data_6755 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 6755 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 ; solution structure of TA0743 from thermoplasma acidophilum ; 'Structure analysis' ; the data from the entries that make up this study were used to determine the structure of TA0743 ; 6755 1 stop_ loop_ _Study_keyword.Study_ID _Study_keyword.Keyword _Study_keyword.Entry_ID _Study_keyword.Study_list_ID . 'NMR structure' 6755 1 . TA0743 6755 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6755 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for TA0743 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-07-28 _Entry.Accession_date 2005-07-28 _Entry.Last_release_date 2006-04-24 _Entry.Original_release_date 2006-04-24 _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 BeomKyu Kim . . . 6755 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . NESGC . 6755 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6755 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 360 6755 '15N chemical shifts' 111 6755 '1H chemical shifts' 826 6755 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 . . 2006-04-24 2005-07-28 original author . 6755 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2ABY 'BMRB Entry Tracking System' 6755 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6755 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16374782 _Citation.Full_citation . _Citation.Title ; NMR structure of the conserved novel-fold protein TA0743 from Thermoplasma acidophilum ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Proteins _Citation.Journal_name_full . _Citation.Journal_volume 62 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 819 _Citation.Page_last 821 _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 BeomKyu Kim . . . 6755 1 2 Jingwon Jung . . . 6755 1 3 Eunmi Hong . . . 6755 1 4 Adelinda Yee . . . 6755 1 5 Cheryl Arrowsmith . H. . 6755 1 6 Weontae Lee . . . 6755 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID TA0743 6755 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6755 _Assembly.ID 1 _Assembly.Name TA0743 _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 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID protein 6755 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 TA0743 1 $TA0743_from_thermoplasma_acidophilum . . no native no no . . . 6755 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_TA0743_from_thermoplasma_acidophilum _Entity.Sf_category entity _Entity.Sf_framecode TA0743_from_thermoplasma_acidophilum _Entity.Entry_ID 6755 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name TA0743 _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 ; MGTSHHHHHHSSGRENLYFQ SHMQKGLEIAFQTINGLDES LVQALAGVTASDFPDLDIKY NIFLVDLYGQKYFRILFQSK KLSELHPEERKKVREKFDEN SRMQYSELMTKYHDLKKQGK IKDRPVKEVHEEYDLWEDPI WQYIGS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 146 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _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 2ABY . "Solution Structure Of Ta0743 From Thermoplasma Acidophilum" . . . . . 100.00 146 100.00 100.00 9.30e-103 . . . . 6755 1 2 no EMBL CAC11877 . "hypothetical protein [Thermoplasma acidophilum]" . . . . . 83.56 122 100.00 100.00 6.19e-83 . . . . 6755 1 3 no REF NP_394207 . "hypothetical protein Ta0743 [Thermoplasma acidophilum DSM 1728]" . . . . . 83.56 122 100.00 100.00 6.19e-83 . . . . 6755 1 4 no REF WP_010901158 . "hypothetical protein [Thermoplasma acidophilum]" . . . . . 83.56 122 100.00 100.00 6.19e-83 . . . . 6755 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID TA0743 . 6755 1 stop_ loop_ _Entity_keyword.Keyword _Entity_keyword.Entry_ID _Entity_keyword.Entity_ID TA0743 6755 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 -22 MET . 6755 1 2 -21 GLY . 6755 1 3 -20 THR . 6755 1 4 -19 SER . 6755 1 5 -18 HIS . 6755 1 6 -17 HIS . 6755 1 7 -16 HIS . 6755 1 8 -15 HIS . 6755 1 9 -14 HIS . 6755 1 10 -13 HIS . 6755 1 11 -12 SER . 6755 1 12 -11 SER . 6755 1 13 -10 GLY . 6755 1 14 -9 ARG . 6755 1 15 -8 GLU . 6755 1 16 -7 ASN . 6755 1 17 -6 LEU . 6755 1 18 -5 TYR . 6755 1 19 -4 PHE . 6755 1 20 -3 GLN . 6755 1 21 -2 SER . 6755 1 22 -1 HIS . 6755 1 23 1 MET . 6755 1 24 2 GLN . 6755 1 25 3 LYS . 6755 1 26 4 GLY . 6755 1 27 5 LEU . 6755 1 28 6 GLU . 6755 1 29 7 ILE . 6755 1 30 8 ALA . 6755 1 31 9 PHE . 6755 1 32 10 GLN . 6755 1 33 11 THR . 6755 1 34 12 ILE . 6755 1 35 13 ASN . 6755 1 36 14 GLY . 6755 1 37 15 LEU . 6755 1 38 16 ASP . 6755 1 39 17 GLU . 6755 1 40 18 SER . 