72 ILE H H 1 8.46 0.01 . 1 . . . . . . . . 4716 1 281 . 1 1 72 72 ILE HA H 1 4.40 0.02 . 1 . . . . . . . . 4716 1 282 . 1 1 72 72 ILE HB H 1 1.87 0.02 . 2 . . . . . . . . 4716 1 283 . 1 1 72 72 ILE HG12 H 1 1.51 0.02 . 2 . . . . . . . . 4716 1 284 . 1 1 72 72 ILE HG13 H 1 1.25 0.02 . 2 . . . . . . . . 4716 1 285 . 1 1 72 72 ILE HG21 H 1 0.90 0.02 . 1 . . . . . . . . 4716 1 286 . 1 1 72 72 ILE HG22 H 1 0.90 0.02 . 1 . . . . . . . . 4716 1 287 . 1 1 72 72 ILE HG23 H 1 0.90 0.02 . 1 . . . . . . . . 4716 1 288 . 1 1 72 72 ILE CA C 13 61.3 0.2 . 1 . . . . . . . . 4716 1 289 . 1 1 72 72 ILE CB C 13 37.9 0.2 . 1 . . . . . . . . 4716 1 290 . 1 1 72 72 ILE N N 15 123.3 0.2 . 1 . . . . . . . . 4716 1 291 . 1 1 73 73 ALA H H 1 8.29 0.01 . 1 . . . . . . . . 4716 1 292 . 1 1 73 73 ALA HA H 1 4.14 0.02 . 1 . . . . . . . . 4716 1 293 . 1 1 73 73 ALA HB1 H 1 1.39 0.02 . 1 . . . . . . . . 4716 1 294 . 1 1 73 73 ALA HB2 H 1 1.39 0.02 . 1 . . . . . . . . 4716 1 295 . 1 1 73 73 ALA HB3 H 1 1.39 0.02 . 1 . . . . . . . . 4716 1 296 . 1 1 73 73 ALA CA C 13 54.3 0.2 . 1 . . . . . . . . 4716 1 297 . 1 1 73 73 ALA CB C 13 18.9 0.2 . 1 . . . . . . . . 4716 1 298 . 1 1 73 73 ALA N N 15 125.1 0.2 . 1 . . . . . . . . 4716 1 299 . 1 1 74 74 GLU H H 1 7.98 0.01 . 1 . . . . . . . . 4716 1 300 . 1 1 74 74 GLU HA H 1 4.09 0.02 . 1 . . . . . . . . 4716 1 301 . 1 1 74 74 GLU HB2 H 1 2.11 0.02 . 2 . . . . . . . . 4716 1 302 . 1 1 74 74 GLU HB3 H 1 2.02 0.02 . 2 . . . . . . . . 4716 1 303 . 1 1 74 74 GLU HG2 H 1 2.28 0.02 . 2 . . . . . . . . 4716 1 304 . 1 1 74 74 GLU CA C 13 58.0 0.2 . 1 . . . . . . . . 4716 1 305 . 1 1 74 74 GLU CB C 13 30.1 0.2 . 1 . . . . . . . . 4716 1 306 . 1 1 74 74 GLU N N 15 119.8 0.2 . 1 . . . . . . . . 4716 1 307 . 1 1 75 75 MET H H 1 8.24 0.01 . 1 . . . . . . . . 4716 1 308 . 1 1 75 75 MET HA H 1 4.24 0.02 . 1 . . . . . . . . 4716 1 309 . 1 1 75 75 MET HB2 H 1 2.11 0.02 . 2 . . . . . . . . 4716 1 310 . 1 1 75 75 MET HG2 H 1 2.63 0.02 . 1 . . . . . . . . 4716 1 311 . 1 1 75 75 MET CA C 13 57.6 0.2 . 1 . . . . . . . . 4716 1 312 . 1 1 75 75 MET CB C 13 32.7 0.2 . 1 . . . . . . . . 4716 1 313 . 1 1 75 75 MET N N 15 121.6 0.2 . 1 . . . . . . . . 4716 1 314 . 1 1 76 76 ARG H H 1 8.36 0.02 . 1 . . . . . . . . 4716 1 315 . 1 1 76 76 ARG HA H 1 4.21 0.02 . 1 . . . . . . . . 4716 1 316 . 1 1 76 76 ARG HB2 H 1 1.85 0.02 . 2 . . . . . . . . 4716 1 317 . 1 1 76 76 ARG HG2 H 1 1.72 0.02 . 2 . . . . . . . . 4716 1 318 . 1 1 76 76 ARG CA C 13 57.8 0.2 . 1 . . . . . . . . 4716 1 319 . 1 1 76 76 ARG CB C 13 30.3 0.2 . 1 . . . . . . . . 4716 1 320 . 1 1 76 76 ARG N N 15 121.8 0.2 . 1 . . . . . . . . 4716 1 321 . 1 1 77 77 LYS H H 1 8.04 0.01 . 1 . . . . . . . . 4716 1 322 . 1 1 77 77 LYS HA H 1 4.10 0.02 . 1 . . . . . . . . 4716 1 323 . 1 1 77 77 LYS HB2 H 1 1.86 0.02 . 2 . . . . . . . . 4716 1 324 . 1 1 77 77 LYS HG2 H 1 1.44 0.03 . 2 . . . . . . . . 4716 1 325 . 1 1 77 77 LYS HG3 H 1 1.52 0.03 . 2 . . . . . . . . 4716 1 326 . 1 1 77 77 LYS HD2 H 1 1.67 0.02 . 2 . . . . . . . . 4716 1 327 . 1 1 77 77 LYS CA C 13 58.5 0.2 . 1 . . . . . . . . 4716 1 328 . 1 1 77 77 LYS CB C 13 32.6 0.2 . 1 . . . . . . . . 4716 1 329 . 1 1 77 77 LYS N N 15 122.0 0.2 . 1 . . . . . . . . 4716 1 330 . 1 1 78 78 GLU H H 1 8.20 0.01 . 1 . . . . . . . . 4716 1 331 . 1 1 78 78 GLU HA H 1 4.14 0.02 . 1 . . . . . . . . 4716 1 332 . 1 1 78 78 GLU HB2 H 1 1.86 0.02 . 2 . . . . . . . . 4716 1 333 . 1 1 78 78 GLU HB3 H 1 2.06 0.02 . 2 . . . . . . . . 4716 1 334 . 1 1 78 78 GLU HG2 H 1 2.26 0.02 . 2 . . . . . . . . 4716 1 335 . 1 1 78 78 GLU HG3 H 1 2.32 0.02 . 2 . . . . . . . . 4716 1 336 . 1 1 78 78 GLU CA C 13 58.2 0.2 . 1 . . . . . . . . 4716 1 337 . 1 1 78 78 GLU CB C 13 29.8 0.2 . 1 . . . . . . . . 4716 1 338 . 1 1 78 78 GLU N N 15 121.3 0.2 . 1 . . . . . . . . 4716 1 339 . 1 1 79 79 GLU H H 1 8.16 0.01 . 1 . . . . . . . . 4716 1 340 . 1 1 79 79 GLU HA H 1 4.14 0.02 . 1 . . . . . . . . 4716 1 341 . 1 1 79 79 GLU HB2 H 1 1.86 0.02 . 2 . . . . . . . . 4716 1 342 . 1 1 79 79 GLU HB3 H 1 2.06 0.02 . 2 . . . . . . . . 4716 1 343 . 1 1 79 79 GLU HG2 H 1 2.29 0.03 . 2 . . . . . . . . 4716 1 344 . 1 1 79 79 GLU CA C 13 58.0 0.2 . 1 . . . . . . . . 4716 1 345 . 1 1 79 79 GLU CB C 13 29.9 0.2 . 1 . . . . . . . . 4716 1 346 . 1 1 79 79 GLU N N 15 121.1 0.2 . 1 . . . . . . . . 4716 1 347 . 1 1 80 80 MET H H 1 8.18 0.01 . 1 . . . . . . . . 4716 1 348 . 1 1 80 80 MET HA H 1 4.24 0.02 . 1 . . . . . . . . 4716 1 349 . 1 1 80 80 MET HB2 H 1 2.09 0.03 . 2 . . . . . . . . 4716 1 350 . 1 1 80 80 MET HG2 H 1 2.54 0.02 . 2 . . . . . . . . 4716 1 351 . 1 1 80 80 MET HG3 H 1 2.67 0.02 . 2 . . . . . . . . 4716 1 352 . 1 1 80 80 MET CA C 13 57.2 0.2 . 1 . . . . . . . . 4716 1 353 . 1 1 80 80 MET CB C 13 33.0 0.2 . 1 . . . . . . . . 4716 1 354 . 1 1 80 80 MET N N 15 120.2 0.2 . 1 . . . . . . . . 4716 1 355 . 1 1 81 81 ALA H H 1 7.92 0.01 . 1 . . . . . . . . 4716 1 356 . 1 1 81 81 ALA HA H 1 4.24 0.02 . 1 . . . . . . . . 4716 1 357 . 1 1 81 81 ALA HB1 H 1 1.44 0.02 . 1 . . . . . . . . 4716 1 358 . 1 1 81 81 ALA HB2 H 1 1.44 0.02 . 1 . . . . . . . . 4716 1 359 . 1 1 81 81 ALA HB3 H 1 1.44 0.02 . 1 . . . . . . . . 4716 1 360 . 1 1 81 81 ALA CA C 13 53.3 0.2 . 1 . . . . . . . . 4716 1 361 . 1 1 81 81 ALA CB C 13 19.0 0.2 . 1 . . . . . . . . 4716 1 362 . 1 1 81 81 ALA N N 15 123.3 0.2 . 1 . . . . . . . . 4716 1 363 . 1 1 82 82 LYS H H 1 7.77 0.01 . 1 . . . . . . . . 4716 1 364 . 1 1 82 82 LYS HA H 1 4.26 0.02 . 1 . . . . . . . . 4716 1 365 . 1 1 82 82 LYS HB2 H 1 1.84 0.02 . 2 . . . . . . . . 4716 1 366 . 1 1 82 82 LYS HG2 H 1 1.44 0.02 . 2 . . . . . . . . 4716 1 367 . 1 1 82 82 LYS CA C 13 56.6 0.2 . 1 . . . . . . . . 4716 1 368 . 1 1 82 82 LYS CB C 13 33.2 0.2 . 1 . . . . . . . . 4716 1 369 . 1 1 82 82 LYS N N 15 119.1 0.2 . 1 . . . . . . . . 4716 1 370 . 1 1 83 83 GLU H H 1 7.95 0.01 . 1 . . . . . . . . 4716 1 371 . 1 1 83 83 GLU HA H 1 4.25 0.02 . 1 . . . . . . . . 4716 1 372 . 1 1 83 83 GLU HB2 H 1 1.86 0.02 . 2 . . . . . . . . 4716 1 373 . 1 1 83 83 GLU HB3 H 1 2.04 0.02 . 2 . . . . . . . . 4716 1 374 . 1 1 83 83 GLU HG2 H 1 2.21 0.03 . 2 . . . . . . . . 4716 1 375 . 1 1 83 83 GLU CA C 13 56.6 0.2 . 1 . . . . . . . . 4716 1 376 . 1 1 83 83 GLU CB C 13 30.1 0.2 . 1 . . . . . . . . 4716 1 377 . 1 1 83 83 GLU N N 15 121.8 0.2 . 1 . . . . . . . . 4716 1 378 . 1 1 84 84 MET H H 1 8.21 0.01 . 1 . . . . . . . . 4716 1 379 . 1 1 84 84 MET HA H 1 4.51 0.02 . 1 . . . . . . . . 4716 1 380 . 1 1 84 84 MET HB2 H 1 2.05 0.02 . 2 . . . . . . . . 4716 1 381 . 1 1 84 84 MET HG2 H 1 2.57 0.02 . 2 . . . . . . . . 4716 1 382 . 1 1 84 84 MET CA C 13 55.4 0.2 . 1 . . . . . . . . 4716 1 383 . 1 1 84 84 MET CB C 13 33.2 0.2 . 1 . . . . . . . . 4716 1 384 . 1 1 84 84 MET N N 15 123.3 0.2 . 1 . . . . . . . . 4716 1 385 . 1 1 85 85 ASP H H 1 8.82 0.02 . 1 . . . . . . . . 4716 1 386 . 1 1 85 85 ASP HA H 1 4.95 0.02 . 1 . . . . . . . . 4716 1 387 . 1 1 85 85 ASP HB2 H 1 2.82 0.02 . 2 . . . . . . . . 4716 1 388 . 1 1 85 85 ASP HB3 H 1 3.03 0.02 . 2 . . . . . . . . 4716 1 389 . 1 1 85 85 ASP CA C 13 51.7 0.2 . 1 . . . . . . . . 4716 1 390 . 1 1 85 85 ASP CB C 13 41.5 0.2 . 1 . . . . . . . . 4716 1 391 . 1 1 85 85 ASP N N 15 124.9 0.2 . 1 . . . . . . . . 4716 1 392 . 1 1 86 86 PRO CA C 13 65.1 0.2 . 1 . . . . . . . . 4716 1 393 . 1 1 86 86 PRO CB C 13 32.7 0.2 . 1 . . . . . . . . 4716 1 394 . 