data_16124 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16124 _Entry.Title ; Solution structure of RppH from Escherichia coli ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-01-18 _Entry.Accession_date 2009-01-18 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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 Yunchen Bi . . . 16124 2 Hongwei Li . . . 16124 3 Changwen Jin . . . 16124 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16124 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 717 16124 '15N chemical shifts' 187 16124 '1H chemical shifts' 1107 16124 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 4 . . 2010-05-27 2009-01-23 update BMRB 'edit entity/assembly name' 16124 3 . . 2009-08-20 2009-01-23 update BMRB 'added PubMed ID' 16124 2 . . 2009-06-05 2009-01-23 update BMRB 'completed entry citation' 16124 1 . . 2009-04-14 2009-01-23 original author 'original release' 16124 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 16125 'RppH mutant E53A' 16124 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16124 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19636968 _Citation.Full_citation . _Citation.Title '1H, 13C and 15N resonance assignments of RNA pyrophosphohydrolase RppH from Escherichia coli' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR Assignments' _Citation.Journal_volume 3 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 149 _Citation.Page_last 151 _Citation.Year 2009 _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 Yunchen Bi . . . 16124 1 2 Hongwei Li . . . 16124 1 3 Shoujin Fan . . . 16124 1 4 Bin Xia . . . 16124 1 5 Changwen Jin . . . 16124 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16124 _Assembly.ID 1 _Assembly.Name RppH _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 RppH 1 $entity A . yes native no no . . . 16124 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 16124 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name RppH _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 ; MIDDDGYRPNVGIVICNRQG QVMWARRFGQHSWQFPQGGI NPGESAEQAMYRELFEEVGL SRKDVRILASTRNWLRYKLP KRLVRWDTKPVCIGQKQKWF LLQLVSGDAEINMQTSSTPE FDGWRWVSYWYPVRQVVSFK RDVYRRVMKEFASVVMSLQE NTPK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 164 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 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 2KDV . "Solution Structure Of Rna Pyrophosphohydrolase Rpph From Escherichia Coli" . . . . . 100.00 164 100.00 100.00 1.32e-116 . . . . 16124 1 2 no PDB 2KDW . "Solution Structure Of Rpph Mutant E53a From Escherichia Coli" . . . . . 100.00 164 99.39 99.39 8.11e-116 . . . . 16124 1 3 no PDB 4S2V . "E. Coli Rpph Structure, Ki Soak" . . . . . 95.12 157 100.00 100.00 3.31e-110 . . . . 16124 1 4 no PDB 4S2W . "Structure Of E. Coli Rpph Bound To Sulfate Ions" . . . . . 96.34 161 100.00 100.00 7.19e-112 . . . . 16124 1 5 no PDB 4S2X . "Structure Of E. Coli Rpph Bound To Rna And Two Magnesium Ions" . . . . . 96.34 161 100.00 100.00 7.19e-112 . . . . 16124 1 6 no PDB 4S2Y . "Structure Of E. Coli Rpph Bound To Rna And Three Magnesium Ions" . . . . . 96.34 161 100.00 100.00 7.19e-112 . . . . 16124 1 7 no DBJ BAB37110 . "putative invasion protein [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 8 no DBJ BAE76899 . "nucleotide hydrolase [Escherichia coli str. K12 substr. W3110]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 9 no DBJ BAG78611 . "dinucleoside polyphosphate hydrolase [Escherichia coli SE11]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 10 no DBJ BAI27093 . "nucleotide hydrolase [Escherichia coli O26:H11 str. 11368]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 11 no DBJ BAI32136 . "nucleotide hydrolase [Escherichia coli O103:H2 str. 12009]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 12 no EMBL CAD02829 . "conserved hypothetical protein [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 100.00 176 96.95 98.78 1.77e-113 . . . . 16124 1 13 no EMBL CAP77286 . "(Di)nucleoside polyphosphate hydrolase [Escherichia coli LF82]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 14 no EMBL CAQ33156 . "RNA pyrophosphohydrolase [Escherichia coli BL21(DE3)]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 15 no EMBL CAQ90258 . "nucleotide hydrolase [Escherichia fergusonii ATCC 35469]" . . . . . 100.00 176 96.95 99.39 7.38e-114 . . . . 16124 1 16 no EMBL CAQ99756 . "nucleotide hydrolase [Escherichia coli IAI1]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 17 no GB AAB40477 . "ORF_f176 [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 18 no GB AAC75869 . "RNA pyrophosphohydrolase [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 19 no GB AAG57941 . "putative invasion protein [Escherichia coli O157:H7 str. EDL933]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 20 no GB AAL21880 . "putative invasion protein [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 100.00 176 96.95 98.78 1.77e-113 . . . . 16124 1 21 no GB AAN44326 . "putative invasion protein [Shigella flexneri 2a str. 301]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 22 no PIR AE0866 . "conserved hypothetical protein STY3145 [imported] - Salmonella enterica subsp. enterica serovar Typhi (strain CT18)" . . . . . 100.00 176 96.95 98.78 1.77e-113 . . . . 16124 1 23 no REF NP_311714 . "dinucleoside polyphosphate hydrolase [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 24 no REF NP_417307 . "RNA pyrophosphohydrolase [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 25 no REF NP_457398 . "RNA pyrophosphohydrolase [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 100.00 176 96.95 98.78 1.77e-113 . . . . 16124 1 26 no REF NP_461921 . "RNA pyrophosphohydrolase [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 100.00 176 96.95 98.78 1.77e-113 . . . . 16124 1 27 no REF NP_708619 . "RNA pyrophosphohydrolase [Shigella flexneri 2a str. 301]" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 28 no SP A7ZQT6 . "RecName: Full=RNA pyrophosphohydrolase; AltName: Full=(Di)nucleoside polyphosphate hydrolase" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 29 no SP A8A3W3 . "RecName: Full=RNA pyrophosphohydrolase; AltName: Full=(Di)nucleoside polyphosphate hydrolase" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 1 30 no SP A9MS78 . "RecName: Full=RNA pyrophosphohydrolase; AltName: Full=(Di)nucleoside polyphosphate hydrolase" . . . . . 100.00 176 97.56 99.39 1.45e-114 . . . . 16124 1 31 no SP A9N2M1 . "RecName: Full=RNA pyrophosphohydrolase; AltName: Full=(Di)nucleoside polyphosphate hydrolase" . . . . . 100.00 176 96.95 98.78 1.77e-113 . . . . 16124 1 32 no SP B1IU14 . "RecName: Full=RNA pyrophosphohydrolase; AltName: Full=(Di)nucleoside polyphosphate hydrolase" . . . . . 100.00 176 100.00 100.00 1.87e-116 . . . . 16124 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 . MET . 16124 1 2 . ILE . 16124 1 3 . ASP . 16124 1 4 . ASP . 16124 1 5 . ASP . 16124 1 6 . GLY . 16124 1 7 . TYR . 16124 1 8 . ARG . 16124 1 9 . PRO . 16124 1 10 . ASN . 16124 1 11 . VAL . 16124 1 12 . GLY . 16124 1 13 . ILE . 16124 1 14 . VAL . 16124 1 15 . ILE . 16124 1 16 . CYS . 16124 1 17 . ASN . 16124 1 18 . ARG . 16124 1 19 . GLN . 16124 1 20 . GLY . 16124 1 21 . GLN . 16124 1 22 . VAL . 16124 1 23 . MET . 16124 1 24 . TRP . 16124 1 25 . ALA . 16124 1 26 . ARG . 16124 1 27 . ARG . 16124 1 28 . PHE . 16124 1 29 . GLY . 16124 1 30 . GLN . 16124 1 31 . HIS . 16124 1 32 . SER . 16124 1 33 . TRP . 16124 1 34 . GLN . 16124 1 35 . PHE . 16124 1 36 . PRO . 16124 1 37 . GLN . 16124 1 38 . GLY . 16124 1 39 . GLY . 16124 1 40 . ILE . 16124 1 41 . ASN . 16124 1 42 . PRO . 16124 1 43 . GLY . 16124 1 44 . GLU . 16124 1 45 . SER . 16124 1 46 . ALA . 16124 1 47 . GLU . 16124 1 48 . GLN . 16124 1 49 . ALA . 16124 1 50 . MET . 16124 1 51 . TYR . 16124 1 52 . ARG . 16124 1 53 . GLU . 16124 1 54 . LEU . 16124 1 55 . PHE . 16124 1 56 . GLU . 16124 1 57 . GLU . 16124 1 58 . VAL . 16124 1 59 . GLY . 16124 1 60 . LEU . 16124 1 61 . SER . 16124 1 62 . ARG . 16124 1 63 . LYS . 16124 1 64 . ASP . 16124 1 65 . VAL . 16124 1 66 . ARG . 16124 1 67 . ILE . 16124 1 68 . LEU . 16124 1 69 . ALA . 16124 1 70 . SER . 16124 1 71 . THR . 16124 1 72 . ARG . 16124 1 73 . ASN . 16124 1 74 . TRP . 16124 1 75 . LEU . 16124 1 76 . ARG . 16124 1 77 . TYR . 16124 1 78 . LYS . 16124 1 79 . LEU . 16124 1 80 . PRO . 16124 1 81 . LYS . 16124 1 82 . ARG . 16124 1 83 . LEU . 16124 1 84 . VAL . 16124 1 85 . ARG . 16124 1 86 . TRP . 16124 1 87 . ASP . 16124 1 88 . THR . 16124 1 89 . LYS . 16124 1 90 . PRO . 16124 1 91 . VAL . 16124 1 92 . CYS . 16124 1 93 . ILE . 16124 1 94 . GLY . 16124 1 95 . GLN . 16124 1 96 . LYS . 16124 1 97 . GLN . 16124 1 98 . LYS . 16124 1 99 . TRP . 16124 1 100 . PHE . 16124 1 101 . LEU . 16124 1 102 . LEU . 16124 1 103 . GLN . 16124 1 104 . LEU . 16124 1 105 . VAL . 16124 1 106 . SER . 16124 1 107 . GLY . 16124 1 108 . ASP . 16124 1 109 . ALA . 16124 1 110 . GLU . 16124 1 111 . ILE . 16124 1 112 . ASN . 16124 1 113 . MET . 16124 1 114 . GLN . 16124 1 115 . THR . 16124 1 116 . SER . 16124 1 117 . SER . 16124 1 118 . THR . 16124 1 119 . PRO . 16124 1 120 . GLU . 16124 1 121 . PHE . 16124 1 122 . ASP . 16124 1 123 . GLY . 16124 1 124 . TRP . 16124 1 125 . ARG . 16124 1 126 . TRP . 16124 1 127 . VAL . 16124 1 128 . SER . 16124 1 129 . TYR . 16124 1 130 . TRP . 16124 1 131 . TYR . 16124 1 132 . PRO . 16124 1 133 . VAL . 16124 1 134 . ARG . 16124 1 135 . GLN . 16124 1 136 . VAL . 16124 1 137 . VAL . 16124 1 138 . SER . 16124 1 139 . PHE . 16124 1 140 . LYS . 16124 1 141 . ARG . 16124 1 142 . ASP . 16124 1 143 . VAL . 16124 1 144 . TYR . 16124 1 145 . ARG . 16124 1 146 . ARG . 16124 1 147 . VAL . 16124 1 148 . MET . 16124 1 149 . LYS . 16124 1 150 . GLU . 16124 1 151 . PHE . 16124 1 152 . ALA . 16124 1 153 . SER . 16124 1 154 . VAL . 16124 1 155 . VAL . 16124 1 156 . MET . 16124 1 157 . SER . 16124 1 158 . LEU . 16124 1 159 . GLN . 16124 1 160 . GLU . 16124 1 161 . ASN . 16124 1 162 . THR . 16124 1 163 . PRO . 16124 1 164 . LYS . 16124 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 16124 1 . ILE 2 2 16124 1 . ASP 3 3 16124 1 . ASP 4 4 16124 1 . ASP 5 5 16124 1 . GLY 6 6 16124 1 . TYR 7 7 16124 1 . ARG 8 8 16124 1 . PRO 9 9 16124 1 . ASN 10 10 16124 1 . VAL 11 11 16124 1 . GLY 12 12 16124 1 . ILE 13 13 16124 1 . VAL 14 14 16124 1 . ILE 15 15 16124 1 . CYS 16 16 16124 1 . ASN 17 17 16124 1 . ARG 18 18 16124 1 . GLN 19 19 16124 1 . GLY 20 20 16124 1 . GLN 21 21 16124 1 . VAL 22 22 16124 1 . MET 23 23 16124 1 . TRP 24 24 16124 1 . ALA 25 25 16124 1 . ARG 26 26 16124 1 . ARG 27 27 16124 1 . PHE 28 28 16124 1 . GLY 29 29 16124 1 . GLN 30 30 16124 1 . HIS 31 31 16124 1 . SER 32 32 16124 1 . TRP 33 33 16124 1 . GLN 34 34 16124 1 . PHE 35 35 16124 1 . PRO 36 36 16124 1 . GLN 37 37 16124 1 . GLY 38 38 16124 1 . GLY 39 39 16124 1 . ILE 40 40 16124 1 . ASN 41 41 16124 1 . PRO 42 42 16124 1 . GLY 43 43 16124 1 . GLU 44 44 16124 1 . SER 45 45 16124 1 . ALA 46 46 16124 1 . GLU 47 47 16124 1 . GLN 48 48 16124 1 . ALA 49 49 16124 1 . MET 50 50 16124 1 . TYR 51 51 16124 1 . ARG 52 52 16124 1 . GLU 53 53 16124 1 . LEU 54 54 16124 1 . PHE 55 55 16124 1 . GLU 56 56 16124 1 . GLU 57 57 16124 1 . VAL 58 58 16124 1 . GLY 59 59 16124 1 . LEU 60 60 16124 1 . SER 61 61 16124 1 . ARG 62 62 16124 1 . LYS 63 63 16124 1 . ASP 64 64 16124 1 . VAL 65 65 16124 1 . ARG 66 66 16124 1 . ILE 67 67 16124 1 . LEU 68 68 16124 1 . ALA 69 69 16124 1 . SER 70 70 16124 1 . THR 71 71 16124 1 . ARG 72 72 16124 1 . ASN 73 73 16124 1 . TRP 74 74 16124 1 . LEU 75 75 16124 1 . ARG 76 76 16124 1 . TYR 77 77 16124 1 . LYS 78 78 16124 1 . LEU 79 79 16124 1 . PRO 80 80 16124 1 . LYS 81 81 16124 1 . ARG 82 82 16124 1 . LEU 83 83 16124 1 . VAL 84 84 16124 1 . ARG 85 85 16124 1 . TRP 86 86 16124 1 . ASP 87 87 16124 1 . THR 88 88 16124 1 . LYS 89 89 16124 1 . PRO 90 90 16124 1 . VAL 91 91 16124 1 . CYS 92 92 16124 1 . ILE 93 93 16124 1 . GLY 94 94 16124 1 . GLN 95 95 16124 1 . LYS 96 96 16124 1 . GLN 97 97 16124 1 . LYS 98 98 16124 1 . TRP 99 99 16124 1 . PHE 100 100 16124 1 . LEU 101 101 16124 1 . LEU 102 102 16124 1 . GLN 103 103 16124 1 . LEU 104 104 16124 1 . VAL 105 105 16124 1 . SER 106 106 16124 1 . GLY 107 107 16124 1 . ASP 108 108 16124 1 . ALA 109 109 16124 1 . GLU 110 110 16124 1 . ILE 111 111 16124 1 . ASN 112 112 16124 1 . MET 113 113 16124 1 . GLN 114 114 16124 1 . THR 115 115 16124 1 . SER 116 116 16124 1 . SER 117 117 16124 1 . THR 118 118 16124 1 . PRO 119 119 16124 1 . GLU 120 120 16124 1 . PHE 121 121 16124 1 . ASP 122 122 16124 1 . GLY 123 123 16124 1 . TRP 124 124 16124 1 . ARG 125 125 16124 1 . TRP 126 126 16124 1 . VAL 127 127 16124 1 . SER 128 128 16124 1 . TYR 129 129 16124 1 . TRP 130 130 16124 1 . TYR 131 131 16124 1 . PRO 132 132 16124 1 . VAL 133 133 16124 1 . ARG 134 134 16124 1 . GLN 135 135 16124 1 . VAL 136 136 16124 1 . VAL 137 137 16124 1 . SER 138 138 16124 1 . PHE 139 139 16124 1 . LYS 140 140 16124 1 . ARG 141 141 16124 1 . ASP 142 142 16124 1 . VAL 143 143 16124 1 . TYR 144 144 16124 1 . ARG 145 145 16124 1 . ARG 146 146 16124 1 . VAL 147 147 16124 1 . MET 148 148 16124 1 . LYS 149 149 16124 1 . GLU 150 150 16124 1 . PHE 151 151 16124 1 . ALA 152 152 16124 1 . SER 153 153 16124 1 . VAL 154 154 16124 1 . VAL 155 155 16124 1 . MET 156 156 16124 1 . SER 157 157 16124 1 . LEU 158 158 16124 1 . GLN 159 159 16124 1 . GLU 160 160 16124 1 . ASN 161 161 16124 1 . THR 162 162 16124 1 . PRO 163 163 16124 1 . LYS 164 164 16124 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 16124 _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 $entity . 562 organism . 'Escherichia coli' 'E. coli' . . Eubacteria . Escherichia coli k12 . . . . . . . . . . . . . . . . . . . . 16124 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 16124 _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 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pet21 . . . . . . 16124 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16124 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'sodium acetate' 'natural abundance' . . . . . . 50 . . mM . . . . 16124 1 2 'sodium chloride' 'natural abundance' . . . . . . 20 . . mM . . . . 16124 1 3 DTT 'natural abundance' . . . . . . 40 . . mM . . . . 16124 1 4 arginine 'natural abundance' . . . . . . 10 . . mM . . . . 16124 1 5 glutamic 'natural abundance' . . . . . . 10 . . mM . . . . 16124 1 6 'RppH protein' '[U-13C; U-15N]' . . 1 $entity . . 0.8 . . mM . . . . 16124 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16124 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 90 . mM 16124 1 pH 5 . pH 16124 1 pressure 1 . atm 16124 1 temperature 303 . K 16124 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 16124 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 16124 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16124 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 16124 _Software.ID 2 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 16124 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16124 2 stop_ save_ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 16124 _Software.ID 3 _Software.Name xwinnmr _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16124 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16124 3 stop_ save_ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 16124 _Software.ID 4 _Software.Name AMBER _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollm' . . 16124 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 16124 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 16124 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16124 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16124 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 16124 1 2 spectrometer_2 Bruker Avance . 800 . . . 16124 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 16124 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16124 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16124 1 3 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16124 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16124 _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 C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 16124 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16124 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 16124 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16124 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 16124 1 2 '3D 1H-15N NOESY' . . . 16124 1 3 '3D 1H-13C NOESY' . . . 16124 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 1 1 MET HA H 1 4.227 0.02 . 1 . . . . 1 M HA . 16124 1 2 . 1 1 1 1 MET HB2 H 1 2.219 0.02 . 2 . . . . 1 M HB2 . 16124 1 3 . 1 1 1 1 MET HE1 H 1 2.073 0.02 . 1 . . . . 1 M HE1 . 16124 1 4 . 1 1 1 1 MET HE2 H 1 2.073 0.02 . 1 . . . . 1 M HE1 . 16124 1 5 . 1 1 1 1 MET HE3 H 1 2.073 0.02 . 1 . . . . 1 M HE1 . 16124 1 6 . 1 1 1 1 MET HG2 H 1 2.425 0.02 . 2 . . . . 1 M HG1 . 16124 1 7 . 1 1 1 1 MET HG3 H 1 2.646 0.02 . 2 . . . . 1 M HG2 . 16124 1 8 . 1 1 1 1 MET C C 13 171.343 0.3 . 1 . . . . 1 M C . 16124 1 9 . 1 1 1 1 MET CA C 13 55.160 0.3 . 1 . . . . 1 M CA . 16124 1 10 . 1 1 1 1 MET CB C 13 33.290 0.3 . 1 . . . . 1 M CB . 16124 1 11 . 1 1 1 1 MET CE C 13 17.084 0.3 . 1 . . . . 1 M CE . 16124 1 12 . 1 1 1 1 MET CG C 13 30.675 0.3 . 1 . . . . 1 M CG . 16124 1 13 . 1 1 2 2 ILE H H 1 8.530 0.02 . 1 . . . . 2 I HN . 16124 1 14 . 1 1 2 2 ILE HA H 1 4.216 0.02 . 1 . . . . 2 I HA . 16124 1 15 . 1 1 2 2 ILE HB H 1 1.733 0.02 . 1 . . . . 2 I HB . 16124 1 16 . 1 1 2 2 ILE HD11 H 1 0.830 0.02 . 1 . . . . 2 I HD11 . 16124 1 17 . 1 1 2 2 ILE HD12 H 1 0.830 0.02 . 1 . . . . 2 I HD11 . 16124 1 18 . 1 1 2 2 ILE HD13 H 1 0.830 0.02 . 1 . . . . 2 I HD11 . 16124 1 19 . 1 1 2 2 ILE HG12 H 1 1.127 0.02 . 1 . . . . 2 I HG11 . 16124 1 20 . 1 1 2 2 ILE HG13 H 1 1.470 0.02 . 1 . . . . 2 I HG12 . 16124 1 21 . 1 1 2 2 ILE HG21 H 1 0.884 0.02 . 1 . . . . 2 I HG21 . 16124 1 22 . 1 1 2 2 ILE HG22 H 1 0.884 0.02 . 1 . . . . 2 I HG21 . 16124 1 23 . 1 1 2 2 ILE HG23 H 1 0.884 0.02 . 1 . . . . 2 I HG21 . 16124 1 24 . 1 1 2 2 ILE C C 13 175.401 0.3 . 1 . . . . 2 I C . 16124 1 25 . 1 1 2 2 ILE CA C 13 61.110 0.3 . 1 . . . . 2 I CA . 16124 1 26 . 1 1 2 2 ILE CB C 13 39.200 0.3 . 1 . . . . 2 I CB . 16124 1 27 . 1 1 2 2 ILE CD1 C 13 13.635 0.3 . 1 . . . . 2 I CD1 . 16124 1 28 . 1 1 2 2 ILE CG1 C 13 27.585 0.3 . 1 . . . . 2 I CG1 . 16124 1 29 . 1 1 2 2 ILE CG2 C 13 17.349 0.3 . 1 . . . . 2 I CG2 . 16124 1 30 . 1 1 2 2 ILE N N 15 121.690 0.3 . 1 . . . . 2 I N . 16124 1 31 . 1 1 3 3 ASP H H 1 8.398 0.02 . 1 . . . . 3 D HN . 16124 1 32 . 1 1 3 3 ASP HA H 1 4.667 0.02 . 1 . . . . 3 D HA . 16124 1 33 . 1 1 3 3 ASP HB2 H 1 2.866 0.02 . 2 . . . . 3 D HB2 . 16124 1 34 . 1 1 3 3 ASP C C 13 176.837 0.3 . 1 . . . . 3 D C . 16124 1 35 . 1 1 3 3 ASP CA C 13 53.740 0.3 . 1 . . . . 3 D CA . 16124 1 36 . 1 1 3 3 ASP CB C 13 40.970 0.3 . 1 . . . . 3 D CB . 16124 1 37 . 1 1 3 3 ASP N N 15 125.470 0.3 . 1 . . . . 3 D N . 16124 1 38 . 1 1 4 4 ASP H H 1 8.433 0.02 . 1 . . . . 4 D HN . 16124 1 39 . 1 1 4 4 ASP HA H 1 4.437 0.02 . 1 . . . . 4 D HA . 16124 1 40 . 1 1 4 4 ASP HB2 H 1 2.639 0.02 . 2 . . . . 4 D HB1 . 16124 1 41 . 1 1 4 4 ASP HB3 H 1 2.735 0.02 . 2 . . . . 4 D HB2 . 16124 1 42 . 1 1 4 4 ASP C C 13 176.309 0.3 . 1 . . . . 4 D C . 16124 1 43 . 1 1 4 4 ASP CA C 13 56.170 0.3 . 1 . . . . 4 D CA . 16124 1 44 . 1 1 4 4 ASP CB C 13 40.920 0.3 . 1 . . . . 4 D CB . 16124 1 45 . 1 1 4 4 ASP N N 15 119.200 0.3 . 1 . . . . 4 D N . 16124 1 46 . 1 1 5 5 ASP H H 1 8.099 0.02 . 1 . . . . 5 D HN . 16124 1 47 . 1 1 5 5 ASP HA H 1 4.602 0.02 . 1 . . . . 5 D HA . 16124 1 48 . 1 1 5 5 ASP HB2 H 1 2.802 0.02 . 2 . . . . 5 D HB1 . 16124 1 49 . 1 1 5 5 ASP HB3 H 1 3.000 0.02 . 2 . . . . 5 D HB2 . 16124 1 50 . 1 1 5 5 ASP C C 13 176.544 0.3 . 1 . . . . 5 D C . 16124 1 51 . 1 1 5 5 ASP CA C 13 53.980 0.3 . 1 . . . . 5 D CA . 16124 1 52 . 