6755 1 41 19 LEU . 6755 1 42 20 VAL . 6755 1 43 21 GLN . 6755 1 44 22 ALA . 6755 1 45 23 LEU . 6755 1 46 24 ALA . 6755 1 47 25 GLY . 6755 1 48 26 VAL . 6755 1 49 27 THR . 6755 1 50 28 ALA . 6755 1 51 29 SER . 6755 1 52 30 ASP . 6755 1 53 31 PHE . 6755 1 54 32 PRO . 6755 1 55 33 ASP . 6755 1 56 34 LEU . 6755 1 57 35 ASP . 6755 1 58 36 ILE . 6755 1 59 37 LYS . 6755 1 60 38 TYR . 6755 1 61 39 ASN . 6755 1 62 40 ILE . 6755 1 63 41 PHE . 6755 1 64 42 LEU . 6755 1 65 43 VAL . 6755 1 66 44 ASP . 6755 1 67 45 LEU . 6755 1 68 46 TYR . 6755 1 69 47 GLY . 6755 1 70 48 GLN . 6755 1 71 49 LYS . 6755 1 72 50 TYR . 6755 1 73 51 PHE . 6755 1 74 52 ARG . 6755 1 75 53 ILE . 6755 1 76 54 LEU . 6755 1 77 55 PHE . 6755 1 78 56 GLN . 6755 1 79 57 SER . 6755 1 80 58 LYS . 6755 1 81 59 LYS . 6755 1 82 60 LEU . 6755 1 83 61 SER . 6755 1 84 62 GLU . 6755 1 85 63 LEU . 6755 1 86 64 HIS . 6755 1 87 65 PRO . 6755 1 88 66 GLU . 6755 1 89 67 GLU . 6755 1 90 68 ARG . 6755 1 91 69 LYS . 6755 1 92 70 LYS . 6755 1 93 71 VAL . 6755 1 94 72 ARG . 6755 1 95 73 GLU . 6755 1 96 74 LYS . 6755 1 97 75 PHE . 6755 1 98 76 ASP . 6755 1 99 77 GLU . 6755 1 100 78 ASN . 6755 1 101 79 SER . 6755 1 102 80 ARG . 6755 1 103 81 MET . 6755 1 104 82 GLN . 6755 1 105 83 TYR . 6755 1 106 84 SER . 6755 1 107 85 GLU . 6755 1 108 86 LEU . 6755 1 109 87 MET . 6755 1 110 88 THR . 6755 1 111 89 LYS . 6755 1 112 90 TYR . 6755 1 113 91 HIS . 6755 1 114 92 ASP . 6755 1 115 93 LEU . 6755 1 116 94 LYS . 6755 1 117 95 LYS . 6755 1 118 96 GLN . 6755 1 119 97 GLY . 6755 1 120 98 LYS . 6755 1 121 99 ILE . 6755 1 122 100 LYS . 6755 1 123 101 ASP . 6755 1 124 102 ARG . 6755 1 125 103 PRO . 6755 1 126 104 VAL . 6755 1 127 105 LYS . 6755 1 128 106 GLU . 6755 1 129 107 VAL . 6755 1 130 108 HIS . 6755 1 131 109 GLU . 6755 1 132 110 GLU . 6755 1 133 111 TYR . 6755 1 134 112 ASP . 6755 1 135 113 LEU . 6755 1 136 114 TRP . 6755 1 137 115 GLU . 6755 1 138 116 ASP . 6755 1 139 117 PRO . 6755 1 140 118 ILE . 6755 1 141 119 TRP . 6755 1 142 120 GLN . 6755 1 143 121 TYR . 6755 1 144 122 ILE . 6755 1 145 123 GLY . 6755 1 146 124 SER . 6755 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 6755 1 . GLY 2 2 6755 1 . THR 3 3 6755 1 . SER 4 4 6755 1 . HIS 5 5 6755 1 . HIS 6 6 6755 1 . HIS 7 7 6755 1 . HIS 8 8 6755 1 . HIS 9 9 6755 1 . HIS 10 10 6755 1 . SER 11 11 6755 1 . SER 12 12 6755 1 . GLY 13 13 6755 1 . ARG 14 14 6755 1 . GLU 15 15 6755 1 . ASN 16 16 6755 1 . LEU 17 17 6755 1 . TYR 18 18 6755 1 . PHE 19 19 6755 1 . GLN 20 20 6755 1 . SER 21 21 6755 1 . HIS 22 22 6755 1 . MET 23 23 6755 1 . GLN 24 24 6755 1 . LYS 25 25 6755 1 . GLY 26 26 6755 1 . LEU 27 27 6755 1 . GLU 28 28 6755 1 . ILE 29 29 6755 1 . ALA 30 30 6755 1 . PHE 31 31 6755 1 . GLN 32 32 6755 1 . THR 33 33 6755 1 . ILE 34 34 6755 1 . ASN 35 35 6755 1 . GLY 36 36 6755 1 . LEU 37 37 6755 1 . ASP 38 38 6755 1 . GLU 39 39 6755 1 . SER 40 40 6755 1 . LEU 41 41 6755 1 . VAL 42 42 6755 1 . GLN 43 43 6755 1 . ALA 44 44 6755 1 . LEU 45 45 6755 1 . ALA 46 46 6755 1 . GLY 47 47 6755 1 . VAL 48 48 6755 1 . THR 49 49 6755 1 . ALA 50 50 6755 1 . SER 51 51 6755 1 . ASP 52 52 6755 1 . PHE 53 53 6755 1 . PRO 54 54 6755 1 . ASP 55 55 6755 1 . LEU 56 56 6755 1 . ASP 57 57 6755 1 . ILE 58 58 6755 1 . LYS 59 59 6755 1 . TYR 60 60 6755 1 . ASN 61 61 6755 1 . ILE 62 62 6755 1 . PHE 63 63 6755 1 . LEU 64 64 6755 1 . VAL 65 65 6755 1 . ASP 66 66 6755 1 . LEU 67 67 6755 1 . TYR 68 68 6755 1 . GLY 69 69 6755 1 . GLN 70 70 6755 1 . LYS 71 71 6755 1 . TYR 72 72 6755 1 . PHE 73 73 6755 1 . ARG 74 74 6755 1 . ILE 75 75 6755 1 . LEU 76 76 6755 1 . PHE 77 77 6755 1 . GLN 78 78 6755 1 . SER 79 79 6755 1 . LYS 80 80 6755 1 . LYS 81 81 6755 1 . LEU 82 82 6755 1 . SER 83 83 6755 1 . GLU 84 84 6755 1 . LEU 85 85 6755 1 . HIS 86 86 6755 1 . PRO 87 87 6755 1 . GLU 88 88 6755 1 . GLU 89 89 6755 1 . ARG 90 90 6755 1 . LYS 91 91 6755 1 . LYS 92 92 6755 1 . VAL 93 93 6755 1 . ARG 94 94 6755 1 . GLU 95 95 6755 1 . LYS 96 96 6755 1 . PHE 97 97 6755 1 . ASP 98 98 6755 1 . GLU 99 99 6755 1 . ASN 100 100 6755 1 . SER 101 101 6755 1 . ARG 102 102 6755 1 . MET 103 103 6755 1 . GLN 104 104 6755 1 . TYR 105 105 6755 1 . SER 106 106 6755 1 . GLU 107 107 6755 1 . LEU 108 108 6755 1 . MET 109 109 6755 1 . THR 110 110 6755 1 . LYS 111 111 6755 1 . TYR 112 112 6755 1 . HIS 113 113 6755 1 . ASP 114 114 6755 1 . LEU 115 115 6755 1 . LYS 116 116 6755 1 . LYS 117 117 6755 1 . GLN 118 118 6755 1 . GLY 119 119 6755 1 . LYS 120 120 6755 1 . ILE 121 121 6755 1 . LYS 122 122 6755 1 . ASP 123 123 6755 1 . ARG 124 124 6755 1 . PRO 125 125 6755 1 . VAL 126 126 6755 1 . LYS 127 127 6755 1 . GLU 128 128 6755 1 . VAL 129 129 6755 1 . HIS 130 130 6755 1 . GLU 131 131 6755 1 . GLU 132 132 6755 1 . TYR 133 133 6755 1 . ASP 134 134 6755 1 . LEU 135 135 6755 1 . TRP 136 136 6755 1 . GLU 137 137 6755 1 . ASP 138 138 6755 1 . PRO 139 139 6755 1 . ILE 140 140 6755 1 . TRP 141 141 6755 1 . GLN 142 142 6755 1 . TYR 143 143 6755 1 . ILE 144 144 6755 1 . GLY 145 145 6755 1 . SER 146 146 6755 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 6755 _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 $TA0743_from_thermoplasma_acidophilum . 