1 1 87 87 GLU H H 1 8.29 0.01 . 1 . . . . . . . . 4716 1 395 . 1 1 87 87 GLU HA H 1 4.00 0.02 . 1 . . . . . . . . 4716 1 396 . 1 1 87 87 GLU HB2 H 1 1.82 0.02 . 2 . . . . . . . . 4716 1 397 . 1 1 87 87 GLU HB3 H 1 2.00 0.02 . 2 . . . . . . . . 4716 1 398 . 1 1 87 87 GLU HG2 H 1 2.13 0.02 . 2 . . . . . . . . 4716 1 399 . 1 1 87 87 GLU CA C 13 58.6 0.2 . 1 . . . . . . . . 4716 1 400 . 1 1 87 87 GLU CB C 13 28.3 0.2 . 1 . . . . . . . . 4716 1 401 . 1 1 87 87 GLU N N 15 119.3 0.2 . 1 . . . . . . . . 4716 1 402 . 1 1 88 88 LYS H H 1 7.33 0.01 . 1 . . . . . . . . 4716 1 403 . 1 1 88 88 LYS HA H 1 3.97 0.02 . 1 . . . . . . . . 4716 1 404 . 1 1 88 88 LYS HB2 H 1 1.83 0.02 . 2 . . . . . . . . 4716 1 405 . 1 1 88 88 LYS HB3 H 1 2.08 0.02 . 2 . . . . . . . . 4716 1 406 . 1 1 88 88 LYS HG2 H 1 1.69 0.02 . 2 . . . . . . . . 4716 1 407 . 1 1 88 88 LYS HE2 H 1 3.04 0.02 . 2 . . . . . . . . 4716 1 408 . 1 1 88 88 LYS CA C 13 59.9 0.2 . 1 . . . . . . . . 4716 1 409 . 1 1 88 88 LYS CB C 13 33.0 0.2 . 1 . . . . . . . . 4716 1 410 . 1 1 88 88 LYS N N 15 120.0 0.2 . 1 . . . . . . . . 4716 1 411 . 1 1 89 89 LEU H H 1 8.05 0.01 . 1 . . . . . . . . 4716 1 412 . 1 1 89 89 LEU HA H 1 4.00 0.02 . 1 . . . . . . . . 4716 1 413 . 1 1 89 89 LEU HB2 H 1 1.63 0.02 . 2 . . . . . . . . 4716 1 414 . 1 1 89 89 LEU HD11 H 1 0.92 0.02 . 2 . . . . . . . . 4716 1 415 . 1 1 89 89 LEU HD12 H 1 0.92 0.02 . 2 . . . . . . . . 4716 1 416 . 1 1 89 89 LEU HD13 H 1 0.92 0.02 . 2 . . . . . . . . 4716 1 417 . 1 1 89 89 LEU CA C 13 58.4 0.2 . 1 . . . . . . . . 4716 1 418 . 1 1 89 89 LEU CB C 13 41.3 0.2 . 1 . . . . . . . . 4716 1 419 . 1 1 89 89 LEU N N 15 119.8 0.2 . 1 . . . . . . . . 4716 1 420 . 1 1 90 90 LYS H H 1 7.59 0.01 . 1 . . . . . . . . 4716 1 421 . 1 1 90 90 LYS HB2 H 1 1.90 0.02 . 2 . . . . . . . . 4716 1 422 . 1 1 90 90 LYS HD2 H 1 1.66 0.02 . 2 . . . . . . . . 4716 1 423 . 1 1 90 90 LYS CA C 13 59.5 0.2 . 1 . . . . . . . . 4716 1 424 . 1 1 90 90 LYS CB C 13 32.3 0.2 . 1 . . . . . . . . 4716 1 425 . 1 1 90 90 LYS N N 15 118.9 0.2 . 1 . . . . . . . . 4716 1 426 . 1 1 91 91 ILE H H 1 7.42 0.01 . 1 . . . . . . . . 4716 1 427 . 1 1 91 91 ILE HA H 1 3.91 0.02 . 1 . . . . . . . . 4716 1 428 . 1 1 91 91 ILE HB H 1 2.16 0.02 . 1 . . . . . . . . 4716 1 429 . 1 1 91 91 ILE HG12 H 1 1.88 0.02 . 2 . . . . . . . . 4716 1 430 . 1 1 91 91 ILE HG21 H 1 1.21 0.02 . 1 . . . . . . . . 4716 1 431 . 1 1 91 91 ILE HG22 H 1 1.21 0.02 . 1 . . . . . . . . 4716 1 432 . 1 1 91 91 ILE HG23 H 1 1.21 0.02 . 1 . . . . . . . . 4716 1 433 . 1 1 91 91 ILE HD11 H 1 1.05 0.02 . 1 . . . . . . . . 4716 1 434 . 1 1 91 91 ILE HD12 H 1 1.05 0.02 . 1 . . . . . . . . 4716 1 435 . 1 1 91 91 ILE HD13 H 1 1.05 0.02 . 1 . . . . . . . . 4716 1 436 . 1 1 91 91 ILE CA C 13 65.2 0.2 . 1 . . . . . . . . 4716 1 437 . 1 1 91 91 ILE CB C 13 37.9 0.2 . 1 . . . . . . . . 4716 1 438 . 1 1 91 91 ILE N N 15 121.6 0.2 . 1 . . . . . . . . 4716 1 439 . 1 1 92 92 LEU H H 1 8.47 0.01 . 1 . . . . . . . . 4716 1 440 . 1 1 92 92 LEU HA H 1 4.08 0.02 . 1 . . . . . . . . 4716 1 441 . 1 1 92 92 LEU HB2 H 1 1.84 0.02 . 2 . . . . . . . . 4716 1 442 . 1 1 92 92 LEU HB3 H 1 2.01 0.02 . 2 . . . . . . . . 4716 1 443 . 1 1 92 92 LEU HG H 1 1.55 0.02 . 1 . . . . . . . . 4716 1 444 . 1 1 92 92 LEU HD11 H 1 0.90 0.02 . 2 . . . . . . . . 4716 1 445 . 1 1 92 92 LEU HD12 H 1 0.90 0.02 . 2 . . . . . . . . 4716 1 446 . 1 1 92 92 LEU HD13 H 1 0.90 0.02 . 2 . . . . . . . . 4716 1 447 . 1 1 92 92 LEU CA C 13 58.7 0.2 . 1 . . . . . . . . 4716 1 448 . 1 1 92 92 LEU CB C 13 41.6 0.2 . 1 . . . . . . . . 4716 1 449 . 1 1 92 92 LEU N N 15 121.8 0.2 . 1 . . . . . . . . 4716 1 450 . 1 1 93 93 GLU H H 1 8.47 0.01 . 1 . . . . . . . . 4716 1 451 . 1 1 93 93 GLU HA H 1 4.01 0.02 . 1 . . . . . . . . 4716 1 452 . 1 1 93 93 GLU HB2 H 1 2.03 0.02 . 2 . . . . . . . . 4716 1 453 . 1 1 93 93 GLU HB3 H 1 2.16 0.02 . 2 . . . . . . . . 4716 1 454 . 1 1 93 93 GLU CA C 13 59.4 0.2 . 1 . . . . . . . . 4716 1 455 . 1 1 93 93 GLU CB C 13 29.9 0.2 . 1 . . . . . . . . 4716 1 456 . 1 1 93 93 GLU N N 15 119.6 0.2 . 1 . . . . . . . . 4716 1 457 . 1 1 94 94 TRP H H 1 7.76 0.01 . 1 . . . . . . . . 4716 1 458 . 1 1 94 94 TRP HA H 1 4.33 0.02 . 1 . . . . . . . . 4716 1 459 . 1 1 94 94 TRP HB2 H 1 3.13 0.02 . 2 . . . . . . . . 4716 1 460 . 1 1 94 94 TRP HD1 H 1 7.03 0.02 . 1 . . . . . . . . 4716 1 461 . 1 1 94 94 TRP HE1 H 1 10.14 0.01 . 1 . . . . . . . . 4716 1 462 . 1 1 94 94 TRP HE3 H 1 7.77 0.01 . 1 . . . . . . . . 4716 1 463 . 1 1 94 94 TRP HZ2 H 1 7.30 0.01 . 1 . . . . . . . . 4716 1 464 . 1 1 94 94 TRP HZ3 H 1 6.73 0.01 . 1 . . . . . . . . 4716 1 465 . 1 1 94 94 TRP HH2 H 1 6.73 0.01 . 1 . . . . . . . . 4716 1 466 . 1 1 94 94 TRP CA C 13 60.2 0.2 . 1 . . . . . . . . 4716 1 467 . 1 1 94 94 TRP CB C 13 28.8 0.2 . 1 . . . . . . . . 4716 1 468 . 1 1 94 94 TRP CD1 C 13 127.4 0.2 . 1 . . . . . . . . 4716 1 469 . 1 1 94 94 TRP CE3 C 13 122.3 0.2 . 1 . . . . . . . . 4716 1 470 . 1 1 94 94 TRP CZ2 C 13 114.6 0.2 . 1 . . . . . . . . 4716 1 471 . 1 1 94 94 TRP CZ3 C 13 121.0 0.2 . 1 . . . . . . . . 4716 1 472 . 1 1 94 94 TRP CH2 C 13 123.7 0.2 . 1 . . . . . . . . 4716 1 473 . 1 1 94 94 TRP N N 15 124.2 0.2 . 1 . . . . . . . . 4716 1 474 . 1 1 94 94 TRP NE1 N 15 130.9 0.2 . 1 . . . . . . . . 4716 1 475 . 1 1 95 95 ILE H H 1 8.26 0.01 . 1 . . . . . . . . 4716 1 476 . 1 1 95 95 ILE HA H 1 2.92 0.02 . 1 . . . . . . . . 4716 1 477 . 1 1 95 95 ILE HB H 1 2.05 0.02 . 1 . . . . . . . . 4716 1 478 . 1 1 95 95 ILE HG12 H 1 1.78 0.02 . 2 . . . . . . . . 4716 1 479 . 1 1 95 95 ILE HG21 H 1 0.87 0.02 . 1 . . . . . . . . 4716 1 480 . 1 1 95 95 ILE HG22 H 1 0.87 0.02 . 1 . . . . . . . . 4716 1 481 . 1 1 95 95 ILE HG23 H 1 0.87 0.02 . 1 . . . . . . . . 4716 1 482 . 1 1 95 95 ILE HD11 H 1 0.74 0.02 . 1 . . . . . . . . 4716 1 483 . 1 1 95 95 ILE HD12 H 1 0.74 0.02 . 1 . . . . . . . . 4716 1 484 . 1 1 95 95 ILE HD13 H 1 0.74 0.02 . 1 . . . . . . . . 4716 1 485 . 1 1 95 95 ILE CA C 13 64.8 0.2 . 1 . . . . . . . . 4716 1 486 . 1 1 95 95 ILE N N 15 117.3 0.2 . 1 . . . . . . . . 4716 1 487 . 1 1 96 96 GLU H H 1 7.61 0.01 . 1 . . . . . . . . 4716 1 488 . 1 1 96 96 GLU HA H 1 3.95 0.02 . 1 . . . . . . . . 4716 1 489 . 1 1 96 96 GLU HB2 H 1 2.03 0.02 . 2 . . . . . . . . 4716 1 490 . 1 1 96 96 GLU CA C 13 58.7 0.2 . 1 . . . . . . . . 4716 1 491 . 1 1 96 96 GLU CB C 13 29.4 0.2 . 1 . . . . . . . . 4716 1 492 . 1 1 96 96 GLU N N 15 119.8 0.2 . 1 . . . . . . . . 4716 1 493 . 1 1 97 97 GLY H H 1 8.51 0.01 . 1 . . . . . . . . 4716 1 494 . 1 1 97 97 GLY HA2 H 1 4.07 0.02 . 2 . . . . . . . . 4716 1 495 . 1 1 97 97 GLY HA3 H 1 3.94 0.02 . 2 . . . . . . . . 4716 1 496 . 1 1 97 97 GLY CA C 13 45.9 0.2 . 1 . . . . . . . . 4716 1 497 . 1 1 97 97 GLY N N 15 111.8 0.2 . 1 . . . . . . . . 4716 1 498 . 1 1 98 98 LYS H H 1 7.97 0.01 . 1 . . . . . . . . 4716 1 499 . 1 1 98 98 LYS HA H 1 4.24 0.02 . 1 . . . . . . . . 4716 1 500 . 1 1 98 98 LYS CA C 13 58.1 0.2 . 1 . . . . . . . . 4716 1 501 . 1 1 98 98 LYS N N 15 119.6 0.2 . 1 . . . . . . . . 4716 1 502 . 1 1 99 99 GLU H H 1 8.14 0.01 . 1 . . . . . . . . 4716 1 503 . 1 1 99 99 GLU HA H 1 3.78 0.02 . 1 . . . . . . . . 4716 1 504 . 1 1 99 99 GLU CA C 13 59.3 0.2 . 1 . . . . . . . . 4716 1 505 . 1 1 99 99 GLU CB C 13 29.3 0.2 . 1 . . . . . . . . 4716 1 506 . 1 1 99 99 GLU N N 15 117.5 0.2 . 1 . . . . . . . . 4716 1 507 . 1 1 100 100 ARG H H 1 9.63 0.01 . 