data_6934 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 6934 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID . 'Investigation of Wzb from E. coli' 'Structure analysis' 'The data from the entry that make up this study were used to determine the structure of Wzb.' 6934 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6934 _Entry.Title ; 1H, 15N, and 13C Assigned Chemical shift for Wzb ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-01-09 _Entry.Accession_date 2006-01-09 _Entry.Last_release_date 2007-02-06 _Entry.Original_release_date 2007-02-06 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Ewen Lescop . . . 6934 2 Changwen Jin . . . 6934 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6934 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 592 6934 '15N chemical shifts' 163 6934 '1H chemical shifts' 1051 6934 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2007-02-06 2006-01-09 original author . 6934 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6934 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16651264 _Citation.Full_citation . _Citation.Title ; The solution structure of Escherichia coli Wzb reveals a novel substrate recognition mechanism of prokaryotic low molecular weight protein tyrosine phosphatases ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 281 _Citation.Journal_issue 28 _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 19570 _Citation.Page_last 19577 _Citation.Year 2006 _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 Ewen Lescop . . . 6934 1 2 Yunfei Hu . . . 6934 1 3 Huimin Xu . . . 6934 1 4 Wei Hu . . . 6934 1 5 Juan Chen . . . 6934 1 6 Bin Xia . . . 6934 1 7 Changwen Jin . . . 6934 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6934 _Assembly.ID 1 _Assembly.Name 'Wzb monomer' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number 3.1.3.48 _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 'Wzb monomer' 1 $Wzb_monomer . . no native no no . . . 6934 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Wzb_monomer _Entity.Sf_category entity _Entity.Sf_framecode Wzb_monomer _Entity.Entry_ID 6934 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Wzb _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 ; MGSSHHHHHHSSGLVPRGSH MFNNILVVCVGNICRSPTAE RLLQRYHPELKVESAGLGAL VGKGADPTAISVAAEHQLSL EGHCARQISRRLCRNYDLIL TMEKRHIERLCEMAPEMRGK VMLFGHWDNECEIPDPYRKS RETFAAVYTLLERSARQWAQ ALNAEQV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; The sequence reported here contains the 147 amino acid residue of Wzb. An 20aa N-terminal His-Tag was present in the construct. ; _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 167 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 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 2FEK . "Structure Of A Protein Tyrosine Phosphatase" . . . . . 100.00 167 100.00 100.00 1.31e-119 . . . . 6934 1 2 no DBJ BAB36289 . "probable protein-tyrosine-phosphatase [Escherichia coli O157:H7 str. Sakai]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 3 no DBJ BAE76575 . "protein-tyrosine phosphatase [Escherichia coli str. K-12 substr. W3110]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 4 no DBJ BAG11867 . "protein-tyrosine phosphatase [Escherichia coli O55:H7]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 5 no DBJ BAG11925 . "protein-tyrosine phosphatase Wzb [Escherichia coli O55:H7]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 6 no DBJ BAG11981 . "protein-tyrosine phosphatase Wzb [Escherichia coli O55:H6]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 7 no EMBL CAP76568 . "Low molecular weight protein-tyrosine-phosphatase wzb [Escherichia coli LF82]" . . . . . 88.02 147 99.32 99.32 2.23e-103 . . . . 6934 1 8 no EMBL CAQ32473 . "phosphotyrosine-protein phosphatase [Escherichia coli BL21(DE3)]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 9 no EMBL CAQ89648 . "protein-tyrosine phosphatase [Escherichia fergusonii ATCC 35469]" . . . . . 88.02 147 99.32 99.32 4.11e-103 . . . . 6934 1 10 no EMBL CAQ98984 . "protein-tyrosine phosphatase [Escherichia coli IAI1]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 11 no EMBL CAR03445 . "protein-tyrosine phosphatase [Escherichia coli S88]" . . . . . 88.02 147 99.32 99.32 3.68e-103 . . . . 6934 1 12 no GB AAC75122 . "colanic acid production protein-tyrosine-phosphatase; Wzc-P dephosphorylase [Escherichia coli str. K-12 substr. MG1655]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 13 no GB AAC77834 . "putative acid phosphatase [Escherichia coli]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 14 no GB AAG57121 . "probable protein-tyrosine-phosphatase [Escherichia coli O157:H7 str. EDL933]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 15 no GB AAN43662 . "probable protein-tyrosine-phosphatase [Shigella flexneri 2a str. 301]" . . . . . 88.02 147 97.96 98.64 2.44e-101 . . . . 6934 1 16 no GB AAP17490 . "probable protein-tyrosine-phosphatase [Shigella flexneri 2a str. 2457T]" . . . . . 88.02 147 97.96 98.64 2.44e-101 . . . . 6934 1 17 no REF NP_288567 . "tyrosine phosphatase [Escherichia coli O157:H7 str. EDL933]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 18 no REF NP_310893 . "tyrosine phosphatase [Escherichia coli O157:H7 str. Sakai]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 19 no REF NP_416565 . "colanic acid production protein-tyrosine-phosphatase; Wzc-P dephosphorylase [Escherichia coli str. K-12 substr. MG1655]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 20 no REF NP_707955 . "tyrosine phosphatase [Shigella flexneri 2a str. 301]" . . . . . 88.02 147 97.96 98.64 2.44e-101 . . . . 6934 1 21 no REF NP_837681 . "tyrosine phosphatase [Shigella flexneri 2a str. 2457T]" . . . . . 88.02 147 97.96 98.64 2.44e-101 . . . . 6934 1 22 no SP P0AAB2 . "RecName: Full=Low molecular weight protein-tyrosine-phosphatase wzb [Escherichia coli K-12]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 1 23 no SP P0AAB3 . "RecName: Full=Low molecular weight protein-tyrosine-phosphatase wzb [Escherichia coli O157:H7]" . . . . . 88.02 147 100.00 100.00 6.14e-104 . . . . 6934 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 -20 MET . 6934 1 2 -19 GLY . 6934 1 3 -18 SER . 6934 1 4 -17 SER . 6934 1 5 -16 HIS . 6934 1 6 -15 HIS . 6934 1 7 -14 HIS . 6934 1 8 -13 HIS . 6934 1 9 -12 HIS . 6934 1 10 -11 HIS . 6934 1 11 -10 SER . 6934 1 12 -9 SER . 6934 1 13 -8 GLY . 6934 1 14 -7 LEU . 6934 1 15 -6 VAL . 6934 1 16 -5 PRO . 6934 1 17 -4 ARG . 6934 1 18 -3 GLY . 6934 1 19 -2 SER . 6934 1 20 -1 HIS . 6934 1 21 1 MET . 6934 1 22 2 PHE . 6934 1 23 3 ASN . 6934 1 24 4 ASN . 6934 1 25 5 ILE . 6934 1 26 6 LEU . 6934 1 27 7 VAL . 6934 1 28 8 VAL . 6934 1 29 9 CYS . 6934 1 30 10 VAL . 6934 1 31 11 GLY . 6934 1 32 12 ASN . 6934 1 33 13 ILE . 6934 1 34 14 CYS . 6934 1 35 15 ARG . 6934 1 36 16 SER . 6934 1 37 17 PRO . 6934 1 38 18 THR . 6934 1 39 19 ALA . 6934 1 40 20 GLU . 6934 1 41 21 ARG . 6934 1 42 22 LEU . 6934 1 43 23 LEU . 6934 1 44 24 GLN . 6934 1 45 25 ARG . 6934 1 46 26 TYR . 6934 1 47 27 HIS . 6934 1 48 28 PRO . 6934 1 49 29 GLU . 6934 1 50 30 LEU . 6934 1 51 31 LYS . 6934 1 52 32 VAL . 6934 1 53 33 GLU . 6934 1 54 34 SER . 6934 1 55 35 ALA . 6934 1 56 36 GLY . 6934 1 57 37 LEU . 6934 1 58 38 GLY . 6934 1 59 39 ALA . 6934 1 60 40 LEU . 6934 1 61 41 VAL . 6934 1 62 42 GLY . 6934 1 63 43 LYS . 6934 1 64 44 GLY . 6934 1 65 45 ALA . 6934 1 66 46 ASP . 6934 1 67 47 PRO . 6934 1 68 48 THR . 6934 1 69 49 ALA . 6934 1 70 50 ILE . 6934 1 71 51 SER . 6934 1 72 52 VAL . 6934 1 73 53 ALA . 6934 1 74 54 ALA . 6934 1 75 55 GLU . 6934 1 76 56 HIS . 6934 1 77 57 GLN . 6934 1 78 58 LEU . 6934 1 79 59 SER . 6934 1 80 60 LEU . 6934 1 81 61 GLU . 6934 1 82 62 GLY . 6934 1 83 63 HIS . 6934 1 84 64 CYS . 6934 1 85 65 ALA . 6934 1 86 66 ARG . 6934 1 87 67 GLN . 6934 1 88 68 ILE . 6934 1 89 69 SER . 6934 1 90 70 ARG . 6934 1 91 71 ARG . 6934 1 92 72 LEU . 6934 1 93 73 CYS . 6934 1 94 74 ARG . 6934 1 95 75 ASN . 6934 1 96 76 TYR . 6934 1 97 77 ASP . 6934 1 98 78 LEU . 6934 1 99 79 ILE . 6934 1 100 80 LEU . 6934 1 101 81 THR . 6934 1 102 82 MET . 6934 1 103 83 GLU . 6934 1 104 84 LYS . 6934 1 105 85 ARG . 6934 1 106 86 HIS . 6934 1 107 87 ILE . 6934 1 108 88 GLU . 6934 1 109 89 ARG . 6934 1 110 90 LEU . 6934 1 111 91 CYS . 6934 1 112 92 GLU . 6934 1 113 93 MET . 6934 1 114 94 ALA . 6934 1 115 95 PRO . 6934 1 116 96 GLU . 6934 1 117 97 MET . 6934 1 118 98 ARG . 6934 1 119 99 GLY . 6934 1 120 100 LYS . 6934 1 121 101 VAL . 6934 1 122 102 MET . 6934 1 123 103 LEU . 6934 1 124 104 PHE . 6934 1 125 105 GLY . 6934 1 126 106 HIS . 6934 1 127 107 TRP . 6934 1 128 108 ASP . 6934 1 129 109 ASN . 6934 1 130 110 GLU . 6934 1 131 111 CYS . 6934 1 132 112 GLU . 6934 1 133 113 ILE . 6934 1 134 114 PRO . 6934 1 135 115 ASP . 6934 1 136 116 PRO . 6934 1 137 117 TYR . 6934 1 138 118 ARG . 6934 1 139 119 LYS . 6934 1 140 120 SER . 6934 1 141 121 ARG . 6934 1 142 122 GLU . 6934 1 143 123 THR . 6934 1 144 124 PHE . 6934 1 145 125 ALA . 6934 1 146 126 ALA . 6934 1 147 127 VAL . 6934 1 148 128 TYR . 6934 1 149 129 THR . 6934 1 150 130 LEU . 6934 1 151 131 LEU . 6934 1 152 132 GLU . 6934 1 153 133 ARG . 6934 1 154 134 SER . 6934 1 155 135 ALA . 6934 1 156 136 ARG . 6934 1 157 137 GLN . 6934 1 158 138 TRP . 6934 1 159 139 ALA . 6934 1 160 140 GLN . 6934 1 161 141 ALA . 6934 1 162 142 LEU . 6934 1 163 143 ASN . 6934 1 164 144 ALA . 6934 1 165 145 GLU . 6934 1 166 146 GLN . 6934 1 167 147 VAL . 6934 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 6934 1 . GLY 2 2 6934 1 . SER 3 3 6934 1 . SER 4 4 6934 1 . HIS 5 5 6934 1 . HIS 6 6 6934 1 . HIS 7 7 6934 1 . HIS 8 8 6934 1 . HIS 9 9 6934 1 . HIS 10 10 6934 1 . SER 11 11 6934 1 . SER 12 12 6934 1 . GLY 13 13 6934 1 . LEU 14 14 6934 1 . VAL 15 15 6934 1 . PRO 16 16 6934 1 . ARG 17 17 6934 1 . GLY 18 18 6934 1 . SER 19 19 6934 1 . HIS 20 20 6934 1 . MET 21 21 6934 1 . PHE 22 22 6934 1 . ASN 23 23 6934 1 . ASN 24 24 6934 1 . ILE 25 25 6934 1 . LEU 26 26 6934 1 . VAL 27 27 6934 1 . VAL 28 28 6934 1 . CYS 29 29 6934 1 . VAL 30 30 6934 1 . GLY 31 31 6934 1 . ASN 32 32 6934 1 . ILE 33 33 6934 1 . CYS 34 34 6934 1 . ARG 35 35 6934 1 . SER 36 36 6934 1 . PRO 37 37 6934 1 . THR 38 38 6934 1 . ALA 39 39 6934 1 . GLU 40 40 6934 1 . ARG 41 41 6934 1 . LEU 42 42 6934 1 . LEU 43 43 6934 1 . GLN 44 44 6934 1 . ARG 45 45 6934 1 . TYR 46 46 6934 1 . HIS 47 47 6934 1 . PRO 48 48 6934 1 . GLU 49 49 6934 1 . LEU 50 50 6934 1 . LYS 51 51 6934 1 . VAL 52 52 6934 1 . GLU 53 53 6934 1 . SER 54 54 6934 1 . ALA 55 55 6934 1 . GLY 56 56 6934 1 . LEU 57 57 6934 1 . GLY 58 58 6934 1 . ALA 59 59 6934 1 . LEU 60 60 6934 1 . VAL 61 61 6934 1 . GLY 62 62 6934 1 . LYS 63 63 6934 1 . GLY 64 64 6934 1 . ALA 65 65 6934 1 . ASP 66 66 6934 1 . PRO 67 67 6934 1 . THR 68 68 6934 1 . ALA 69 69 6934 1 . ILE 70 70 6934 1 . SER 71 71 6934 1 . VAL 72 72 6934 1 . ALA 73 73 6934 1 . ALA 74 74 6934 1 . GLU 75 75 6934 1 . HIS 76 76 6934 1 . GLN 77 77 6934 1 . LEU 78 78 6934 1 . SER 79 79 6934 1 . LEU 80 80 6934 1 . GLU 81 81 6934 1 . GLY 82 82 6934 1 . HIS 83 83 6934 1 . CYS 84 84 6934 1 . ALA 85 85 6934 1 . ARG 86 86 6934 1 . GLN 87 87 6934 1 . ILE 88 88 6934 1 . SER 89 89 6934 1 . ARG 90 90 6934 1 . ARG 91 91 6934 1 . LEU 92 92 6934 1 . CYS 93 93 6934 1 . ARG 94 94 6934 1 . ASN 95 95 6934 1 . TYR 96 96 6934 1 . ASP 97 97 6934 1 . LEU 98 98 6934 1 . ILE 99 99 6934 1 . LEU 100 100 6934 1 . THR 101 101 6934 1 . MET 102 102 6934 1 . GLU 103 103 6934 1 . LYS 104 104 6934 1 . ARG 105 105 6934 1 . HIS 106 106 6934 1 . ILE 107 107 6934 1 . GLU 108 108 6934 1 . ARG 109 109 6934 1 . LEU 110 110 6934 1 . CYS 111 111 6934 1 . GLU 112 112 6934 1 . MET 113 113 6934 1 . ALA 114 114 6934 1 . PRO 115 115 6934 1 . GLU 116 116 6934 1 . MET 117 117 6934 1 . ARG 118 118 6934 1 . GLY 119 119 6934 1 . LYS 120 120 6934 1 . VAL 121 121 6934 1 . MET 122 122 6934 1 . LEU 123 123 6934 1 . PHE 124 124 6934 1 . GLY 125 125 6934 1 . HIS 126 126 6934 1 . TRP 127 127 6934 1 . ASP 128 128 6934 1 . ASN 129 129 6934 1 . GLU 130 130 6934 1 . CYS 131 131 6934 1 . GLU 132 132 6934 1 . ILE 133 133 6934 1 . PRO 134 134 6934 1 . ASP 135 135 6934 1 . PRO 136 136 6934 1 . TYR 137 137 6934 1 . ARG 138 138 6934 1 . LYS 139 139 6934 1 . SER 140 140 6934 1 . ARG 141 141 6934 1 . GLU 142 142 6934 1 . THR 143 143 6934 1 . PHE 144 144 6934 1 . ALA 145 145 6934 1 . ALA 146 146 6934 1 . VAL 147 147 6934 1 . TYR 148 148 6934 1 . THR 149 149 6934 1 . LEU 150 150 6934 1 . LEU 151 151 6934 1 . GLU 152 152 6934 1 . ARG 153 153 6934 1 . SER 154 154 6934 1 . ALA 155 155 6934 1 . ARG 156 156 6934 1 . GLN 157 157 6934 1 . TRP 158 158 6934 1 . ALA 159 159 6934 1 . GLN 160 160 6934 1 . ALA 161 161 6934 1 . LEU 162 162 6934 1 . ASN 163 163 6934 1 . ALA 164 164 6934 1 . GLU 165 165 6934 1 . GLN 166 166 6934 1 . VAL 167 167 6934 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 6934 _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 $Wzb_monomer . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli K12 . . . . . . . . . . . . . . . . . . . . 6934 1 stop_ loop_ _Natural_source_db.Entity_natural_src_ID _Natural_source_db.Entity_ID _Natural_source_db.Entity_label _Natural_source_db.Entity_chimera_segment_ID _Natural_source_db.Database_code _Natural_source_db.Database_type _Natural_source_db.Entry_code _Natural_source_db.Entry_type _Natural_source_db.ORF_code _Natural_source_db.Gene_locus_code _Natural_source_db.Gene_cDNA_code _Natural_source_db.Entry_ID _Natural_source_db.Entity_natural_src_list_ID . 1 $Wzb_monomer . swiss-prot . P0AAB2 . . . . 6934 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 6934 _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 $Wzb_monomer . 'recombinant technology' . 'E. coli' . . Escherichia coli BL21 DE3 . . . . . . . . . . . plasmid . . pET28a . . . . . . 6934 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6934 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Wzb '[U-95% 13C; U-95% 15N]' . . 1 $Wzb_monomer . . 1 . . mM . . . . 6934 1 2 'sodium phosphate' . . . . . . . 50 . . mM . . . . 6934 1 3 'sodium chloride' . . . . . . . 50 . . mM . . . . 6934 1 4 DTT . . . . . . . 25 . . mM . . . . 6934 1 5 'sodium azide' . . . . . . . 0.02 . . % . . . . 6934 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 6934 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Wzb '[U-95% 15N]' . . 1 $Wzb_monomer . . 1 . . mM . . . . 6934 2 2 'sodium phosphate' . . . . . . . 50 . . mM . . . . 6934 2 3 'sodium chloride' . . . . . . . 50 . . mM . . . . 6934 2 4 DTT . . . . . . . 25 . . mM . . . . 6934 2 5 'sodium azide' . . . . . . . 0.02 . . % . . . . 6934 2 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6934 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6 0.1 pH 6934 1 temperature 298 0.2 K 6934 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 6934 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'equipped with triple-resonance probes and pulsed-field gradients' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 6934 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'with cryoprobe and equipped with triple-resonance probes and pulsed-field gradients' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6934 _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 1H-15N_HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6934 1 2 1H-13C_HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6934 1 3 HNCA no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6934 1 4 HNCO no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6934 1 5 HN(CA)CO no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6934 1 6 CBCACONH no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6934 1 7 HNCACB no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6934 1 8 CCH-TOCSY-HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6934 1 9 HCCH-TOCSY-HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6934 1 10 CCH-COSY-HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6934 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6934 _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 internal indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6934 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6934 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6934 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6934 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.15 _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 . 1H-15N_HSQC 1 $sample_1 isotropic 6934 1 . 1H-13C_HSQC 2 $sample_2 isotropic 6934 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 21 21 MET H H 1 8.260 0.01 . 1 . . . . 1 MET H . 6934 1 2 . 1 1 21 21 MET HA H 1 4.216 0.01 . 1 . . . . 1 MET HA . 6934 1 3 . 1 1 21 21 MET HB2 H 1 1.777 0.01 . 2 . . . . 1 MET HB1 . 6934 1 4 . 1 1 21 21 MET HB3 H 1 1.732 0.01 . 2 . . . . 1 MET HB2 . 6934 1 5 . 1 1 21 21 MET HG2 H 1 2.260 0.01 . 2 . . . . 1 MET HG1 . 6934 1 6 . 1 1 21 21 MET HG3 H 1 2.150 0.01 . 2 . . . . 1 MET HG2 . 6934 1 7 . 1 1 21 21 MET HE1 H 1 2.050 0.01 . 1 . . . . 1 MET HE . 6934 1 8 . 1 1 21 21 MET HE2 H 1 2.050 0.01 . 1 . . . . 1 MET HE . 6934 1 9 . 1 1 21 21 MET HE3 H 1 2.050 0.01 . 1 . . . . 1 MET HE . 6934 1 10 . 1 1 21 21 MET C C 13 175.343 0.2 . 1 . . . . 1 MET C . 6934 1 11 . 1 1 21 21 MET CA C 13 56.150 0.2 . 1 . . . . 1 MET CA . 6934 1 12 . 1 1 21 21 MET CB C 13 32.922 0.2 . 1 . . . . 1 MET CB . 6934 1 13 . 1 1 21 21 MET CG C 13 31.700 0.2 . 1 . . . . 1 MET CG . 6934 1 14 . 1 1 21 21 MET CE C 13 16.870 0.2 . 1 . . . . 1 MET CE . 6934 1 15 . 1 1 21 21 MET N N 15 120.844 0.15 . 1 . . . . 1 MET N . 6934 1 16 . 1 1 22 22 PHE H H 1 8.197 0.01 . 1 . . . . 2 PHE HN . 6934 1 17 . 1 1 22 22 PHE HA H 1 4.700 0.01 . 1 . . . . 2 PHE HA . 6934 1 18 . 1 1 22 22 PHE HB2 H 1 2.952 0.01 . 2 . . . . 2 PHE HB1 . 6934 1 19 . 1 1 22 22 PHE HB3 H 1 2.838 0.01 . 2 . . . . 2 PHE HB2 . 6934 1 20 . 1 1 22 22 PHE HD1 H 1 7.160 0.01 . 4 . . . . 2 PHE HD1 . 6934 1 21 . 1 1 22 22 PHE HE1 H 1 7.390 0.01 . 4 . . . . 2 PHE HE1 . 6934 1 22 . 1 1 22 22 PHE C C 13 173.553 0.2 . 1 . . . . 2 PHE C . 6934 1 23 . 1 1 22 22 PHE CA C 13 56.054 0.2 . 1 . . . . 2 PHE CA . 6934 1 24 . 1 1 22 22 PHE CB C 13 39.675 0.2 . 1 . . . . 2 PHE CB . 6934 1 25 . 1 1 22 22 PHE N N 15 119.458 0.15 . 1 . . . . 2 PHE N . 6934 1 26 . 1 1 23 23 ASN H H 1 8.764 0.01 . 1 . . . . 3 ASN HN . 6934 1 27 . 