2303 . no . 'Thermoplasma acidophilum' . . Archaea . Thermoplasma acidophilum . . . . . . . . . . . . . . . . . . . . . 6755 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 6755 _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 $TA0743_from_thermoplasma_acidophilum . 'recombinant technology' . E.coli . . Escherichia Coli . . . . . . . . . . . . . . . . . . . . . . . 6755 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6755 _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 TA0743 '[U-99% 13C; U-99% 15N]' 1 $assembly 1 $TA0743_from_thermoplasma_acidophilum . protein 1.6 . . mM . . . . 6755 1 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 6755 _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 6.5 0.1 pH 6755 1 pressure 1 0 atm 6755 1 temperature 298 0 K 6755 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_500MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 500MHz_spectrometer _NMR_spectrometer.Entry_ID 6755 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500.13 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 6755 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 15N_NOESY no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6755 1 2 13C_NOESY no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6755 1 3 HNCACB no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6755 1 4 CBCA(CO)NH no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6755 1 5 HNCA no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6755 1 6 HCCH-TOCSY no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6755 1 7 (H)CCH-TOCSY no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6755 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 6755 _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 external indirect 0.251449530 . . . . . . . . . 6755 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1.0 . . . . . . . . . 6755 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.101329118 . . . . . . . . . 6755 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 6755 _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 . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 isotropic 6755 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 25 25 LYS HA H 1 4.237 0 . 1 . . . . 3 LYS HA . 6755 1 2 . 1 1 26 26 GLY H H 1 8.012 0.006 . 1 . . . . 4 GLY H . 6755 1 3 . 1 1 26 26 GLY HA2 H 1 3.916 0.006 . 1 . . . . 4 GLY HA2 . 6755 1 4 . 1 1 26 26 GLY HA3 H 1 3.856 0.006 . 1 . . . . 4 GLY HA3 . 6755 1 5 . 1 1 26 26 GLY CA C 13 45.359 0.3 . 1 . . . . 4 GLY CA . 6755 1 6 . 1 1 26 26 GLY N N 15 110.406 0.17 . 1 . . . . 4 GLY N . 6755 1 7 . 1 1 27 27 LEU H H 1 8.704 0.006 . 1 . . . . 5 LEU H . 6755 1 8 . 1 1 27 27 LEU HA H 1 4.803 0.006 . 1 . . . . 5 LEU HA . 6755 1 9 . 1 1 27 27 LEU HB2 H 1 1.974 0.006 . 1 . . . . 5 LEU HB2 . 6755 1 10 . 1 1 27 27 LEU HB3 H 1 1.388 0.006 . 1 . . . . 5 LEU HB3 . 6755 1 11 . 1 1 27 27 LEU HG H 1 1.473 0.006 . 1 . . . . 5 LEU HG . 6755 1 12 . 1 1 27 27 LEU HD11 H 1 0.923 0.006 . 1 . . . . 5 LEU HD1 . 6755 1 13 . 1 1 27 27 LEU HD12 H 1 0.923 0.006 . 1 . . . . 5 LEU HD1 . 6755 1 14 . 1 1 27 27 LEU HD13 H 1 0.923 0.006 . 1 . . . . 5 LEU HD1 . 6755 1 15 . 1 1 27 27 LEU HD21 H 1 0.742 0.006 . 1 . . . . 5 LEU HD2 . 6755 1 16 . 1 1 27 27 LEU HD22 H 1 0.742 0.006 . 1 . . . . 5 LEU HD2 . 6755 1 17 . 1 1 27 27 LEU HD23 H 1 0.742 0.006 . 1 . . . . 5 LEU HD2 . 6755 1 18 . 1 1 27 27 LEU CA C 13 53.504 0.3 . 1 . . . . 5 LEU CA . 6755 1 19 . 1 1 27 27 LEU CB C 13 47.652 0.3 . 1 . . . . 5 LEU CB . 6755 1 20 . 1 1 27 27 LEU CG C 13 27.224 0.3 . 1 . . . . 5 LEU CG . 6755 1 21 . 1 1 27 27 LEU CD1 C 13 23.774 0.3 . 1 . . . . 5 LEU CD1 . 6755 1 22 . 1 1 27 27 LEU N N 15 124.396 0.17 . 1 . . . . 5 LEU N . 6755 1 23 . 1 1 28 28 GLU H H 1 8.914 0.006 . 1 . . . . 6 GLU H . 6755 1 24 . 1 1 28 28 GLU HA H 1 5.354 0.006 . 1 . . . . 6 GLU HA . 6755 1 25 . 