1 . . . . . . . . 4716 1 508 . 1 1 100 100 ARG HA H 1 3.32 0.02 . 1 . . . . . . . . 4716 1 509 . 1 1 100 100 ARG HB2 H 1 1.91 0.02 . 2 . . . . . . . . 4716 1 510 . 1 1 100 100 ARG CA C 13 57.7 0.2 . 1 . . . . . . . . 4716 1 511 . 1 1 100 100 ARG CB C 13 28.7 0.2 . 1 . . . . . . . . 4716 1 512 . 1 1 100 100 ARG N N 15 118.0 0.2 . 1 . . . . . . . . 4716 1 513 . 1 1 101 101 ASN H H 1 7.68 0.01 . 1 . . . . . . . . 4716 1 514 . 1 1 101 101 ASN HA H 1 4.70 0.02 . 1 . . . . . . . . 4716 1 515 . 1 1 101 101 ASN HB2 H 1 2.57 0.02 . 2 . . . . . . . . 4716 1 516 . 1 1 101 101 ASN HB3 H 1 3.13 0.02 . 2 . . . . . . . . 4716 1 517 . 1 1 101 101 ASN CA C 13 52.1 0.2 . 1 . . . . . . . . 4716 1 518 . 1 1 101 101 ASN CB C 13 38.5 0.2 . 1 . . . . . . . . 4716 1 519 . 1 1 101 101 ASN N N 15 118.4 0.2 . 1 . . . . . . . . 4716 1 520 . 1 1 102 102 ILE H H 1 8.81 0.01 . 1 . . . . . . . . 4716 1 521 . 1 1 102 102 ILE HA H 1 3.98 0.02 . 1 . . . . . . . . 4716 1 522 . 1 1 102 102 ILE HB H 1 1.62 0.02 . 1 . . . . . . . . 4716 1 523 . 1 1 102 102 ILE HG12 H 1 1.28 0.02 . 2 . . . . . . . . 4716 1 524 . 1 1 102 102 ILE HG21 H 1 0.62 0.02 . 1 . . . . . . . . 4716 1 525 . 1 1 102 102 ILE HG22 H 1 0.62 0.02 . 1 . . . . . . . . 4716 1 526 . 1 1 102 102 ILE HG23 H 1 0.62 0.02 . 1 . . . . . . . . 4716 1 527 . 1 1 102 102 ILE CA C 13 62.0 0.2 . 1 . . . . . . . . 4716 1 528 . 1 1 102 102 ILE CB C 13 38.1 0.2 . 1 . . . . . . . . 4716 1 529 . 1 1 102 102 ILE N N 15 124.7 0.2 . 1 . . . . . . . . 4716 1 530 . 1 1 103 103 ARG H H 1 7.76 0.01 . 1 . . . . . . . . 4716 1 531 . 1 1 103 103 ARG HA H 1 3.97 0.02 . 1 . . . . . . . . 4716 1 532 . 1 1 103 103 ARG HB2 H 1 1.89 0.02 . 2 . . . . . . . . 4716 1 533 . 1 1 103 103 ARG HB3 H 1 1.76 0.02 . 2 . . . . . . . . 4716 1 534 . 1 1 103 103 ARG HG2 H 1 1.38 0.02 . 2 . . . . . . . . 4716 1 535 . 1 1 103 103 ARG CA C 13 60.3 0.2 . 1 . . . . . . . . 4716 1 536 . 1 1 103 103 ARG CB C 13 29.9 0.2 . 1 . . . . . . . . 4716 1 537 . 1 1 103 103 ARG N N 15 121.8 0.2 . 1 . . . . . . . . 4716 1 538 . 1 1 104 104 ALA H H 1 7.48 0.01 . 1 . . . . . . . . 4716 1 539 . 1 1 104 104 ALA HA H 1 3.93 0.02 . 1 . . . . . . . . 4716 1 540 . 1 1 104 104 ALA HB1 H 1 1.39 0.02 . 1 . . . . . . . . 4716 1 541 . 1 1 104 104 ALA HB2 H 1 1.39 0.02 . 1 . . . . . . . . 4716 1 542 . 1 1 104 104 ALA HB3 H 1 1.39 0.02 . 1 . . . . . . . . 4716 1 543 . 1 1 104 104 ALA CA C 13 54.9 0.2 . 1 . . . . . . . . 4716 1 544 . 1 1 104 104 ALA CB C 13 18.5 0.2 . 1 . . . . . . . . 4716 1 545 . 1 1 104 104 ALA N N 15 124.2 0.2 . 1 . . . . . . . . 4716 1 546 . 1 1 105 105 LEU H H 1 8.09 0.01 . 1 . . . . . . . . 4716 1 547 . 1 1 105 105 LEU HA H 1 3.75 0.02 . 1 . . . . . . . . 4716 1 548 . 1 1 105 105 LEU HB2 H 1 1.65 0.02 . 2 . . . . . . . . 4716 1 549 . 1 1 105 105 LEU CA C 13 58.1 0.2 . 1 . . . . . . . . 4716 1 550 . 1 1 105 105 LEU CB C 13 42.3 0.2 . 1 . . . . . . . . 4716 1 551 . 1 1 105 105 LEU N N 15 118.7 0.2 . 1 . . . . . . . . 4716 1 552 . 1 1 106 106 LEU H H 1 8.51 0.01 . 1 . . . . . . . . 4716 1 553 . 1 1 106 106 LEU HA H 1 4.19 0.02 . 1 . . . . . . . . 4716 1 554 . 1 1 106 106 LEU HB2 H 1 2.14 0.02 . 2 . . . . . . . . 4716 1 555 . 1 1 106 106 LEU CA C 13 58.8 0.2 . 1 . . . . . . . . 4716 1 556 . 1 1 106 106 LEU CB C 13 42.4 0.2 . 1 . . . . . . . . 4716 1 557 . 1 1 106 106 LEU N N 15 118.4 0.2 . 1 . . . . . . . . 4716 1 558 . 1 1 107 107 SER H H 1 8.11 0.01 . 1 . . . . . . . . 4716 1 559 . 1 1 107 107 SER HA H 1 5.00 0.02 . 1 . . . . . . . . 4716 1 560 . 1 1 107 107 SER HB2 H 1 3.88 0.02 . 2 . . . . . . . . 4716 1 561 . 1 1 107 107 SER HB3 H 1 4.27 0.02 . 2 . . . . . . . . 4716 1 562 . 1 1 107 107 SER CA C 13 60.2 0.2 . 1 . . . . . . . . 4716 1 563 . 1 1 107 107 SER CB C 13 63.8 0.2 . 1 . . . . . . . . 4716 1 564 . 1 1 107 107 SER N N 15 111.1 0.2 . 1 . . . . . . . . 4716 1 565 . 1 1 108 108 THR H H 1 7.39 0.01 . 1 . . . . . . . . 4716 1 566 . 1 1 108 108 THR HA H 1 4.94 0.02 . 1 . . . . . . . . 4716 1 567 . 1 1 108 108 THR HB H 1 4.62 0.02 . 1 . . . . . . . . 4716 1 568 . 1 1 108 108 THR HG21 H 1 1.37 0.02 . 1 . . . . . . . . 4716 1 569 . 1 1 108 108 THR HG22 H 1 1.37 0.02 . 1 . . . . . . . . 4716 1 570 . 1 1 108 108 THR HG23 H 1 1.37 0.02 . 1 . . . . . . . . 4716 1 571 . 1 1 108 108 THR CA C 13 61.7 0.2 . 1 . . . . . . . . 4716 1 572 . 1 1 108 108 THR CB C 13 71.0 0.2 . 1 . . . . . . . . 4716 1 573 . 1 1 108 108 THR N N 15 108.4 0.2 . 1 . . . . . . . . 4716 1 574 . 1 1 109 109 MET H H 1 7.96 0.01 . 1 . . . . . . . . 4716 1 575 . 1 1 109 109 MET HA H 1 3.54 0.02 . 1 . . . . . . . . 4716 1 576 . 1 1 109 109 MET HB2 H 1 1.84 0.02 . 2 . . . . . . . . 4716 1 577 . 1 1 109 109 MET HG2 H 1 2.22 0.02 . 2 . . . . . . . . 4716 1 578 . 1 1 109 109 MET CA C 13 59.2 0.2 . 1 . . . . . . . . 4716 1 579 . 1 1 109 109 MET CB C 13 34.2 0.2 . 1 . . . . . . . . 4716 1 580 . 1 1 109 109 MET N N 15 128.7 0.2 . 1 . . . . . . . . 4716 1 581 . 1 1 110 110 HIS H H 1 8.55 0.01 . 1 . . . . . . . . 4716 1 582 . 1 1 110 110 HIS HA H 1 4.16 0.02 . 1 . . . . . . . . 4716 1 583 . 1 1 110 110 HIS HB2 H 1 2.90 0.02 . 2 . . . . . . . . 4716 1 584 . 1 1 110 110 HIS HB3 H 1 3.42 0.02 . 2 . . . . . . . . 4716 1 585 . 1 1 110 110 HIS HD2 H 1 7.08 0.02 . 2 . . . . . . . . 4716 1 586 . 1 1 110 110 HIS CA C 13 58.7 0.2 . 1 . . . . . . . . 4716 1 587 . 1 1 110 110 HIS CB C 13 30.2 0.2 . 1 . . . . . . . . 4716 1 588 . 1 1 110 110 HIS CD2 C 13 119.6 0.2 . 1 . . . . . . . . 4716 1 589 . 1 1 110 110 HIS N N 15 113.1 0.2 . 1 . . . . . . . . 4716 1 590 . 1 1 111 111 THR H H 1 7.07 0.01 . 1 . . . . . . . . 4716 1 591 . 1 1 111 111 THR HA H 1 4.04 0.02 . 1 . . . . . . . . 4716 1 592 . 1 1 111 111 THR HB H 1 4.15 0.02 . 1 . . . . . . . . 4716 1 593 . 1 1 111 111 THR HG21 H 1 0.74 0.02 . 1 . . . . . . . . 4716 1 594 . 1 1 111 111 THR HG22 H 1 0.74 0.02 . 1 . . . . . . . . 4716 1 595 . 1 1 111 111 THR HG23 H 1 0.74 0.02 . 1 . . . . . . . . 4716 1 596 . 1 1 111 111 THR CA C 13 63.3 0.2 . 1 . . . . . . . . 4716 1 597 . 1 1 111 111 THR CB C 13 69.6 0.2 . 1 . . . . . . . . 4716 1 598 . 1 1 111 111 THR N N 15 111.1 0.2 . 1 . . . . . . . . 4716 1 599 . 1 1 112 112 VAL H H 1 6.71 0.01 . 1 . . . . . . . . 4716 1 600 . 1 1 112 112 VAL HA H 1 4.25 0.02 . 1 . . . . . . . . 4716 1 601 . 1 1 112 112 VAL HB H 1 1.73 0.02 . 1 . . . . . . . . 4716 1 602 . 1 1 112 112 VAL CA C 13 60.3 0.2 . 1 . . . . . . . . 4716 1 603 . 1 1 112 112 VAL CB C 13 32.6 0.2 . 1 . . . . . . . . 4716 1 604 . 1 1 112 112 VAL N N 15 112.9 0.2 . 1 . . . . . . . . 4716 1 605 . 1 1 113 113 LEU H H 1 6.09 0.01 . 1 . . . . . . . . 4716 1 606 . 1 1 113 113 LEU HA H 1 3.49 0.02 . 1 . . . . . . . . 4716 1 607 . 1 1 113 113 LEU HB2 H 1 1.28 0.02 . 2 . . . . . . . . 4716 1 608 . 1 1 113 113 LEU HD11 H 1 0.31 0.02 . 2 . . . . . . . . 4716 1 609 . 1 1 113 113 LEU HD12 H 1 0.31 0.02 . 2 . . . . . . . . 4716 1 610 . 1 1 113 113 LEU HD13 H 1 0.31 0.02 . 2 . . . . . . . . 4716 1 611 . 1 1 113 113 LEU CA C 13 54.6 0.2 . 1 . . . . . . . . 4716 1 612 . 1 1 113 113 LEU CB C 13 42.6 0.2 . 1 . . . . . . . . 4716 1 613 . 1 1 113 113 LEU N N 15 119.6 0.2 . 1 . . . . . . . . 4716 1 614 . 1 1 114 114 TRP H H 1 6.04 0.01 . 1 . . . . . . . . 4716 1 615 . 1 1 114 114 TRP HA H 1 4.50 0.02 . 1 . . . . . . . . 4716 1 616 . 1 1 114 114 TRP HB2 H 1 3.27 0.02 . 2 . . . . . . . . 4716 1 617 . 1 1 114 114 TRP HB3 H 1 3.49 0.02 . 2 . . . . . . . . 4716 1 618 . 