1 1 23 23 ASN HA H 1 4.957 0.01 . 1 . . . . 3 ASN HA . 6934 1 28 . 1 1 23 23 ASN HB2 H 1 2.731 0.01 . 1 . . . . 3 ASN HB1 . 6934 1 29 . 1 1 23 23 ASN HB3 H 1 2.731 0.01 . 1 . . . . 3 ASN HB2 . 6934 1 30 . 1 1 23 23 ASN HD21 H 1 7.687 0.01 . 2 . . . . 3 ASN HD21 . 6934 1 31 . 1 1 23 23 ASN HD22 H 1 6.839 0.01 . 2 . . . . 3 ASN HD22 . 6934 1 32 . 1 1 23 23 ASN C C 13 173.751 0.2 . 1 . . . . 3 ASN C . 6934 1 33 . 1 1 23 23 ASN CA C 13 55.076 0.2 . 1 . . . . 3 ASN CA . 6934 1 34 . 1 1 23 23 ASN CB C 13 41.761 0.2 . 1 . . . . 3 ASN CB . 6934 1 35 . 1 1 23 23 ASN N N 15 119.417 0.15 . 1 . . . . 3 ASN N . 6934 1 36 . 1 1 23 23 ASN ND2 N 15 114.100 0.15 . 1 . . . . 3 ASN ND2 . 6934 1 37 . 1 1 24 24 ASN H H 1 8.789 0.01 . 1 . . . . 4 ASN HN . 6934 1 38 . 1 1 24 24 ASN HA H 1 5.752 0.01 . 1 . . . . 4 ASN HA . 6934 1 39 . 1 1 24 24 ASN HB2 H 1 2.823 0.01 . 2 . . . . 4 ASN HB1 . 6934 1 40 . 1 1 24 24 ASN HB3 H 1 2.613 0.01 . 2 . . . . 4 ASN HB2 . 6934 1 41 . 1 1 24 24 ASN HD21 H 1 7.620 0.01 . 2 . . . . 4 ASN HD21 . 6934 1 42 . 1 1 24 24 ASN HD22 H 1 6.631 0.01 . 2 . . . . 4 ASN HD22 . 6934 1 43 . 1 1 24 24 ASN C C 13 174.195 0.2 . 1 . . . . 4 ASN C . 6934 1 44 . 1 1 24 24 ASN CA C 13 52.335 0.2 . 1 . . . . 4 ASN CA . 6934 1 45 . 1 1 24 24 ASN CB C 13 40.539 0.2 . 1 . . . . 4 ASN CB . 6934 1 46 . 1 1 24 24 ASN N N 15 118.982 0.15 . 1 . . . . 4 ASN N . 6934 1 47 . 1 1 24 24 ASN ND2 N 15 113.884 0.15 . 1 . . . . 4 ASN ND2 . 6934 1 48 . 1 1 25 25 ILE H H 1 9.604 0.01 . 1 . . . . 5 ILE HN . 6934 1 49 . 1 1 25 25 ILE HA H 1 4.889 0.01 . 1 . . . . 5 ILE HA . 6934 1 50 . 1 1 25 25 ILE HB H 1 1.852 0.01 . 1 . . . . 5 ILE HB . 6934 1 51 . 1 1 25 25 ILE HG12 H 1 1.365 0.01 . 2 . . . . 5 ILE HG11 . 6934 1 52 . 1 1 25 25 ILE HG13 H 1 1.185 0.01 . 2 . . . . 5 ILE HG12 . 6934 1 53 . 1 1 25 25 ILE HG21 H 1 0.519 0.01 . 1 . . . . 5 ILE HG2 . 6934 1 54 . 1 1 25 25 ILE HG22 H 1 0.519 0.01 . 1 . . . . 5 ILE HG2 . 6934 1 55 . 1 1 25 25 ILE HG23 H 1 0.519 0.01 . 1 . . . . 5 ILE HG2 . 6934 1 56 . 1 1 25 25 ILE HD11 H 1 0.695 0.01 . 1 . . . . 5 ILE HD1 . 6934 1 57 . 1 1 25 25 ILE HD12 H 1 0.695 0.01 . 1 . . . . 5 ILE HD1 . 6934 1 58 . 1 1 25 25 ILE HD13 H 1 0.695 0.01 . 1 . . . . 5 ILE HD1 . 6934 1 59 . 1 1 25 25 ILE C C 13 172.307 0.2 . 1 . . . . 5 ILE C . 6934 1 60 . 1 1 25 25 ILE CA C 13 59.684 0.2 . 1 . . . . 5 ILE CA . 6934 1 61 . 1 1 25 25 ILE CB C 13 40.679 0.2 . 1 . . . . 5 ILE CB . 6934 1 62 . 1 1 25 25 ILE CG1 C 13 28.020 0.2 . 1 . . . . 5 ILE CG1 . 6934 1 63 . 1 1 25 25 ILE CG2 C 13 16.900 0.2 . 1 . . . . 5 ILE CG2 . 6934 1 64 . 1 1 25 25 ILE CD1 C 13 13.550 0.2 . 1 . . . . 5 ILE CD1 . 6934 1 65 . 1 1 25 25 ILE N N 15 127.362 0.15 . 1 . . . . 5 ILE N . 6934 1 66 . 1 1 26 26 LEU H H 1 8.262 0.01 . 1 . . . . 6 LEU HN . 6934 1 67 . 1 1 26 26 LEU HA H 1 4.486 0.01 . 1 . . . . 6 LEU HA . 6934 1 68 . 1 1 26 26 LEU HB2 H 1 1.189 0.01 . 2 . . . . 6 LEU HB1 . 6934 1 69 . 1 1 26 26 LEU HB3 H 1 -0.430 0.01 . 2 . . . . 6 LEU HB2 . 6934 1 70 . 1 1 26 26 LEU HG H 1 0.880 0.01 . 1 . . . . 6 LEU HG . 6934 1 71 . 1 1 26 26 LEU HD11 H 1 0.320 0.01 . 2 . . . . 6 LEU HD1 . 6934 1 72 . 1 1 26 26 LEU HD12 H 1 0.320 0.01 . 2 . . . . 6 LEU HD1 . 6934 1 73 . 1 1 26 26 LEU HD13 H 1 0.320 0.01 . 2 . . . . 6 LEU HD1 . 6934 1 74 . 1 1 26 26 LEU HD21 H 1 0.070 0.01 . 2 . . . . 6 LEU HD2 . 6934 1 75 . 1 1 26 26 LEU HD22 H 1 0.070 0.01 . 2 . . . . 6 LEU HD2 . 6934 1 76 . 1 1 26 26 LEU HD23 H 1 0.070 0.01 . 2 . . . . 6 LEU HD2 . 6934 1 77 . 1 1 26 26 LEU C C 13 174.379 0.2 . 1 . . . . 6 LEU C . 6934 1 78 . 1 1 26 26 LEU CA C 13 51.822 0.2 . 1 . . . . 6 LEU CA . 6934 1 79 . 1 1 26 26 LEU CB C 13 43.326 0.2 . 1 . . . . 6 LEU CB . 6934 1 80 . 1 1 26 26 LEU CG C 13 26.020 0.2 . 1 . . . . 6 LEU CG . 6934 1 81 . 1 1 26 26 LEU CD1 C 13 25.850 0.2 . 2 . . . . 6 LEU CD1 . 6934 1 82 . 1 1 26 26 LEU CD2 C 13 21.400 0.2 . 2 . . . . 6 LEU CD2 . 6934 1 83 . 1 1 26 26 LEU N N 15 128.048 0.15 . 1 . . . . 6 LEU N . 6934 1 84 . 1 1 27 27 VAL H H 1 8.990 0.01 . 1 . . . . 7 VAL HN . 6934 1 85 . 1 1 27 27 VAL HA H 1 4.975 0.01 . 1 . . . . 7 VAL HA . 6934 1 86 . 1 1 27 27 VAL HB H 1 1.605 0.01 . 1 . . . . 7 VAL HB . 6934 1 87 . 1 1 27 27 VAL HG11 H 1 0.485 0.01 . 2 . . . . 7 VAL HG1 . 6934 1 88 . 1 1 27 27 VAL HG12 H 1 0.485 0.01 . 2 . . . . 7 VAL HG1 . 6934 1 89 . 1 1 27 27 VAL HG13 H 1 0.485 0.01 . 2 . . . . 7 VAL HG1 . 6934 1 90 . 1 1 27 27 VAL HG21 H 1 0.635 0.01 . 2 . . . . 7 VAL HG2 . 6934 1 91 . 1 1 27 27 VAL HG22 H 1 0.635 0.01 . 2 . . . . 7 VAL HG2 . 6934 1 92 . 1 1 27 27 VAL HG23 H 1 0.635 0.01 . 2 . . . . 7 VAL HG2 . 6934 1 93 . 1 1 27 27 VAL C C 13 175.351 0.2 . 1 . . . . 7 VAL C . 6934 1 94 . 1 1 27 27 VAL CA C 13 60.236 0.2 . 1 . . . . 7 VAL CA . 6934 1 95 . 1 1 27 27 VAL CB C 13 32.134 0.2 . 1 . . . . 7 VAL CB . 6934 1 96 . 1 1 27 27 VAL CG1 C 13 22.800 0.2 . 2 . . . . 7 VAL CG1 . 6934 1 97 . 1 1 27 27 VAL CG2 C 13 20.710 0.2 . 2 . . . . 7 VAL CG2 . 6934 1 98 . 1 1 27 27 VAL N N 15 126.786 0.15 . 1 . . . . 7 VAL N . 6934 1 99 . 1 1 28 28 VAL H H 1 8.968 0.01 . 1 . . . . 8 VAL HN . 6934 1 100 . 1 1 28 28 VAL HA H 1 5.255 0.01 . 1 . . . . 8 VAL HA . 6934 1 101 . 1 1 28 28 VAL HB H 1 1.552 0.01 . 1 . . . . 8 VAL HB . 6934 1 102 . 1 1 28 28 VAL HG11 H 1 0.842 0.01 . 2 . . . . 8 VAL HG1 . 6934 1 103 . 1 1 28 28 VAL HG12 H 1 0.842 0.01 . 2 . . . . 8 VAL HG1 . 6934 1 104 . 1 1 28 28 VAL HG13 H 1 0.842 0.01 . 2 . . . . 8 VAL HG1 . 6934 1 105 . 1 1 28 28 VAL HG21 H 1 0.583 0.01 . 2 . . . . 8 VAL HG2 . 6934 1 106 . 1 1 28 28 VAL HG22 H 1 0.583 0.01 . 2 . . . . 8 VAL HG2 . 6934 1 107 . 1 1 28 28 VAL HG23 H 1 0.583 0.01 . 2 . . . . 8 VAL HG2 . 6934 1 108 . 1 1 28 28 VAL C C 13 175.946 0.2 . 1 . . . . 8 VAL C . 6934 1 109 . 1 1 28 28 VAL CA C 13 60.956 0.2 . 1 . . . . 8 VAL CA . 6934 1 110 . 1 1 28 28 VAL CB C 13 36.293 0.2 . 1 . . . . 8 VAL CB . 6934 1 111 . 1 1 28 28 VAL CG1 C 13 21.670 0.2 . 2 . . . . 8 VAL CG1 . 6934 1 112 . 1 1 28 28 VAL CG2 C 13 23.540 0.2 . 2 . . . . 8 VAL CG2 . 6934 1 113 . 1 1 28 28 VAL N N 15 125.073 0.15 . 1 . . . . 8 VAL N . 6934 1 114 . 1 1 29 29 CYS H H 1 7.676 0.01 . 1 . . . . 9 CYS HN . 6934 1 115 . 1 1 29 29 CYS HA H 1 4.806 0.01 . 1 . . . . 9 CYS HA . 6934 1 116 . 1 1 29 29 CYS HB2 H 1 3.560 0.01 . 2 . . . . 9 CYS HB1 . 6934 1 117 . 1 1 29 29 CYS HB3 H 1 3.048 0.01 . 2 . . . . 9 CYS HB2 . 6934 1 118 . 1 1 29 29 CYS C C 13 173.602 0.2 . 1 . . . . 9 CYS C . 6934 1 119 . 1 1 29 29 CYS CA C 13 57.491 0.2 . 1 . . . . 9 CYS CA . 6934 1 120 . 1 1 29 29 CYS CB C 13 31.426 0.2 . 1 . . . . 9 CYS CB . 6934 1 121 . 1 1 29 29 CYS N N 15 125.751 0.15 . 1 . . . . 9 CYS N . 6934 1 122 . 1 1 30 30 VAL H H 1 8.435 0.01 . 1 . . . . 10 VAL HN . 6934 1 123 . 1 1 30 30 VAL HA H 1 3.785 0.01 . 1 . . . . 10 VAL HA . 6934 1 124 . 1 1 30 30 VAL HB H 1 2.265 0.01 . 1 . . . . 10 VAL HB . 6934 1 125 . 1 1 30 30 VAL HG11 H 1 0.870 0.01 . 2 . . . . 10 VAL HG1 . 6934 1 126 . 1 1 30 30 VAL HG12 H 1 0.870 0.01 . 2 . . . . 10 VAL HG1 . 6934 1 127 . 1 1 30 30 VAL HG13 H 1 0.870 0.01 . 2 . . . . 10 VAL HG1 . 6934 1 128 . 1 1 30 30 VAL HG21 H 1 0.896 0.01 . 2 . . . . 10 VAL HG2 . 6934 1 129 . 1 1 30 30 VAL HG22 H 1 0.896 0.01 . 2 . . . . 10 VAL HG2 . 6934 1 130 . 1 1 30 30 VAL HG23 H 1 0.896 0.01 . 2 . . . . 10 VAL HG2 . 6934 1 131 . 1 1 30 30 VAL C C 13 176.849 0.2 . 1 . . . . 10 VAL C . 6934 1 132 . 1 1 30 30 VAL CA C 13 66.550 0.2 . 1 . . . . 10 VAL CA . 6934 1 133 . 1 1 30 30 VAL CB C 13 31.550 0.2 . 1 . . . . 10 VAL CB . 6934 1 134 . 1 1 30 30 VAL CG1 C 13 21.130 0.2 . 2 . . . . 10 VAL CG1 . 6934 1 135 . 1 1 30 30 VAL CG2 C 13 22.600 0.2 . 2 . . . . 10 VAL CG2 . 6934 1 136 . 1 1 30 30 VAL N N 15 121.566 0.15 . 1 . . . . 10 VAL N . 6934 1 137 . 1 1 31 31 GLY H H 1 8.910 0.01 . 1 . . . . 11 GLY HN . 6934 1 138 . 1 1 31 31 GLY HA2 H 1 4.086 0.01 . 2 . . . . 11 GLY HA1 . 6934 1 139 . 1 1 31 31 GLY HA3 H 1 3.720 0.01 . 2 . . . . 11 GLY HA2 . 6934 1 140 . 1 1 31 31 GLY C C 13 174.345 0.2 . 1 . . . . 11 GLY C . 6934 1 141 . 1 1 31 31 GLY CA C 13 47.137 0.2 . 1 . . . . 11 GLY CA . 6934 1 142 . 1 1 31 31 GLY N N 15 107.372 0.15 . 1 . . . . 11 GLY N . 6934 1 143 . 1 1 32 32 ASN H H 1 8.746 0.01 . 1 . . . . 12 ASN HN . 6934 1 144 . 1 1 32 32 ASN HA H 1 3.864 0.01 . 1 . . . . 12 ASN HA . 6934 1 145 . 1 1 32 32 ASN HB2 H 1 3.190 0.01 . 2 . . . . 12 ASN HB1 . 6934 1 146 . 1 1 32 32 ASN HB3 H 1 1.937 0.01 . 2 . . . . 12 ASN HB2 . 6934 1 147 . 1 1 32 32 ASN HD21 H 1 7.136 0.01 . 1 . . . . 12 ASN HD21 . 6934 1 148 . 1 1 32 32 ASN HD22 H 1 7.136 0.01 . 1 . . . . 12 ASN HD22 . 6934 1 149 . 1 1 32 32 ASN CA C 13 54.547 0.2 . 1 . . . . 12 ASN CA . 6934 1 150 . 1 1 32 32 ASN CB C 13 40.300 0.2 . 1 . . . . 12 ASN CB . 6934 1 151 . 1 1 32 32 ASN N N 15 116.984 0.15 . 1 . . . . 12 ASN N . 6934 1 152 . 1 1 32 32 ASN ND2 N 15 106.900 0.15 . 1 . . . . 12 ASN ND2 . 6934 1 153 . 1 1 33 33 ILE HA H 1 4.590 0.01 . 1 . . . . 13 ILE HA . 6934 1 154 . 1 1 33 33 ILE HB H 1 2.140 0.01 . 1 . . . . 13 ILE HB . 6934 1 155 . 1 1 33 33 ILE HG12 H 1 1.670 0.01 . 2 . . . . 13 ILE HG11 . 6934 1 156 . 1 1 33 33 ILE HG13 H 1 0.815 0.01 . 2 . . . . 13 ILE HG12 . 6934 1 157 . 1 1 33 33 ILE HG21 H 1 0.930 0.01 . 1 . . . . 13 ILE HG2 . 6934 1 158 . 1 1 33 33 ILE HG22 H 1 0.930 0.01 . 1 . . . . 13 ILE HG2 . 6934 1 159 . 1 1 33 33 ILE HG23 H 1 0.930 0.01 . 1 . . . . 13 ILE HG2 . 6934 1 160 . 1 1 33 33 ILE HD11 H 1 0.640 0.01 . 1 . . . . 13 ILE HD1 . 6934 1 161 . 1 1 33 33 ILE HD12 H 1 0.640 0.01 . 1 . . . . 13 ILE HD1 . 6934 1 162 . 1 1 33 33 ILE HD13 H 1 0.640 0.01 . 1 . . . . 13 ILE HD1 . 6934 1 163 . 1 1 33 33 ILE CA C 13 63.200 0.2 . 1 . . . . 13 ILE CA . 6934 1 164 . 1 1 33 33 ILE CB C 13 41.300 0.2 . 1 . . . . 13 ILE CB . 6934 1 165 . 1 1 33 33 ILE CG1 C 13 26.500 0.2 . 1 . . . . 13 ILE CG1 . 6934 1 166 . 1 1 33 33 ILE CG2 C 13 19.490 0.2 . 1 . . . . 13 ILE CG2 . 6934 1 167 . 1 1 33 33 ILE CD1 C 13 15.434 0.2 . 1 . . . . 13 ILE CD1 . 6934 1 168 . 1 1 34 34 CYS H H 1 8.160 0.01 . 1 . . . . 14 CYS HN . 6934 1 169 . 1 1 34 34 CYS HA H 1 4.820 0.01 . 1 . . . . 14 CYS HA . 6934 1 170 . 1 1 34 34 CYS HB2 H 1 4.120 0.01 . 2 . . . . 14 CYS HB1 . 6934 1 171 . 1 1 34 34 CYS HB3 H 1 3.175 0.01 . 2 . . . . 14 CYS HB2 . 6934 1 172 . 1 1 34 34 CYS C C 13 176.660 0.2 . 1 . . . . 14 CYS C . 6934 1 173 . 1 1 34 34 CYS CA C 13 59.800 0.2 . 1 . . . . 14 CYS CA . 6934 1 174 . 1 1 34 34 CYS CB C 13 27.800 0.2 . 1 . . . . 14 CYS CB . 6934 1 175 . 1 1 34 34 CYS N N 15 118.600 0.15 . 1 . . . . 14 CYS N . 6934 1 176 . 1 1 35 35 ARG H H 1 10.401 0.01 . 1 . . . . 15 ARG HN . 6934 1 177 . 1 1 35 35 ARG HA H 1 3.830 0.01 . 1 . . . . 15 ARG HA . 6934 1 178 . 1 1 35 35 ARG HB2 H 1 2.220 0.01 . 2 . . . . 15 ARG HB1 . 6934 1 179 . 1 1 35 35 ARG HB3 H 1 2.050 0.01 . 2 . . . . 15 ARG HB2 . 6934 1 180 . 1 1 35 35 ARG HG2 H 1 1.590 0.01 . 2 . . . . 15 ARG HG1 . 6934 1 181 . 1 1 35 35 ARG HG3 H 1 1.880 0.01 . 2 . . . . 15 ARG HG2 . 6934 1 182 . 1 1 35 35 ARG HD2 H 1 3.000 0.01 . 1 . . . . 15 ARG HD1 . 6934 1 183 . 1 1 35 35 ARG HD3 H 1 3.000 0.01 . 1 . . . . 15 ARG HD2 . 6934 1 184 . 1 1 35 35 ARG C C 13 177.610 0.2 . 1 . . . . 15 ARG C . 6934 1 185 . 1 1 35 35 ARG CA C 13 60.880 0.2 . 1 . . . . 15 ARG CA . 6934 1 186 . 1 1 35 35 ARG CB C 13 30.400 0.2 . 1 . . . . 15 ARG CB . 6934 1 187 . 1 1 35 35 ARG CG C 13 27.100 0.2 . 1 . . . . 15 ARG CG . 6934 1 188 . 1 1 35 35 ARG CD C 13 42.120 0.2 . 1 . . . . 15 ARG CD . 6934 1 189 . 1 1 35 35 ARG N N 15 125.284 0.15 . 1 . . . . 15 ARG N . 6934 1 190 . 1 1 35 35 ARG NE N 15 114.000 0.15 . 1 . . . . 15 ARG NE . 6934 1 191 . 1 1 36 36 SER H H 1 9.905 0.01 . 1 . . . . 16 SER HN . 6934 1 192 . 1 1 36 36 SER HA H 1 3.770 0.01 . 1 . . . . 16 SER HA . 6934 1 193 . 1 1 36 36 SER HB2 H 1 3.625 0.01 . 2 . . . . 16 SER HB1 . 6934 1 194 . 1 1 36 36 SER HB3 H 1 3.810 0.01 . 2 . . . . 16 SER HB2 . 6934 1 195 . 1 1 36 36 SER CA C 13 64.500 0.2 . 1 . . . . 16 SER CA . 6934 1 196 . 1 1 36 36 SER CB C 13 62.500 0.2 . 1 . . . . 16 SER CB . 6934 1 197 . 1 1 36 36 SER N N 15 117.390 0.15 . 1 . . . . 16 SER N . 6934 1 198 . 1 1 37 37 PRO HA H 1 4.010 0.01 . 1 . . . . 17 PRO HA . 6934 1 199 . 1 1 37 37 PRO HB2 H 1 0.500 0.01 . 2 . . . . 17 PRO HB1 . 6934 1 200 . 1 1 37 37 PRO HB3 H 1 0.960 0.01 . 2 . . . . 17 PRO HB2 . 6934 1 201 . 1 1 37 37 PRO HG2 H 1 0.865 0.01 . 2 . . . . 17 PRO HG1 . 6934 1 202 . 1 1 37 37 PRO HG3 H 1 1.220 0.01 . 2 . . . . 17 PRO HG2 . 6934 1 203 . 1 1 37 37 PRO HD2 H 1 3.195 0.01 . 2 . . . . 17 PRO HD1 . 6934 1 204 . 1 1 37 37 PRO HD3 H 1 3.290 0.01 . 2 . . . . 17 PRO HD2 . 6934 1 205 . 1 1 37 37 PRO C C 13 177.541 0.2 . 1 . . . . 17 PRO C . 6934 1 206 . 1 1 37 37 PRO CA C 13 65.027 0.2 . 1 . . . . 17 PRO CA . 6934 1 207 . 1 1 37 37 PRO CB C 13 28.425 0.2 . 1 . . . . 17 PRO CB . 6934 1 208 . 1 1 37 37 PRO CG C 13 27.670 0.2 . 1 . . . . 17 PRO CG . 6934 1 209 . 1 1 37 37 PRO CD C 13 49.200 0.2 . 1 . . . . 17 PRO CD . 6934 1 210 . 1 1 38 38 THR H H 1 6.292 0.01 . 1 . . . . 18 THR HN . 6934 1 211 . 1 1 38 38 THR HA H 1 3.690 0.01 . 1 . . . . 18 THR HA . 6934 1 212 . 1 1 38 38 THR HB H 1 4.224 0.01 . 1 . . . . 18 THR HB . 6934 1 213 . 1 1 38 38 THR HG21 H 1 1.130 0.01 . 1 . . . . 18 THR HG2 . 6934 1 214 . 1 1 38 38 THR HG22 H 1 1.130 0.01 . 1 . . . . 18 THR HG2 . 6934 1 215 . 1 1 38 38 THR HG23 H 1 1.130 0.01 . 1 . . . . 18 THR HG2 . 6934 1 216 . 1 1 38 38 THR C C 13 174.574 0.2 . 1 . . . . 18 THR C . 6934 1 217 . 1 1 38 38 THR CA C 13 67.390 0.2 . 1 . . . . 18 THR CA . 6934 1 218 . 1 1 38 38 THR CB C 13 68.296 0.2 . 1 . . . . 18 THR CB . 6934 1 219 . 1 1 38 38 THR CG2 C 13 22.000 0.2 . 1 . . . . 18 THR CG2 . 6934 1 220 . 1 1 38 38 THR N N 15 111.262 0.15 . 1 . . . . 18 THR N . 6934 1 221 . 1 1 39 39 ALA H H 1 8.028 0.01 . 1 . . . . 19 ALA HN . 6934 1 222 . 1 1 39 39 ALA HA H 1 3.605 0.01 . 1 . . . . 19 ALA HA . 6934 1 223 . 1 1 39 39 ALA HB1 H 1 0.648 0.01 . 1 . . . . 19 ALA HB . 6934 1 224 . 1 1 39 39 ALA HB2 H 1 0.648 0.01 . 1 . . . . 19 ALA HB . 6934 1 225 . 1 1 39 39 ALA HB3 H 1 0.648 0.01 . 1 . . . . 19 ALA HB . 6934 1 226 . 1 1 39 39 ALA C C 13 177.508 0.2 . 1 . . . . 19 ALA C . 6934 1 227 . 1 1 39 39 ALA CA C 13 55.066 0.2 . 1 . . . . 19 ALA CA . 6934 1 228 . 1 1 39 39 ALA CB C 13 20.460 0.2 . 1 . . . . 19 ALA CB . 6934 1 229 . 1 1 39 39 ALA N N 15 121.810 0.15 . 1 . . . . 19 ALA N . 6934 1 230 . 1 1 40 40 GLU H H 1 8.587 0.01 . 1 . . . . 20 GLU HN . 6934 1 231 . 1 1 40 40 GLU HA H 1 3.655 0.01 . 1 . . . . 20 GLU HA . 6934 1 232 . 1 1 40 40 GLU HB2 H 1 1.910 0.01 . 2 . . . . 20 GLU HB1 . 6934 1 233 . 1 1 40 40 GLU HB3 H 1 2.101 0.01 . 2 . . . . 20 GLU HB2 . 6934 1 234 . 1 1 40 40 GLU HG2 H 1 1.800 0.01 . 2 . . . . 20 GLU HG1 . 6934 1 235 . 1 1 40 40 GLU HG3 H 1 1.914 0.01 . 2 . . . . 20 GLU HG2 . 6934 1 236 . 1 1 40 40 GLU C C 13 177.148 0.2 . 1 . . . . 20 GLU C . 6934 1 237 . 1 1 40 40 GLU CA C 13 58.858 0.2 . 1 . . . . 20 GLU CA . 6934 1 238 . 1 1 40 40 GLU CB C 13 30.488 0.2 . 1 . . . . 20 GLU CB . 6934 1 239 . 1 1 40 40 GLU CG C 13 35.600 0.2 . 1 . . . . 20 GLU CG . 6934 1 240 . 1 1 40 40 GLU N N 15 117.627 0.15 . 1 . . . . 20 GLU N . 6934 1 241 . 1 1 41 41 ARG H H 1 7.310 0.01 . 1 . . . . 21 ARG HN . 6934 1 242 . 1 1 41 41 ARG HA H 1 4.081 0.01 . 1 . . . . 21 ARG HA . 6934 1 243 . 1 1 41 41 ARG HB2 H 1 1.912 0.01 . 2 . . . . 21 ARG HB1 . 6934 1 244 . 1 1 41 41 ARG HB3 H 1 1.760 0.01 . 2 . . . . 21 ARG HB2 . 6934 1 245 . 1 1 41 41 ARG HG2 H 1 1.860 0.01 . 2 . . . . 21 ARG HG1 . 6934 1 246 . 1 1 41 41 ARG HG3 H 1 2.000 0.01 . 2 . . . . 21 ARG HG2 . 6934 1 247 . 1 1 41 41 ARG HD2 H 1 3.165 0.01 . 2 . . . . 21 ARG HD1 . 6934 1 248 . 1 1 41 41 ARG HD3 H 1 3.290 0.01 . 2 . . . . 21 ARG HD2 . 6934 1 249 . 1 1 41 41 ARG HE H 1 7.390 0.01 . 1 . . . . 21 ARG HE . 6934 1 250 . 1 1 41 41 ARG HH11 H 1 6.760 0.01 . 4 . . . . 21 ARG HH11 . 6934 1 251 . 1 1 41 41 ARG HH12 H 1 6.760 0.01 . 4 . . . . 21 ARG HH12 . 6934 1 252 . 1 1 41 41 ARG C C 13 179.943 0.2 . 1 . . . . 21 ARG C . 6934 1 253 . 1 1 41 41 ARG CA C 13 56.716 0.2 . 1 . . . . 21 ARG CA . 6934 1 254 . 1 1 41 41 ARG CB C 13 28.064 0.2 . 1 . . . . 21 ARG CB . 6934 1 255 . 1 1 41 41 ARG CG C 13 27.300 0.2 . 1 . . . . 21 ARG CG . 6934 1 256 . 1 1 41 41 ARG CD C 13 41.400 0.2 . 1 . . . . 21 ARG CD . 6934 1 257 . 1 1 41 41 ARG N N 15 114.375 0.15 . 1 . . . . 21 ARG N . 6934 1 258 . 1 1 41 41 ARG NE N 15 115.200 0.15 . 1 . . . . 21 ARG NE . 6934 1 259 . 1 1 42 42 LEU H H 1 8.175 0.01 . 1 . . . . 22 LEU HN . 6934 1 260 . 1 1 42 42 LEU HA H 1 3.890 0.01 . 1 . . . . 22 LEU HA . 6934 1 261 . 1 1 42 42 LEU HB2 H 1 1.126 0.01 . 1 . . . . 22 LEU HB1 . 6934 1 262 . 1 1 42 42 LEU HB3 H 1 1.965 0.01 . 1 . . . . 22 LEU HB2 . 6934 1 263 . 1 1 42 42 LEU HG H 1 1.690 0.01 . 1 . . . . 22 LEU HG . 6934 1 264 . 1 1 42 42 LEU HD11 H 1 0.970 0.01 . 2 . . . . 22 LEU HD1 . 6934 1 265 . 1 1 42 42 LEU HD12 H 1 0.970 0.01 . 2 . . . . 22 LEU HD1 . 6934 1 266 . 1 1 42 42 LEU HD13 H 1 0.970 0.01 . 2 . . . . 22 LEU HD1 . 6934 1 267 . 1 1 42 42 LEU HD21 H 1 0.375 0.01 . 2 . . . . 22 LEU HD2 . 6934 1 268 . 1 1 42 42 LEU HD22 H 1 0.375 0.01 . 2 . . . . 22 LEU HD2 . 6934 1 269 . 1 1 42 42 LEU HD23 H 1 0.375 0.01 . 2 . . . . 22 LEU HD2 . 6934 1 270 . 1 1 42 42 LEU CA C 13 58.032 0.2 . 1 . . . . 22 LEU CA . 6934 1 271 . 1 1 42 42 LEU CB C 13 43.828 0.2 . 1 . . . . 22 LEU CB . 6934 1 272 . 1 1 42 42 LEU CG C 13 26.200 0.2 . 1 . . . . 22 LEU CG . 6934 1 273 . 1 1 42 42 LEU CD1 C 13 23.900 0.2 . 2 . . . . 22 LEU CD1 . 6934 1 274 . 1 1 42 42 LEU CD2 C 13 25.700 0.2 . 2 . . . . 22 LEU CD2 . 6934 1 275 . 1 1 42 42 LEU N N 15 122.253 0.15 . 1 . . . . 22 LEU N . 6934 1 276 . 1 1 43 43 LEU H H 1 8.487 0.01 . 1 . . . . 23 LEU HN . 6934 1 277 . 1 1 43 43 LEU HA H 1 4.285 0.01 . 1 . . . . 23 LEU HA . 6934 1 278 . 1 1 43 43 LEU HB2 H 1 1.735 0.01 . 2 . . . . 23 LEU HB1 . 6934 1 279 . 1 1 43 43 LEU HB3 H 1 1.820 0.01 . 2 . . . . 23 LEU HB2 . 6934 1 280 . 1 1 43 43 LEU HD11 H 1 0.898 0.01 . 2 . . . . 23 LEU HD1 . 6934 1 281 . 1 1 43 43 LEU HD12 H 1 0.898 0.01 . 2 . . . . 23 LEU HD1 . 6934 1 282 . 1 1 43 43 LEU HD13 H 1 0.898 0.01 . 2 . . . . 23 LEU HD1 . 6934 1 283 . 1 1 43 43 LEU HD21 H 1 1.020 0.01 . 2 . . . . 23 LEU HD2 . 6934 1 284 . 1 1 43 43 LEU HD22 H 1 1.020 0.01 . 2 . . . . 23 LEU HD2 . 6934 1 285 . 1 1 43 43 LEU HD23 H 1 1.020 0.01 . 2 . . . . 23 LEU HD2 . 6934 1 286 . 1 1 43 43 LEU C C 13 178.312 0.2 . 1 . . . . 23 LEU C . 6934 1 287 . 1 1 43 43 LEU CA C 13 58.427 0.2 . 1 . . . . 23 LEU CA . 6934 1 288 . 1 1 43 43 LEU CB C 13 42.369 0.2 . 1 . . . . 23 LEU CB . 