1 1 28 28 GLU HB2 H 1 2.047 0.006 . 1 . . . . 6 GLU HB . 6755 1 26 . 1 1 28 28 GLU HB3 H 1 2.047 0.006 . 1 . . . . 6 GLU HB . 6755 1 27 . 1 1 28 28 GLU HG2 H 1 2.216 0.006 . 1 . . . . 6 GLU HG2 . 6755 1 28 . 1 1 28 28 GLU HG3 H 1 2.083 0.006 . 1 . . . . 6 GLU HG3 . 6755 1 29 . 1 1 28 28 GLU CA C 13 54.637 0.3 . 1 . . . . 6 GLU CA . 6755 1 30 . 1 1 28 28 GLU CB C 13 32.562 0.3 . 1 . . . . 6 GLU CB . 6755 1 31 . 1 1 28 28 GLU CG C 13 36.585 0.3 . 1 . . . . 6 GLU CG . 6755 1 32 . 1 1 28 28 GLU N N 15 127.165 0.17 . 1 . . . . 6 GLU N . 6755 1 33 . 1 1 29 29 ILE H H 1 9.159 0.006 . 1 . . . . 7 ILE H . 6755 1 34 . 1 1 29 29 ILE HA H 1 4.177 0.006 . 1 . . . . 7 ILE HA . 6755 1 35 . 1 1 29 29 ILE HB H 1 1.296 0.006 . 1 . . . . 7 ILE HB . 6755 1 36 . 1 1 29 29 ILE HG12 H 1 0.869 0.006 . 1 . . . . 7 ILE HG1 . 6755 1 37 . 1 1 29 29 ILE HG13 H 1 0.869 0.006 . 1 . . . . 7 ILE HG1 . 6755 1 38 . 1 1 29 29 ILE HG21 H 1 0.291 0.006 . 1 . . . . 7 ILE HG2 . 6755 1 39 . 1 1 29 29 ILE HG22 H 1 0.291 0.006 . 1 . . . . 7 ILE HG2 . 6755 1 40 . 1 1 29 29 ILE HG23 H 1 0.291 0.006 . 1 . . . . 7 ILE HG2 . 6755 1 41 . 1 1 29 29 ILE HD11 H 1 0.206 0.006 . 1 . . . . 7 ILE HD1 . 6755 1 42 . 1 1 29 29 ILE HD12 H 1 0.206 0.006 . 1 . . . . 7 ILE HD1 . 6755 1 43 . 1 1 29 29 ILE HD13 H 1 0.206 0.006 . 1 . . . . 7 ILE HD1 . 6755 1 44 . 1 1 29 29 ILE CA C 13 60.96 0.3 . 1 . . . . 7 ILE CA . 6755 1 45 . 1 1 29 29 ILE CB C 13 41.424 0.3 . 1 . . . . 7 ILE CB . 6755 1 46 . 1 1 29 29 ILE CG2 C 13 13.5 0.3 . 1 . . . . 7 ILE CG2 . 6755 1 47 . 1 1 29 29 ILE CD1 C 13 16.472 0.3 . 1 . . . . 7 ILE CD1 . 6755 1 48 . 1 1 29 29 ILE N N 15 125.785 0.17 . 1 . . . . 7 ILE N . 6755 1 49 . 1 1 30 30 ALA H H 1 8.602 0.006 . 1 . . . . 8 ALA H . 6755 1 50 . 1 1 30 30 ALA HA H 1 5.327 0.006 . 1 . . . . 8 ALA HA . 6755 1 51 . 1 1 30 30 ALA HB1 H 1 1.329 0.006 . 1 . . . . 8 ALA HB . 6755 1 52 . 1 1 30 30 ALA HB2 H 1 1.329 0.006 . 1 . . . . 8 ALA HB . 6755 1 53 . 1 1 30 30 ALA HB3 H 1 1.329 0.006 . 1 . . . . 8 ALA HB . 6755 1 54 . 1 1 30 30 ALA CA C 13 50.644 0.3 . 1 . . . . 8 ALA CA . 6755 1 55 . 1 1 30 30 ALA CB C 13 20.367 0.3 . 1 . . . . 8 ALA CB . 6755 1 56 . 1 1 30 30 ALA N N 15 130.198 0.17 . 1 . . . . 8 ALA N . 6755 1 57 . 1 1 31 31 PHE H H 1 9.433 0.006 . 1 . . . . 9 PHE H . 6755 1 58 . 1 1 31 31 PHE HA H 1 4.933 0.006 . 1 . . . . 9 PHE HA . 6755 1 59 . 1 1 31 31 PHE HB2 H 1 2.993 0.006 . 1 . . . . 9 PHE HB2 . 6755 1 60 . 1 1 31 31 PHE HB3 H 1 2.906 0.006 . 1 . . . . 9 PHE HB3 . 6755 1 61 . 1 1 31 31 PHE HD1 H 1 7.219 0.006 . 1 . . . . 9 PHE HD . 6755 1 62 . 1 1 31 31 PHE HD2 H 1 7.219 0.006 . 1 . . . . 9 PHE HD . 6755 1 63 . 1 1 31 31 PHE CA C 13 57.91 0.3 . 1 . . . . 9 PHE CA . 6755 1 64 . 1 1 31 31 PHE CB C 13 43.883 0.3 . 1 . . . . 9 PHE CB . 6755 1 65 . 1 1 31 31 PHE N N 15 124.122 0.17 . 1 . . . . 9 PHE N . 6755 1 66 . 1 1 32 32 GLN H H 1 8.126 0.006 . 1 . . . . 10 GLN H . 6755 1 67 . 1 1 32 32 GLN HA H 1 4.485 0.006 . 1 . . . . 10 GLN HA . 6755 1 68 . 1 1 32 32 GLN HB2 H 1 1.867 0.006 . 1 . . . . 10 GLN HB2 . 6755 1 69 . 1 1 32 32 GLN HB3 H 1 1.701 0.006 . 1 . . . . 10 GLN HB3 . 6755 1 70 . 1 1 32 32 GLN CA C 13 55.067 0.3 . 1 . . . . 10 GLN CA . 6755 1 71 . 1 1 32 32 GLN CB C 13 30.493 0.3 . 1 . . . . 10 GLN CB . 6755 1 72 . 1 1 32 32 GLN N N 15 126.76 0.17 . 1 . . . . 10 GLN N . 6755 1 73 . 1 1 33 33 THR H H 1 8.063 0.006 . 1 . . . . 11 THR H . 6755 1 74 . 1 1 33 33 THR HA H 1 4.478 0.006 . 1 . . . . 11 THR HA . 6755 1 75 . 1 1 33 33 THR HB H 1 4.386 0.006 . 1 . . . . 11 THR HB . 6755 1 76 . 1 1 33 33 THR HG21 H 1 1.163 0.006 . 1 . . . . 11 THR HG2 . 6755 1 77 . 1 1 33 33 THR HG22 H 1 1.163 0.006 . 1 . . . . 11 THR HG2 . 6755 1 78 . 1 1 33 33 THR HG23 H 1 1.163 0.006 . 1 . . . . 11 THR HG2 . 6755 1 79 . 1 1 33 33 THR CA C 13 59.953 0.3 . 1 . . . . 11 THR CA . 6755 1 80 . 1 1 33 33 THR CB C 13 69.489 0.3 . 1 . . . . 11 THR CB . 6755 1 81 . 1 1 33 33 THR CG2 C 13 22.324 0.3 . 1 . . . . 11 THR CG2 . 6755 1 82 . 1 1 33 33 THR N N 15 113.943 0.17 . 1 . . . . 11 THR N . 6755 1 83 . 1 1 34 34 ILE H H 1 8.354 0.006 . 1 . . . . 12 ILE H . 6755 1 84 . 1 1 34 34 ILE HA H 1 4.137 0.006 . 1 . . . . 12 ILE HA . 6755 1 85 . 1 1 34 34 ILE HB H 1 1.834 0.006 . 1 . . . . 12 ILE HB . 6755 1 86 . 1 1 34 34 ILE HG12 H 1 1.386 0.006 . 1 . . . . 12 ILE HG1 . 6755 1 87 . 1 1 34 34 ILE HG13 H 1 1.386 0.006 . 1 . . . . 12 ILE HG1 . 6755 1 88 . 1 1 34 34 ILE HG21 H 1 0.856 0.006 . 1 . . . . 12 ILE HG2 . 6755 1 89 . 1 1 34 34 ILE HG22 H 1 0.856 0.006 . 1 . . . . 12 ILE HG2 . 6755 1 90 . 