1 1 114 114 TRP HD1 H 1 6.66 0.01 . 1 . . . . . . . . 4716 1 619 . 1 1 114 114 TRP HE1 H 1 9.91 0.01 . 1 . . . . . . . . 4716 1 620 . 1 1 114 114 TRP HE3 H 1 7.58 0.01 . 1 . . . . . . . . 4716 1 621 . 1 1 114 114 TRP HZ2 H 1 7.09 0.01 . 1 . . . . . . . . 4716 1 622 . 1 1 114 114 TRP HZ3 H 1 6.73 0.01 . 1 . . . . . . . . 4716 1 623 . 1 1 114 114 TRP HH2 H 1 6.91 0.01 . 1 . . . . . . . . 4716 1 624 . 1 1 114 114 TRP CA C 13 56.2 0.2 . 1 . . . . . . . . 4716 1 625 . 1 1 114 114 TRP CB C 13 28.7 0.2 . 1 . . . . . . . . 4716 1 626 . 1 1 114 114 TRP CD1 C 13 128.8 0.2 . 1 . . . . . . . . 4716 1 627 . 1 1 114 114 TRP CE3 C 13 119.1 0.2 . 1 . . . . . . . . 4716 1 628 . 1 1 114 114 TRP CZ2 C 13 115.9 0.2 . 1 . . . . . . . . 4716 1 629 . 1 1 114 114 TRP CZ3 C 13 121.4 0.2 . 1 . . . . . . . . 4716 1 630 . 1 1 114 114 TRP CH2 C 13 124.2 0.2 . 1 . . . . . . . . 4716 1 631 . 1 1 114 114 TRP N N 15 119.3 0.2 . 1 . . . . . . . . 4716 1 632 . 1 1 114 114 TRP NE1 N 15 133.6 0.2 . 1 . . . . . . . . 4716 1 633 . 1 1 115 115 ALA H H 1 8.63 0.01 . 1 . . . . . . . . 4716 1 634 . 1 1 115 115 ALA HA H 1 4.11 0.02 . 1 . . . . . . . . 4716 1 635 . 1 1 115 115 ALA HB1 H 1 1.41 0.02 . 1 . . . . . . . . 4716 1 636 . 1 1 115 115 ALA HB2 H 1 1.41 0.02 . 1 . . . . . . . . 4716 1 637 . 1 1 115 115 ALA HB3 H 1 1.41 0.02 . 1 . . . . . . . . 4716 1 638 . 1 1 115 115 ALA CA C 13 53.4 0.2 . 1 . . . . . . . . 4716 1 639 . 1 1 115 115 ALA CB C 13 18.6 0.2 . 1 . . . . . . . . 4716 1 640 . 1 1 115 115 ALA N N 15 124.2 0.2 . 1 . . . . . . . . 4716 1 641 . 1 1 116 116 GLY H H 1 8.67 0.02 . 1 . . . . . . . . 4716 1 642 . 1 1 116 116 GLY HA2 H 1 3.78 0.03 . 2 . . . . . . . . 4716 1 643 . 1 1 116 116 GLY HA3 H 1 4.26 0.03 . 2 . . . . . . . . 4716 1 644 . 1 1 116 116 GLY CA C 13 45.0 0.2 . 1 . . . . . . . . 4716 1 645 . 1 1 116 116 GLY N N 15 109.3 0.2 . 1 . . . . . . . . 4716 1 646 . 1 1 117 117 GLU H H 1 7.44 0.01 . 1 . . . . . . . . 4716 1 647 . 1 1 117 117 GLU HA H 1 4.24 0.02 . 1 . . . . . . . . 4716 1 648 . 1 1 117 117 GLU HB2 H 1 1.75 0.02 . 2 . . . . . . . . 4716 1 649 . 1 1 117 117 GLU CA C 13 58.6 0.2 . 1 . . . . . . . . 4716 1 650 . 1 1 117 117 GLU CB C 13 28.7 0.2 . 1 . . . . . . . . 4716 1 651 . 1 1 117 117 GLU N N 15 124.7 0.2 . 1 . . . . . . . . 4716 1 652 . 1 1 118 118 THR HA H 1 4.57 0.02 . 1 . . . . . . . . 4716 1 653 . 1 1 118 118 THR HB H 1 4.41 0.02 . 1 . . . . . . . . 4716 1 654 . 1 1 118 118 THR CA C 13 62.3 0.2 . 1 . . . . . . . . 4716 1 655 . 1 1 118 118 THR CB C 13 69.2 0.2 . 1 . . . . . . . . 4716 1 656 . 1 1 119 119 LYS H H 1 9.71 0.01 . 1 . . . . . . . . 4716 1 657 . 1 1 119 119 LYS HA H 1 4.31 0.02 . 1 . . . . . . . . 4716 1 658 . 1 1 119 119 LYS HB2 H 1 1.89 0.02 . 2 . . . . . . . . 4716 1 659 . 1 1 119 119 LYS HB3 H 1 2.06 0.02 . 2 . . . . . . . . 4716 1 660 . 1 1 119 119 LYS HG2 H 1 1.43 0.02 . 2 . . . . . . . . 4716 1 661 . 1 1 119 119 LYS HG3 H 1 1.56 0.02 . 2 . . . . . . . . 4716 1 662 . 1 1 119 119 LYS HD2 H 1 1.70 0.02 . 2 . . . . . . . . 4716 1 663 . 1 1 119 119 LYS CA C 13 57.2 0.2 . 1 . . . . . . . . 4716 1 664 . 1 1 119 119 LYS CB C 13 33.0 0.2 . 1 . . . . . . . . 4716 1 665 . 1 1 119 119 LYS N N 15 124.4 0.2 . 1 . . . . . . . . 4716 1 666 . 1 1 120 120 TRP H H 1 9.58 0.01 . 1 . . . . . . . . 4716 1 667 . 1 1 120 120 TRP HA H 1 4.47 0.02 . 1 . . . . . . . . 4716 1 668 . 1 1 120 120 TRP HB2 H 1 2.72 0.02 . 2 . . . . . . . . 4716 1 669 . 1 1 120 120 TRP HB3 H 1 2.93 0.02 . 2 . . . . . . . . 4716 1 670 . 1 1 120 120 TRP HD1 H 1 6.84 0.02 . 1 . . . . . . . . 4716 1 671 . 1 1 120 120 TRP HE1 H 1 10.7 0.01 . 1 . . . . . . . . 4716 1 672 . 1 1 120 120 TRP HE3 H 1 7.43 0.01 . 1 . . . . . . . . 4716 1 673 . 1 1 120 120 TRP HZ2 H 1 7.71 0.01 . 1 . . . . . . . . 4716 1 674 . 1 1 120 120 TRP HZ3 H 1 6.84 0.01 . 1 . . . . . . . . 4716 1 675 . 1 1 120 120 TRP HH2 H 1 7.21 0.01 . 1 . . . . . . . . 4716 1 676 . 1 1 120 120 TRP CA C 13 57.2 0.2 . 1 . . . . . . . . 4716 1 677 . 1 1 120 120 TRP CB C 13 30.7 0.2 . 1 . . . . . . . . 4716 1 678 . 1 1 120 120 TRP CD1 C 13 126.9 0.2 . 1 . . . . . . . . 4716 1 679 . 1 1 120 120 TRP CE3 C 13 121.0 0.2 . 1 . . . . . . . . 4716 1 680 . 1 1 120 120 TRP CZ2 C 13 115.9 0.2 . 1 . . . . . . . . 4716 1 681 . 1 1 120 120 TRP CZ3 C 13 120.5 0.2 . 1 . . . . . . . . 4716 1 682 . 1 1 120 120 TRP CH2 C 13 124.6 0.2 . 1 . . . . . . . . 4716 1 683 . 1 1 120 120 TRP N N 15 124.2 0.2 . 1 . . . . . . . . 4716 1 684 . 1 1 120 120 TRP NE1 N 15 130.7 0.2 . 1 . . . . . . . . 4716 1 685 . 1 1 121 121 LYS H H 1 6.73 0.01 . 1 . . . . . . . . 4716 1 686 . 1 1 121 121 LYS HA H 1 4.47 0.02 . 1 . . . . . . . . 4716 1 687 . 1 1 121 121 LYS HB2 H 1 1.23 0.02 . 2 . . . . . . . . 4716 1 688 . 1 1 121 121 LYS HB3 H 1 1.36 0.02 . 2 . . . . . . . . 4716 1 689 . 1 1 121 121 LYS CA C 13 51.9 0.2 . 1 . . . . . . . . 4716 1 690 . 1 1 121 121 LYS CB C 13 32.9 0.2 . 1 . . . . . . . . 4716 1 691 . 1 1 121 121 LYS N N 15 129.6 0.2 . 1 . . . . . . . . 4716 1 692 . 1 1 122 122 PRO CA C 13 63.3 0.2 . 1 . . . . . . . . 4716 1 693 . 1 1 122 122 PRO CB C 13 31.5 0.2 . 1 . . . . . . . . 4716 1 694 . 1 1 123 123 VAL H H 1 7.77 0.01 . 1 . . . . . . . . 4716 1 695 . 1 1 123 123 VAL HA H 1 4.28 0.01 . 1 . . . . . . . . 4716 1 696 . 1 1 123 123 VAL HB H 1 2.04 0.01 . 1 . . . . . . . . 4716 1 697 . 1 1 123 123 VAL HG11 H 1 0.87 0.02 . 2 . . . . . . . . 4716 1 698 . 1 1 123 123 VAL HG12 H 1 0.87 0.02 . 2 . . . . . . . . 4716 1 699 . 1 1 123 123 VAL HG13 H 1 0.87 0.02 . 2 . . . . . . . . 4716 1 700 . 1 1 123 123 VAL CA C 13 59.7 0.2 . 1 . . . . . . . . 4716 1 701 . 1 1 123 123 VAL CB C 13 34.7 0.2 . 1 . . . . . . . . 4716 1 702 . 1 1 123 123 VAL N N 15 121.1 0.2 . 1 . . . . . . . . 4716 1 703 . 1 1 124 124 GLY H H 1 8.89 0.01 . 1 . . . . . . . . 4716 1 704 . 1 1 124 124 GLY HA2 H 1 4.65 0.02 . 2 . . . . . . . . 4716 1 705 . 1 1 124 124 GLY HA3 H 1 3.75 0.02 . 2 . . . . . . . . 4716 1 706 . 1 1 124 124 GLY CA C 13 43.5 0.2 . 1 . . . . . . . . 4716 1 707 . 1 1 124 124 GLY N N 15 111.3 0.2 . 1 . . . . . . . . 4716 1 708 . 1 1 125 125 MET H H 1 8.69 0.01 . 1 . . . . . . . . 4716 1 709 . 1 1 125 125 MET HA H 1 4.23 0.01 . 1 . . . . . . . . 4716 1 710 . 1 1 125 125 MET HB2 H 1 2.04 0.02 . 2 . . . . . . . . 4716 1 711 . 1 1 125 125 MET HG2 H 1 2.66 0.02 . 2 . . . . . . . . 4716 1 712 . 1 1 125 125 MET HG3 H 1 2.77 0.02 . 2 . . . . . . . . 4716 1 713 . 1 1 125 125 MET CA C 13 57.4 0.2 . 1 . . . . . . . . 4716 1 714 . 1 1 125 125 MET CB C 13 30.7 0.2 . 1 . . . . . . . . 4716 1 715 . 1 1 125 125 MET N N 15 119.6 0.2 . 1 . . . . . . . . 4716 1 716 . 1 1 126 126 ALA H H 1 8.58 0.01 . 1 . . . . . . . . 4716 1 717 . 1 1 126 126 ALA HA H 1 4.10 0.02 . 1 . . . . . . . . 4716 1 718 . 1 1 126 126 ALA HB1 H 1 1.37 0.02 . 1 . . . . . . . . 4716 1 719 . 1 1 126 126 ALA HB2 H 1 1.37 0.02 . 1 . . . . . . . . 4716 1 720 . 1 1 126 126 ALA HB3 H 1 1.37 0.02 . 1 . . . . . . . . 4716 1 721 . 1 1 126 126 ALA CA C 13 54.3 0.2 . 1 . . . . . . . . 4716 1 722 . 1 1 126 126 ALA CB C 13 18.5 0.2 . 1 . . . . . . . . 4716 1 723 . 1 1 126 126 ALA N N 15 120.7 0.2 . 1 . . . . . . . . 4716 1 724 . 1 1 127 127 ASP H H 1 7.53 0.01 . 1 . . . . . . . . 4716 1 725 . 1 1 127 127 ASP HA H 1 4.80 0.02 . 9 . . . . . . . . 4716 1 726 . 1 1 127 127 ASP HB2 H 1 2.82 0.02 . 2 . . . . . . . . 4716 1 727 . 1 1 127 127 ASP CA C 13 54.5 0.2 . 1 . . . . . . . . 4716 1 728 . 