6934 1 289 . 1 1 43 43 LEU CG C 13 27.800 0.2 . 1 . . . . 23 LEU CG . 6934 1 290 . 1 1 43 43 LEU CD1 C 13 24.500 0.2 . 2 . . . . 23 LEU CD1 . 6934 1 291 . 1 1 43 43 LEU CD2 C 13 24.666 0.2 . 2 . . . . 23 LEU CD2 . 6934 1 292 . 1 1 43 43 LEU N N 15 118.368 0.15 . 1 . . . . 23 LEU N . 6934 1 293 . 1 1 44 44 GLN H H 1 8.096 0.01 . 1 . . . . 24 GLN HN . 6934 1 294 . 1 1 44 44 GLN HA H 1 4.060 0.01 . 1 . . . . 24 GLN HA . 6934 1 295 . 1 1 44 44 GLN HB2 H 1 2.045 0.01 . 2 . . . . 24 GLN HB1 . 6934 1 296 . 1 1 44 44 GLN HB3 H 1 2.180 0.01 . 2 . . . . 24 GLN HB2 . 6934 1 297 . 1 1 44 44 GLN HG2 H 1 2.605 0.01 . 1 . . . . 24 GLN HG1 . 6934 1 298 . 1 1 44 44 GLN HG3 H 1 2.605 0.01 . 1 . . . . 24 GLN HG2 . 6934 1 299 . 1 1 44 44 GLN HE21 H 1 7.210 0.01 . 2 . . . . 24 GLN HE21 . 6934 1 300 . 1 1 44 44 GLN HE22 H 1 7.210 0.01 . 2 . . . . 24 GLN HE22 . 6934 1 301 . 1 1 44 44 GLN C C 13 178.069 0.2 . 1 . . . . 24 GLN C . 6934 1 302 . 1 1 44 44 GLN CA C 13 57.848 0.2 . 1 . . . . 24 GLN CA . 6934 1 303 . 1 1 44 44 GLN CB C 13 29.177 0.2 . 1 . . . . 24 GLN CB . 6934 1 304 . 1 1 44 44 GLN CG C 13 34.000 0.2 . 1 . . . . 24 GLN CG . 6934 1 305 . 1 1 44 44 GLN N N 15 116.306 0.15 . 1 . . . . 24 GLN N . 6934 1 306 . 1 1 44 44 GLN NE2 N 15 114.140 0.15 . 1 . . . . 24 GLN NE2 . 6934 1 307 . 1 1 45 45 ARG H H 1 7.340 0.01 . 1 . . . . 25 ARG HN . 6934 1 308 . 1 1 45 45 ARG HA H 1 4.030 0.01 . 1 . . . . 25 ARG HA . 6934 1 309 . 1 1 45 45 ARG HB2 H 1 1.850 0.01 . 1 . . . . 25 ARG HB1 . 6934 1 310 . 1 1 45 45 ARG HB3 H 1 1.850 0.01 . 1 . . . . 25 ARG HB2 . 6934 1 311 . 1 1 45 45 ARG HG2 H 1 1.530 0.01 . 2 . . . . 25 ARG HG1 . 6934 1 312 . 1 1 45 45 ARG HG3 H 1 1.260 0.01 . 2 . . . . 25 ARG HG2 . 6934 1 313 . 1 1 45 45 ARG HD2 H 1 3.085 0.01 . 2 . . . . 25 ARG HD1 . 6934 1 314 . 1 1 45 45 ARG HD3 H 1 2.860 0.01 . 2 . . . . 25 ARG HD2 . 6934 1 315 . 1 1 45 45 ARG HE H 1 7.180 0.01 . 1 . . . . 25 ARG HE . 6934 1 316 . 1 1 45 45 ARG C C 13 178.065 0.2 . 1 . . . . 25 ARG C . 6934 1 317 . 1 1 45 45 ARG CA C 13 58.552 0.2 . 1 . . . . 25 ARG CA . 6934 1 318 . 1 1 45 45 ARG CB C 13 29.930 0.2 . 1 . . . . 25 ARG CB . 6934 1 319 . 1 1 45 45 ARG CG C 13 25.700 0.2 . 1 . . . . 25 ARG CG . 6934 1 320 . 1 1 45 45 ARG CD C 13 44.400 0.2 . 1 . . . . 25 ARG CD . 6934 1 321 . 1 1 45 45 ARG N N 15 117.423 0.15 . 1 . . . . 25 ARG N . 6934 1 322 . 1 1 45 45 ARG NE N 15 114.850 0.15 . 1 . . . . 25 ARG NE . 6934 1 323 . 1 1 46 46 TYR H H 1 7.369 0.01 . 1 . . . . 26 TYR HN . 6934 1 324 . 1 1 46 46 TYR HA H 1 4.585 0.01 . 1 . . . . 26 TYR HA . 6934 1 325 . 1 1 46 46 TYR HB2 H 1 3.225 0.01 . 2 . . . . 26 TYR HB1 . 6934 1 326 . 1 1 46 46 TYR HB3 H 1 2.760 0.01 . 2 . . . . 26 TYR HB2 . 6934 1 327 . 1 1 46 46 TYR HD1 H 1 7.120 0.01 . 3 . . . . 26 TYR HD1 . 6934 1 328 . 1 1 46 46 TYR HE1 H 1 6.810 0.01 . 3 . . . . 26 TYR HE1 . 6934 1 329 . 1 1 46 46 TYR C C 13 176.193 0.2 . 1 . . . . 26 TYR C . 6934 1 330 . 1 1 46 46 TYR CA C 13 59.000 0.2 . 1 . . . . 26 TYR CA . 6934 1 331 . 1 1 46 46 TYR CB C 13 39.743 0.2 . 1 . . . . 26 TYR CB . 6934 1 332 . 1 1 46 46 TYR N N 15 115.171 0.15 . 1 . . . . 26 TYR N . 6934 1 333 . 1 1 47 47 HIS H H 1 8.276 0.01 . 1 . . . . 27 HIS HN . 6934 1 334 . 1 1 47 47 HIS HA H 1 5.265 0.01 . 1 . . . . 27 HIS HA . 6934 1 335 . 1 1 47 47 HIS HB2 H 1 2.710 0.01 . 2 . . . . 27 HIS HB1 . 6934 1 336 . 1 1 47 47 HIS HB3 H 1 3.390 0.01 . 2 . . . . 27 HIS HB2 . 6934 1 337 . 1 1 47 47 HIS HD2 H 1 6.810 0.01 . 1 . . . . 27 HIS HD2 . 6934 1 338 . 1 1 47 47 HIS HE1 H 1 8.430 0.01 . 1 . . . . 27 HIS HE1 . 6934 1 339 . 1 1 47 47 HIS C C 13 176.193 0.2 . 1 . . . . 27 HIS C . 6934 1 340 . 1 1 47 47 HIS CA C 13 53.964 0.2 . 1 . . . . 27 HIS CA . 6934 1 341 . 1 1 47 47 HIS CB C 13 30.642 0.2 . 1 . . . . 27 HIS CB . 6934 1 342 . 1 1 47 47 HIS N N 15 118.595 0.15 . 1 . . . . 27 HIS N . 6934 1 343 . 1 1 48 48 PRO HA H 1 4.664 0.01 . 1 . . . . 28 PRO HA . 6934 1 344 . 1 1 48 48 PRO HB2 H 1 2.511 0.01 . 2 . . . . 28 PRO HB1 . 6934 1 345 . 1 1 48 48 PRO HB3 H 1 2.080 0.01 . 2 . . . . 28 PRO HB2 . 6934 1 346 . 1 1 48 48 PRO HG2 H 1 2.090 0.01 . 1 . . . . 28 PRO HG1 . 6934 1 347 . 1 1 48 48 PRO HG3 H 1 2.090 0.01 . 1 . . . . 28 PRO HG2 . 6934 1 348 . 1 1 48 48 PRO HD2 H 1 3.495 0.01 . 2 . . . . 28 PRO HD1 . 6934 1 349 . 1 1 48 48 PRO HD3 H 1 3.791 0.01 . 2 . . . . 28 PRO HD2 . 6934 1 350 . 1 1 48 48 PRO C C 13 176.769 0.2 . 1 . . . . 28 PRO C . 6934 1 351 . 1 1 48 48 PRO CA C 13 64.459 0.2 . 1 . . . . 28 PRO CA . 6934 1 352 . 1 1 48 48 PRO CB C 13 32.280 0.2 . 1 . . . . 28 PRO CB . 6934 1 353 . 1 1 48 48 PRO CG C 13 27.100 0.2 . 1 . . . . 28 PRO CG . 6934 1 354 . 1 1 48 48 PRO CD C 13 50.600 0.2 . 1 . . . . 28 PRO CD . 6934 1 355 . 1 1 49 49 GLU H H 1 9.290 0.01 . 1 . . . . 29 GLU HN . 6934 1 356 . 1 1 49 49 GLU HA H 1 4.459 0.01 . 1 . . . . 29 GLU HA . 6934 1 357 . 1 1 49 49 GLU HB2 H 1 2.093 0.01 . 2 . . . . 29 GLU HB1 . 6934 1 358 . 1 1 49 49 GLU HB3 H 1 2.209 0.01 . 2 . . . . 29 GLU HB2 . 6934 1 359 . 1 1 49 49 GLU HG2 H 1 2.300 0.01 . 2 . . . . 29 GLU HG1 . 6934 1 360 . 1 1 49 49 GLU HG3 H 1 2.555 0.01 . 2 . . . . 29 GLU HG2 . 6934 1 361 . 1 1 49 49 GLU C C 13 176.491 0.2 . 1 . . . . 29 GLU C . 6934 1 362 . 1 1 49 49 GLU CA C 13 56.670 0.2 . 1 . . . . 29 GLU CA . 6934 1 363 . 1 1 49 49 GLU CB C 13 29.155 0.2 . 1 . . . . 29 GLU CB . 6934 1 364 . 1 1 49 49 GLU CG C 13 35.600 0.2 . 1 . . . . 29 GLU CG . 6934 1 365 . 1 1 49 49 GLU N N 15 118.285 0.15 . 1 . . . . 29 GLU N . 6934 1 366 . 1 1 50 50 LEU H H 1 7.462 0.01 . 1 . . . . 30 LEU HN . 6934 1 367 . 1 1 50 50 LEU HA H 1 4.582 0.01 . 1 . . . . 30 LEU HA . 6934 1 368 . 1 1 50 50 LEU HB2 H 1 1.581 0.01 . 2 . . . . 30 LEU HB1 . 6934 1 369 . 1 1 50 50 LEU HB3 H 1 1.396 0.01 . 2 . . . . 30 LEU HB2 . 6934 1 370 . 1 1 50 50 LEU HD11 H 1 0.690 0.01 . 2 . . . . 30 LEU HD1 . 6934 1 371 . 1 1 50 50 LEU HD12 H 1 0.690 0.01 . 2 . . . . 30 LEU HD1 . 6934 1 372 . 1 1 50 50 LEU HD13 H 1 0.690 0.01 . 2 . . . . 30 LEU HD1 . 6934 1 373 . 1 1 50 50 LEU HD21 H 1 0.830 0.01 . 2 . . . . 30 LEU HD2 . 6934 1 374 . 1 1 50 50 LEU HD22 H 1 0.830 0.01 . 2 . . . . 30 LEU HD2 . 6934 1 375 . 1 1 50 50 LEU HD23 H 1 0.830 0.01 . 2 . . . . 30 LEU HD2 . 6934 1 376 . 1 1 50 50 LEU C C 13 176.077 0.2 . 1 . . . . 30 LEU C . 6934 1 377 . 1 1 50 50 LEU CA C 13 53.893 0.2 . 1 . . . . 30 LEU CA . 6934 1 378 . 1 1 50 50 LEU CB C 13 43.183 0.2 . 1 . . . . 30 LEU CB . 6934 1 379 . 1 1 50 50 LEU CD1 C 13 25.600 0.2 . 2 . . . . 30 LEU CD1 . 6934 1 380 . 1 1 50 50 LEU CD2 C 13 22.720 0.2 . 2 . . . . 30 LEU CD2 . 6934 1 381 . 1 1 50 50 LEU N N 15 120.840 0.15 . 1 . . . . 30 LEU N . 6934 1 382 . 1 1 51 51 LYS H H 1 8.305 0.01 . 1 . . . . 31 LYS HN . 6934 1 383 . 1 1 51 51 LYS HA H 1 4.785 0.01 . 1 . . . . 31 LYS HA . 6934 1 384 . 1 1 51 51 LYS HB2 H 1 2.260 0.01 . 2 . . . . 31 LYS HB1 . 6934 1 385 . 1 1 51 51 LYS HB3 H 1 1.860 0.01 . 2 . . . . 31 LYS HB2 . 6934 1 386 . 1 1 51 51 LYS HG2 H 1 1.390 0.01 . 2 . . . . 31 LYS HG1 . 6934 1 387 . 1 1 51 51 LYS HG3 H 1 1.490 0.01 . 2 . . . . 31 LYS HG2 . 6934 1 388 . 1 1 51 51 LYS HD2 H 1 1.730 0.01 . 1 . . . . 31 LYS HD1 . 6934 1 389 . 1 1 51 51 LYS HD3 H 1 1.730 0.01 . 1 . . . . 31 LYS HD2 . 6934 1 390 . 1 1 51 51 LYS C C 13 174.211 0.2 . 1 . . . . 31 LYS C . 6934 1 391 . 1 1 51 51 LYS CA C 13 55.852 0.2 . 1 . . . . 31 LYS CA . 6934 1 392 . 1 1 51 51 LYS CB C 13 32.027 0.2 . 1 . . . . 31 LYS CB . 6934 1 393 . 1 1 51 51 LYS CG C 13 24.960 0.2 . 1 . . . . 31 LYS CG . 6934 1 394 . 1 1 51 51 LYS N N 15 123.882 0.15 . 1 . . . . 31 LYS N . 6934 1 395 . 1 1 52 52 VAL H H 1 8.419 0.01 . 1 . . . . 32 VAL HN . 6934 1 396 . 1 1 52 52 VAL HA H 1 5.244 0.01 . 1 . . . . 32 VAL HA . 6934 1 397 . 1 1 52 52 VAL HB H 1 1.959 0.01 . 1 . . . . 32 VAL HB . 6934 1 398 . 1 1 52 52 VAL HG11 H 1 0.980 0.01 . 2 . . . . 32 VAL HG1 . 6934 1 399 . 1 1 52 52 VAL HG12 H 1 0.980 0.01 . 2 . . . . 32 VAL HG1 . 6934 1 400 . 1 1 52 52 VAL HG13 H 1 0.980 0.01 . 2 . . . . 32 VAL HG1 . 6934 1 401 . 1 1 52 52 VAL HG21 H 1 0.768 0.01 . 2 . . . . 32 VAL HG2 . 6934 1 402 . 1 1 52 52 VAL HG22 H 1 0.768 0.01 . 2 . . . . 32 VAL HG2 . 6934 1 403 . 1 1 52 52 VAL HG23 H 1 0.768 0.01 . 2 . . . . 32 VAL HG2 . 6934 1 404 . 1 1 52 52 VAL C C 13 174.605 0.2 . 1 . . . . 32 VAL C . 6934 1 405 . 1 1 52 52 VAL CA C 13 60.293 0.2 . 1 . . . . 32 VAL CA . 6934 1 406 . 1 1 52 52 VAL CB C 13 33.645 0.2 . 1 . . . . 32 VAL CB . 6934 1 407 . 1 1 52 52 VAL CG1 C 13 23.200 0.2 . 2 . . . . 32 VAL CG1 . 6934 1 408 . 1 1 52 52 VAL CG2 C 13 20.950 0.2 . 2 . . . . 32 VAL CG2 . 6934 1 409 . 1 1 52 52 VAL N N 15 126.902 0.15 . 1 . . . . 32 VAL N . 6934 1 410 . 1 1 53 53 GLU H H 1 8.728 0.01 . 1 . . . . 33 GLU HN . 6934 1 411 . 1 1 53 53 GLU HA H 1 4.814 0.01 . 1 . . . . 33 GLU HA . 6934 1 412 . 1 1 53 53 GLU HB2 H 1 1.715 0.01 . 2 . . . . 33 GLU HB1 . 6934 1 413 . 1 1 53 53 GLU HB3 H 1 2.260 0.01 . 2 . . . . 33 GLU HB2 . 6934 1 414 . 1 1 53 53 GLU HG2 H 1 2.277 0.01 . 2 . . . . 33 GLU HG1 . 6934 1 415 . 1 1 53 53 GLU HG3 H 1 2.470 0.01 . 2 . . . . 33 GLU HG2 . 6934 1 416 . 1 1 53 53 GLU C C 13 174.581 0.2 . 1 . . . . 33 GLU C . 6934 1 417 . 1 1 53 53 GLU CA C 13 54.050 0.2 . 1 . . . . 33 GLU CA . 6934 1 418 . 1 1 53 53 GLU CB C 13 34.800 0.2 . 1 . . . . 33 GLU CB . 6934 1 419 . 1 1 53 53 GLU CG C 13 37.600 0.2 . 1 . . . . 33 GLU CG . 6934 1 420 . 1 1 53 53 GLU N N 15 124.835 0.15 . 1 . . . . 33 GLU N . 6934 1 421 . 1 1 54 54 SER H H 1 9.015 0.01 . 1 . . . . 34 SER HN . 6934 1 422 . 1 1 54 54 SER HA H 1 5.783 0.01 . 1 . . . . 34 SER HA . 6934 1 423 . 1 1 54 54 SER HB2 H 1 3.685 0.01 . 1 . . . . 34 SER HB1 . 6934 1 424 . 1 1 54 54 SER HB3 H 1 3.685 0.01 . 1 . . . . 34 SER HB2 . 6934 1 425 . 1 1 54 54 SER C C 13 173.831 0.2 . 1 . . . . 34 SER C . 6934 1 426 . 1 1 54 54 SER CA C 13 57.759 0.2 . 1 . . . . 34 SER CA . 6934 1 427 . 1 1 54 54 SER CB C 13 66.646 0.2 . 1 . . . . 34 SER CB . 6934 1 428 . 1 1 54 54 SER N N 15 112.893 0.15 . 1 . . . . 34 SER N . 6934 1 429 . 1 1 55 55 ALA H H 1 8.410 0.01 . 1 . . . . 35 ALA HN . 6934 1 430 . 1 1 55 55 ALA HA H 1 4.482 0.01 . 1 . . . . 35 ALA HA . 6934 1 431 . 1 1 55 55 ALA HB1 H 1 1.114 0.01 . 1 . . . . 35 ALA HB . 6934 1 432 . 1 1 55 55 ALA HB2 H 1 1.114 0.01 . 1 . . . . 35 ALA HB . 6934 1 433 . 1 1 55 55 ALA HB3 H 1 1.114 0.01 . 1 . . . . 35 ALA HB . 6934 1 434 . 1 1 55 55 ALA C C 13 174.606 0.2 . 1 . . . . 35 ALA C . 6934 1 435 . 1 1 55 55 ALA CA C 13 51.651 0.2 . 1 . . . . 35 ALA CA . 6934 1 436 . 1 1 55 55 ALA CB C 13 22.363 0.2 . 1 . . . . 35 ALA CB . 6934 1 437 . 1 1 55 55 ALA N N 15 118.511 0.15 . 1 . . . . 35 ALA N . 6934 1 438 . 1 1 56 56 GLY H H 1 8.646 0.01 . 1 . . . . 36 GLY HN . 6934 1 439 . 1 1 56 56 GLY HA2 H 1 4.945 0.01 . 2 . . . . 36 GLY HA1 . 6934 1 440 . 1 1 56 56 GLY HA3 H 1 3.065 0.01 . 2 . . . . 36 GLY HA2 . 6934 1 441 . 1 1 56 56 GLY C C 13 173.200 0.2 . 1 . . . . 36 GLY C . 6934 1 442 . 1 1 56 56 GLY CA C 13 44.000 0.2 . 1 . . . . 36 GLY CA . 6934 1 443 . 1 1 56 56 GLY N N 15 102.770 0.15 . 1 . . . . 36 GLY N . 6934 1 444 . 1 1 57 57 LEU H H 1 8.836 0.01 . 1 . . . . 37 LEU HN . 6934 1 445 . 1 1 57 57 LEU HA H 1 4.022 0.01 . 1 . . . . 37 LEU HA . 6934 1 446 . 1 1 57 57 LEU HB2 H 1 1.550 0.01 . 2 . . . . 37 LEU HB1 . 6934 1 447 . 1 1 57 57 LEU HB3 H 1 1.380 0.01 . 2 . . . . 37 LEU HB2 . 6934 1 448 . 1 1 57 57 LEU HG H 1 1.400 0.01 . 1 . . . . 37 LEU HG . 6934 1 449 . 1 1 57 57 LEU HD11 H 1 0.500 0.01 . 2 . . . . 37 LEU HD1 . 6934 1 450 . 1 1 57 57 LEU HD12 H 1 0.500 0.01 . 2 . . . . 37 LEU HD1 . 6934 1 451 . 1 1 57 57 LEU HD13 H 1 0.500 0.01 . 2 . . . . 37 LEU HD1 . 6934 1 452 . 1 1 57 57 LEU HD21 H 1 0.730 0.01 . 2 . . . . 37 LEU HD2 . 6934 1 453 . 1 1 57 57 LEU HD22 H 1 0.730 0.01 . 2 . . . . 37 LEU HD2 . 6934 1 454 . 1 1 57 57 LEU HD23 H 1 0.730 0.01 . 2 . . . . 37 LEU HD2 . 6934 1 455 . 1 1 57 57 LEU C C 13 177.215 0.2 . 1 . . . . 37 LEU C . 6934 1 456 . 1 1 57 57 LEU CA C 13 57.471 0.2 . 1 . . . . 37 LEU CA . 6934 1 457 . 1 1 57 57 LEU CB C 13 43.800 0.2 . 1 . . . . 37 LEU CB . 6934 1 458 . 1 1 57 57 LEU CG C 13 27.200 0.2 . 1 . . . . 37 LEU CG . 6934 1 459 . 1 1 57 57 LEU CD1 C 13 25.040 0.2 . 2 . . . . 37 LEU CD1 . 6934 1 460 . 1 1 57 57 LEU CD2 C 13 23.280 0.2 . 2 . . . . 37 LEU CD2 . 6934 1 461 . 1 1 57 57 LEU N N 15 122.580 0.15 . 1 . . . . 37 LEU N . 6934 1 462 . 1 1 58 58 GLY H H 1 9.200 0.01 . 1 . . . . 38 GLY HN . 6934 1 463 . 1 1 58 58 GLY HA2 H 1 4.616 0.01 . 2 . . . . 38 GLY HA1 . 6934 1 464 . 1 1 58 58 GLY HA3 H 1 3.140 0.01 . 2 . . . . 38 GLY HA2 . 6934 1 465 . 1 1 58 58 GLY C C 13 174.068 0.2 . 1 . . . . 38 GLY C . 6934 1 466 . 1 1 58 58 GLY CA C 13 46.696 0.2 . 1 . . . . 38 GLY CA . 6934 1 467 . 1 1 58 58 GLY N N 15 114.300 0.15 . 1 . . . . 38 GLY N . 6934 1 468 . 1 1 59 59 ALA H H 1 7.756 0.01 . 1 . . . . 39 ALA HN . 6934 1 469 . 1 1 59 59 ALA HA H 1 3.910 0.01 . 1 . . . . 39 ALA HA . 6934 1 470 . 1 1 59 59 ALA HB1 H 1 0.990 0.01 . 1 . . . . 39 ALA HB . 6934 1 471 . 1 1 59 59 ALA HB2 H 1 0.990 0.01 . 1 . . . . 39 ALA HB . 6934 1 472 . 1 1 59 59 ALA HB3 H 1 0.990 0.01 . 1 . . . . 39 ALA HB . 6934 1 473 . 1 1 59 59 ALA C C 13 178.078 0.2 . 1 . . . . 39 ALA C . 6934 1 474 . 1 1 59 59 ALA CA C 13 52.249 0.2 . 1 . . . . 39 ALA CA . 6934 1 475 . 1 1 59 59 ALA CB C 13 19.991 0.2 . 1 . . . . 39 ALA CB . 6934 1 476 . 1 1 59 59 ALA N N 15 121.783 0.15 . 1 . . . . 39 ALA N . 6934 1 477 . 1 1 60 60 LEU H H 1 7.634 0.01 . 1 . . . . 40 LEU HN . 6934 1 478 . 1 1 60 60 LEU HA H 1 4.555 0.01 . 1 . . . . 40 LEU HA . 6934 1 479 . 1 1 60 60 LEU HB2 H 1 1.457 0.01 . 2 . . . . 40 LEU HB1 . 6934 1 480 . 1 1 60 60 LEU HB3 H 1 1.552 0.01 . 2 . . . . 40 LEU HB2 . 6934 1 481 . 1 1 60 60 LEU HG H 1 1.630 0.01 . 1 . . . . 40 LEU HG . 6934 1 482 . 1 1 60 60 LEU HD11 H 1 0.870 0.01 . 2 . . . . 40 LEU HD1 . 6934 1 483 . 1 1 60 60 LEU HD12 H 1 0.870 0.01 . 2 . . . . 40 LEU HD1 . 6934 1 484 . 1 1 60 60 LEU HD13 H 1 0.870 0.01 . 2 . . . . 40 LEU HD1 . 6934 1 485 . 1 1 60 60 LEU HD21 H 1 0.880 0.01 . 2 . . . . 40 LEU HD2 . 6934 1 486 . 1 1 60 60 LEU HD22 H 1 0.880 0.01 . 2 . . . . 40 LEU HD2 . 6934 1 487 . 1 1 60 60 LEU HD23 H 1 0.880 0.01 . 2 . . . . 40 LEU HD2 . 6934 1 488 . 1 1 60 60 LEU C C 13 174.853 0.2 . 1 . . . . 40 LEU C . 6934 1 489 . 1 1 60 60 LEU CA C 13 53.345 0.2 . 1 . . . . 40 LEU CA . 6934 1 490 . 1 1 60 60 LEU CB C 13 38.373 0.2 . 1 . . . . 40 LEU CB . 6934 1 491 . 1 1 60 60 LEU CG C 13 27.800 0.2 . 1 . . . . 40 LEU CG . 6934 1 492 . 1 1 60 60 LEU CD1 C 13 25.400 0.2 . 2 . . . . 40 LEU CD1 . 6934 1 493 . 1 1 60 60 LEU CD2 C 13 24.000 0.2 . 2 . . . . 40 LEU CD2 . 6934 1 494 . 1 1 60 60 LEU N N 15 124.666 0.15 . 1 . . . . 40 LEU N . 6934 1 495 . 1 1 61 61 VAL H H 1 7.074 0.01 . 1 . . . . 41 VAL HN . 6934 1 496 . 1 1 61 61 VAL HA H 1 3.054 0.01 . 1 . . . . 41 VAL HA . 6934 1 497 . 1 1 61 61 VAL HB H 1 1.929 0.01 . 1 . . . . 41 VAL HB . 6934 1 498 . 1 1 61 61 VAL HG11 H 1 0.960 0.01 . 2 . . . . 41 VAL HG1 . 6934 1 499 . 1 1 61 61 VAL HG12 H 1 0.960 0.01 . 2 . . . . 41 VAL HG1 . 6934 1 500 . 1 1 61 61 VAL HG13 H 1 0.960 0.01 . 2 . . . . 41 VAL HG1 . 6934 1 501 . 1 1 61 61 VAL HG21 H 1 1.035 0.01 . 2 . . . . 41 VAL HG2 . 6934 1 502 . 1 1 61 61 VAL HG22 H 1 1.035 0.01 . 2 . . . . 41 VAL HG2 . 6934 1 503 . 1 1 61 61 VAL HG23 H 1 1.035 0.01 . 2 . . . . 41 VAL HG2 . 6934 1 504 . 1 1 61 61 VAL C C 13 177.508 0.2 . 1 . . . . 41 VAL C . 6934 1 505 . 1 1 61 61 VAL CA C 13 65.629 0.2 . 1 . . . . 41 VAL CA . 6934 1 506 . 1 1 61 61 VAL CB C 13 31.921 0.2 . 1 . . . . 41 VAL CB . 6934 1 507 . 1 1 61 61 VAL CG1 C 13 21.400 0.2 . 2 . . . . 41 VAL CG1 . 6934 1 508 . 1 1 61 61 VAL CG2 C 13 22.500 0.2 . 2 . . . . 41 VAL CG2 . 6934 1 509 . 1 1 61 61 VAL N N 15 117.074 0.15 . 1 . . . . 41 VAL N . 6934 1 510 . 1 1 62 62 GLY H H 1 8.658 0.01 . 1 . . . . 42 GLY HN . 6934 1 511 . 1 1 62 62 GLY HA2 H 1 3.787 0.01 . 2 . . . . 42 GLY HA1 . 6934 1 512 . 1 1 62 62 GLY HA3 H 1 4.285 0.01 . 2 . . . . 42 GLY HA2 . 6934 1 513 . 1 1 62 62 GLY C C 13 174.380 0.2 . 1 . . . . 42 GLY C . 6934 1 514 . 1 1 62 62 GLY CA C 13 45.259 0.2 . 1 . . . . 42 GLY CA . 6934 1 515 . 1 1 62 62 GLY N N 15 113.649 0.15 . 1 . . . . 42 GLY N . 6934 1 516 . 1 1 63 63 LYS H H 1 7.844 0.01 . 1 . . . . 43 LYS HN . 6934 1 517 . 1 1 63 63 LYS HA H 1 4.387 0.01 . 1 . . . . 43 LYS HA . 6934 1 518 . 1 1 63 63 LYS HB2 H 1 2.055 0.01 . 2 . . . . 43 LYS HB1 . 6934 1 519 . 1 1 63 63 LYS HB3 H 1 2.158 0.01 . 2 . . . . 43 LYS HB2 . 6934 1 520 . 1 1 63 63 LYS HG2 H 1 1.380 0.01 . 2 . . . . 43 LYS HG1 . 6934 1 521 . 1 1 63 63 LYS HG3 H 1 1.510 0.01 . 2 . . . . 43 LYS HG2 . 6934 1 522 . 1 1 63 63 LYS HD2 H 1 1.725 0.01 . 1 . . . . 43 LYS HD1 . 6934 1 523 . 1 1 63 63 LYS HD3 H 1 1.725 0.01 . 1 . . . . 43 LYS HD2 . 6934 1 524 . 1 1 63 63 LYS HE2 H 1 3.000 0.01 . 2 . . . . 43 LYS HE1 . 6934 1 525 . 1 1 63 63 LYS HE3 H 1 3.090 0.01 . 2 . . . . 43 LYS HE2 . 6934 1 526 . 1 1 63 63 LYS C C 13 176.667 0.2 . 1 . . . . 43 LYS C . 6934 1 527 . 1 1 63 63 LYS CA C 13 56.115 0.2 . 1 . . . . 43 LYS CA . 6934 1 528 . 1 1 63 63 LYS CB C 13 33.000 0.2 . 1 . . . . 43 LYS CB . 6934 1 529 . 1 1 63 63 LYS CG C 13 25.770 0.2 . 1 . . . . 43 LYS CG . 6934 1 530 . 1 1 63 63 LYS CD C 13 28.460 0.2 . 1 . . . . 43 LYS CD . 6934 1 531 . 1 1 63 63 LYS CE C 13 42.200 0.2 . 1 . . . . 43 LYS CE . 6934 1 532 . 1 1 63 63 LYS N N 15 121.325 0.15 . 1 . . . . 43 LYS N . 6934 1 533 . 1 1 64 64 GLY H H 1 8.112 0.01 . 1 . . . . 44 GLY HN . 6934 1 534 . 1 1 64 64 GLY HA2 H 1 3.707 0.01 . 2 . . . . 44 GLY HA1 . 6934 1 535 . 1 1 64 64 GLY HA3 H 1 4.668 0.01 . 2 . . . . 44 GLY HA2 . 6934 1 536 . 1 1 64 64 GLY C C 13 173.297 0.2 . 1 . . . . 44 GLY C . 6934 1 537 . 1 1 64 64 GLY CA C 13 43.708 0.2 . 1 . . . . 44 GLY CA . 6934 1 538 . 1 1 64 64 GLY N N 15 105.710 0.15 . 1 . . . . 44 GLY N . 6934 1 539 . 1 1 65 65 ALA H H 1 8.418 0.01 . 1 . . . . 45 ALA HN . 6934 1 540 . 1 1 65 65 ALA HA H 1 4.360 0.01 . 1 . . . . 45 ALA HA . 6934 1 541 . 1 1 65 65 ALA HB1 H 1 1.195 0.01 . 1 . . . . 45 ALA HB . 6934 1 542 . 1 1 65 65 ALA HB2 H 1 1.195 0.01 . 1 . . . . 45 ALA HB . 6934 1 543 . 1 1 65 65 ALA HB3 H 1 1.195 0.01 . 1 . . . . 45 ALA HB . 6934 1 544 . 1 1 65 65 ALA C C 13 175.724 0.2 . 1 . . . . 45 ALA C . 6934 1 545 . 1 1 65 65 ALA CA C 13 51.800 0.2 . 1 . . . . 45 ALA CA . 6934 1 546 . 1 1 65 65 ALA CB C 13 18.790 0.2 . 1 . . . . 45 ALA CB . 6934 1 547 . 1 1 65 65 ALA N N 15 117.083 0.15 . 1 . . . . 45 ALA N . 6934 1 548 . 1 1 66 66 ASP H H 1 8.360 0.01 . 1 . . . . 46 ASP HN . 6934 1 549 . 