1 1 34 34 ILE HG23 H 1 0.856 0.006 . 1 . . . . 12 ILE HG2 . 6755 1 91 . 1 1 34 34 ILE HD11 H 1 0.797 0.006 . 1 . . . . 12 ILE HD1 . 6755 1 92 . 1 1 34 34 ILE HD12 H 1 0.797 0.006 . 1 . . . . 12 ILE HD1 . 6755 1 93 . 1 1 34 34 ILE HD13 H 1 0.797 0.006 . 1 . . . . 12 ILE HD1 . 6755 1 94 . 1 1 34 34 ILE CA C 13 61.854 0.3 . 1 . . . . 12 ILE CA . 6755 1 95 . 1 1 34 34 ILE CB C 13 38.81 0.3 . 1 . . . . 12 ILE CB . 6755 1 96 . 1 1 34 34 ILE CG2 C 13 17.51 0.3 . 1 . . . . 12 ILE CG2 . 6755 1 97 . 1 1 34 34 ILE CD1 C 13 13.06 0.3 . 1 . . . . 12 ILE CD1 . 6755 1 98 . 1 1 34 34 ILE N N 15 121.409 0.17 . 1 . . . . 12 ILE N . 6755 1 99 . 1 1 35 35 ASN H H 1 8.442 0.006 . 1 . . . . 13 ASN H . 6755 1 100 . 1 1 35 35 ASN HA H 1 4.662 0.006 . 1 . . . . 13 ASN HA . 6755 1 101 . 1 1 35 35 ASN HB2 H 1 2.89 0.006 . 1 . . . . 13 ASN HB2 . 6755 1 102 . 1 1 35 35 ASN HB3 H 1 2.771 0.006 . 1 . . . . 13 ASN HB3 . 6755 1 103 . 1 1 35 35 ASN CA C 13 53.899 0.3 . 1 . . . . 13 ASN CA . 6755 1 104 . 1 1 35 35 ASN CB C 13 38.37 0.3 . 1 . . . . 13 ASN CB . 6755 1 105 . 1 1 35 35 ASN N N 15 119.39 0.17 . 1 . . . . 13 ASN N . 6755 1 106 . 1 1 36 36 GLY HA2 H 1 4.11 0.006 . 1 . . . . 14 GLY HA2 . 6755 1 107 . 1 1 36 36 GLY HA3 H 1 3.678 0.006 . 1 . . . . 14 GLY HA3 . 6755 1 108 . 1 1 36 36 GLY CA C 13 44.905 0.3 . 1 . . . . 14 GLY CA . 6755 1 109 . 1 1 37 37 LEU H H 1 8.284 0.006 . 1 . . . . 15 LEU H . 6755 1 110 . 1 1 37 37 LEU HA H 1 4.392 0.006 . 1 . . . . 15 LEU HA . 6755 1 111 . 1 1 37 37 LEU HB2 H 1 1.685 0.006 . 1 . . . . 15 LEU HB2 . 6755 1 112 . 1 1 37 37 LEU HB3 H 1 1.546 0.006 . 1 . . . . 15 LEU HB3 . 6755 1 113 . 1 1 37 37 LEU HD11 H 1 0.757 0.006 . 1 . . . . 15 LEU HD1 . 6755 1 114 . 1 1 37 37 LEU HD12 H 1 0.757 0.006 . 1 . . . . 15 LEU HD1 . 6755 1 115 . 1 1 37 37 LEU HD13 H 1 0.757 0.006 . 1 . . . . 15 LEU HD1 . 6755 1 116 . 1 1 37 37 LEU HD21 H 1 0.687 0.006 . 1 . . . . 15 LEU HD2 . 6755 1 117 . 1 1 37 37 LEU HD22 H 1 0.687 0.006 . 1 . . . . 15 LEU HD2 . 6755 1 118 . 1 1 37 37 LEU HD23 H 1 0.687 0.006 . 1 . . . . 15 LEU HD2 . 6755 1 119 . 1 1 37 37 LEU CA C 13 54.78 0.3 . 1 . . . . 15 LEU CA . 6755 1 120 . 1 1 37 37 LEU CB C 13 41.594 0.3 . 1 . . . . 15 LEU CB . 6755 1 121 . 1 1 37 37 LEU CD1 C 13 25.073 0.3 . 1 . . . . 15 LEU CD1 . 6755 1 122 . 1 1 37 37 LEU CD2 C 13 23.464 0.3 . 1 . . . . 15 LEU CD2 . 6755 1 123 . 1 1 37 37 LEU N N 15 122.253 0.17 . 1 . . . . 15 LEU N . 6755 1 124 . 1 1 38 38 ASP H H 1 8.012 0.006 . 1 . . . . 16 ASP H . 6755 1 125 . 1 1 38 38 ASP HA H 1 4.766 0.006 . 1 . . . . 16 ASP HA . 6755 1 126 . 1 1 38 38 ASP HB2 H 1 2.907 0.006 . 1 . . . . 16 ASP HB2 . 6755 1 127 . 1 1 38 38 ASP HB3 H 1 2.614 0.006 . 1 . . . . 16 ASP HB3 . 6755 1 128 . 1 1 38 38 ASP CA C 13 52.901 0.3 . 1 . . . . 16 ASP CA . 6755 1 129 . 1 1 38 38 ASP CB C 13 41.075 0.3 . 1 . . . . 16 ASP CB . 6755 1 130 . 1 1 38 38 ASP N N 15 122.9 0.17 . 1 . . . . 16 ASP N . 6755 1 131 . 1 1 39 39 GLU H H 1 8.677 0.006 . 1 . . . . 17 GLU H . 6755 1 132 . 1 1 39 39 GLU HA H 1 3.58 0.006 . 1 . . . . 17 GLU HA . 6755 1 133 . 1 1 39 39 GLU HB2 H 1 2.158 0.006 . 1 . . . . 17 GLU HB2 . 6755 1 134 . 1 1 39 39 GLU HB3 H 1 2.043 0.006 . 1 . . . . 17 GLU HB3 . 6755 1 135 . 1 1 39 39 GLU HG2 H 1 2.238 0.006 . 1 . . . . 17 GLU HG . 6755 1 136 . 1 1 39 39 GLU HG3 H 1 2.238 0.006 . 1 . . . . 17 GLU HG . 6755 1 137 . 1 1 39 39 GLU CA C 13 59.323 0.3 . 1 . . . . 17 GLU CA . 6755 1 138 . 1 1 39 39 GLU CB C 13 29.88 0.3 . 1 . . . . 17 GLU CB . 6755 1 139 . 1 1 39 39 GLU CG C 13 36.87 0.3 . 1 . . . . 17 GLU CG . 6755 1 140 . 1 1 39 39 GLU N N 15 123.624 0.17 . 1 . . . . 17 GLU N . 6755 1 141 . 1 1 40 40 SER H H 1 8.274 0.006 . 1 . . . . 18 SER H . 6755 1 142 . 1 1 40 40 SER HA H 1 3.892 0.006 . 1 . . . . 18 SER HA . 6755 1 143 . 1 1 40 40 SER HB2 H 1 4.006 0.006 . 1 . . . . 18 SER HB . 6755 1 144 . 1 1 40 40 SER HB3 H 1 4.006 0.006 . 1 . . . . 18 SER HB . 6755 1 145 . 1 1 40 40 SER CA C 13 61.84 0.3 . 1 . . . . 18 SER CA . 6755 1 146 . 1 1 40 40 SER N N 15 114.835 0.17 . 1 . . . . 18 SER N . 6755 1 147 . 1 1 41 41 LEU H H 1 7.232 0.006 . 1 . . . . 19 LEU H . 6755 1 148 . 1 1 41 41 LEU HA H 1 3.786 0.006 . 1 . . . . 19 LEU HA . 6755 1 149 . 1 1 41 41 LEU HB2 H 1 1.859 0.006 . 1 . . . . 19 LEU HB2 . 6755 1 150 . 1 1 41 41 LEU HB3 H 1 1.611 0.006 . 1 . . . . 19 LEU HB3 . 6755 1 151 . 1 1 41 41 LEU HG H 1 1.326 0.006 . 1 . . . . 19 LEU HG . 6755 1 152 . 1 1 41 41 LEU HD11 H 1 1.079 0.006 . 1 . . . . 19 LEU HD1 . 6755 1 153 . 1 1 41 41 LEU HD12 H 1 1.079 0.006 . 1 . . . . 19 LEU HD1 . 6755 1 154 . 