1 1 5 5 ASP CB C 13 40.950 0.3 . 1 . . . . 5 D CB . 16124 1 53 . 1 1 5 5 ASP N N 15 118.220 0.3 . 1 . . . . 5 D N . 16124 1 54 . 1 1 6 6 GLY H H 1 8.326 0.02 . 1 . . . . 6 G HN . 16124 1 55 . 1 1 6 6 GLY HA2 H 1 3.703 0.02 . 2 . . . . 6 G HA1 . 16124 1 56 . 1 1 6 6 GLY HA3 H 1 4.187 0.02 . 2 . . . . 6 G HA2 . 16124 1 57 . 1 1 6 6 GLY C C 13 173.797 0.3 . 1 . . . . 6 G C . 16124 1 58 . 1 1 6 6 GLY CA C 13 45.580 0.3 . 1 . . . . 6 G CA . 16124 1 59 . 1 1 6 6 GLY N N 15 107.440 0.3 . 1 . . . . 6 G N . 16124 1 60 . 1 1 7 7 TYR H H 1 8.233 0.02 . 1 . . . . 7 Y HN . 16124 1 61 . 1 1 7 7 TYR HA H 1 4.547 0.02 . 1 . . . . 7 Y HA . 16124 1 62 . 1 1 7 7 TYR HB2 H 1 2.088 0.02 . 2 . . . . 7 Y HB1 . 16124 1 63 . 1 1 7 7 TYR HB3 H 1 2.969 0.02 . 2 . . . . 7 Y HB2 . 16124 1 64 . 1 1 7 7 TYR HD1 H 1 6.749 0.02 . 3 . . . . 7 Y HD1 . 16124 1 65 . 1 1 7 7 TYR HE1 H 1 6.541 0.02 . 3 . . . . 7 Y HE1 . 16124 1 66 . 1 1 7 7 TYR C C 13 175.664 0.3 . 1 . . . . 7 Y C . 16124 1 67 . 1 1 7 7 TYR CA C 13 56.710 0.3 . 1 . . . . 7 Y CA . 16124 1 68 . 1 1 7 7 TYR CB C 13 39.210 0.3 . 1 . . . . 7 Y CB . 16124 1 69 . 1 1 7 7 TYR CD1 C 13 132.868 0.3 . 3 . . . . 7 Y CD1 . 16124 1 70 . 1 1 7 7 TYR CE1 C 13 117.830 0.3 . 3 . . . . 7 Y CE1 . 16124 1 71 . 1 1 7 7 TYR N N 15 119.240 0.3 . 1 . . . . 7 Y N . 16124 1 72 . 1 1 8 8 ARG H H 1 8.380 0.02 . 1 . . . . 8 R HN . 16124 1 73 . 1 1 8 8 ARG HA H 1 5.057 0.02 . 1 . . . . 8 R HA . 16124 1 74 . 1 1 8 8 ARG HB2 H 1 1.968 0.02 . 2 . . . . 8 R HB1 . 16124 1 75 . 1 1 8 8 ARG HB3 H 1 1.992 0.02 . 2 . . . . 8 R HB2 . 16124 1 76 . 1 1 8 8 ARG HD2 H 1 3.269 0.02 . 2 . . . . 8 R HD1 . 16124 1 77 . 1 1 8 8 ARG HD3 H 1 3.329 0.02 . 2 . . . . 8 R HD2 . 16124 1 78 . 1 1 8 8 ARG HG2 H 1 2.011 0.02 . 2 . . . . 8 R HG2 . 16124 1 79 . 1 1 8 8 ARG CA C 13 53.560 0.3 . 1 . . . . 8 R CA . 16124 1 80 . 1 1 8 8 ARG CB C 13 31.993 0.3 . 1 . . . . 8 R CB . 16124 1 81 . 1 1 8 8 ARG CD C 13 43.643 0.3 . 1 . . . . 8 R CD . 16124 1 82 . 1 1 8 8 ARG CG C 13 27.140 0.3 . 1 . . . . 8 R CG . 16124 1 83 . 1 1 8 8 ARG N N 15 125.050 0.3 . 1 . . . . 8 R N . 16124 1 84 . 1 1 9 9 PRO HA H 1 5.295 0.02 . 1 . . . . 9 P HA . 16124 1 85 . 1 1 9 9 PRO HB2 H 1 1.915 0.02 . 2 . . . . 9 P HB1 . 16124 1 86 . 1 1 9 9 PRO HB3 H 1 2.125 0.02 . 2 . . . . 9 P HB2 . 16124 1 87 . 1 1 9 9 PRO HD2 H 1 4.060 0.02 . 2 . . . . 9 P HD2 . 16124 1 88 . 1 1 9 9 PRO HG2 H 1 1.980 0.02 . 2 . . . . 9 P HG1 . 16124 1 89 . 1 1 9 9 PRO HG3 H 1 2.304 0.02 . 2 . . . . 9 P HG2 . 16124 1 90 . 1 1 9 9 PRO C C 13 177.306 0.3 . 1 . . . . 9 P C . 16124 1 91 . 1 1 9 9 PRO CA C 13 62.450 0.3 . 1 . . . . 9 P CA . 16124 1 92 . 1 1 9 9 PRO CB C 13 32.750 0.3 . 1 . . . . 9 P CB . 16124 1 93 . 1 1 9 9 PRO CD C 13 51.212 0.3 . 1 . . . . 9 P CD . 16124 1 94 . 1 1 9 9 PRO CG C 13 27.437 0.3 . 1 . . . . 9 P CG . 16124 1 95 . 1 1 10 10 ASN H H 1 9.483 0.02 . 1 . . . . 10 N HN . 16124 1 96 . 1 1 10 10 ASN HA H 1 5.429 0.02 . 1 . . . . 10 N HA . 16124 1 97 . 1 1 10 10 ASN HB2 H 1 2.545 0.02 . 2 . . . . 10 N HB1 . 16124 1 98 . 1 1 10 10 ASN HB3 H 1 2.659 0.02 . 2 . . . . 10 N HB2 . 16124 1 99 . 1 1 10 10 ASN HD21 H 1 7.146 0.02 . 2 . . . . 10 N HD21 . 16124 1 100 . 1 1 10 10 ASN HD22 H 1 6.631 0.02 . 2 . . . . 10 N HD22 . 16124 1 101 . 1 1 10 10 ASN C C 13 172.909 0.3 . 1 . . . . 10 N C . 16124 1 102 . 1 1 10 10 ASN CA C 13 52.980 0.3 . 1 . . . . 10 N CA . 16124 1 103 . 1 1 10 10 ASN CB C 13 45.270 0.3 . 1 . . . . 10 N CB . 16124 1 104 . 1 1 10 10 ASN CG C 13 175.342 0.3 . 1 . . . . 10 N CG . 16124 1 105 . 1 1 10 10 ASN N N 15 124.760 0.3 . 1 . . . . 10 N N . 16124 1 106 . 1 1 10 10 ASN ND2 N 15 109.988 0.3 . 1 . . . . 10 N ND2 . 16124 1 107 . 1 1 11 11 VAL H H 1 9.223 0.02 . 1 . . . . 11 V HN . 16124 1 108 . 1 1 11 11 VAL HA H 1 5.470 0.02 . 1 . . . . 11 V HA . 16124 1 109 . 1 1 11 11 VAL HB H 1 1.864 0.02 . 1 . . . . 11 V HB . 16124 1 110 . 1 1 11 11 VAL HG11 H 1 0.714 0.02 . 2 . . . . 11 V HG11 . 16124 1 111 . 1 1 11 11 VAL HG12 H 1 0.714 0.02 . 2 . . . . 11 V HG11 . 16124 1 112 . 1 1 11 11 VAL HG13 H 1 0.714 0.02 . 2 . . . . 11 V HG11 . 16124 1 113 . 1 1 11 11 VAL HG21 H 1 0.977 0.02 . 2 . . . . 11 V HG21 . 16124 1 114 . 1 1 11 11 VAL HG22 H 1 0.977 0.02 . 2 . . . . 11 V HG21 . 16124 1 115 . 1 1 11 11 VAL HG23 H 1 0.977 0.02 . 2 . . . . 11 V HG21 . 16124 1 116 . 1 1 11 11 VAL C C 13 174.169 0.3 . 1 . . . . 11 V C . 16124 1 117 . 1 1 11 11 VAL CA C 13 58.510 0.3 . 1 . . . . 11 V CA . 16124 1 118 . 1 1 11 11 VAL CB C 13 35.300 0.3 . 1 . . . . 11 V CB . 16124 1 119 . 1 1 11 11 VAL CG1 C 13 19.076 0.3 . 1 . . . . 11 V CG1 . 16124 1 120 . 1 1 11 11 VAL CG2 C 13 21.479 0.3 . 1 . . . . 11 V CG2 . 16124 1 121 . 1 1 11 11 VAL N N 15 115.040 0.3 . 1 . . . . 11 V N . 16124 1 122 . 1 1 12 12 GLY H H 1 7.843 0.02 . 1 . . . . 12 G HN . 16124 1 123 . 1 1 12 12 GLY HA2 H 1 4.282 0.02 . 2 . . . . 12 G HA1 . 16124 1 124 . 1 1 12 12 GLY HA3 H 1 4.255 0.02 . 2 . . . . 12 G HA2 . 16124 1 125 . 1 1 12 12 GLY C C 13 172.704 0.3 . 1 . . . . 12 G C . 16124 1 126 . 1 1 12 12 GLY CA C 13 42.690 0.3 . 1 . . . . 12 G CA . 16124 1 127 . 1 1 12 12 GLY N N 15 110.338 0.3 . 1 . . . . 12 G N . 16124 1 128 . 1 1 13 13 ILE H H 1 7.902 0.02 . 1 . . . . 13 I HN . 16124 1 129 . 1 1 13 13 ILE HA H 1 4.695 0.02 . 1 . . . . 13 I HA . 16124 1 130 . 1 1 13 13 ILE HB H 1 1.536 0.02 . 1 . . . . 13 I HB . 16124 1 131 . 1 1 13 13 ILE HD11 H 1 0.621 0.02 . 1 . . . . 13 I HD11 . 16124 1 132 . 1 1 13 13 ILE HD12 H 1 0.621 0.02 . 1 . . . . 13 I HD11 . 16124 1 133 . 1 1 13 13 ILE HD13 H 1 0.621 0.02 . 1 . . . . 13 I HD11 . 16124 1 134 . 1 1 13 13 ILE HG12 H 1 0.609 0.02 . 1 . . . . 13 I HG11 . 16124 1 135 . 1 1 13 13 ILE HG13 H 1 1.297 0.02 . 1 . . . . 13 I HG12 . 16124 1 136 . 1 1 13 13 ILE HG21 H 1 0.739 0.02 . 1 . . . . 13 I HG21 . 16124 1 137 . 1 1 13 13 ILE HG22 H 1 0.739 0.02 . 1 . . . . 13 I HG21 . 16124 1 138 . 1 1 13 13 ILE HG23 H 1 0.739 0.02 . 1 . . . . 13 I HG21 . 16124 1 139 . 1 1 13 13 ILE C C 13 173.701 0.3 . 1 . . . . 13 I C . 16124 1 140 . 1 1 13 13 ILE CA C 13 61.220 0.3 . 1 . . . . 13 I CA . 16124 1 141 . 1 1 13 13 ILE CB C 13 42.040 0.3 . 1 . . . . 13 I CB . 16124 1 142 . 1 1 13 13 ILE CD1 C 13 14.126 0.3 . 1 . . . . 13 I CD1 . 16124 1 143 . 1 1 13 13 ILE CG1 C 13 27.419 0.3 . 1 . . . . 13 I CG1 . 16124 1 144 . 1 1 13 13 ILE CG2 C 13 19.447 0.3 . 1 . . . . 13 I CG2 . 16124 1 145 . 1 1 13 13 ILE N N 15 121.470 0.3 . 1 . . . . 13 I N . 16124 1 146 . 1 1 14 14 VAL H H 1 9.042 0.02 . 1 . . . . 14 V HN . 16124 1 147 . 1 1 14 14 VAL HA H 1 3.845 0.02 . 1 . . . . 14 V HA . 16124 1 148 . 1 1 14 14 VAL HB H 1 2.007 0.02 . 1 . . . . 14 V HB . 16124 1 149 . 1 1 14 14 VAL HG11 H 1 0.417 0.02 . 2 . . . . 14 V HG11 . 16124 1 150 . 1 1 14 14 VAL HG12 H 1 0.417 0.02 . 2 . . . . 14 V HG11 . 16124 1 151 . 1 1 14 14 VAL HG13 H 1 0.417 0.02 . 2 . . . . 14 V HG11 . 16124 1 152 . 1 1 14 14 VAL HG21 H 1 0.556 0.02 . 2 . . . . 14 V HG21 . 16124 1 153 . 1 1 14 14 VAL HG22 H 1 0.556 0.02 . 2 . . . . 14 V HG21 . 16124 1 154 . 1 1 14 14 VAL HG23 H 1 0.556 0.02 . 2 . . . . 14 V HG21 . 16124 1 155 . 1 1 14 14 VAL C C 13 174.257 0.3 . 1 . . . . 14 V C . 16124 1 156 . 1 1 14 14 VAL CA C 13 61.340 0.3 . 1 . . . . 14 V CA . 16124 1 157 . 1 1 14 14 VAL CB C 13 32.430 0.3 . 1 . . . . 14 V CB . 16124 1 158 . 1 1 14 14 VAL CG1 C 13 20.303 0.3 . 1 . . . . 14 V CG1 . 16124 1 159 . 1 1 14 14 VAL CG2 C 13 21.334 0.3 . 1 . . . . 14 V CG2 . 16124 1 160 . 1 1 14 14 VAL N N 15 127.670 0.3 . 1 . . . . 14 V N . 16124 1 161 . 1 1 15 15 ILE H H 1 9.220 0.02 . 1 . . . . 15 I HN . 16124 1 162 . 1 1 15 15 ILE HA H 1 4.892 0.02 . 1 . . . . 15 I HA . 16124 1 163 . 1 1 15 15 ILE HB H 1 1.823 0.02 . 1 . . . . 15 I HB . 16124 1 164 . 1 1 15 15 ILE HD11 H 1 0.726 0.02 . 1 . . . . 15 I HD11 . 16124 1 165 . 1 1 15 15 ILE HD12 H 1 0.726 0.02 . 1 . . . . 15 I HD11 . 16124 1 166 . 1 1 15 15 ILE HD13 H 1 0.726 0.02 . 1 . . . . 15 I HD11 . 16124 1 167 . 1 1 15 15 ILE HG12 H 1 1.611 0.02 . 1 . . . . 15 I HG11 . 16124 1 168 . 1 1 15 15 ILE HG13 H 1 0.720 0.02 . 1 . . . . 15 I HG12 . 16124 1 169 . 1 1 15 15 ILE HG21 H 1 0.916 0.02 . 1 . . . . 15 I HG21 . 16124 1 170 . 1 1 15 15 ILE HG22 H 1 0.916 0.02 . 1 . . . . 15 I HG21 . 16124 1 171 . 1 1 15 15 ILE HG23 H 1 0.916 0.02 . 1 . . . . 15 I HG21 . 16124 1 172 . 1 1 15 15 ILE C C 13 175.166 0.3 . 1 . . . . 15 I C . 16124 1 173 . 1 1 15 15 ILE CA C 13 60.410 0.3 . 1 . . . . 15 I CA . 16124 1 174 . 1 1 15 15 ILE CB C 13 39.170 0.3 . 1 . . . . 15 I CB . 16124 1 175 . 1 1 15 15 ILE CD1 C 13 14.161 0.3 . 1 . . . . 15 I CD1 . 16124 1 176 . 1 1 15 15 ILE CG1 C 13 29.303 0.3 . 1 . . . . 15 I CG1 . 16124 1 177 . 1 1 15 15 ILE CG2 C 13 18.412 0.3 . 1 . . . . 15 I CG2 . 16124 1 178 . 1 1 15 15 ILE N N 15 128.140 0.3 . 1 . . . . 15 I N . 16124 1 179 . 1 1 16 16 CYS H H 1 9.580 0.02 . 1 . . . . 16 C HN . 16124 1 180 . 1 1 16 16 CYS HA H 1 6.484 0.02 . 1 . . . . 16 C HA . 16124 1 181 . 1 1 16 16 CYS HB2 H 1 2.639 0.02 . 2 . . . . 16 C HB1 . 16124 1 182 . 1 1 16 16 CYS HB3 H 1 3.120 0.02 . 2 . . . . 16 C HB2 . 16124 1 183 . 1 1 16 16 CYS C C 13 177.524 0.3 . 1 . . . . 16 C C . 16124 1 184 . 1 1 16 16 CYS CA C 13 54.970 0.3 . 1 . . . . 16 C CA . 16124 1 185 . 1 1 16 16 CYS CB C 13 32.580 0.3 . 1 . . . . 16 C CB . 16124 1 186 . 1 1 16 16 CYS N N 15 123.370 0.3 . 1 . . . . 16 C N . 16124 1 187 . 1 1 17 17 ASN H H 1 7.780 0.02 . 1 . . . . 17 N HN . 16124 1 188 . 1 1 17 17 ASN HA H 1 4.943 0.02 . 1 . . . . 17 N HA . 16124 1 189 . 1 1 17 17 ASN HB2 H 1 1.483 0.02 . 2 . . . . 17 N HB1 . 16124 1 190 . 1 1 17 17 ASN HB3 H 1 3.029 0.02 . 2 . . . . 17 N HB2 . 16124 1 191 . 1 1 17 17 ASN HD21 H 1 7.342 0.02 . 2 . . . . 17 N HD21 . 16124 1 192 . 1 1 17 17 ASN HD22 H 1 6.540 0.02 . 2 . . . . 17 N HD22 . 16124 1 193 . 1 1 17 17 ASN C C 13 174.965 0.3 . 1 . . . . 17 N C . 16124 1 194 . 1 1 17 17 ASN CA C 13 49.750 0.3 . 1 . . . . 17 N CA . 16124 1 195 . 1 1 17 17 ASN CB C 13 38.590 0.3 . 1 . . . . 17 N CB . 16124 1 196 . 1 1 17 17 ASN CG C 13 179.651 0.3 . 1 . . . . 17 N CG . 16124 1 197 . 1 1 17 17 ASN N N 15 118.057 0.3 . 1 . . . . 17 N N . 16124 1 198 . 1 1 17 17 ASN ND2 N 15 110.954 0.3 . 1 . . . . 17 N ND2 . 16124 1 199 . 1 1 18 18 ARG H H 1 8.087 0.02 . 1 . . . . 18 R HN . 16124 1 200 . 1 1 18 18 ARG HA H 1 4.078 0.02 . 1 . . . . 18 R HA . 16124 1 201 . 1 1 18 18 ARG HB2 H 1 1.755 0.02 . 2 . . . . 18 R HB1 . 16124 1 202 . 1 1 18 18 ARG HB3 H 1 1.967 0.02 . 2 . . . . 18 R HB2 . 16124 1 203 . 1 1 18 18 ARG HD2 H 1 3.201 0.02 . 2 . . . . 18 R HD2 . 16124 1 204 . 1 1 18 18 ARG HE H 1 7.289 0.02 . 1 . . . . 18 R HE . 16124 1 205 . 1 1 18 18 ARG HG2 H 1 1.565 0.02 . 2 . . . . 18 R HG1 . 16124 1 206 . 1 1 18 18 ARG HG3 H 1 1.686 0.02 . 2 . . . . 18 R HG2 . 16124 1 207 . 1 1 18 18 ARG C C 13 176.014 0.3 . 1 . . . . 18 R C . 16124 1 208 . 1 1 18 18 ARG CA C 13 58.190 0.3 . 1 . . . . 18 R CA . 16124 1 209 . 1 1 18 18 ARG CB C 13 29.470 0.3 . 1 . . . . 18 R CB . 16124 1 210 . 1 1 18 18 ARG CD C 13 43.416 0.3 . 1 . . . . 18 R CD . 16124 1 211 . 1 1 18 18 ARG CG C 13 27.684 0.3 . 1 . . . . 18 R CG . 16124 1 212 . 1 1 18 18 ARG N N 15 116.100 0.3 . 1 . . . . 18 R N . 16124 1 213 . 1 1 18 18 ARG NE N 15 110.755 0.3 . 1 . . . . 18 R NE . 16124 1 214 . 1 1 19 19 GLN H H 1 7.420 0.02 . 1 . . . . 19 Q HN . 16124 1 215 . 1 1 19 19 GLN HA H 1 4.445 0.02 . 1 . . . . 19 Q HA . 16124 1 216 . 1 1 19 19 GLN HB2 H 1 1.770 0.02 . 2 . . . . 19 Q HB1 . 16124 1 217 . 1 1 19 19 GLN HB3 H 1 2.143 0.02 . 2 . . . . 19 Q HB2 . 16124 1 218 . 1 1 19 19 GLN HE21 H 1 7.320 0.02 . 2 . . . . 19 Q HE21 . 16124 1 219 . 1 1 19 19 GLN HE22 H 1 6.673 0.02 . 2 . . . . 19 Q HE22 . 16124 1 220 . 1 1 19 19 GLN HG2 H 1 2.130 0.02 . 2 . . . . 19 Q HG1 . 16124 1 221 . 1 1 19 19 GLN HG3 H 1 2.225 0.02 . 2 . . . . 19 Q HG2 . 16124 1 222 . 1 1 19 19 GLN C C 13 176.173 0.3 . 1 . . . . 19 Q C . 16124 1 223 . 1 1 19 19 GLN CA C 13 55.330 0.3 . 1 . . . . 19 Q CA . 16124 1 224 . 1 1 19 19 GLN CB C 13 28.760 0.3 . 1 . . . . 19 Q CB . 16124 1 225 . 1 1 19 19 GLN CD C 13 180.589 0.3 . 1 . . . . 19 Q CD . 16124 1 226 . 1 1 19 19 GLN CG C 13 34.384 0.3 . 1 . . . . 19 Q CG . 16124 1 227 . 1 1 19 19 GLN N N 15 115.460 0.3 . 1 . . . . 19 Q N . 16124 1 228 . 1 1 19 19 GLN NE2 N 15 111.465 0.3 . 1 . . . . 19 Q NE2 . 16124 1 229 . 1 1 20 20 GLY H H 1 8.219 0.02 . 1 . . . . 20 G HN . 16124 1 230 . 1 1 20 20 GLY HA2 H 1 3.383 0.02 . 2 . . . . 20 G HA1 . 16124 1 231 . 1 1 20 20 GLY HA3 H 1 3.992 0.02 . 2 . . . . 20 G HA2 . 16124 1 232 . 1 1 20 20 GLY C C 13 174.164 0.3 . 1 . . . . 20 G C . 16124 1 233 . 1 1 20 20 GLY CA C 13 46.310 0.3 . 1 . . . . 20 G CA . 16124 1 234 . 1 1 20 20 GLY N N 15 108.120 0.3 . 1 . . . . 20 G N . 16124 1 235 . 1 1 21 21 GLN H H 1 7.512 0.02 . 1 . . . . 21 Q HN . 16124 1 236 . 1 1 21 21 GLN HA H 1 4.819 0.02 . 1 . . . . 21 Q HA . 16124 1 237 . 1 1 21 21 GLN HB2 H 1 1.818 0.02 . 2 . . . . 21 Q HB2 . 16124 1 238 . 1 1 21 21 GLN HG2 H 1 2.025 0.02 . 2 . . . . 21 Q HG1 . 16124 1 239 . 1 1 21 21 GLN HG3 H 1 2.102 0.02 . 2 . . . . 21 Q HG2 . 16124 1 240 . 1 1 21 21 GLN C C 13 175.302 0.3 . 1 . . . . 21 Q C . 16124 1 241 . 1 1 21 21 GLN CA C 13 54.570 0.3 . 1 . . . . 21 Q CA . 16124 1 242 . 1 1 21 21 GLN CB C 13 31.130 0.3 . 1 . . . . 21 Q CB . 16124 1 243 . 1 1 21 21 GLN CD C 13 179.706 0.3 . 1 . . . . 21 Q CD . 16124 1 244 . 1 1 21 21 GLN CG C 13 34.350 0.3 . 1 . . . . 21 Q CG . 16124 1 245 . 1 1 21 21 GLN N N 15 116.750 0.3 . 1 . . . . 21 Q N . 16124 1 246 . 1 1 22 22 VAL H H 1 9.076 0.02 . 1 . . . . 22 V HN . 16124 1 247 . 1 1 22 22 VAL HA H 1 6.069 0.02 . 1 . . . . 22 V HA . 16124 1 248 . 1 1 22 22 VAL HB H 1 2.288 0.02 . 1 . . . . 22 V HB . 16124 1 249 . 1 1 22 22 VAL HG11 H 1 0.905 0.02 . 2 . . . . 22 V HG11 . 16124 1 250 . 1 1 22 22 VAL HG12 H 1 0.905 0.02 . 2 . . . . 22 V HG11 . 16124 1 251 . 1 1 22 22 VAL HG13 H 1 0.905 0.02 . 2 . . . . 22 V HG11 . 16124 1 252 . 1 1 22 22 VAL HG21 H 1 0.841 0.02 . 2 . . . . 22 V HG21 . 16124 1 253 . 1 1 22 22 VAL HG22 H 1 0.841 0.02 . 2 . . . . 22 V HG21 . 16124 1 254 . 1 1 22 22 VAL HG23 H 1 0.841 0.02 . 2 . . . . 22 V HG21 . 16124 1 255 . 1 1 22 22 VAL C C 13 176.137 0.3 . 1 . . . . 22 V C . 16124 1 256 . 1 1 22 22 VAL CA C 13 58.500 0.3 . 1 . . . . 22 V CA . 16124 1 257 . 1 1 22 22 VAL CB C 13 35.980 0.3 . 1 . . . . 22 V CB . 16124 1 258 . 1 1 22 22 VAL CG1 C 13 19.516 0.3 . 1 . . . . 22 V CG1 . 16124 1 259 . 1 1 22 22 VAL CG2 C 13 22.664 0.3 . 1 . . . . 22 V CG2 . 16124 1 260 . 1 1 22 22 VAL N N 15 108.307 0.3 . 1 . . . . 22 V N . 16124 1 261 . 1 1 23 23 MET H H 1 8.954 0.02 . 1 . . . . 23 M HN . 16124 1 262 . 1 1 23 23 MET HA H 1 4.249 0.02 . 1 . . . . 23 M HA . 16124 1 263 . 1 1 23 23 MET HB2 H 1 2.152 0.02 . 2 . . . . 23 M HB2 . 16124 1 264 . 1 1 23 23 MET HE1 H 1 1.309 0.02 . 1 . . . . 23 M HE1 . 16124 1 265 . 1 1 23 23 MET HE2 H 1 1.309 0.02 . 1 . . . . 23 M HE1 . 16124 1 266 . 1 1 23 23 MET HE3 H 1 1.309 0.02 . 1 . . . . 23 M HE1 . 16124 1 267 . 1 1 23 23 MET C C 13 174.218 0.3 . 1 . . . . 23 M C . 16124 1 268 . 1 1 23 23 MET CA C 13 57.361 0.3 . 1 . . . . 23 M CA . 16124 1 269 . 1 1 23 23 MET CB C 13 32.930 0.3 . 1 . . . . 23 M CB . 16124 1 270 . 1 1 23 23 MET CE C 13 17.084 0.3 . 1 . . . . 23 M CE . 16124 1 271 . 1 1 23 23 MET N N 15 123.780 0.3 . 1 . . . . 23 M N . 16124 1 272 . 1 1 24 24 TRP H H 1 9.350 0.02 . 1 . . . . 24 W HN . 16124 1 273 . 1 1 24 24 TRP HA H 1 4.244 0.02 . 1 . . . . 24 W HA . 16124 1 274 . 1 1 24 24 TRP HB2 H 1 2.506 0.02 . 2 . . . . 24 W HB2 . 16124 1 275 . 1 1 24 24 TRP HD1 H 1 6.326 0.02 . 1 . . . . 24 W HD1 . 16124 1 276 . 1 1 24 24 TRP HE1 H 1 9.894 0.02 . 1 . . . . 24 W HE1 . 16124 1 277 . 1 1 24 24 TRP HZ2 H 1 6.450 0.02 . 1 . . . . 24 W HZ2 . 16124 1 278 . 1 1 24 24 TRP C C 13 174.467 0.3 . 1 . . . . 24 W C . 16124 1 279 . 1 1 24 24 TRP CA C 13 54.910 0.3 . 1 . . . . 24 W CA . 16124 1 280 . 1 1 24 24 TRP CD1 C 13 127.380 0.3 . 1 . . . . 24 W CD1 . 16124 1 281 . 1 1 24 24 TRP CZ2 C 13 118.039 0.3 . 1 . . . . 24 W CZ2 . 16124 1 282 . 1 1 24 24 TRP N N 15 108.110 0.3 . 1 . . . . 24 W N . 16124 1 283 . 1 1 24 24 TRP NE1 N 15 129.634 0.3 . 1 . . . . 24 W NE1 . 16124 1 284 . 1 1 25 25 ALA H H 1 7.868 0.02 . 1 . . . . 25 A HN . 16124 1 285 . 1 1 25 25 ALA HA H 1 5.080 0.02 . 1 . . . . 25 A HA . 16124 1 286 . 1 1 25 25 ALA HB1 H 1 0.397 0.02 . 1 . . . . 25 A HB1 . 16124 1 287 . 1 1 25 25 ALA HB2 H 1 0.397 0.02 . 1 . . . . 25 A HB1 . 16124 1 288 . 1 1 25 25 ALA HB3 H 1 0.397 0.02 . 1 . . . . 25 A HB1 . 16124 1 289 . 1 1 25 25 ALA C C 13 173.418 0.3 . 1 . . . . 25 A C . 16124 1 290 . 1 1 25 25 ALA CA C 13 51.310 0.3 . 1 . . . . 25 A CA . 16124 1 291 . 1 1 25 25 ALA CB C 13 21.000 0.3 . 1 . . . . 25 A CB . 16124 1 292 . 1 1 25 25 ALA N N 15 128.760 0.3 . 1 . . . . 25 A N . 16124 1 293 . 1 1 26 26 ARG H H 1 7.835 0.02 . 1 . . . . 26 R HN . 16124 1 294 . 1 1 26 26 ARG HA H 1 3.486 0.02 . 1 . . . . 26 R HA . 16124 1 295 . 1 1 26 26 ARG HB2 H 1 0.568 0.02 . 2 . . . . 26 R HB1 . 16124 1 296 . 1 1 26 26 ARG HB3 H 1 0.976 0.02 . 2 . . . . 26 R HB2 . 16124 1 297 . 1 1 26 26 ARG C C 13 177.470 0.3 . 1 . . . . 26 R C . 16124 1 298 . 1 1 26 26 ARG CA C 13 54.670 0.3 . 1 . . . . 26 R CA . 16124 1 299 . 1 1 26 26 ARG CB C 13 30.010 0.3 . 1 . . . . 26 R CB . 16124 1 300 . 1 1 26 26 ARG N N 15 123.750 0.3 . 1 . . . . 26 R N . 16124 1 301 . 1 1 27 27 ARG H H 1 8.596 0.02 . 1 . . . . 27 R HN . 16124 1 302 . 1 1 27 27 ARG HA H 1 4.323 0.02 . 1 . . . . 27 R HA . 16124 1 303 . 1 1 27 27 ARG HB2 H 1 1.583 0.02 . 2 . . . . 27 R HB2 . 16124 1 304 . 1 1 27 27 ARG HD2 H 1 3.160 0.02 . 2 . . . . 27 R HD1 . 16124 1 305 . 1 1 27 27 ARG HD3 H 1 2.940 0.02 . 2 . . . . 27 R HD2 . 16124 1 306 . 1 1 27 27 ARG HG2 H 1 1.640 0.02 . 2 . . . . 27 R HG1 . 16124 1 307 . 1 1 27 27 ARG HG3 H 1 1.421 0.02 . 2 . . . . 27 R HG2 . 16124 1 308 . 1 1 27 27 ARG C C 13 175.835 0.3 . 1 . . . . 27 R C . 16124 1 309 . 1 1 27 27 ARG CA C 13 56.370 0.3 . 1 . . . . 27 R CA . 16124 1 310 . 1 1 27 27 ARG CB C 13 30.360 0.3 . 1 . . . . 27 R CB . 16124 1 311 . 1 1 27 27 ARG CD C 13 42.500 0.3 . 1 . . . . 27 R CD . 16124 1 312 . 1 1 27 27 ARG CG C 13 27.900 0.3 . 1 . . . . 27 R CG . 16124 1 313 . 1 1 27 27 ARG N N 15 126.650 0.3 . 1 . . . . 27 R N . 16124 1 314 . 1 1 28 28 PHE H H 1 8.380 0.02 . 1 . . . . 28 F HN . 16124 1 315 . 1 1 28 28 PHE HA H 1 3.751 0.02 . 1 . . . . 28 F HA . 16124 1 316 . 1 1 28 28 PHE HB2 H 1 2.432 0.02 . 2 . . . . 28 F HB1 . 16124 1 317 . 1 1 28 28 PHE HB3 H 1 2.845 0.02 . 2 . . . . 28 F HB2 . 16124 1 318 . 1 1 28 28 PHE HD1 H 1 7.053 0.02 . 3 . . . . 28 F HD1 . 16124 1 319 . 1 1 28 28 PHE HE1 H 1 7.340 0.02 . 3 . . . . 28 F HE1 . 16124 1 320 . 1 1 28 28 PHE C C 13 177.079 0.3 . 1 . . . . 28 F C . 16124 1 321 . 1 1 28 28 PHE CA C 13 59.570 0.3 . 1 . . . . 28 F CA . 16124 1 322 . 1 1 28 28 PHE CB C 13 39.680 0.3 . 1 . . . . 28 F CB . 16124 1 323 . 1 1 28 28 PHE CD1 C 13 131.756 0.3 . 3 . . . . 28 F CD1 . 16124 1 324 . 1 1 28 28 PHE CE1 C 13 130.430 0.3 . 3 . . . . 28 F CE1 . 16124 1 325 . 1 1 28 28 PHE N N 15 123.760 0.3 . 1 . . . . 28 F N . 16124 1 326 . 1 1 29 29 GLY H H 1 8.446 0.02 . 1 . . . . 29 G HN . 16124 1 327 . 1 1 29 29 GLY HA2 H 1 3.238 0.02 . 2 . . . . 29 G HA1 . 16124 1 328 . 1 1 29 29 GLY HA3 H 1 3.868 0.02 . 2 . . . . 29 G HA2 . 16124 1 329 . 1 1 29 29 GLY C C 13 173.880 0.3 . 1 . . . . 29 G C . 16124 1 330 . 1 1 29 29 GLY CA C 13 45.910 0.3 . 1 . . . . 29 G CA . 16124 1 331 . 1 1 29 29 GLY N N 15 117.280 0.3 . 1 . . . . 29 G N . 16124 1 332 . 1 1 30 30 GLN H H 1 8.068 0.02 . 1 . . . . 30 Q HN . 16124 1 333 . 1 1 30 30 GLN HA H 1 4.387 0.02 . 1 . . . . 30 Q HA . 16124 1 334 . 1 1 30 30 GLN HB2 H 1 1.719 0.02 . 2 . . . . 30 Q HB1 . 16124 1 335 . 1 1 30 30 GLN HB3 H 1 2.207 0.02 . 2 . . . . 30 Q HB2 . 16124 1 336 . 1 1 30 30 GLN HE21 H 1 7.579 0.02 . 2 . . . . 30 Q HE21 . 16124 1 337 . 1 1 30 30 GLN HE22 H 1 6.751 0.02 . 2 . . . . 30 Q HE22 . 16124 1 338 . 1 1 30 30 GLN HG2 H 1 2.269 0.02 . 2 . . . . 30 Q HG2 . 16124 1 339 . 1 1 30 30 GLN C C 13 175.462 0.3 . 1 . . . . 30 Q C . 16124 1 340 . 1 1 30 30 GLN CA C 13 54.980 0.3 . 1 . . . . 30 Q CA . 16124 1 341 . 