1 1 66 66 ASP HA H 1 4.300 0.01 . 1 . . . . 46 ASP HA . 6934 1 550 . 1 1 66 66 ASP HB2 H 1 2.668 0.01 . 2 . . . . 46 ASP HB1 . 6934 1 551 . 1 1 66 66 ASP HB3 H 1 2.790 0.01 . 2 . . . . 46 ASP HB2 . 6934 1 552 . 1 1 66 66 ASP CA C 13 52.661 0.2 . 1 . . . . 46 ASP CA . 6934 1 553 . 1 1 66 66 ASP CB C 13 46.120 0.2 . 1 . . . . 46 ASP CB . 6934 1 554 . 1 1 66 66 ASP N N 15 120.980 0.15 . 1 . . . . 46 ASP N . 6934 1 555 . 1 1 67 67 PRO HA H 1 4.155 0.01 . 1 . . . . 47 PRO HA . 6934 1 556 . 1 1 67 67 PRO HB2 H 1 1.975 0.01 . 2 . . . . 47 PRO HB1 . 6934 1 557 . 1 1 67 67 PRO HB3 H 1 2.405 0.01 . 2 . . . . 47 PRO HB2 . 6934 1 558 . 1 1 67 67 PRO HG2 H 1 2.085 0.01 . 2 . . . . 47 PRO HG1 . 6934 1 559 . 1 1 67 67 PRO HG3 H 1 2.169 0.01 . 2 . . . . 47 PRO HG2 . 6934 1 560 . 1 1 67 67 PRO HD2 H 1 3.796 0.01 . 2 . . . . 47 PRO HD1 . 6934 1 561 . 1 1 67 67 PRO HD3 H 1 4.030 0.01 . 2 . . . . 47 PRO HD2 . 6934 1 562 . 1 1 67 67 PRO C C 13 179.553 0.2 . 1 . . . . 47 PRO C . 6934 1 563 . 1 1 67 67 PRO CA C 13 65.839 0.2 . 1 . . . . 47 PRO CA . 6934 1 564 . 1 1 67 67 PRO CB C 13 32.500 0.2 . 1 . . . . 47 PRO CB . 6934 1 565 . 1 1 67 67 PRO CG C 13 27.770 0.2 . 1 . . . . 47 PRO CG . 6934 1 566 . 1 1 67 67 PRO CD C 13 51.370 0.2 . 1 . . . . 47 PRO CD . 6934 1 567 . 1 1 68 68 THR H H 1 8.991 0.01 . 1 . . . . 48 THR HN . 6934 1 568 . 1 1 68 68 THR HA H 1 3.825 0.01 . 1 . . . . 48 THR HA . 6934 1 569 . 1 1 68 68 THR HB H 1 2.738 0.01 . 1 . . . . 48 THR HB . 6934 1 570 . 1 1 68 68 THR HG21 H 1 0.677 0.01 . 1 . . . . 48 THR HG2 . 6934 1 571 . 1 1 68 68 THR HG22 H 1 0.677 0.01 . 1 . . . . 48 THR HG2 . 6934 1 572 . 1 1 68 68 THR HG23 H 1 0.677 0.01 . 1 . . . . 48 THR HG2 . 6934 1 573 . 1 1 68 68 THR CA C 13 66.090 0.2 . 1 . . . . 48 THR CA . 6934 1 574 . 1 1 68 68 THR CB C 13 66.050 0.2 . 1 . . . . 48 THR CB . 6934 1 575 . 1 1 68 68 THR CG2 C 13 23.860 0.2 . 1 . . . . 48 THR CG2 . 6934 1 576 . 1 1 68 68 THR N N 15 118.733 0.15 . 1 . . . . 48 THR N . 6934 1 577 . 1 1 69 69 ALA H H 1 7.404 0.01 . 1 . . . . 49 ALA HN . 6934 1 578 . 1 1 69 69 ALA HA H 1 4.110 0.01 . 1 . . . . 49 ALA HA . 6934 1 579 . 1 1 69 69 ALA HB1 H 1 1.740 0.01 . 1 . . . . 49 ALA HB . 6934 1 580 . 1 1 69 69 ALA HB2 H 1 1.740 0.01 . 1 . . . . 49 ALA HB . 6934 1 581 . 1 1 69 69 ALA HB3 H 1 1.740 0.01 . 1 . . . . 49 ALA HB . 6934 1 582 . 1 1 69 69 ALA C C 13 181.380 0.2 . 1 . . . . 49 ALA C . 6934 1 583 . 1 1 69 69 ALA CA C 13 55.660 0.2 . 1 . . . . 49 ALA CA . 6934 1 584 . 1 1 69 69 ALA CB C 13 17.520 0.2 . 1 . . . . 49 ALA CB . 6934 1 585 . 1 1 69 69 ALA N N 15 125.769 0.15 . 1 . . . . 49 ALA N . 6934 1 586 . 1 1 70 70 ILE H H 1 8.661 0.01 . 1 . . . . 50 ILE HN . 6934 1 587 . 1 1 70 70 ILE HA H 1 3.515 0.01 . 1 . . . . 50 ILE HA . 6934 1 588 . 1 1 70 70 ILE HB H 1 1.862 0.01 . 1 . . . . 50 ILE HB . 6934 1 589 . 1 1 70 70 ILE HG12 H 1 1.686 0.01 . 1 . . . . 50 ILE HG11 . 6934 1 590 . 1 1 70 70 ILE HG13 H 1 0.760 0.01 . 1 . . . . 50 ILE HG12 . 6934 1 591 . 1 1 70 70 ILE HG21 H 1 0.905 0.01 . 1 . . . . 50 ILE HG2 . 6934 1 592 . 1 1 70 70 ILE HG22 H 1 0.905 0.01 . 1 . . . . 50 ILE HG2 . 6934 1 593 . 1 1 70 70 ILE HG23 H 1 0.905 0.01 . 1 . . . . 50 ILE HG2 . 6934 1 594 . 1 1 70 70 ILE HD11 H 1 0.815 0.01 . 1 . . . . 50 ILE HD1 . 6934 1 595 . 1 1 70 70 ILE HD12 H 1 0.815 0.01 . 1 . . . . 50 ILE HD1 . 6934 1 596 . 1 1 70 70 ILE HD13 H 1 0.815 0.01 . 1 . . . . 50 ILE HD1 . 6934 1 597 . 1 1 70 70 ILE C C 13 178.133 0.2 . 1 . . . . 50 ILE C . 6934 1 598 . 1 1 70 70 ILE CA C 13 66.043 0.2 . 1 . . . . 50 ILE CA . 6934 1 599 . 1 1 70 70 ILE CB C 13 38.293 0.2 . 1 . . . . 50 ILE CB . 6934 1 600 . 1 1 70 70 ILE CG1 C 13 30.200 0.2 . 1 . . . . 50 ILE CG1 . 6934 1 601 . 1 1 70 70 ILE CG2 C 13 16.800 0.2 . 1 . . . . 50 ILE CG2 . 6934 1 602 . 1 1 70 70 ILE CD1 C 13 13.900 0.2 . 1 . . . . 50 ILE CD1 . 6934 1 603 . 1 1 70 70 ILE N N 15 119.110 0.15 . 1 . . . . 50 ILE N . 6934 1 604 . 1 1 71 71 SER H H 1 7.881 0.01 . 1 . . . . 51 SER HN . 6934 1 605 . 1 1 71 71 SER HA H 1 4.210 0.01 . 1 . . . . 51 SER HA . 6934 1 606 . 1 1 71 71 SER HB2 H 1 3.970 0.01 . 2 . . . . 51 SER HB1 . 6934 1 607 . 1 1 71 71 SER HB3 H 1 4.100 0.01 . 2 . . . . 51 SER HB2 . 6934 1 608 . 1 1 71 71 SER C C 13 177.946 0.2 . 1 . . . . 51 SER C . 6934 1 609 . 1 1 71 71 SER CA C 13 61.372 0.2 . 1 . . . . 51 SER CA . 6934 1 610 . 1 1 71 71 SER CB C 13 63.003 0.2 . 1 . . . . 51 SER CB . 6934 1 611 . 1 1 71 71 SER N N 15 116.124 0.15 . 1 . . . . 51 SER N . 6934 1 612 . 1 1 72 72 VAL H H 1 8.371 0.01 . 1 . . . . 52 VAL HN . 6934 1 613 . 1 1 72 72 VAL HA H 1 3.736 0.01 . 1 . . . . 52 VAL HA . 6934 1 614 . 1 1 72 72 VAL HB H 1 2.000 0.01 . 1 . . . . 52 VAL HB . 6934 1 615 . 1 1 72 72 VAL HG11 H 1 0.920 0.01 . 2 . . . . 52 VAL HG1 . 6934 1 616 . 1 1 72 72 VAL HG12 H 1 0.920 0.01 . 2 . . . . 52 VAL HG1 . 6934 1 617 . 1 1 72 72 VAL HG13 H 1 0.920 0.01 . 2 . . . . 52 VAL HG1 . 6934 1 618 . 1 1 72 72 VAL HG21 H 1 1.060 0.01 . 2 . . . . 52 VAL HG2 . 6934 1 619 . 1 1 72 72 VAL HG22 H 1 1.060 0.01 . 2 . . . . 52 VAL HG2 . 6934 1 620 . 1 1 72 72 VAL HG23 H 1 1.060 0.01 . 2 . . . . 52 VAL HG2 . 6934 1 621 . 1 1 72 72 VAL C C 13 178.028 0.2 . 1 . . . . 52 VAL C . 6934 1 622 . 1 1 72 72 VAL CA C 13 66.236 0.2 . 1 . . . . 52 VAL CA . 6934 1 623 . 1 1 72 72 VAL CB C 13 31.814 0.2 . 1 . . . . 52 VAL CB . 6934 1 624 . 1 1 72 72 VAL CG1 C 13 21.200 0.2 . 2 . . . . 52 VAL CG1 . 6934 1 625 . 1 1 72 72 VAL CG2 C 13 23.300 0.2 . 2 . . . . 52 VAL CG2 . 6934 1 626 . 1 1 72 72 VAL N N 15 120.152 0.15 . 1 . . . . 52 VAL N . 6934 1 627 . 1 1 73 73 ALA H H 1 7.997 0.01 . 1 . . . . 53 ALA HN . 6934 1 628 . 1 1 73 73 ALA HA H 1 3.956 0.01 . 1 . . . . 53 ALA HA . 6934 1 629 . 1 1 73 73 ALA HB1 H 1 1.655 0.01 . 1 . . . . 53 ALA HB . 6934 1 630 . 1 1 73 73 ALA HB2 H 1 1.655 0.01 . 1 . . . . 53 ALA HB . 6934 1 631 . 1 1 73 73 ALA HB3 H 1 1.655 0.01 . 1 . . . . 53 ALA HB . 6934 1 632 . 1 1 73 73 ALA C C 13 180.397 0.2 . 1 . . . . 53 ALA C . 6934 1 633 . 1 1 73 73 ALA CA C 13 55.816 0.2 . 1 . . . . 53 ALA CA . 6934 1 634 . 1 1 73 73 ALA CB C 13 17.700 0.2 . 1 . . . . 53 ALA CB . 6934 1 635 . 1 1 73 73 ALA N N 15 122.461 0.15 . 1 . . . . 53 ALA N . 6934 1 636 . 1 1 74 74 ALA H H 1 8.585 0.01 . 1 . . . . 54 ALA HN . 6934 1 637 . 1 1 74 74 ALA HA H 1 4.064 0.01 . 1 . . . . 54 ALA HA . 6934 1 638 . 1 1 74 74 ALA HB1 H 1 1.550 0.01 . 1 . . . . 54 ALA HB . 6934 1 639 . 1 1 74 74 ALA HB2 H 1 1.550 0.01 . 1 . . . . 54 ALA HB . 6934 1 640 . 1 1 74 74 ALA HB3 H 1 1.550 0.01 . 1 . . . . 54 ALA HB . 6934 1 641 . 1 1 74 74 ALA C C 13 181.719 0.2 . 1 . . . . 54 ALA C . 6934 1 642 . 1 1 74 74 ALA CA C 13 55.315 0.2 . 1 . . . . 54 ALA CA . 6934 1 643 . 1 1 74 74 ALA CB C 13 17.644 0.2 . 1 . . . . 54 ALA CB . 6934 1 644 . 1 1 74 74 ALA N N 15 121.979 0.15 . 1 . . . . 54 ALA N . 6934 1 645 . 1 1 75 75 GLU H H 1 7.502 0.01 . 1 . . . . 55 GLU HN . 6934 1 646 . 1 1 75 75 GLU HA H 1 4.004 0.01 . 1 . . . . 55 GLU HA . 6934 1 647 . 1 1 75 75 GLU HB2 H 1 1.895 0.01 . 2 . . . . 55 GLU HB1 . 6934 1 648 . 1 1 75 75 GLU HB3 H 1 1.964 0.01 . 2 . . . . 55 GLU HB2 . 6934 1 649 . 1 1 75 75 GLU HG2 H 1 2.070 0.01 . 2 . . . . 55 GLU HG1 . 6934 1 650 . 1 1 75 75 GLU HG3 H 1 2.377 0.01 . 2 . . . . 55 GLU HG2 . 6934 1 651 . 1 1 75 75 GLU C C 13 176.595 0.2 . 1 . . . . 55 GLU C . 6934 1 652 . 1 1 75 75 GLU CA C 13 58.491 0.2 . 1 . . . . 55 GLU CA . 6934 1 653 . 1 1 75 75 GLU CB C 13 29.486 0.2 . 1 . . . . 55 GLU CB . 6934 1 654 . 1 1 75 75 GLU CG C 13 36.330 0.2 . 1 . . . . 55 GLU CG . 6934 1 655 . 1 1 75 75 GLU N N 15 119.938 0.15 . 1 . . . . 55 GLU N . 6934 1 656 . 1 1 76 76 HIS H H 1 7.556 0.01 . 1 . . . . 56 HIS HN . 6934 1 657 . 1 1 76 76 HIS HA H 1 4.602 0.01 . 1 . . . . 56 HIS HA . 6934 1 658 . 1 1 76 76 HIS HB2 H 1 3.720 0.01 . 2 . . . . 56 HIS HB1 . 6934 1 659 . 1 1 76 76 HIS HB3 H 1 2.779 0.01 . 2 . . . . 56 HIS HB2 . 6934 1 660 . 1 1 76 76 HIS HD2 H 1 6.960 0.01 . 1 . . . . 56 HIS HD2 . 6934 1 661 . 1 1 76 76 HIS HE1 H 1 8.380 0.01 . 1 . . . . 56 HIS HE1 . 6934 1 662 . 1 1 76 76 HIS C C 13 173.556 0.2 . 1 . . . . 56 HIS C . 6934 1 663 . 1 1 76 76 HIS CA C 13 54.504 0.2 . 1 . . . . 56 HIS CA . 6934 1 664 . 1 1 76 76 HIS CB C 13 28.816 0.2 . 1 . . . . 56 HIS CB . 6934 1 665 . 1 1 76 76 HIS N N 15 116.080 0.15 . 1 . . . . 56 HIS N . 6934 1 666 . 1 1 77 77 GLN H H 1 7.884 0.01 . 1 . . . . 57 GLN HN . 6934 1 667 . 1 1 77 77 GLN HA H 1 3.872 0.01 . 1 . . . . 57 GLN HA . 6934 1 668 . 1 1 77 77 GLN HB2 H 1 2.305 0.01 . 2 . . . . 57 GLN HB1 . 6934 1 669 . 1 1 77 77 GLN HB3 H 1 2.370 0.01 . 2 . . . . 57 GLN HB2 . 6934 1 670 . 1 1 77 77 GLN HG2 H 1 2.280 0.01 . 2 . . . . 57 GLN HG1 . 6934 1 671 . 1 1 77 77 GLN HG3 H 1 2.340 0.01 . 2 . . . . 57 GLN HG2 . 6934 1 672 . 1 1 77 77 GLN HE21 H 1 7.521 0.01 . 2 . . . . 57 GLN HE21 . 6934 1 673 . 1 1 77 77 GLN HE22 H 1 6.646 0.01 . 2 . . . . 57 GLN HE22 . 6934 1 674 . 1 1 77 77 GLN C C 13 173.122 0.2 . 1 . . . . 57 GLN C . 6934 1 675 . 1 1 77 77 GLN CA C 13 57.418 0.2 . 1 . . . . 57 GLN CA . 6934 1 676 . 1 1 77 77 GLN CB C 13 25.521 0.2 . 1 . . . . 57 GLN CB . 6934 1 677 . 1 1 77 77 GLN CG C 13 34.660 0.2 . 1 . . . . 57 GLN CG . 6934 1 678 . 1 1 77 77 GLN N N 15 113.486 0.15 . 1 . . . . 57 GLN N . 6934 1 679 . 1 1 77 77 GLN NE2 N 15 112.850 0.15 . 1 . . . . 57 GLN NE2 . 6934 1 680 . 1 1 78 78 LEU H H 1 7.926 0.01 . 1 . . . . 58 LEU HN . 6934 1 681 . 1 1 78 78 LEU HA H 1 4.589 0.01 . 1 . . . . 58 LEU HA . 6934 1 682 . 1 1 78 78 LEU HB2 H 1 1.260 0.01 . 2 . . . . 58 LEU HB1 . 6934 1 683 . 1 1 78 78 LEU HB3 H 1 1.970 0.01 . 2 . . . . 58 LEU HB2 . 6934 1 684 . 1 1 78 78 LEU HG H 1 1.300 0.01 . 1 . . . . 58 LEU HG . 6934 1 685 . 1 1 78 78 LEU HD11 H 1 1.040 0.01 . 2 . . . . 58 LEU HD1 . 6934 1 686 . 1 1 78 78 LEU HD12 H 1 1.040 0.01 . 2 . . . . 58 LEU HD1 . 6934 1 687 . 1 1 78 78 LEU HD13 H 1 1.040 0.01 . 2 . . . . 58 LEU HD1 . 6934 1 688 . 1 1 78 78 LEU HD21 H 1 0.824 0.01 . 2 . . . . 58 LEU HD2 . 6934 1 689 . 1 1 78 78 LEU HD22 H 1 0.824 0.01 . 2 . . . . 58 LEU HD2 . 6934 1 690 . 1 1 78 78 LEU HD23 H 1 0.824 0.01 . 2 . . . . 58 LEU HD2 . 6934 1 691 . 1 1 78 78 LEU C C 13 174.979 0.2 . 1 . . . . 58 LEU C . 6934 1 692 . 1 1 78 78 LEU CA C 13 53.461 0.2 . 1 . . . . 58 LEU CA . 6934 1 693 . 1 1 78 78 LEU CB C 13 44.359 0.2 . 1 . . . . 58 LEU CB . 6934 1 694 . 1 1 78 78 LEU CG C 13 26.500 0.2 . 1 . . . . 58 LEU CG . 6934 1 695 . 1 1 78 78 LEU CD1 C 13 26.800 0.2 . 2 . . . . 58 LEU CD1 . 6934 1 696 . 1 1 78 78 LEU CD2 C 13 23.400 0.2 . 2 . . . . 58 LEU CD2 . 6934 1 697 . 1 1 78 78 LEU N N 15 121.847 0.15 . 1 . . . . 58 LEU N . 6934 1 698 . 1 1 79 79 SER H H 1 8.719 0.01 . 1 . . . . 59 SER HN . 6934 1 699 . 1 1 79 79 SER HA H 1 4.485 0.01 . 1 . . . . 59 SER HA . 6934 1 700 . 1 1 79 79 SER HB2 H 1 3.870 0.01 . 1 . . . . 59 SER HB1 . 6934 1 701 . 1 1 79 79 SER HB3 H 1 3.870 0.01 . 1 . . . . 59 SER HB2 . 6934 1 702 . 1 1 79 79 SER C C 13 175.515 0.2 . 1 . . . . 59 SER C . 6934 1 703 . 1 1 79 79 SER CA C 13 56.955 0.2 . 1 . . . . 59 SER CA . 6934 1 704 . 1 1 79 79 SER CB C 13 63.600 0.2 . 1 . . . . 59 SER CB . 6934 1 705 . 1 1 79 79 SER N N 15 120.946 0.15 . 1 . . . . 59 SER N . 6934 1 706 . 1 1 80 80 LEU H H 1 8.504 0.01 . 1 . . . . 60 LEU HN . 6934 1 707 . 1 1 80 80 LEU HA H 1 4.464 0.01 . 1 . . . . 60 LEU HA . 6934 1 708 . 1 1 80 80 LEU HB2 H 1 1.603 0.01 . 2 . . . . 60 LEU HB1 . 6934 1 709 . 1 1 80 80 LEU HB3 H 1 1.395 0.01 . 2 . . . . 60 LEU HB2 . 6934 1 710 . 1 1 80 80 LEU HG H 1 1.475 0.01 . 1 . . . . 60 LEU HG . 6934 1 711 . 1 1 80 80 LEU HD11 H 1 0.620 0.01 . 2 . . . . 60 LEU HD1 . 6934 1 712 . 1 1 80 80 LEU HD12 H 1 0.620 0.01 . 2 . . . . 60 LEU HD1 . 6934 1 713 . 1 1 80 80 LEU HD13 H 1 0.620 0.01 . 2 . . . . 60 LEU HD1 . 6934 1 714 . 1 1 80 80 LEU HD21 H 1 0.594 0.01 . 2 . . . . 60 LEU HD2 . 6934 1 715 . 1 1 80 80 LEU HD22 H 1 0.594 0.01 . 2 . . . . 60 LEU HD2 . 6934 1 716 . 1 1 80 80 LEU HD23 H 1 0.594 0.01 . 2 . . . . 60 LEU HD2 . 6934 1 717 . 1 1 80 80 LEU C C 13 175.926 0.2 . 1 . . . . 60 LEU C . 6934 1 718 . 1 1 80 80 LEU CA C 13 53.741 0.2 . 1 . . . . 60 LEU CA . 6934 1 719 . 1 1 80 80 LEU CB C 13 41.758 0.2 . 1 . . . . 60 LEU CB . 6934 1 720 . 1 1 80 80 LEU CG C 13 27.650 0.2 . 1 . . . . 60 LEU CG . 6934 1 721 . 1 1 80 80 LEU CD1 C 13 25.440 0.2 . 2 . . . . 60 LEU CD1 . 6934 1 722 . 1 1 80 80 LEU CD2 C 13 23.900 0.2 . 2 . . . . 60 LEU CD2 . 6934 1 723 . 1 1 80 80 LEU N N 15 128.081 0.15 . 1 . . . . 60 LEU N . 6934 1 724 . 1 1 81 81 GLU H H 1 7.968 0.01 . 1 . . . . 61 GLU HN . 6934 1 725 . 1 1 81 81 GLU HA H 1 4.063 0.01 . 1 . . . . 61 GLU HA . 6934 1 726 . 1 1 81 81 GLU HB2 H 1 1.883 0.01 . 2 . . . . 61 GLU HB1 . 6934 1 727 . 1 1 81 81 GLU HB3 H 1 2.000 0.01 . 2 . . . . 61 GLU HB2 . 6934 1 728 . 1 1 81 81 GLU HG2 H 1 2.330 0.01 . 1 . . . . 61 GLU HG1 . 6934 1 729 . 1 1 81 81 GLU HG3 H 1 2.330 0.01 . 1 . . . . 61 GLU HG2 . 6934 1 730 . 1 1 81 81 GLU C C 13 178.049 0.2 . 1 . . . . 61 GLU C . 6934 1 731 . 1 1 81 81 GLU CA C 13 57.741 0.2 . 1 . . . . 61 GLU CA . 6934 1 732 . 1 1 81 81 GLU CB C 13 29.923 0.2 . 1 . . . . 61 GLU CB . 6934 1 733 . 1 1 81 81 GLU CG C 13 36.010 0.2 . 1 . . . . 61 GLU CG . 6934 1 734 . 1 1 81 81 GLU N N 15 120.520 0.15 . 1 . . . . 61 GLU N . 6934 1 735 . 1 1 82 82 GLY H H 1 9.083 0.01 . 1 . . . . 62 GLY HN . 6934 1 736 . 1 1 82 82 GLY HA2 H 1 3.777 0.01 . 2 . . . . 62 GLY HA1 . 6934 1 737 . 1 1 82 82 GLY HA3 H 1 4.172 0.01 . 2 . . . . 62 GLY HA2 . 6934 1 738 . 1 1 82 82 GLY C C 13 174.135 0.2 . 1 . . . . 62 GLY C . 6934 1 739 . 1 1 82 82 GLY CA C 13 45.648 0.2 . 1 . . . . 62 GLY CA . 6934 1 740 . 1 1 82 82 GLY N N 15 112.095 0.15 . 1 . . . . 62 GLY N . 6934 1 741 . 1 1 83 83 HIS H H 1 7.615 0.01 . 1 . . . . 63 HIS HN . 6934 1 742 . 1 1 83 83 HIS HA H 1 4.302 0.01 . 1 . . . . 63 HIS HA . 6934 1 743 . 1 1 83 83 HIS HB2 H 1 2.790 0.01 . 2 . . . . 63 HIS HB1 . 6934 1 744 . 1 1 83 83 HIS HB3 H 1 3.103 0.01 . 2 . . . . 63 HIS HB2 . 6934 1 745 . 1 1 83 83 HIS HD1 H 1 6.730 0.01 . 4 . . . . 63 HIS HD1 . 6934 1 746 . 1 1 83 83 HIS HD2 H 1 6.480 0.01 . 4 . . . . 63 HIS HD2 . 6934 1 747 . 1 1 83 83 HIS HE1 H 1 7.610 0.01 . 4 . . . . 63 HIS HE1 . 6934 1 748 . 1 1 83 83 HIS C C 13 174.131 0.2 . 1 . . . . 63 HIS C . 6934 1 749 . 1 1 83 83 HIS CA C 13 57.725 0.2 . 1 . . . . 63 HIS CA . 6934 1 750 . 1 1 83 83 HIS CB C 13 31.660 0.2 . 1 . . . . 63 HIS CB . 6934 1 751 . 1 1 83 83 HIS N N 15 119.477 0.15 . 1 . . . . 63 HIS N . 6934 1 752 . 1 1 84 84 CYS H H 1 7.488 0.01 . 1 . . . . 64 CYS HN . 6934 1 753 . 1 1 84 84 CYS HA H 1 4.160 0.01 . 1 . . . . 64 CYS HA . 6934 1 754 . 1 1 84 84 CYS HB2 H 1 2.455 0.01 . 2 . . . . 64 CYS HB1 . 6934 1 755 . 1 1 84 84 CYS HB3 H 1 2.595 0.01 . 2 . . . . 64 CYS HB2 . 6934 1 756 . 1 1 84 84 CYS C C 13 172.854 0.2 . 1 . . . . 64 CYS C . 6934 1 757 . 1 1 84 84 CYS CA C 13 57.513 0.2 . 1 . . . . 64 CYS CA . 6934 1 758 . 1 1 84 84 CYS CB C 13 28.226 0.2 . 1 . . . . 64 CYS CB . 6934 1 759 . 1 1 84 84 CYS N N 15 127.377 0.15 . 1 . . . . 64 CYS N . 6934 1 760 . 1 1 85 85 ALA H H 1 8.912 0.01 . 1 . . . . 65 ALA HN . 6934 1 761 . 1 1 85 85 ALA HA H 1 4.510 0.01 . 1 . . . . 65 ALA HA . 6934 1 762 . 1 1 85 85 ALA HB1 H 1 1.366 0.01 . 1 . . . . 65 ALA HB . 6934 1 763 . 1 1 85 85 ALA HB2 H 1 1.366 0.01 . 1 . . . . 65 ALA HB . 6934 1 764 . 1 1 85 85 ALA HB3 H 1 1.366 0.01 . 1 . . . . 65 ALA HB . 6934 1 765 . 1 1 85 85 ALA C C 13 178.513 0.2 . 1 . . . . 65 ALA C . 6934 1 766 . 1 1 85 85 ALA CA C 13 52.573 0.2 . 1 . . . . 65 ALA CA . 6934 1 767 . 1 1 85 85 ALA CB C 13 19.306 0.2 . 1 . . . . 65 ALA CB . 6934 1 768 . 1 1 85 85 ALA N N 15 130.360 0.15 . 1 . . . . 65 ALA N . 6934 1 769 . 1 1 86 86 ARG H H 1 9.263 0.01 . 1 . . . . 66 ARG HN . 6934 1 770 . 1 1 86 86 ARG HA H 1 4.691 0.01 . 1 . . . . 66 ARG HA . 6934 1 771 . 1 1 86 86 ARG HB2 H 1 1.710 0.01 . 2 . . . . 66 ARG HB1 . 6934 1 772 . 1 1 86 86 ARG HB3 H 1 1.800 0.01 . 2 . . . . 66 ARG HB2 . 6934 1 773 . 1 1 86 86 ARG HG2 H 1 1.605 0.01 . 2 . . . . 66 ARG HG1 . 6934 1 774 . 1 1 86 86 ARG HG3 H 1 1.710 0.01 . 2 . . . . 66 ARG HG2 . 6934 1 775 . 1 1 86 86 ARG HD2 H 1 3.165 0.01 . 2 . . . . 66 ARG HD1 . 6934 1 776 . 1 1 86 86 ARG HD3 H 1 3.260 0.01 . 2 . . . . 66 ARG HD2 . 6934 1 777 . 1 1 86 86 ARG HE H 1 7.060 0.01 . 1 . . . . 66 ARG HE . 6934 1 778 . 1 1 86 86 ARG HH21 H 1 6.280 0.01 . 1 . . . . 66 ARG HH21 . 6934 1 779 . 1 1 86 86 ARG C C 13 173.274 0.2 . 1 . . . . 66 ARG C . 6934 1 780 . 1 1 86 86 ARG CA C 13 54.494 0.2 . 1 . . . . 66 ARG CA . 6934 1 781 . 1 1 86 86 ARG CB C 13 34.171 0.2 . 1 . . . . 66 ARG CB . 6934 1 782 . 1 1 86 86 ARG CG C 13 25.500 0.2 . 1 . . . . 66 ARG CG . 6934 1 783 . 1 1 86 86 ARG CD C 13 44.110 0.2 . 1 . . . . 66 ARG CD . 6934 1 784 . 1 1 86 86 ARG N N 15 120.868 0.15 . 1 . . . . 66 ARG N . 6934 1 785 . 1 1 86 86 ARG NE N 15 114.100 0.15 . 1 . . . . 66 ARG NE . 6934 1 786 . 1 1 87 87 GLN H H 1 8.848 0.01 . 1 . . . . 67 GLN HN . 6934 1 787 . 1 1 87 87 GLN HA H 1 4.490 0.01 . 1 . . . . 67 GLN HA . 6934 1 788 . 1 1 87 87 GLN HB2 H 1 1.840 0.01 . 2 . . . . 67 GLN HB1 . 6934 1 789 . 1 1 87 87 GLN HB3 H 1 2.020 0.01 . 2 . . . . 67 GLN HB2 . 6934 1 790 . 1 1 87 87 GLN HG2 H 1 2.735 0.01 . 2 . . . . 67 GLN HG1 . 6934 1 791 . 1 1 87 87 GLN HG3 H 1 2.500 0.01 . 2 . . . . 67 GLN HG2 . 6934 1 792 . 1 1 87 87 GLN HE21 H 1 7.310 0.01 . 2 . . . . 67 GLN HE21 . 6934 1 793 . 1 1 87 87 GLN HE22 H 1 6.715 0.01 . 2 . . . . 67 GLN HE22 . 6934 1 794 . 1 1 87 87 GLN C C 13 175.453 0.2 . 1 . . . . 67 GLN C . 6934 1 795 . 1 1 87 87 GLN CA C 13 53.925 0.2 . 1 . . . . 67 GLN CA . 6934 1 796 . 1 1 87 87 GLN CB C 13 29.100 0.2 . 1 . . . . 67 GLN CB . 6934 1 797 . 1 1 87 87 GLN CG C 13 31.600 0.2 . 1 . . . . 67 GLN CG . 6934 1 798 . 1 1 87 87 GLN N N 15 125.442 0.15 . 1 . . . . 67 GLN N . 6934 1 799 . 1 1 87 87 GLN NE2 N 15 113.251 0.15 . 1 . . . . 67 GLN NE2 . 6934 1 800 . 1 1 88 88 ILE H H 1 8.448 0.01 . 1 . . . . 68 ILE HN . 6934 1 801 . 1 1 88 88 ILE HA H 1 3.955 0.01 . 1 . . . . 68 ILE HA . 6934 1 802 . 1 1 88 88 ILE HB H 1 1.333 0.01 . 1 . . . . 68 ILE HB . 6934 1 803 . 1 1 88 88 ILE HG12 H 1 1.210 0.01 . 2 . . . . 68 ILE HG11 . 6934 1 804 . 1 1 88 88 ILE HG13 H 1 1.280 0.01 . 2 . . . . 68 ILE HG12 . 6934 1 805 . 1 1 88 88 ILE HG21 H 1 0.780 0.01 . 2 . . . . 68 ILE HG2 . 6934 1 806 . 1 1 88 88 ILE HG22 H 1 0.780 0.01 . 2 . . . . 68 ILE HG2 . 6934 1 807 . 1 1 88 88 ILE HG23 H 1 0.780 0.01 . 2 . . . . 68 ILE HG2 . 6934 1 808 . 1 1 88 88 ILE HD11 H 1 0.750 0.01 . 2 . . . . 68 ILE HD1 . 6934 1 809 . 1 1 88 88 ILE HD12 H 1 0.750 0.01 . 