1 1 127 127 ASP CB C 13 42.2 0.2 . 1 . . . . . . . . 4716 1 729 . 1 1 127 127 ASP N N 15 116.0 0.2 . 1 . . . . . . . . 4716 1 730 . 1 1 128 128 LEU H H 1 7.50 0.01 . 1 . . . . . . . . 4716 1 731 . 1 1 128 128 LEU HA H 1 4.49 0.02 . 1 . . . . . . . . 4716 1 732 . 1 1 128 128 LEU HD11 H 1 0.89 0.02 . 2 . . . . . . . . 4716 1 733 . 1 1 128 128 LEU HD12 H 1 0.89 0.02 . 2 . . . . . . . . 4716 1 734 . 1 1 128 128 LEU HD13 H 1 0.89 0.02 . 2 . . . . . . . . 4716 1 735 . 1 1 128 128 LEU CA C 13 53.0 0.2 . 1 . . . . . . . . 4716 1 736 . 1 1 128 128 LEU CB C 13 44.1 0.2 . 1 . . . . . . . . 4716 1 737 . 1 1 128 128 LEU N N 15 119.3 0.2 . 1 . . . . . . . . 4716 1 738 . 1 1 129 129 VAL H H 1 7.45 0.01 . 1 . . . . . . . . 4716 1 739 . 1 1 129 129 VAL HA H 1 3.69 0.02 . 1 . . . . . . . . 4716 1 740 . 1 1 129 129 VAL HB H 1 2.34 0.02 . 1 . . . . . . . . 4716 1 741 . 1 1 129 129 VAL HG11 H 1 0.91 0.02 . 2 . . . . . . . . 4716 1 742 . 1 1 129 129 VAL HG12 H 1 0.91 0.02 . 2 . . . . . . . . 4716 1 743 . 1 1 129 129 VAL HG13 H 1 0.91 0.02 . 2 . . . . . . . . 4716 1 744 . 1 1 129 129 VAL HG21 H 1 1.13 0.02 . 2 . . . . . . . . 4716 1 745 . 1 1 129 129 VAL HG22 H 1 1.13 0.02 . 2 . . . . . . . . 4716 1 746 . 1 1 129 129 VAL HG23 H 1 1.13 0.02 . 2 . . . . . . . . 4716 1 747 . 1 1 129 129 VAL CA C 13 67.1 0.2 . 1 . . . . . . . . 4716 1 748 . 1 1 129 129 VAL CB C 13 32.6 0.2 . 1 . . . . . . . . 4716 1 749 . 1 1 129 129 VAL N N 15 122.9 0.2 . 1 . . . . . . . . 4716 1 750 . 1 1 130 130 THR H H 1 8.81 0.01 . 1 . . . . . . . . 4716 1 751 . 1 1 130 130 THR HA H 1 4.88 0.02 . 2 . . . . . . . . 4716 1 752 . 1 1 130 130 THR HB H 1 4.88 0.02 . 2 . . . . . . . . 4716 1 753 . 1 1 130 130 THR HG21 H 1 1.34 0.02 . 1 . . . . . . . . 4716 1 754 . 1 1 130 130 THR HG22 H 1 1.34 0.02 . 1 . . . . . . . . 4716 1 755 . 1 1 130 130 THR HG23 H 1 1.34 0.02 . 1 . . . . . . . . 4716 1 756 . 1 1 130 130 THR CA C 13 59.5 0.2 . 1 . . . . . . . . 4716 1 757 . 1 1 130 130 THR CB C 13 68.8 0.2 . 1 . . . . . . . . 4716 1 758 . 1 1 130 130 THR N N 15 112.4 0.2 . 1 . . . . . . . . 4716 1 759 . 1 1 131 131 PRO CA C 13 66.2 0.2 . 1 . . . . . . . . 4716 1 760 . 1 1 131 131 PRO CB C 13 32.1 0.2 . 1 . . . . . . . . 4716 1 761 . 1 1 132 132 GLU H H 1 8.53 0.01 . 1 . . . . . . . . 4716 1 762 . 1 1 132 132 GLU HA H 1 4.13 0.02 . 1 . . . . . . . . 4716 1 763 . 1 1 132 132 GLU HB2 H 1 2.00 0.02 . 2 . . . . . . . . 4716 1 764 . 1 1 132 132 GLU HB3 H 1 2.15 0.02 . 2 . . . . . . . . 4716 1 765 . 1 1 132 132 GLU HG2 H 1 2.35 0.02 . 2 . . . . . . . . 4716 1 766 . 1 1 132 132 GLU HG3 H 1 2.45 0.02 . 2 . . . . . . . . 4716 1 767 . 1 1 132 132 GLU CA C 13 60.3 0.2 . 1 . . . . . . . . 4716 1 768 . 1 1 132 132 GLU CB C 13 29.2 0.2 . 1 . . . . . . . . 4716 1 769 . 1 1 132 132 GLU N N 15 118.2 0.2 . 1 . . . . . . . . 4716 1 770 . 1 1 133 133 GLN H H 1 7.92 0.01 . 1 . . . . . . . . 4716 1 771 . 1 1 133 133 GLN HA H 1 4.04 0.02 . 1 . . . . . . . . 4716 1 772 . 1 1 133 133 GLN HB2 H 1 2.01 0.02 . 2 . . . . . . . . 4716 1 773 . 1 1 133 133 GLN HB3 H 1 2.16 0.02 . 2 . . . . . . . . 4716 1 774 . 1 1 133 133 GLN HG2 H 1 2.31 0.02 . 2 . . . . . . . . 4716 1 775 . 1 1 133 133 GLN HG3 H 1 2.49 0.02 . 2 . . . . . . . . 4716 1 776 . 1 1 133 133 GLN CA C 13 59.7 0.2 . 1 . . . . . . . . 4716 1 777 . 1 1 133 133 GLN CB C 13 29.0 0.2 . 1 . . . . . . . . 4716 1 778 . 1 1 133 133 GLN N N 15 121.6 0.2 . 1 . . . . . . . . 4716 1 779 . 1 1 134 134 VAL H H 1 8.19 0.2 . 1 . . . . . . . . 4716 1 780 . 1 1 134 134 VAL HA H 1 3.36 0.02 . 1 . . . . . . . . 4716 1 781 . 1 1 134 134 VAL HB H 1 2.04 0.02 . 1 . . . . . . . . 4716 1 782 . 1 1 134 134 VAL HG11 H 1 0.82 0.02 . 2 . . . . . . . . 4716 1 783 . 1 1 134 134 VAL HG12 H 1 0.82 0.02 . 2 . . . . . . . . 4716 1 784 . 1 1 134 134 VAL HG13 H 1 0.82 0.02 . 2 . . . . . . . . 4716 1 785 . 1 1 134 134 VAL CA C 13 67.1 0.2 . 1 . . . . . . . . 4716 1 786 . 1 1 134 134 VAL CB C 13 32.2 0.2 . 1 . . . . . . . . 4716 1 787 . 1 1 134 134 VAL N N 15 118.2 0.2 . 1 . . . . . . . . 4716 1 788 . 1 1 135 135 LYS H H 1 8.43 0.01 . 1 . . . . . . . . 4716 1 789 . 1 1 135 135 LYS HA H 1 3.82 0.02 . 1 . . . . . . . . 4716 1 790 . 1 1 135 135 LYS HB2 H 1 2.04 0.02 . 2 . . . . . . . . 4716 1 791 . 1 1 135 135 LYS HB3 H 1 2.22 0.02 . 2 . . . . . . . . 4716 1 792 . 1 1 135 135 LYS CA C 13 60.7 0.2 . 1 . . . . . . . . 4716 1 793 . 1 1 135 135 LYS CB C 13 32.9 0.2 . 1 . . . . . . . . 4716 1 794 . 1 1 135 135 LYS N N 15 119.3 0.2 . 1 . . . . . . . . 4716 1 795 . 1 1 136 136 LYS H H 1 7.80 0.01 . 1 . . . . . . . . 4716 1 796 . 1 1 136 136 LYS HA H 1 3.98 0.02 . 1 . . . . . . . . 4716 1 797 . 1 1 136 136 LYS HB2 H 1 2.02 0.02 . 2 . . . . . . . . 4716 1 798 . 1 1 136 136 LYS HG2 H 1 1.41 0.02 . 2 . . . . . . . . 4716 1 799 . 1 1 136 136 LYS HG3 H 1 1.66 0.02 . 2 . . . . . . . . 4716 1 800 . 1 1 136 136 LYS CA C 13 60.0 0.2 . 1 . . . . . . . . 4716 1 801 . 1 1 136 136 LYS CB C 13 32.7 0.2 . 1 . . . . . . . . 4716 1 802 . 1 1 136 136 LYS N N 15 118.7 0.2 . 1 . . . . . . . . 4716 1 803 . 1 1 137 137 VAL H H 1 8.28 0.01 . 1 . . . . . . . . 4716 1 804 . 1 1 137 137 VAL HA H 1 3.71 0.02 . 1 . . . . . . . . 4716 1 805 . 1 1 137 137 VAL HB H 1 2.08 0.02 . 2 . . . . . . . . 4716 1 806 . 1 1 137 137 VAL HG11 H 1 1.15 0.02 . 2 . . . . . . . . 4716 1 807 . 1 1 137 137 VAL HG12 H 1 1.15 0.02 . 2 . . . . . . . . 4716 1 808 . 1 1 137 137 VAL HG13 H 1 1.15 0.02 . 2 . . . . . . . . 4716 1 809 . 1 1 137 137 VAL HG21 H 1 1.44 0.02 . 2 . . . . . . . . 4716 1 810 . 1 1 137 137 VAL HG22 H 1 1.44 0.02 . 2 . . . . . . . . 4716 1 811 . 1 1 137 137 VAL HG23 H 1 1.44 0.02 . 2 . . . . . . . . 4716 1 812 . 1 1 137 137 VAL CA C 13 66.1 0.2 . 1 . . . . . . . . 4716 1 813 . 1 1 137 137 VAL CB C 13 31.5 0.2 . 1 . . . . . . . . 4716 1 814 . 1 1 137 137 VAL N N 15 121.3 0.2 . 1 . . . . . . . . 4716 1 815 . 1 1 138 138 TYR H H 1 9.22 0.01 . 1 . . . . . . . . 4716 1 816 . 1 1 138 138 TYR HA H 1 4.23 0.02 . 1 . . . . . . . . 4716 1 817 . 1 1 138 138 TYR HB2 H 1 2.98 0.02 . 2 . . . . . . . . 4716 1 818 . 1 1 138 138 TYR HD1 H 1 6.33 0.02 . 3 . . . . . . . . 4716 1 819 . 1 1 138 138 TYR HE1 H 1 6.06 0.02 . 3 . . . . . . . . 4716 1 820 . 1 1 138 138 TYR CA C 13 61.3 0.2 . 1 . . . . . . . . 4716 1 821 . 1 1 138 138 TYR CB C 13 38.2 0.2 . 1 . . . . . . . . 4716 1 822 . 1 1 138 138 TYR CD1 C 13 132.4 0.2 . 3 . . . . . . . . 4716 1 823 . 1 1 138 138 TYR CE1 C 13 118.7 0.2 . 3 . . . . . . . . 4716 1 824 . 1 1 138 138 TYR N N 15 123.6 0.2 . 1 . . . . . . . . 4716 1 825 . 1 1 139 139 ARG H H 1 8.16 0.2 . 1 . . . . . . . . 4716 1 826 . 1 1 139 139 ARG HA H 1 3.45 0.02 . 1 . . . . . . . . 4716 1 827 . 1 1 139 139 ARG HB2 H 1 2.12 0.02 . 2 . . . . . . . . 4716 1 828 . 1 1 139 139 ARG HG2 H 1 1.80 0.02 . 2 . . . . . . . . 4716 1 829 . 1 1 139 139 ARG HD2 H 1 3.00 0.02 . 2 . . . . . . . . 4716 1 830 . 1 1 139 139 ARG CA C 13 59.3 0.2 . 1 . . . . . . . . 4716 1 831 . 1 1 139 139 ARG CB C 13 29.5 0.2 . 1 . . . . . . . . 4716 1 832 . 1 1 139 139 ARG N N 15 117.8 0.2 . 1 . . . . . . . . 4716 1 833 . 1 1 140 140 LYS H H 1 7.47 0.01 . 1 . . . . . . . . 4716 1 834 . 1 1 140 140 LYS HA H 1 4.10 0.02 . 1 . . . . . . . . 4716 1 835 . 1 1 140 140 LYS HB2 H 1 2.24 0.02 . 2 . . . . . . . . 4716 1 836 . 1 1 140 140 LYS HG2 H 1 1.79 0.02 . 2 . . . . . . . . 4716 1 837 . 1 1 140 140 LYS CA C 13 59.5 0.2 . 1 . . . . . . . . 4716 1 838 . 1 1 140 140 LYS CB C 13 32.9 0.2 . 