1 1 30 30 GLN CB C 13 31.330 0.3 . 1 . . . . 30 Q CB . 16124 1 342 . 1 1 30 30 GLN CG C 13 33.541 0.3 . 1 . . . . 30 Q CG . 16124 1 343 . 1 1 30 30 GLN N N 15 119.478 0.3 . 1 . . . . 30 Q N . 16124 1 344 . 1 1 30 30 GLN NE2 N 15 112.025 0.3 . 1 . . . . 30 Q NE2 . 16124 1 345 . 1 1 31 31 HIS H H 1 8.407 0.02 . 1 . . . . 31 H HN . 16124 1 346 . 1 1 31 31 HIS HA H 1 4.592 0.02 . 1 . . . . 31 H HA . 16124 1 347 . 1 1 31 31 HIS HB2 H 1 3.207 0.02 . 2 . . . . 31 H HB1 . 16124 1 348 . 1 1 31 31 HIS HB3 H 1 3.500 0.02 . 2 . . . . 31 H HB2 . 16124 1 349 . 1 1 31 31 HIS HD2 H 1 7.317 0.02 . 1 . . . . 31 H HD2 . 16124 1 350 . 1 1 31 31 HIS C C 13 173.489 0.3 . 1 . . . . 31 H C . 16124 1 351 . 1 1 31 31 HIS CA C 13 54.670 0.3 . 1 . . . . 31 H CA . 16124 1 352 . 1 1 31 31 HIS CB C 13 27.290 0.3 . 1 . . . . 31 H CB . 16124 1 353 . 1 1 31 31 HIS CD2 C 13 119.868 0.3 . 1 . . . . 31 H CD2 . 16124 1 354 . 1 1 31 31 HIS N N 15 113.730 0.3 . 1 . . . . 31 H N . 16124 1 355 . 1 1 32 32 SER H H 1 6.858 0.02 . 1 . . . . 32 S HN . 16124 1 356 . 1 1 32 32 SER HA H 1 4.840 0.02 . 1 . . . . 32 S HA . 16124 1 357 . 1 1 32 32 SER HB2 H 1 3.851 0.02 . 2 . . . . 32 S HB1 . 16124 1 358 . 1 1 32 32 SER HB3 H 1 3.891 0.02 . 2 . . . . 32 S HB2 . 16124 1 359 . 1 1 32 32 SER C C 13 172.156 0.3 . 1 . . . . 32 S C . 16124 1 360 . 1 1 32 32 SER CA C 13 57.320 0.3 . 1 . . . . 32 S CA . 16124 1 361 . 1 1 32 32 SER CB C 13 65.110 0.3 . 1 . . . . 32 S CB . 16124 1 362 . 1 1 32 32 SER N N 15 112.230 0.3 . 1 . . . . 32 S N . 16124 1 363 . 1 1 33 33 TRP H H 1 8.411 0.02 . 1 . . . . 33 W HN . 16124 1 364 . 1 1 33 33 TRP HA H 1 4.292 0.02 . 1 . . . . 33 W HA . 16124 1 365 . 1 1 33 33 TRP HB2 H 1 3.510 0.02 . 2 . . . . 33 W HB2 . 16124 1 366 . 1 1 33 33 TRP HD1 H 1 7.254 0.02 . 1 . . . . 33 W HD1 . 16124 1 367 . 1 1 33 33 TRP HE1 H 1 10.237 0.02 . 1 . . . . 33 W HE1 . 16124 1 368 . 1 1 33 33 TRP HH2 H 1 6.945 0.02 . 1 . . . . 33 W HH2 . 16124 1 369 . 1 1 33 33 TRP HZ2 H 1 7.450 0.02 . 1 . . . . 33 W HZ2 . 16124 1 370 . 1 1 33 33 TRP C C 13 175.876 0.3 . 1 . . . . 33 W C . 16124 1 371 . 1 1 33 33 TRP CA C 13 55.880 0.3 . 1 . . . . 33 W CA . 16124 1 372 . 1 1 33 33 TRP CB C 13 31.420 0.3 . 1 . . . . 33 W CB . 16124 1 373 . 1 1 33 33 TRP CD1 C 13 127.383 0.3 . 1 . . . . 33 W CD1 . 16124 1 374 . 1 1 33 33 TRP CH2 C 13 123.931 0.3 . 1 . . . . 33 W CH2 . 16124 1 375 . 1 1 33 33 TRP CZ2 C 13 114.993 0.3 . 1 . . . . 33 W CZ2 . 16124 1 376 . 1 1 33 33 TRP N N 15 123.280 0.3 . 1 . . . . 33 W N . 16124 1 377 . 1 1 33 33 TRP NE1 N 15 130.306 0.3 . 1 . . . . 33 W NE1 . 16124 1 378 . 1 1 34 34 GLN H H 1 8.105 0.02 . 1 . . . . 34 Q HN . 16124 1 379 . 1 1 34 34 GLN HA H 1 4.633 0.02 . 1 . . . . 34 Q HA . 16124 1 380 . 1 1 34 34 GLN HB2 H 1 3.273 0.02 . 2 . . . . 34 Q HB1 . 16124 1 381 . 1 1 34 34 GLN HB3 H 1 3.335 0.02 . 2 . . . . 34 Q HB2 . 16124 1 382 . 1 1 34 34 GLN HG2 H 1 1.683 0.02 . 2 . . . . 34 Q HG2 . 16124 1 383 . 1 1 34 34 GLN C C 13 175.671 0.3 . 1 . . . . 34 Q C . 16124 1 384 . 1 1 34 34 GLN CA C 13 57.700 0.3 . 1 . . . . 34 Q CA . 16124 1 385 . 1 1 34 34 GLN CB C 13 29.270 0.3 . 1 . . . . 34 Q CB . 16124 1 386 . 1 1 34 34 GLN N N 15 121.360 0.3 . 1 . . . . 34 Q N . 16124 1 387 . 1 1 35 35 PHE H H 1 7.999 0.02 . 1 . . . . 35 F HN . 16124 1 388 . 1 1 35 35 PHE HA H 1 4.584 0.02 . 1 . . . . 35 F HA . 16124 1 389 . 1 1 35 35 PHE HB2 H 1 2.607 0.02 . 2 . . . . 35 F HB1 . 16124 1 390 . 1 1 35 35 PHE HB3 H 1 2.423 0.02 . 2 . . . . 35 F HB2 . 16124 1 391 . 1 1 35 35 PHE HD1 H 1 7.043 0.02 . 3 . . . . 35 F HD1 . 16124 1 392 . 1 1 35 35 PHE HE1 H 1 7.000 0.02 . 3 . . . . 35 F HE1 . 16124 1 393 . 1 1 35 35 PHE CA C 13 54.010 0.3 . 1 . . . . 35 F CA . 16124 1 394 . 1 1 35 35 PHE CB C 13 40.950 0.3 . 1 . . . . 35 F CB . 16124 1 395 . 1 1 35 35 PHE CD1 C 13 131.649 0.3 . 3 . . . . 35 F CD1 . 16124 1 396 . 1 1 35 35 PHE N N 15 120.910 0.3 . 1 . . . . 35 F N . 16124 1 397 . 1 1 36 36 PRO HA H 1 4.695 0.02 . 1 . . . . 36 P HA . 16124 1 398 . 1 1 36 36 PRO HB2 H 1 1.880 0.02 . 2 . . . . 36 P HB1 . 16124 1 399 . 1 1 36 36 PRO HB3 H 1 2.520 0.02 . 2 . . . . 36 P HB2 . 16124 1 400 . 1 1 36 36 PRO HG2 H 1 2.140 0.02 . 2 . . . . 36 P HG2 . 16124 1 401 . 1 1 36 36 PRO C C 13 173.929 0.3 . 1 . . . . 36 P C . 16124 1 402 . 1 1 36 36 PRO CA C 13 64.740 0.3 . 1 . . . . 36 P CA . 16124 1 403 . 1 1 36 36 PRO CB C 13 31.695 0.3 . 1 . . . . 36 P CB . 16124 1 404 . 1 1 36 36 PRO CD C 13 50.400 0.3 . 1 . . . . 36 P CD . 16124 1 405 . 1 1 36 36 PRO CG C 13 27.937 0.3 . 1 . . . . 36 P CG . 16124 1 406 . 1 1 37 37 GLN H H 1 8.074 0.02 . 1 . . . . 37 Q HN . 16124 1 407 . 1 1 37 37 GLN HA H 1 5.243 0.02 . 1 . . . . 37 Q HA . 16124 1 408 . 1 1 37 37 GLN HB2 H 1 2.069 0.02 . 2 . . . . 37 Q HB1 . 16124 1 409 . 1 1 37 37 GLN HB3 H 1 2.109 0.02 . 2 . . . . 37 Q HB2 . 16124 1 410 . 1 1 37 37 GLN HG2 H 1 2.214 0.02 . 2 . . . . 37 Q HG1 . 16124 1 411 . 1 1 37 37 GLN HG3 H 1 2.293 0.02 . 2 . . . . 37 Q HG2 . 16124 1 412 . 1 1 37 37 GLN C C 13 175.209 0.3 . 1 . . . . 37 Q C . 16124 1 413 . 1 1 37 37 GLN CA C 13 54.970 0.3 . 1 . . . . 37 Q CA . 16124 1 414 . 1 1 37 37 GLN CB C 13 33.030 0.3 . 1 . . . . 37 Q CB . 16124 1 415 . 1 1 37 37 GLN CD C 13 178.009 0.3 . 1 . . . . 37 Q CD . 16124 1 416 . 1 1 37 37 GLN CG C 13 33.820 0.3 . 1 . . . . 37 Q CG . 16124 1 417 . 1 1 37 37 GLN N N 15 119.680 0.3 . 1 . . . . 37 Q N . 16124 1 418 . 1 1 38 38 GLY H H 1 8.652 0.02 . 1 . . . . 38 G HN . 16124 1 419 . 1 1 38 38 GLY HA2 H 1 3.947 0.02 . 2 . . . . 38 G HA1 . 16124 1 420 . 1 1 38 38 GLY HA3 H 1 4.380 0.02 . 2 . . . . 38 G HA2 . 16124 1 421 . 1 1 38 38 GLY C C 13 172.067 0.3 . 1 . . . . 38 G C . 16124 1 422 . 1 1 38 38 GLY CA C 13 45.470 0.3 . 1 . . . . 38 G CA . 16124 1 423 . 1 1 38 38 GLY N N 15 110.338 0.3 . 1 . . . . 38 G N . 16124 1 424 . 1 1 39 39 GLY H H 1 8.461 0.02 . 1 . . . . 39 G HN . 16124 1 425 . 1 1 39 39 GLY HA2 H 1 3.806 0.02 . 2 . . . . 39 G HA1 . 16124 1 426 . 1 1 39 39 GLY HA3 H 1 4.375 0.02 . 2 . . . . 39 G HA2 . 16124 1 427 . 1 1 39 39 GLY C C 13 172.672 0.3 . 1 . . . . 39 G C . 16124 1 428 . 1 1 39 39 GLY CA C 13 45.430 0.3 . 1 . . . . 39 G CA . 16124 1 429 . 1 1 39 39 GLY N N 15 106.300 0.3 . 1 . . . . 39 G N . 16124 1 430 . 1 1 40 40 ILE H H 1 7.318 0.02 . 1 . . . . 40 I HN . 16124 1 431 . 1 1 40 40 ILE HA H 1 3.967 0.02 . 1 . . . . 40 I HA . 16124 1 432 . 1 1 40 40 ILE HB H 1 1.510 0.02 . 1 . . . . 40 I HB . 16124 1 433 . 1 1 40 40 ILE HD11 H 1 1.085 0.02 . 1 . . . . 40 I HD11 . 16124 1 434 . 1 1 40 40 ILE HD12 H 1 1.085 0.02 . 1 . . . . 40 I HD11 . 16124 1 435 . 1 1 40 40 ILE HD13 H 1 1.085 0.02 . 1 . . . . 40 I HD11 . 16124 1 436 . 1 1 40 40 ILE HG12 H 1 0.820 0.02 . 1 . . . . 40 I HG11 . 16124 1 437 . 1 1 40 40 ILE HG13 H 1 1.550 0.02 . 1 . . . . 40 I HG12 . 16124 1 438 . 1 1 40 40 ILE HG21 H 1 1.038 0.02 . 1 . . . . 40 I HG21 . 16124 1 439 . 1 1 40 40 ILE HG22 H 1 1.038 0.02 . 1 . . . . 40 I HG21 . 16124 1 440 . 1 1 40 40 ILE HG23 H 1 1.038 0.02 . 1 . . . . 40 I HG21 . 16124 1 441 . 1 1 40 40 ILE C C 13 175.959 0.3 . 1 . . . . 40 I C . 16124 1 442 . 1 1 40 40 ILE CA C 13 61.200 0.3 . 1 . . . . 40 I CA . 16124 1 443 . 1 1 40 40 ILE CB C 13 39.720 0.3 . 1 . . . . 40 I CB . 16124 1 444 . 1 1 40 40 ILE CD1 C 13 14.481 0.3 . 1 . . . . 40 I CD1 . 16124 1 445 . 1 1 40 40 ILE CG1 C 13 28.228 0.3 . 1 . . . . 40 I CG1 . 16124 1 446 . 1 1 40 40 ILE CG2 C 13 17.611 0.3 . 1 . . . . 40 I CG2 . 16124 1 447 . 1 1 40 40 ILE N N 15 118.870 0.3 . 1 . . . . 40 I N . 16124 1 448 . 1 1 41 41 ASN H H 1 9.251 0.02 . 1 . . . . 41 N HN . 16124 1 449 . 1 1 41 41 ASN HA H 1 5.133 0.02 . 1 . . . . 41 N HA . 16124 1 450 . 1 1 41 41 ASN HB2 H 1 2.493 0.02 . 2 . . . . 41 N HB1 . 16124 1 451 . 1 1 41 41 ASN HB3 H 1 2.812 0.02 . 2 . . . . 41 N HB2 . 16124 1 452 . 1 1 41 41 ASN HD21 H 1 7.475 0.02 . 2 . . . . 41 N HD21 . 16124 1 453 . 1 1 41 41 ASN HD22 H 1 7.065 0.02 . 2 . . . . 41 N HD22 . 16124 1 454 . 1 1 41 41 ASN CA C 13 51.380 0.3 . 1 . . . . 41 N CA . 16124 1 455 . 1 1 41 41 ASN CB C 13 37.010 0.3 . 1 . . . . 41 N CB . 16124 1 456 . 1 1 41 41 ASN CG C 13 176.133 0.3 . 1 . . . . 41 N CG . 16124 1 457 . 1 1 41 41 ASN N N 15 128.420 0.3 . 1 . . . . 41 N N . 16124 1 458 . 1 1 41 41 ASN ND2 N 15 111.675 0.3 . 1 . . . . 41 N ND2 . 16124 1 459 . 1 1 42 42 PRO HA H 1 4.354 0.02 . 1 . . . . 42 P HA . 16124 1 460 . 1 1 42 42 PRO HB2 H 1 1.895 0.02 . 2 . . . . 42 P HB1 . 16124 1 461 . 1 1 42 42 PRO HB3 H 1 2.339 0.02 . 2 . . . . 42 P HB2 . 16124 1 462 . 1 1 42 42 PRO HD2 H 1 3.613 0.02 . 2 . . . . 42 P HD1 . 16124 1 463 . 1 1 42 42 PRO HD3 H 1 3.900 0.02 . 2 . . . . 42 P HD2 . 16124 1 464 . 1 1 42 42 PRO HG2 H 1 2.063 0.02 . 2 . . . . 42 P HG1 . 16124 1 465 . 1 1 42 42 PRO HG3 H 1 2.202 0.02 . 2 . . . . 42 P HG2 . 16124 1 466 . 1 1 42 42 PRO C C 13 177.879 0.3 . 1 . . . . 42 P C . 16124 1 467 . 1 1 42 42 PRO CA C 13 64.790 0.3 . 1 . . . . 42 P CA . 16124 1 468 . 1 1 42 42 PRO CB C 13 31.410 0.3 . 1 . . . . 42 P CB . 16124 1 469 . 1 1 42 42 PRO CD C 13 50.548 0.3 . 1 . . . . 42 P CD . 16124 1 470 . 1 1 42 42 PRO CG C 13 28.044 0.3 . 1 . . . . 42 P CG . 16124 1 471 . 1 1 43 43 GLY H H 1 8.729 0.02 . 1 . . . . 43 G HN . 16124 1 472 . 1 1 43 43 GLY HA2 H 1 3.712 0.02 . 2 . . . . 43 G HA1 . 16124 1 473 . 1 1 43 43 GLY HA3 H 1 4.210 0.02 . 2 . . . . 43 G HA2 . 16124 1 474 . 1 1 43 43 GLY C C 13 174.022 0.3 . 1 . . . . 43 G C . 16124 1 475 . 1 1 43 43 GLY CA C 13 45.530 0.3 . 1 . . . . 43 G CA . 16124 1 476 . 1 1 43 43 GLY N N 15 113.230 0.3 . 1 . . . . 43 G N . 16124 1 477 . 1 1 44 44 GLU H H 1 7.847 0.02 . 1 . . . . 44 E HN . 16124 1 478 . 1 1 44 44 GLU HA H 1 4.652 0.02 . 1 . . . . 44 E HA . 16124 1 479 . 1 1 44 44 GLU HB2 H 1 2.246 0.02 . 2 . . . . 44 E HB2 . 16124 1 480 . 1 1 44 44 GLU HG2 H 1 2.218 0.02 . 2 . . . . 44 E HG1 . 16124 1 481 . 1 1 44 44 GLU HG3 H 1 2.299 0.02 . 2 . . . . 44 E HG2 . 16124 1 482 . 1 1 44 44 GLU C C 13 177.061 0.3 . 1 . . . . 44 E C . 16124 1 483 . 1 1 44 44 GLU CA C 13 55.650 0.3 . 1 . . . . 44 E CA . 16124 1 484 . 1 1 44 44 GLU CB C 13 32.220 0.3 . 1 . . . . 44 E CB . 16124 1 485 . 1 1 44 44 GLU CG C 13 37.241 0.3 . 1 . . . . 44 E CG . 16124 1 486 . 1 1 44 44 GLU N N 15 120.300 0.3 . 1 . . . . 44 E N . 16124 1 487 . 1 1 45 45 SER H H 1 8.561 0.02 . 1 . . . . 45 S HN . 16124 1 488 . 1 1 45 45 SER HA H 1 4.726 0.02 . 1 . . . . 45 S HA . 16124 1 489 . 1 1 45 45 SER HB2 H 1 4.096 0.02 . 2 . . . . 45 S HB1 . 16124 1 490 . 1 1 45 45 SER HB3 H 1 4.489 0.02 . 2 . . . . 45 S HB2 . 16124 1 491 . 1 1 45 45 SER C C 13 175.124 0.3 . 1 . . . . 45 S C . 16124 1 492 . 1 1 45 45 SER CA C 13 56.720 0.3 . 1 . . . . 45 S CA . 16124 1 493 . 1 1 45 45 SER CB C 13 65.640 0.3 . 1 . . . . 45 S CB . 16124 1 494 . 1 1 45 45 SER N N 15 117.700 0.3 . 1 . . . . 45 S N . 16124 1 495 . 1 1 46 46 ALA H H 1 9.154 0.02 . 1 . . . . 46 A HN . 16124 1 496 . 1 1 46 46 ALA HA H 1 4.029 0.02 . 1 . . . . 46 A HA . 16124 1 497 . 1 1 46 46 ALA HB1 H 1 1.565 0.02 . 1 . . . . 46 A HB1 . 16124 1 498 . 1 1 46 46 ALA HB2 H 1 1.565 0.02 . 1 . . . . 46 A HB1 . 16124 1 499 . 1 1 46 46 ALA HB3 H 1 1.565 0.02 . 1 . . . . 46 A HB1 . 16124 1 500 . 1 1 46 46 ALA C C 13 178.483 0.3 . 1 . . . . 46 A C . 16124 1 501 . 1 1 46 46 ALA CA C 13 56.150 0.3 . 1 . . . . 46 A CA . 16124 1 502 . 1 1 46 46 ALA CB C 13 17.630 0.3 . 1 . . . . 46 A CB . 16124 1 503 . 1 1 46 46 ALA N N 15 123.320 0.3 . 1 . . . . 46 A N . 16124 1 504 . 1 1 47 47 GLU H H 1 8.605 0.02 . 1 . . . . 47 E HN . 16124 1 505 . 1 1 47 47 GLU HA H 1 3.296 0.02 . 1 . . . . 47 E HA . 16124 1 506 . 1 1 47 47 GLU HB2 H 1 1.871 0.02 . 2 . . . . 47 E HB1 . 16124 1 507 . 1 1 47 47 GLU HB3 H 1 2.187 0.02 . 2 . . . . 47 E HB2 . 16124 1 508 . 1 1 47 47 GLU HG2 H 1 1.973 0.02 . 2 . . . . 47 E HG1 . 16124 1 509 . 1 1 47 47 GLU HG3 H 1 2.225 0.02 . 2 . . . . 47 E HG2 . 16124 1 510 . 1 1 47 47 GLU C C 13 177.559 0.3 . 1 . . . . 47 E C . 16124 1 511 . 1 1 47 47 GLU CA C 13 60.290 0.3 . 1 . . . . 47 E CA . 16124 1 512 . 1 1 47 47 GLU CB C 13 30.080 0.3 . 1 . . . . 47 E CB . 16124 1 513 . 1 1 47 47 GLU CG C 13 37.611 0.3 . 1 . . . . 47 E CG . 16124 1 514 . 1 1 47 47 GLU N N 15 116.800 0.3 . 1 . . . . 47 E N . 16124 1 515 . 1 1 48 48 GLN H H 1 7.787 0.02 . 1 . . . . 48 Q HN . 16124 1 516 . 1 1 48 48 GLN HA H 1 4.091 0.02 . 1 . . . . 48 Q HA . 16124 1 517 . 1 1 48 48 GLN HB2 H 1 2.147 0.02 . 2 . . . . 48 Q HB1 . 16124 1 518 . 1 1 48 48 GLN HB3 H 1 2.388 0.02 . 2 . . . . 48 Q HB2 . 16124 1 519 . 1 1 48 48 GLN HE21 H 1 7.566 0.02 . 2 . . . . 48 Q HE21 . 16124 1 520 . 1 1 48 48 GLN HE22 H 1 6.910 0.02 . 2 . . . . 48 Q HE22 . 16124 1 521 . 1 1 48 48 GLN HG2 H 1 2.530 0.02 . 2 . . . . 48 Q HG2 . 16124 1 522 . 1 1 48 48 GLN C C 13 179.729 0.3 . 1 . . . . 48 Q C . 16124 1 523 . 1 1 48 48 GLN CA C 13 59.320 0.3 . 1 . . . . 48 Q CA . 16124 1 524 . 1 1 48 48 GLN CB C 13 28.540 0.3 . 1 . . . . 48 Q CB . 16124 1 525 . 1 1 48 48 GLN CD C 13 180.237 0.3 . 1 . . . . 48 Q CD . 16124 1 526 . 1 1 48 48 GLN CG C 13 34.376 0.3 . 1 . . . . 48 Q CG . 16124 1 527 . 1 1 48 48 GLN N N 15 118.100 0.3 . 1 . . . . 48 Q N . 16124 1 528 . 1 1 48 48 GLN NE2 N 15 111.500 0.3 . 1 . . . . 48 Q NE2 . 16124 1 529 . 1 1 49 49 ALA H H 1 8.398 0.02 . 1 . . . . 49 A HN . 16124 1 530 . 1 1 49 49 ALA HA H 1 4.113 0.02 . 1 . . . . 49 A HA . 16124 1 531 . 1 1 49 49 ALA HB1 H 1 1.554 0.02 . 1 . . . . 49 A HB1 . 16124 1 532 . 1 1 49 49 ALA HB2 H 1 1.554 0.02 . 1 . . . . 49 A HB1 . 16124 1 533 . 1 1 49 49 ALA HB3 H 1 1.554 0.02 . 1 . . . . 49 A HB1 . 16124 1 534 . 1 1 49 49 ALA C C 13 175.892 0.3 . 1 . . . . 49 A C . 16124 1 535 . 1 1 49 49 ALA CA C 13 55.330 0.3 . 1 . . . . 49 A CA . 16124 1 536 . 1 1 49 49 ALA CB C 13 20.270 0.3 . 1 . . . . 49 A CB . 16124 1 537 . 1 1 49 49 ALA N N 15 122.880 0.3 . 1 . . . . 49 A N . 16124 1 538 . 1 1 50 50 MET H H 1 8.212 0.02 . 1 . . . . 50 M HN . 16124 1 539 . 1 1 50 50 MET HA H 1 3.394 0.02 . 1 . . . . 50 M HA . 16124 1 540 . 1 1 50 50 MET HB2 H 1 1.247 0.02 . 2 . . . . 50 M HB1 . 16124 1 541 . 1 1 50 50 MET HB3 H 1 1.623 0.02 . 2 . . . . 50 M HB2 . 16124 1 542 . 1 1 50 50 MET HE1 H 1 0.547 0.02 . 1 . . . . 50 M HE1 . 16124 1 543 . 1 1 50 50 MET HE2 H 1 0.547 0.02 . 1 . . . . 50 M HE1 . 16124 1 544 . 1 1 50 50 MET HE3 H 1 0.547 0.02 . 1 . . . . 50 M HE1 . 16124 1 545 . 1 1 50 50 MET HG2 H 1 1.545 0.02 . 2 . . . . 50 M HG1 . 16124 1 546 . 1 1 50 50 MET HG3 H 1 1.638 0.02 . 2 . . . . 50 M HG2 . 16124 1 547 . 1 1 50 50 MET C C 13 177.594 0.3 . 1 . . . . 50 M C . 16124 1 548 . 1 1 50 50 MET CA C 13 60.310 0.3 . 1 . . . . 50 M CA . 16124 1 549 . 1 1 50 50 MET CB C 13 28.300 0.3 . 1 . . . . 50 M CB . 16124 1 550 . 1 1 50 50 MET CE C 13 14.958 0.3 . 1 . . . . 50 M CE . 16124 1 551 . 1 1 50 50 MET CG C 13 31.041 0.3 . 1 . . . . 50 M CG . 16124 1 552 . 1 1 50 50 MET N N 15 119.120 0.3 . 1 . . . . 50 M N . 16124 1 553 . 1 1 51 51 TYR H H 1 8.015 0.02 . 1 . . . . 51 Y HN . 16124 1 554 . 1 1 51 51 TYR HA H 1 4.129 0.02 . 1 . . . . 51 Y HA . 16124 1 555 . 1 1 51 51 TYR HB2 H 1 2.724 0.02 . 2 . . . . 51 Y HB1 . 16124 1 556 . 1 1 51 51 TYR HB3 H 1 2.980 0.02 . 2 . . . . 51 Y HB2 . 16124 1 557 . 1 1 51 51 TYR HD1 H 1 7.081 0.02 . 3 . . . . 51 Y HD1 . 16124 1 558 . 1 1 51 51 TYR HE1 H 1 6.508 0.02 . 3 . . . . 51 Y HE1 . 16124 1 559 . 1 1 51 51 TYR C C 13 179.799 0.3 . 1 . . . . 51 Y C . 16124 1 560 . 1 1 51 51 TYR CA C 13 62.820 0.3 . 1 . . . . 51 Y CA . 16124 1 561 . 1 1 51 51 TYR CB C 13 37.760 0.3 . 1 . . . . 51 Y CB . 16124 1 562 . 1 1 51 51 TYR CD1 C 13 133.470 0.3 . 3 . . . . 51 Y CD1 . 16124 1 563 . 1 1 51 51 TYR CE1 C 13 117.612 0.3 . 3 . . . . 51 Y CE1 . 16124 1 564 . 1 1 51 51 TYR N N 15 117.200 0.3 . 1 . . . . 51 Y N . 16124 1 565 . 1 1 52 52 ARG H H 1 8.181 0.02 . 1 . . . . 52 R HN . 16124 1 566 . 1 1 52 52 ARG HA H 1 4.298 0.02 . 1 . . . . 52 R HA . 16124 1 567 . 1 1 52 52 ARG HB2 H 1 2.076 0.02 . 2 . . . . 52 R HB1 . 16124 1 568 . 1 1 52 52 ARG HB3 H 1 1.798 0.02 . 2 . . . . 52 R HB2 . 16124 1 569 . 1 1 52 52 ARG HD2 H 1 3.450 0.02 . 2 . . . . 52 R HD1 . 16124 1 570 . 1 1 52 52 ARG HD3 H 1 3.043 0.02 . 2 . . . . 52 R HD2 . 16124 1 571 . 1 1 52 52 ARG HE H 1 9.726 0.02 . 1 . . . . 52 R HE . 16124 1 572 . 1 1 52 52 ARG HG2 H 1 1.634 0.02 . 2 . . . . 52 R HG1 . 16124 1 573 . 1 1 52 52 ARG HG3 H 1 1.815 0.02 . 2 . . . . 52 R HG2 . 16124 1 574 . 1 1 52 52 ARG C C 13 178.288 0.3 . 1 . . . . 52 R C . 16124 1 575 . 1 1 52 52 ARG CA C 13 60.280 0.3 . 1 . . . . 52 R CA . 16124 1 576 . 1 1 52 52 ARG CB C 13 29.080 0.3 . 1 . . . . 52 R CB . 16124 1 577 . 1 1 52 52 ARG CD C 13 42.074 0.3 . 1 . . . . 52 R CD . 16124 1 578 . 1 1 52 52 ARG CG C 13 25.610 0.3 . 1 . . . . 52 R CG . 16124 1 579 . 1 1 52 52 ARG N N 15 123.330 0.3 . 1 . . . . 52 R N . 16124 1 580 . 1 1 52 52 ARG NE N 15 106.900 0.3 . 1 . . . . 52 R NE . 16124 1 581 . 1 1 53 53 GLU H H 1 8.621 0.02 . 1 . . . . 53 E HN . 16124 1 582 . 1 1 53 53 GLU HA H 1 4.190 0.02 . 1 . . . . 53 E HA . 16124 1 583 . 1 1 53 53 GLU HB2 H 1 1.809 0.02 . 2 . . . . 53 E HB2 . 16124 1 584 . 1 1 53 53 GLU HG2 H 1 2.033 0.02 . 2 . . . . 53 E HG1 . 16124 1 585 . 1 1 53 53 GLU C C 13 178.164 0.3 . 1 . . . . 53 E C . 16124 1 586 . 1 1 53 53 GLU CA C 13 58.460 0.3 . 1 . . . . 53 E CA . 16124 1 587 . 1 1 53 53 GLU CB C 13 27.410 0.3 . 1 . . . . 53 E CB . 16124 1 588 . 1 1 53 53 GLU CG C 13 32.477 0.3 . 1 . . . . 53 E CG . 16124 1 589 . 1 1 53 53 GLU N N 15 119.680 0.3 . 1 . . . . 53 E N . 16124 1 590 . 1 1 54 54 LEU H H 1 8.974 0.02 . 1 . . . . 54 L HN . 16124 1 591 . 1 1 54 54 LEU HA H 1 3.707 0.02 . 1 . . . . 54 L HA . 16124 1 592 . 1 1 54 54 LEU HB2 H 1 1.569 0.02 . 2 . . . . 54 L HB1 . 16124 1 593 . 1 1 54 54 LEU HB3 H 1 2.014 0.02 . 2 . . . . 54 L HB2 . 16124 1 594 . 1 1 54 54 LEU HD11 H 1 0.745 0.02 . 2 . . . . 54 L HD11 . 16124 1 595 . 1 1 54 54 LEU HD12 H 1 0.745 0.02 . 2 . . . . 54 L HD11 . 16124 1 596 . 1 1 54 54 LEU HD13 H 1 0.745 0.02 . 2 . . . . 54 L HD11 . 16124 1 597 . 1 1 54 54 LEU HD21 H 1 0.714 0.02 . 2 . . . . 54 L HD21 . 16124 1 598 . 1 1 54 54 LEU HD22 H 1 0.714 0.02 . 2 . . . . 54 L HD21 . 16124 1 599 . 1 1 54 54 LEU HD23 H 1 0.714 0.02 . 2 . . . . 54 L HD21 . 16124 1 600 . 1 1 54 54 LEU HG H 1 1.632 0.02 . 1 . . . . 54 L HG . 16124 1 601 . 1 1 54 54 LEU C C 13 178.999 0.3 . 1 . . . . 54 L C . 16124 1 602 . 1 1 54 54 LEU CA C 13 58.190 0.3 . 1 . . . . 54 L CA . 16124 1 603 . 1 1 54 54 LEU CB C 13 42.680 0.3 . 1 . . . . 54 L CB . 16124 1 604 . 1 1 54 54 LEU CD1 C 13 26.414 0.3 . 1 . . . . 54 L CD1 . 16124 1 605 . 1 1 54 54 LEU CD2 C 13 24.529 0.3 . 1 . . . . 54 L CD2 . 16124 1 606 . 1 1 54 54 LEU CG C 13 25.858 0.3 . 1 . . . . 54 L CG . 16124 1 607 . 1 1 54 54 LEU N N 15 120.291 0.3 . 1 . . . . 54 L N . 16124 1 608 . 1 1 55 55 PHE H H 1 7.769 0.02 . 1 . . . . 55 F HN . 16124 1 609 . 1 1 55 55 PHE HA H 1 4.382 0.02 . 1 . . . . 55 F HA . 16124 1 610 . 1 1 55 55 PHE HB2 H 1 3.148 0.02 . 2 . . . . 55 F HB1 . 16124 1 611 . 1 1 55 55 PHE HB3 H 1 3.433 0.02 . 2 . . . . 55 F HB2 . 16124 1 612 . 1 1 55 55 PHE HD1 H 1 7.074 0.02 . 3 . . . . 55 F HD1 . 16124 1 613 . 1 1 55 55 PHE HE1 H 1 7.290 0.02 . 3 . . . . 55 F HE1 . 16124 1 614 . 1 1 55 55 PHE C C 13 178.239 0.3 . 1 . . . . 55 F C . 16124 1 615 . 1 1 55 55 PHE CA C 13 62.245 0.3 . 1 . . . . 55 F CA . 16124 1 616 . 1 1 55 55 PHE CB C 13 39.310 0.3 . 1 . . . . 55 F CB . 16124 1 617 . 1 1 55 55 PHE CD1 C 13 131.649 0.3 . 3 . . . . 55 F CD1 . 16124 1 618 . 1 1 55 55 PHE N N 15 119.010 0.3 . 1 . . . . 55 F N . 16124 1 619 . 1 1 56 56 GLU H H 1 8.715 0.02 . 1 . . . . 56 E HN . 16124 1 620 . 1 1 56 56 GLU HA H 1 3.767 0.02 . 1 . . . . 56 E HA . 16124 1 621 . 1 1 56 56 GLU HB2 H 1 2.020 0.02 . 2 . . . . 56 E HB1 . 16124 1 622 . 1 1 56 56 GLU HB3 H 1 2.104 0.02 . 2 . . . . 56 E HB2 . 16124 1 623 . 1 1 56 56 GLU HG2 H 1 2.430 0.02 . 2 . . . . 56 E HG1 . 16124 1 624 . 1 1 56 56 GLU HG3 H 1 2.682 0.02 . 2 . . . . 56 E HG2 . 16124 1 625 . 1 1 56 56 GLU C C 13 178.417 0.3 . 1 . . . . 56 E C . 16124 1 626 . 1 1 56 56 GLU CA C 13 59.580 0.3 . 1 . . . . 56 E CA . 16124 1 627 . 1 1 56 56 GLU CB C 13 30.120 0.3 . 1 . . . . 56 E CB . 16124 1 628 . 1 1 56 56 GLU CG C 13 36.476 0.3 . 