1 1 41 41 LEU HD13 H 1 1.079 0.006 . 1 . . . . 19 LEU HD1 . 6755 1 155 . 1 1 41 41 LEU HD21 H 1 0.786 0.006 . 1 . . . . 19 LEU HD2 . 6755 1 156 . 1 1 41 41 LEU HD22 H 1 0.786 0.006 . 1 . . . . 19 LEU HD2 . 6755 1 157 . 1 1 41 41 LEU HD23 H 1 0.786 0.006 . 1 . . . . 19 LEU HD2 . 6755 1 158 . 1 1 41 41 LEU CA C 13 57.48 0.3 . 1 . . . . 19 LEU CA . 6755 1 159 . 1 1 41 41 LEU CB C 13 41.669 0.3 . 1 . . . . 19 LEU CB . 6755 1 160 . 1 1 41 41 LEU CD1 C 13 26.105 0.3 . 1 . . . . 19 LEU CD1 . 6755 1 161 . 1 1 41 41 LEU CD2 C 13 23.138 0.3 . 1 . . . . 19 LEU CD2 . 6755 1 162 . 1 1 41 41 LEU N N 15 122.557 0.17 . 1 . . . . 19 LEU N . 6755 1 163 . 1 1 42 42 VAL H H 1 6.952 0.006 . 1 . . . . 20 VAL H . 6755 1 164 . 1 1 42 42 VAL HA H 1 3.17 0.006 . 1 . . . . 20 VAL HA . 6755 1 165 . 1 1 42 42 VAL HB H 1 1.386 0.006 . 1 . . . . 20 VAL HB . 6755 1 166 . 1 1 42 42 VAL HG11 H 1 0.341 0.006 . 1 . . . . 20 VAL HG1 . 6755 1 167 . 1 1 42 42 VAL HG12 H 1 0.341 0.006 . 1 . . . . 20 VAL HG1 . 6755 1 168 . 1 1 42 42 VAL HG13 H 1 0.341 0.006 . 1 . . . . 20 VAL HG1 . 6755 1 169 . 1 1 42 42 VAL HG21 H 1 0.198 0.006 . 1 . . . . 20 VAL HG2 . 6755 1 170 . 1 1 42 42 VAL HG22 H 1 0.198 0.006 . 1 . . . . 20 VAL HG2 . 6755 1 171 . 1 1 42 42 VAL HG23 H 1 0.198 0.006 . 1 . . . . 20 VAL HG2 . 6755 1 172 . 1 1 42 42 VAL CA C 13 66.467 0.3 . 1 . . . . 20 VAL CA . 6755 1 173 . 1 1 42 42 VAL CB C 13 30.912 0.3 . 1 . . . . 20 VAL CB . 6755 1 174 . 1 1 42 42 VAL CG1 C 13 21.567 0.3 . 1 . . . . 20 VAL CG1 . 6755 1 175 . 1 1 42 42 VAL CG2 C 13 22.274 0.3 . 1 . . . . 20 VAL CG2 . 6755 1 176 . 1 1 42 42 VAL N N 15 116.446 0.17 . 1 . . . . 20 VAL N . 6755 1 177 . 1 1 43 43 GLN H H 1 8.047 0.006 . 1 . . . . 21 GLN H . 6755 1 178 . 1 1 43 43 GLN HA H 1 3.82 0.006 . 1 . . . . 21 GLN HA . 6755 1 179 . 1 1 43 43 GLN HB2 H 1 1.971 0.006 . 1 . . . . 21 GLN HB . 6755 1 180 . 1 1 43 43 GLN HB3 H 1 1.971 0.006 . 1 . . . . 21 GLN HB . 6755 1 181 . 1 1 43 43 GLN HG2 H 1 2.277 0.006 . 1 . . . . 21 GLN HG2 . 6755 1 182 . 1 1 43 43 GLN HG3 H 1 2.148 0.006 . 1 . . . . 21 GLN HG3 . 6755 1 183 . 1 1 43 43 GLN CA C 13 58.671 0.3 . 1 . . . . 21 GLN CA . 6755 1 184 . 1 1 43 43 GLN CB C 13 27.312 0.3 . 1 . . . . 21 GLN CB . 6755 1 185 . 1 1 43 43 GLN CG C 13 36.16 0.3 . 1 . . . . 21 GLN CG . 6755 1 186 . 1 1 43 43 GLN N N 15 119.067 0.17 . 1 . . . . 21 GLN N . 6755 1 187 . 1 1 44 44 ALA H H 1 7.345 0.006 . 1 . . . . 22 ALA H . 6755 1 188 . 1 1 44 44 ALA HA H 1 3.147 0.006 . 1 . . . . 22 ALA HA . 6755 1 189 . 1 1 44 44 ALA HB1 H 1 0.774 0.006 . 1 . . . . 22 ALA HB . 6755 1 190 . 1 1 44 44 ALA HB2 H 1 0.774 0.006 . 1 . . . . 22 ALA HB . 6755 1 191 . 1 1 44 44 ALA HB3 H 1 0.774 0.006 . 1 . . . . 22 ALA HB . 6755 1 192 . 1 1 44 44 ALA CA C 13 54.443 0.3 . 1 . . . . 22 ALA CA . 6755 1 193 . 1 1 44 44 ALA CB C 13 18.194 0.3 . 1 . . . . 22 ALA CB . 6755 1 194 . 1 1 44 44 ALA N N 15 121.745 0.17 . 1 . . . . 22 ALA N . 6755 1 195 . 1 1 45 45 LEU H H 1 8.503 0.006 . 1 . . . . 23 LEU H . 6755 1 196 . 1 1 45 45 LEU HA H 1 3.429 0.006 . 1 . . . . 23 LEU HA . 6755 1 197 . 1 1 45 45 LEU HB2 H 1 1.285 0.006 . 1 . . . . 23 LEU HB2 . 6755 1 198 . 1 1 45 45 LEU HB3 H 1 0.794 0.006 . 1 . . . . 23 LEU HB3 . 6755 1 199 . 1 1 45 45 LEU HG H 1 1.225 0.006 . 1 . . . . 23 LEU HG . 6755 1 200 . 1 1 45 45 LEU HD11 H 1 0.054 0.006 . 1 . . . . 23 LEU HD1 . 6755 1 201 . 1 1 45 45 LEU HD12 H 1 0.054 0.006 . 1 . . . . 23 LEU HD1 . 6755 1 202 . 1 1 45 45 LEU HD13 H 1 0.054 0.006 . 1 . . . . 23 LEU HD1 . 6755 1 203 . 1 1 45 45 LEU HD21 H 1 0.031 0.006 . 1 . . . . 23 LEU HD2 . 6755 1 204 . 1 1 45 45 LEU HD22 H 1 0.031 0.006 . 1 . . . . 23 LEU HD2 . 6755 1 205 . 1 1 45 45 LEU HD23 H 1 0.031 0.006 . 1 . . . . 23 LEU HD2 . 6755 1 206 . 1 1 45 45 LEU CA C 13 58.046 0.3 . 1 . . . . 23 LEU CA . 6755 1 207 . 1 1 45 45 LEU CB C 13 42.232 0.3 . 1 . . . . 23 LEU CB . 6755 1 208 . 1 1 45 45 LEU CG C 13 25.94 0.3 . 1 . . . . 23 LEU CG . 6755 1 209 . 1 1 45 45 LEU CD1 C 13 25.335 0.3 . 1 . . . . 23 LEU CD1 . 6755 1 210 . 1 1 45 45 LEU CD2 C 13 24.072 0.3 . 1 . . . . 23 LEU CD2 . 6755 1 211 . 1 1 45 45 LEU N N 15 118.125 0.17 . 1 . . . . 23 LEU N . 6755 1 212 . 1 1 46 46 ALA H H 1 8.517 0.006 . 1 . . . . 24 ALA H . 6755 1 213 . 1 1 46 46 ALA HA H 1 3.94 0.006 . 1 . . . . 24 ALA HA . 6755 1 214 . 1 1 46 46 ALA HB1 H 1 1.006 0.006 . 1 . . . . 24 ALA HB . 6755 1 215 . 1 1 46 46 ALA HB2 H 1 1.006 0.006 . 1 . . . . 24 ALA HB . 6755 1 216 . 1 1 46 46 ALA HB3 H 1 1.006 0.006 . 1 . . . . 24 ALA HB . 6755 1 217 . 1 1 46 46 ALA CA C 13 55.77 0.3 . 1 . . . . 