1 . . . . . . . . 4716 1 839 . 1 1 140 140 LYS N N 15 119.1 0.2 . 1 . . . . . . . . 4716 1 840 . 1 1 141 141 ALA H H 1 8.70 0.01 . 1 . . . . . . . . 4716 1 841 . 1 1 141 141 ALA HA H 1 3.69 0.02 . 1 . . . . . . . . 4716 1 842 . 1 1 141 141 ALA HB1 H 1 1.23 0.02 . 1 . . . . . . . . 4716 1 843 . 1 1 141 141 ALA HB2 H 1 1.23 0.02 . 1 . . . . . . . . 4716 1 844 . 1 1 141 141 ALA HB3 H 1 1.23 0.02 . 1 . . . . . . . . 4716 1 845 . 1 1 141 141 ALA CA C 13 55.5 0.2 . 1 . . . . . . . . 4716 1 846 . 1 1 141 141 ALA CB C 13 19.4 0.2 . 1 . . . . . . . . 4716 1 847 . 1 1 141 141 ALA N N 15 124.9 0.2 . 1 . . . . . . . . 4716 1 848 . 1 1 142 142 VAL H H 1 8.22 0.01 . 1 . . . . . . . . 4716 1 849 . 1 1 142 142 VAL HA H 1 3.52 0.02 . 1 . . . . . . . . 4716 1 850 . 1 1 142 142 VAL HB H 1 1.99 0.02 . 1 . . . . . . . . 4716 1 851 . 1 1 142 142 VAL HG11 H 1 0.58 0.02 . 2 . . . . . . . . 4716 1 852 . 1 1 142 142 VAL HG12 H 1 0.58 0.02 . 2 . . . . . . . . 4716 1 853 . 1 1 142 142 VAL HG13 H 1 0.58 0.02 . 2 . . . . . . . . 4716 1 854 . 1 1 142 142 VAL HG21 H 1 0.91 0.02 . 2 . . . . . . . . 4716 1 855 . 1 1 142 142 VAL HG22 H 1 0.91 0.02 . 2 . . . . . . . . 4716 1 856 . 1 1 142 142 VAL HG23 H 1 0.91 0.02 . 2 . . . . . . . . 4716 1 857 . 1 1 142 142 VAL CA C 13 65.9 0.2 . 1 . . . . . . . . 4716 1 858 . 1 1 142 142 VAL CB C 13 31.7 0.2 . 1 . . . . . . . . 4716 1 859 . 1 1 142 142 VAL N N 15 116.0 0.2 . 1 . . . . . . . . 4716 1 860 . 1 1 143 143 LEU H H 1 7.08 0.01 . 1 . . . . . . . . 4716 1 861 . 1 1 143 143 LEU HA H 1 4.15 0.02 . 1 . . . . . . . . 4716 1 862 . 1 1 143 143 LEU HB2 H 1 1.98 0.02 . 2 . . . . . . . . 4716 1 863 . 1 1 143 143 LEU HD11 H 1 0.91 0.02 . 2 . . . . . . . . 4716 1 864 . 1 1 143 143 LEU HD12 H 1 0.91 0.02 . 2 . . . . . . . . 4716 1 865 . 1 1 143 143 LEU HD13 H 1 0.91 0.02 . 2 . . . . . . . . 4716 1 866 . 1 1 143 143 LEU CA C 13 57.6 0.2 . 1 . . . . . . . . 4716 1 867 . 1 1 143 143 LEU CB C 13 41.8 0.2 . 1 . . . . . . . . 4716 1 868 . 1 1 143 143 LEU N N 15 117.3 0.2 . 1 . . . . . . . . 4716 1 869 . 1 1 144 144 VAL H H 1 7.48 0.01 . 1 . . . . . . . . 4716 1 870 . 1 1 144 144 VAL HA H 1 3.85 0.02 . 1 . . . . . . . . 4716 1 871 . 1 1 144 144 VAL HB H 1 2.23 0.02 . 1 . . . . . . . . 4716 1 872 . 1 1 144 144 VAL HG11 H 1 1.20 0.02 . 2 . . . . . . . . 4716 1 873 . 1 1 144 144 VAL HG12 H 1 1.20 0.02 . 2 . . . . . . . . 4716 1 874 . 1 1 144 144 VAL HG13 H 1 1.20 0.02 . 2 . . . . . . . . 4716 1 875 . 1 1 144 144 VAL CA C 13 65.9 0.2 . 1 . . . . . . . . 4716 1 876 . 1 1 144 144 VAL CB C 13 32.2 0.2 . 1 . . . . . . . . 4716 1 877 . 1 1 144 144 VAL N N 15 118.7 0.2 . 1 . . . . . . . . 4716 1 878 . 1 1 145 145 VAL H H 1 7.41 0.01 . 1 . . . . . . . . 4716 1 879 . 1 1 145 145 VAL HA H 1 4.66 0.02 . 1 . . . . . . . . 4716 1 880 . 1 1 145 145 VAL HG11 H 1 0.99 0.02 . 2 . . . . . . . . 4716 1 881 . 1 1 145 145 VAL HG12 H 1 0.99 0.02 . 2 . . . . . . . . 4716 1 882 . 1 1 145 145 VAL HG13 H 1 0.99 0.02 . 2 . . . . . . . . 4716 1 883 . 1 1 145 145 VAL CA C 13 60.9 0.2 . 1 . . . . . . . . 4716 1 884 . 1 1 145 145 VAL CB C 13 31.4 0.2 . 1 . . . . . . . . 4716 1 885 . 1 1 145 145 VAL N N 15 109.1 0.2 . 1 . . . . . . . . 4716 1 886 . 1 1 146 146 HIS H H 1 7.29 0.01 . 1 . . . . . . . . 4716 1 887 . 1 1 146 146 HIS HA H 1 4.16 0.02 . 1 . . . . . . . . 4716 1 888 . 1 1 146 146 HIS HB2 H 1 3.55 0.02 . 2 . . . . . . . . 4716 1 889 . 1 1 146 146 HIS HB3 H 1 3.64 0.02 . 2 . . . . . . . . 4716 1 890 . 1 1 146 146 HIS HD2 H 1 6.88 0.02 . 2 . . . . . . . . 4716 1 891 . 1 1 146 146 HIS HE2 H 1 7.63 0.02 . 2 . . . . . . . . 4716 1 892 . 1 1 146 146 HIS CA C 13 57.4 0.2 . 1 . . . . . . . . 4716 1 893 . 1 1 146 146 HIS CB C 13 31.4 0.2 . 1 . . . . . . . . 4716 1 894 . 1 1 146 146 HIS CD2 C 13 117.8 0.2 . 1 . . . . . . . . 4716 1 895 . 1 1 146 146 HIS CE1 C 13 139.8 0.2 . 1 . . . . . . . . 4716 1 896 . 1 1 146 146 HIS N N 15 122.9 0.2 . 1 . . . . . . . . 4716 1 897 . 1 1 147 147 PRO CA C 13 65.3 0.2 . 1 . . . . . . . . 4716 1 898 . 1 1 147 147 PRO CB C 13 32.0 0.2 . 1 . . . . . . . . 4716 1 899 . 1 1 148 148 ASP H H 1 11.05 0.01 . 1 . . . . . . . . 4716 1 900 . 1 1 148 148 ASP HA H 1 4.40 0.01 . 1 . . . . . . . . 4716 1 901 . 1 1 148 148 ASP HB2 H 1 2.65 0.02 . 2 . . . . . . . . 4716 1 902 . 1 1 148 148 ASP CA C 13 57.5 0.2 . 1 . . . . . . . . 4716 1 903 . 1 1 148 148 ASP CB C 13 39.8 0.2 . 1 . . . . . . . . 4716 1 904 . 1 1 148 148 ASP N N 15 124.2 0.2 . 1 . . . . . . . . 4716 1 905 . 1 1 149 149 LYS H H 1 7.55 0.01 . 1 . . . . . . . . 4716 1 906 . 1 1 149 149 LYS HA H 1 4.37 0.01 . 1 . . . . . . . . 4716 1 907 . 1 1 149 149 LYS HB2 H 1 1.99 0.02 . 2 . . . . . . . . 4716 1 908 . 1 1 149 149 LYS HG2 H 1 1.44 0.02 . 2 . . . . . . . . 4716 1 909 . 1 1 149 149 LYS CA C 13 56.2 0.2 . 1 . . . . . . . . 4716 1 910 . 1 1 149 149 LYS CB C 13 32.7 0.2 . 1 . . . . . . . . 4716 1 911 . 1 1 149 149 LYS N N 15 118.0 0.2 . 1 . . . . . . . . 4716 1 912 . 1 1 150 150 ALA H H 1 7.56 0.01 . 1 . . . . . . . . 4716 1 913 . 1 1 150 150 ALA HA H 1 4.05 0.03 . 1 . . . . . . . . 4716 1 914 . 1 1 150 150 ALA HB1 H 1 1.19 0.02 . 1 . . . . . . . . 4716 1 915 . 1 1 150 150 ALA HB2 H 1 1.19 0.02 . 1 . . . . . . . . 4716 1 916 . 1 1 150 150 ALA HB3 H 1 1.19 0.02 . 1 . . . . . . . . 4716 1 917 . 1 1 150 150 ALA CA C 13 52.0 0.2 . 1 . . . . . . . . 4716 1 918 . 1 1 150 150 ALA CB C 13 20.8 0.2 . 1 . . . . . . . . 4716 1 919 . 1 1 150 150 ALA N N 15 121.1 0.2 . 1 . . . . . . . . 4716 1 920 . 1 1 151 151 THR H H 1 7.26 0.01 . 1 . . . . . . . . 4716 1 921 . 1 1 151 151 THR HA H 1 3.72 0.01 . 1 . . . . . . . . 4716 1 922 . 1 1 151 151 THR HB H 1 4.01 0.02 . 1 . . . . . . . . 4716 1 923 . 1 1 151 151 THR HG21 H 1 1.17 0.02 . 1 . . . . . . . . 4716 1 924 . 1 1 151 151 THR HG22 H 1 1.17 0.02 . 1 . . . . . . . . 4716 1 925 . 1 1 151 151 THR HG23 H 1 1.17 0.02 . 1 . . . . . . . . 4716 1 926 . 1 1 151 151 THR CA C 13 64.8 0.2 . 1 . . . . . . . . 4716 1 927 . 1 1 151 151 THR CB C 13 68.8 0.2 . 1 . . . . . . . . 4716 1 928 . 1 1 151 151 THR N N 15 114.9 0.2 . 1 . . . . . . . . 4716 1 929 . 1 1 152 152 GLY H H 1 8.98 0.01 . 1 . . . . . . . . 4716 1 930 . 1 1 152 152 GLY HA2 H 1 4.05 0.02 . 2 . . . . . . . . 4716 1 931 . 1 1 152 152 GLY HA3 H 1 3.62 0.02 . 2 . . . . . . . . 4716 1 932 . 1 1 152 152 GLY CA C 13 45.5 0.2 . 1 . . . . . . . . 4716 1 933 . 1 1 152 152 GLY N N 15 116.9 0.2 . 1 . . . . . . . . 4716 1 934 . 1 1 153 153 GLN H H 1 7.68 0.01 . 1 . . . . . . . . 4716 1 935 . 1 1 153 153 GLN HA H 1 4.46 0.02 . 1 . . . . . . . . 4716 1 936 . 1 1 153 153 GLN HB2 H 1 1.89 0.02 . 2 . . . . . . . . 4716 1 937 . 1 1 153 153 GLN HG2 H 1 2.17 0.02 . 2 . . . . . . . . 4716 1 938 . 1 1 153 153 GLN HG3 H 1 2.34 0.02 . 2 . . . . . . . . 4716 1 939 . 1 1 153 153 GLN CA C 13 52.4 0.2 . 1 . . . . . . . . 4716 1 940 . 1 1 153 153 GLN N N 15 118.7 0.2 . 1 . . . . . . . . 4716 1 941 . 1 1 154 154 PRO CA C 13 65.0 0.2 . 1 . . . . . . . . 4716 1 942 . 1 1 154 154 PRO CB C 13 31.8 0.2 . 1 . . . . . . . . 4716 1 943 . 1 1 155 155 TYR H H 1 5.78 0.01 . 1 . . . . . . . . 4716 1 944 . 1 1 155 155 TYR HA H 1 4.61 0.02 . 1 . . . . . . . . 4716 1 945 . 1 1 155 155 TYR HB2 H 1 2.34 0.02 . 2 . . . . . . . . 4716 1 946 . 1 1 155 155 TYR HB3 H 1 2.76 0.02 . 2 . . . . . . . . 4716 1 947 . 1 1 155 155 TYR HD1 H 1 6.16 0.02 . 3 . . . . . . . . 4716 1 948 . 1 1 155 155 TYR HE1 H 1 6.47 0.02 . 3 . . . . . . . . 