1 . . . . 56 E CG . 16124 1 629 . 1 1 56 56 GLU N N 15 117.170 0.3 . 1 . . . . 56 E N . 16124 1 630 . 1 1 57 57 GLU H H 1 8.702 0.02 . 1 . . . . 57 E HN . 16124 1 631 . 1 1 57 57 GLU HA H 1 4.694 0.02 . 1 . . . . 57 E HA . 16124 1 632 . 1 1 57 57 GLU HB2 H 1 2.200 0.02 . 2 . . . . 57 E HB1 . 16124 1 633 . 1 1 57 57 GLU HB3 H 1 2.273 0.02 . 2 . . . . 57 E HB2 . 16124 1 634 . 1 1 57 57 GLU HG2 H 1 2.897 0.02 . 2 . . . . 57 E HG1 . 16124 1 635 . 1 1 57 57 GLU HG3 H 1 2.328 0.02 . 2 . . . . 57 E HG2 . 16124 1 636 . 1 1 57 57 GLU C C 13 177.369 0.3 . 1 . . . . 57 E C . 16124 1 637 . 1 1 57 57 GLU CA C 13 57.200 0.3 . 1 . . . . 57 E CA . 16124 1 638 . 1 1 57 57 GLU CB C 13 29.835 0.3 . 1 . . . . 57 E CB . 16124 1 639 . 1 1 57 57 GLU CG C 13 34.080 0.3 . 1 . . . . 57 E CG . 16124 1 640 . 1 1 57 57 GLU N N 15 111.570 0.3 . 1 . . . . 57 E N . 16124 1 641 . 1 1 58 58 VAL H H 1 7.269 0.02 . 1 . . . . 58 V HN . 16124 1 642 . 1 1 58 58 VAL HA H 1 4.436 0.02 . 1 . . . . 58 V HA . 16124 1 643 . 1 1 58 58 VAL HB H 1 2.294 0.02 . 1 . . . . 58 V HB . 16124 1 644 . 1 1 58 58 VAL HG11 H 1 0.784 0.02 . 2 . . . . 58 V HG11 . 16124 1 645 . 1 1 58 58 VAL HG12 H 1 0.784 0.02 . 2 . . . . 58 V HG11 . 16124 1 646 . 1 1 58 58 VAL HG13 H 1 0.784 0.02 . 2 . . . . 58 V HG11 . 16124 1 647 . 1 1 58 58 VAL HG21 H 1 0.821 0.02 . 2 . . . . 58 V HG21 . 16124 1 648 . 1 1 58 58 VAL HG22 H 1 0.821 0.02 . 2 . . . . 58 V HG21 . 16124 1 649 . 1 1 58 58 VAL HG23 H 1 0.821 0.02 . 2 . . . . 58 V HG21 . 16124 1 650 . 1 1 58 58 VAL C C 13 174.952 0.3 . 1 . . . . 58 V C . 16124 1 651 . 1 1 58 58 VAL CA C 13 60.640 0.3 . 1 . . . . 58 V CA . 16124 1 652 . 1 1 58 58 VAL CB C 13 33.550 0.3 . 1 . . . . 58 V CB . 16124 1 653 . 1 1 58 58 VAL CG1 C 13 21.501 0.3 . 1 . . . . 58 V CG1 . 16124 1 654 . 1 1 58 58 VAL CG2 C 13 23.619 0.3 . 1 . . . . 58 V CG2 . 16124 1 655 . 1 1 58 58 VAL N N 15 112.110 0.3 . 1 . . . . 58 V N . 16124 1 656 . 1 1 59 59 GLY H H 1 7.531 0.02 . 1 . . . . 59 G HN . 16124 1 657 . 1 1 59 59 GLY HA2 H 1 3.591 0.02 . 2 . . . . 59 G HA1 . 16124 1 658 . 1 1 59 59 GLY HA3 H 1 4.087 0.02 . 2 . . . . 59 G HA2 . 16124 1 659 . 1 1 59 59 GLY C C 13 173.868 0.3 . 1 . . . . 59 G C . 16124 1 660 . 1 1 59 59 GLY CA C 13 46.830 0.3 . 1 . . . . 59 G CA . 16124 1 661 . 1 1 59 59 GLY N N 15 108.740 0.3 . 1 . . . . 59 G N . 16124 1 662 . 1 1 60 60 LEU H H 1 6.690 0.02 . 1 . . . . 60 L HN . 16124 1 663 . 1 1 60 60 LEU HA H 1 4.678 0.02 . 1 . . . . 60 L HA . 16124 1 664 . 1 1 60 60 LEU HB2 H 1 1.352 0.02 . 2 . . . . 60 L HB1 . 16124 1 665 . 1 1 60 60 LEU HB3 H 1 1.434 0.02 . 2 . . . . 60 L HB2 . 16124 1 666 . 1 1 60 60 LEU HD11 H 1 0.592 0.02 . 2 . . . . 60 L HD11 . 16124 1 667 . 1 1 60 60 LEU HD12 H 1 0.592 0.02 . 2 . . . . 60 L HD11 . 16124 1 668 . 1 1 60 60 LEU HD13 H 1 0.592 0.02 . 2 . . . . 60 L HD11 . 16124 1 669 . 1 1 60 60 LEU HD21 H 1 0.620 0.02 . 2 . . . . 60 L HD21 . 16124 1 670 . 1 1 60 60 LEU HD22 H 1 0.620 0.02 . 2 . . . . 60 L HD21 . 16124 1 671 . 1 1 60 60 LEU HD23 H 1 0.620 0.02 . 2 . . . . 60 L HD21 . 16124 1 672 . 1 1 60 60 LEU HG H 1 1.475 0.02 . 1 . . . . 60 L HG . 16124 1 673 . 1 1 60 60 LEU C C 13 175.627 0.3 . 1 . . . . 60 L C . 16124 1 674 . 1 1 60 60 LEU CA C 13 53.740 0.3 . 1 . . . . 60 L CA . 16124 1 675 . 1 1 60 60 LEU CB C 13 43.920 0.3 . 1 . . . . 60 L CB . 16124 1 676 . 1 1 60 60 LEU CD1 C 13 26.415 0.3 . 1 . . . . 60 L CD1 . 16124 1 677 . 1 1 60 60 LEU CD2 C 13 22.047 0.3 . 1 . . . . 60 L CD2 . 16124 1 678 . 1 1 60 60 LEU CG C 13 26.149 0.3 . 1 . . . . 60 L CG . 16124 1 679 . 1 1 60 60 LEU N N 15 118.280 0.3 . 1 . . . . 60 L N . 16124 1 680 . 1 1 61 61 SER H H 1 9.464 0.02 . 1 . . . . 61 S HN . 16124 1 681 . 1 1 61 61 SER HA H 1 4.815 0.02 . 1 . . . . 61 S HA . 16124 1 682 . 1 1 61 61 SER HB2 H 1 3.929 0.02 . 2 . . . . 61 S HB1 . 16124 1 683 . 1 1 61 61 SER HB3 H 1 4.013 0.02 . 2 . . . . 61 S HB2 . 16124 1 684 . 1 1 61 61 SER C C 13 174.952 0.3 . 1 . . . . 61 S C . 16124 1 685 . 1 1 61 61 SER CA C 13 57.380 0.3 . 1 . . . . 61 S CA . 16124 1 686 . 1 1 61 61 SER CB C 13 66.230 0.3 . 1 . . . . 61 S CB . 16124 1 687 . 1 1 61 61 SER N N 15 117.447 0.3 . 1 . . . . 61 S N . 16124 1 688 . 1 1 62 62 ARG H H 1 8.322 0.02 . 1 . . . . 62 R HN . 16124 1 689 . 1 1 62 62 ARG HA H 1 3.834 0.02 . 1 . . . . 62 R HA . 16124 1 690 . 1 1 62 62 ARG HB2 H 1 1.416 0.02 . 2 . . . . 62 R HB1 . 16124 1 691 . 1 1 62 62 ARG HB3 H 1 1.462 0.02 . 2 . . . . 62 R HB2 . 16124 1 692 . 1 1 62 62 ARG HD2 H 1 2.735 0.02 . 2 . . . . 62 R HD2 . 16124 1 693 . 1 1 62 62 ARG HE H 1 6.838 0.02 . 1 . . . . 62 R HE . 16124 1 694 . 1 1 62 62 ARG HG2 H 1 0.893 0.02 . 2 . . . . 62 R HG1 . 16124 1 695 . 1 1 62 62 ARG HG3 H 1 1.251 0.02 . 2 . . . . 62 R HG2 . 16124 1 696 . 1 1 62 62 ARG C C 13 178.062 0.3 . 1 . . . . 62 R C . 16124 1 697 . 1 1 62 62 ARG CA C 13 60.060 0.3 . 1 . . . . 62 R CA . 16124 1 698 . 1 1 62 62 ARG CB C 13 29.830 0.3 . 1 . . . . 62 R CB . 16124 1 699 . 1 1 62 62 ARG CD C 13 43.169 0.3 . 1 . . . . 62 R CD . 16124 1 700 . 1 1 62 62 ARG CG C 13 27.094 0.3 . 1 . . . . 62 R CG . 16124 1 701 . 1 1 62 62 ARG N N 15 120.740 0.3 . 1 . . . . 62 R N . 16124 1 702 . 1 1 62 62 ARG NE N 15 110.552 0.3 . 1 . . . . 62 R NE . 16124 1 703 . 1 1 63 63 LYS H H 1 7.826 0.02 . 1 . . . . 63 K HN . 16124 1 704 . 1 1 63 63 LYS HA H 1 4.235 0.02 . 1 . . . . 63 K HA . 16124 1 705 . 1 1 63 63 LYS HB2 H 1 1.799 0.02 . 2 . . . . 63 K HB1 . 16124 1 706 . 1 1 63 63 LYS HB3 H 1 1.833 0.02 . 2 . . . . 63 K HB2 . 16124 1 707 . 1 1 63 63 LYS HD2 H 1 1.633 0.02 . 2 . . . . 63 K HD1 . 16124 1 708 . 1 1 63 63 LYS HD3 H 1 1.571 0.02 . 2 . . . . 63 K HD2 . 16124 1 709 . 1 1 63 63 LYS HE2 H 1 3.011 0.02 . 2 . . . . 63 K HE2 . 16124 1 710 . 1 1 63 63 LYS HG2 H 1 1.272 0.02 . 2 . . . . 63 K HG1 . 16124 1 711 . 1 1 63 63 LYS HG3 H 1 1.300 0.02 . 2 . . . . 63 K HG2 . 16124 1 712 . 1 1 63 63 LYS C C 13 177.226 0.3 . 1 . . . . 63 K C . 16124 1 713 . 1 1 63 63 LYS CA C 13 57.460 0.3 . 1 . . . . 63 K CA . 16124 1 714 . 1 1 63 63 LYS CB C 13 31.430 0.3 . 1 . . . . 63 K CB . 16124 1 715 . 1 1 63 63 LYS CD C 13 29.309 0.3 . 1 . . . . 63 K CD . 16124 1 716 . 1 1 63 63 LYS CE C 13 42.358 0.3 . 1 . . . . 63 K CE . 16124 1 717 . 1 1 63 63 LYS CG C 13 23.998 0.3 . 1 . . . . 63 K CG . 16124 1 718 . 1 1 63 63 LYS N N 15 112.570 0.3 . 1 . . . . 63 K N . 16124 1 719 . 1 1 64 64 ASP H H 1 7.908 0.02 . 1 . . . . 64 D HN . 16124 1 720 . 1 1 64 64 ASP HA H 1 4.730 0.02 . 1 . . . . 64 D HA . 16124 1 721 . 1 1 64 64 ASP HB2 H 1 2.931 0.02 . 2 . . . . 64 D HB2 . 16124 1 722 . 1 1 64 64 ASP C C 13 176.053 0.3 . 1 . . . . 64 D C . 16124 1 723 . 1 1 64 64 ASP CA C 13 56.270 0.3 . 1 . . . . 64 D CA . 16124 1 724 . 1 1 64 64 ASP CB C 13 44.446 0.3 . 1 . . . . 64 D CB . 16124 1 725 . 1 1 64 64 ASP N N 15 117.090 0.3 . 1 . . . . 64 D N . 16124 1 726 . 1 1 65 65 VAL H H 1 7.472 0.02 . 1 . . . . 65 V HN . 16124 1 727 . 1 1 65 65 VAL HA H 1 5.753 0.02 . 1 . . . . 65 V HA . 16124 1 728 . 1 1 65 65 VAL HB H 1 1.998 0.02 . 1 . . . . 65 V HB . 16124 1 729 . 1 1 65 65 VAL HG11 H 1 0.886 0.02 . 2 . . . . 65 V HG11 . 16124 1 730 . 1 1 65 65 VAL HG12 H 1 0.886 0.02 . 2 . . . . 65 V HG11 . 16124 1 731 . 1 1 65 65 VAL HG13 H 1 0.886 0.02 . 2 . . . . 65 V HG11 . 16124 1 732 . 1 1 65 65 VAL HG21 H 1 0.842 0.02 . 2 . . . . 65 V HG21 . 16124 1 733 . 1 1 65 65 VAL HG22 H 1 0.842 0.02 . 2 . . . . 65 V HG21 . 16124 1 734 . 1 1 65 65 VAL HG23 H 1 0.842 0.02 . 2 . . . . 65 V HG21 . 16124 1 735 . 1 1 65 65 VAL C C 13 174.312 0.3 . 1 . . . . 65 V C . 16124 1 736 . 1 1 65 65 VAL CA C 13 58.260 0.3 . 1 . . . . 65 V CA . 16124 1 737 . 1 1 65 65 VAL CB C 13 37.800 0.3 . 1 . . . . 65 V CB . 16124 1 738 . 1 1 65 65 VAL CG1 C 13 17.084 0.3 . 1 . . . . 65 V CG1 . 16124 1 739 . 1 1 65 65 VAL CG2 C 13 21.865 0.3 . 1 . . . . 65 V CG2 . 16124 1 740 . 1 1 65 65 VAL N N 15 108.530 0.3 . 1 . . . . 65 V N . 16124 1 741 . 1 1 66 66 ARG H H 1 8.447 0.02 . 1 . . . . 66 R HN . 16124 1 742 . 1 1 66 66 ARG HA H 1 4.825 0.02 . 1 . . . . 66 R HA . 16124 1 743 . 1 1 66 66 ARG HB2 H 1 1.666 0.02 . 2 . . . . 66 R HB1 . 16124 1 744 . 1 1 66 66 ARG HB3 H 1 1.719 0.02 . 2 . . . . 66 R HB2 . 16124 1 745 . 1 1 66 66 ARG HD2 H 1 3.164 0.02 . 2 . . . . 66 R HD2 . 16124 1 746 . 1 1 66 66 ARG HE H 1 7.062 0.02 . 1 . . . . 66 R HE . 16124 1 747 . 1 1 66 66 ARG HG2 H 1 1.464 0.02 . 2 . . . . 66 R HG1 . 16124 1 748 . 1 1 66 66 ARG HG3 H 1 1.548 0.02 . 2 . . . . 66 R HG2 . 16124 1 749 . 1 1 66 66 ARG HH21 H 1 6.662 0.02 . 1 . . . . 66 R HH21 . 16124 1 750 . 1 1 66 66 ARG C C 13 175.822 0.3 . 1 . . . . 66 R C . 16124 1 751 . 1 1 66 66 ARG CA C 13 54.220 0.3 . 1 . . . . 66 R CA . 16124 1 752 . 1 1 66 66 ARG CB C 13 33.850 0.3 . 1 . . . . 66 R CB . 16124 1 753 . 1 1 66 66 ARG CD C 13 43.640 0.3 . 1 . . . . 66 R CD . 16124 1 754 . 1 1 66 66 ARG CG C 13 27.308 0.3 . 1 . . . . 66 R CG . 16124 1 755 . 1 1 66 66 ARG N N 15 117.790 0.3 . 1 . . . . 66 R N . 16124 1 756 . 1 1 66 66 ARG NE N 15 110.338 0.3 . 1 . . . . 66 R NE . 16124 1 757 . 1 1 67 67 ILE H H 1 9.091 0.02 . 1 . . . . 67 I HN . 16124 1 758 . 1 1 67 67 ILE HA H 1 4.109 0.02 . 1 . . . . 67 I HA . 16124 1 759 . 1 1 67 67 ILE HB H 1 1.851 0.02 . 1 . . . . 67 I HB . 16124 1 760 . 1 1 67 67 ILE HD11 H 1 0.801 0.02 . 1 . . . . 67 I HD11 . 16124 1 761 . 1 1 67 67 ILE HD12 H 1 0.801 0.02 . 1 . . . . 67 I HD11 . 16124 1 762 . 1 1 67 67 ILE HD13 H 1 0.801 0.02 . 1 . . . . 67 I HD11 . 16124 1 763 . 1 1 67 67 ILE HG12 H 1 0.689 0.02 . 1 . . . . 67 I HG11 . 16124 1 764 . 1 1 67 67 ILE HG13 H 1 1.657 0.02 . 1 . . . . 67 I HG12 . 16124 1 765 . 1 1 67 67 ILE HG21 H 1 0.951 0.02 . 1 . . . . 67 I HG21 . 16124 1 766 . 1 1 67 67 ILE HG22 H 1 0.951 0.02 . 1 . . . . 67 I HG21 . 16124 1 767 . 1 1 67 67 ILE HG23 H 1 0.951 0.02 . 1 . . . . 67 I HG21 . 16124 1 768 . 1 1 67 67 ILE C C 13 176.373 0.3 . 1 . . . . 67 I C . 16124 1 769 . 1 1 67 67 ILE CA C 13 63.000 0.3 . 1 . . . . 67 I CA . 16124 1 770 . 1 1 67 67 ILE CB C 13 38.070 0.3 . 1 . . . . 67 I CB . 16124 1 771 . 1 1 67 67 ILE CD1 C 13 13.894 0.3 . 1 . . . . 67 I CD1 . 16124 1 772 . 1 1 67 67 ILE CG1 C 13 27.667 0.3 . 1 . . . . 67 I CG1 . 16124 1 773 . 1 1 67 67 ILE CG2 C 13 17.612 0.3 . 1 . . . . 67 I CG2 . 16124 1 774 . 1 1 67 67 ILE N N 15 124.450 0.3 . 1 . . . . 67 I N . 16124 1 775 . 1 1 68 68 LEU H H 1 9.333 0.02 . 1 . . . . 68 L HN . 16124 1 776 . 1 1 68 68 LEU HA H 1 4.456 0.02 . 1 . . . . 68 L HA . 16124 1 777 . 1 1 68 68 LEU HB2 H 1 1.280 0.02 . 2 . . . . 68 L HB1 . 16124 1 778 . 1 1 68 68 LEU HB3 H 1 1.393 0.02 . 2 . . . . 68 L HB2 . 16124 1 779 . 1 1 68 68 LEU HD11 H 1 0.979 0.02 . 2 . . . . 68 L HD11 . 16124 1 780 . 1 1 68 68 LEU HD12 H 1 0.979 0.02 . 2 . . . . 68 L HD11 . 16124 1 781 . 1 1 68 68 LEU HD13 H 1 0.979 0.02 . 2 . . . . 68 L HD11 . 16124 1 782 . 1 1 68 68 LEU HD21 H 1 0.731 0.02 . 2 . . . . 68 L HD21 . 16124 1 783 . 1 1 68 68 LEU HD22 H 1 0.731 0.02 . 2 . . . . 68 L HD21 . 16124 1 784 . 1 1 68 68 LEU HD23 H 1 0.731 0.02 . 2 . . . . 68 L HD21 . 16124 1 785 . 1 1 68 68 LEU HG H 1 0.645 0.02 . 1 . . . . 68 L HG . 16124 1 786 . 1 1 68 68 LEU C C 13 177.084 0.3 . 1 . . . . 68 L C . 16124 1 787 . 1 1 68 68 LEU CA C 13 55.250 0.3 . 1 . . . . 68 L CA . 16124 1 788 . 1 1 68 68 LEU CB C 13 43.650 0.3 . 1 . . . . 68 L CB . 16124 1 789 . 1 1 68 68 LEU CD1 C 13 24.780 0.3 . 1 . . . . 68 L CD1 . 16124 1 790 . 1 1 68 68 LEU CD2 C 13 21.598 0.3 . 1 . . . . 68 L CD2 . 16124 1 791 . 1 1 68 68 LEU CG C 13 26.115 0.3 . 1 . . . . 68 L CG . 16124 1 792 . 1 1 68 68 LEU N N 15 128.300 0.3 . 1 . . . . 68 L N . 16124 1 793 . 1 1 69 69 ALA H H 1 7.872 0.02 . 1 . . . . 69 A HN . 16124 1 794 . 1 1 69 69 ALA HA H 1 4.610 0.02 . 1 . . . . 69 A HA . 16124 1 795 . 1 1 69 69 ALA HB1 H 1 1.365 0.02 . 1 . . . . 69 A HB1 . 16124 1 796 . 1 1 69 69 ALA HB2 H 1 1.365 0.02 . 1 . . . . 69 A HB1 . 16124 1 797 . 1 1 69 69 ALA HB3 H 1 1.365 0.02 . 1 . . . . 69 A HB1 . 16124 1 798 . 1 1 69 69 ALA C C 13 174.454 0.3 . 1 . . . . 69 A C . 16124 1 799 . 1 1 69 69 ALA CA C 13 51.880 0.3 . 1 . . . . 69 A CA . 16124 1 800 . 1 1 69 69 ALA CB C 13 22.140 0.3 . 1 . . . . 69 A CB . 16124 1 801 . 1 1 69 69 ALA N N 15 117.750 0.3 . 1 . . . . 69 A N . 16124 1 802 . 1 1 70 70 SER H H 1 8.279 0.02 . 1 . . . . 70 S HN . 16124 1 803 . 1 1 70 70 SER HA H 1 5.215 0.02 . 1 . . . . 70 S HA . 16124 1 804 . 1 1 70 70 SER HB2 H 1 3.064 0.02 . 2 . . . . 70 S HB1 . 16124 1 805 . 1 1 70 70 SER HB3 H 1 3.454 0.02 . 2 . . . . 70 S HB2 . 16124 1 806 . 1 1 70 70 SER C C 13 174.703 0.3 . 1 . . . . 70 S C . 16124 1 807 . 1 1 70 70 SER CA C 13 56.930 0.3 . 1 . . . . 70 S CA . 16124 1 808 . 1 1 70 70 SER CB C 13 65.980 0.3 . 1 . . . . 70 S CB . 16124 1 809 . 1 1 70 70 SER N N 15 110.780 0.3 . 1 . . . . 70 S N . 16124 1 810 . 1 1 71 71 THR H H 1 8.678 0.02 . 1 . . . . 71 T HN . 16124 1 811 . 1 1 71 71 THR HA H 1 4.314 0.02 . 1 . . . . 71 T HA . 16124 1 812 . 1 1 71 71 THR HB H 1 4.550 0.02 . 1 . . . . 71 T HB . 16124 1 813 . 1 1 71 71 THR HG21 H 1 1.091 0.02 . 1 . . . . 71 T HG21 . 16124 1 814 . 1 1 71 71 THR HG22 H 1 1.091 0.02 . 1 . . . . 71 T HG21 . 16124 1 815 . 1 1 71 71 THR HG23 H 1 1.091 0.02 . 1 . . . . 71 T HG21 . 16124 1 816 . 1 1 71 71 THR C C 13 175.795 0.3 . 1 . . . . 71 T C . 16124 1 817 . 1 1 71 71 THR CA C 13 60.910 0.3 . 1 . . . . 71 T CA . 16124 1 818 . 1 1 71 71 THR CB C 13 69.940 0.3 . 1 . . . . 71 T CB . 16124 1 819 . 1 1 71 71 THR CG2 C 13 23.307 0.3 . 1 . . . . 71 T CG2 . 16124 1 820 . 1 1 71 71 THR N N 15 112.820 0.3 . 1 . . . . 71 T N . 16124 1 821 . 1 1 72 72 ARG H H 1 9.226 0.02 . 1 . . . . 72 R HN . 16124 1 822 . 1 1 72 72 ARG HA H 1 3.992 0.02 . 1 . . . . 72 R HA . 16124 1 823 . 1 1 72 72 ARG HB2 H 1 1.840 0.02 . 2 . . . . 72 R HB2 . 16124 1 824 . 1 1 72 72 ARG HD2 H 1 3.238 0.02 . 2 . . . . 72 R HD2 . 16124 1 825 . 1 1 72 72 ARG HE H 1 7.015 0.02 . 1 . . . . 72 R HE . 16124 1 826 . 1 1 72 72 ARG HG2 H 1 1.683 0.02 . 2 . . . . 72 R HG1 . 16124 1 827 . 1 1 72 72 ARG HG3 H 1 1.740 0.02 . 2 . . . . 72 R HG2 . 16124 1 828 . 1 1 72 72 ARG C C 13 176.843 0.3 . 1 . . . . 72 R C . 16124 1 829 . 1 1 72 72 ARG CA C 13 58.230 0.3 . 1 . . . . 72 R CA . 16124 1 830 . 1 1 72 72 ARG CB C 13 30.470 0.3 . 1 . . . . 72 R CB . 16124 1 831 . 1 1 72 72 ARG CD C 13 43.375 0.3 . 1 . . . . 72 R CD . 16124 1 832 . 1 1 72 72 ARG CG C 13 27.238 0.3 . 1 . . . . 72 R CG . 16124 1 833 . 1 1 72 72 ARG N N 15 125.350 0.3 . 1 . . . . 72 R N . 16124 1 834 . 1 1 72 72 ARG NE N 15 110.338 0.3 . 1 . . . . 72 R NE . 16124 1 835 . 1 1 73 73 ASN H H 1 8.419 0.02 . 1 . . . . 73 N HN . 16124 1 836 . 1 1 73 73 ASN HA H 1 4.937 0.02 . 1 . . . . 73 N HA . 16124 1 837 . 1 1 73 73 ASN HB2 H 1 2.675 0.02 . 2 . . . . 73 N HB1 . 16124 1 838 . 1 1 73 73 ASN HB3 H 1 2.947 0.02 . 2 . . . . 73 N HB2 . 16124 1 839 . 1 1 73 73 ASN HD21 H 1 7.655 0.02 . 2 . . . . 73 N HD21 . 16124 1 840 . 1 1 73 73 ASN HD22 H 1 7.023 0.02 . 2 . . . . 73 N HD22 . 16124 1 841 . 1 1 73 73 ASN C C 13 174.569 0.3 . 1 . . . . 73 N C . 16124 1 842 . 1 1 73 73 ASN CA C 13 51.350 0.3 . 1 . . . . 73 N CA . 16124 1 843 . 1 1 73 73 ASN CB C 13 40.840 0.3 . 1 . . . . 73 N CB . 16124 1 844 . 1 1 73 73 ASN CG C 13 177.234 0.3 . 1 . . . . 73 N CG . 16124 1 845 . 1 1 73 73 ASN N N 15 115.820 0.3 . 1 . . . . 73 N N . 16124 1 846 . 1 1 73 73 ASN ND2 N 15 113.573 0.3 . 1 . . . . 73 N ND2 . 16124 1 847 . 1 1 74 74 TRP H H 1 8.399 0.02 . 1 . . . . 74 W HN . 16124 1 848 . 1 1 74 74 TRP HA H 1 4.531 0.02 . 1 . . . . 74 W HA . 16124 1 849 . 1 1 74 74 TRP HB2 H 1 2.866 0.02 . 2 . . . . 74 W HB1 . 16124 1 850 . 1 1 74 74 TRP HB3 H 1 2.949 0.02 . 2 . . . . 74 W HB2 . 16124 1 851 . 1 1 74 74 TRP HD1 H 1 7.471 0.02 . 1 . . . . 74 W HD1 . 16124 1 852 . 1 1 74 74 TRP HE1 H 1 10.358 0.02 . 1 . . . . 74 W HE1 . 16124 1 853 . 1 1 74 74 TRP HH2 H 1 7.143 0.02 . 1 . . . . 74 W HH2 . 16124 1 854 . 1 1 74 74 TRP HZ2 H 1 7.604 0.02 . 1 . . . . 74 W HZ2 . 16124 1 855 . 1 1 74 74 TRP C C 13 176.506 0.3 . 1 . . . . 74 W C . 16124 1 856 . 1 1 74 74 TRP CA C 13 57.210 0.3 . 1 . . . . 74 W CA . 16124 1 857 . 1 1 74 74 TRP CB C 13 29.760 0.3 . 1 . . . . 74 W CB . 16124 1 858 . 1 1 74 74 TRP CD1 C 13 128.302 0.3 . 1 . . . . 74 W CD1 . 16124 1 859 . 1 1 74 74 TRP CH2 C 13 124.450 0.3 . 1 . . . . 74 W CH2 . 16124 1 860 . 1 1 74 74 TRP CZ2 C 13 114.953 0.3 . 1 . . . . 74 W CZ2 . 16124 1 861 . 1 1 74 74 TRP N N 15 119.590 0.3 . 1 . . . . 74 W N . 16124 1 862 . 1 1 74 74 TRP NE1 N 15 130.487 0.3 . 1 . . . . 74 W NE1 . 16124 1 863 . 1 1 75 75 LEU H H 1 9.397 0.02 . 1 . . . . 75 L HN . 16124 1 864 . 1 1 75 75 LEU HA H 1 4.709 0.02 . 1 . . . . 75 L HA . 16124 1 865 . 1 1 75 75 LEU HB2 H 1 1.798 0.02 . 2 . . . . 75 L HB1 . 16124 1 866 . 1 1 75 75 LEU HB3 H 1 1.988 0.02 . 2 . . . . 75 L HB2 . 16124 1 867 . 1 1 75 75 LEU HD11 H 1 1.016 0.02 . 2 . . . . 75 L HD11 . 16124 1 868 . 1 1 75 75 LEU HD12 H 1 1.016 0.02 . 2 . . . . 75 L HD11 . 16124 1 869 . 1 1 75 75 LEU HD13 H 1 1.016 0.02 . 2 . . . . 75 L HD11 . 16124 1 870 . 1 1 75 75 LEU HD21 H 1 0.970 0.02 . 2 . . . . 75 L HD21 . 16124 1 871 . 1 1 75 75 LEU HD22 H 1 0.970 0.02 . 2 . . . . 75 L HD21 . 16124 1 872 . 1 1 75 75 LEU HD23 H 1 0.970 0.02 . 2 . . . . 75 L HD21 . 16124 1 873 . 1 1 75 75 LEU HG H 1 1.902 0.02 . 1 . . . . 75 L HG . 16124 1 874 . 1 1 75 75 LEU C C 13 176.772 0.3 . 1 . . . . 75 L C . 16124 1 875 . 1 1 75 75 LEU CA C 13 55.060 0.3 . 1 . . . . 75 L CA . 16124 1 876 . 1 1 75 75 LEU CB C 13 43.380 0.3 . 1 . . . . 75 L CB . 16124 1 877 . 1 1 75 75 LEU CD1 C 13 26.116 0.3 . 1 . . . . 75 L CD1 . 16124 1 878 . 1 1 75 75 LEU CD2 C 13 25.050 0.3 . 1 . . . . 75 L CD2 . 16124 1 879 . 1 1 75 75 LEU CG C 13 28.540 0.3 . 1 . . . . 75 L CG . 16124 1 880 . 1 1 75 75 LEU N N 15 126.030 0.3 . 1 . . . . 75 L N . 16124 1 881 . 1 1 76 76 ARG H H 1 8.738 0.02 . 1 . . . . 76 R HN . 16124 1 882 . 1 1 76 76 ARG HA H 1 5.269 0.02 . 1 . . . . 76 R HA . 16124 1 883 . 1 1 76 76 ARG HB2 H 1 1.462 0.02 . 2 . . . . 76 R HB1 . 16124 1 884 . 1 1 76 76 ARG HB3 H 1 1.608 0.02 . 2 . . . . 76 R HB2 . 16124 1 885 . 1 1 76 76 ARG HD2 H 1 2.272 0.02 . 2 . . . . 76 R HD1 . 16124 1 886 . 1 1 76 76 ARG HD3 H 1 2.704 0.02 . 2 . . . . 76 R HD2 . 16124 1 887 . 1 1 76 76 ARG HG2 H 1 0.930 0.02 . 2 . . . . 76 R HG1 . 16124 1 888 . 1 1 76 76 ARG HG3 H 1 1.397 0.02 . 2 . . . . 76 R HG2 . 16124 1 889 . 1 1 76 76 ARG C C 13 175.599 0.3 . 1 . . . . 76 R C . 16124 1 890 . 1 1 76 76 ARG CA C 13 55.570 0.3 . 1 . . . . 76 R CA . 16124 1 891 . 1 1 76 76 ARG CB C 13 32.890 0.3 . 1 . . . . 76 R CB . 16124 1 892 . 1 1 76 76 ARG CD C 13 42.653 0.3 . 1 . . . . 76 R CD . 16124 1 893 . 1 1 76 76 ARG CG C 13 28.242 0.3 . 1 . . . . 76 R CG . 16124 1 894 . 1 1 76 76 ARG N N 15 122.190 0.3 . 1 . . . . 76 R N . 16124 1 895 . 1 1 77 77 TYR H H 1 8.768 0.02 . 1 . . . . 77 Y HN . 16124 1 896 . 1 1 77 77 TYR HA H 1 5.026 0.02 . 1 . . . . 77 Y HA . 16124 1 897 . 1 1 77 77 TYR HB2 H 1 3.147 0.02 . 2 . . . . 77 Y HB1 . 16124 1 898 . 1 1 77 77 TYR HB3 H 1 3.190 0.02 . 2 . . . . 77 Y HB2 . 16124 1 899 . 1 1 77 77 TYR HD1 H 1 7.053 0.02 . 3 . . . . 77 Y HD1 . 16124 1 900 . 1 1 77 77 TYR HD2 H 1 6.550 0.02 . 3 . . . . 77 Y HD2 . 16124 1 901 . 1 1 77 77 TYR HE1 H 1 6.846 0.02 . 3 . . . . 77 Y HE1 . 16124 1 902 . 1 1 77 77 TYR C C 13 173.911 0.3 . 1 . . . . 77 Y C . 16124 1 903 . 1 1 77 77 TYR CA C 13 56.770 0.3 . 1 . . . . 77 Y CA . 16124 1 904 . 1 1 77 77 TYR CB C 13 40.980 0.3 . 1 . . . . 77 Y CB . 16124 1 905 . 1 1 77 77 TYR CD1 C 13 133.481 0.3 . 3 . . . . 77 Y CD1 . 16124 1 906 . 1 1 77 77 TYR CD2 C 13 118.039 0.3 . 3 . . . . 77 Y CD2 . 16124 1 907 . 1 1 77 77 TYR CE1 C 13 118.040 0.3 . 3 . . . . 77 Y CE1 . 16124 1 908 . 1 1 77 77 TYR N N 15 119.320 0.3 . 1 . . . . 77 Y N . 16124 1 909 . 1 1 78 78 LYS H H 1 8.801 0.02 . 1 . . . . 78 K HN . 16124 1 910 . 1 1 78 78 LYS HA H 1 4.649 0.02 . 1 . . . . 78 K HA . 16124 1 911 . 1 1 78 78 LYS HB2 H 1 1.762 0.02 . 2 . . . . 78 K HB1 . 16124 1 912 . 1 1 78 78 LYS HB3 H 1 1.948 0.02 . 2 . . . . 78 K HB2 . 16124 1 913 . 1 1 78 78 LYS HD2 H 1 1.765 0.02 . 2 . . . . 78 K HD2 . 16124 1 914 . 1 1 78 78 LYS HE2 H 1 3.022 0.02 . 2 . . . . 78 K HE2 . 16124 1 915 . 