24 ALA CA . 6755 1 218 . 1 1 46 46 ALA CB C 13 19.663 0.3 . 1 . . . . 24 ALA CB . 6755 1 219 . 1 1 46 46 ALA N N 15 121.808 0.17 . 1 . . . . 24 ALA N . 6755 1 220 . 1 1 47 47 GLY HA2 H 1 3.886 0.006 . 1 . . . . 25 GLY HA2 . 6755 1 221 . 1 1 47 47 GLY HA3 H 1 3.65 0.006 . 1 . . . . 25 GLY HA3 . 6755 1 222 . 1 1 47 47 GLY CA C 13 47.68 0.3 . 1 . . . . 25 GLY CA . 6755 1 223 . 1 1 48 48 VAL H H 1 9.137 0.006 . 1 . . . . 26 VAL H . 6755 1 224 . 1 1 48 48 VAL HA H 1 3.416 0.006 . 1 . . . . 26 VAL HA . 6755 1 225 . 1 1 48 48 VAL HB H 1 1.91 0.006 . 1 . . . . 26 VAL HB . 6755 1 226 . 1 1 48 48 VAL HG11 H 1 0.911 0.006 . 1 . . . . 26 VAL HG1 . 6755 1 227 . 1 1 48 48 VAL HG12 H 1 0.911 0.006 . 1 . . . . 26 VAL HG1 . 6755 1 228 . 1 1 48 48 VAL HG13 H 1 0.911 0.006 . 1 . . . . 26 VAL HG1 . 6755 1 229 . 1 1 48 48 VAL HG21 H 1 0.707 0.006 . 1 . . . . 26 VAL HG2 . 6755 1 230 . 1 1 48 48 VAL HG22 H 1 0.707 0.006 . 1 . . . . 26 VAL HG2 . 6755 1 231 . 1 1 48 48 VAL HG23 H 1 0.707 0.006 . 1 . . . . 26 VAL HG2 . 6755 1 232 . 1 1 48 48 VAL CA C 13 66.754 0.3 . 1 . . . . 26 VAL CA . 6755 1 233 . 1 1 48 48 VAL CB C 13 30.948 0.3 . 1 . . . . 26 VAL CB . 6755 1 234 . 1 1 48 48 VAL CG1 C 13 23.861 0.3 . 1 . . . . 26 VAL CG1 . 6755 1 235 . 1 1 48 48 VAL CG2 C 13 21.18 0.3 . 1 . . . . 26 VAL CG2 . 6755 1 236 . 1 1 48 48 VAL N N 15 122.308 0.17 . 1 . . . . 26 VAL N . 6755 1 237 . 1 1 49 49 THR H H 1 7.236 0.006 . 1 . . . . 27 THR H . 6755 1 238 . 1 1 49 49 THR HA H 1 4.234 0.006 . 1 . . . . 27 THR HA . 6755 1 239 . 1 1 49 49 THR HB H 1 3.952 0.006 . 1 . . . . 27 THR HB . 6755 1 240 . 1 1 49 49 THR CA C 13 68.599 0.3 . 1 . . . . 27 THR CA . 6755 1 241 . 1 1 49 49 THR CB C 13 68.19 0.3 . 1 . . . . 27 THR CB . 6755 1 242 . 1 1 49 49 THR N N 15 114.372 0.17 . 1 . . . . 27 THR N . 6755 1 243 . 1 1 50 50 ALA H H 1 8.25 0.006 . 1 . . . . 28 ALA H . 6755 1 244 . 1 1 50 50 ALA HA H 1 3.907 0.006 . 1 . . . . 28 ALA HA . 6755 1 245 . 1 1 50 50 ALA HB1 H 1 1.444 0.006 . 1 . . . . 28 ALA HB . 6755 1 246 . 1 1 50 50 ALA HB2 H 1 1.444 0.006 . 1 . . . . 28 ALA HB . 6755 1 247 . 1 1 50 50 ALA HB3 H 1 1.444 0.006 . 1 . . . . 28 ALA HB . 6755 1 248 . 1 1 50 50 ALA CA C 13 56.172 0.3 . 1 . . . . 28 ALA CA . 6755 1 249 . 1 1 50 50 ALA CB C 13 18.372 0.3 . 1 . . . . 28 ALA CB . 6755 1 250 . 1 1 50 50 ALA N N 15 120.643 0.17 . 1 . . . . 28 ALA N . 6755 1 251 . 1 1 51 51 SER H H 1 7.687 0.006 . 1 . . . . 29 SER H . 6755 1 252 . 1 1 51 51 SER HA H 1 4.197 0.006 . 1 . . . . 29 SER HA . 6755 1 253 . 1 1 51 51 SER HB2 H 1 3.925 0.006 . 1 . . . . 29 SER HB . 6755 1 254 . 1 1 51 51 SER HB3 H 1 3.925 0.006 . 1 . . . . 29 SER HB . 6755 1 255 . 1 1 51 51 SER CA C 13 60.813 0.3 . 1 . . . . 29 SER CA . 6755 1 256 . 1 1 51 51 SER CB C 13 63.649 0.3 . 1 . . . . 29 SER CB . 6755 1 257 . 1 1 51 51 SER N N 15 112.175 0.17 . 1 . . . . 29 SER N . 6755 1 258 . 1 1 52 52 ASP H H 1 7.442 0.006 . 1 . . . . 30 ASP H . 6755 1 259 . 1 1 52 52 ASP HA H 1 4.431 0.006 . 1 . . . . 30 ASP HA . 6755 1 260 . 1 1 52 52 ASP HB2 H 1 2.804 0.006 . 1 . . . . 30 ASP HB2 . 6755 1 261 . 1 1 52 52 ASP HB3 H 1 1.905 0.006 . 1 . . . . 30 ASP HB3 . 6755 1 262 . 1 1 52 52 ASP CA C 13 55.66 0.3 . 1 . . . . 30 ASP CA . 6755 1 263 . 1 1 52 52 ASP CB C 13 41.963 0.3 . 1 . . . . 30 ASP CB . 6755 1 264 . 1 1 52 52 ASP N N 15 121.599 0.17 . 1 . . . . 30 ASP N . 6755 1 265 . 1 1 53 53 PHE H H 1 7.124 0.006 . 1 . . . . 31 PHE H . 6755 1 266 . 1 1 53 53 PHE HA H 1 4.125 0.006 . 1 . . . . 31 PHE HA . 6755 1 267 . 1 1 53 53 PHE HB2 H 1 3.071 0.006 . 1 . . . . 31 PHE HB . 6755 1 268 . 1 1 53 53 PHE HB3 H 1 3.071 0.006 . 1 . . . . 31 PHE HB . 6755 1 269 . 1 1 53 53 PHE HD1 H 1 6.871 0.006 . 1 . . . . 31 PHE HD . 6755 1 270 . 1 1 53 53 PHE HD2 H 1 6.871 0.006 . 1 . . . . 31 PHE HD . 6755 1 271 . 1 1 53 53 PHE HE1 H 1 6.673 0.006 . 1 . . . . 31 PHE QE . 6755 1 272 . 1 1 53 53 PHE HE2 H 1 6.673 0.006 . 1 . . . . 31 PHE QE . 6755 1 273 . 1 1 53 53 PHE CA C 13 55.844 0.3 . 1 . . . . 31 PHE CA . 6755 1 274 . 1 1 53 53 PHE CB C 13 40.07 0.3 . 1 . . . . 31 PHE CB . 6755 1 275 . 1 1 53 53 PHE N N 15 115.311 0.17 . 1 . . . . 31 PHE N . 6755 1 276 . 1 1 54 54 PRO HA H 1 4.459 0.006 . 1 . . . . 32 PRO HA . 6755 1 277 . 1 1 54 54 PRO HB2 H 1 2.389 0.006 . 1 . . . . 32 PRO HB2 . 6755 1 278 . 1 1 54 54 PRO HB3 H 1 1.919 0.006 . 1 . . . . 32 PRO HB3 . 6755 1 279 . 1 1 54 54 PRO HG2 H 1 1.997 0.006 . 1 . . . . 32 PRO HG2 . 6755 1 280 . 1 1 54 54 PRO HG3 H 1 1.881 0.006 . 1 . . . . 32 PRO HG3 . 6755 1 281 . 1 1 54 54 PRO HD2 H 1 3.617 0.006 . 