4716 1 949 . 1 1 155 155 TYR CA C 13 54.2 0.2 . 1 . . . . . . . . 4716 1 950 . 1 1 155 155 TYR CB C 13 36.4 0.2 . 1 . . . . . . . . 4716 1 951 . 1 1 155 155 TYR CD1 C 13 132.9 0.2 . 3 . . . . . . . . 4716 1 952 . 1 1 155 155 TYR CE1 C 13 118.7 0.2 . 3 . . . . . . . . 4716 1 953 . 1 1 155 155 TYR N N 15 109.5 0.2 . 1 . . . . . . . . 4716 1 954 . 1 1 156 156 GLU H H 1 7.23 0.01 . 1 . . . . . . . . 4716 1 955 . 1 1 156 156 GLU HA H 1 3.36 0.02 . 1 . . . . . . . . 4716 1 956 . 1 1 156 156 GLU HB2 H 1 1.73 0.02 . 2 . . . . . . . . 4716 1 957 . 1 1 156 156 GLU HG2 H 1 2.34 0.02 . 2 . . . . . . . . 4716 1 958 . 1 1 156 156 GLU CA C 13 61.0 0.2 . 1 . . . . . . . . 4716 1 959 . 1 1 156 156 GLU CB C 13 30.0 0.2 . 1 . . . . . . . . 4716 1 960 . 1 1 156 156 GLU N N 15 126.2 0.2 . 1 . . . . . . . . 4716 1 961 . 1 1 157 157 GLN H H 1 8.70 0.01 . 1 . . . . . . . . 4716 1 962 . 1 1 157 157 GLN HA H 1 3.94 0.02 . 1 . . . . . . . . 4716 1 963 . 1 1 157 157 GLN HB2 H 1 1.73 0.02 . 2 . . . . . . . . 4716 1 964 . 1 1 157 157 GLN HG2 H 1 2.11 0.02 . 2 . . . . . . . . 4716 1 965 . 1 1 157 157 GLN CA C 13 58.4 0.2 . 1 . . . . . . . . 4716 1 966 . 1 1 157 157 GLN CB C 13 27.8 0.2 . 1 . . . . . . . . 4716 1 967 . 1 1 157 157 GLN N N 15 116.0 0.2 . 1 . . . . . . . . 4716 1 968 . 1 1 158 158 TYR H H 1 6.77 0.01 . 1 . . . . . . . . 4716 1 969 . 1 1 158 158 TYR HA H 1 4.52 0.02 . 1 . . . . . . . . 4716 1 970 . 1 1 158 158 TYR HB2 H 1 3.09 0.02 . 2 . . . . . . . . 4716 1 971 . 1 1 158 158 TYR HB3 H 1 3.61 0.02 . 2 . . . . . . . . 4716 1 972 . 1 1 158 158 TYR HD1 H 1 6.97 0.02 . 3 . . . . . . . . 4716 1 973 . 1 1 158 158 TYR HE1 H 1 6.86 0.02 . 3 . . . . . . . . 4716 1 974 . 1 1 158 158 TYR CA C 13 58.3 0.2 . 1 . . . . . . . . 4716 1 975 . 1 1 158 158 TYR CB C 13 37.2 0.2 . 1 . . . . . . . . 4716 1 976 . 1 1 158 158 TYR CD1 C 13 132.4 0.2 . 3 . . . . . . . . 4716 1 977 . 1 1 158 158 TYR CE1 C 13 119.1 0.2 . 3 . . . . . . . . 4716 1 978 . 1 1 158 158 TYR N N 15 122.0 0.2 . 1 . . . . . . . . 4716 1 979 . 1 1 159 159 ALA H H 1 8.29 0.01 . 1 . . . . . . . . 4716 1 980 . 1 1 159 159 ALA HA H 1 4.16 0.02 . 1 . . . . . . . . 4716 1 981 . 1 1 159 159 ALA HB1 H 1 1.44 0.02 . 1 . . . . . . . . 4716 1 982 . 1 1 159 159 ALA HB2 H 1 1.44 0.02 . 1 . . . . . . . . 4716 1 983 . 1 1 159 159 ALA HB3 H 1 1.44 0.02 . 1 . . . . . . . . 4716 1 984 . 1 1 159 159 ALA CA C 13 56.3 0.2 . 1 . . . . . . . . 4716 1 985 . 1 1 159 159 ALA CB C 13 19.2 0.2 . 1 . . . . . . . . 4716 1 986 . 1 1 159 159 ALA N N 15 121.6 0.2 . 1 . . . . . . . . 4716 1 987 . 1 1 160 160 LYS H H 1 7.69 0.01 . 1 . . . . . . . . 4716 1 988 . 1 1 160 160 LYS HA H 1 4.05 0.02 . 1 . . . . . . . . 4716 1 989 . 1 1 160 160 LYS HB2 H 1 1.94 0.02 . 2 . . . . . . . . 4716 1 990 . 1 1 160 160 LYS HG2 H 1 1.44 0.02 . 2 . . . . . . . . 4716 1 991 . 1 1 160 160 LYS HD2 H 1 1.59 0.02 . 2 . . . . . . . . 4716 1 992 . 1 1 160 160 LYS HD3 H 1 1.71 0.02 . 2 . . . . . . . . 4716 1 993 . 1 1 160 160 LYS CA C 13 60.5 0.2 . 1 . . . . . . . . 4716 1 994 . 1 1 160 160 LYS CB C 13 32.4 0.2 . 1 . . . . . . . . 4716 1 995 . 1 1 160 160 LYS N N 15 116.2 0.2 . 1 . . . . . . . . 4716 1 996 . 1 1 161 161 MET H H 1 7.61 0.01 . 1 . . . . . . . . 4716 1 997 . 1 1 161 161 MET HA H 1 4.15 0.02 . 1 . . . . . . . . 4716 1 998 . 1 1 161 161 MET HB2 H 1 2.54 0.02 . 4 . . . . . . . . 4716 1 999 . 1 1 161 161 MET HB3 H 1 2.67 0.02 . 4 . . . . . . . . 4716 1 1000 . 1 1 161 161 MET HG2 H 1 3.11 0.02 . 4 . . . . . . . . 4716 1 1001 . 1 1 161 161 MET HE1 H 1 2.36 0.02 . 4 . . . . . . . . 4716 1 1002 . 1 1 161 161 MET HE2 H 1 2.36 0.02 . 4 . . . . . . . . 4716 1 1003 . 1 1 161 161 MET HE3 H 1 2.36 0.02 . 4 . . . . . . . . 4716 1 1004 . 1 1 161 161 MET CA C 13 59.7 0.2 . 1 . . . . . . . . 4716 1 1005 . 1 1 161 161 MET CB C 13 35.3 0.2 . 1 . . . . . . . . 4716 1 1006 . 1 1 161 161 MET N N 15 117.5 0.2 . 1 . . . . . . . . 4716 1 1007 . 1 1 162 162 ILE H H 1 8.09 0.01 . 1 . . . . . . . . 4716 1 1008 . 1 1 162 162 ILE HA H 1 3.79 0.02 . 1 . . . . . . . . 4716 1 1009 . 1 1 162 162 ILE HB H 1 1.91 0.02 . 4 . . . . . . . . 4716 1 1010 . 1 1 162 162 ILE CA C 13 66.6 0.2 . 1 . . . . . . . . 4716 1 1011 . 1 1 162 162 ILE CB C 13 39.5 0.2 . 1 . . . . . . . . 4716 1 1012 . 1 1 162 162 ILE N N 15 120.2 0.2 . 1 . . . . . . . . 4716 1 1013 . 1 1 163 163 PHE H H 1 9.17 0.01 . 1 . . . . . . . . 4716 1 1014 . 1 1 163 163 PHE HA H 1 3.95 0.02 . 1 . . . . . . . . 4716 1 1015 . 1 1 163 163 PHE HB2 H 1 3.18 0.02 . 2 . . . . . . . . 4716 1 1016 . 1 1 163 163 PHE HB3 H 1 3.38 0.02 . 2 . . . . . . . . 4716 1 1017 . 1 1 163 163 PHE HD1 H 1 7.07 0.02 . 3 . . . . . . . . 4716 1 1018 . 1 1 163 163 PHE HE1 H 1 7.28 0.02 . 3 . . . . . . . . 4716 1 1019 . 1 1 163 163 PHE HZ H 1 7.19 0.02 . 1 . . . . . . . . 4716 1 1020 . 1 1 163 163 PHE CA C 13 61.9 0.2 . 1 . . . . . . . . 4716 1 1021 . 1 1 163 163 PHE CB C 13 40.0 0.2 . 1 . . . . . . . . 4716 1 1022 . 1 1 163 163 PHE CD1 C 13 132.4 0.2 . 3 . . . . . . . . 4716 1 1023 . 1 1 163 163 PHE CE1 C 13 132.4 0.2 . 3 . . . . . . . . 4716 1 1024 . 1 1 163 163 PHE CZ C 13 130.6 0.2 . 1 . . . . . . . . 4716 1 1025 . 1 1 163 163 PHE N N 15 120.4 0.2 . 1 . . . . . . . . 4716 1 1026 . 1 1 164 164 MET H H 1 8.36 0.01 . 1 . . . . . . . . 4716 1 1027 . 1 1 164 164 MET HA H 1 4.02 0.02 . 1 . . . . . . . . 4716 1 1028 . 1 1 164 164 MET HB2 H 1 2.27 0.02 . 2 . . . . . . . . 4716 1 1029 . 1 1 164 164 MET HG2 H 1 2.77 0.02 . 2 . . . . . . . . 4716 1 1030 . 1 1 164 164 MET HG3 H 1 2.98 0.02 . 2 . . . . . . . . 4716 1 1031 . 1 1 164 164 MET CA C 13 58.4 0.2 . 1 . . . . . . . . 4716 1 1032 . 1 1 164 164 MET CB C 13 32.3 0.2 . 1 . . . . . . . . 4716 1 1033 . 1 1 164 164 MET N N 15 116.4 0.2 . 1 . . . . . . . . 4716 1 1034 . 1 1 165 165 GLU H H 1 7.51 0.01 . 1 . . . . . . . . 4716 1 1035 . 1 1 165 165 GLU HA H 1 4.28 0.02 . 1 . . . . . . . . 4716 1 1036 . 1 1 165 165 GLU HB2 H 1 1.92 0.02 . 4 . . . . . . . . 4716 1 1037 . 1 1 165 165 GLU HB3 H 1 2.12 0.02 . 4 . . . . . . . . 4716 1 1038 . 1 1 165 165 GLU HG2 H 1 2.27 0.02 . 4 . . . . . . . . 4716 1 1039 . 1 1 165 165 GLU CA C 13 58.7 0.2 . 1 . . . . . . . . 4716 1 1040 . 1 1 165 165 GLU CB C 13 28.6 0.2 . 1 . . . . . . . . 4716 1 1041 . 1 1 165 165 GLU N N 15 119.8 0.2 . 1 . . . . . . . . 4716 1 1042 . 1 1 166 166 LEU H H 1 8.76 0.01 . 1 . . . . . . . . 4716 1 1043 . 1 1 166 166 LEU HA H 1 3.92 0.02 . 1 . . . . . . . . 4716 1 1044 . 1 1 166 166 LEU HB2 H 1 2.12 0.02 . 2 . . . . . . . . 4716 1 1045 . 1 1 166 166 LEU HD11 H 1 0.84 0.02 . 2 . . . . . . . . 4716 1 1046 . 1 1 166 166 LEU HD12 H 1 0.84 0.02 . 2 . . . . . . . . 4716 1 1047 . 1 1 166 166 LEU HD13 H 1 0.84 0.02 . 2 . . . . . . . . 4716 1 1048 . 1 1 166 166 LEU CA C 13 58.2 0.2 . 1 . . . . . . . . 4716 1 1049 . 1 1 166 166 LEU CB C 13 42.2 0.2 . 1 . . . . . . . . 4716 1 1050 . 1 1 166 166 LEU N N 15 119.6 0.2 . 1 . . . . . . . . 4716 1 1051 . 1 1 167 167 ASN H H 1 8.26 0.01 . 1 . . . . . . . . 4716 1 1052 . 1 1 167 167 ASN HA H 1 4.58 0.02 . 1 . . . . . . . . 4716 1 1053 . 1 1 167 167 ASN HB2 H 1 2.54 0.02 . 2 . . . . . . . . 4716 1 1054 . 1 1 167 167 ASN HB3 H 1 2.69 0.02 . 2 . . . . . . . . 4716 1 1055 . 1 1 167 167 ASN CA C 13 56.3 0.2 . 1 . . . . . . . . 4716 1 1056 . 1 1 167 167 ASN CB C 13 37.7 0.2 . 1 . . . . . . . . 4716 1 1057 . 1 1 167 167 ASN N N 15 118.0 0.2 . 1 . . . . . . . . 4716 1 1058 . 