1 1 78 78 LYS HG2 H 1 1.465 0.02 . 2 . . . . 78 K HG1 . 16124 1 916 . 1 1 78 78 LYS HG3 H 1 1.657 0.02 . 2 . . . . 78 K HG2 . 16124 1 917 . 1 1 78 78 LYS C C 13 176.790 0.3 . 1 . . . . 78 K C . 16124 1 918 . 1 1 78 78 LYS CA C 13 56.130 0.3 . 1 . . . . 78 K CA . 16124 1 919 . 1 1 78 78 LYS CB C 13 33.820 0.3 . 1 . . . . 78 K CB . 16124 1 920 . 1 1 78 78 LYS CD C 13 29.568 0.3 . 1 . . . . 78 K CD . 16124 1 921 . 1 1 78 78 LYS CE C 13 42.143 0.3 . 1 . . . . 78 K CE . 16124 1 922 . 1 1 78 78 LYS CG C 13 25.862 0.3 . 1 . . . . 78 K CG . 16124 1 923 . 1 1 78 78 LYS N N 15 123.830 0.3 . 1 . . . . 78 K N . 16124 1 924 . 1 1 79 79 LEU H H 1 8.199 0.02 . 1 . . . . 79 L HN . 16124 1 925 . 1 1 79 79 LEU HA H 1 4.209 0.02 . 1 . . . . 79 L HA . 16124 1 926 . 1 1 79 79 LEU HB2 H 1 1.163 0.02 . 2 . . . . 79 L HB1 . 16124 1 927 . 1 1 79 79 LEU HB3 H 1 1.231 0.02 . 2 . . . . 79 L HB2 . 16124 1 928 . 1 1 79 79 LEU HD11 H 1 0.713 0.02 . 2 . . . . 79 L HD11 . 16124 1 929 . 1 1 79 79 LEU HD12 H 1 0.713 0.02 . 2 . . . . 79 L HD11 . 16124 1 930 . 1 1 79 79 LEU HD13 H 1 0.713 0.02 . 2 . . . . 79 L HD11 . 16124 1 931 . 1 1 79 79 LEU HD21 H 1 0.874 0.02 . 2 . . . . 79 L HD21 . 16124 1 932 . 1 1 79 79 LEU HD22 H 1 0.874 0.02 . 2 . . . . 79 L HD21 . 16124 1 933 . 1 1 79 79 LEU HD23 H 1 0.874 0.02 . 2 . . . . 79 L HD21 . 16124 1 934 . 1 1 79 79 LEU HG H 1 1.338 0.02 . 1 . . . . 79 L HG . 16124 1 935 . 1 1 79 79 LEU CA C 13 53.200 0.3 . 1 . . . . 79 L CA . 16124 1 936 . 1 1 79 79 LEU CB C 13 41.790 0.3 . 1 . . . . 79 L CB . 16124 1 937 . 1 1 79 79 LEU CD1 C 13 25.382 0.3 . 1 . . . . 79 L CD1 . 16124 1 938 . 1 1 79 79 LEU CD2 C 13 23.459 0.3 . 1 . . . . 79 L CD2 . 16124 1 939 . 1 1 79 79 LEU CG C 13 27.978 0.3 . 1 . . . . 79 L CG . 16124 1 940 . 1 1 79 79 LEU N N 15 124.030 0.3 . 1 . . . . 79 L N . 16124 1 941 . 1 1 80 80 PRO HA H 1 4.447 0.02 . 1 . . . . 80 P HA . 16124 1 942 . 1 1 80 80 PRO HB2 H 1 1.731 0.02 . 2 . . . . 80 P HB1 . 16124 1 943 . 1 1 80 80 PRO HB3 H 1 2.410 0.02 . 2 . . . . 80 P HB2 . 16124 1 944 . 1 1 80 80 PRO HD2 H 1 3.121 0.02 . 2 . . . . 80 P HD1 . 16124 1 945 . 1 1 80 80 PRO HD3 H 1 3.320 0.02 . 2 . . . . 80 P HD2 . 16124 1 946 . 1 1 80 80 PRO HG2 H 1 1.795 0.02 . 2 . . . . 80 P HG1 . 16124 1 947 . 1 1 80 80 PRO HG3 H 1 1.917 0.02 . 2 . . . . 80 P HG2 . 16124 1 948 . 1 1 80 80 PRO C C 13 177.430 0.3 . 1 . . . . 80 P C . 16124 1 949 . 1 1 80 80 PRO CA C 13 62.777 0.3 . 1 . . . . 80 P CA . 16124 1 950 . 1 1 80 80 PRO CB C 13 32.226 0.3 . 1 . . . . 80 P CB . 16124 1 951 . 1 1 80 80 PRO CD C 13 50.291 0.3 . 1 . . . . 80 P CD . 16124 1 952 . 1 1 80 80 PRO CG C 13 27.710 0.3 . 1 . . . . 80 P CG . 16124 1 953 . 1 1 81 81 LYS H H 1 8.572 0.02 . 1 . . . . 81 K HN . 16124 1 954 . 1 1 81 81 LYS HA H 1 4.013 0.02 . 1 . . . . 81 K HA . 16124 1 955 . 1 1 81 81 LYS HB2 H 1 1.976 0.02 . 2 . . . . 81 K HB1 . 16124 1 956 . 1 1 81 81 LYS HB3 H 1 2.011 0.02 . 2 . . . . 81 K HB2 . 16124 1 957 . 1 1 81 81 LYS HD2 H 1 1.787 0.02 . 2 . . . . 81 K HD2 . 16124 1 958 . 1 1 81 81 LYS HE2 H 1 3.041 0.02 . 2 . . . . 81 K HE2 . 16124 1 959 . 1 1 81 81 LYS HG2 H 1 1.618 0.02 . 2 . . . . 81 K HG1 . 16124 1 960 . 1 1 81 81 LYS HG3 H 1 1.709 0.02 . 2 . . . . 81 K HG2 . 16124 1 961 . 1 1 81 81 LYS C C 13 179.118 0.3 . 1 . . . . 81 K C . 16124 1 962 . 1 1 81 81 LYS CA C 13 60.380 0.3 . 1 . . . . 81 K CA . 16124 1 963 . 1 1 81 81 LYS CB C 13 32.650 0.3 . 1 . . . . 81 K CB . 16124 1 964 . 1 1 81 81 LYS CD C 13 29.601 0.3 . 1 . . . . 81 K CD . 16124 1 965 . 1 1 81 81 LYS CE C 13 42.099 0.3 . 1 . . . . 81 K CE . 16124 1 966 . 1 1 81 81 LYS CG C 13 25.585 0.3 . 1 . . . . 81 K CG . 16124 1 967 . 1 1 81 81 LYS N N 15 124.010 0.3 . 1 . . . . 81 K N . 16124 1 968 . 1 1 82 82 ARG H H 1 8.510 0.02 . 1 . . . . 82 R HN . 16124 1 969 . 1 1 82 82 ARG HA H 1 4.361 0.02 . 1 . . . . 82 R HA . 16124 1 970 . 1 1 82 82 ARG HB2 H 1 1.833 0.02 . 2 . . . . 82 R HB1 . 16124 1 971 . 1 1 82 82 ARG HB3 H 1 1.977 0.02 . 2 . . . . 82 R HB2 . 16124 1 972 . 1 1 82 82 ARG HD2 H 1 3.246 0.02 . 2 . . . . 82 R HD2 . 16124 1 973 . 1 1 82 82 ARG HE H 1 7.386 0.02 . 1 . . . . 82 R HE . 16124 1 974 . 1 1 82 82 ARG HG2 H 1 1.553 0.02 . 2 . . . . 82 R HG1 . 16124 1 975 . 1 1 82 82 ARG HG3 H 1 1.620 0.02 . 2 . . . . 82 R HG2 . 16124 1 976 . 1 1 82 82 ARG C C 13 176.595 0.3 . 1 . . . . 82 R C . 16124 1 977 . 1 1 82 82 ARG CA C 13 57.990 0.3 . 1 . . . . 82 R CA . 16124 1 978 . 1 1 82 82 ARG CB C 13 29.570 0.3 . 1 . . . . 82 R CB . 16124 1 979 . 1 1 82 82 ARG CD C 13 43.146 0.3 . 1 . . . . 82 R CD . 16124 1 980 . 1 1 82 82 ARG CG C 13 27.178 0.3 . 1 . . . . 82 R CG . 16124 1 981 . 1 1 82 82 ARG N N 15 114.770 0.3 . 1 . . . . 82 R N . 16124 1 982 . 1 1 82 82 ARG NE N 15 110.744 0.3 . 1 . . . . 82 R NE . 16124 1 983 . 1 1 83 83 LEU H H 1 7.970 0.02 . 1 . . . . 83 L HN . 16124 1 984 . 1 1 83 83 LEU HA H 1 4.456 0.02 . 1 . . . . 83 L HA . 16124 1 985 . 1 1 83 83 LEU HB2 H 1 1.566 0.02 . 2 . . . . 83 L HB1 . 16124 1 986 . 1 1 83 83 LEU HB3 H 1 1.704 0.02 . 2 . . . . 83 L HB2 . 16124 1 987 . 1 1 83 83 LEU HD11 H 1 0.865 0.02 . 2 . . . . 83 L HD11 . 16124 1 988 . 1 1 83 83 LEU HD12 H 1 0.865 0.02 . 2 . . . . 83 L HD11 . 16124 1 989 . 1 1 83 83 LEU HD13 H 1 0.865 0.02 . 2 . . . . 83 L HD11 . 16124 1 990 . 1 1 83 83 LEU HD21 H 1 0.865 0.02 . 2 . . . . 83 L HD21 . 16124 1 991 . 1 1 83 83 LEU HD22 H 1 0.865 0.02 . 2 . . . . 83 L HD21 . 16124 1 992 . 1 1 83 83 LEU HD23 H 1 0.865 0.02 . 2 . . . . 83 L HD21 . 16124 1 993 . 1 1 83 83 LEU HG H 1 1.473 0.02 . 1 . . . . 83 L HG . 16124 1 994 . 1 1 83 83 LEU C C 13 176.417 0.3 . 1 . . . . 83 L C . 16124 1 995 . 1 1 83 83 LEU CA C 13 54.276 0.3 . 1 . . . . 83 L CA . 16124 1 996 . 1 1 83 83 LEU CB C 13 43.090 0.3 . 1 . . . . 83 L CB . 16124 1 997 . 1 1 83 83 LEU CD1 C 13 25.423 0.3 . 1 . . . . 83 L CD1 . 16124 1 998 . 1 1 83 83 LEU CD2 C 13 22.680 0.3 . 1 . . . . 83 L CD2 . 16124 1 999 . 1 1 83 83 LEU CG C 13 27.437 0.3 . 1 . . . . 83 L CG . 16124 1 1000 . 1 1 83 83 LEU N N 15 118.390 0.3 . 1 . . . . 83 L N . 16124 1 1001 . 1 1 84 84 VAL H H 1 7.095 0.02 . 1 . . . . 84 V HN . 16124 1 1002 . 1 1 84 84 VAL HA H 1 3.520 0.02 . 1 . . . . 84 V HA . 16124 1 1003 . 1 1 84 84 VAL HB H 1 1.611 0.02 . 1 . . . . 84 V HB . 16124 1 1004 . 1 1 84 84 VAL HG11 H 1 -0.379 0.02 . 2 . . . . 84 V HG11 . 16124 1 1005 . 1 1 84 84 VAL HG12 H 1 -0.379 0.02 . 2 . . . . 84 V HG11 . 16124 1 1006 . 1 1 84 84 VAL HG13 H 1 -0.379 0.02 . 2 . . . . 84 V HG11 . 16124 1 1007 . 1 1 84 84 VAL HG21 H 1 0.825 0.02 . 2 . . . . 84 V HG21 . 16124 1 1008 . 1 1 84 84 VAL HG22 H 1 0.825 0.02 . 2 . . . . 84 V HG21 . 16124 1 1009 . 1 1 84 84 VAL HG23 H 1 0.825 0.02 . 2 . . . . 84 V HG21 . 16124 1 1010 . 1 1 84 84 VAL C C 13 175.653 0.3 . 1 . . . . 84 V C . 16124 1 1011 . 1 1 84 84 VAL CA C 13 63.570 0.3 . 1 . . . . 84 V CA . 16124 1 1012 . 1 1 84 84 VAL CB C 13 32.570 0.3 . 1 . . . . 84 V CB . 16124 1 1013 . 1 1 84 84 VAL CG1 C 13 20.007 0.3 . 1 . . . . 84 V CG1 . 16124 1 1014 . 1 1 84 84 VAL CG2 C 13 23.192 0.3 . 1 . . . . 84 V CG2 . 16124 1 1015 . 1 1 84 84 VAL N N 15 121.980 0.3 . 1 . . . . 84 V N . 16124 1 1016 . 1 1 85 85 ARG H H 1 8.386 0.02 . 1 . . . . 85 R HN . 16124 1 1017 . 1 1 85 85 ARG HA H 1 4.551 0.02 . 1 . . . . 85 R HA . 16124 1 1018 . 1 1 85 85 ARG HB2 H 1 1.746 0.02 . 2 . . . . 85 R HB1 . 16124 1 1019 . 1 1 85 85 ARG HB3 H 1 1.914 0.02 . 2 . . . . 85 R HB2 . 16124 1 1020 . 1 1 85 85 ARG HD2 H 1 3.189 0.02 . 2 . . . . 85 R HD2 . 16124 1 1021 . 1 1 85 85 ARG HE H 1 7.857 0.02 . 1 . . . . 85 R HE . 16124 1 1022 . 1 1 85 85 ARG HG2 H 1 1.552 0.02 . 2 . . . . 85 R HG1 . 16124 1 1023 . 1 1 85 85 ARG HG3 H 1 1.700 0.02 . 2 . . . . 85 R HG2 . 16124 1 1024 . 1 1 85 85 ARG HH21 H 1 6.737 0.02 . 1 . . . . 85 R HH21 . 16124 1 1025 . 1 1 85 85 ARG C C 13 175.937 0.3 . 1 . . . . 85 R C . 16124 1 1026 . 1 1 85 85 ARG CA C 13 53.700 0.3 . 1 . . . . 85 R CA . 16124 1 1027 . 1 1 85 85 ARG CB C 13 29.304 0.3 . 1 . . . . 85 R CB . 16124 1 1028 . 1 1 85 85 ARG CD C 13 42.852 0.3 . 1 . . . . 85 R CD . 16124 1 1029 . 1 1 85 85 ARG CG C 13 26.381 0.3 . 1 . . . . 85 R CG . 16124 1 1030 . 1 1 85 85 ARG N N 15 126.994 0.3 . 1 . . . . 85 R N . 16124 1 1031 . 1 1 85 85 ARG NE N 15 110.958 0.3 . 1 . . . . 85 R NE . 16124 1 1032 . 1 1 86 86 TRP H H 1 8.081 0.02 . 1 . . . . 86 W HN . 16124 1 1033 . 1 1 86 86 TRP HA H 1 4.382 0.02 . 1 . . . . 86 W HA . 16124 1 1034 . 1 1 86 86 TRP HB2 H 1 3.001 0.02 . 2 . . . . 86 W HB1 . 16124 1 1035 . 1 1 86 86 TRP HB3 H 1 3.517 0.02 . 2 . . . . 86 W HB2 . 16124 1 1036 . 1 1 86 86 TRP HD1 H 1 7.340 0.02 . 1 . . . . 86 W HD1 . 16124 1 1037 . 1 1 86 86 TRP HE1 H 1 9.970 0.02 . 1 . . . . 86 W HE1 . 16124 1 1038 . 1 1 86 86 TRP HE3 H 1 7.688 0.02 . 1 . . . . 86 W HE3 . 16124 1 1039 . 1 1 86 86 TRP HH2 H 1 7.101 0.02 . 1 . . . . 86 W HH2 . 16124 1 1040 . 1 1 86 86 TRP HZ2 H 1 7.395 0.02 . 1 . . . . 86 W HZ2 . 16124 1 1041 . 1 1 86 86 TRP HZ3 H 1 7.146 0.02 . 1 . . . . 86 W HZ3 . 16124 1 1042 . 1 1 86 86 TRP C C 13 175.724 0.3 . 1 . . . . 86 W C . 16124 1 1043 . 1 1 86 86 TRP CA C 13 58.570 0.3 . 1 . . . . 86 W CA . 16124 1 1044 . 1 1 86 86 TRP CB C 13 29.304 0.3 . 1 . . . . 86 W CB . 16124 1 1045 . 1 1 86 86 TRP CD1 C 13 128.193 0.3 . 1 . . . . 86 W CD1 . 16124 1 1046 . 1 1 86 86 TRP CE3 C 13 121.300 0.3 . 1 . . . . 86 W CE3 . 16124 1 1047 . 1 1 86 86 TRP CZ2 C 13 114.597 0.3 . 1 . . . . 86 W CZ2 . 16124 1 1048 . 1 1 86 86 TRP CZ3 C 13 121.490 0.3 . 1 . . . . 86 W CZ3 . 16124 1 1049 . 1 1 86 86 TRP N N 15 124.150 0.3 . 1 . . . . 86 W N . 16124 1 1050 . 1 1 86 86 TRP NE1 N 15 129.007 0.3 . 1 . . . . 86 W NE1 . 16124 1 1051 . 1 1 87 87 ASP H H 1 8.793 0.02 . 1 . . . . 87 D HN . 16124 1 1052 . 1 1 87 87 ASP HA H 1 4.604 0.02 . 1 . . . . 87 D HA . 16124 1 1053 . 1 1 87 87 ASP HB2 H 1 2.600 0.02 . 2 . . . . 87 D HB1 . 16124 1 1054 . 1 1 87 87 ASP HB3 H 1 2.832 0.02 . 2 . . . . 87 D HB2 . 16124 1 1055 . 1 1 87 87 ASP C C 13 175.777 0.3 . 1 . . . . 87 D C . 16124 1 1056 . 1 1 87 87 ASP CA C 13 54.010 0.3 . 1 . . . . 87 D CA . 16124 1 1057 . 1 1 87 87 ASP CB C 13 39.930 0.3 . 1 . . . . 87 D CB . 16124 1 1058 . 1 1 87 87 ASP N N 15 115.820 0.3 . 1 . . . . 87 D N . 16124 1 1059 . 1 1 88 88 THR H H 1 7.212 0.02 . 1 . . . . 88 T HN . 16124 1 1060 . 1 1 88 88 THR HA H 1 4.403 0.02 . 1 . . . . 88 T HA . 16124 1 1061 . 1 1 88 88 THR HB H 1 4.062 0.02 . 1 . . . . 88 T HB . 16124 1 1062 . 1 1 88 88 THR HG21 H 1 1.084 0.02 . 1 . . . . 88 T HG21 . 16124 1 1063 . 1 1 88 88 THR HG22 H 1 1.084 0.02 . 1 . . . . 88 T HG21 . 16124 1 1064 . 1 1 88 88 THR HG23 H 1 1.084 0.02 . 1 . . . . 88 T HG21 . 16124 1 1065 . 1 1 88 88 THR C C 13 172.099 0.3 . 1 . . . . 88 T C . 16124 1 1066 . 1 1 88 88 THR CA C 13 60.917 0.3 . 1 . . . . 88 T CA . 16124 1 1067 . 1 1 88 88 THR CB C 13 70.746 0.3 . 1 . . . . 88 T CB . 16124 1 1068 . 1 1 88 88 THR CG2 C 13 20.803 0.3 . 1 . . . . 88 T CG2 . 16124 1 1069 . 1 1 88 88 THR N N 15 113.180 0.3 . 1 . . . . 88 T N . 16124 1 1070 . 1 1 89 89 LYS H H 1 8.150 0.02 . 1 . . . . 89 K HN . 16124 1 1071 . 1 1 89 89 LYS HA H 1 4.521 0.02 . 1 . . . . 89 K HA . 16124 1 1072 . 1 1 89 89 LYS HB2 H 1 1.674 0.02 . 2 . . . . 89 K HB1 . 16124 1 1073 . 1 1 89 89 LYS HB3 H 1 1.719 0.02 . 2 . . . . 89 K HB2 . 16124 1 1074 . 1 1 89 89 LYS HD2 H 1 1.661 0.02 . 2 . . . . 89 K HD2 . 16124 1 1075 . 1 1 89 89 LYS HE2 H 1 3.006 0.02 . 2 . . . . 89 K HE2 . 16124 1 1076 . 1 1 89 89 LYS HG2 H 1 1.333 0.02 . 2 . . . . 89 K HG1 . 16124 1 1077 . 1 1 89 89 LYS HG3 H 1 1.426 0.02 . 2 . . . . 89 K HG2 . 16124 1 1078 . 1 1 89 89 LYS CA C 13 53.240 0.3 . 1 . . . . 89 K CA . 16124 1 1079 . 1 1 89 89 LYS CB C 13 34.080 0.3 . 1 . . . . 89 K CB . 16124 1 1080 . 1 1 89 89 LYS CD C 13 29.038 0.3 . 1 . . . . 89 K CD . 16124 1 1081 . 1 1 89 89 LYS CE C 13 42.299 0.3 . 1 . . . . 89 K CE . 16124 1 1082 . 1 1 89 89 LYS CG C 13 24.788 0.3 . 1 . . . . 89 K CG . 16124 1 1083 . 1 1 89 89 LYS N N 15 121.350 0.3 . 1 . . . . 89 K N . 16124 1 1084 . 1 1 90 90 PRO HA H 1 4.656 0.02 . 1 . . . . 90 P HA . 16124 1 1085 . 1 1 90 90 PRO HB2 H 1 1.925 0.02 . 2 . . . . 90 P HB1 . 16124 1 1086 . 1 1 90 90 PRO HB3 H 1 2.389 0.02 . 2 . . . . 90 P HB2 . 16124 1 1087 . 1 1 90 90 PRO HD2 H 1 3.508 0.02 . 2 . . . . 90 P HD2 . 16124 1 1088 . 1 1 90 90 PRO HG2 H 1 1.794 0.02 . 2 . . . . 90 P HG1 . 16124 1 1089 . 1 1 90 90 PRO HG3 H 1 1.915 0.02 . 2 . . . . 90 P HG2 . 16124 1 1090 . 1 1 90 90 PRO C C 13 175.848 0.3 . 1 . . . . 90 P C . 16124 1 1091 . 1 1 90 90 PRO CA C 13 62.777 0.3 . 1 . . . . 90 P CA . 16124 1 1092 . 1 1 90 90 PRO CB C 13 34.351 0.3 . 1 . . . . 90 P CB . 16124 1 1093 . 1 1 90 90 PRO CD C 13 50.291 0.3 . 1 . . . . 90 P CD . 16124 1 1094 . 1 1 90 90 PRO CG C 13 25.053 0.3 . 1 . . . . 90 P CG . 16124 1 1095 . 1 1 91 91 VAL H H 1 8.349 0.02 . 1 . . . . 91 V HN . 16124 1 1096 . 1 1 91 91 VAL HA H 1 3.760 0.02 . 1 . . . . 91 V HA . 16124 1 1097 . 1 1 91 91 VAL HB H 1 1.767 0.02 . 1 . . . . 91 V HB . 16124 1 1098 . 1 1 91 91 VAL HG11 H 1 0.363 0.02 . 2 . . . . 91 V HG11 . 16124 1 1099 . 1 1 91 91 VAL HG12 H 1 0.363 0.02 . 2 . . . . 91 V HG11 . 16124 1 1100 . 1 1 91 91 VAL HG13 H 1 0.363 0.02 . 2 . . . . 91 V HG11 . 16124 1 1101 . 1 1 91 91 VAL HG21 H 1 1.010 0.02 . 2 . . . . 91 V HG21 . 16124 1 1102 . 1 1 91 91 VAL HG22 H 1 1.010 0.02 . 2 . . . . 91 V HG21 . 16124 1 1103 . 1 1 91 91 VAL HG23 H 1 1.010 0.02 . 2 . . . . 91 V HG21 . 16124 1 1104 . 1 1 91 91 VAL C C 13 175.475 0.3 . 1 . . . . 91 V C . 16124 1 1105 . 1 1 91 91 VAL CA C 13 63.042 0.3 . 1 . . . . 91 V CA . 16124 1 1106 . 1 1 91 91 VAL CB C 13 32.492 0.3 . 1 . . . . 91 V CB . 16124 1 1107 . 1 1 91 91 VAL CG1 C 13 20.847 0.3 . 1 . . . . 91 V CG1 . 16124 1 1108 . 1 1 91 91 VAL CG2 C 13 22.131 0.3 . 1 . . . . 91 V CG2 . 16124 1 1109 . 1 1 91 91 VAL N N 15 122.690 0.3 . 1 . . . . 91 V N . 16124 1 1110 . 1 1 92 92 CYS H H 1 8.358 0.02 . 1 . . . . 92 C HN . 16124 1 1111 . 1 1 92 92 CYS HA H 1 4.751 0.02 . 1 . . . . 92 C HA . 16124 1 1112 . 1 1 92 92 CYS HB2 H 1 2.642 0.02 . 2 . . . . 92 C HB1 . 16124 1 1113 . 1 1 92 92 CYS HB3 H 1 2.725 0.02 . 2 . . . . 92 C HB2 . 16124 1 1114 . 1 1 92 92 CYS C C 13 174.498 0.3 . 1 . . . . 92 C C . 16124 1 1115 . 1 1 92 92 CYS CA C 13 57.430 0.3 . 1 . . . . 92 C CA . 16124 1 1116 . 1 1 92 92 CYS CB C 13 27.180 0.3 . 1 . . . . 92 C CB . 16124 1 1117 . 1 1 92 92 CYS N N 15 126.791 0.3 . 1 . . . . 92 C N . 16124 1 1118 . 1 1 93 93 ILE H H 1 8.755 0.02 . 1 . . . . 93 I HN . 16124 1 1119 . 1 1 93 93 ILE HA H 1 4.318 0.02 . 1 . . . . 93 I HA . 16124 1 1120 . 1 1 93 93 ILE HB H 1 1.830 0.02 . 1 . . . . 93 I HB . 16124 1 1121 . 1 1 93 93 ILE HD11 H 1 0.596 0.02 . 1 . . . . 93 I HD11 . 16124 1 1122 . 1 1 93 93 ILE HD12 H 1 0.596 0.02 . 1 . . . . 93 I HD11 . 16124 1 1123 . 1 1 93 93 ILE HD13 H 1 0.596 0.02 . 1 . . . . 93 I HD11 . 16124 1 1124 . 1 1 93 93 ILE HG12 H 1 0.576 0.02 . 1 . . . . 93 I HG11 . 16124 1 1125 . 1 1 93 93 ILE HG13 H 1 0.780 0.02 . 1 . . . . 93 I HG12 . 16124 1 1126 . 1 1 93 93 ILE HG21 H 1 0.670 0.02 . 1 . . . . 93 I HG21 . 16124 1 1127 . 1 1 93 93 ILE HG22 H 1 0.670 0.02 . 1 . . . . 93 I HG21 . 16124 1 1128 . 1 1 93 93 ILE HG23 H 1 0.670 0.02 . 1 . . . . 93 I HG21 . 16124 1 1129 . 1 1 93 93 ILE C C 13 176.595 0.3 . 1 . . . . 93 I C . 16124 1 1130 . 1 1 93 93 ILE CA C 13 60.280 0.3 . 1 . . . . 93 I CA . 16124 1 1131 . 1 1 93 93 ILE CB C 13 39.380 0.3 . 1 . . . . 93 I CB . 16124 1 1132 . 1 1 93 93 ILE CD1 C 13 14.161 0.3 . 1 . . . . 93 I CD1 . 16124 1 1133 . 1 1 93 93 ILE CG1 C 13 26.111 0.3 . 1 . . . . 93 I CG1 . 16124 1 1134 . 1 1 93 93 ILE CG2 C 13 18.943 0.3 . 1 . . . . 93 I CG2 . 16124 1 1135 . 1 1 93 93 ILE N N 15 120.710 0.3 . 1 . . . . 93 I N . 16124 1 1136 . 1 1 94 94 GLY H H 1 7.697 0.02 . 1 . . . . 94 G HN . 16124 1 1137 . 1 1 94 94 GLY HA2 H 1 3.980 0.02 . 2 . . . . 94 G HA1 . 16124 1 1138 . 1 1 94 94 GLY HA3 H 1 4.222 0.02 . 2 . . . . 94 G HA2 . 16124 1 1139 . 1 1 94 94 GLY C C 13 171.228 0.3 . 1 . . . . 94 G C . 16124 1 1140 . 1 1 94 94 GLY CA C 13 46.040 0.3 . 1 . . . . 94 G CA . 16124 1 1141 . 1 1 94 94 GLY N N 15 109.110 0.3 . 1 . . . . 94 G N . 16124 1 1142 . 1 1 95 95 GLN H H 1 8.585 0.02 . 1 . . . . 95 Q HN . 16124 1 1143 . 1 1 95 95 GLN HA H 1 5.353 0.02 . 1 . . . . 95 Q HA . 16124 1 1144 . 1 1 95 95 GLN HB2 H 1 1.672 0.02 . 2 . . . . 95 Q HB1 . 16124 1 1145 . 1 1 95 95 GLN HB3 H 1 2.020 0.02 . 2 . . . . 95 Q HB2 . 16124 1 1146 . 1 1 95 95 GLN HE21 H 1 7.213 0.02 . 2 . . . . 95 Q HE21 . 16124 1 1147 . 1 1 95 95 GLN HE22 H 1 6.658 0.02 . 2 . . . . 95 Q HE22 . 16124 1 1148 . 1 1 95 95 GLN HG2 H 1 2.266 0.02 . 2 . . . . 95 Q HG1 . 16124 1 1149 . 1 1 95 95 GLN HG3 H 1 2.357 0.02 . 2 . . . . 95 Q HG2 . 16124 1 1150 . 1 1 95 95 GLN C C 13 174.036 0.3 . 1 . . . . 95 Q C . 16124 1 1151 . 1 1 95 95 GLN CA C 13 54.270 0.3 . 1 . . . . 95 Q CA . 16124 1 1152 . 1 1 95 95 GLN CB C 13 32.490 0.3 . 1 . . . . 95 Q CB . 16124 1 1153 . 1 1 95 95 GLN CD C 13 178.713 0.3 . 1 . . . . 95 Q CD . 16124 1 1154 . 1 1 95 95 GLN CG C 13 33.555 0.3 . 1 . . . . 95 Q CG . 16124 1 1155 . 1 1 95 95 GLN N N 15 116.800 0.3 . 1 . . . . 95 Q N . 16124 1 1156 . 1 1 95 95 GLN NE2 N 15 109.436 0.3 . 1 . . . . 95 Q NE2 . 16124 1 1157 . 1 1 96 96 LYS H H 1 8.668 0.02 . 1 . . . . 96 K HN . 16124 1 1158 . 1 1 96 96 LYS HA H 1 5.606 0.02 . 1 . . . . 96 K HA . 16124 1 1159 . 1 1 96 96 LYS HB2 H 1 1.260 0.02 . 2 . . . . 96 K HB1 . 16124 1 1160 . 1 1 96 96 LYS HB3 H 1 1.481 0.02 . 2 . . . . 96 K HB2 . 16124 1 1161 . 1 1 96 96 LYS HD2 H 1 0.911 0.02 . 2 . . . . 96 K HD2 . 16124 1 1162 . 1 1 96 96 LYS HE2 H 1 2.097 0.02 . 2 . . . . 96 K HE2 . 16124 1 1163 . 1 1 96 96 LYS HG2 H 1 0.787 0.02 . 2 . . . . 96 K HG1 . 16124 1 1164 . 1 1 96 96 LYS HG3 H 1 0.836 0.02 . 2 . . . . 96 K HG2 . 16124 1 1165 . 1 1 96 96 LYS C C 13 175.013 0.3 . 1 . . . . 96 K C . 16124 1 1166 . 1 1 96 96 LYS CA C 13 53.478 0.3 . 1 . . . . 96 K CA . 16124 1 1167 . 1 1 96 96 LYS CB C 13 35.920 0.3 . 1 . . . . 96 K CB . 16124 1 1168 . 1 1 96 96 LYS CD C 13 29.630 0.3 . 1 . . . . 96 K CD . 16124 1 1169 . 1 1 96 96 LYS CE C 13 41.439 0.3 . 1 . . . . 96 K CE . 16124 1 1170 . 1 1 96 96 LYS CG C 13 24.255 0.3 . 1 . . . . 96 K CG . 16124 1 1171 . 1 1 96 96 LYS N N 15 121.306 0.3 . 1 . . . . 96 K N . 16124 1 1172 . 1 1 97 97 GLN H H 1 9.889 0.02 . 1 . . . . 97 Q HN . 16124 1 1173 . 1 1 97 97 GLN HA H 1 5.891 0.02 . 1 . . . . 97 Q HA . 16124 1 1174 . 1 1 97 97 GLN HB2 H 1 1.908 0.02 . 2 . . . . 97 Q HB1 . 16124 1 1175 . 1 1 97 97 GLN HB3 H 1 2.269 0.02 . 2 . . . . 97 Q HB2 . 16124 1 1176 . 1 1 97 97 GLN HE21 H 1 7.190 0.02 . 2 . . . . 97 Q HE21 . 16124 1 1177 . 1 1 97 97 GLN HE22 H 1 6.359 0.02 . 2 . . . . 97 Q HE22 . 16124 1 1178 . 1 1 97 97 GLN HG2 H 1 2.243 0.02 . 2 . . . . 97 Q HG1 . 16124 1 1179 . 1 1 97 97 GLN HG3 H 1 2.110 0.02 . 2 . . . . 97 Q HG2 . 16124 1 1180 . 1 1 97 97 GLN C C 13 175.475 0.3 . 1 . . . . 97 Q C . 16124 1 1181 . 1 1 97 97 GLN CA C 13 54.430 0.3 . 1 . . . . 97 Q CA . 16124 1 1182 . 1 1 97 97 GLN CB C 13 33.590 0.3 . 1 . . . . 97 Q CB . 16124 1 1183 . 1 1 97 97 GLN CD C 13 177.951 0.3 . 1 . . . . 97 Q CD . 16124 1 1184 . 1 1 97 97 GLN CG C 13 33.675 0.3 . 1 . . . . 97 Q CG . 16124 1 1185 . 1 1 97 97 GLN N N 15 122.220 0.3 . 1 . . . . 97 Q N . 16124 1 1186 . 1 1 97 97 GLN NE2 N 15 108.128 0.3 . 1 . . . . 97 Q NE2 . 16124 1 1187 . 1 1 98 98 LYS H H 1 8.154 0.02 . 1 . . . . 98 K HN . 16124 1 1188 . 1 1 98 98 LYS HA H 1 4.266 0.02 . 1 . . . . 98 K HA . 16124 1 1189 . 1 1 98 98 LYS HB2 H 1 0.237 0.02 . 2 . . . . 98 K HB1 . 16124 1 1190 . 1 1 98 98 LYS HB3 H 1 1.144 0.02 . 2 . . . . 98 K HB2 . 16124 1 1191 . 1 1 98 98 LYS HD2 H 1 0.747 0.02 . 2 . . . . 98 K HD1 . 16124 1 1192 . 1 1 98 98 LYS HD3 H 1 0.913 0.02 . 2 . . . . 98 K HD2 . 16124 1 1193 . 1 1 98 98 LYS HE2 H 1 1.776 0.02 . 2 . . . . 98 K HE1 . 16124 1 1194 . 1 1 98 98 LYS HE3 H 1 1.979 0.02 . 2 . . . . 98 K HE2 . 16124 1 1195 . 1 1 98 98 LYS HG2 H 1 0.523 0.02 . 2 . . . . 98 K HG1 . 16124 1 1196 . 1 1 98 98 LYS HG3 H 1 0.588 0.02 . 2 . . . . 98 K HG2 . 16124 1 1197 . 1 1 98 98 LYS C C 13 174.267 0.3 . 1 . . . . 98 K C . 16124 1 1198 . 1 1 98 98 LYS CA C 13 54.800 0.3 . 