2 . . . . 68 ILE HD1 . 6934 1 810 . 1 1 88 88 ILE HD13 H 1 0.750 0.01 . 2 . . . . 68 ILE HD1 . 6934 1 811 . 1 1 88 88 ILE C C 13 171.433 0.2 . 1 . . . . 68 ILE C . 6934 1 812 . 1 1 88 88 ILE CA C 13 61.563 0.2 . 1 . . . . 68 ILE CA . 6934 1 813 . 1 1 88 88 ILE CB C 13 39.448 0.2 . 1 . . . . 68 ILE CB . 6934 1 814 . 1 1 88 88 ILE CG1 C 13 30.120 0.2 . 1 . . . . 68 ILE CG1 . 6934 1 815 . 1 1 88 88 ILE CG2 C 13 17.400 0.2 . 2 . . . . 68 ILE CG2 . 6934 1 816 . 1 1 88 88 ILE CD1 C 13 16.900 0.2 . 2 . . . . 68 ILE CD1 . 6934 1 817 . 1 1 88 88 ILE N N 15 127.457 0.15 . 1 . . . . 68 ILE N . 6934 1 818 . 1 1 89 89 SER H H 1 6.739 0.01 . 1 . . . . 69 SER HN . 6934 1 819 . 1 1 89 89 SER HA H 1 4.792 0.01 . 1 . . . . 69 SER HA . 6934 1 820 . 1 1 89 89 SER HB2 H 1 4.231 0.01 . 2 . . . . 69 SER HB1 . 6934 1 821 . 1 1 89 89 SER HB3 H 1 3.979 0.01 . 2 . . . . 69 SER HB2 . 6934 1 822 . 1 1 89 89 SER C C 13 174.266 0.2 . 1 . . . . 69 SER C . 6934 1 823 . 1 1 89 89 SER CA C 13 56.602 0.2 . 1 . . . . 69 SER CA . 6934 1 824 . 1 1 89 89 SER CB C 13 66.677 0.2 . 1 . . . . 69 SER CB . 6934 1 825 . 1 1 89 89 SER N N 15 116.198 0.15 . 1 . . . . 69 SER N . 6934 1 826 . 1 1 90 90 ARG H H 1 9.493 0.01 . 1 . . . . 70 ARG HN . 6934 1 827 . 1 1 90 90 ARG HA H 1 3.815 0.01 . 1 . . . . 70 ARG HA . 6934 1 828 . 1 1 90 90 ARG HB2 H 1 1.975 0.01 . 1 . . . . 70 ARG HB1 . 6934 1 829 . 1 1 90 90 ARG HB3 H 1 1.955 0.01 . 1 . . . . 70 ARG HB2 . 6934 1 830 . 1 1 90 90 ARG HG2 H 1 1.610 0.01 . 2 . . . . 70 ARG HG1 . 6934 1 831 . 1 1 90 90 ARG HG3 H 1 1.720 0.01 . 2 . . . . 70 ARG HG2 . 6934 1 832 . 1 1 90 90 ARG HD2 H 1 3.290 0.01 . 2 . . . . 70 ARG HD1 . 6934 1 833 . 1 1 90 90 ARG HD3 H 1 3.420 0.01 . 2 . . . . 70 ARG HD2 . 6934 1 834 . 1 1 90 90 ARG HE H 1 8.370 0.01 . 1 . . . . 70 ARG HE . 6934 1 835 . 1 1 90 90 ARG HH11 H 1 6.980 0.01 . 4 . . . . 70 ARG HH11 . 6934 1 836 . 1 1 90 90 ARG HH21 H 1 6.980 0.01 . 4 . . . . 70 ARG HH21 . 6934 1 837 . 1 1 90 90 ARG C C 13 177.573 0.2 . 1 . . . . 70 ARG C . 6934 1 838 . 1 1 90 90 ARG CA C 13 61.059 0.2 . 1 . . . . 70 ARG CA . 6934 1 839 . 1 1 90 90 ARG CB C 13 30.094 0.2 . 1 . . . . 70 ARG CB . 6934 1 840 . 1 1 90 90 ARG CG C 13 26.850 0.2 . 1 . . . . 70 ARG CG . 6934 1 841 . 1 1 90 90 ARG CD C 13 44.000 0.2 . 1 . . . . 70 ARG CD . 6934 1 842 . 1 1 90 90 ARG N N 15 124.761 0.15 . 1 . . . . 70 ARG N . 6934 1 843 . 1 1 90 90 ARG NE N 15 115.600 0.15 . 1 . . . . 70 ARG NE . 6934 1 844 . 1 1 91 91 ARG H H 1 8.401 0.01 . 1 . . . . 71 ARG HN . 6934 1 845 . 1 1 91 91 ARG HA H 1 3.905 0.01 . 1 . . . . 71 ARG HA . 6934 1 846 . 1 1 91 91 ARG HB2 H 1 1.875 0.01 . 2 . . . . 71 ARG HB1 . 6934 1 847 . 1 1 91 91 ARG HB3 H 1 1.755 0.01 . 2 . . . . 71 ARG HB2 . 6934 1 848 . 1 1 91 91 ARG HG2 H 1 1.625 0.01 . 1 . . . . 71 ARG HG1 . 6934 1 849 . 1 1 91 91 ARG HG3 H 1 1.625 0.01 . 1 . . . . 71 ARG HG2 . 6934 1 850 . 1 1 91 91 ARG HD2 H 1 3.420 0.01 . 2 . . . . 71 ARG HD1 . 6934 1 851 . 1 1 91 91 ARG HD3 H 1 3.180 0.01 . 2 . . . . 71 ARG HD2 . 6934 1 852 . 1 1 91 91 ARG C C 13 178.458 0.2 . 1 . . . . 71 ARG C . 6934 1 853 . 1 1 91 91 ARG CA C 13 59.102 0.2 . 1 . . . . 71 ARG CA . 6934 1 854 . 1 1 91 91 ARG CB C 13 29.873 0.2 . 1 . . . . 71 ARG CB . 6934 1 855 . 1 1 91 91 ARG CG C 13 27.200 0.2 . 1 . . . . 71 ARG CG . 6934 1 856 . 1 1 91 91 ARG N N 15 117.173 0.15 . 1 . . . . 71 ARG N . 6934 1 857 . 1 1 92 92 LEU H H 1 7.616 0.01 . 1 . . . . 72 LEU HN . 6934 1 858 . 1 1 92 92 LEU HA H 1 4.164 0.01 . 1 . . . . 72 LEU HA . 6934 1 859 . 1 1 92 92 LEU HB2 H 1 1.720 0.01 . 2 . . . . 72 LEU HB1 . 6934 1 860 . 1 1 92 92 LEU HB3 H 1 1.790 0.01 . 2 . . . . 72 LEU HB2 . 6934 1 861 . 1 1 92 92 LEU HG H 1 1.810 0.01 . 1 . . . . 72 LEU HG . 6934 1 862 . 1 1 92 92 LEU HD11 H 1 0.870 0.01 . 2 . . . . 72 LEU HD1 . 6934 1 863 . 1 1 92 92 LEU HD12 H 1 0.870 0.01 . 2 . . . . 72 LEU HD1 . 6934 1 864 . 1 1 92 92 LEU HD13 H 1 0.870 0.01 . 2 . . . . 72 LEU HD1 . 6934 1 865 . 1 1 92 92 LEU HD21 H 1 1.080 0.01 . 2 . . . . 72 LEU HD2 . 6934 1 866 . 1 1 92 92 LEU HD22 H 1 1.080 0.01 . 2 . . . . 72 LEU HD2 . 6934 1 867 . 1 1 92 92 LEU HD23 H 1 1.080 0.01 . 2 . . . . 72 LEU HD2 . 6934 1 868 . 1 1 92 92 LEU C C 13 179.016 0.2 . 1 . . . . 72 LEU C . 6934 1 869 . 1 1 92 92 LEU CA C 13 57.824 0.2 . 1 . . . . 72 LEU CA . 6934 1 870 . 1 1 92 92 LEU CB C 13 42.935 0.2 . 1 . . . . 72 LEU CB . 6934 1 871 . 1 1 92 92 LEU CG C 13 27.200 0.2 . 1 . . . . 72 LEU CG . 6934 1 872 . 1 1 92 92 LEU CD1 C 13 25.820 0.2 . 2 . . . . 72 LEU CD1 . 6934 1 873 . 1 1 92 92 LEU CD2 C 13 24.300 0.2 . 2 . . . . 72 LEU CD2 . 6934 1 874 . 1 1 92 92 LEU N N 15 119.519 0.15 . 1 . . . . 72 LEU N . 6934 1 875 . 1 1 93 93 CYS H H 1 7.621 0.01 . 1 . . . . 73 CYS HN . 6934 1 876 . 1 1 93 93 CYS HA H 1 3.900 0.01 . 1 . . . . 73 CYS HA . 6934 1 877 . 1 1 93 93 CYS HB2 H 1 3.196 0.01 . 2 . . . . 73 CYS HB1 . 6934 1 878 . 1 1 93 93 CYS HB3 H 1 2.625 0.01 . 2 . . . . 73 CYS HB2 . 6934 1 879 . 1 1 93 93 CYS C C 13 174.789 0.2 . 1 . . . . 73 CYS C . 6934 1 880 . 1 1 93 93 CYS CA C 13 64.580 0.2 . 1 . . . . 73 CYS CA . 6934 1 881 . 1 1 93 93 CYS CB C 13 27.456 0.2 . 1 . . . . 73 CYS CB . 6934 1 882 . 1 1 93 93 CYS N N 15 113.329 0.15 . 1 . . . . 73 CYS N . 6934 1 883 . 1 1 94 94 ARG H H 1 7.074 0.01 . 1 . . . . 74 ARG HN . 6934 1 884 . 1 1 94 94 ARG HA H 1 4.350 0.01 . 1 . . . . 74 ARG HA . 6934 1 885 . 1 1 94 94 ARG HB2 H 1 1.831 0.01 . 2 . . . . 74 ARG HB1 . 6934 1 886 . 1 1 94 94 ARG HB3 H 1 1.955 0.01 . 2 . . . . 74 ARG HB2 . 6934 1 887 . 1 1 94 94 ARG HG2 H 1 1.810 0.01 . 2 . . . . 74 ARG HG1 . 6934 1 888 . 1 1 94 94 ARG HG3 H 1 1.700 0.01 . 2 . . . . 74 ARG HG2 . 6934 1 889 . 1 1 94 94 ARG HD2 H 1 3.180 0.01 . 2 . . . . 74 ARG HD2 . 6934 1 890 . 1 1 94 94 ARG HE H 1 7.530 0.01 . 1 . . . . 74 ARG HE . 6934 1 891 . 1 1 94 94 ARG C C 13 176.633 0.2 . 1 . . . . 74 ARG C . 6934 1 892 . 1 1 94 94 ARG CA C 13 57.594 0.2 . 1 . . . . 74 ARG CA . 6934 1 893 . 1 1 94 94 ARG CB C 13 30.344 0.2 . 1 . . . . 74 ARG CB . 6934 1 894 . 1 1 94 94 ARG N N 15 112.691 0.15 . 1 . . . . 74 ARG N . 6934 1 895 . 1 1 94 94 ARG NE N 15 114.600 0.15 . 1 . . . . 74 ARG NE . 6934 1 896 . 1 1 95 95 ASN H H 1 7.477 0.01 . 1 . . . . 75 ASN HN . 6934 1 897 . 1 1 95 95 ASN HA H 1 4.509 0.01 . 1 . . . . 75 ASN HA . 6934 1 898 . 1 1 95 95 ASN HB2 H 1 2.501 0.01 . 1 . . . . 75 ASN HB1 . 6934 1 899 . 1 1 95 95 ASN HB3 H 1 2.501 0.01 . 1 . . . . 75 ASN HB2 . 6934 1 900 . 1 1 95 95 ASN HD21 H 1 7.266 0.01 . 4 . . . . 75 ASN HD21 . 6934 1 901 . 1 1 95 95 ASN HD22 H 1 6.814 0.01 . 4 . . . . 75 ASN HD22 . 6934 1 902 . 1 1 95 95 ASN C C 13 173.711 0.2 . 1 . . . . 75 ASN C . 6934 1 903 . 1 1 95 95 ASN CA C 13 53.464 0.2 . 1 . . . . 75 ASN CA . 6934 1 904 . 1 1 95 95 ASN CB C 13 38.522 0.2 . 1 . . . . 75 ASN CB . 6934 1 905 . 1 1 95 95 ASN N N 15 115.917 0.15 . 1 . . . . 75 ASN N . 6934 1 906 . 1 1 95 95 ASN ND2 N 15 112.250 0.15 . 1 . . . . 75 ASN ND2 . 6934 1 907 . 1 1 96 96 TYR H H 1 7.290 0.01 . 1 . . . . 76 TYR HN . 6934 1 908 . 1 1 96 96 TYR HA H 1 4.493 0.01 . 1 . . . . 76 TYR HA . 6934 1 909 . 1 1 96 96 TYR HB2 H 1 2.990 0.01 . 2 . . . . 76 TYR HB1 . 6934 1 910 . 1 1 96 96 TYR HB3 H 1 2.407 0.01 . 2 . . . . 76 TYR HB2 . 6934 1 911 . 1 1 96 96 TYR HD1 H 1 6.835 0.01 . 3 . . . . 76 TYR HD1 . 6934 1 912 . 1 1 96 96 TYR HE1 H 1 6.620 0.01 . 3 . . . . 76 TYR HE1 . 6934 1 913 . 1 1 96 96 TYR C C 13 173.673 0.2 . 1 . . . . 76 TYR C . 6934 1 914 . 1 1 96 96 TYR CA C 13 58.112 0.2 . 1 . . . . 76 TYR CA . 6934 1 915 . 1 1 96 96 TYR CB C 13 40.870 0.2 . 1 . . . . 76 TYR CB . 6934 1 916 . 1 1 96 96 TYR N N 15 116.799 0.15 . 1 . . . . 76 TYR N . 6934 1 917 . 1 1 97 97 ASP H H 1 9.154 0.01 . 1 . . . . 77 ASP HN . 6934 1 918 . 1 1 97 97 ASP HA H 1 4.704 0.01 . 1 . . . . 77 ASP HA . 6934 1 919 . 1 1 97 97 ASP HB2 H 1 2.770 0.01 . 2 . . . . 77 ASP HB1 . 6934 1 920 . 1 1 97 97 ASP HB3 H 1 3.159 0.01 . 2 . . . . 77 ASP HB2 . 6934 1 921 . 1 1 97 97 ASP C C 13 174.698 0.2 . 1 . . . . 77 ASP C . 6934 1 922 . 1 1 97 97 ASP CA C 13 55.768 0.2 . 1 . . . . 77 ASP CA . 6934 1 923 . 1 1 97 97 ASP CB C 13 44.307 0.2 . 1 . . . . 77 ASP CB . 6934 1 924 . 1 1 97 97 ASP N N 15 118.843 0.15 . 1 . . . . 77 ASP N . 6934 1 925 . 1 1 98 98 LEU H H 1 7.345 0.01 . 1 . . . . 78 LEU HN . 6934 1 926 . 1 1 98 98 LEU HA H 1 4.617 0.01 . 1 . . . . 78 LEU HA . 6934 1 927 . 1 1 98 98 LEU HB2 H 1 1.145 0.01 . 2 . . . . 78 LEU HB1 . 6934 1 928 . 1 1 98 98 LEU HB3 H 1 1.267 0.01 . 2 . . . . 78 LEU HB2 . 6934 1 929 . 1 1 98 98 LEU HG H 1 0.900 0.01 . 1 . . . . 78 LEU HG . 6934 1 930 . 1 1 98 98 LEU HD11 H 1 0.145 0.01 . 2 . . . . 78 LEU HD1 . 6934 1 931 . 1 1 98 98 LEU HD12 H 1 0.145 0.01 . 2 . . . . 78 LEU HD1 . 6934 1 932 . 1 1 98 98 LEU HD13 H 1 0.145 0.01 . 2 . . . . 78 LEU HD1 . 6934 1 933 . 1 1 98 98 LEU HD21 H 1 0.504 0.01 . 2 . . . . 78 LEU HD2 . 6934 1 934 . 1 1 98 98 LEU HD22 H 1 0.504 0.01 . 2 . . . . 78 LEU HD2 . 6934 1 935 . 1 1 98 98 LEU HD23 H 1 0.504 0.01 . 2 . . . . 78 LEU HD2 . 6934 1 936 . 1 1 98 98 LEU C C 13 173.452 0.2 . 1 . . . . 78 LEU C . 6934 1 937 . 1 1 98 98 LEU CA C 13 54.143 0.2 . 1 . . . . 78 LEU CA . 6934 1 938 . 1 1 98 98 LEU CB C 13 46.112 0.2 . 1 . . . . 78 LEU CB . 6934 1 939 . 1 1 98 98 LEU CG C 13 27.070 0.2 . 1 . . . . 78 LEU CG . 6934 1 940 . 1 1 98 98 LEU CD1 C 13 25.170 0.2 . 2 . . . . 78 LEU CD1 . 6934 1 941 . 1 1 98 98 LEU CD2 C 13 22.000 0.2 . 2 . . . . 78 LEU CD2 . 6934 1 942 . 1 1 98 98 LEU N N 15 117.418 0.15 . 1 . . . . 78 LEU N . 6934 1 943 . 1 1 99 99 ILE H H 1 8.753 0.01 . 1 . . . . 79 ILE HN . 6934 1 944 . 1 1 99 99 ILE HA H 1 5.080 0.01 . 1 . . . . 79 ILE HA . 6934 1 945 . 1 1 99 99 ILE HB H 1 1.746 0.01 . 1 . . . . 79 ILE HB . 6934 1 946 . 1 1 99 99 ILE HG12 H 1 1.440 0.01 . 1 . . . . 79 ILE HG11 . 6934 1 947 . 1 1 99 99 ILE HG13 H 1 0.975 0.01 . 1 . . . . 79 ILE HG12 . 6934 1 948 . 1 1 99 99 ILE HG21 H 1 0.660 0.01 . 1 . . . . 79 ILE HG2 . 6934 1 949 . 1 1 99 99 ILE HG22 H 1 0.660 0.01 . 1 . . . . 79 ILE HG2 . 6934 1 950 . 1 1 99 99 ILE HG23 H 1 0.660 0.01 . 1 . . . . 79 ILE HG2 . 6934 1 951 . 1 1 99 99 ILE HD11 H 1 0.862 0.01 . 1 . . . . 79 ILE HD1 . 6934 1 952 . 1 1 99 99 ILE HD12 H 1 0.862 0.01 . 1 . . . . 79 ILE HD1 . 6934 1 953 . 1 1 99 99 ILE HD13 H 1 0.862 0.01 . 1 . . . . 79 ILE HD1 . 6934 1 954 . 1 1 99 99 ILE C C 13 173.792 0.2 . 1 . . . . 79 ILE C . 6934 1 955 . 1 1 99 99 ILE CA C 13 59.325 0.2 . 1 . . . . 79 ILE CA . 6934 1 956 . 1 1 99 99 ILE CB C 13 39.478 0.2 . 1 . . . . 79 ILE CB . 6934 1 957 . 1 1 99 99 ILE CG1 C 13 27.150 0.2 . 1 . . . . 79 ILE CG1 . 6934 1 958 . 1 1 99 99 ILE CG2 C 13 18.300 0.2 . 1 . . . . 79 ILE CG2 . 6934 1 959 . 1 1 99 99 ILE CD1 C 13 13.880 0.2 . 1 . . . . 79 ILE CD1 . 6934 1 960 . 1 1 99 99 ILE N N 15 125.510 0.15 . 1 . . . . 79 ILE N . 6934 1 961 . 1 1 100 100 LEU H H 1 9.020 0.01 . 1 . . . . 80 LEU HN . 6934 1 962 . 1 1 100 100 LEU HA H 1 5.641 0.01 . 1 . . . . 80 LEU HA . 6934 1 963 . 1 1 100 100 LEU HB2 H 1 1.020 0.01 . 2 . . . . 80 LEU HB1 . 6934 1 964 . 1 1 100 100 LEU HB3 H 1 1.660 0.01 . 2 . . . . 80 LEU HB2 . 6934 1 965 . 1 1 100 100 LEU HG H 1 1.010 0.01 . 1 . . . . 80 LEU HG . 6934 1 966 . 1 1 100 100 LEU HD11 H 1 -0.230 0.01 . 2 . . . . 80 LEU HD1 . 6934 1 967 . 1 1 100 100 LEU HD12 H 1 -0.230 0.01 . 2 . . . . 80 LEU HD1 . 6934 1 968 . 1 1 100 100 LEU HD13 H 1 -0.230 0.01 . 2 . . . . 80 LEU HD1 . 6934 1 969 . 1 1 100 100 LEU HD21 H 1 0.051 0.01 . 2 . . . . 80 LEU HD2 . 6934 1 970 . 1 1 100 100 LEU HD22 H 1 0.051 0.01 . 2 . . . . 80 LEU HD2 . 6934 1 971 . 1 1 100 100 LEU HD23 H 1 0.051 0.01 . 2 . . . . 80 LEU HD2 . 6934 1 972 . 1 1 100 100 LEU C C 13 176.624 0.2 . 1 . . . . 80 LEU C . 6934 1 973 . 1 1 100 100 LEU CA C 13 51.428 0.2 . 1 . . . . 80 LEU CA . 6934 1 974 . 1 1 100 100 LEU CB C 13 45.512 0.2 . 1 . . . . 80 LEU CB . 6934 1 975 . 1 1 100 100 LEU CG C 13 26.440 0.2 . 1 . . . . 80 LEU CG . 6934 1 976 . 1 1 100 100 LEU CD1 C 13 23.650 0.2 . 2 . . . . 80 LEU CD1 . 6934 1 977 . 1 1 100 100 LEU CD2 C 13 23.900 0.2 . 2 . . . . 80 LEU CD2 . 6934 1 978 . 1 1 100 100 LEU N N 15 124.946 0.15 . 1 . . . . 80 LEU N . 6934 1 979 . 1 1 101 101 THR H H 1 8.969 0.01 . 1 . . . . 81 THR HN . 6934 1 980 . 1 1 101 101 THR HA H 1 5.640 0.01 . 1 . . . . 81 THR HA . 6934 1 981 . 1 1 101 101 THR HB H 1 4.170 0.01 . 1 . . . . 81 THR HB . 6934 1 982 . 1 1 101 101 THR HG21 H 1 0.960 0.01 . 1 . . . . 81 THR HG2 . 6934 1 983 . 1 1 101 101 THR HG22 H 1 0.960 0.01 . 1 . . . . 81 THR HG2 . 6934 1 984 . 1 1 101 101 THR HG23 H 1 0.960 0.01 . 1 . . . . 81 THR HG2 . 6934 1 985 . 1 1 101 101 THR C C 13 174.850 0.2 . 1 . . . . 81 THR C . 6934 1 986 . 1 1 101 101 THR CA C 13 59.269 0.2 . 1 . . . . 81 THR CA . 6934 1 987 . 1 1 101 101 THR CB C 13 71.128 0.2 . 1 . . . . 81 THR CB . 6934 1 988 . 1 1 101 101 THR CG2 C 13 20.540 0.2 . 1 . . . . 81 THR CG2 . 6934 1 989 . 1 1 101 101 THR N N 15 113.919 0.15 . 1 . . . . 81 THR N . 6934 1 990 . 1 1 102 102 MET H H 1 8.260 0.01 . 1 . . . . 82 MET HN . 6934 1 991 . 1 1 102 102 MET HA H 1 5.184 0.01 . 1 . . . . 82 MET HA . 6934 1 992 . 1 1 102 102 MET HB2 H 1 2.440 0.01 . 2 . . . . 82 MET HB1 . 6934 1 993 . 1 1 102 102 MET HB3 H 1 2.580 0.01 . 2 . . . . 82 MET HB2 . 6934 1 994 . 1 1 102 102 MET HG2 H 1 2.860 0.01 . 1 . . . . 82 MET HG1 . 6934 1 995 . 1 1 102 102 MET HG3 H 1 2.860 0.01 . 1 . . . . 82 MET HG2 . 6934 1 996 . 1 1 102 102 MET HE1 H 1 1.230 0.01 . 1 . . . . 82 MET HE . 6934 1 997 . 1 1 102 102 MET HE2 H 1 1.230 0.01 . 1 . . . . 82 MET HE . 6934 1 998 . 1 1 102 102 MET HE3 H 1 1.230 0.01 . 1 . . . . 82 MET HE . 6934 1 999 . 1 1 102 102 MET C C 13 176.598 0.2 . 1 . . . . 82 MET C . 6934 1 1000 . 1 1 102 102 MET CA C 13 56.488 0.2 . 1 . . . . 82 MET CA . 6934 1 1001 . 1 1 102 102 MET CB C 13 34.340 0.2 . 1 . . . . 82 MET CB . 6934 1 1002 . 1 1 102 102 MET CE C 13 18.500 0.2 . 1 . . . . 82 MET CE . 6934 1 1003 . 1 1 102 102 MET N N 15 118.992 0.15 . 1 . . . . 82 MET N . 6934 1 1004 . 1 1 103 103 GLU H H 1 8.015 0.01 . 1 . . . . 83 GLU HN . 6934 1 1005 . 1 1 103 103 GLU HA H 1 4.662 0.01 . 1 . . . . 83 GLU HA . 6934 1 1006 . 1 1 103 103 GLU HB2 H 1 0.180 0.01 . 2 . . . . 83 GLU HB1 . 6934 1 1007 . 1 1 103 103 GLU HB3 H 1 2.130 0.01 . 2 . . . . 83 GLU HB2 . 6934 1 1008 . 1 1 103 103 GLU HG2 H 1 1.780 0.01 . 2 . . . . 83 GLU HG1 . 6934 1 1009 . 1 1 103 103 GLU HG3 H 1 2.020 0.01 . 2 . . . . 83 GLU HG2 . 6934 1 1010 . 1 1 103 103 GLU C C 13 177.158 0.2 . 1 . . . . 83 GLU C . 6934 1 1011 . 1 1 103 103 GLU CA C 13 54.055 0.2 . 1 . . . . 83 GLU CA . 6934 1 1012 . 1 1 103 103 GLU CB C 13 33.158 0.2 . 1 . . . . 83 GLU CB . 6934 1 1013 . 1 1 103 103 GLU CG C 13 37.400 0.2 . 1 . . . . 83 GLU CG . 6934 1 1014 . 1 1 103 103 GLU N N 15 119.203 0.15 . 1 . . . . 83 GLU N . 6934 1 1015 . 1 1 104 104 LYS H H 1 10.412 0.01 . 1 . . . . 84 LYS HN . 6934 1 1016 . 1 1 104 104 LYS HA H 1 3.765 0.01 . 1 . . . . 84 LYS HA . 6934 1 1017 . 1 1 104 104 LYS HB2 H 1 1.786 0.01 . 2 . . . . 84 LYS HB1 . 6934 1 1018 . 1 1 104 104 LYS HB3 H 1 1.904 0.01 . 2 . . . . 84 LYS HB2 . 6934 1 1019 . 1 1 104 104 LYS HG2 H 1 1.445 0.01 . 1 . . . . 84 LYS HG1 . 6934 1 1020 . 1 1 104 104 LYS HG3 H 1 1.445 0.01 . 1 . . . . 84 LYS HG2 . 6934 1 1021 . 1 1 104 104 LYS HD2 H 1 1.660 0.01 . 2 . . . . 84 LYS HD1 . 6934 1 1022 . 1 1 104 104 LYS HD3 H 1 1.710 0.01 . 2 . . . . 84 LYS HD2 . 6934 1 1023 . 1 1 104 104 LYS HE2 H 1 2.965 0.01 . 1 . . . . 84 LYS HE1 . 6934 1 1024 . 1 1 104 104 LYS HE3 H 1 2.965 0.01 . 1 . . . . 84 LYS HE2 . 6934 1 1025 . 1 1 104 104 LYS C C 13 180.626 0.2 . 1 . . . . 84 LYS C . 6934 1 1026 . 1 1 104 104 LYS CA C 13 61.182 0.2 . 1 . . . . 84 LYS CA . 6934 1 1027 . 1 1 104 104 LYS CB C 13 31.467 0.2 . 1 . . . . 84 LYS CB . 6934 1 1028 . 1 1 104 104 LYS CG C 13 27.100 0.2 . 1 . . . . 84 LYS CG . 6934 1 1029 . 1 1 104 104 LYS CD C 13 29.600 0.2 . 1 . . . . 84 LYS CD . 6934 1 1030 . 1 1 104 104 LYS CE C 13 42.000 0.2 . 1 . . . . 84 LYS CE . 6934 1 1031 . 1 1 104 104 LYS N N 15 126.937 0.15 . 1 . . . . 84 LYS N . 6934 1 1032 . 1 1 105 105 ARG H H 1 9.050 0.01 . 1 . . . . 85 ARG HN . 6934 1 1033 . 1 1 105 105 ARG HA H 1 4.195 0.01 . 1 . . . . 85 ARG HA . 6934 1 1034 . 1 1 105 105 ARG HB2 H 1 1.790 0.01 . 2 . . . . 85 ARG HB1 . 6934 1 1035 . 1 1 105 105 ARG HB3 H 1 1.880 0.01 . 2 . . . . 85 ARG HB2 . 6934 1 1036 . 1 1 105 105 ARG HG2 H 1 1.550 0.01 . 2 . . . . 85 ARG HG1 . 6934 1 1037 . 1 1 105 105 ARG HG3 H 1 1.440 0.01 . 2 . . . . 85 ARG HG2 . 6934 1 1038 . 1 1 105 105 ARG HD2 H 1 3.140 0.01 . 2 . . . . 85 ARG HD1 . 6934 1 1039 . 1 1 105 105 ARG HD3 H 1 3.260 0.01 . 2 . . . . 85 ARG HD2 . 6934 1 1040 . 1 1 105 105 ARG C C 13 178.092 0.2 . 1 . . . . 85 ARG C . 6934 1 1041 . 1 1 105 105 ARG CA C 13 58.244 0.2 . 1 . . . . 85 ARG CA . 6934 1 1042 . 1 1 105 105 ARG CB C 13 29.119 0.2 . 1 . . . . 85 ARG CB . 6934 1 1043 . 1 1 105 105 ARG CG C 13 26.500 0.2 . 1 . . . . 85 ARG CG . 6934 1 1044 . 1 1 105 105 ARG CD C 13 43.250 0.2 . 1 . . . . 85 ARG CD . 6934 1 1045 . 1 1 105 105 ARG N N 15 118.528 0.15 . 1 . . . . 85 ARG N . 6934 1 1046 . 1 1 106 106 HIS H H 1 7.057 0.01 . 1 . . . . 86 HIS HN . 6934 1 1047 . 1 1 106 106 HIS HA H 1 4.275 0.01 . 1 . . . . 86 HIS HA . 6934 1 1048 . 1 1 106 106 HIS HB2 H 1 3.641 0.01 . 2 . . . . 86 HIS HB1 . 6934 1 1049 . 1 1 106 106 HIS HB3 H 1 3.070 0.01 . 2 . . . . 86 HIS HB2 . 6934 1 1050 . 1 1 106 106 HIS HD1 H 1 6.750 0.01 . 4 . . . . 86 HIS HD1 . 6934 1 1051 . 1 1 106 106 HIS HD2 H 1 7.490 0.01 . 4 . . . . 86 HIS HD2 . 6934 1 1052 . 1 1 106 106 HIS HE1 H 1 8.976 0.01 . 1 . . . . 86 HIS HE1 . 6934 1 1053 . 1 1 106 106 HIS C C 13 177.980 0.2 . 1 . . . . 86 HIS C . 6934 1 1054 . 1 1 106 106 HIS CA C 13 56.744 0.2 . 1 . . . . 86 HIS CA . 6934 1 1055 . 1 1 106 106 HIS CB C 13 33.075 0.2 . 1 . . . . 86 HIS CB . 6934 1 1056 . 1 1 106 106 HIS N N 15 118.294 0.15 . 1 . . . . 86 HIS N . 6934 1 1057 . 1 1 107 107 ILE H H 1 7.402 0.01 . 1 . . . . 87 ILE HN . 6934 1 1058 . 1 1 107 107 ILE HA H 1 3.474 0.01 . 1 . . . . 87 ILE HA . 6934 1 1059 . 1 1 107 107 ILE HB H 1 2.245 0.01 . 1 . . . . 87 ILE HB . 6934 1 1060 . 1 1 107 107 ILE HG12 H 1 1.723 0.01 . 1 . . . . 87 ILE HG11 . 6934 1 1061 . 1 1 107 107 ILE HG13 H 1 0.675 0.01 . 1 . . . . 87 ILE HG12 . 6934 1 1062 . 1 1 107 107 ILE HG21 H 1 0.820 0.01 . 1 . . . . 87 ILE HG2 . 6934 1 1063 . 1 1 107 107 ILE HG22 H 1 0.820 0.01 . 1 . . . . 87 ILE HG2 . 6934 1 1064 . 1 1 107 107 ILE HG23 H 1 0.820 0.01 . 1 . . . . 87 ILE HG2 . 6934 1 1065 . 1 1 107 107 ILE HD11 H 1 0.825 0.01 . 1 . . . . 