1 1 168 168 ASP H H 1 8.12 0.01 . 1 . . . . . . . . 4716 1 1059 . 1 1 168 168 ASP HA H 1 4.50 0.02 . 1 . . . . . . . . 4716 1 1060 . 1 1 168 168 ASP HB2 H 1 2.53 0.02 . 2 . . . . . . . . 4716 1 1061 . 1 1 168 168 ASP HB3 H 1 2.70 0.02 . 2 . . . . . . . . 4716 1 1062 . 1 1 168 168 ASP CA C 13 57.7 0.2 . 1 . . . . . . . . 4716 1 1063 . 1 1 168 168 ASP CB C 13 40.4 0.2 . 1 . . . . . . . . 4716 1 1064 . 1 1 168 168 ASP N N 15 123.3 0.2 . 1 . . . . . . . . 4716 1 1065 . 1 1 169 169 ALA H H 1 8.58 0.01 . 1 . . . . . . . . 4716 1 1066 . 1 1 169 169 ALA HA H 1 3.98 0.02 . 1 . . . . . . . . 4716 1 1067 . 1 1 169 169 ALA HB1 H 1 1.28 0.02 . 1 . . . . . . . . 4716 1 1068 . 1 1 169 169 ALA HB2 H 1 1.28 0.02 . 1 . . . . . . . . 4716 1 1069 . 1 1 169 169 ALA HB3 H 1 1.28 0.02 . 1 . . . . . . . . 4716 1 1070 . 1 1 169 169 ALA CA C 13 54.8 0.2 . 1 . . . . . . . . 4716 1 1071 . 1 1 169 169 ALA CB C 13 18.9 0.2 . 1 . . . . . . . . 4716 1 1072 . 1 1 169 169 ALA N N 15 123.8 0.2 . 1 . . . . . . . . 4716 1 1073 . 1 1 170 170 TRP H H 1 9.11 0.01 . 1 . . . . . . . . 4716 1 1074 . 1 1 170 170 TRP HA H 1 4.04 0.02 . 1 . . . . . . . . 4716 1 1075 . 1 1 170 170 TRP HB2 H 1 3.05 0.02 . 2 . . . . . . . . 4716 1 1076 . 1 1 170 170 TRP HD1 H 1 7.03 0.02 . 1 . . . . . . . . 4716 1 1077 . 1 1 170 170 TRP HE1 H 1 9.78 0.01 . 1 . . . . . . . . 4716 1 1078 . 1 1 170 170 TRP HE3 H 1 6.58 0.01 . 1 . . . . . . . . 4716 1 1079 . 1 1 170 170 TRP HZ2 H 1 7.48 0.01 . 1 . . . . . . . . 4716 1 1080 . 1 1 170 170 TRP HZ3 H 1 6.58 0.01 . 1 . . . . . . . . 4716 1 1081 . 1 1 170 170 TRP HH2 H 1 7.15 0.01 . 1 . . . . . . . . 4716 1 1082 . 1 1 170 170 TRP CA C 13 60.4 0.2 . 1 . . . . . . . . 4716 1 1083 . 1 1 170 170 TRP CB C 13 28.8 0.2 . 1 . . . . . . . . 4716 1 1084 . 1 1 170 170 TRP CD1 C 13 127.4 0.2 . 1 . . . . . . . . 4716 1 1085 . 1 1 170 170 TRP CE3 C 13 120.5 0.2 . 1 . . . . . . . . 4716 1 1086 . 1 1 170 170 TRP CZ2 C 13 114.6 0.2 . 1 . . . . . . . . 4716 1 1087 . 1 1 170 170 TRP CZ3 C 13 121.0 0.2 . 1 . . . . . . . . 4716 1 1088 . 1 1 170 170 TRP CH2 C 13 123.3 0.2 . 1 . . . . . . . . 4716 1 1089 . 1 1 170 170 TRP N N 15 125.1 0.2 . 1 . . . . . . . . 4716 1 1090 . 1 1 170 170 TRP NE1 N 15 128.9 0.2 . 1 . . . . . . . . 4716 1 1091 . 1 1 171 171 SER H H 1 8.06 0.01 . 1 . . . . . . . . 4716 1 1092 . 1 1 171 171 SER HA H 1 4.50 0.02 . 1 . . . . . . . . 4716 1 1093 . 1 1 171 171 SER HB2 H 1 4.04 0.02 . 2 . . . . . . . . 4716 1 1094 . 1 1 171 171 SER CA C 13 61.9 0.2 . 1 . . . . . . . . 4716 1 1095 . 1 1 171 171 SER CB C 13 62.8 0.2 . 1 . . . . . . . . 4716 1 1096 . 1 1 171 171 SER N N 15 114.9 0.2 . 1 . . . . . . . . 4716 1 1097 . 1 1 172 172 GLU H H 1 7.56 0.01 . 1 . . . . . . . . 4716 1 1098 . 1 1 172 172 GLU HA H 1 4.13 0.02 . 1 . . . . . . . . 4716 1 1099 . 1 1 172 172 GLU HB2 H 1 2.06 0.02 . 2 . . . . . . . . 4716 1 1100 . 1 1 172 172 GLU CA C 13 58.8 0.2 . 1 . . . . . . . . 4716 1 1101 . 1 1 172 172 GLU CB C 13 29.3 0.2 . 1 . . . . . . . . 4716 1 1102 . 1 1 172 172 GLU N N 15 120.9 0.2 . 1 . . . . . . . . 4716 1 1103 . 1 1 173 173 PHE H H 1 7.72 0.01 . 1 . . . . . . . . 4716 1 1104 . 1 1 173 173 PHE HA H 1 4.12 0.02 . 1 . . . . . . . . 4716 1 1105 . 1 1 173 173 PHE HB2 H 1 2.76 0.02 . 2 . . . . . . . . 4716 1 1106 . 1 1 173 173 PHE HB3 H 1 3.02 0.02 . 2 . . . . . . . . 4716 1 1107 . 1 1 173 173 PHE HD1 H 1 6.70 0.02 . 3 . . . . . . . . 4716 1 1108 . 1 1 173 173 PHE HE1 H 1 7.24 0.02 . 3 . . . . . . . . 4716 1 1109 . 1 1 173 173 PHE HZ H 1 6.93 0.02 . 1 . . . . . . . . 4716 1 1110 . 1 1 173 173 PHE CA C 13 60.7 0.2 . 1 . . . . . . . . 4716 1 1111 . 1 1 173 173 PHE CB C 13 39.2 0.2 . 1 . . . . . . . . 4716 1 1112 . 1 1 173 173 PHE CD1 C 13 133.3 0.2 . 3 . . . . . . . . 4716 1 1113 . 1 1 173 173 PHE CE1 C 13 131.5 0.2 . 3 . . . . . . . . 4716 1 1114 . 1 1 173 173 PHE CZ C 13 128.8 0.2 . 1 . . . . . . . . 4716 1 1115 . 1 1 173 173 PHE N N 15 122.4 0.2 . 1 . . . . . . . . 4716 1 1116 . 1 1 174 174 GLU H H 1 8.20 0.01 . 1 . . . . . . . . 4716 1 1117 . 1 1 174 174 GLU HA H 1 4.49 0.01 . 1 . . . . . . . . 4716 1 1118 . 1 1 174 174 GLU HB2 H 1 1.64 0.02 . 2 . . . . . . . . 4716 1 1119 . 1 1 174 174 GLU CA C 13 59.1 0.2 . 1 . . . . . . . . 4716 1 1120 . 1 1 174 174 GLU CB C 13 29.7 0.2 . 1 . . . . . . . . 4716 1 1121 . 1 1 174 174 GLU N N 15 119.8 0.2 . 1 . . . . . . . . 4716 1 1122 . 1 1 175 175 ASN H H 1 8.01 0.01 . 1 . . . . . . . . 4716 1 1123 . 1 1 175 175 ASN HA H 1 4.45 0.02 . 1 . . . . . . . . 4716 1 1124 . 1 1 175 175 ASN HB2 H 1 2.81 0.02 . 2 . . . . . . . . 4716 1 1125 . 1 1 175 175 ASN CA C 13 54.9 0.2 . 1 . . . . . . . . 4716 1 1126 . 1 1 175 175 ASN CB C 13 38.7 0.2 . 1 . . . . . . . . 4716 1 1127 . 1 1 175 175 ASN N N 15 119.3 0.2 . 1 . . . . . . . . 4716 1 1128 . 1 1 176 176 GLN H H 1 7.75 0.01 . 1 . . . . . . . . 4716 1 1129 . 1 1 176 176 GLN HA H 1 4.17 0.02 . 1 . . . . . . . . 4716 1 1130 . 1 1 176 176 GLN HB2 H 1 1.96 0.02 . 2 . . . . . . . . 4716 1 1131 . 1 1 176 176 GLN HB3 H 1 2.16 0.02 . 2 . . . . . . . . 4716 1 1132 . 1 1 176 176 GLN HG2 H 1 2.38 0.02 . 2 . . . . . . . . 4716 1 1133 . 1 1 176 176 GLN HG3 H 1 2.49 0.02 . 2 . . . . . . . . 4716 1 1134 . 1 1 176 176 GLN CA C 13 56.4 0.2 . 1 . . . . . . . . 4716 1 1135 . 1 1 176 176 GLN CB C 13 28.6 0.2 . 1 . . . . . . . . 4716 1 1136 . 1 1 176 176 GLN N N 15 118.7 0.2 . 1 . . . . . . . . 4716 1 1137 . 1 1 177 177 GLY H H 1 7.83 0.01 . 1 . . . . . . . . 4716 1 1138 . 1 1 177 177 GLY HA2 H 1 3.73 0.02 . 2 . . . . . . . . 4716 1 1139 . 1 1 177 177 GLY HA3 H 1 3.90 0.02 . 2 . . . . . . . . 4716 1 1140 . 1 1 177 177 GLY CA C 13 45.4 0.2 . 1 . . . . . . . . 4716 1 1141 . 1 1 177 177 GLY N N 15 108.2 0.2 . 1 . . . . . . . . 4716 1 1142 . 1 1 178 178 GLN H H 1 7.84 0.01 . 1 . . . . . . . . 4716 1 1143 . 1 1 178 178 GLN HA H 1 3.16 0.02 . 1 . . . . . . . . 4716 1 1144 . 1 1 178 178 GLN CA C 13 55.6 0.2 . 1 . . . . . . . . 4716 1 1145 . 1 1 178 178 GLN CB C 13 28.2 0.2 . 1 . . . . . . . . 4716 1 1146 . 1 1 178 178 GLN N N 15 119.1 0.2 . 1 . . . . . . . . 4716 1 1147 . 1 1 179 179 LYS H H 1 8.05 0.01 . 1 . . . . . . . . 4716 1 1148 . 1 1 179 179 LYS HA H 1 4.46 0.02 . 1 . . . . . . . . 4716 1 1149 . 1 1 179 179 LYS HB2 H 1 1.80 0.02 . 2 . . . . . . . . 4716 1 1150 . 1 1 179 179 LYS HG2 H 1 1.44 0.02 . 2 . . . . . . . . 4716 1 1151 . 1 1 179 179 LYS HD2 H 1 1.67 0.02 . 2 . . . . . . . . 4716 1 1152 . 1 1 179 179 LYS CA C 13 54.6 0.2 . 1 . . . . . . . . 4716 1 1153 . 1 1 179 179 LYS CB C 13 32.3 0.2 . 1 . . . . . . . . 4716 1 1154 . 1 1 179 179 LYS N N 15 122.4 0.2 . 1 . . . . . . . . 4716 1 1155 . 1 1 180 180 PRO CA C 13 62.8 0.2 . 1 . . . . . . . . 4716 1 1156 . 1 1 180 180 PRO CB C 13 32.7 0.2 . 1 . . . . . . . . 4716 1 1157 . 1 1 181 181 LEU H H 1 8.28 0.01 . 1 . . . . . . . . 4716 1 1158 . 1 1 181 181 LEU HA H 1 4.15 0.02 . 1 . . . . . . . . 4716 1 1159 . 1 1 181 181 LEU CA C 13 55.9 0.2 . 1 . . . . . . . . 4716 1 1160 . 1 1 181 181 LEU CB C 13 43.2 0.2 . 1 . . . . . . . . 4716 1 1161 . 1 1 181 181 LEU N N 15 123.1 0.2 . 1 . . . . . . . . 4716 1 1162 . 1 1 182 182 TYR H H 1 7.36 0.01 . 1 . . . . . . . . 4716 1 1163 . 1 1 182 182 TYR HA H 1 4.35 0.02 . 1 . . . . . . . . 4716 1 1164 . 1 1 182 182 TYR CA C 13 58.4 0.2 . 1 . . . . . . . . 4716 1 1165 . 1 1 182 182 TYR CB C 13 39.2 0.2 . 1 . . . . . . . . 4716 1 1166 . 1 1 182 182 TYR N N 15 123.6 0.2 . 1 . . . . . . . . 4716 1 stop_ save_