1 . . . . 98 K CA . 16124 1 1199 . 1 1 98 98 LYS CB C 13 34.080 0.3 . 1 . . . . 98 K CB . 16124 1 1200 . 1 1 98 98 LYS CD C 13 28.507 0.3 . 1 . . . . 98 K CD . 16124 1 1201 . 1 1 98 98 LYS CE C 13 41.527 0.3 . 1 . . . . 98 K CE . 16124 1 1202 . 1 1 98 98 LYS CG C 13 25.319 0.3 . 1 . . . . 98 K CG . 16124 1 1203 . 1 1 98 98 LYS N N 15 126.040 0.3 . 1 . . . . 98 K N . 16124 1 1204 . 1 1 99 99 TRP H H 1 7.881 0.02 . 1 . . . . 99 W HN . 16124 1 1205 . 1 1 99 99 TRP HA H 1 5.300 0.02 . 1 . . . . 99 W HA . 16124 1 1206 . 1 1 99 99 TRP HB2 H 1 2.900 0.02 . 2 . . . . 99 W HB1 . 16124 1 1207 . 1 1 99 99 TRP HB3 H 1 3.038 0.02 . 2 . . . . 99 W HB2 . 16124 1 1208 . 1 1 99 99 TRP HD1 H 1 6.780 0.02 . 1 . . . . 99 W HD1 . 16124 1 1209 . 1 1 99 99 TRP HE1 H 1 9.927 0.02 . 1 . . . . 99 W HE1 . 16124 1 1210 . 1 1 99 99 TRP HE3 H 1 7.223 0.02 . 1 . . . . 99 W HE3 . 16124 1 1211 . 1 1 99 99 TRP HZ2 H 1 7.530 0.02 . 1 . . . . 99 W HZ2 . 16124 1 1212 . 1 1 99 99 TRP C C 13 175.209 0.3 . 1 . . . . 99 W C . 16124 1 1213 . 1 1 99 99 TRP CA C 13 56.520 0.3 . 1 . . . . 99 W CA . 16124 1 1214 . 1 1 99 99 TRP CB C 13 31.710 0.3 . 1 . . . . 99 W CB . 16124 1 1215 . 1 1 99 99 TRP CD1 C 13 123.935 0.3 . 1 . . . . 99 W CD1 . 16124 1 1216 . 1 1 99 99 TRP CE3 C 13 119.665 0.3 . 1 . . . . 99 W CE3 . 16124 1 1217 . 1 1 99 99 TRP N N 15 122.920 0.3 . 1 . . . . 99 W N . 16124 1 1218 . 1 1 99 99 TRP NE1 N 15 129.634 0.3 . 1 . . . . 99 W NE1 . 16124 1 1219 . 1 1 100 100 PHE H H 1 8.715 0.02 . 1 . . . . 100 F HN . 16124 1 1220 . 1 1 100 100 PHE HA H 1 4.794 0.02 . 1 . . . . 100 F HA . 16124 1 1221 . 1 1 100 100 PHE HB2 H 1 2.703 0.02 . 2 . . . . 100 F HB2 . 16124 1 1222 . 1 1 100 100 PHE HD2 H 1 7.091 0.02 . 3 . . . . 100 F HD2 . 16124 1 1223 . 1 1 100 100 PHE HE2 H 1 6.938 0.02 . 3 . . . . 100 F HE2 . 16124 1 1224 . 1 1 100 100 PHE C C 13 172.134 0.3 . 1 . . . . 100 F C . 16124 1 1225 . 1 1 100 100 PHE CA C 13 57.590 0.3 . 1 . . . . 100 F CA . 16124 1 1226 . 1 1 100 100 PHE CB C 13 43.700 0.3 . 1 . . . . 100 F CB . 16124 1 1227 . 1 1 100 100 PHE N N 15 119.310 0.3 . 1 . . . . 100 F N . 16124 1 1228 . 1 1 101 101 LEU H H 1 8.483 0.02 . 1 . . . . 101 L HN . 16124 1 1229 . 1 1 101 101 LEU HA H 1 5.010 0.02 . 1 . . . . 101 L HA . 16124 1 1230 . 1 1 101 101 LEU HB2 H 1 -0.818 0.02 . 2 . . . . 101 L HB1 . 16124 1 1231 . 1 1 101 101 LEU HB3 H 1 0.998 0.02 . 2 . . . . 101 L HB2 . 16124 1 1232 . 1 1 101 101 LEU HD11 H 1 0.611 0.02 . 2 . . . . 101 L HD11 . 16124 1 1233 . 1 1 101 101 LEU HD12 H 1 0.611 0.02 . 2 . . . . 101 L HD11 . 16124 1 1234 . 1 1 101 101 LEU HD13 H 1 0.611 0.02 . 2 . . . . 101 L HD11 . 16124 1 1235 . 1 1 101 101 LEU HD21 H 1 0.511 0.02 . 2 . . . . 101 L HD21 . 16124 1 1236 . 1 1 101 101 LEU HD22 H 1 0.511 0.02 . 2 . . . . 101 L HD21 . 16124 1 1237 . 1 1 101 101 LEU HD23 H 1 0.511 0.02 . 2 . . . . 101 L HD21 . 16124 1 1238 . 1 1 101 101 LEU HG H 1 1.056 0.02 . 1 . . . . 101 L HG . 16124 1 1239 . 1 1 101 101 LEU C C 13 174.675 0.3 . 1 . . . . 101 L C . 16124 1 1240 . 1 1 101 101 LEU CA C 13 52.682 0.3 . 1 . . . . 101 L CA . 16124 1 1241 . 1 1 101 101 LEU CB C 13 41.520 0.3 . 1 . . . . 101 L CB . 16124 1 1242 . 1 1 101 101 LEU CD1 C 13 21.865 0.3 . 1 . . . . 101 L CD1 . 16124 1 1243 . 1 1 101 101 LEU CD2 C 13 26.913 0.3 . 1 . . . . 101 L CD2 . 16124 1 1244 . 1 1 101 101 LEU CG C 13 27.179 0.3 . 1 . . . . 101 L CG . 16124 1 1245 . 1 1 101 101 LEU N N 15 123.820 0.3 . 1 . . . . 101 L N . 16124 1 1246 . 1 1 102 102 LEU H H 1 9.655 0.02 . 1 . . . . 102 L HN . 16124 1 1247 . 1 1 102 102 LEU HA H 1 5.326 0.02 . 1 . . . . 102 L HA . 16124 1 1248 . 1 1 102 102 LEU HB2 H 1 1.200 0.02 . 2 . . . . 102 L HB1 . 16124 1 1249 . 1 1 102 102 LEU HB3 H 1 1.647 0.02 . 2 . . . . 102 L HB2 . 16124 1 1250 . 1 1 102 102 LEU HD11 H 1 0.707 0.02 . 2 . . . . 102 L HD11 . 16124 1 1251 . 1 1 102 102 LEU HD12 H 1 0.707 0.02 . 2 . . . . 102 L HD11 . 16124 1 1252 . 1 1 102 102 LEU HD13 H 1 0.707 0.02 . 2 . . . . 102 L HD11 . 16124 1 1253 . 1 1 102 102 LEU HD21 H 1 0.804 0.02 . 2 . . . . 102 L HD21 . 16124 1 1254 . 1 1 102 102 LEU HD22 H 1 0.804 0.02 . 2 . . . . 102 L HD21 . 16124 1 1255 . 1 1 102 102 LEU HD23 H 1 0.804 0.02 . 2 . . . . 102 L HD21 . 16124 1 1256 . 1 1 102 102 LEU HG H 1 1.512 0.02 . 1 . . . . 102 L HG . 16124 1 1257 . 1 1 102 102 LEU C C 13 175.315 0.3 . 1 . . . . 102 L C . 16124 1 1258 . 1 1 102 102 LEU CA C 13 52.150 0.3 . 1 . . . . 102 L CA . 16124 1 1259 . 1 1 102 102 LEU CB C 13 45.540 0.3 . 1 . . . . 102 L CB . 16124 1 1260 . 1 1 102 102 LEU CD1 C 13 25.384 0.3 . 1 . . . . 102 L CD1 . 16124 1 1261 . 1 1 102 102 LEU CD2 C 13 27.444 0.3 . 1 . . . . 102 L CD2 . 16124 1 1262 . 1 1 102 102 LEU CG C 13 27.700 0.3 . 1 . . . . 102 L CG . 16124 1 1263 . 1 1 102 102 LEU N N 15 127.470 0.3 . 1 . . . . 102 L N . 16124 1 1264 . 1 1 103 103 GLN H H 1 9.093 0.02 . 1 . . . . 103 Q HN . 16124 1 1265 . 1 1 103 103 GLN HA H 1 5.084 0.02 . 1 . . . . 103 Q HA . 16124 1 1266 . 1 1 103 103 GLN HB2 H 1 1.756 0.02 . 2 . . . . 103 Q HB1 . 16124 1 1267 . 1 1 103 103 GLN HB3 H 1 1.889 0.02 . 2 . . . . 103 Q HB2 . 16124 1 1268 . 1 1 103 103 GLN HE21 H 1 7.004 0.02 . 2 . . . . 103 Q HE21 . 16124 1 1269 . 1 1 103 103 GLN HE22 H 1 6.814 0.02 . 2 . . . . 103 Q HE22 . 16124 1 1270 . 1 1 103 103 GLN HG2 H 1 2.060 0.02 . 2 . . . . 103 Q HG2 . 16124 1 1271 . 1 1 103 103 GLN C C 13 176.204 0.3 . 1 . . . . 103 Q C . 16124 1 1272 . 1 1 103 103 GLN CA C 13 53.744 0.3 . 1 . . . . 103 Q CA . 16124 1 1273 . 1 1 103 103 GLN CB C 13 31.429 0.3 . 1 . . . . 103 Q CB . 16124 1 1274 . 1 1 103 103 GLN CD C 13 181.058 0.3 . 1 . . . . 103 Q CD . 16124 1 1275 . 1 1 103 103 GLN CG C 13 33.554 0.3 . 1 . . . . 103 Q CG . 16124 1 1276 . 1 1 103 103 GLN N N 15 120.910 0.3 . 1 . . . . 103 Q N . 16124 1 1277 . 1 1 103 103 GLN NE2 N 15 108.698 0.3 . 1 . . . . 103 Q NE2 . 16124 1 1278 . 1 1 104 104 LEU H H 1 8.751 0.02 . 1 . . . . 104 L HN . 16124 1 1279 . 1 1 104 104 LEU HA H 1 4.664 0.02 . 1 . . . . 104 L HA . 16124 1 1280 . 1 1 104 104 LEU HB2 H 1 1.298 0.02 . 2 . . . . 104 L HB1 . 16124 1 1281 . 1 1 104 104 LEU HB3 H 1 2.118 0.02 . 2 . . . . 104 L HB2 . 16124 1 1282 . 1 1 104 104 LEU HD11 H 1 0.977 0.02 . 2 . . . . 104 L HD11 . 16124 1 1283 . 1 1 104 104 LEU HD12 H 1 0.977 0.02 . 2 . . . . 104 L HD11 . 16124 1 1284 . 1 1 104 104 LEU HD13 H 1 0.977 0.02 . 2 . . . . 104 L HD11 . 16124 1 1285 . 1 1 104 104 LEU HD21 H 1 1.054 0.02 . 2 . . . . 104 L HD21 . 16124 1 1286 . 1 1 104 104 LEU HD22 H 1 1.054 0.02 . 2 . . . . 104 L HD21 . 16124 1 1287 . 1 1 104 104 LEU HD23 H 1 1.054 0.02 . 2 . . . . 104 L HD21 . 16124 1 1288 . 1 1 104 104 LEU HG H 1 1.436 0.02 . 1 . . . . 104 L HG . 16124 1 1289 . 1 1 104 104 LEU C C 13 176.399 0.3 . 1 . . . . 104 L C . 16124 1 1290 . 1 1 104 104 LEU CA C 13 55.770 0.3 . 1 . . . . 104 L CA . 16124 1 1291 . 1 1 104 104 LEU CB C 13 42.587 0.3 . 1 . . . . 104 L CB . 16124 1 1292 . 1 1 104 104 LEU CD1 C 13 24.523 0.3 . 1 . . . . 104 L CD1 . 16124 1 1293 . 1 1 104 104 LEU CD2 C 13 27.179 0.3 . 1 . . . . 104 L CD2 . 16124 1 1294 . 1 1 104 104 LEU CG C 13 29.038 0.3 . 1 . . . . 104 L CG . 16124 1 1295 . 1 1 104 104 LEU N N 15 128.010 0.3 . 1 . . . . 104 L N . 16124 1 1296 . 1 1 105 105 VAL H H 1 8.891 0.02 . 1 . . . . 105 V HN . 16124 1 1297 . 1 1 105 105 VAL HA H 1 4.417 0.02 . 1 . . . . 105 V HA . 16124 1 1298 . 1 1 105 105 VAL HB H 1 2.155 0.02 . 1 . . . . 105 V HB . 16124 1 1299 . 1 1 105 105 VAL HG11 H 1 0.734 0.02 . 2 . . . . 105 V HG11 . 16124 1 1300 . 1 1 105 105 VAL HG12 H 1 0.734 0.02 . 2 . . . . 105 V HG11 . 16124 1 1301 . 1 1 105 105 VAL HG13 H 1 0.734 0.02 . 2 . . . . 105 V HG11 . 16124 1 1302 . 1 1 105 105 VAL HG21 H 1 0.843 0.02 . 2 . . . . 105 V HG21 . 16124 1 1303 . 1 1 105 105 VAL HG22 H 1 0.843 0.02 . 2 . . . . 105 V HG21 . 16124 1 1304 . 1 1 105 105 VAL HG23 H 1 0.843 0.02 . 2 . . . . 105 V HG21 . 16124 1 1305 . 1 1 105 105 VAL C C 13 176.986 0.3 . 1 . . . . 105 V C . 16124 1 1306 . 1 1 105 105 VAL CA C 13 62.511 0.3 . 1 . . . . 105 V CA . 16124 1 1307 . 1 1 105 105 VAL CB C 13 32.492 0.3 . 1 . . . . 105 V CB . 16124 1 1308 . 1 1 105 105 VAL CG1 C 13 19.599 0.3 . 1 . . . . 105 V CG1 . 16124 1 1309 . 1 1 105 105 VAL CG2 C 13 21.865 0.3 . 1 . . . . 105 V CG2 . 16124 1 1310 . 1 1 105 105 VAL N N 15 124.860 0.3 . 1 . . . . 105 V N . 16124 1 1311 . 1 1 106 106 SER H H 1 7.332 0.02 . 1 . . . . 106 S HN . 16124 1 1312 . 1 1 106 106 SER HA H 1 4.716 0.02 . 1 . . . . 106 S HA . 16124 1 1313 . 1 1 106 106 SER HB2 H 1 3.910 0.02 . 2 . . . . 106 S HB1 . 16124 1 1314 . 1 1 106 106 SER HB3 H 1 4.096 0.02 . 2 . . . . 106 S HB2 . 16124 1 1315 . 1 1 106 106 SER C C 13 173.343 0.3 . 1 . . . . 106 S C . 16124 1 1316 . 1 1 106 106 SER CA C 13 57.464 0.3 . 1 . . . . 106 S CA . 16124 1 1317 . 1 1 106 106 SER CB C 13 64.636 0.3 . 1 . . . . 106 S CB . 16124 1 1318 . 1 1 106 106 SER N N 15 116.730 0.3 . 1 . . . . 106 S N . 16124 1 1319 . 1 1 107 107 GLY H H 1 8.472 0.02 . 1 . . . . 107 G HN . 16124 1 1320 . 1 1 107 107 GLY HA2 H 1 4.090 0.02 . 2 . . . . 107 G HA1 . 16124 1 1321 . 1 1 107 107 GLY HA3 H 1 4.216 0.02 . 2 . . . . 107 G HA2 . 16124 1 1322 . 1 1 107 107 GLY C C 13 173.911 0.3 . 1 . . . . 107 G C . 16124 1 1323 . 1 1 107 107 GLY CA C 13 45.509 0.3 . 1 . . . . 107 G CA . 16124 1 1324 . 1 1 107 107 GLY N N 15 107.294 0.3 . 1 . . . . 107 G N . 16124 1 1325 . 1 1 108 108 ASP H H 1 8.503 0.02 . 1 . . . . 108 D HN . 16124 1 1326 . 1 1 108 108 ASP HA H 1 4.356 0.02 . 1 . . . . 108 D HA . 16124 1 1327 . 1 1 108 108 ASP HB2 H 1 3.011 0.02 . 2 . . . . 108 D HB2 . 16124 1 1328 . 1 1 108 108 ASP C C 13 178.212 0.3 . 1 . . . . 108 D C . 16124 1 1329 . 1 1 108 108 ASP CA C 13 56.667 0.3 . 1 . . . . 108 D CA . 16124 1 1330 . 1 1 108 108 ASP CB C 13 40.727 0.3 . 1 . . . . 108 D CB . 16124 1 1331 . 1 1 108 108 ASP N N 15 120.450 0.3 . 1 . . . . 108 D N . 16124 1 1332 . 1 1 109 109 ALA H H 1 8.293 0.02 . 1 . . . . 109 A HN . 16124 1 1333 . 1 1 109 109 ALA HA H 1 4.320 0.02 . 1 . . . . 109 A HA . 16124 1 1334 . 1 1 109 109 ALA HB1 H 1 1.501 0.02 . 1 . . . . 109 A HB1 . 16124 1 1335 . 1 1 109 109 ALA HB2 H 1 1.501 0.02 . 1 . . . . 109 A HB1 . 16124 1 1336 . 1 1 109 109 ALA HB3 H 1 1.501 0.02 . 1 . . . . 109 A HB1 . 16124 1 1337 . 1 1 109 109 ALA C C 13 179.243 0.3 . 1 . . . . 109 A C . 16124 1 1338 . 1 1 109 109 ALA CA C 13 53.770 0.3 . 1 . . . . 109 A CA . 16124 1 1339 . 1 1 109 109 ALA CB C 13 18.677 0.3 . 1 . . . . 109 A CB . 16124 1 1340 . 1 1 109 109 ALA N N 15 120.050 0.3 . 1 . . . . 109 A N . 16124 1 1341 . 1 1 110 110 GLU H H 1 7.731 0.02 . 1 . . . . 110 E HN . 16124 1 1342 . 1 1 110 110 GLU HA H 1 4.168 0.02 . 1 . . . . 110 E HA . 16124 1 1343 . 1 1 110 110 GLU HB2 H 1 1.867 0.02 . 2 . . . . 110 E HB1 . 16124 1 1344 . 1 1 110 110 GLU HB3 H 1 2.122 0.02 . 2 . . . . 110 E HB2 . 16124 1 1345 . 1 1 110 110 GLU HG2 H 1 2.415 0.02 . 2 . . . . 110 E HG1 . 16124 1 1346 . 1 1 110 110 GLU HG3 H 1 2.514 0.02 . 2 . . . . 110 E HG2 . 16124 1 1347 . 1 1 110 110 GLU C C 13 176.666 0.3 . 1 . . . . 110 E C . 16124 1 1348 . 1 1 110 110 GLU CA C 13 56.401 0.3 . 1 . . . . 110 E CA . 16124 1 1349 . 1 1 110 110 GLU CB C 13 29.290 0.3 . 1 . . . . 110 E CB . 16124 1 1350 . 1 1 110 110 GLU CG C 13 35.680 0.3 . 1 . . . . 110 E CG . 16124 1 1351 . 1 1 110 110 GLU N N 15 115.050 0.3 . 1 . . . . 110 E N . 16124 1 1352 . 1 1 111 111 ILE H H 1 7.187 0.02 . 1 . . . . 111 I HN . 16124 1 1353 . 1 1 111 111 ILE HA H 1 3.495 0.02 . 1 . . . . 111 I HA . 16124 1 1354 . 1 1 111 111 ILE HB H 1 1.543 0.02 . 1 . . . . 111 I HB . 16124 1 1355 . 1 1 111 111 ILE HD11 H 1 -0.124 0.02 . 1 . . . . 111 I HD11 . 16124 1 1356 . 1 1 111 111 ILE HD12 H 1 -0.124 0.02 . 1 . . . . 111 I HD11 . 16124 1 1357 . 1 1 111 111 ILE HD13 H 1 -0.124 0.02 . 1 . . . . 111 I HD11 . 16124 1 1358 . 1 1 111 111 ILE HG12 H 1 0.388 0.02 . 1 . . . . 111 I HG11 . 16124 1 1359 . 1 1 111 111 ILE HG13 H 1 1.265 0.02 . 1 . . . . 111 I HG12 . 16124 1 1360 . 1 1 111 111 ILE HG21 H 1 0.141 0.02 . 1 . . . . 111 I HG21 . 16124 1 1361 . 1 1 111 111 ILE HG22 H 1 0.141 0.02 . 1 . . . . 111 I HG21 . 16124 1 1362 . 1 1 111 111 ILE HG23 H 1 0.141 0.02 . 1 . . . . 111 I HG21 . 16124 1 1363 . 1 1 111 111 ILE C C 13 175.990 0.3 . 1 . . . . 111 I C . 16124 1 1364 . 1 1 111 111 ILE CA C 13 63.574 0.3 . 1 . . . . 111 I CA . 16124 1 1365 . 1 1 111 111 ILE CB C 13 37.539 0.3 . 1 . . . . 111 I CB . 16124 1 1366 . 1 1 111 111 ILE CD1 C 13 12.567 0.3 . 1 . . . . 111 I CD1 . 16124 1 1367 . 1 1 111 111 ILE CG1 C 13 29.398 0.3 . 1 . . . . 111 I CG1 . 16124 1 1368 . 1 1 111 111 ILE CG2 C 13 16.619 0.3 . 1 . . . . 111 I CG2 . 16124 1 1369 . 1 1 111 111 ILE N N 15 118.430 0.3 . 1 . . . . 111 I N . 16124 1 1370 . 1 1 112 112 ASN H H 1 8.249 0.02 . 1 . . . . 112 N HN . 16124 1 1371 . 1 1 112 112 ASN HA H 1 4.778 0.02 . 1 . . . . 112 N HA . 16124 1 1372 . 1 1 112 112 ASN HB2 H 1 2.752 0.02 . 2 . . . . 112 N HB2 . 16124 1 1373 . 1 1 112 112 ASN HD21 H 1 7.504 0.02 . 2 . . . . 112 N HD21 . 16124 1 1374 . 1 1 112 112 ASN HD22 H 1 6.735 0.02 . 2 . . . . 112 N HD22 . 16124 1 1375 . 1 1 112 112 ASN C C 13 174.302 0.3 . 1 . . . . 112 N C . 16124 1 1376 . 1 1 112 112 ASN CA C 13 52.416 0.3 . 1 . . . . 112 N CA . 16124 1 1377 . 1 1 112 112 ASN CB C 13 39.399 0.3 . 1 . . . . 112 N CB . 16124 1 1378 . 1 1 112 112 ASN CG C 13 177.570 0.3 . 1 . . . . 112 N CG . 16124 1 1379 . 1 1 112 112 ASN N N 15 125.978 0.3 . 1 . . . . 112 N N . 16124 1 1380 . 1 1 112 112 ASN ND2 N 15 110.876 0.3 . 1 . . . . 112 N ND2 . 16124 1 1381 . 1 1 113 113 MET H H 1 8.848 0.02 . 1 . . . . 113 M HN . 16124 1 1382 . 1 1 113 113 MET HA H 1 4.347 0.02 . 1 . . . . 113 M HA . 16124 1 1383 . 1 1 113 113 MET HB2 H 1 1.853 0.02 . 2 . . . . 113 M HB2 . 16124 1 1384 . 1 1 113 113 MET HE1 H 1 1.833 0.02 . 1 . . . . 113 M HE1 . 16124 1 1385 . 1 1 113 113 MET HE2 H 1 1.833 0.02 . 1 . . . . 113 M HE1 . 16124 1 1386 . 1 1 113 113 MET HE3 H 1 1.833 0.02 . 1 . . . . 113 M HE1 . 16124 1 1387 . 1 1 113 113 MET HG2 H 1 2.589 0.02 . 2 . . . . 113 M HG1 . 16124 1 1388 . 1 1 113 113 MET HG3 H 1 2.686 0.02 . 2 . . . . 113 M HG2 . 16124 1 1389 . 1 1 113 113 MET C C 13 176.950 0.3 . 1 . . . . 113 M C . 16124 1 1390 . 1 1 113 113 MET CA C 13 56.401 0.3 . 1 . . . . 113 M CA . 16124 1 1391 . 1 1 113 113 MET CB C 13 32.480 0.3 . 1 . . . . 113 M CB . 16124 1 1392 . 1 1 113 113 MET CE C 13 19.208 0.3 . 1 . . . . 113 M CE . 16124 1 1393 . 1 1 113 113 MET CG C 13 34.351 0.3 . 1 . . . . 113 M CG . 16124 1 1394 . 1 1 113 113 MET N N 15 121.780 0.3 . 1 . . . . 113 M N . 16124 1 1395 . 1 1 114 114 GLN H H 1 8.179 0.02 . 1 . . . . 114 Q HN . 16124 1 1396 . 1 1 114 114 GLN HA H 1 4.644 0.02 . 1 . . . . 114 Q HA . 16124 1 1397 . 1 1 114 114 GLN HB2 H 1 2.008 0.02 . 2 . . . . 114 Q HB1 . 16124 1 1398 . 1 1 114 114 GLN HB3 H 1 2.370 0.02 . 2 . . . . 114 Q HB2 . 16124 1 1399 . 1 1 114 114 GLN HE21 H 1 7.554 0.02 . 2 . . . . 114 Q HE21 . 16124 1 1400 . 1 1 114 114 GLN HE22 H 1 6.809 0.02 . 2 . . . . 114 Q HE22 . 16124 1 1401 . 1 1 114 114 GLN HG2 H 1 2.227 0.02 . 2 . . . . 114 Q HG1 . 16124 1 1402 . 1 1 114 114 GLN HG3 H 1 2.382 0.02 . 2 . . . . 114 Q HG2 . 16124 1 1403 . 1 1 114 114 GLN C C 13 175.759 0.3 . 1 . . . . 114 Q C . 16124 1 1404 . 1 1 114 114 GLN CA C 13 55.073 0.3 . 1 . . . . 114 Q CA . 16124 1 1405 . 1 1 114 114 GLN CB C 13 28.507 0.3 . 1 . . . . 114 Q CB . 16124 1 1406 . 1 1 114 114 GLN CD C 13 181.022 0.3 . 1 . . . . 114 Q CD . 16124 1 1407 . 1 1 114 114 GLN CG C 13 34.351 0.3 . 1 . . . . 114 Q CG . 16124 1 1408 . 1 1 114 114 GLN N N 15 119.120 0.3 . 1 . . . . 114 Q N . 16124 1 1409 . 1 1 114 114 GLN NE2 N 15 111.631 0.3 . 1 . . . . 114 Q NE2 . 16124 1 1410 . 1 1 115 115 THR H H 1 7.902 0.02 . 1 . . . . 115 T HN . 16124 1 1411 . 1 1 115 115 THR HA H 1 4.014 0.02 . 1 . . . . 115 T HA . 16124 1 1412 . 1 1 115 115 THR HB H 1 4.062 0.02 . 1 . . . . 115 T HB . 16124 1 1413 . 1 1 115 115 THR HG21 H 1 0.841 0.02 . 1 . . . . 115 T HG21 . 16124 1 1414 . 1 1 115 115 THR HG22 H 1 0.841 0.02 . 1 . . . . 115 T HG21 . 16124 1 1415 . 1 1 115 115 THR HG23 H 1 0.841 0.02 . 1 . . . . 115 T HG21 . 16124 1 1416 . 1 1 115 115 THR C C 13 174.977 0.3 . 1 . . . . 115 T C . 16124 1 1417 . 1 1 115 115 THR CA C 13 63.840 0.3 . 1 . . . . 115 T CA . 16124 1 1418 . 1 1 115 115 THR CB C 13 69.418 0.3 . 1 . . . . 115 T CB . 16124 1 1419 . 1 1 115 115 THR CG2 C 13 21.839 0.3 . 1 . . . . 115 T CG2 . 16124 1 1420 . 1 1 115 115 THR N N 15 113.460 0.3 . 1 . . . . 115 T N . 16124 1 1421 . 1 1 116 116 SER H H 1 8.098 0.02 . 1 . . . . 116 S HN . 16124 1 1422 . 1 1 116 116 SER HA H 1 4.642 0.02 . 1 . . . . 116 S HA . 16124 1 1423 . 1 1 116 116 SER HB2 H 1 3.693 0.02 . 2 . . . . 116 S HB1 . 16124 1 1424 . 1 1 116 116 SER HB3 H 1 3.982 0.02 . 2 . . . . 116 S HB2 . 16124 1 1425 . 1 1 116 116 SER C C 13 174.142 0.3 . 1 . . . . 116 S C . 16124 1 1426 . 1 1 116 116 SER CA C 13 56.932 0.3 . 1 . . . . 116 S CA . 16124 1 1427 . 1 1 116 116 SER CB C 13 64.902 0.3 . 1 . . . . 116 S CB . 16124 1 1428 . 1 1 116 116 SER N N 15 116.130 0.3 . 1 . . . . 116 S N . 16124 1 1429 . 1 1 117 117 SER H H 1 8.523 0.02 . 1 . . . . 117 S HN . 16124 1 1430 . 1 1 117 117 SER HA H 1 4.319 0.02 . 1 . . . . 117 S HA . 16124 1 1431 . 1 1 117 117 SER HB2 H 1 3.934 0.02 . 2 . . . . 117 S HB1 . 16124 1 1432 . 1 1 117 117 SER HB3 H 1 3.982 0.02 . 2 . . . . 117 S HB2 . 16124 1 1433 . 1 1 117 117 SER C C 13 174.924 0.3 . 1 . . . . 117 S C . 16124 1 1434 . 1 1 117 117 SER CA C 13 60.120 0.3 . 1 . . . . 117 S CA . 16124 1 1435 . 1 1 117 117 SER CB C 13 63.330 0.3 . 1 . . . . 117 S CB . 16124 1 1436 . 1 1 117 117 SER N N 15 116.250 0.3 . 1 . . . . 117 S N . 16124 1 1437 . 1 1 118 118 THR H H 1 8.003 0.02 . 1 . . . . 118 T HN . 16124 1 1438 . 1 1 118 118 THR HA H 1 4.358 0.02 . 1 . . . . 118 T HA . 16124 1 1439 . 1 1 118 118 THR HB H 1 4.061 0.02 . 1 . . . . 118 T HB . 16124 1 1440 . 1 1 118 118 THR HG21 H 1 0.984 0.02 . 1 . . . . 118 T HG21 . 16124 1 1441 . 1 1 118 118 THR HG22 H 1 0.984 0.02 . 1 . . . . 118 T HG21 . 16124 1 1442 . 1 1 118 118 THR HG23 H 1 0.984 0.02 . 1 . . . . 118 T HG21 . 16124 1 1443 . 1 1 118 118 THR CA C 13 57.680 0.3 . 1 . . . . 118 T CA . 16124 1 1444 . 1 1 118 118 THR CB C 13 69.418 0.3 . 1 . . . . 118 T CB . 16124 1 1445 . 1 1 118 118 THR CG2 C 13 20.784 0.3 . 1 . . . . 118 T CG2 . 16124 1 1446 . 1 1 118 118 THR N N 15 113.720 0.3 . 1 . . . . 118 T N . 16124 1 1447 . 1 1 119 119 PRO HA H 1 4.410 0.02 . 1 . . . . 119 P HA . 16124 1 1448 . 1 1 119 119 PRO HB2 H 1 2.483 0.02 . 2 . . . . 119 P HB1 . 16124 1 1449 . 1 1 119 119 PRO HB3 H 1 2.028 0.02 . 2 . . . . 119 P HB2 . 16124 1 1450 . 1 1 119 119 PRO HD2 H 1 2.835 0.02 . 2 . . . . 119 P HD1 . 16124 1 1451 . 1 1 119 119 PRO HD3 H 1 3.238 0.02 . 2 . . . . 119 P HD2 . 16124 1 1452 . 1 1 119 119 PRO HG2 H 1 1.589 0.02 . 2 . . . . 119 P HG1 . 16124 1 1453 . 1 1 119 119 PRO HG3 H 1 1.800 0.02 . 2 . . . . 119 P HG2 . 16124 1 1454 . 1 1 119 119 PRO C C 13 176.008 0.3 . 1 . . . . 119 P C . 16124 1 1455 . 1 1 119 119 PRO CA C 13 62.970 0.3 . 1 . . . . 119 P CA . 16124 1 1456 . 1 1 119 119 PRO CB C 13 32.474 0.3 . 1 . . . . 119 P CB . 16124 1 1457 . 1 1 119 119 PRO CD C 13 50.291 0.3 . 1 . . . . 119 P CD . 16124 1 1458 . 1 1 119 119 PRO CG C 13 27.207 0.3 . 1 . . . . 119 P CG . 16124 1 1459 . 1 1 120 120 GLU H H 1 8.364 0.02 . 1 . . . . 120 E HN . 16124 1 1460 . 1 1 120 120 GLU HA H 1 4.003 0.02 . 1 . . . . 120 E HA . 16124 1 1461 . 1 1 120 120 GLU HB2 H 1 1.140 0.02 . 2 . . . . 120 E HB1 . 16124 1 1462 . 1 1 120 120 GLU HB3 H 1 1.678 0.02 . 2 . . . . 120 E HB2 . 16124 1 1463 . 1 1 120 120 GLU HG2 H 1 1.494 0.02 . 2 . . . . 120 E HG1 . 16124 1 1464 . 1 1 120 120 GLU HG3 H 1 1.567 0.02 . 2 . . . . 120 E HG2 . 16124 1 1465 . 1 1 120 120 GLU C C 13 177.963 0.3 . 1 . . . . 120 E C . 16124 1 1466 . 1 1 120 120 GLU CA C 13 57.464 0.3 . 1 . . . . 120 E CA . 16124 1 1467 . 1 1 120 120 GLU CB C 13 30.367 0.3 . 1 . . . . 120 E CB . 16124 1 1468 . 1 1 120 120 GLU CG C 13 33.820 0.3 . 1 . . . . 120 E CG . 16124 1 1469 . 1 1 120 120 GLU N N 15 122.340 0.3 . 1 . . . . 120 E N . 16124 1 1470 . 