87 ILE HD1 . 6934 1 1066 . 1 1 107 107 ILE HD12 H 1 0.825 0.01 . 1 . . . . 87 ILE HD1 . 6934 1 1067 . 1 1 107 107 ILE HD13 H 1 0.825 0.01 . 1 . . . . 87 ILE HD1 . 6934 1 1068 . 1 1 107 107 ILE C C 13 178.037 0.2 . 1 . . . . 87 ILE C . 6934 1 1069 . 1 1 107 107 ILE CA C 13 66.265 0.2 . 1 . . . . 87 ILE CA . 6934 1 1070 . 1 1 107 107 ILE CB C 13 37.525 0.2 . 1 . . . . 87 ILE CB . 6934 1 1071 . 1 1 107 107 ILE CG1 C 13 29.000 0.2 . 1 . . . . 87 ILE CG1 . 6934 1 1072 . 1 1 107 107 ILE CG2 C 13 16.300 0.2 . 1 . . . . 87 ILE CG2 . 6934 1 1073 . 1 1 107 107 ILE CD1 C 13 13.260 0.2 . 1 . . . . 87 ILE CD1 . 6934 1 1074 . 1 1 107 107 ILE N N 15 119.150 0.15 . 1 . . . . 87 ILE N . 6934 1 1075 . 1 1 108 108 GLU H H 1 7.226 0.01 . 1 . . . . 88 GLU HN . 6934 1 1076 . 1 1 108 108 GLU HA H 1 3.968 0.01 . 1 . . . . 88 GLU HA . 6934 1 1077 . 1 1 108 108 GLU HB2 H 1 2.117 0.01 . 1 . . . . 88 GLU HB1 . 6934 1 1078 . 1 1 108 108 GLU HB3 H 1 2.117 0.01 . 1 . . . . 88 GLU HB2 . 6934 1 1079 . 1 1 108 108 GLU HG2 H 1 2.260 0.01 . 2 . . . . 88 GLU HG1 . 6934 1 1080 . 1 1 108 108 GLU HG3 H 1 2.380 0.01 . 2 . . . . 88 GLU HG2 . 6934 1 1081 . 1 1 108 108 GLU C C 13 179.153 0.2 . 1 . . . . 88 GLU C . 6934 1 1082 . 1 1 108 108 GLU CA C 13 59.240 0.2 . 1 . . . . 88 GLU CA . 6934 1 1083 . 1 1 108 108 GLU CB C 13 29.143 0.2 . 1 . . . . 88 GLU CB . 6934 1 1084 . 1 1 108 108 GLU CG C 13 35.800 0.2 . 1 . . . . 88 GLU CG . 6934 1 1085 . 1 1 108 108 GLU N N 15 117.661 0.15 . 1 . . . . 88 GLU N . 6934 1 1086 . 1 1 109 109 ARG H H 1 7.675 0.01 . 1 . . . . 89 ARG HN . 6934 1 1087 . 1 1 109 109 ARG HA H 1 4.140 0.01 . 1 . . . . 89 ARG HA . 6934 1 1088 . 1 1 109 109 ARG HB2 H 1 1.990 0.01 . 1 . . . . 89 ARG HB1 . 6934 1 1089 . 1 1 109 109 ARG HB3 H 1 1.990 0.01 . 1 . . . . 89 ARG HB2 . 6934 1 1090 . 1 1 109 109 ARG HG2 H 1 1.820 0.01 . 2 . . . . 89 ARG HG1 . 6934 1 1091 . 1 1 109 109 ARG HG3 H 1 1.888 0.01 . 2 . . . . 89 ARG HG2 . 6934 1 1092 . 1 1 109 109 ARG HD2 H 1 3.390 0.01 . 2 . . . . 89 ARG HD1 . 6934 1 1093 . 1 1 109 109 ARG HD3 H 1 3.095 0.01 . 2 . . . . 89 ARG HD2 . 6934 1 1094 . 1 1 109 109 ARG C C 13 179.649 0.2 . 1 . . . . 89 ARG C . 6934 1 1095 . 1 1 109 109 ARG CA C 13 58.592 0.2 . 1 . . . . 89 ARG CA . 6934 1 1096 . 1 1 109 109 ARG CB C 13 30.747 0.2 . 1 . . . . 89 ARG CB . 6934 1 1097 . 1 1 109 109 ARG CG C 13 26.500 0.2 . 1 . . . . 89 ARG CG . 6934 1 1098 . 1 1 109 109 ARG CD C 13 43.200 0.2 . 1 . . . . 89 ARG CD . 6934 1 1099 . 1 1 109 109 ARG N N 15 117.578 0.15 . 1 . . . . 89 ARG N . 6934 1 1100 . 1 1 110 110 LEU H H 1 8.322 0.01 . 1 . . . . 90 LEU HN . 6934 1 1101 . 1 1 110 110 LEU HA H 1 4.000 0.01 . 1 . . . . 90 LEU HA . 6934 1 1102 . 1 1 110 110 LEU HB2 H 1 1.393 0.01 . 2 . . . . 90 LEU HB1 . 6934 1 1103 . 1 1 110 110 LEU HB3 H 1 2.055 0.01 . 2 . . . . 90 LEU HB2 . 6934 1 1104 . 1 1 110 110 LEU HG H 1 1.743 0.01 . 1 . . . . 90 LEU HG . 6934 1 1105 . 1 1 110 110 LEU HD11 H 1 0.760 0.01 . 2 . . . . 90 LEU HD1 . 6934 1 1106 . 1 1 110 110 LEU HD12 H 1 0.760 0.01 . 2 . . . . 90 LEU HD1 . 6934 1 1107 . 1 1 110 110 LEU HD13 H 1 0.760 0.01 . 2 . . . . 90 LEU HD1 . 6934 1 1108 . 1 1 110 110 LEU HD21 H 1 0.820 0.01 . 2 . . . . 90 LEU HD2 . 6934 1 1109 . 1 1 110 110 LEU HD22 H 1 0.820 0.01 . 2 . . . . 90 LEU HD2 . 6934 1 1110 . 1 1 110 110 LEU HD23 H 1 0.820 0.01 . 2 . . . . 90 LEU HD2 . 6934 1 1111 . 1 1 110 110 LEU C C 13 178.312 0.2 . 1 . . . . 90 LEU C . 6934 1 1112 . 1 1 110 110 LEU CA C 13 58.352 0.2 . 1 . . . . 90 LEU CA . 6934 1 1113 . 1 1 110 110 LEU CB C 13 42.361 0.2 . 1 . . . . 90 LEU CB . 6934 1 1114 . 1 1 110 110 LEU CG C 13 28.000 0.2 . 1 . . . . 90 LEU CG . 6934 1 1115 . 1 1 110 110 LEU CD1 C 13 26.500 0.2 . 2 . . . . 90 LEU CD1 . 6934 1 1116 . 1 1 110 110 LEU CD2 C 13 24.830 0.2 . 2 . . . . 90 LEU CD2 . 6934 1 1117 . 1 1 110 110 LEU N N 15 121.464 0.15 . 1 . . . . 90 LEU N . 6934 1 1118 . 1 1 111 111 CYS H H 1 8.257 0.01 . 1 . . . . 91 CYS HN . 6934 1 1119 . 1 1 111 111 CYS HA H 1 3.989 0.01 . 1 . . . . 91 CYS HA . 6934 1 1120 . 1 1 111 111 CYS HB2 H 1 2.726 0.01 . 2 . . . . 91 CYS HB1 . 6934 1 1121 . 1 1 111 111 CYS HB3 H 1 2.980 0.01 . 2 . . . . 91 CYS HB2 . 6934 1 1122 . 1 1 111 111 CYS CA C 13 62.928 0.2 . 1 . . . . 91 CYS CA . 6934 1 1123 . 1 1 111 111 CYS CB C 13 26.982 0.2 . 1 . . . . 91 CYS CB . 6934 1 1124 . 1 1 111 111 CYS N N 15 115.667 0.15 . 1 . . . . 91 CYS N . 6934 1 1125 . 1 1 112 112 GLU H H 1 7.604 0.01 . 1 . . . . 92 GLU HN . 6934 1 1126 . 1 1 112 112 GLU HA H 1 4.059 0.01 . 1 . . . . 92 GLU HA . 6934 1 1127 . 1 1 112 112 GLU HB2 H 1 2.160 0.01 . 2 . . . . 92 GLU HB1 . 6934 1 1128 . 1 1 112 112 GLU HB3 H 1 2.090 0.01 . 2 . . . . 92 GLU HB2 . 6934 1 1129 . 1 1 112 112 GLU HG2 H 1 2.240 0.01 . 2 . . . . 92 GLU HG1 . 6934 1 1130 . 1 1 112 112 GLU HG3 H 1 2.410 0.01 . 2 . . . . 92 GLU HG2 . 6934 1 1131 . 1 1 112 112 GLU C C 13 177.809 0.2 . 1 . . . . 92 GLU C . 6934 1 1132 . 1 1 112 112 GLU CA C 13 58.301 0.2 . 1 . . . . 92 GLU CA . 6934 1 1133 . 1 1 112 112 GLU CB C 13 29.679 0.2 . 1 . . . . 92 GLU CB . 6934 1 1134 . 1 1 112 112 GLU CG C 13 36.300 0.2 . 1 . . . . 92 GLU CG . 6934 1 1135 . 1 1 112 112 GLU N N 15 118.896 0.15 . 1 . . . . 92 GLU N . 6934 1 1136 . 1 1 113 113 MET H H 1 7.385 0.01 . 1 . . . . 93 MET HN . 6934 1 1137 . 1 1 113 113 MET HA H 1 4.132 0.01 . 1 . . . . 93 MET HA . 6934 1 1138 . 1 1 113 113 MET HB2 H 1 2.119 0.01 . 2 . . . . 93 MET HB1 . 6934 1 1139 . 1 1 113 113 MET HB3 H 1 2.245 0.01 . 2 . . . . 93 MET HB2 . 6934 1 1140 . 1 1 113 113 MET HG2 H 1 2.640 0.01 . 2 . . . . 93 MET HG1 . 6934 1 1141 . 1 1 113 113 MET HG3 H 1 2.345 0.01 . 2 . . . . 93 MET HG2 . 6934 1 1142 . 1 1 113 113 MET HE1 H 1 1.950 0.01 . 1 . . . . 93 MET HE . 6934 1 1143 . 1 1 113 113 MET HE2 H 1 1.950 0.01 . 1 . . . . 93 MET HE . 6934 1 1144 . 1 1 113 113 MET HE3 H 1 1.950 0.01 . 1 . . . . 93 MET HE . 6934 1 1145 . 1 1 113 113 MET C C 13 175.748 0.2 . 1 . . . . 93 MET C . 6934 1 1146 . 1 1 113 113 MET CA C 13 57.752 0.2 . 1 . . . . 93 MET CA . 6934 1 1147 . 1 1 113 113 MET CB C 13 33.825 0.2 . 1 . . . . 93 MET CB . 6934 1 1148 . 1 1 113 113 MET CG C 13 31.286 0.2 . 1 . . . . 93 MET CG . 6934 1 1149 . 1 1 113 113 MET CE C 13 16.600 0.2 . 1 . . . . 93 MET CE . 6934 1 1150 . 1 1 113 113 MET N N 15 118.130 0.15 . 1 . . . . 93 MET N . 6934 1 1151 . 1 1 114 114 ALA H H 1 8.111 0.01 . 1 . . . . 94 ALA HN . 6934 1 1152 . 1 1 114 114 ALA HA H 1 4.844 0.01 . 1 . . . . 94 ALA HA . 6934 1 1153 . 1 1 114 114 ALA HB1 H 1 1.130 0.01 . 1 . . . . 94 ALA HB . 6934 1 1154 . 1 1 114 114 ALA HB2 H 1 1.130 0.01 . 1 . . . . 94 ALA HB . 6934 1 1155 . 1 1 114 114 ALA HB3 H 1 1.130 0.01 . 1 . . . . 94 ALA HB . 6934 1 1156 . 1 1 114 114 ALA CA C 13 49.063 0.2 . 1 . . . . 94 ALA CA . 6934 1 1157 . 1 1 114 114 ALA CB C 13 19.426 0.2 . 1 . . . . 94 ALA CB . 6934 1 1158 . 1 1 114 114 ALA N N 15 119.705 0.15 . 1 . . . . 94 ALA N . 6934 1 1159 . 1 1 115 115 PRO HA H 1 4.506 0.01 . 1 . . . . 95 PRO HA . 6934 1 1160 . 1 1 115 115 PRO HB2 H 1 2.440 0.01 . 2 . . . . 95 PRO HB1 . 6934 1 1161 . 1 1 115 115 PRO HB3 H 1 1.975 0.01 . 2 . . . . 95 PRO HB2 . 6934 1 1162 . 1 1 115 115 PRO HG2 H 1 2.050 0.01 . 1 . . . . 95 PRO HG1 . 6934 1 1163 . 1 1 115 115 PRO HG3 H 1 2.050 0.01 . 1 . . . . 95 PRO HG2 . 6934 1 1164 . 1 1 115 115 PRO HD2 H 1 3.620 0.01 . 2 . . . . 95 PRO HD1 . 6934 1 1165 . 1 1 115 115 PRO HD3 H 1 3.360 0.01 . 2 . . . . 95 PRO HD2 . 6934 1 1166 . 1 1 115 115 PRO C C 13 179.421 0.2 . 1 . . . . 95 PRO C . 6934 1 1167 . 1 1 115 115 PRO CA C 13 65.280 0.2 . 1 . . . . 95 PRO CA . 6934 1 1168 . 1 1 115 115 PRO CB C 13 31.630 0.2 . 1 . . . . 95 PRO CB . 6934 1 1169 . 1 1 115 115 PRO CG C 13 27.310 0.2 . 1 . . . . 95 PRO CG . 6934 1 1170 . 1 1 115 115 PRO CD C 13 50.000 0.2 . 1 . . . . 95 PRO CD . 6934 1 1171 . 1 1 116 116 GLU H H 1 10.257 0.01 . 1 . . . . 96 GLU HN . 6934 1 1172 . 1 1 116 116 GLU HA H 1 4.315 0.01 . 1 . . . . 96 GLU HA . 6934 1 1173 . 1 1 116 116 GLU HB2 H 1 2.140 0.01 . 2 . . . . 96 GLU HB1 . 6934 1 1174 . 1 1 116 116 GLU HB3 H 1 2.059 0.01 . 2 . . . . 96 GLU HB2 . 6934 1 1175 . 1 1 116 116 GLU HG2 H 1 2.020 0.01 . 2 . . . . 96 GLU HG1 . 6934 1 1176 . 1 1 116 116 GLU HG3 H 1 2.410 0.01 . 2 . . . . 96 GLU HG2 . 6934 1 1177 . 1 1 116 116 GLU C C 13 177.470 0.2 . 1 . . . . 96 GLU C . 6934 1 1178 . 1 1 116 116 GLU CA C 13 58.183 0.2 . 1 . . . . 96 GLU CA . 6934 1 1179 . 1 1 116 116 GLU CB C 13 27.686 0.2 . 1 . . . . 96 GLU CB . 6934 1 1180 . 1 1 116 116 GLU CG C 13 35.300 0.2 . 1 . . . . 96 GLU CG . 6934 1 1181 . 1 1 116 116 GLU N N 15 118.729 0.15 . 1 . . . . 96 GLU N . 6934 1 1182 . 1 1 117 117 MET H H 1 8.514 0.01 . 1 . . . . 97 MET HN . 6934 1 1183 . 1 1 117 117 MET HA H 1 4.743 0.01 . 1 . . . . 97 MET HA . 6934 1 1184 . 1 1 117 117 MET HB2 H 1 2.120 0.01 . 2 . . . . 97 MET HB1 . 6934 1 1185 . 1 1 117 117 MET HB3 H 1 2.020 0.01 . 2 . . . . 97 MET HB2 . 6934 1 1186 . 1 1 117 117 MET HG2 H 1 2.420 0.01 . 2 . . . . 97 MET HG1 . 6934 1 1187 . 1 1 117 117 MET HG3 H 1 2.330 0.01 . 2 . . . . 97 MET HG2 . 6934 1 1188 . 1 1 117 117 MET HE1 H 1 2.030 0.01 . 1 . . . . 97 MET HE . 6934 1 1189 . 1 1 117 117 MET HE2 H 1 2.030 0.01 . 1 . . . . 97 MET HE . 6934 1 1190 . 1 1 117 117 MET HE3 H 1 2.030 0.01 . 1 . . . . 97 MET HE . 6934 1 1191 . 1 1 117 117 MET C C 13 176.244 0.2 . 1 . . . . 97 MET C . 6934 1 1192 . 1 1 117 117 MET CA C 13 53.473 0.2 . 1 . . . . 97 MET CA . 6934 1 1193 . 1 1 117 117 MET CB C 13 29.837 0.2 . 1 . . . . 97 MET CB . 6934 1 1194 . 1 1 117 117 MET CG C 13 32.500 0.2 . 1 . . . . 97 MET CG . 6934 1 1195 . 1 1 117 117 MET CE C 13 16.400 0.2 . 1 . . . . 97 MET CE . 6934 1 1196 . 1 1 117 117 MET N N 15 118.554 0.15 . 1 . . . . 97 MET N . 6934 1 1197 . 1 1 118 118 ARG H H 1 7.515 0.01 . 1 . . . . 98 ARG HN . 6934 1 1198 . 1 1 118 118 ARG HA H 1 4.109 0.01 . 1 . . . . 98 ARG HA . 6934 1 1199 . 1 1 118 118 ARG HB2 H 1 1.930 0.01 . 2 . . . . 98 ARG HB1 . 6934 1 1200 . 1 1 118 118 ARG HB3 H 1 1.830 0.01 . 2 . . . . 98 ARG HB2 . 6934 1 1201 . 1 1 118 118 ARG HG2 H 1 1.820 0.01 . 2 . . . . 98 ARG HG1 . 6934 1 1202 . 1 1 118 118 ARG HG3 H 1 1.690 0.01 . 2 . . . . 98 ARG HG2 . 6934 1 1203 . 1 1 118 118 ARG HD2 H 1 3.215 0.01 . 2 . . . . 98 ARG HD1 . 6934 1 1204 . 1 1 118 118 ARG HD3 H 1 3.350 0.01 . 2 . . . . 98 ARG HD2 . 6934 1 1205 . 1 1 118 118 ARG HE H 1 7.340 0.01 . 1 . . . . 98 ARG HE . 6934 1 1206 . 1 1 118 118 ARG C C 13 177.221 0.2 . 1 . . . . 98 ARG C . 6934 1 1207 . 1 1 118 118 ARG CA C 13 59.701 0.2 . 1 . . . . 98 ARG CA . 6934 1 1208 . 1 1 118 118 ARG CB C 13 29.750 0.2 . 1 . . . . 98 ARG CB . 6934 1 1209 . 1 1 118 118 ARG CG C 13 27.140 0.2 . 1 . . . . 98 ARG CG . 6934 1 1210 . 1 1 118 118 ARG CD C 13 43.200 0.2 . 1 . . . . 98 ARG CD . 6934 1 1211 . 1 1 118 118 ARG N N 15 121.019 0.15 . 1 . . . . 98 ARG N . 6934 1 1212 . 1 1 118 118 ARG NE N 15 113.678 0.15 . 1 . . . . 98 ARG NE . 6934 1 1213 . 1 1 119 119 GLY H H 1 8.899 0.01 . 1 . . . . 99 GLY HN . 6934 1 1214 . 1 1 119 119 GLY HA2 H 1 3.840 0.01 . 2 . . . . 99 GLY HA1 . 6934 1 1215 . 1 1 119 119 GLY HA3 H 1 4.331 0.01 . 2 . . . . 99 GLY HA2 . 6934 1 1216 . 1 1 119 119 GLY C C 13 174.660 0.2 . 1 . . . . 99 GLY C . 6934 1 1217 . 1 1 119 119 GLY CA C 13 45.467 0.2 . 1 . . . . 99 GLY CA . 6934 1 1218 . 1 1 119 119 GLY N N 15 113.279 0.15 . 1 . . . . 99 GLY N . 6934 1 1219 . 1 1 120 120 LYS H H 1 8.495 0.01 . 1 . . . . 100 LYS HN . 6934 1 1220 . 1 1 120 120 LYS HA H 1 4.543 0.01 . 1 . . . . 100 LYS HA . 6934 1 1221 . 1 1 120 120 LYS HB2 H 1 1.800 0.01 . 2 . . . . 100 LYS HB1 . 6934 1 1222 . 1 1 120 120 LYS HB3 H 1 2.230 0.01 . 2 . . . . 100 LYS HB2 . 6934 1 1223 . 1 1 120 120 LYS HG2 H 1 1.391 0.01 . 1 . . . . 100 LYS HG1 . 6934 1 1224 . 1 1 120 120 LYS HG3 H 1 1.391 0.01 . 1 . . . . 100 LYS HG2 . 6934 1 1225 . 1 1 120 120 LYS HD2 H 1 1.470 0.01 . 2 . . . . 100 LYS HD1 . 6934 1 1226 . 1 1 120 120 LYS HD3 H 1 1.360 0.01 . 2 . . . . 100 LYS HD2 . 6934 1 1227 . 1 1 120 120 LYS HE2 H 1 3.110 0.01 . 1 . . . . 100 LYS HE1 . 6934 1 1228 . 1 1 120 120 LYS HE3 H 1 3.110 0.01 . 1 . . . . 100 LYS HE2 . 6934 1 1229 . 1 1 120 120 LYS C C 13 173.118 0.2 . 1 . . . . 100 LYS C . 6934 1 1230 . 1 1 120 120 LYS CA C 13 55.454 0.2 . 1 . . . . 100 LYS CA . 6934 1 1231 . 1 1 120 120 LYS CB C 13 33.420 0.2 . 1 . . . . 100 LYS CB . 6934 1 1232 . 1 1 120 120 LYS CG C 13 25.000 0.2 . 1 . . . . 100 LYS CG . 6934 1 1233 . 1 1 120 120 LYS CD C 13 25.000 0.2 . 1 . . . . 100 LYS CD . 6934 1 1234 . 1 1 120 120 LYS N N 15 119.138 0.15 . 1 . . . . 100 LYS N . 6934 1 1235 . 1 1 121 121 VAL H H 1 6.892 0.01 . 1 . . . . 101 VAL HN . 6934 1 1236 . 1 1 121 121 VAL HA H 1 5.287 0.01 . 1 . . . . 101 VAL HA . 6934 1 1237 . 1 1 121 121 VAL HB H 1 1.867 0.01 . 1 . . . . 101 VAL HB . 6934 1 1238 . 1 1 121 121 VAL HG11 H 1 0.835 0.01 . 2 . . . . 101 VAL HG1 . 6934 1 1239 . 1 1 121 121 VAL HG12 H 1 0.835 0.01 . 2 . . . . 101 VAL HG1 . 6934 1 1240 . 1 1 121 121 VAL HG13 H 1 0.835 0.01 . 2 . . . . 101 VAL HG1 . 6934 1 1241 . 1 1 121 121 VAL HG21 H 1 0.826 0.01 . 2 . . . . 101 VAL HG2 . 6934 1 1242 . 1 1 121 121 VAL HG22 H 1 0.826 0.01 . 2 . . . . 101 VAL HG2 . 6934 1 1243 . 1 1 121 121 VAL HG23 H 1 0.826 0.01 . 2 . . . . 101 VAL HG2 . 6934 1 1244 . 1 1 121 121 VAL C C 13 175.729 0.2 . 1 . . . . 101 VAL C . 6934 1 1245 . 1 1 121 121 VAL CA C 13 60.225 0.2 . 1 . . . . 101 VAL CA . 6934 1 1246 . 1 1 121 121 VAL CB C 13 32.573 0.2 . 1 . . . . 101 VAL CB . 6934 1 1247 . 1 1 121 121 VAL CG1 C 13 24.200 0.2 . 2 . . . . 101 VAL CG1 . 6934 1 1248 . 1 1 121 121 VAL CG2 C 13 21.060 0.2 . 2 . . . . 101 VAL CG2 . 6934 1 1249 . 1 1 121 121 VAL N N 15 117.669 0.15 . 1 . . . . 101 VAL N . 6934 1 1250 . 1 1 122 122 MET H H 1 9.052 0.01 . 1 . . . . 102 MET HN . 6934 1 1251 . 1 1 122 122 MET HA H 1 4.660 0.01 . 1 . . . . 102 MET HA . 6934 1 1252 . 1 1 122 122 MET HB2 H 1 1.600 0.01 . 2 . . . . 102 MET HB1 . 6934 1 1253 . 1 1 122 122 MET HB3 H 1 2.060 0.01 . 2 . . . . 102 MET HB2 . 6934 1 1254 . 1 1 122 122 MET HG2 H 1 2.295 0.01 . 2 . . . . 102 MET HG1 . 6934 1 1255 . 1 1 122 122 MET HG3 H 1 2.060 0.01 . 2 . . . . 102 MET HG2 . 6934 1 1256 . 1 1 122 122 MET HE1 H 1 1.510 0.01 . 1 . . . . 102 MET HE . 6934 1 1257 . 1 1 122 122 MET HE2 H 1 1.510 0.01 . 1 . . . . 102 MET HE . 6934 1 1258 . 1 1 122 122 MET HE3 H 1 1.510 0.01 . 1 . . . . 102 MET HE . 6934 1 1259 . 1 1 122 122 MET C C 13 174.260 0.2 . 1 . . . . 102 MET C . 6934 1 1260 . 1 1 122 122 MET CA C 13 53.760 0.2 . 1 . . . . 102 MET CA . 6934 1 1261 . 1 1 122 122 MET CB C 13 38.158 0.2 . 1 . . . . 102 MET CB . 6934 1 1262 . 1 1 122 122 MET CG C 13 32.000 0.2 . 1 . . . . 102 MET CG . 6934 1 1263 . 1 1 122 122 MET CE C 13 16.050 0.2 . 1 . . . . 102 MET CE . 6934 1 1264 . 1 1 122 122 MET N N 15 124.571 0.15 . 1 . . . . 102 MET N . 6934 1 1265 . 1 1 123 123 LEU H H 1 9.403 0.01 . 1 . . . . 103 LEU HN . 6934 1 1266 . 1 1 123 123 LEU HA H 1 4.561 0.01 . 1 . . . . 103 LEU HA . 6934 1 1267 . 1 1 123 123 LEU HB2 H 1 1.755 0.01 . 2 . . . . 103 LEU HB1 . 6934 1 1268 . 1 1 123 123 LEU HB3 H 1 1.485 0.01 . 2 . . . . 103 LEU HB2 . 6934 1 1269 . 1 1 123 123 LEU HG H 1 1.796 0.01 . 1 . . . . 103 LEU HG . 6934 1 1270 . 1 1 123 123 LEU HD11 H 1 0.660 0.01 . 2 . . . . 103 LEU HD1 . 6934 1 1271 . 1 1 123 123 LEU HD12 H 1 0.660 0.01 . 2 . . . . 103 LEU HD1 . 6934 1 1272 . 1 1 123 123 LEU HD13 H 1 0.660 0.01 . 2 . . . . 103 LEU HD1 . 6934 1 1273 . 1 1 123 123 LEU HD21 H 1 0.510 0.01 . 2 . . . . 103 LEU HD2 . 6934 1 1274 . 1 1 123 123 LEU HD22 H 1 0.510 0.01 . 2 . . . . 103 LEU HD2 . 6934 1 1275 . 1 1 123 123 LEU HD23 H 1 0.510 0.01 . 2 . . . . 103 LEU HD2 . 6934 1 1276 . 1 1 123 123 LEU C C 13 179.170 0.2 . 1 . . . . 103 LEU C . 6934 1 1277 . 1 1 123 123 LEU CA C 13 54.364 0.2 . 1 . . . . 103 LEU CA . 6934 1 1278 . 1 1 123 123 LEU CB C 13 41.186 0.2 . 1 . . . . 103 LEU CB . 6934 1 1279 . 1 1 123 123 LEU CG C 13 26.300 0.2 . 1 . . . . 103 LEU CG . 6934 1 1280 . 1 1 123 123 LEU CD1 C 13 25.360 0.2 . 2 . . . . 103 LEU CD1 . 6934 1 1281 . 1 1 123 123 LEU CD2 C 13 22.120 0.2 . 2 . . . . 103 LEU CD2 . 6934 1 1282 . 1 1 123 123 LEU N N 15 120.276 0.15 . 1 . . . . 103 LEU N . 6934 1 1283 . 1 1 124 124 PHE H H 1 10.552 0.01 . 1 . . . . 104 PHE HN . 6934 1 1284 . 1 1 124 124 PHE HA H 1 4.302 0.01 . 1 . . . . 104 PHE HA . 6934 1 1285 . 1 1 124 124 PHE HB2 H 1 2.871 0.01 . 2 . . . . 104 PHE HB1 . 6934 1 1286 . 1 1 124 124 PHE HB3 H 1 3.131 0.01 . 2 . . . . 104 PHE HB2 . 6934 1 1287 . 1 1 124 124 PHE HD1 H 1 7.050 0.01 . 4 . . . . 104 PHE HD1 . 6934 1 1288 . 1 1 124 124 PHE HE1 H 1 7.380 0.01 . 4 . . . . 104 PHE HE1 . 6934 1 1289 . 1 1 124 124 PHE HZ H 1 7.080 0.01 . 4 . . . . 104 PHE HZ . 6934 1 1290 . 1 1 124 124 PHE C C 13 177.605 0.2 . 1 . . . . 104 PHE C . 6934 1 1291 . 1 1 124 124 PHE CA C 13 62.707 0.2 . 1 . . . . 104 PHE CA . 6934 1 1292 . 1 1 124 124 PHE CB C 13 39.078 0.2 . 1 . . . . 104 PHE CB . 6934 1 1293 . 1 1 124 124 PHE N N 15 128.370 0.15 . 1 . . . . 104 PHE N . 6934 1 1294 . 1 1 125 125 GLY H H 1 9.495 0.01 . 1 . . . . 105 GLY HN . 6934 1 1295 . 1 1 125 125 GLY HA2 H 1 4.375 0.01 . 2 . . . . 105 GLY HA1 . 6934 1 1296 . 1 1 125 125 GLY HA3 H 1 5.094 0.01 . 2 . . . . 105 GLY HA2 . 6934 1 1297 . 1 1 125 125 GLY C C 13 176.147 0.2 . 1 . . . . 105 GLY C . 6934 1 1298 . 1 1 125 125 GLY CA C 13 45.220 0.2 . 1 . . . . 105 GLY CA . 6934 1 1299 . 1 1 125 125 GLY N N 15 105.667 0.15 . 1 . . . . 105 GLY N . 6934 1 1300 . 1 1 126 126 HIS H H 1 7.559 0.01 . 1 . . . . 106 HIS HN . 6934 1 1301 . 1 1 126 126 HIS HA H 1 3.985 0.01 . 1 . . . . 106 HIS HA . 6934 1 1302 . 1 1 126 126 HIS HB2 H 1 3.810 0.01 . 2 . . . . 106 HIS HB1 . 6934 1 1303 . 1 1 126 126 HIS HB3 H 1 1.874 0.01 . 2 . . . . 106 HIS HB2 . 6934 1 1304 . 1 1 126 126 HIS HD2 H 1 7.100 0.01 . 1 . . . . 106 HIS HD2 . 6934 1 1305 . 1 1 126 126 HIS HE1 H 1 8.720 0.01 . 1 . . . . 106 HIS HE1 . 6934 1 1306 . 1 1 126 126 HIS C C 13 175.524 0.2 . 1 . . . . 106 HIS C . 6934 1 1307 . 1 1 126 126 HIS CA C 13 59.831 0.2 . 1 . . . . 106 HIS CA . 6934 1 1308 . 1 1 126 126 HIS CB C 13 31.947 0.2 . 1 . . . . 106 HIS CB . 6934 1 1309 . 1 1 126 126 HIS N N 15 118.818 0.15 . 1 . . . . 106 HIS N . 6934 1 1310 . 1 1 127 127 TRP H H 1 8.311 0.01 . 1 . . . . 107 TRP HN . 6934 1 1311 . 1 1 127 127 TRP HA H 1 4.085 0.01 . 1 . . . . 107 TRP HA . 6934 1 1312 . 1 1 127 127 TRP HB2 H 1 2.700 0.01 . 2 . . . . 107 TRP HB1 . 6934 1 1313 . 1 1 127 127 TRP HB3 H 1 3.169 0.01 . 2 . . . . 107 TRP HB2 . 6934 1 1314 . 1 1 127 127 TRP HD1 H 1 5.640 0.01 . 