1 1 121 121 PHE H H 1 9.077 0.02 . 1 . . . . 121 F HN . 16124 1 1471 . 1 1 121 121 PHE HA H 1 5.734 0.02 . 1 . . . . 121 F HA . 16124 1 1472 . 1 1 121 121 PHE HB2 H 1 3.203 0.02 . 2 . . . . 121 F HB1 . 16124 1 1473 . 1 1 121 121 PHE HB3 H 1 3.469 0.02 . 2 . . . . 121 F HB2 . 16124 1 1474 . 1 1 121 121 PHE HE1 H 1 6.967 0.02 . 3 . . . . 121 F HE1 . 16124 1 1475 . 1 1 121 121 PHE C C 13 175.191 0.3 . 1 . . . . 121 F C . 16124 1 1476 . 1 1 121 121 PHE CA C 13 56.135 0.3 . 1 . . . . 121 F CA . 16124 1 1477 . 1 1 121 121 PHE CB C 13 43.500 0.3 . 1 . . . . 121 F CB . 16124 1 1478 . 1 1 121 121 PHE CE1 C 13 128.402 0.3 . 3 . . . . 121 F CE1 . 16124 1 1479 . 1 1 121 121 PHE N N 15 119.260 0.3 . 1 . . . . 121 F N . 16124 1 1480 . 1 1 122 122 ASP H H 1 8.823 0.02 . 1 . . . . 122 D HN . 16124 1 1481 . 1 1 122 122 ASP HA H 1 4.861 0.02 . 1 . . . . 122 D HA . 16124 1 1482 . 1 1 122 122 ASP HB2 H 1 2.329 0.02 . 2 . . . . 122 D HB1 . 16124 1 1483 . 1 1 122 122 ASP HB3 H 1 3.083 0.02 . 2 . . . . 122 D HB2 . 16124 1 1484 . 1 1 122 122 ASP C C 13 176.719 0.3 . 1 . . . . 122 D C . 16124 1 1485 . 1 1 122 122 ASP CA C 13 52.682 0.3 . 1 . . . . 122 D CA . 16124 1 1486 . 1 1 122 122 ASP CB C 13 42.321 0.3 . 1 . . . . 122 D CB . 16124 1 1487 . 1 1 122 122 ASP N N 15 115.490 0.3 . 1 . . . . 122 D N . 16124 1 1488 . 1 1 123 123 GLY H H 1 7.548 0.02 . 1 . . . . 123 G HN . 16124 1 1489 . 1 1 123 123 GLY HA2 H 1 3.868 0.02 . 2 . . . . 123 G HA1 . 16124 1 1490 . 1 1 123 123 GLY HA3 H 1 4.272 0.02 . 2 . . . . 123 G HA2 . 16124 1 1491 . 1 1 123 123 GLY C C 13 170.552 0.3 . 1 . . . . 123 G C . 16124 1 1492 . 1 1 123 123 GLY CA C 13 45.470 0.3 . 1 . . . . 123 G CA . 16124 1 1493 . 1 1 123 123 GLY N N 15 106.750 0.3 . 1 . . . . 123 G N . 16124 1 1494 . 1 1 124 124 TRP H H 1 8.195 0.02 . 1 . . . . 124 W HN . 16124 1 1495 . 1 1 124 124 TRP HA H 1 5.853 0.02 . 1 . . . . 124 W HA . 16124 1 1496 . 1 1 124 124 TRP HB2 H 1 3.074 0.02 . 2 . . . . 124 W HB1 . 16124 1 1497 . 1 1 124 124 TRP HB3 H 1 3.200 0.02 . 2 . . . . 124 W HB2 . 16124 1 1498 . 1 1 124 124 TRP HE1 H 1 10.137 0.02 . 1 . . . . 124 W HE1 . 16124 1 1499 . 1 1 124 124 TRP HZ2 H 1 7.262 0.02 . 1 . . . . 124 W HZ2 . 16124 1 1500 . 1 1 124 124 TRP C C 13 173.840 0.3 . 1 . . . . 124 W C . 16124 1 1501 . 1 1 124 124 TRP CA C 13 56.667 0.3 . 1 . . . . 124 W CA . 16124 1 1502 . 1 1 124 124 TRP CB C 13 31.160 0.3 . 1 . . . . 124 W CB . 16124 1 1503 . 1 1 124 124 TRP N N 15 116.670 0.3 . 1 . . . . 124 W N . 16124 1 1504 . 1 1 124 124 TRP NE1 N 15 129.634 0.3 . 1 . . . . 124 W NE1 . 16124 1 1505 . 1 1 125 125 ARG H H 1 9.568 0.02 . 1 . . . . 125 R HN . 16124 1 1506 . 1 1 125 125 ARG HA H 1 4.096 0.02 . 1 . . . . 125 R HA . 16124 1 1507 . 1 1 125 125 ARG HB2 H 1 1.736 0.02 . 2 . . . . 125 R HB1 . 16124 1 1508 . 1 1 125 125 ARG HB3 H 1 1.822 0.02 . 2 . . . . 125 R HB2 . 16124 1 1509 . 1 1 125 125 ARG HD2 H 1 2.855 0.02 . 2 . . . . 125 R HD1 . 16124 1 1510 . 1 1 125 125 ARG HD3 H 1 2.915 0.02 . 2 . . . . 125 R HD2 . 16124 1 1511 . 1 1 125 125 ARG HE H 1 6.404 0.02 . 1 . . . . 125 R HE . 16124 1 1512 . 1 1 125 125 ARG HG2 H 1 1.366 0.02 . 2 . . . . 125 R HG1 . 16124 1 1513 . 1 1 125 125 ARG HG3 H 1 1.654 0.02 . 2 . . . . 125 R HG2 . 16124 1 1514 . 1 1 125 125 ARG C C 13 174.622 0.3 . 1 . . . . 125 R C . 16124 1 1515 . 1 1 125 125 ARG CA C 13 55.300 0.3 . 1 . . . . 125 R CA . 16124 1 1516 . 1 1 125 125 ARG CB C 13 33.820 0.3 . 1 . . . . 125 R CB . 16124 1 1517 . 1 1 125 125 ARG CD C 13 43.649 0.3 . 1 . . . . 125 R CD . 16124 1 1518 . 1 1 125 125 ARG CG C 13 26.116 0.3 . 1 . . . . 125 R CG . 16124 1 1519 . 1 1 125 125 ARG N N 15 117.360 0.3 . 1 . . . . 125 R N . 16124 1 1520 . 1 1 125 125 ARG NE N 15 110.958 0.3 . 1 . . . . 125 R NE . 16124 1 1521 . 1 1 126 126 TRP H H 1 8.507 0.02 . 1 . . . . 126 W HN . 16124 1 1522 . 1 1 126 126 TRP HA H 1 5.528 0.02 . 1 . . . . 126 W HA . 16124 1 1523 . 1 1 126 126 TRP HB2 H 1 3.040 0.02 . 2 . . . . 126 W HB2 . 16124 1 1524 . 1 1 126 126 TRP HD1 H 1 7.410 0.02 . 1 . . . . 126 W HD1 . 16124 1 1525 . 1 1 126 126 TRP HE1 H 1 11.224 0.02 . 1 . . . . 126 W HE1 . 16124 1 1526 . 1 1 126 126 TRP HH2 H 1 6.990 0.02 . 1 . . . . 126 W HH2 . 16124 1 1527 . 1 1 126 126 TRP HZ2 H 1 7.553 0.02 . 1 . . . . 126 W HZ2 . 16124 1 1528 . 1 1 126 126 TRP C C 13 177.448 0.3 . 1 . . . . 126 W C . 16124 1 1529 . 1 1 126 126 TRP CA C 13 56.390 0.3 . 1 . . . . 126 W CA . 16124 1 1530 . 1 1 126 126 TRP CB C 13 31.164 0.3 . 1 . . . . 126 W CB . 16124 1 1531 . 1 1 126 126 TRP CD1 C 13 127.990 0.3 . 1 . . . . 126 W CD1 . 16124 1 1532 . 1 1 126 126 TRP CH2 C 13 123.800 0.3 . 1 . . . . 126 W CH2 . 16124 1 1533 . 1 1 126 126 TRP CZ2 C 13 115.196 0.3 . 1 . . . . 126 W CZ2 . 16124 1 1534 . 1 1 126 126 TRP N N 15 121.580 0.3 . 1 . . . . 126 W N . 16124 1 1535 . 1 1 126 126 TRP NE1 N 15 131.463 0.3 . 1 . . . . 126 W NE1 . 16124 1 1536 . 1 1 127 127 VAL H H 1 9.493 0.02 . 1 . . . . 127 V HN . 16124 1 1537 . 1 1 127 127 VAL HA H 1 4.706 0.02 . 1 . . . . 127 V HA . 16124 1 1538 . 1 1 127 127 VAL HB H 1 1.703 0.02 . 1 . . . . 127 V HB . 16124 1 1539 . 1 1 127 127 VAL HG11 H 1 0.672 0.02 . 2 . . . . 127 V HG11 . 16124 1 1540 . 1 1 127 127 VAL HG12 H 1 0.672 0.02 . 2 . . . . 127 V HG11 . 16124 1 1541 . 1 1 127 127 VAL HG13 H 1 0.672 0.02 . 2 . . . . 127 V HG11 . 16124 1 1542 . 1 1 127 127 VAL HG21 H 1 0.470 0.02 . 2 . . . . 127 V HG21 . 16124 1 1543 . 1 1 127 127 VAL HG22 H 1 0.470 0.02 . 2 . . . . 127 V HG21 . 16124 1 1544 . 1 1 127 127 VAL HG23 H 1 0.470 0.02 . 2 . . . . 127 V HG21 . 16124 1 1545 . 1 1 127 127 VAL C C 13 174.853 0.3 . 1 . . . . 127 V C . 16124 1 1546 . 1 1 127 127 VAL CA C 13 58.520 0.3 . 1 . . . . 127 V CA . 16124 1 1547 . 1 1 127 127 VAL CB C 13 35.673 0.3 . 1 . . . . 127 V CB . 16124 1 1548 . 1 1 127 127 VAL CG1 C 13 18.412 0.3 . 1 . . . . 127 V CG1 . 16124 1 1549 . 1 1 127 127 VAL CG2 C 13 21.333 0.3 . 1 . . . . 127 V CG2 . 16124 1 1550 . 1 1 127 127 VAL N N 15 115.800 0.3 . 1 . . . . 127 V N . 16124 1 1551 . 1 1 128 128 SER H H 1 8.193 0.02 . 1 . . . . 128 S HN . 16124 1 1552 . 1 1 128 128 SER HA H 1 4.385 0.02 . 1 . . . . 128 S HA . 16124 1 1553 . 1 1 128 128 SER HB2 H 1 3.851 0.02 . 2 . . . . 128 S HB2 . 16124 1 1554 . 1 1 128 128 SER C C 13 175.209 0.3 . 1 . . . . 128 S C . 16124 1 1555 . 1 1 128 128 SER CA C 13 59.400 0.3 . 1 . . . . 128 S CA . 16124 1 1556 . 1 1 128 128 SER CB C 13 63.308 0.3 . 1 . . . . 128 S CB . 16124 1 1557 . 1 1 128 128 SER N N 15 115.740 0.3 . 1 . . . . 128 S N . 16124 1 1558 . 1 1 129 129 TYR H H 1 8.320 0.02 . 1 . . . . 129 Y HN . 16124 1 1559 . 1 1 129 129 TYR HA H 1 3.762 0.02 . 1 . . . . 129 Y HA . 16124 1 1560 . 1 1 129 129 TYR HB2 H 1 2.493 0.02 . 2 . . . . 129 Y HB1 . 16124 1 1561 . 1 1 129 129 TYR HB3 H 1 3.120 0.02 . 2 . . . . 129 Y HB2 . 16124 1 1562 . 1 1 129 129 TYR HD1 H 1 5.940 0.02 . 3 . . . . 129 Y HD1 . 16124 1 1563 . 1 1 129 129 TYR HE1 H 1 6.988 0.02 . 3 . . . . 129 Y HE1 . 16124 1 1564 . 1 1 129 129 TYR C C 13 173.218 0.3 . 1 . . . . 129 Y C . 16124 1 1565 . 1 1 129 129 TYR CA C 13 63.830 0.3 . 1 . . . . 129 Y CA . 16124 1 1566 . 1 1 129 129 TYR CB C 13 39.399 0.3 . 1 . . . . 129 Y CB . 16124 1 1567 . 1 1 129 129 TYR CD1 C 13 132.800 0.3 . 3 . . . . 129 Y CD1 . 16124 1 1568 . 1 1 129 129 TYR CE1 C 13 124.350 0.3 . 3 . . . . 129 Y CE1 . 16124 1 1569 . 1 1 129 129 TYR N N 15 121.820 0.3 . 1 . . . . 129 Y N . 16124 1 1570 . 1 1 130 130 TRP H H 1 7.578 0.02 . 1 . . . . 130 W HN . 16124 1 1571 . 1 1 130 130 TRP HA H 1 4.520 0.02 . 1 . . . . 130 W HA . 16124 1 1572 . 1 1 130 130 TRP HB2 H 1 3.090 0.02 . 2 . . . . 130 W HB1 . 16124 1 1573 . 1 1 130 130 TRP HB3 H 1 3.441 0.02 . 2 . . . . 130 W HB2 . 16124 1 1574 . 1 1 130 130 TRP HD1 H 1 7.367 0.02 . 1 . . . . 130 W HD1 . 16124 1 1575 . 1 1 130 130 TRP HE1 H 1 10.323 0.02 . 1 . . . . 130 W HE1 . 16124 1 1576 . 1 1 130 130 TRP HE3 H 1 7.473 0.02 . 1 . . . . 130 W HE3 . 16124 1 1577 . 1 1 130 130 TRP HH2 H 1 7.125 0.02 . 1 . . . . 130 W HH2 . 16124 1 1578 . 1 1 130 130 TRP HZ2 H 1 7.565 0.02 . 1 . . . . 130 W HZ2 . 16124 1 1579 . 1 1 130 130 TRP C C 13 177.928 0.3 . 1 . . . . 130 W C . 16124 1 1580 . 1 1 130 130 TRP CA C 13 56.670 0.3 . 1 . . . . 130 W CA . 16124 1 1581 . 1 1 130 130 TRP CB C 13 29.303 0.3 . 1 . . . . 130 W CB . 16124 1 1582 . 1 1 130 130 TRP CD1 C 13 128.399 0.3 . 1 . . . . 130 W CD1 . 16124 1 1583 . 1 1 130 130 TRP CH2 C 13 124.376 0.3 . 1 . . . . 130 W CH2 . 16124 1 1584 . 1 1 130 130 TRP CZ2 C 13 115.294 0.3 . 1 . . . . 130 W CZ2 . 16124 1 1585 . 1 1 130 130 TRP N N 15 108.120 0.3 . 1 . . . . 130 W N . 16124 1 1586 . 1 1 130 130 TRP NE1 N 15 129.518 0.3 . 1 . . . . 130 W NE1 . 16124 1 1587 . 1 1 131 131 TYR H H 1 7.765 0.02 . 1 . . . . 131 Y HN . 16124 1 1588 . 1 1 131 131 TYR HA H 1 4.082 0.02 . 1 . . . . 131 Y HA . 16124 1 1589 . 1 1 131 131 TYR HB2 H 1 2.856 0.02 . 2 . . . . 131 Y HB1 . 16124 1 1590 . 1 1 131 131 TYR HB3 H 1 2.910 0.02 . 2 . . . . 131 Y HB2 . 16124 1 1591 . 1 1 131 131 TYR HD1 H 1 6.343 0.02 . 3 . . . . 131 Y HD1 . 16124 1 1592 . 1 1 131 131 TYR HE1 H 1 6.453 0.02 . 3 . . . . 131 Y HE1 . 16124 1 1593 . 1 1 131 131 TYR CA C 13 62.510 0.3 . 1 . . . . 131 Y CA . 16124 1 1594 . 1 1 131 131 TYR CB C 13 36.350 0.3 . 1 . . . . 131 Y CB . 16124 1 1595 . 1 1 131 131 TYR CD1 C 13 132.840 0.3 . 3 . . . . 131 Y CD1 . 16124 1 1596 . 1 1 131 131 TYR CE1 C 13 118.000 0.3 . 3 . . . . 131 Y CE1 . 16124 1 1597 . 1 1 131 131 TYR N N 15 123.050 0.3 . 1 . . . . 131 Y N . 16124 1 1598 . 1 1 132 132 PRO HA H 1 2.738 0.02 . 1 . . . . 132 P HA . 16124 1 1599 . 1 1 132 132 PRO HB2 H 1 1.078 0.02 . 2 . . . . 132 P HB1 . 16124 1 1600 . 1 1 132 132 PRO HB3 H 1 1.437 0.02 . 2 . . . . 132 P HB2 . 16124 1 1601 . 1 1 132 132 PRO HD2 H 1 3.656 0.02 . 2 . . . . 132 P HD2 . 16124 1 1602 . 1 1 132 132 PRO C C 13 179.211 0.3 . 1 . . . . 132 P C . 16124 1 1603 . 1 1 132 132 PRO CA C 13 66.010 0.3 . 1 . . . . 132 P CA . 16124 1 1604 . 1 1 132 132 PRO CB C 13 33.000 0.3 . 1 . . . . 132 P CB . 16124 1 1605 . 1 1 133 133 VAL H H 1 6.959 0.02 . 1 . . . . 133 V HN . 16124 1 1606 . 1 1 133 133 VAL HA H 1 3.538 0.02 . 1 . . . . 133 V HA . 16124 1 1607 . 1 1 133 133 VAL HB H 1 2.264 0.02 . 1 . . . . 133 V HB . 16124 1 1608 . 1 1 133 133 VAL HG11 H 1 1.028 0.02 . 2 . . . . 133 V HG11 . 16124 1 1609 . 1 1 133 133 VAL HG12 H 1 1.028 0.02 . 2 . . . . 133 V HG11 . 16124 1 1610 . 1 1 133 133 VAL HG13 H 1 1.028 0.02 . 2 . . . . 133 V HG11 . 16124 1 1611 . 1 1 133 133 VAL HG21 H 1 1.063 0.02 . 2 . . . . 133 V HG21 . 16124 1 1612 . 1 1 133 133 VAL HG22 H 1 1.063 0.02 . 2 . . . . 133 V HG21 . 16124 1 1613 . 1 1 133 133 VAL HG23 H 1 1.063 0.02 . 2 . . . . 133 V HG21 . 16124 1 1614 . 1 1 133 133 VAL C C 13 176.186 0.3 . 1 . . . . 133 V C . 16124 1 1615 . 1 1 133 133 VAL CA C 13 65.699 0.3 . 1 . . . . 133 V CA . 16124 1 1616 . 1 1 133 133 VAL CB C 13 31.520 0.3 . 1 . . . . 133 V CB . 16124 1 1617 . 1 1 133 133 VAL CG1 C 13 21.865 0.3 . 1 . . . . 133 V CG1 . 16124 1 1618 . 1 1 133 133 VAL CG2 C 13 23.090 0.3 . 1 . . . . 133 V CG2 . 16124 1 1619 . 1 1 133 133 VAL N N 15 110.338 0.3 . 1 . . . . 133 V N . 16124 1 1620 . 1 1 134 134 ARG H H 1 7.170 0.02 . 1 . . . . 134 R HN . 16124 1 1621 . 1 1 134 134 ARG HA H 1 4.189 0.02 . 1 . . . . 134 R HA . 16124 1 1622 . 1 1 134 134 ARG HB2 H 1 1.719 0.02 . 2 . . . . 134 R HB1 . 16124 1 1623 . 1 1 134 134 ARG HB3 H 1 1.843 0.02 . 2 . . . . 134 R HB2 . 16124 1 1624 . 1 1 134 134 ARG HD2 H 1 3.152 0.02 . 2 . . . . 134 R HD2 . 16124 1 1625 . 1 1 134 134 ARG HE H 1 7.263 0.02 . 1 . . . . 134 R HE . 16124 1 1626 . 1 1 134 134 ARG HG2 H 1 1.587 0.02 . 2 . . . . 134 R HG1 . 16124 1 1627 . 1 1 134 134 ARG HG3 H 1 1.668 0.02 . 2 . . . . 134 R HG2 . 16124 1 1628 . 1 1 134 134 ARG C C 13 177.128 0.3 . 1 . . . . 134 R C . 16124 1 1629 . 1 1 134 134 ARG CA C 13 56.932 0.3 . 1 . . . . 134 R CA . 16124 1 1630 . 1 1 134 134 ARG CB C 13 30.367 0.3 . 1 . . . . 134 R CB . 16124 1 1631 . 1 1 134 134 ARG CD C 13 43.401 0.3 . 1 . . . . 134 R CD . 16124 1 1632 . 1 1 134 134 ARG CG C 13 27.680 0.3 . 1 . . . . 134 R CG . 16124 1 1633 . 1 1 134 134 ARG N N 15 114.570 0.3 . 1 . . . . 134 R N . 16124 1 1634 . 1 1 134 134 ARG NE N 15 110.740 0.3 . 1 . . . . 134 R NE . 16124 1 1635 . 1 1 135 135 GLN H H 1 7.098 0.02 . 1 . . . . 135 Q HN . 16124 1 1636 . 1 1 135 135 GLN HA H 1 4.179 0.02 . 1 . . . . 135 Q HA . 16124 1 1637 . 1 1 135 135 GLN HB2 H 1 1.368 0.02 . 2 . . . . 135 Q HB1 . 16124 1 1638 . 1 1 135 135 GLN HB3 H 1 2.215 0.02 . 2 . . . . 135 Q HB2 . 16124 1 1639 . 1 1 135 135 GLN HE21 H 1 6.773 0.02 . 2 . . . . 135 Q HE21 . 16124 1 1640 . 1 1 135 135 GLN HE22 H 1 6.666 0.02 . 2 . . . . 135 Q HE22 . 16124 1 1641 . 1 1 135 135 GLN HG2 H 1 1.460 0.02 . 2 . . . . 135 Q HG1 . 16124 1 1642 . 1 1 135 135 GLN HG3 H 1 1.614 0.02 . 2 . . . . 135 Q HG2 . 16124 1 1643 . 1 1 135 135 GLN C C 13 176.310 0.3 . 1 . . . . 135 Q C . 16124 1 1644 . 1 1 135 135 GLN CA C 13 55.480 0.3 . 1 . . . . 135 Q CA . 16124 1 1645 . 1 1 135 135 GLN CB C 13 30.367 0.3 . 1 . . . . 135 Q CB . 16124 1 1646 . 1 1 135 135 GLN CD C 13 179.592 0.3 . 1 . . . . 135 Q CD . 16124 1 1647 . 1 1 135 135 GLN CG C 13 32.752 0.3 . 1 . . . . 135 Q CG . 16124 1 1648 . 1 1 135 135 GLN N N 15 114.870 0.3 . 1 . . . . 135 Q N . 16124 1 1649 . 1 1 135 135 GLN NE2 N 15 112.506 0.3 . 1 . . . . 135 Q NE2 . 16124 1 1650 . 1 1 136 136 VAL H H 1 7.391 0.02 . 1 . . . . 136 V HN . 16124 1 1651 . 1 1 136 136 VAL HA H 1 4.359 0.02 . 1 . . . . 136 V HA . 16124 1 1652 . 1 1 136 136 VAL HB H 1 2.150 0.02 . 1 . . . . 136 V HB . 16124 1 1653 . 1 1 136 136 VAL HG11 H 1 0.597 0.02 . 2 . . . . 136 V HG11 . 16124 1 1654 . 1 1 136 136 VAL HG12 H 1 0.597 0.02 . 2 . . . . 136 V HG11 . 16124 1 1655 . 1 1 136 136 VAL HG13 H 1 0.597 0.02 . 2 . . . . 136 V HG11 . 16124 1 1656 . 1 1 136 136 VAL HG21 H 1 0.677 0.02 . 2 . . . . 136 V HG21 . 16124 1 1657 . 1 1 136 136 VAL HG22 H 1 0.677 0.02 . 2 . . . . 136 V HG21 . 16124 1 1658 . 1 1 136 136 VAL HG23 H 1 0.677 0.02 . 2 . . . . 136 V HG21 . 16124 1 1659 . 1 1 136 136 VAL C C 13 173.822 0.3 . 1 . . . . 136 V C . 16124 1 1660 . 1 1 136 136 VAL CA C 13 61.183 0.3 . 1 . . . . 136 V CA . 16124 1 1661 . 1 1 136 136 VAL CB C 13 33.023 0.3 . 1 . . . . 136 V CB . 16124 1 1662 . 1 1 136 136 VAL CG1 C 13 19.475 0.3 . 1 . . . . 136 V CG1 . 16124 1 1663 . 1 1 136 136 VAL CG2 C 13 21.334 0.3 . 1 . . . . 136 V CG2 . 16124 1 1664 . 1 1 136 136 VAL N N 15 118.310 0.3 . 1 . . . . 136 V N . 16124 1 1665 . 1 1 137 137 VAL H H 1 7.821 0.02 . 1 . . . . 137 V HN . 16124 1 1666 . 1 1 137 137 VAL HA H 1 4.180 0.02 . 1 . . . . 137 V HA . 16124 1 1667 . 1 1 137 137 VAL HB H 1 2.144 0.02 . 1 . . . . 137 V HB . 16124 1 1668 . 1 1 137 137 VAL HG11 H 1 0.670 0.02 . 2 . . . . 137 V HG11 . 16124 1 1669 . 1 1 137 137 VAL HG12 H 1 0.670 0.02 . 2 . . . . 137 V HG11 . 16124 1 1670 . 1 1 137 137 VAL HG13 H 1 0.670 0.02 . 2 . . . . 137 V HG11 . 16124 1 1671 . 1 1 137 137 VAL HG21 H 1 0.913 0.02 . 2 . . . . 137 V HG21 . 16124 1 1672 . 1 1 137 137 VAL HG22 H 1 0.913 0.02 . 2 . . . . 137 V HG21 . 16124 1 1673 . 1 1 137 137 VAL HG23 H 1 0.913 0.02 . 2 . . . . 137 V HG21 . 16124 1 1674 . 1 1 137 137 VAL C C 13 174.320 0.3 . 1 . . . . 137 V C . 16124 1 1675 . 1 1 137 137 VAL CA C 13 62.000 0.3 . 1 . . . . 137 V CA . 16124 1 1676 . 1 1 137 137 VAL CB C 13 32.730 0.3 . 1 . . . . 137 V CB . 16124 1 1677 . 1 1 137 137 VAL CG1 C 13 20.537 0.3 . 1 . . . . 137 V CG1 . 16124 1 1678 . 1 1 137 137 VAL CG2 C 13 20.537 0.3 . 1 . . . . 137 V CG2 . 16124 1 1679 . 1 1 137 137 VAL N N 15 121.410 0.3 . 1 . . . . 137 V N . 16124 1 1680 . 1 1 138 138 SER H H 1 8.419 0.02 . 1 . . . . 138 S HN . 16124 1 1681 . 1 1 138 138 SER HA H 1 3.871 0.02 . 1 . . . . 138 S HA . 16124 1 1682 . 1 1 138 138 SER HB2 H 1 4.058 0.02 . 2 . . . . 138 S HB1 . 16124 1 1683 . 1 1 138 138 SER HB3 H 1 4.003 0.02 . 2 . . . . 138 S HB2 . 16124 1 1684 . 1 1 138 138 SER C C 13 176.897 0.3 . 1 . . . . 138 S C . 16124 1 1685 . 1 1 138 138 SER CA C 13 61.110 0.3 . 1 . . . . 138 S CA . 16124 1 1686 . 1 1 138 138 SER CB C 13 62.777 0.3 . 1 . . . . 138 S CB . 16124 1 1687 . 1 1 138 138 SER N N 15 118.190 0.3 . 1 . . . . 138 S N . 16124 1 1688 . 1 1 139 139 PHE H H 1 7.555 0.02 . 1 . . . . 139 F HN . 16124 1 1689 . 1 1 139 139 PHE HA H 1 4.684 0.02 . 1 . . . . 139 F HA . 16124 1 1690 . 1 1 139 139 PHE HB2 H 1 3.149 0.02 . 2 . . . . 139 F HB1 . 16124 1 1691 . 1 1 139 139 PHE HB3 H 1 3.496 0.02 . 2 . . . . 139 F HB2 . 16124 1 1692 . 1 1 139 139 PHE HD1 H 1 7.248 0.02 . 3 . . . . 139 F HD1 . 16124 1 1693 . 1 1 139 139 PHE C C 13 176.186 0.3 . 1 . . . . 139 F C . 16124 1 1694 . 1 1 139 139 PHE CA C 13 59.589 0.3 . 1 . . . . 139 F CA . 16124 1 1695 . 1 1 139 139 PHE CB C 13 37.830 0.3 . 1 . . . . 139 F CB . 16124 1 1696 . 1 1 139 139 PHE CD1 C 13 132.259 0.3 . 3 . . . . 139 F CD1 . 16124 1 1697 . 1 1 139 139 PHE N N 15 118.130 0.3 . 1 . . . . 139 F N . 16124 1 1698 . 1 1 140 140 LYS H H 1 7.576 0.02 . 1 . . . . 140 K HN . 16124 1 1699 . 1 1 140 140 LYS HA H 1 4.049 0.02 . 1 . . . . 140 K HA . 16124 1 1700 . 1 1 140 140 LYS HB2 H 1 1.267 0.02 . 2 . . . . 140 K HB1 . 16124 1 1701 . 1 1 140 140 LYS HB3 H 1 1.540 0.02 . 2 . . . . 140 K HB2 . 16124 1 1702 . 1 1 140 140 LYS HD2 H 1 1.614 0.02 . 2 . . . . 140 K HD1 . 16124 1 1703 . 1 1 140 140 LYS HD3 H 1 1.414 0.02 . 2 . . . . 140 K HD2 . 16124 1 1704 . 1 1 140 140 LYS HE2 H 1 2.867 0.02 . 2 . . . . 140 K HE1 . 16124 1 1705 . 1 1 140 140 LYS HE3 H 1 3.009 0.02 . 2 . . . . 140 K HE2 . 16124 1 1706 . 1 1 140 140 LYS HG2 H 1 0.901 0.02 . 2 . . . . 140 K HG1 . 16124 1 1707 . 1 1 140 140 LYS HG3 H 1 0.717 0.02 . 2 . . . . 140 K HG2 . 16124 1 1708 . 1 1 140 140 LYS C C 13 176.133 0.3 . 1 . . . . 140 K C . 16124 1 1709 . 1 1 140 140 LYS CA C 13 57.198 0.3 . 1 . . . . 140 K CA . 16124 1 1710 . 1 1 140 140 LYS CB C 13 33.554 0.3 . 1 . . . . 140 K CB . 16124 1 1711 . 1 1 140 140 LYS CD C 13 29.759 0.3 . 1 . . . . 140 K CD . 16124 1 1712 . 1 1 140 140 LYS CE C 13 42.549 0.3 . 1 . . . . 140 K CE . 16124 1 1713 . 1 1 140 140 LYS CG C 13 25.850 0.3 . 1 . . . . 140 K CG . 16124 1 1714 . 1 1 140 140 LYS N N 15 119.060 0.3 . 1 . . . . 140 K N . 16124 1 1715 . 1 1 141 141 ARG H H 1 7.335 0.02 . 1 . . . . 141 R HN . 16124 1 1716 . 1 1 141 141 ARG HA H 1 3.575 0.02 . 1 . . . . 141 R HA . 16124 1 1717 . 1 1 141 141 ARG HB2 H 1 1.740 0.02 . 2 . . . . 141 R HB1 . 16124 1 1718 . 1 1 141 141 ARG HB3 H 1 1.861 0.02 . 2 . . . . 141 R HB2 . 16124 1 1719 . 1 1 141 141 ARG HD2 H 1 3.192 0.02 . 2 . . . . 141 R HD2 . 16124 1 1720 . 1 1 141 141 ARG HE H 1 8.591 0.02 . 1 . . . . 141 R HE . 16124 1 1721 . 1 1 141 141 ARG HG2 H 1 1.599 0.02 . 2 . . . . 141 R HG1 . 16124 1 1722 . 1 1 141 141 ARG HG3 H 1 1.749 0.02 . 2 . . . . 141 R HG2 . 16124 1 1723 . 1 1 141 141 ARG C C 13 177.252 0.3 . 1 . . . . 141 R C . 16124 1 1724 . 1 1 141 141 ARG CA C 13 60.652 0.3 . 1 . . . . 141 R CA . 16124 1 1725 . 1 1 141 141 ARG CB C 13 30.101 0.3 . 1 . . . . 141 R CB . 16124 1 1726 . 1 1 141 141 ARG CD C 13 43.649 0.3 . 1 . . . . 141 R CD . 16124 1 1727 . 1 1 141 141 ARG CG C 13 27.443 0.3 . 1 . . . . 141 R CG . 16124 1 1728 . 1 1 141 141 ARG N N 15 120.030 0.3 . 1 . . . . 141 R N . 16124 1 1729 . 1 1 142 142 ASP H H 1 8.302 0.02 . 1 . . . . 142 D HN . 16124 1 1730 . 1 1 142 142 ASP HA H 1 4.436 0.02 . 1 . . . . 142 D HA . 16124 1 1731 . 1 1 142 142 ASP HB2 H 1 2.783 0.02 . 2 . . . . 142 D HB2 . 16124 1 1732 . 1 1 142 142 ASP C C 13 178.905 0.3 . 1 . . . . 142 D C . 16124 1 1733 . 1 1 142 142 ASP CA C 13 57.995 0.3 . 1 . . . . 142 D CA . 16124 1 1734 . 1 1 142 142 ASP CB C 13 40.993 0.3 . 1 . . . . 142 D CB . 16124 1 1735 . 1 1 142 142 ASP N N 15 118.430 0.3 . 1 . . . . 142 D N . 16124 1 1736 . 1 1 143 143 VAL H H 1 7.889 0.02 . 1 . . . . 143 V HN . 16124 1 1737 . 1 1 143 143 VAL HA H 1 3.662 0.02 . 1 . . . . 143 V HA . 16124 1 1738 . 1 1 143 143 VAL HB H 1 2.143 0.02 . 1 . . . . 143 V HB . 16124 1 1739 . 1 1 143 143 VAL HG11 H 1 1.114 0.02 . 2 . . . . 143 V HG11 . 16124 1 1740 . 1 1 143 143 VAL HG12 H 1 1.114 0.02 . 2 . . . . 143 V HG11 . 16124 1 1741 . 1 1 143 143 VAL HG13 H 1 1.114 0.02 . 2 . . . . 143 V HG11 . 16124 1 1742 . 1 1 143 143 VAL HG21 H 1 1.054 0.02 . 2 . . . . 143 V HG21 . 16124 1 1743 . 1 1 143 143 VAL HG22 H 1 1.054 0.02 . 2 . . . . 143 V HG21 . 16124 1 1744 . 1 1 143 143 VAL HG23 H 1 1.054 0.02 . 2 . . . . 143 V HG21 . 16124 1 1745 . 1 1 143 143 VAL C C 13 177.146 0.3 . 1 . . . . 143 V C . 16124 1 1746 . 1 1 143 143 VAL CA C 13 67.027 0.3 . 1 . . . . 143 V CA . 16124 1 1747 . 1 1 143 143 VAL CB C 13 31.960 0.3 . 1 . . . . 143 V CB . 16124 1 1748 . 1 1 143 143 VAL CG1 C 13 21.334 0.3 . 1 . . . . 143 V CG1 . 16124 1 1749 . 1 1 143 143 VAL CG2 C 13 23.459 0.3 . 1 . . . . 143 V CG2 . 16124 1 1750 . 1 1 143 143 VAL N N 15 119.780 0.3 . 1 . . . . 143 V N . 16124 1 1751 . 1 1 144 144 TYR H H 1 8.479 0.02 . 1 . . . . 144 Y HN . 16124 1 1752 . 1 1 144 144 TYR HA H 1 3.775 0.02 . 1 . . . . 144 Y HA . 16124 1 1753 . 1 1 144 144 TYR HB2 H 1 2.639 0.02 . 2 . . . . 144 Y HB1 . 16124 1 1754 . 1 1 144 144 TYR HB3 H 1 3.197 0.02 . 2 . . . . 144 Y HB2 . 16124 1 1755 . 1 1 144 144 TYR HD1 H 1 6.790 0.02 . 3 . . . . 144 Y HD1 . 16124 1 1756 . 1 1 144 144 TYR HE1 H 1 6.951 0.02 . 3 . . . . 144 Y HE1 . 16124 1 1757 . 1 1 144 144 TYR C C 13 177.821 0.3 . 1 . . . . 144 Y C . 16124 1 1758 . 1 1 144 144 TYR CA C 13 60.910 0.3 . 1 . . . . 144 Y CA . 16124 1 1759 . 1 1 144 144 TYR CB C 13 37.008 0.3 . 1 . . . . 144 Y CB . 16124 1 1760 . 1 1 144 144 TYR CD1 C 13 131.000 0.3 . 3 . . . . 144 Y CD1 . 16124 1 1761 . 1 1 144 144 TYR N N 15 119.170 0.3 . 1 . . . . 144 Y N . 16124 1 1762 . 1 1 145 145 ARG H H 1 8.866 0.02 . 1 . . . . 145 R HN . 16124 1 1763 . 1 1 145 145 ARG HA H 1 3.874 0.02 . 1 . . . . 145 R HA . 16124 1 1764 . 1 1 145 145 ARG HB2 H 1 1.998 0.02 . 2 . . . . 145 R HB2 . 16124 1 1765 . 1 1 145 145 ARG HD2 H 1 3.286 0.02 . 2 . . . . 145 R HD2 . 16124 1 1766 . 1 1 145 145 ARG HG2 H 1 1.664 0.02 . 2 . . . . 145 R HG1 . 16124 1 1767 . 1 1 145 145 ARG HG3 H 1 1.779 0.02 . 2 . . . . 145 R HG2 . 16124 1 1768 . 1 1 145 145 ARG C C 13 178.081 0.3 . 1 . . . . 145 R C . 16124 1 1769 . 1 1 145 145 ARG CA C 13 60.917 0.3 . 1 . . . . 145 R CA . 16124 1 1770 . 1 1 145 145 ARG CB C 13 30.108 0.3 . 1 . . . . 145 R CB . 16124 1 1771 . 1 1 145 145 ARG CD C 13 43.649 0.3 . 1 . . . . 145 R CD . 16124 1 1772 . 1 1 145 145 ARG CG C 13 27.904 0.3 . 1 . . . . 145 R CG . 16124 1 1773 . 1 1 145 145 ARG N N 15 118.460 0.3 . 1 . . . . 145 R N . 16124 1 1774 . 1 1 146 146 ARG H H 1 7.579 0.02 . 1 . . . . 146 R HN . 16124 1 1775 . 1 1 146 146 ARG HA H 1 3.971 0.02 . 1 . . . . 146 R HA . 16124 1 1776 . 1 1 146 146 ARG HB2 H 1 1.946 0.02 . 2 . . . . 146 R HB2 . 16124 1 1777 . 1 1 146 146 ARG HD2 H 1 3.228 0.02 . 2 . . . . 146 R HD2 . 16124 1 1778 . 1 1 146 146 ARG HG2 H 1 1.718 0.02 . 2 . . . . 146 R HG1 . 16124 1 1779 . 1 1 146 146 ARG HG3 H 1 1.912 0.02 . 2 . . . . 146 R HG2 . 16124 1 1780 . 1 1 146 146 ARG C C 13 179.580 0.3 . 1 . . . . 146 R C . 16124 1 1781 . 1 1 146 146 ARG CA C 13 59.589 0.3 . 1 . . . . 146 R CA . 16124 1 1782 . 1 1 146 146 ARG CB C 13 30.368 0.3 . 1 . . . . 146 R CB . 16124 1 1783 . 1 1 146 146 ARG CD C 13 43.915 0.3 . 1 . . . . 146 R CD . 16124 1 1784 . 1 1 146 146 ARG CG C 13 27.823 0.3 . 1 . . . . 146 R CG . 16124 1 1785 . 1 1 146 146 ARG N N 15 118.220 0.3 . 1 . . . . 146 R N . 16124 1 1786 . 1 1 147 147 VAL H H 1 8.237 0.02 . 1 . . . . 147 V HN . 16124 1 1787 . 1 1 147 147 VAL HA H 1 2.741 0.02 . 1 . . . . 147 V HA . 16124 1 1788 . 1 1 147 147 VAL HB H 1 1.202 0.02 . 1 . . . . 147 V HB . 16124 1 1789 . 1 1 147 147 VAL HG11 H 1 -0.127 0.02 . 2 . . . . 147 V HG11 . 16124 1 1790 . 1 1 147 147 VAL HG12 H 1 -0.127 0.02 . 2 . . . . 147 V HG11 . 16124 1 1791 . 1 1 147 147 VAL HG13 H 1 -0.127 0.02 . 2 . . . . 147 V HG11 . 16124 1 1792 . 1 1 147 147 VAL HG21 H 1 -0.298 0.02 . 2 . . . . 147 V HG21 . 16124 1 1793 . 1 1 147 147 VAL HG22 H 1 -0.298 0.02 . 2 . . . . 147 V HG21 . 16124 1 1794 . 1 1 147 147 VAL HG23 H 1 -0.298 0.02 . 2 . . . . 147 V HG21 . 16124 1 1795 . 1 1 147 147 VAL C C 13 176.755 0.3 . 1 . . . . 147 V C . 16124 1 1796 . 1 1 147 147 VAL CA C 13 66.762 0.3 . 1 . . . . 147 V CA . 16124 1 1797 . 1 1 147 147 VAL CB C 13 31.695 0.3 . 1 . . . . 147 V CB . 16124 1 1798 . 1 1 147 147 VAL CG1 C 13 21.068 0.3 . 1 . . . . 147 V CG1 . 16124 1 1799 . 1 1 147 147 VAL CG2 C 13 21.865 0.3 . 1 . . . . 147 V CG2 . 16124 1 1800 . 1 1 147 147 VAL N N 15 121.750 0.3 . 1 . . . . 147 V N . 16124 1 1801 . 1 1 148 148 MET H H 1 8.271 0.02 . 1 . . . . 148 M HN . 16124 1 1802 . 1 1 148 148 MET HA H 1 4.263 0.02 . 1 . . . . 148 M HA . 16124 1 1803 . 1 1 148 148 MET HB2 H 1 1.728 0.02 . 2 . . . . 148 M HB1 . 16124 1 1804 . 1 1 148 148 MET HB3 H 1 1.843 0.02 . 2 . . . . 148 M HB2 . 16124 1 1805 . 1 1 148 148 MET HE1 H 1 1.442 0.02 . 1 . . . . 148 M HE1 . 16124 1 1806 . 1 1 148 148 MET HE2 H 1 1.442 0.02 . 1 . . . . 148 M HE1 . 16124 1 1807 . 1 1 148 148 MET HE3 H 1 1.442 0.02 . 1 . . . . 148 M HE1 . 16124 1 1808 . 1 1 148 148 MET HG2 H 1 2.198 0.02 . 2 . . . . 148 M HG1 . 16124 1 1809 . 1 1 148 148 MET HG3 H 1 2.515 0.02 . 2 . . . . 148 M HG2 . 16124 1 1810 . 1 1 148 148 MET C C 13 176.541 0.3 . 1 . . . . 148 M C . 16124 1 1811 . 1 1 148 148 MET CA C 13 56.667 0.3 . 1 . . . . 148 M CA . 16124 1 1812 . 1 1 148 148 MET CB C 13 30.260 0.3 . 1 . . . . 148 M CB . 16124 1 1813 . 1 1 148 148 MET CE C 13 18.412 0.3 . 1 . . . . 148 M CE . 16124 1 1814 . 1 1 148 148 MET CG C 13 33.023 0.3 . 1 . . . . 148 M CG . 16124 1 1815 . 1 1 148 148 MET N N 15 115.030 0.3 . 1 . . . . 148 M N . 16124 1 1816 . 1 1 149 149 LYS H H 1 8.391 0.02 . 1 . . . . 149 K HN . 16124 1 1817 . 1 1 149 149 LYS HA H 1 4.406 0.02 . 1 . . . . 149 K HA . 16124 1 1818 . 1 1 149 149 LYS HB2 H 1 2.050 0.02 . 2 . . . . 149 K HB1 . 16124 1 1819 . 1 1 149 149 LYS HB3 H 1 2.153 0.02 . 2 . . . . 149 K HB2 . 16124 1 1820 . 1 1 149 149 LYS HD2 H 1 1.753 0.02 . 2 . . . . 149 K HD1 . 16124 1 1821 . 1 1 149 149 LYS HD3 H 1 1.828 0.02 . 2 . . . . 149 K HD2 . 16124 1 1822 . 1 1 149 149 LYS HE2 H 1 3.021 0.02 . 2 . . . . 149 K HE2 . 16124 1 1823 . 1 1 149 149 LYS HG2 H 1 1.627 0.02 . 2 . . . . 149 K HG1 . 16124 1 1824 . 1 1 149 149 LYS HG3 H 1 1.820 0.02 . 2 . . . . 149 K HG2 . 16124 1 1825 . 1 1 149 149 LYS C C 13 178.515 0.3 . 1 . . . . 149 K C . 16124 1 1826 . 1 1 149 149 LYS CA C 13 60.120 0.3 . 1 . . . . 149 K CA . 16124 1 1827 . 1 1 149 149 LYS CB C 13 32.492 0.3 . 1 . . . . 149 K CB . 16124 1 1828 . 1 1 149 149 LYS CD C 13 29.570 0.3 . 1 . . . . 149 K CD . 16124 1 1829 . 1 1 149 149 LYS CE C 13 42.100 0.3 . 1 . . . . 149 K CE . 16124 1 1830 . 1 1 149 149 LYS CG C 13 25.586 0.3 . 1 . . . . 149 K CG . 16124 1 1831 . 1 1 149 149 LYS N N 15 120.800 0.3 . 1 . . . . 149 K N . 16124 1 1832 . 1 1 150 150 GLU H H 1 7.630 0.02 . 1 . . . . 150 E HN . 16124 1 1833 . 1 1 150 150 GLU HA H 1 4.096 0.02 . 1 . . . . 150 E HA . 16124 1 1834 . 1 1 150 150 GLU HB2 H 1 1.698 0.02 . 2 . . . . 150 E HB1 . 16124 1 1835 . 1 1 150 150 GLU HB3 H 1 1.936 0.02 . 2 . . . . 150 E HB2 . 16124 1 1836 . 1 1 150 150 GLU HG2 H 1 2.100 0.02 . 2 . . . . 150 E HG1 . 16124 1 1837 . 1 1 150 150 GLU HG3 H 1 2.291 0.02 . 2 . . . . 150 E HG2 . 16124 1 1838 . 1 1 150 150 GLU C C 13 179.243 0.3 . 1 . . . . 150 E C . 16124 1 1839 . 1 1 150 150 GLU CA C 13 59.590 0.3 . 1 . . . . 150 E CA . 16124 1 1840 . 1 1 150 150 GLU CB C 13 28.507 0.3 . 1 . . . . 150 E CB . 16124 1 1841 . 1 1 150 150 GLU CG C 13 35.680 0.3 . 1 . . . . 150 E CG . 16124 1 1842 . 1 1 150 150 GLU N N 15 120.640 0.3 . 1 . . . . 150 E N . 16124 1 1843 . 1 1 151 151 PHE H H 1 7.733 0.02 . 1 . . . . 151 F HN . 16124 1 1844 . 1 1 151 151 PHE HA H 1 4.881 0.02 . 1 . . . . 151 F HA . 16124 1 1845 . 1 1 151 151 PHE HB2 H 1 3.264 0.02 . 2 . . . . 151 F HB1 . 16124 1 1846 . 1 1 151 151 PHE HB3 H 1 3.409 0.02 . 2 . . . . 151 F HB2 . 16124 1 1847 . 1 1 151 151 PHE HD1 H 1 7.108 0.02 . 3 . . . . 151 F HD1 . 16124 1 1848 . 1 1 151 151 PHE HD2 H 1 6.812 0.02 . 3 . . . . 151 F HD2 . 16124 1 1849 . 1 1 151 151 PHE C C 13 177.359 0.3 . 1 . . . . 151 F C . 16124 1 1850 . 1 1 151 151 PHE CA C 13 54.276 0.3 . 1 . . . . 151 F CA . 16124 1 1851 . 1 1 151 151 PHE CB C 13 38.602 0.3 . 1 . . . . 151 F CB . 16124 1 1852 . 1 1 151 151 PHE CD1 C 13 132.868 0.3 . 3 . . . . 151 F CD1 . 16124 1 1853 . 1 1 151 151 PHE N N 15 114.970 0.3 . 1 . . . . 151 F N . 16124 1 1854 . 1 1 152 152 ALA H H 1 7.619 0.02 . 1 . . . . 152 A HN . 16124 1 1855 . 1 1 152 152 ALA HA H 1 3.616 0.02 . 1 . . . . 152 A HA . 16124 1 1856 . 1 1 152 152 ALA HB1 H 1 1.660 0.02 . 1 . . . . 152 A HB1 . 16124 1 1857 . 1 1 152 152 ALA HB2 H 1 1.660 0.02 . 1 . . . . 152 A HB1 . 16124 1 1858 . 1 1 152 152 ALA HB3 H 1 1.660 0.02 . 1 . . . . 152 A HB1 . 16124 1 1859 . 1 1 152 152 ALA C C 13 179.331 0.3 . 1 . . . . 152 A C . 16124 1 1860 . 1 1 152 152 ALA CA C 13 56.667 0.3 . 1 . . . . 152 A CA . 16124 1 1861 . 1 1 152 152 ALA CB C 13 18.412 0.3 . 1 . . . . 152 A CB . 16124 1 1862 . 1 1 152 152 ALA N N 15 123.730 0.3 . 1 . . . . 152 A N . 16124 1 1863 . 1 1 153 153 SER H H 1 8.599 0.02 . 1 . . . . 153 S HN . 16124 1 1864 . 1 1 153 153 SER HA H 1 4.129 0.02 . 1 . . . . 153 S HA . 16124 1 1865 . 1 1 153 153 SER HB2 H 1 3.965 0.02 . 2 . . . . 153 S HB2 . 16124 1 1866 . 1 1 153 153 SER C C 13 176.790 0.3 . 1 . . . . 153 S C . 16124 1 1867 . 1 1 153 153 SER CA C 13 61.448 0.3 . 1 . . . . 153 S CA . 16124 1 1868 . 1 1 153 153 SER CB C 13 62.245 0.3 . 1 . . . . 153 S CB . 16124 1 1869 . 1 1 153 153 SER N N 15 110.890 0.3 . 1 . . . . 153 S N . 16124 1 1870 . 1 1 154 154 VAL H H 1 7.418 0.02 . 1 . . . . 154 V HN . 16124 1 1871 . 1 1 154 154 VAL HA H 1 3.744 0.02 . 1 . . . . 154 V HA . 16124 1 1872 . 1 1 154 154 VAL HB H 1 1.990 0.02 . 1 . . . . 154 V HB . 16124 1 1873 . 1 1 154 154 VAL HG11 H 1 1.012 0.02 . 2 . . . . 154 V HG11 . 16124 1 1874 . 1 1 154 154 VAL HG12 H 1 1.012 0.02 . 2 . . . . 154 V HG11 . 16124 1 1875 . 1 1 154 154 VAL HG13 H 1 1.012 0.02 . 2 . . . . 154 V HG11 . 16124 1 1876 . 1 1 154 154 VAL HG21 H 1 0.814 0.02 . 2 . . . . 154 V HG21 . 16124 1 1877 . 1 1 154 154 VAL HG22 H 1 0.814 0.02 . 2 . . . . 154 V HG21 . 16124 1 1878 . 1 1 154 154 VAL HG23 H 1 0.814 0.02 . 2 . . . . 154 V HG21 . 16124 1 1879 . 1 1 154 154 VAL C C 13 178.709 0.3 . 1 . . . . 154 V C . 16124 1 1880 . 1 1 154 154 VAL CA C 13 65.433 0.3 . 1 . . . . 154 V CA . 16124 1 1881 . 1 1 154 154 VAL CB C 13 31.695 0.3 . 1 . . . . 154 V CB . 16124 1 1882 . 1 1 154 154 VAL CG1 C 13 21.865 0.3 . 1 . . . . 154 V CG1 . 16124 1 1883 . 1 1 154 154 VAL CG2 C 13 22.663 0.3 . 1 . . . . 154 V CG2 . 16124 1 1884 . 1 1 154 154 VAL N N 15 122.750 0.3 . 1 . . . . 154 V N . 16124 1 1885 . 1 1 155 155 VAL H H 1 7.515 0.02 . 1 . . . . 155 V HN . 16124 1 1886 . 1 1 155 155 VAL HA H 1 3.496 0.02 . 1 . . . . 155 V HA . 16124 1 1887 . 1 1 155 155 VAL HB H 1 1.643 0.02 . 1 . . . . 155 V HB . 16124 1 1888 . 1 1 155 155 VAL HG11 H 1 0.767 0.02 . 2 . . . . 155 V HG11 . 16124 1 1889 . 1 1 155 155 VAL HG12 H 1 0.767 0.02 . 2 . . . . 155 V HG11 . 16124 1 1890 . 1 1 155 155 VAL HG13 H 1 0.767 0.02 . 2 . . . . 155 V HG11 . 16124 1 1891 . 1 1 155 155 VAL HG21 H 1 0.984 0.02 . 2 . . . . 155 V HG21 . 16124 1 1892 . 1 1 155 155 VAL HG22 H 1 0.984 0.02 . 2 . . . . 155 V HG21 . 16124 1 1893 . 1 1 155 155 VAL HG23 H 1 0.984 0.02 . 2 . . . . 155 V HG21 . 16124 1 1894 . 1 1 155 155 VAL C C 13 178.514 0.3 . 1 . . . . 155 V C . 16124 1 1895 . 1 1 155 155 VAL CA C 13 66.762 0.3 . 1 . . . . 155 V CA . 16124 1 1896 . 1 1 155 155 VAL CB C 13 31.429 0.3 . 1 . . . . 155 V CB . 16124 1 1897 . 1 1 155 155 VAL CG1 C 13 21.600 0.3 . 1 . . . . 155 V CG1 . 16124 1 1898 . 1 1 155 155 VAL CG2 C 13 24.175 0.3 . 1 . . . . 155 V CG2 . 16124 1 1899 . 1 1 155 155 VAL N N 15 119.478 0.3 . 1 . . . . 155 V N . 16124 1 1900 . 1 1 156 156 MET H H 1 8.298 0.02 . 1 . . . . 156 M HN . 16124 1 1901 . 1 1 156 156 MET HA H 1 4.214 0.02 . 1 . . . . 156 M HA . 16124 1 1902 . 1 1 156 156 MET HB2 H 1 2.060 0.02 . 2 . . . . 156 M HB2 . 16124 1 1903 . 1 1 156 156 MET HE1 H 1 1.968 0.02 . 1 . . . . 156 M HE1 . 16124 1 1904 . 1 1 156 156 MET HE2 H 1 1.968 0.02 . 1 . . . . 156 M HE1 . 16124 1 1905 . 1 1 156 156 MET HE3 H 1 1.968 0.02 . 1 . . . . 156 M HE1 . 16124 1 1906 . 1 1 156 156 MET HG2 H 1 2.494 0.02 . 2 . . . . 156 M HG1 . 16124 1 1907 . 1 1 156 156 MET HG3 H 1 2.630 0.02 . 2 . . . . 156 M HG2 . 16124 1 1908 . 1 1 156 156 MET C C 13 178.638 0.3 . 1 . . . . 156 M C . 16124 1 1909 . 1 1 156 156 MET CA C 13 57.995 0.3 . 1 . . . . 156 M CA . 16124 1 1910 . 1 1 156 156 MET CB C 13 31.960 0.3 . 1 . . . . 156 M CB . 16124 1 1911 . 1 1 156 156 MET CE C 13 17.084 0.3 . 1 . . . . 156 M CE . 16124 1 1912 . 1 1 156 156 MET CG C 13 32.496 0.3 . 1 . . . . 156 M CG . 16124 1 1913 . 1 1 156 156 MET N N 15 118.260 0.3 . 1 . . . . 156 M N . 16124 1 1914 . 1 1 157 157 SER H H 1 7.602 0.02 . 1 . . . . 157 S HN . 16124 1 1915 . 1 1 157 157 SER HA H 1 4.354 0.02 . 1 . . . . 157 S HA . 16124 1 1916 . 1 1 157 157 SER HB2 H 1 4.012 0.02 . 2 . . . . 157 S HB2 . 16124 1 1917 . 1 1 157 157 SER C C 13 175.493 0.3 . 1 . . . . 157 S C . 16124 1 1918 . 1 1 157 157 SER CA C 13 60.770 0.3 . 1 . . . . 157 S CA . 16124 1 1919 . 1 1 157 157 SER CB C 13 63.308 0.3 . 1 . . . . 157 S CB . 16124 1 1920 . 1 1 157 157 SER N N 15 114.360 0.3 . 1 . . . . 157 S N . 16124 1 1921 . 1 1 158 158 LEU H H 1 7.438 0.02 . 1 . . . . 158 L HN . 16124 1 1922 . 1 1 158 158 LEU HA H 1 4.199 0.02 . 1 . . . . 158 L HA . 16124 1 1923 . 1 1 158 158 LEU HB2 H 1 1.616 0.02 . 2 . . . . 158 L HB1 . 16124 1 1924 . 1 1 158 158 LEU HB3 H 1 1.781 0.02 . 2 . . . . 158 L HB2 . 16124 1 1925 . 1 1 158 158 LEU HD11 H 1 0.813 0.02 . 2 . . . . 158 L HD11 . 16124 1 1926 . 1 1 158 158 LEU HD12 H 1 0.813 0.02 . 2 . . . . 158 L HD11 . 16124 1 1927 . 1 1 158 158 LEU HD13 H 1 0.813 0.02 . 2 . . . . 158 L HD11 . 16124 1 1928 . 1 1 158 158 LEU HD21 H 1 0.758 0.02 . 2 . . . . 158 L HD21 . 16124 1 1929 . 1 1 158 158 LEU HD22 H 1 0.758 0.02 . 2 . . . . 158 L HD21 . 16124 1 1930 . 1 1 158 158 LEU HD23 H 1 0.758 0.02 . 2 . . . . 158 L HD21 . 16124 1 1931 . 1 1 158 158 LEU HG H 1 1.792 0.02 . 1 . . . . 158 L HG . 16124 1 1932 . 1 1 158 158 LEU C C 13 177.981 0.3 . 1 . . . . 158 L C . 16124 1 1933 . 1 1 158 158 LEU CA C 13 56.401 0.3 . 1 . . . . 158 L CA . 16124 1 1934 . 1 1 158 158 LEU CB C 13 42.321 0.3 . 1 . . . . 158 L CB . 16124 1 1935 . 1 1 158 158 LEU CD1 C 13 25.319 0.3 . 1 . . . . 158 L CD1 . 16124 1 1936 . 1 1 158 158 LEU CD2 C 13 23.459 0.3 . 1 . . . . 158 L CD2 . 16124 1 1937 . 1 1 158 158 LEU CG C 13 26.382 0.3 . 1 . . . . 158 L CG . 16124 1 1938 . 1 1 158 158 LEU N N 15 121.680 0.3 . 1 . . . . 158 L N . 16124 1 1939 . 1 1 159 159 GLN H H 1 7.611 0.02 . 1 . . . . 159 Q HN . 16124 1 1940 . 1 1 159 159 GLN HA H 1 4.241 0.02 . 1 . . . . 159 Q HA . 16124 1 1941 . 1 1 159 159 GLN HB2 H 1 2.053 0.02 . 2 . . . . 159 Q HB1 . 16124 1 1942 . 1 1 159 159 GLN HB3 H 1 2.143 0.02 . 2 . . . . 159 Q HB2 . 16124 1 1943 . 1 1 159 159 GLN HE21 H 1 7.320 0.02 . 2 . . . . 159 Q HE21 . 16124 1 1944 . 1 1 159 159 GLN HE22 H 1 6.698 0.02 . 2 . . . . 159 Q HE22 . 16124 1 1945 . 1 1 159 159 GLN HG2 H 1 2.345 0.02 . 2 . . . . 159 Q HG1 . 16124 1 1946 . 1 1 159 159 GLN HG3 H 1 2.373 0.02 . 2 . . . . 159 Q HG2 . 16124 1 1947 . 1 1 159 159 GLN C C 13 176.755 0.3 . 1 . . . . 159 Q C . 16124 1 1948 . 1 1 159 159 GLN CA C 13 56.666 0.3 . 1 . . . . 159 Q CA . 16124 1 1949 . 1 1 159 159 GLN CB C 13 29.304 0.3 . 1 . . . . 159 Q CB . 16124 1 1950 . 1 1 159 159 GLN CD C 13 179.885 0.3 . 1 . . . . 159 Q CD . 16124 1 1951 . 1 1 159 159 GLN CG C 13 34.086 0.3 . 1 . . . . 159 Q CG . 16124 1 1952 . 1 1 159 159 GLN N N 15 117.220 0.3 . 1 . . . . 159 Q N . 16124 1 1953 . 1 1 159 159 GLN NE2 N 15 110.762 0.3 . 1 . . . . 159 Q NE2 . 16124 1 1954 . 1 1 160 160 GLU H H 1 8.086 0.02 . 1 . . . . 160 E HN . 16124 1 1955 . 1 1 160 160 GLU HA H 1 4.261 0.02 . 1 . . . . 160 E HA . 16124 1 1956 . 1 1 160 160 GLU HB2 H 1 1.996 0.02 . 2 . . . . 160 E HB1 . 16124 1 1957 . 1 1 160 160 GLU HB3 H 1 2.082 0.02 . 2 . . . . 160 E HB2 . 16124 1 1958 . 1 1 160 160 GLU HG2 H 1 2.306 0.02 . 2 . . . . 160 E HG1 . 16124 1 1959 . 1 1 160 160 GLU HG3 H 1 2.367 0.02 . 2 . . . . 160 E HG2 . 16124 1 1960 . 1 1 160 160 GLU C C 13 176.381 0.3 . 1 . . . . 160 E C . 16124 1 1961 . 1 1 160 160 GLU CA C 13 56.932 0.3 . 1 . . . . 160 E CA . 16124 1 1962 . 1 1 160 160 GLU CB C 13 30.109 0.3 . 1 . . . . 160 E CB . 16124 1 1963 . 1 1 160 160 GLU CG C 13 35.761 0.3 . 1 . . . . 160 E CG . 16124 1 1964 . 1 1 160 160 GLU N N 15 120.330 0.3 . 1 . . . . 160 E N . 16124 1 1965 . 1 1 161 161 ASN H H 1 8.263 0.02 . 1 . . . . 161 N HN . 16124 1 1966 . 1 1 161 161 ASN HA H 1 4.780 0.02 . 1 . . . . 161 N HA . 16124 1 1967 . 1 1 161 161 ASN HB2 H 1 2.756 0.02 . 2 . . . . 161 N HB1 . 16124 1 1968 . 1 1 161 161 ASN HB3 H 1 2.852 0.02 . 2 . . . . 161 N HB2 . 16124 1 1969 . 1 1 161 161 ASN HD21 H 1 7.576 0.02 . 2 . . . . 161 N HD21 . 16124 1 1970 . 1 1 161 161 ASN HD22 H 1 6.909 0.02 . 2 . . . . 161 N HD22 . 16124 1 1971 . 1 1 161 161 ASN C C 13 174.871 0.3 . 1 . . . . 161 N C . 16124 1 1972 . 1 1 161 161 ASN CA C 13 53.213 0.3 . 1 . . . . 161 N CA . 16124 1 1973 . 1 1 161 161 ASN CB C 13 39.133 0.3 . 1 . . . . 161 N CB . 16124 1 1974 . 1 1 161 161 ASN CG C 13 177.146 0.3 . 1 . . . . 161 N CG . 16124 1 1975 . 1 1 161 161 ASN N N 15 118.810 0.3 . 1 . . . . 161 N N . 16124 1 1976 . 1 1 161 161 ASN ND2 N 15 113.040 0.3 . 1 . . . . 161 N ND2 . 16124 1 1977 . 1 1 162 162 THR H H 1 7.991 0.02 . 1 . . . . 162 T HN . 16124 1 1978 . 1 1 162 162 THR HA H 1 4.564 0.02 . 1 . . . . 162 T HA . 16124 1 1979 . 1 1 162 162 THR HB H 1 4.154 0.02 . 1 . . . . 162 T HB . 16124 1 1980 . 1 1 162 162 THR HG21 H 1 1.258 0.02 . 1 . . . . 162 T HG21 . 16124 1 1981 . 1 1 162 162 THR HG22 H 1 1.258 0.02 . 1 . . . . 162 T HG21 . 16124 1 1982 . 1 1 162 162 THR HG23 H 1 1.258 0.02 . 1 . . . . 162 T HG21 . 16124 1 1983 . 1 1 162 162 THR CA C 13 60.260 0.3 . 1 . . . . 162 T CA . 16124 1 1984 . 1 1 162 162 THR CB C 13 69.684 0.3 . 1 . . . . 162 T CB . 16124 1 1985 . 1 1 162 162 THR CG2 C 13 21.480 0.3 . 1 . . . . 162 T CG2 . 16124 1 1986 . 1 1 162 162 THR N N 15 117.150 0.3 . 1 . . . . 162 T N . 16124 1 1987 . 1 1 163 163 PRO HA H 1 4.416 0.02 . 1 . . . . 163 P HA . 16124 1 1988 . 1 1 163 163 PRO HB2 H 1 1.957 0.02 . 2 . . . . 163 P HB1 . 16124 1 1989 . 1 1 163 163 PRO HB3 H 1 2.308 0.02 . 2 . . . . 163 P HB2 . 16124 1 1990 . 1 1 163 163 PRO HD2 H 1 3.698 0.02 . 2 . . . . 163 P HD1 . 16124 1 1991 . 1 1 163 163 PRO HD3 H 1 3.863 0.02 . 2 . . . . 163 P HD2 . 16124 1 1992 . 1 1 163 163 PRO HG2 H 1 1.982 0.02 . 2 . . . . 163 P HG1 . 16124 1 1993 . 1 1 163 163 PRO HG3 H 1 2.065 0.02 . 2 . . . . 163 P HG2 . 16124 1 1994 . 1 1 163 163 PRO C C 13 176.079 0.3 . 1 . . . . 163 P C . 16124 1 1995 . 1 1 163 163 PRO CA C 13 63.574 0.3 . 1 . . . . 163 P CA . 16124 1 1996 . 1 1 163 163 PRO CB C 13 31.960 0.3 . 1 . . . . 163 P CB . 16124 1 1997 . 1 1 163 163 PRO CD C 13 51.088 0.3 . 1 . . . . 163 P CD . 16124 1 1998 . 1 1 163 163 PRO CG C 13 27.444 0.3 . 1 . . . . 163 P CG . 16124 1 1999 . 1 1 164 164 LYS H H 1 7.999 0.02 . 1 . . . . 164 K HN . 16124 1 2000 . 1 1 164 164 LYS HA H 1 4.163 0.02 . 1 . . . . 164 K HA . 16124 1 2001 . 1 1 164 164 LYS HB2 H 1 1.714 0.02 . 2 . . . . 164 K HB1 . 16124 1 2002 . 1 1 164 164 LYS HB3 H 1 1.839 0.02 . 2 . . . . 164 K HB2 . 16124 1 2003 . 1 1 164 164 LYS HD2 H 1 1.678 0.02 . 2 . . . . 164 K HD2 . 16124 1 2004 . 1 1 164 164 LYS HE2 H 1 3.017 0.02 . 2 . . . . 164 K HE2 . 16124 1 2005 . 1 1 164 164 LYS HG2 H 1 1.438 0.02 . 2 . . . . 164 K HG2 . 16124 1 2006 . 1 1 164 164 LYS CA C 13 57.729 0.3 . 1 . . . . 164 K CA . 16124 1 2007 . 1 1 164 164 LYS CB C 13 33.730 0.3 . 1 . . . . 164 K CB . 16124 1 2008 . 1 1 164 164 LYS CD C 13 29.170 0.3 . 1 . . . . 164 K CD . 16124 1 2009 . 1 1 164 164 LYS CE C 13 42.352 0.3 . 1 . . . . 164 K CE . 16124 1 2010 . 1 1 164 164 LYS CG C 13 24.788 0.3 . 1 . . . . 164 K CG . 16124 1 2011 . 1 1 164 164 LYS N N 15 127.170 0.3 . 1 . . . . 164 K N . 16124 1 stop_ save_