1 . . . . 107 TRP HD1 . 6934 1 1315 . 1 1 127 127 TRP HE1 H 1 5.000 0.01 . 4 . . . . 107 TRP HE1 . 6934 1 1316 . 1 1 127 127 TRP HZ2 H 1 6.850 0.01 . 4 . . . . 107 TRP HZ2 . 6934 1 1317 . 1 1 127 127 TRP HH2 H 1 7.180 0.01 . 4 . . . . 107 TRP HH2 . 6934 1 1318 . 1 1 127 127 TRP C C 13 175.151 0.2 . 1 . . . . 107 TRP C . 6934 1 1319 . 1 1 127 127 TRP CA C 13 56.101 0.2 . 1 . . . . 107 TRP CA . 6934 1 1320 . 1 1 127 127 TRP CB C 13 27.765 0.2 . 1 . . . . 107 TRP CB . 6934 1 1321 . 1 1 127 127 TRP N N 15 115.930 0.15 . 1 . . . . 107 TRP N . 6934 1 1322 . 1 1 128 128 ASP H H 1 7.537 0.01 . 1 . . . . 108 ASP HN . 6934 1 1323 . 1 1 128 128 ASP HA H 1 4.980 0.01 . 1 . . . . 108 ASP HA . 6934 1 1324 . 1 1 128 128 ASP HB2 H 1 2.697 0.01 . 2 . . . . 108 ASP HB1 . 6934 1 1325 . 1 1 128 128 ASP HB3 H 1 2.805 0.01 . 2 . . . . 108 ASP HB2 . 6934 1 1326 . 1 1 128 128 ASP C C 13 175.172 0.2 . 1 . . . . 108 ASP C . 6934 1 1327 . 1 1 128 128 ASP CA C 13 52.104 0.2 . 1 . . . . 108 ASP CA . 6934 1 1328 . 1 1 128 128 ASP CB C 13 40.144 0.2 . 1 . . . . 108 ASP CB . 6934 1 1329 . 1 1 128 128 ASP N N 15 123.799 0.15 . 1 . . . . 108 ASP N . 6934 1 1330 . 1 1 129 129 ASN H H 1 7.686 0.01 . 1 . . . . 109 ASN HN . 6934 1 1331 . 1 1 129 129 ASN HA H 1 4.191 0.01 . 1 . . . . 109 ASN HA . 6934 1 1332 . 1 1 129 129 ASN HB2 H 1 2.969 0.01 . 2 . . . . 109 ASN HB1 . 6934 1 1333 . 1 1 129 129 ASN HB3 H 1 2.623 0.01 . 2 . . . . 109 ASN HB2 . 6934 1 1334 . 1 1 129 129 ASN HD21 H 1 7.537 0.01 . 2 . . . . 109 ASN HD21 . 6934 1 1335 . 1 1 129 129 ASN HD22 H 1 6.795 0.01 . 2 . . . . 109 ASN HD22 . 6934 1 1336 . 1 1 129 129 ASN C C 13 174.250 0.2 . 1 . . . . 109 ASN C . 6934 1 1337 . 1 1 129 129 ASN CA C 13 53.979 0.2 . 1 . . . . 109 ASN CA . 6934 1 1338 . 1 1 129 129 ASN CB C 13 36.900 0.2 . 1 . . . . 109 ASN CB . 6934 1 1339 . 1 1 129 129 ASN N N 15 113.206 0.15 . 1 . . . . 109 ASN N . 6934 1 1340 . 1 1 129 129 ASN ND2 N 15 113.300 0.15 . 1 . . . . 109 ASN ND2 . 6934 1 1341 . 1 1 130 130 GLU H H 1 7.268 0.01 . 1 . . . . 110 GLU HN . 6934 1 1342 . 1 1 130 130 GLU HA H 1 3.437 0.01 . 1 . . . . 110 GLU HA . 6934 1 1343 . 1 1 130 130 GLU HB2 H 1 1.950 0.01 . 1 . . . . 110 GLU HB1 . 6934 1 1344 . 1 1 130 130 GLU HB3 H 1 1.950 0.01 . 1 . . . . 110 GLU HB2 . 6934 1 1345 . 1 1 130 130 GLU HG2 H 1 2.010 0.01 . 2 . . . . 110 GLU HG1 . 6934 1 1346 . 1 1 130 130 GLU HG3 H 1 2.135 0.01 . 2 . . . . 110 GLU HG2 . 6934 1 1347 . 1 1 130 130 GLU C C 13 173.531 0.2 . 1 . . . . 110 GLU C . 6934 1 1348 . 1 1 130 130 GLU CA C 13 56.684 0.2 . 1 . . . . 110 GLU CA . 6934 1 1349 . 1 1 130 130 GLU CB C 13 26.250 0.2 . 1 . . . . 110 GLU CB . 6934 1 1350 . 1 1 130 130 GLU CG C 13 35.500 0.2 . 1 . . . . 110 GLU CG . 6934 1 1351 . 1 1 130 130 GLU N N 15 111.984 0.15 . 1 . . . . 110 GLU N . 6934 1 1352 . 1 1 131 131 CYS H H 1 6.900 0.01 . 1 . . . . 111 CYS HN . 6934 1 1353 . 1 1 131 131 CYS HA H 1 4.261 0.01 . 1 . . . . 111 CYS HA . 6934 1 1354 . 1 1 131 131 CYS HB2 H 1 3.285 0.01 . 2 . . . . 111 CYS HB1 . 6934 1 1355 . 1 1 131 131 CYS HB3 H 1 2.924 0.01 . 2 . . . . 111 CYS HB2 . 6934 1 1356 . 1 1 131 131 CYS C C 13 174.814 0.2 . 1 . . . . 111 CYS C . 6934 1 1357 . 1 1 131 131 CYS CA C 13 58.918 0.2 . 1 . . . . 111 CYS CA . 6934 1 1358 . 1 1 131 131 CYS CB C 13 27.816 0.2 . 1 . . . . 111 CYS CB . 6934 1 1359 . 1 1 131 131 CYS N N 15 119.091 0.15 . 1 . . . . 111 CYS N . 6934 1 1360 . 1 1 132 132 GLU H H 1 8.837 0.01 . 1 . . . . 112 GLU HN . 6934 1 1361 . 1 1 132 132 GLU HA H 1 4.535 0.01 . 1 . . . . 112 GLU HA . 6934 1 1362 . 1 1 132 132 GLU HB2 H 1 1.985 0.01 . 2 . . . . 112 GLU HB1 . 6934 1 1363 . 1 1 132 132 GLU HB3 H 1 2.150 0.01 . 2 . . . . 112 GLU HB2 . 6934 1 1364 . 1 1 132 132 GLU HG2 H 1 2.010 0.01 . 2 . . . . 112 GLU HG1 . 6934 1 1365 . 1 1 132 132 GLU HG3 H 1 2.625 0.01 . 2 . . . . 112 GLU HG2 . 6934 1 1366 . 1 1 132 132 GLU C C 13 175.079 0.2 . 1 . . . . 112 GLU C . 6934 1 1367 . 1 1 132 132 GLU CA C 13 56.321 0.2 . 1 . . . . 112 GLU CA . 6934 1 1368 . 1 1 132 132 GLU CB C 13 32.189 0.2 . 1 . . . . 112 GLU CB . 6934 1 1369 . 1 1 132 132 GLU CG C 13 39.400 0.2 . 1 . . . . 112 GLU CG . 6934 1 1370 . 1 1 132 132 GLU N N 15 126.438 0.15 . 1 . . . . 112 GLU N . 6934 1 1371 . 1 1 133 133 ILE H H 1 7.734 0.01 . 1 . . . . 113 ILE HN . 6934 1 1372 . 1 1 133 133 ILE HA H 1 4.590 0.01 . 1 . . . . 113 ILE HA . 6934 1 1373 . 1 1 133 133 ILE HB H 1 1.934 0.01 . 1 . . . . 113 ILE HB . 6934 1 1374 . 1 1 133 133 ILE HG12 H 1 1.880 0.01 . 1 . . . . 113 ILE HG11 . 6934 1 1375 . 1 1 133 133 ILE HG13 H 1 1.450 0.01 . 1 . . . . 113 ILE HG12 . 6934 1 1376 . 1 1 133 133 ILE HG21 H 1 0.960 0.01 . 1 . . . . 113 ILE HG2 . 6934 1 1377 . 1 1 133 133 ILE HG22 H 1 0.960 0.01 . 1 . . . . 113 ILE HG2 . 6934 1 1378 . 1 1 133 133 ILE HG23 H 1 0.960 0.01 . 1 . . . . 113 ILE HG2 . 6934 1 1379 . 1 1 133 133 ILE HD11 H 1 0.984 0.01 . 1 . . . . 113 ILE HD1 . 6934 1 1380 . 1 1 133 133 ILE HD12 H 1 0.984 0.01 . 1 . . . . 113 ILE HD1 . 6934 1 1381 . 1 1 133 133 ILE HD13 H 1 0.984 0.01 . 1 . . . . 113 ILE HD1 . 6934 1 1382 . 1 1 133 133 ILE C C 13 173.386 0.2 . 1 . . . . 113 ILE C . 6934 1 1383 . 1 1 133 133 ILE CA C 13 57.686 0.2 . 1 . . . . 113 ILE CA . 6934 1 1384 . 1 1 133 133 ILE CB C 13 38.000 0.2 . 1 . . . . 113 ILE CB . 6934 1 1385 . 1 1 133 133 ILE CG1 C 13 27.600 0.2 . 1 . . . . 113 ILE CG1 . 6934 1 1386 . 1 1 133 133 ILE CG2 C 13 17.750 0.2 . 1 . . . . 113 ILE CG2 . 6934 1 1387 . 1 1 133 133 ILE CD1 C 13 12.700 0.2 . 1 . . . . 113 ILE CD1 . 6934 1 1388 . 1 1 133 133 ILE N N 15 124.378 0.15 . 1 . . . . 113 ILE N . 6934 1 1389 . 1 1 134 134 PRO HA H 1 4.330 0.01 . 1 . . . . 114 PRO HA . 6934 1 1390 . 1 1 134 134 PRO HB2 H 1 1.790 0.01 . 2 . . . . 114 PRO HB1 . 6934 1 1391 . 1 1 134 134 PRO HB3 H 1 2.140 0.01 . 2 . . . . 114 PRO HB2 . 6934 1 1392 . 1 1 134 134 PRO HG2 H 1 1.750 0.01 . 2 . . . . 114 PRO HG1 . 6934 1 1393 . 1 1 134 134 PRO HG3 H 1 1.930 0.01 . 2 . . . . 114 PRO HG2 . 6934 1 1394 . 1 1 134 134 PRO HD2 H 1 3.880 0.01 . 2 . . . . 114 PRO HD1 . 6934 1 1395 . 1 1 134 134 PRO HD3 H 1 3.490 0.01 . 2 . . . . 114 PRO HD2 . 6934 1 1396 . 1 1 134 134 PRO CA C 13 62.400 0.2 . 1 . . . . 114 PRO CA . 6934 1 1397 . 1 1 134 134 PRO CB C 13 32.560 0.2 . 1 . . . . 114 PRO CB . 6934 1 1398 . 1 1 134 134 PRO CG C 13 26.800 0.2 . 1 . . . . 114 PRO CG . 6934 1 1399 . 1 1 134 134 PRO CD C 13 50.830 0.2 . 1 . . . . 114 PRO CD . 6934 1 1400 . 1 1 135 135 ASP H H 1 8.500 0.01 . 1 . . . . 115 ASP HN . 6934 1 1401 . 1 1 135 135 ASP HA H 1 4.365 0.01 . 1 . . . . 115 ASP HA . 6934 1 1402 . 1 1 135 135 ASP HB2 H 1 2.710 0.01 . 2 . . . . 115 ASP HB1 . 6934 1 1403 . 1 1 135 135 ASP HB3 H 1 3.060 0.01 . 2 . . . . 115 ASP HB2 . 6934 1 1404 . 1 1 135 135 ASP CA C 13 51.400 0.2 . 1 . . . . 115 ASP CA . 6934 1 1405 . 1 1 135 135 ASP CB C 13 42.600 0.2 . 1 . . . . 115 ASP CB . 6934 1 1406 . 1 1 135 135 ASP N N 15 118.130 0.15 . 1 . . . . 115 ASP N . 6934 1 1407 . 1 1 136 136 PRO HA H 1 4.140 0.01 . 1 . . . . 116 PRO HA . 6934 1 1408 . 1 1 136 136 PRO HB2 H 1 0.060 0.01 . 2 . . . . 116 PRO HB1 . 6934 1 1409 . 1 1 136 136 PRO HB3 H 1 1.050 0.01 . 2 . . . . 116 PRO HB2 . 6934 1 1410 . 1 1 136 136 PRO HG2 H 1 1.510 0.01 . 2 . . . . 116 PRO HG1 . 6934 1 1411 . 1 1 136 136 PRO HG3 H 1 1.795 0.01 . 2 . . . . 116 PRO HG2 . 6934 1 1412 . 1 1 136 136 PRO HD2 H 1 4.190 0.01 . 2 . . . . 116 PRO HD1 . 6934 1 1413 . 1 1 136 136 PRO HD3 H 1 4.360 0.01 . 2 . . . . 116 PRO HD2 . 6934 1 1414 . 1 1 136 136 PRO C C 13 172.793 0.2 . 1 . . . . 116 PRO C . 6934 1 1415 . 1 1 136 136 PRO CA C 13 62.642 0.2 . 1 . . . . 116 PRO CA . 6934 1 1416 . 1 1 136 136 PRO CB C 13 30.721 0.2 . 1 . . . . 116 PRO CB . 6934 1 1417 . 1 1 136 136 PRO CG C 13 26.600 0.2 . 1 . . . . 116 PRO CG . 6934 1 1418 . 1 1 136 136 PRO CD C 13 49.200 0.2 . 1 . . . . 116 PRO CD . 6934 1 1419 . 1 1 137 137 TYR H H 1 7.493 0.01 . 1 . . . . 117 TYR HN . 6934 1 1420 . 1 1 137 137 TYR HA H 1 4.346 0.01 . 1 . . . . 117 TYR HA . 6934 1 1421 . 1 1 137 137 TYR HB2 H 1 2.799 0.01 . 2 . . . . 117 TYR HB1 . 6934 1 1422 . 1 1 137 137 TYR HB3 H 1 3.386 0.01 . 2 . . . . 117 TYR HB2 . 6934 1 1423 . 1 1 137 137 TYR HD1 H 1 7.200 0.01 . 3 . . . . 117 TYR HD1 . 6934 1 1424 . 1 1 137 137 TYR HE1 H 1 6.920 0.01 . 3 . . . . 117 TYR HE1 . 6934 1 1425 . 1 1 137 137 TYR C C 13 176.559 0.2 . 1 . . . . 117 TYR C . 6934 1 1426 . 1 1 137 137 TYR CA C 13 59.683 0.2 . 1 . . . . 117 TYR CA . 6934 1 1427 . 1 1 137 137 TYR CB C 13 38.315 0.2 . 1 . . . . 117 TYR CB . 6934 1 1428 . 1 1 137 137 TYR N N 15 120.617 0.15 . 1 . . . . 117 TYR N . 6934 1 1429 . 1 1 138 138 ARG H H 1 8.958 0.01 . 1 . . . . 118 ARG HN . 6934 1 1430 . 1 1 138 138 ARG HA H 1 3.655 0.01 . 1 . . . . 118 ARG HA . 6934 1 1431 . 1 1 138 138 ARG HB2 H 1 1.890 0.01 . 1 . . . . 118 ARG HB1 . 6934 1 1432 . 1 1 138 138 ARG HB3 H 1 1.890 0.01 . 1 . . . . 118 ARG HB2 . 6934 1 1433 . 1 1 138 138 ARG HG2 H 1 0.801 0.01 . 2 . . . . 118 ARG HG1 . 6934 1 1434 . 1 1 138 138 ARG HG3 H 1 0.390 0.01 . 2 . . . . 118 ARG HG2 . 6934 1 1435 . 1 1 138 138 ARG HD2 H 1 2.865 0.01 . 1 . . . . 118 ARG HD1 . 6934 1 1436 . 1 1 138 138 ARG HD3 H 1 2.865 0.01 . 1 . . . . 118 ARG HD2 . 6934 1 1437 . 1 1 138 138 ARG C C 13 176.104 0.2 . 1 . . . . 118 ARG C . 6934 1 1438 . 1 1 138 138 ARG CA C 13 58.618 0.2 . 1 . . . . 118 ARG CA . 6934 1 1439 . 1 1 138 138 ARG CB C 13 27.200 0.2 . 1 . . . . 118 ARG CB . 6934 1 1440 . 1 1 138 138 ARG CG C 13 26.800 0.2 . 1 . . . . 118 ARG CG . 6934 1 1441 . 1 1 138 138 ARG CD C 13 43.600 0.2 . 1 . . . . 118 ARG CD . 6934 1 1442 . 1 1 138 138 ARG N N 15 119.909 0.15 . 1 . . . . 118 ARG N . 6934 1 1443 . 1 1 139 139 LYS H H 1 8.523 0.01 . 1 . . . . 119 LYS HN . 6934 1 1444 . 1 1 139 139 LYS HA H 1 4.760 0.01 . 1 . . . . 119 LYS HA . 6934 1 1445 . 1 1 139 139 LYS HB2 H 1 2.080 0.01 . 1 . . . . 119 LYS HB1 . 6934 1 1446 . 1 1 139 139 LYS HB3 H 1 2.080 0.01 . 1 . . . . 119 LYS HB2 . 6934 1 1447 . 1 1 139 139 LYS HG2 H 1 1.260 0.01 . 2 . . . . 119 LYS HG1 . 6934 1 1448 . 1 1 139 139 LYS HG3 H 1 1.395 0.01 . 2 . . . . 119 LYS HG2 . 6934 1 1449 . 1 1 139 139 LYS HD2 H 1 1.640 0.01 . 2 . . . . 119 LYS HD1 . 6934 1 1450 . 1 1 139 139 LYS HD3 H 1 1.700 0.01 . 2 . . . . 119 LYS HD2 . 6934 1 1451 . 1 1 139 139 LYS HE2 H 1 3.070 0.01 . 2 . . . . 119 LYS HE2 . 6934 1 1452 . 1 1 139 139 LYS C C 13 175.698 0.2 . 1 . . . . 119 LYS C . 6934 1 1453 . 1 1 139 139 LYS CA C 13 54.604 0.2 . 1 . . . . 119 LYS CA . 6934 1 1454 . 1 1 139 139 LYS CB C 13 32.587 0.2 . 1 . . . . 119 LYS CB . 6934 1 1455 . 1 1 139 139 LYS CG C 13 25.230 0.2 . 1 . . . . 119 LYS CG . 6934 1 1456 . 1 1 139 139 LYS CD C 13 28.500 0.2 . 1 . . . . 119 LYS CD . 6934 1 1457 . 1 1 139 139 LYS CE C 13 42.500 0.2 . 1 . . . . 119 LYS CE . 6934 1 1458 . 1 1 139 139 LYS N N 15 119.471 0.15 . 1 . . . . 119 LYS N . 6934 1 1459 . 1 1 140 140 SER H H 1 8.156 0.01 . 1 . . . . 120 SER HN . 6934 1 1460 . 1 1 140 140 SER HA H 1 4.512 0.01 . 1 . . . . 120 SER HA . 6934 1 1461 . 1 1 140 140 SER HB2 H 1 4.500 0.01 . 2 . . . . 120 SER HB1 . 6934 1 1462 . 1 1 140 140 SER HB3 H 1 4.206 0.01 . 2 . . . . 120 SER HB2 . 6934 1 1463 . 1 1 140 140 SER C C 13 175.614 0.2 . 1 . . . . 120 SER C . 6934 1 1464 . 1 1 140 140 SER CA C 13 57.791 0.2 . 1 . . . . 120 SER CA . 6934 1 1465 . 1 1 140 140 SER CB C 13 65.613 0.2 . 1 . . . . 120 SER CB . 6934 1 1466 . 1 1 140 140 SER N N 15 112.976 0.15 . 1 . . . . 120 SER N . 6934 1 1467 . 1 1 141 141 ARG H H 1 9.228 0.01 . 1 . . . . 121 ARG HN . 6934 1 1468 . 1 1 141 141 ARG HA H 1 3.950 0.01 . 1 . . . . 121 ARG HA . 6934 1 1469 . 1 1 141 141 ARG HB2 H 1 1.929 0.01 . 2 . . . . 121 ARG HB1 . 6934 1 1470 . 1 1 141 141 ARG HB3 H 1 1.770 0.01 . 2 . . . . 121 ARG HB2 . 6934 1 1471 . 1 1 141 141 ARG HG2 H 1 1.350 0.01 . 1 . . . . 121 ARG HG1 . 6934 1 1472 . 1 1 141 141 ARG HG3 H 1 1.350 0.01 . 1 . . . . 121 ARG HG2 . 6934 1 1473 . 1 1 141 141 ARG HD2 H 1 3.170 0.01 . 1 . . . . 121 ARG HD1 . 6934 1 1474 . 1 1 141 141 ARG HD3 H 1 3.170 0.01 . 1 . . . . 121 ARG HD2 . 6934 1 1475 . 1 1 141 141 ARG HE H 1 7.340 0.01 . 1 . . . . 121 ARG HE . 6934 1 1476 . 1 1 141 141 ARG HH11 H 1 6.660 0.01 . 4 . . . . 121 ARG HH11 . 6934 1 1477 . 1 1 141 141 ARG HH21 H 1 6.960 0.01 . 4 . . . . 121 ARG HH21 . 6934 1 1478 . 1 1 141 141 ARG C C 13 178.091 0.2 . 1 . . . . 121 ARG C . 6934 1 1479 . 1 1 141 141 ARG CA C 13 60.761 0.2 . 1 . . . . 121 ARG CA . 6934 1 1480 . 1 1 141 141 ARG CB C 13 29.302 0.2 . 1 . . . . 121 ARG CB . 6934 1 1481 . 1 1 141 141 ARG CG C 13 28.400 0.2 . 1 . . . . 121 ARG CG . 6934 1 1482 . 1 1 141 141 ARG CD C 13 42.900 0.2 . 1 . . . . 121 ARG CD . 6934 1 1483 . 1 1 141 141 ARG N N 15 123.066 0.15 . 1 . . . . 121 ARG N . 6934 1 1484 . 1 1 141 141 ARG NE N 15 115.550 0.15 . 1 . . . . 121 ARG NE . 6934 1 1485 . 1 1 142 142 GLU H H 1 9.041 0.01 . 1 . . . . 122 GLU HN . 6934 1 1486 . 1 1 142 142 GLU HA H 1 4.145 0.01 . 1 . . . . 122 GLU HA . 6934 1 1487 . 1 1 142 142 GLU HB2 H 1 2.155 0.01 . 2 . . . . 122 GLU HB1 . 6934 1 1488 . 1 1 142 142 GLU HB3 H 1 2.038 0.01 . 2 . . . . 122 GLU HB2 . 6934 1 1489 . 1 1 142 142 GLU HG2 H 1 2.360 0.01 . 2 . . . . 122 GLU HG1 . 6934 1 1490 . 1 1 142 142 GLU HG3 H 1 2.510 0.01 . 2 . . . . 122 GLU HG2 . 6934 1 1491 . 1 1 142 142 GLU C C 13 179.687 0.2 . 1 . . . . 122 GLU C . 6934 1 1492 . 1 1 142 142 GLU CA C 13 60.322 0.2 . 1 . . . . 122 GLU CA . 6934 1 1493 . 1 1 142 142 GLU CB C 13 28.461 0.2 . 1 . . . . 122 GLU CB . 6934 1 1494 . 1 1 142 142 GLU CG C 13 37.100 0.2 . 1 . . . . 122 GLU CG . 6934 1 1495 . 1 1 142 142 GLU N N 15 117.580 0.15 . 1 . . . . 122 GLU N . 6934 1 1496 . 1 1 143 143 THR H H 1 8.099 0.01 . 1 . . . . 123 THR HN . 6934 1 1497 . 1 1 143 143 THR HA H 1 4.130 0.01 . 1 . . . . 123 THR HA . 6934 1 1498 . 1 1 143 143 THR HB H 1 4.538 0.01 . 1 . . . . 123 THR HB . 6934 1 1499 . 1 1 143 143 THR HG21 H 1 1.085 0.01 . 1 . . . . 123 THR HG2 . 6934 1 1500 . 1 1 143 143 THR HG22 H 1 1.085 0.01 . 1 . . . . 123 THR HG2 . 6934 1 1501 . 1 1 143 143 THR HG23 H 1 1.085 0.01 . 1 . . . . 123 THR HG2 . 6934 1 1502 . 1 1 143 143 THR C C 13 176.524 0.2 . 1 . . . . 123 THR C . 6934 1 1503 . 1 1 143 143 THR CA C 13 67.100 0.2 . 1 . . . . 123 THR CA . 6934 1 1504 . 1 1 143 143 THR CB C 13 67.600 0.2 . 1 . . . . 123 THR CB . 6934 1 1505 . 1 1 143 143 THR CG2 C 13 21.140 0.2 . 1 . . . . 123 THR CG2 . 6934 1 1506 . 1 1 143 143 THR N N 15 120.408 0.15 . 1 . . . . 123 THR N . 6934 1 1507 . 1 1 144 144 PHE H H 1 8.018 0.01 . 1 . . . . 124 PHE HN . 6934 1 1508 . 1 1 144 144 PHE HA H 1 3.871 0.01 . 1 . . . . 124 PHE HA . 6934 1 1509 . 1 1 144 144 PHE HB2 H 1 2.900 0.01 . 2 . . . . 124 PHE HB1 . 6934 1 1510 . 1 1 144 144 PHE HB3 H 1 3.400 0.01 . 2 . . . . 124 PHE HB2 . 6934 1 1511 . 1 1 144 144 PHE HD1 H 1 7.370 0.01 . 4 . . . . 124 PHE HD1 . 6934 1 1512 . 1 1 144 144 PHE HE1 H 1 7.370 0.01 . 4 . . . . 124 PHE HE1 . 6934 1 1513 . 1 1 144 144 PHE HZ H 1 7.400 0.01 . 4 . . . . 124 PHE HZ . 6934 1 1514 . 1 1 144 144 PHE C C 13 179.533 0.2 . 1 . . . . 124 PHE C . 6934 1 1515 . 1 1 144 144 PHE CA C 13 63.703 0.2 . 1 . . . . 124 PHE CA . 6934 1 1516 . 1 1 144 144 PHE CB C 13 39.913 0.2 . 1 . . . . 124 PHE CB . 6934 1 1517 . 1 1 144 144 PHE N N 15 121.082 0.15 . 1 . . . . 124 PHE N . 6934 1 1518 . 1 1 145 145 ALA H H 1 9.036 0.01 . 1 . . . . 125 ALA HN . 6934 1 1519 . 1 1 145 145 ALA HA H 1 4.287 0.01 . 1 . . . . 125 ALA HA . 6934 1 1520 . 1 1 145 145 ALA HB1 H 1 1.635 0.01 . 1 . . . . 125 ALA HB . 6934 1 1521 . 1 1 145 145 ALA HB2 H 1 1.635 0.01 . 1 . . . . 125 ALA HB . 6934 1 1522 . 1 1 145 145 ALA HB3 H 1 1.635 0.01 . 1 . . . . 125 ALA HB . 6934 1 1523 . 1 1 145 145 ALA C C 13 179.254 0.2 . 1 . . . . 125 ALA C . 6934 1 1524 . 1 1 145 145 ALA CA C 13 55.583 0.2 . 1 . . . . 125 ALA CA . 6934 1 1525 . 1 1 145 145 ALA CB C 13 17.954 0.2 . 1 . . . . 125 ALA CB . 6934 1 1526 . 1 1 145 145 ALA N N 15 124.757 0.15 . 1 . . . . 125 ALA N . 6934 1 1527 . 1 1 146 146 ALA H H 1 8.089 0.01 . 1 . . . . 126 ALA HN . 6934 1 1528 . 1 1 146 146 ALA HA H 1 4.280 0.01 . 1 . . . . 126 ALA HA . 6934 1 1529 . 1 1 146 146 ALA HB1 H 1 1.635 0.01 . 1 . . . . 126 ALA HB . 6934 1 1530 . 1 1 146 146 ALA HB2 H 1 1.635 0.01 . 1 . . . . 126 ALA HB . 6934 1 1531 . 1 1 146 146 ALA HB3 H 1 1.635 0.01 . 1 . . . . 126 ALA HB . 6934 1 1532 . 1 1 146 146 ALA C C 13 181.350 0.2 . 1 . . . . 126 ALA C . 6934 1 1533 . 1 1 146 146 ALA CA C 13 55.200 0.2 . 1 . . . . 126 ALA CA . 6934 1 1534 . 1 1 146 146 ALA CB C 13 17.980 0.2 . 1 . . . . 126 ALA CB . 6934 1 1535 . 1 1 146 146 ALA N N 15 123.744 0.15 . 1 . . . . 126 ALA N . 6934 1 1536 . 1 1 147 147 VAL H H 1 8.416 0.01 . 1 . . . . 127 VAL HN . 6934 1 1537 . 1 1 147 147 VAL HA H 1 3.598 0.01 . 1 . . . . 127 VAL HA . 6934 1 1538 . 1 1 147 147 VAL HB H 1 2.084 0.01 . 1 . . . . 127 VAL HB . 6934 1 1539 . 1 1 147 147 VAL HG11 H 1 0.935 0.01 . 2 . . . . 127 VAL HG1 . 6934 1 1540 . 1 1 147 147 VAL HG12 H 1 0.935 0.01 . 2 . . . . 127 VAL HG1 . 6934 1 1541 . 1 1 147 147 VAL HG13 H 1 0.935 0.01 . 2 . . . . 127 VAL HG1 . 6934 1 1542 . 1 1 147 147 VAL HG21 H 1 0.980 0.01 . 2 . . . . 127 VAL HG2 . 6934 1 1543 . 1 1 147 147 VAL HG22 H 1 0.980 0.01 . 2 . . . . 127 VAL HG2 . 6934 1 1544 . 1 1 147 147 VAL HG23 H 1 0.980 0.01 . 2 . . . . 127 VAL HG2 . 6934 1 1545 . 1 1 147 147 VAL C C 13 177.234 0.2 . 1 . . . . 127 VAL C . 6934 1 1546 . 1 1 147 147 VAL CA C 13 67.303 0.2 . 1 . . . . 127 VAL CA . 6934 1 1547 . 1 1 147 147 VAL CB C 13 31.886 0.2 . 1 . . . . 127 VAL CB . 6934 1 1548 . 1 1 147 147 VAL CG1 C 13 21.200 0.2 . 2 . . . . 127 VAL CG1 . 6934 1 1549 . 1 1 147 147 VAL CG2 C 13 24.600 0.2 . 2 . . . . 127 VAL CG2 . 6934 1 1550 . 1 1 147 147 VAL N N 15 119.528 0.15 . 1 . . . . 127 VAL N . 6934 1 1551 . 1 1 148 148 TYR H H 1 8.570 0.01 . 1 . . . . 128 TYR HN . 6934 1 1552 . 1 1 148 148 TYR HA H 1 3.655 0.01 . 1 . . . . 128 TYR HA . 6934 1 1553 . 1 1 148 148 TYR HB2 H 1 2.975 0.01 . 2 . . . . 128 TYR HB1 . 6934 1 1554 . 1 1 148 148 TYR HB3 H 1 3.293 0.01 . 2 . . . . 128 TYR HB2 . 6934 1 1555 . 1 1 148 148 TYR HD1 H 1 6.750 0.01 . 3 . . . . 128 TYR HD1 . 6934 1 1556 . 1 1 148 148 TYR HE1 H 1 6.225 0.01 . 3 . . . . 128 TYR HE1 . 6934 1 1557 . 1 1 148 148 TYR C C 13 176.575 0.2 . 1 . . . . 128 TYR C . 6934 1 1558 . 1 1 148 148 TYR CA C 13 63.856 0.2 . 1 . . . . 128 TYR CA . 6934 1 1559 . 1 1 148 148 TYR CB C 13 38.410 0.2 . 1 . . . . 128 TYR CB . 6934 1 1560 . 1 1 148 148 TYR N N 15 122.323 0.15 . 1 . . . . 128 TYR N . 6934 1 1561 . 1 1 149 149 THR H H 1 8.089 0.01 . 1 . . . . 129 THR HN . 6934 1 1562 . 1 1 149 149 THR HA H 1 3.875 0.01 . 1 . . . . 129 THR HA . 6934 1 1563 . 1 1 149 149 THR HB H 1 4.373 0.01 . 1 . . . . 129 THR HB . 6934 1 1564 . 1 1 149 149 THR HG21 H 1 1.346 0.01 . 1 . . . . 129 THR HG2 . 6934 1 1565 . 1 1 149 149 THR HG22 H 1 1.346 0.01 . 1 . . . . 129 THR HG2 . 6934 1 1566 . 1 1 149 149 THR HG23 H 1 1.346 0.01 . 1 . . . . 129 THR HG2 . 6934 1 1567 . 1 1 149 149 THR C C 13 177.139 0.2 . 1 . . . . 129 THR C . 6934 1 1568 . 1 1 149 149 THR CA C 13 67.223 0.2 . 1 . . . . 129 THR CA . 6934 1 1569 . 1 1 149 149 THR CB C 13 68.971 0.2 . 1 . . . . 129 THR CB . 6934 1 1570 . 1 1 149 149 THR CG2 C 13 21.950 0.2 . 1 . . . . 129 THR CG2 . 6934 1 1571 . 1 1 149 149 THR N N 15 115.473 0.15 . 1 . . . . 129 THR N . 6934 1 1572 . 1 1 150 150 LEU H H 1 7.542 0.01 . 1 . . . . 130 LEU HN . 6934 1 1573 . 1 1 150 150 LEU HA H 1 4.090 0.01 . 1 . . . . 130 LEU HA . 6934 1 1574 . 1 1 150 150 LEU HB2 H 1 1.538 0.01 . 2 . . . . 130 LEU HB1 . 6934 1 1575 . 1 1 150 150 LEU HB3 H 1 2.146 0.01 . 2 . . . . 130 LEU HB2 . 6934 1 1576 . 1 1 150 150 LEU HG H 1 1.965 0.01 . 1 . . . . 130 LEU HG . 6934 1 1577 . 1 1 150 150 LEU HD11 H 1 1.040 0.01 . 2 . . . . 130 LEU HD1 . 6934 1 1578 . 1 1 150 150 LEU HD12 H 1 1.040 0.01 . 2 . . . . 130 LEU HD1 . 6934 1 1579 . 1 1 150 150 LEU HD13 H 1 1.040 0.01 . 2 . . . . 130 LEU HD1 . 6934 1 1580 . 1 1 150 150 LEU HD21 H 1 0.970 0.01 . 2 . . . . 130 LEU HD2 . 6934 1 1581 . 1 1 150 150 LEU HD22 H 1 0.970 0.01 . 2 . . . . 130 LEU HD2 . 6934 1 1582 . 1 1 150 150 LEU HD23 H 1 0.970 0.01 . 2 . . . . 130 LEU HD2 . 6934 1 1583 . 1 1 150 150 LEU C C 13 180.043 0.2 . 1 . . . . 130 LEU C . 6934 1 1584 . 1 1 150 150 LEU CA C 13 58.302 0.2 . 1 . . . . 130 LEU CA . 6934 1 1585 . 1 1 150 150 LEU CB C 13 43.002 0.2 . 1 . . . . 130 LEU CB . 6934 1 1586 . 1 1 150 150 LEU CG C 13 26.300 0.2 . 1 . . . . 130 LEU CG . 6934 1 1587 . 1 1 150 150 LEU CD1 C 13 26.000 0.2 . 2 . . . . 130 LEU CD1 . 6934 1 1588 . 1 1 150 150 LEU CD2 C 13 22.900 0.2 . 2 . . . . 130 LEU CD2 . 6934 1 1589 . 1 1 150 150 LEU N N 15 120.901 0.15 . 1 . . . . 130 LEU N . 6934 1 1590 . 1 1 151 151 LEU H H 1 8.725 0.01 . 1 . . . . 131 LEU HN . 6934 1 1591 . 1 1 151 151 LEU HA H 1 4.084 0.01 . 1 . . . . 131 LEU HA . 6934 1 1592 . 1 1 151 151 LEU HB2 H 1 1.854 0.01 . 2 . . . . 131 LEU HB1 . 6934 1 1593 . 1 1 151 151 LEU HB3 H 1 0.824 0.01 . 2 . . . . 131 LEU HB2 . 6934 1 1594 . 1 1 151 151 LEU HG H 1 1.930 0.01 . 1 . . . . 131 LEU HG . 6934 1 1595 . 1 1 151 151 LEU HD11 H 1 0.766 0.01 . 2 . . . . 131 LEU HD1 . 6934 1 1596 . 1 1 151 151 LEU HD12 H 1 0.766 0.01 . 2 . . . . 131 LEU HD1 . 6934 1 1597 . 1 1 151 151 LEU HD13 H 1 0.766 0.01 . 2 . . . . 131 LEU HD1 . 6934 1 1598 . 1 1 151 151 LEU HD21 H 1 0.710 0.01 . 2 . . . . 131 LEU HD2 . 6934 1 1599 . 1 1 151 151 LEU HD22 H 1 0.710 0.01 . 2 . . . . 131 LEU HD2 . 6934 1 1600 . 1 1 151 151 LEU HD23 H 1 0.710 0.01 . 2 . . . . 131 LEU HD2 . 6934 1 1601 . 1 1 151 151 LEU C C 13 178.259 0.2 . 1 . . . . 131 LEU C . 6934 1 1602 . 1 1 151 151 LEU CA C 13 58.030 0.2 . 1 . . . . 131 LEU CA . 6934 1 1603 . 1 1 151 151 LEU CB C 13 42.200 0.2 . 1 . . . . 131 LEU CB . 6934 1 1604 . 1 1 151 151 LEU CG C 13 28.200 0.2 . 1 . . . . 131 LEU CG . 6934 1 1605 . 1 1 151 151 LEU CD1 C 13 28.200 0.2 . 2 . . . . 131 LEU CD1 . 6934 1 1606 . 1 1 151 151 LEU CD2 C 13 25.070 0.2 . 2 . . . . 131 LEU CD2 . 6934 1 1607 . 1 1 151 151 LEU N N 15 121.140 0.15 . 1 . . . . 131 LEU N . 6934 1 1608 . 1 1 152 152 GLU H H 1 9.047 0.01 . 1 . . . . 132 GLU HN . 6934 1 1609 . 1 1 152 152 GLU HA H 1 3.829 0.01 . 1 . . . . 132 GLU HA . 6934 1 1610 . 1 1 152 152 GLU HB2 H 1 1.630 0.01 . 2 . . . . 132 GLU HB1 . 6934 1 1611 . 1 1 152 152 GLU HB3 H 1 1.994 0.01 . 2 . . . . 132 GLU HB2 . 6934 1 1612 . 1 1 152 152 GLU HG2 H 1 2.297 0.01 . 2 . . . . 132 GLU HG1 . 6934 1 1613 . 1 1 152 152 GLU HG3 H 1 2.420 0.01 . 2 . . . . 132 GLU HG2 . 6934 1 1614 . 1 1 152 152 GLU C C 13 177.694 0.2 . 1 . . . . 132 GLU C . 6934 1 1615 . 1 1 152 152 GLU CA C 13 60.751 0.2 . 1 . . . . 132 GLU CA . 6934 1 1616 . 1 1 152 152 GLU CB C 13 29.181 0.2 . 1 . . . . 132 GLU CB . 6934 1 1617 . 1 1 152 152 GLU CG C 13 36.900 0.2 . 1 . . . . 132 GLU CG . 6934 1 1618 . 1 1 152 152 GLU N N 15 121.654 0.15 . 1 . . . . 132 GLU N . 6934 1 1619 . 1 1 153 153 ARG H H 1 7.728 0.01 . 1 . . . . 133 ARG HN . 6934 1 1620 . 1 1 153 153 ARG HA H 1 4.005 0.01 . 1 . . . . 133 ARG HA . 6934 1 1621 . 1 1 153 153 ARG HB2 H 1 1.971 0.01 . 1 . . . . 133 ARG HB1 . 6934 1 1622 . 1 1 153 153 ARG HB3 H 1 1.971 0.01 . 1 . . . . 133 ARG HB2 . 6934 1 1623 . 1 1 153 153 ARG HG2 H 1 1.510 0.01 . 2 . . . . 133 ARG HG1 . 6934 1 1624 . 1 1 153 153 ARG HG3 H 1 1.720 0.01 . 2 . . . . 133 ARG HG2 . 6934 1 1625 . 1 1 153 153 ARG HD2 H 1 3.280 0.01 . 2 . . . . 133 ARG HD1 . 6934 1 1626 . 1 1 153 153 ARG HD3 H 1 3.165 0.01 . 2 . . . . 133 ARG HD2 . 6934 1 1627 . 1 1 153 153 ARG HE H 1 7.690 0.01 . 1 . . . . 133 ARG HE . 6934 1 1628 . 1 1 153 153 ARG HH11 H 1 6.720 0.01 . 1 . . . . 133 ARG HH11 . 6934 1 1629 . 1 1 153 153 ARG HH21 H 1 6.720 0.01 . 1 . . . . 133 ARG HH21 . 6934 1 1630 . 1 1 153 153 ARG C C 13 179.352 0.2 . 1 . . . . 133 ARG C . 6934 1 1631 . 1 1 153 153 ARG CA C 13 59.650 0.2 . 1 . . . . 133 ARG CA . 6934 1 1632 . 1 1 153 153 ARG CB C 13 30.522 0.2 . 1 . . . . 133 ARG CB . 6934 1 1633 . 1 1 153 153 ARG CG C 13 26.900 0.2 . 1 . . . . 133 ARG CG . 6934 1 1634 . 1 1 153 153 ARG CD C 13 43.600 0.2 . 1 . . . . 133 ARG CD . 6934 1 1635 . 1 1 153 153 ARG N N 15 119.274 0.15 . 1 . . . . 133 ARG N . 6934 1 1636 . 1 1 153 153 ARG NE N 15 114.850 0.15 . 1 . . . . 133 ARG NE . 6934 1 1637 . 1 1 154 154 SER H H 1 7.862 0.01 . 1 . . . . 134 SER HN . 6934 1 1638 . 1 1 154 154 SER HA H 1 4.500 0.01 . 1 . . . . 134 SER HA . 6934 1 1639 . 1 1 154 154 SER HB2 H 1 3.915 0.01 . 2 . . . . 134 SER HB1 . 6934 1 1640 . 1 1 154 154 SER HB3 H 1 3.610 0.01 . 2 . . . . 134 SER HB2 . 6934 1 1641 . 1 1 154 154 SER C C 13 175.941 0.2 . 1 . . . . 134 SER C . 6934 1 1642 . 1 1 154 154 SER CA C 13 63.615 0.2 . 1 . . . . 134 SER CA . 6934 1 1643 . 1 1 154 154 SER CB C 13 63.600 0.2 . 1 . . . . 134 SER CB . 6934 1 1644 . 1 1 154 154 SER N N 15 116.129 0.15 . 1 . . . . 134 SER N . 6934 1 1645 . 1 1 155 155 ALA H H 1 9.153 0.01 . 1 . . . . 135 ALA HN . 6934 1 1646 . 1 1 155 155 ALA HA H 1 4.108 0.01 . 1 . . . . 135 ALA HA . 6934 1 1647 . 1 1 155 155 ALA HB1 H 1 1.755 0.01 . 1 . . . . 135 ALA HB . 6934 1 1648 . 1 1 155 155 ALA HB2 H 1 1.755 0.01 . 1 . . . . 135 ALA HB . 6934 1 1649 . 1 1 155 155 ALA HB3 H 1 1.755 0.01 . 1 . . . . 135 ALA HB . 6934 1 1650 . 1 1 155 155 ALA C C 13 179.073 0.2 . 1 . . . . 135 ALA C . 6934 1 1651 . 1 1 155 155 ALA CA C 13 55.730 0.2 . 1 . . . . 135 ALA CA . 6934 1 1652 . 1 1 155 155 ALA CB C 13 19.590 0.2 . 1 . . . . 135 ALA CB . 6934 1 1653 . 1 1 155 155 ALA N N 15 125.252 0.15 . 1 . . . . 135 ALA N . 6934 1 1654 . 1 1 156 156 ARG H H 1 7.961 0.01 . 1 . . . . 136 ARG HN . 6934 1 1655 . 1 1 156 156 ARG HA H 1 3.501 0.01 . 1 . . . . 136 ARG HA . 6934 1 1656 . 1 1 156 156 ARG HB2 H 1 1.764 0.01 . 2 . . . . 136 ARG HB1 . 6934 1 1657 . 1 1 156 156 ARG HB3 H 1 1.867 0.01 . 2 . . . . 136 ARG HB2 . 6934 1 1658 . 1 1 156 156 ARG HG2 H 1 1.582 0.01 . 2 . . . . 136 ARG HG1 . 6934 1 1659 . 1 1 156 156 ARG HG3 H 1 1.125 0.01 . 2 . . . . 136 ARG HG2 . 6934 1 1660 . 1 1 156 156 ARG HD2 H 1 3.040 0.01 . 1 . . . . 136 ARG HD1 . 6934 1 1661 . 1 1 156 156 ARG HD3 H 1 3.040 0.01 . 1 . . . . 136 ARG HD2 . 6934 1 1662 . 1 1 156 156 ARG HE H 1 7.300 0.01 . 1 . . . . 136 ARG HE . 6934 1 1663 . 1 1 156 156 ARG C C 13 179.342 0.2 . 1 . . . . 136 ARG C . 6934 1 1664 . 1 1 156 156 ARG CA C 13 59.741 0.2 . 1 . . . . 136 ARG CA . 6934 1 1665 . 1 1 156 156 ARG CB C 13 29.999 0.2 . 1 . . . . 136 ARG CB . 6934 1 1666 . 1 1 156 156 ARG CG C 13 27.900 0.2 . 1 . . . . 136 ARG CG . 6934 1 1667 . 1 1 156 156 ARG CD C 13 43.500 0.2 . 1 . . . . 136 ARG CD . 6934 1 1668 . 1 1 156 156 ARG N N 15 117.755 0.15 . 1 . . . . 136 ARG N . 6934 1 1669 . 1 1 156 156 ARG NE N 15 115.000 0.15 . 1 . . . . 136 ARG NE . 6934 1 1670 . 1 1 157 157 GLN H H 1 7.608 0.01 . 1 . . . . 137 GLN HN . 6934 1 1671 . 1 1 157 157 GLN HA H 1 3.885 0.01 . 1 . . . . 137 GLN HA . 6934 1 1672 . 1 1 157 157 GLN HB2 H 1 2.390 0.01 . 2 . . . . 137 GLN HB1 . 6934 1 1673 . 1 1 157 157 GLN HB3 H 1 1.563 0.01 . 2 . . . . 137 GLN HB2 . 6934 1 1674 . 1 1 157 157 GLN HG2 H 1 2.258 0.01 . 2 . . . . 137 GLN HG1 . 6934 1 1675 . 1 1 157 157 GLN HG3 H 1 2.574 0.01 . 2 . . . . 137 GLN HG2 . 6934 1 1676 . 1 1 157 157 GLN HE21 H 1 6.998 0.01 . 2 . . . . 137 GLN HE21 . 6934 1 1677 . 1 1 157 157 GLN HE22 H 1 6.149 0.01 . 2 . . . . 137 GLN HE22 . 6934 1 1678 . 1 1 157 157 GLN C C 13 180.204 0.2 . 1 . . . . 137 GLN C . 6934 1 1679 . 1 1 157 157 GLN CA C 13 58.788 0.2 . 1 . . . . 137 GLN CA . 6934 1 1680 . 1 1 157 157 GLN CB C 13 28.123 0.2 . 1 . . . . 137 GLN CB . 6934 1 1681 . 1 1 157 157 GLN CG C 13 33.300 0.2 . 1 . . . . 137 GLN CG . 6934 1 1682 . 1 1 157 157 GLN N N 15 118.811 0.15 . 1 . . . . 137 GLN N . 6934 1 1683 . 1 1 157 157 GLN NE2 N 15 107.914 0.15 . 1 . . . . 137 GLN NE2 . 6934 1 1684 . 1 1 158 158 TRP H H 1 8.823 0.01 . 1 . . . . 138 TRP HN . 6934 1 1685 . 1 1 158 158 TRP HA H 1 4.257 0.01 . 1 . . . . 138 TRP HA . 6934 1 1686 . 1 1 158 158 TRP HB2 H 1 3.080 0.01 . 2 . . . . 138 TRP HB1 . 6934 1 1687 . 1 1 158 158 TRP HB3 H 1 3.150 0.01 . 2 . . . . 138 TRP HB2 . 6934 1 1688 . 1 1 158 158 TRP HD1 H 1 6.980 0.01 . 4 . . . . 138 TRP HD1 . 6934 1 1689 . 1 1 158 158 TRP HE1 H 1 9.760 0.01 . 4 . . . . 138 TRP HE1 . 6934 1 1690 . 1 1 158 158 TRP HZ2 H 1 7.310 0.01 . 4 . . . . 138 TRP HZ2 . 6934 1 1691 . 1 1 158 158 TRP HZ3 H 1 7.100 0.01 . 4 . . . . 138 TRP HZ3 . 6934 1 1692 . 1 1 158 158 TRP C C 13 178.178 0.2 . 1 . . . . 138 TRP C . 6934 1 1693 . 1 1 158 158 TRP CA C 13 61.670 0.2 . 1 . . . . 138 TRP CA . 6934 1 1694 . 1 1 158 158 TRP CB C 13 29.301 0.2 . 1 . . . . 138 TRP CB . 6934 1 1695 . 1 1 158 158 TRP N N 15 120.652 0.15 . 1 . . . . 138 TRP N . 6934 1 1696 . 1 1 158 158 TRP NE1 N 15 128.700 0.15 . 1 . . . . 138 TRP NE1 . 6934 1 1697 . 1 1 159 159 ALA H H 1 8.733 0.01 . 1 . . . . 139 ALA HN . 6934 1 1698 . 1 1 159 159 ALA HA H 1 4.018 0.01 . 1 . . . . 139 ALA HA . 6934 1 1699 . 1 1 159 159 ALA HB1 H 1 1.510 0.01 . 1 . . . . 139 ALA HB . 6934 1 1700 . 1 1 159 159 ALA HB2 H 1 1.510 0.01 . 1 . . . . 139 ALA HB . 6934 1 1701 . 1 1 159 159 ALA HB3 H 1 1.510 0.01 . 1 . . . . 139 ALA HB . 6934 1 1702 . 1 1 159 159 ALA C C 13 179.601 0.2 . 1 . . . . 139 ALA C . 6934 1 1703 . 1 1 159 159 ALA CA C 13 55.943 0.2 . 1 . . . . 139 ALA CA . 6934 1 1704 . 1 1 159 159 ALA CB C 13 18.557 0.2 . 1 . . . . 139 ALA CB . 6934 1 1705 . 1 1 159 159 ALA N N 15 120.549 0.15 . 1 . . . . 139 ALA N . 6934 1 1706 . 1 1 160 160 GLN H H 1 7.451 0.01 . 1 . . . . 140 GLN HN . 6934 1 1707 . 1 1 160 160 GLN HA H 1 4.124 0.01 . 1 . . . . 140 GLN HA . 6934 1 1708 . 1 1 160 160 GLN HB2 H 1 1.960 0.01 . 2 . . . . 140 GLN HB1 . 6934 1 1709 . 1 1 160 160 GLN HB3 H 1 2.020 0.01 . 2 . . . . 140 GLN HB2 . 6934 1 1710 . 1 1 160 160 GLN HG2 H 1 2.370 0.01 . 2 . . . . 140 GLN HG1 . 6934 1 1711 . 1 1 160 160 GLN HG3 H 1 2.265 0.01 . 2 . . . . 140 GLN HG2 . 6934 1 1712 . 1 1 160 160 GLN HE21 H 1 7.331 0.01 . 2 . . . . 140 GLN HE21 . 6934 1 1713 . 1 1 160 160 GLN HE22 H 1 6.767 0.01 . 2 . . . . 140 GLN HE22 . 6934 1 1714 . 1 1 160 160 GLN C C 13 178.407 0.2 . 1 . . . . 140 GLN C . 6934 1 1715 . 1 1 160 160 GLN CA C 13 58.137 0.2 . 1 . . . . 140 GLN CA . 6934 1 1716 . 1 1 160 160 GLN CB C 13 28.398 0.2 . 1 . . . . 140 GLN CB . 6934 1 1717 . 1 1 160 160 GLN CG C 13 33.500 0.2 . 1 . . . . 140 GLN CG . 6934 1 1718 . 1 1 160 160 GLN N N 15 115.895 0.15 . 1 . . . . 140 GLN N . 6934 1 1719 . 1 1 160 160 GLN NE2 N 15 111.799 0.15 . 1 . . . . 140 GLN NE2 . 6934 1 1720 . 1 1 161 161 ALA H H 1 7.710 0.01 . 1 . . . . 141 ALA HN . 6934 1 1721 . 1 1 161 161 ALA HA H 1 3.860 0.01 . 1 . . . . 141 ALA HA . 6934 1 1722 . 1 1 161 161 ALA HB1 H 1 0.951 0.01 . 1 . . . . 141 ALA HB . 6934 1 1723 . 1 1 161 161 ALA HB2 H 1 0.951 0.01 . 1 . . . . 141 ALA HB . 6934 1 1724 . 1 1 161 161 ALA HB3 H 1 0.951 0.01 . 1 . . . . 141 ALA HB . 6934 1 1725 . 1 1 161 161 ALA C C 13 179.368 0.2 . 1 . . . . 141 ALA C . 6934 1 1726 . 1 1 161 161 ALA CA C 13 54.571 0.2 . 1 . . . . 141 ALA CA . 6934 1 1727 . 1 1 161 161 ALA CB C 13 18.375 0.2 . 1 . . . . 141 ALA CB . 6934 1 1728 . 1 1 161 161 ALA N N 15 123.135 0.15 . 1 . . . . 141 ALA N . 6934 1 1729 . 1 1 162 162 LEU H H 1 8.049 0.01 . 1 . . . . 142 LEU HN . 6934 1 1730 . 1 1 162 162 LEU HA H 1 4.464 0.01 . 1 . . . . 142 LEU HA . 6934 1 1731 . 1 1 162 162 LEU HB2 H 1 1.600 0.01 . 2 . . . . 142 LEU HB1 . 6934 1 1732 . 1 1 162 162 LEU HB3 H 1 1.535 0.01 . 2 . . . . 142 LEU HB2 . 6934 1 1733 . 1 1 162 162 LEU HG H 1 2.280 0.01 . 1 . . . . 142 LEU HG . 6934 1 1734 . 1 1 162 162 LEU HD11 H 1 0.773 0.01 . 2 . . . . 142 LEU HD1 . 6934 1 1735 . 1 1 162 162 LEU HD12 H 1 0.773 0.01 . 2 . . . . 142 LEU HD1 . 6934 1 1736 . 1 1 162 162 LEU HD13 H 1 0.773 0.01 . 2 . . . . 142 LEU HD1 . 6934 1 1737 . 1 1 162 162 LEU HD21 H 1 1.010 0.01 . 2 . . . . 142 LEU HD2 . 6934 1 1738 . 1 1 162 162 LEU HD22 H 1 1.010 0.01 . 2 . . . . 142 LEU HD2 . 6934 1 1739 . 1 1 162 162 LEU HD23 H 1 1.010 0.01 . 2 . . . . 142 LEU HD2 . 6934 1 1740 . 1 1 162 162 LEU C C 13 176.825 0.2 . 1 . . . . 142 LEU C . 6934 1 1741 . 1 1 162 162 LEU CA C 13 55.312 0.2 . 1 . . . . 142 LEU CA . 6934 1 1742 . 1 1 162 162 LEU CB C 13 41.616 0.2 . 1 . . . . 142 LEU CB . 6934 1 1743 . 1 1 162 162 LEU CG C 13 27.200 0.2 . 1 . . . . 142 LEU CG . 6934 1 1744 . 1 1 162 162 LEU CD1 C 13 25.800 0.2 . 2 . . . . 142 LEU CD1 . 6934 1 1745 . 1 1 162 162 LEU CD2 C 13 22.700 0.2 . 2 . . . . 142 LEU CD2 . 6934 1 1746 . 1 1 162 162 LEU N N 15 115.380 0.15 . 1 . . . . 142 LEU N . 6934 1 1747 . 1 1 163 163 ASN H H 1 7.607 0.01 . 1 . . . . 143 ASN HN . 6934 1 1748 . 1 1 163 163 ASN HA H 1 4.793 0.01 . 1 . . . . 143 ASN HA . 6934 1 1749 . 1 1 163 163 ASN HB2 H 1 2.898 0.01 . 2 . . . . 143 ASN HB1 . 6934 1 1750 . 1 1 163 163 ASN HB3 H 1 2.987 0.01 . 2 . . . . 143 ASN HB2 . 6934 1 1751 . 1 1 163 163 ASN HD21 H 1 7.568 0.01 . 2 . . . . 143 ASN HD21 . 6934 1 1752 . 1 1 163 163 ASN HD22 H 1 6.863 0.01 . 2 . . . . 143 ASN HD22 . 6934 1 1753 . 1 1 163 163 ASN C C 13 175.154 0.2 . 1 . . . . 143 ASN C . 6934 1 1754 . 1 1 163 163 ASN CA C 13 53.680 0.2 . 1 . . . . 143 ASN CA . 6934 1 1755 . 1 1 163 163 ASN CB C 13 38.543 0.2 . 1 . . . . 143 ASN CB . 6934 1 1756 . 1 1 163 163 ASN N N 15 118.193 0.15 . 1 . . . . 143 ASN N . 6934 1 1757 . 1 1 163 163 ASN ND2 N 15 111.900 0.15 . 1 . . . . 143 ASN ND2 . 6934 1 1758 . 1 1 164 164 ALA H H 1 8.047 0.01 . 1 . . . . 144 ALA HN . 6934 1 1759 . 1 1 164 164 ALA HA H 1 4.162 0.01 . 1 . . . . 144 ALA HA . 6934 1 1760 . 1 1 164 164 ALA HB1 H 1 1.380 0.01 . 1 . . . . 144 ALA HB . 6934 1 1761 . 1 1 164 164 ALA HB2 H 1 1.380 0.01 . 1 . . . . 144 ALA HB . 6934 1 1762 . 1 1 164 164 ALA HB3 H 1 1.380 0.01 . 1 . . . . 144 ALA HB . 6934 1 1763 . 1 1 164 164 ALA C C 13 177.438 0.2 . 1 . . . . 144 ALA C . 6934 1 1764 . 1 1 164 164 ALA CA C 13 52.821 0.2 . 1 . . . . 144 ALA CA . 6934 1 1765 . 1 1 164 164 ALA CB C 13 19.475 0.2 . 1 . . . . 144 ALA CB . 6934 1 1766 . 1 1 164 164 ALA N N 15 123.480 0.15 . 1 . . . . 144 ALA N . 6934 1 1767 . 1 1 165 165 GLU H H 1 8.325 0.01 . 1 . . . . 145 GLU HN . 6934 1 1768 . 1 1 165 165 GLU HA H 1 4.274 0.01 . 1 . . . . 145 GLU HA . 6934 1 1769 . 1 1 165 165 GLU HB2 H 1 1.951 0.01 . 2 . . . . 145 GLU HB1 . 6934 1 1770 . 1 1 165 165 GLU HB3 H 1 2.069 0.01 . 2 . . . . 145 GLU HB2 . 6934 1 1771 . 1 1 165 165 GLU HG2 H 1 2.270 0.01 . 2 . . . . 145 GLU HG1 . 6934 1 1772 . 1 1 165 165 GLU HG3 H 1 2.310 0.01 . 2 . . . . 145 GLU HG2 . 6934 1 1773 . 1 1 165 165 GLU C C 13 176.227 0.2 . 1 . . . . 145 GLU C . 6934 1 1774 . 1 1 165 165 GLU CA C 13 56.553 0.2 . 1 . . . . 145 GLU CA . 6934 1 1775 . 1 1 165 165 GLU CB C 13 30.293 0.2 . 1 . . . . 145 GLU CB . 6934 1 1776 . 1 1 165 165 GLU CG C 13 36.300 0.2 . 1 . . . . 145 GLU CG . 6934 1 1777 . 1 1 165 165 GLU N N 15 119.563 0.15 . 1 . . . . 145 GLU N . 6934 1 1778 . 1 1 166 166 GLN H H 1 8.298 0.01 . 1 . . . . 146 GLN HN . 6934 1 1779 . 1 1 166 166 GLN HA H 1 4.389 0.01 . 1 . . . . 146 GLN HA . 6934 1 1780 . 1 1 166 166 GLN HB2 H 1 1.951 0.01 . 2 . . . . 146 GLN HB1 . 6934 1 1781 . 1 1 166 166 GLN HB3 H 1 2.110 0.01 . 2 . . . . 146 GLN HB2 . 6934 1 1782 . 1 1 166 166 GLN HG2 H 1 2.324 0.01 . 1 . . . . 146 GLN HG1 . 6934 1 1783 . 1 1 166 166 GLN HG3 H 1 2.329 0.01 . 1 . . . . 146 GLN HG2 . 6934 1 1784 . 1 1 166 166 GLN HE21 H 1 7.561 0.01 . 2 . . . . 146 GLN HE21 . 6934 1 1785 . 1 1 166 166 GLN HE22 H 1 6.822 0.01 . 2 . . . . 146 GLN HE22 . 6934 1 1786 . 1 1 166 166 GLN C C 13 174.836 0.2 . 1 . . . . 146 GLN C . 6934 1 1787 . 1 1 166 166 GLN CA C 13 55.734 0.2 . 1 . . . . 146 GLN CA . 6934 1 1788 . 1 1 166 166 GLN CB C 13 29.677 0.2 . 1 . . . . 146 GLN CB . 6934 1 1789 . 1 1 166 166 GLN CG C 13 33.880 0.2 . 1 . . . . 146 GLN CG . 6934 1 1790 . 1 1 166 166 GLN N N 15 121.449 0.15 . 1 . . . . 146 GLN N . 6934 1 1791 . 1 1 166 166 GLN NE2 N 15 112.925 0.15 . 1 . . . . 146 GLN NE2 . 6934 1 1792 . 1 1 167 167 VAL H H 1 7.779 0.01 . 1 . . . . 147 VAL HN . 6934 1 1793 . 1 1 167 167 VAL HA H 1 4.076 0.01 . 1 . . . . 147 VAL HA . 6934 1 1794 . 1 1 167 167 VAL HB H 1 2.090 0.01 . 1 . . . . 147 VAL HB . 6934 1 1795 . 1 1 167 167 VAL HG11 H 1 0.869 0.01 . 2 . . . . 147 VAL HG1 . 6934 1 1796 . 1 1 167 167 VAL HG12 H 1 0.869 0.01 . 2 . . . . 147 VAL HG1 . 6934 1 1797 . 1 1 167 167 VAL HG13 H 1 0.869 0.01 . 2 . . . . 147 VAL HG1 . 6934 1 1798 . 1 1 167 167 VAL HG21 H 1 0.895 0.01 . 2 . . . . 147 VAL HG2 . 6934 1 1799 . 1 1 167 167 VAL HG22 H 1 0.895 0.01 . 2 . . . . 147 VAL HG2 . 6934 1 1800 . 1 1 167 167 VAL HG23 H 1 0.895 0.01 . 2 . . . . 147 VAL HG2 . 6934 1 1801 . 1 1 167 167 VAL C C 13 180.893 0.2 . 1 . . . . 147 VAL C . 6934 1 1802 . 1 1 167 167 VAL CA C 13 63.655 0.2 . 1 . . . . 147 VAL CA . 6934 1 1803 . 1 1 167 167 VAL CB C 13 33.258 0.2 . 1 . . . . 147 VAL CB . 6934 1 1804 . 1 1 167 167 VAL CG1 C 13 20.300 0.2 . 2 . . . . 147 VAL CG1 . 6934 1 1805 . 1 1 167 167 VAL CG2 C 13 21.700 0.2 . 2 . . . . 147 VAL CG2 . 6934 1 1806 . 1 1 167 167 VAL N N 15 125.731 0.15 . 1 . . . . 147 VAL N . 6934 1 stop_ save_