1 . . . . 32 PRO HD2 . 6755 1 282 . 1 1 54 54 PRO HD3 H 1 3.491 0.006 . 1 . . . . 32 PRO HD3 . 6755 1 283 . 1 1 54 54 PRO CA C 13 65.33 0.3 . 1 . . . . 32 PRO CA . 6755 1 284 . 1 1 54 54 PRO CB C 13 31.74 0.3 . 1 . . . . 32 PRO CB . 6755 1 285 . 1 1 55 55 ASP H H 1 8.962 0.006 . 1 . . . . 33 ASP H . 6755 1 286 . 1 1 55 55 ASP HA H 1 4.508 0.006 . 1 . . . . 33 ASP HA . 6755 1 287 . 1 1 55 55 ASP HB2 H 1 2.717 0.006 . 1 . . . . 33 ASP HB2 . 6755 1 288 . 1 1 55 55 ASP HB3 H 1 2.644 0.006 . 1 . . . . 33 ASP HB3 . 6755 1 289 . 1 1 55 55 ASP CA C 13 55.08 0.3 . 1 . . . . 33 ASP CA . 6755 1 290 . 1 1 55 55 ASP CB C 13 39.79 0.3 . 1 . . . . 33 ASP CB . 6755 1 291 . 1 1 55 55 ASP N N 15 115.056 0.17 . 1 . . . . 33 ASP N . 6755 1 292 . 1 1 56 56 LEU H H 1 7.483 0.006 . 1 . . . . 34 LEU H . 6755 1 293 . 1 1 56 56 LEU HA H 1 4.266 0.006 . 1 . . . . 34 LEU HA . 6755 1 294 . 1 1 56 56 LEU HB2 H 1 1.811 0.006 . 1 . . . . 34 LEU HB2 . 6755 1 295 . 1 1 56 56 LEU HB3 H 1 1.316 0.006 . 1 . . . . 34 LEU HB3 . 6755 1 296 . 1 1 56 56 LEU HG H 1 1.577 0.006 . 1 . . . . 34 LEU HG . 6755 1 297 . 1 1 56 56 LEU CA C 13 55.25 0.3 . 1 . . . . 34 LEU CA . 6755 1 298 . 1 1 56 56 LEU CB C 13 41.81 0.3 . 1 . . . . 34 LEU CB . 6755 1 299 . 1 1 56 56 LEU CG C 13 29.13 0.3 . 1 . . . . 34 LEU CG . 6755 1 300 . 1 1 56 56 LEU CD1 C 13 24.676 0.3 . 1 . . . . 34 LEU CD1 . 6755 1 301 . 1 1 56 56 LEU N N 15 116.257 0.17 . 1 . . . . 34 LEU N . 6755 1 302 . 1 1 56 56 LEU HD11 H 1 1.264 0.006 . 1 . . . . 34 LEU QHD . 6755 1 303 . 1 1 56 56 LEU HD12 H 1 1.264 0.006 . 1 . . . . 34 LEU QHD . 6755 1 304 . 1 1 56 56 LEU HD13 H 1 1.264 0.006 . 1 . . . . 34 LEU QHD . 6755 1 305 . 1 1 57 57 ASP H H 1 7.716 0.006 . 1 . . . . 35 ASP H . 6755 1 306 . 1 1 57 57 ASP HA H 1 4.339 0.006 . 1 . . . . 35 ASP HA . 6755 1 307 . 1 1 57 57 ASP HB2 H 1 2.963 0.006 . 1 . . . . 35 ASP HB2 . 6755 1 308 . 1 1 57 57 ASP HB3 H 1 2.427 0.006 . 1 . . . . 35 ASP HB3 . 6755 1 309 . 1 1 57 57 ASP CA C 13 55.454 0.3 . 1 . . . . 35 ASP CA . 6755 1 310 . 1 1 57 57 ASP CB C 13 39.404 0.3 . 1 . . . . 35 ASP CB . 6755 1 311 . 1 1 57 57 ASP N N 15 120.521 0.17 . 1 . . . . 35 ASP N . 6755 1 312 . 1 1 58 58 ILE H H 1 8.767 0.006 . 1 . . . . 36 ILE H . 6755 1 313 . 1 1 58 58 ILE HA H 1 4.329 0.006 . 1 . . . . 36 ILE HA . 6755 1 314 . 1 1 58 58 ILE HB H 1 1.848 0.006 . 1 . . . . 36 ILE HB . 6755 1 315 . 1 1 58 58 ILE HG12 H 1 0.763 0.006 . 1 . . . . 36 ILE HG1 . 6755 1 316 . 1 1 58 58 ILE HG13 H 1 0.763 0.006 . 1 . . . . 36 ILE HG1 . 6755 1 317 . 1 1 58 58 ILE HG21 H 1 1.074 0.006 . 1 . . . . 36 ILE HG2 . 6755 1 318 . 1 1 58 58 ILE HG22 H 1 1.074 0.006 . 1 . . . . 36 ILE HG2 . 6755 1 319 . 1 1 58 58 ILE HG23 H 1 1.074 0.006 . 1 . . . . 36 ILE HG2 . 6755 1 320 . 1 1 58 58 ILE HD11 H 1 0.867 0.006 . 1 . . . . 36 ILE HD1 . 6755 1 321 . 1 1 58 58 ILE HD12 H 1 0.867 0.006 . 1 . . . . 36 ILE HD1 . 6755 1 322 . 1 1 58 58 ILE HD13 H 1 0.867 0.006 . 1 . . . . 36 ILE HD1 . 6755 1 323 . 1 1 58 58 ILE CA C 13 62.62 0.3 . 1 . . . . 36 ILE CA . 6755 1 324 . 1 1 58 58 ILE CB C 13 39.43 0.3 . 1 . . . . 36 ILE CB . 6755 1 325 . 1 1 58 58 ILE CG1 C 13 29.79 0.3 . 1 . . . . 36 ILE CG1 . 6755 1 326 . 1 1 58 58 ILE CG2 C 13 19.504 0.3 . 1 . . . . 36 ILE CG2 . 6755 1 327 . 1 1 58 58 ILE CD1 C 13 14.346 0.3 . 1 . . . . 36 ILE CD1 . 6755 1 328 . 1 1 58 58 ILE N N 15 118.636 0.17 . 1 . . . . 36 ILE N . 6755 1 329 . 1 1 59 59 LYS H H 1 8.889 0.006 . 1 . . . . 37 LYS H . 6755 1 330 . 1 1 59 59 LYS HA H 1 4.825 0.006 . 1 . . . . 37 LYS HA . 6755 1 331 . 1 1 59 59 LYS HB2 H 1 2.131 0.006 . 1 . . . . 37 LYS HB2 . 6755 1 332 . 1 1 59 59 LYS HB3 H 1 2.028 0.006 . 1 . . . . 37 LYS HB3 . 6755 1 333 . 1 1 59 59 LYS HG2 H 1 1.626 0.006 . 1 . . . . 37 LYS HG2 . 6755 1 334 . 1 1 59 59 LYS HG3 H 1 1.562 0.006 . 1 . . . . 37 LYS HG3 . 6755 1 335 . 1 1 59 59 LYS HD2 H 1 1.809 0.006 . 1 . . . . 37 LYS HD2 . 6755 1 336 . 1 1 59 59 LYS HD3 H 1 1.737 0.006 . 1 . . . . 37 LYS HD3 . 6755 1 337 . 1 1 59 59 LYS HE2 H 1 3.001 0.006 . 1 . . . . 37 LYS QE . 6755 1 338 . 1 1 59 59 LYS HE3 H 1 3.001 0.006 . 1 . . . . 37 LYS QE . 6755 1 339 . 1 1 59 59 LYS CA C 13 55.181 0.3 . 1 . . . . 37 LYS CA . 6755 1 340 . 1 1 59 59 LYS CB C 13 34.55 0.3 . 1 . . . . 37 LYS CB . 6755 1 341 . 1 1 59 59 LYS CG C 13 25.04 0.3 . 1 . . . . 37 LYS CG . 6755 1 342 . 1 1 59 59 LYS CD C 13 28.823 0.3 . 1 . . . . 37 LYS CD . 6755 1 343 . 1 1 59 59 LYS CE C 13 42.49 0.3 . 1 . . . . 37 LYS CE . 6755 1 344 . 1 1 59 59 LYS N N 15 128.448 0.17 . 1 . . . . 37 LYS N . 6755 1 345 . 1 1 60 60 TYR H H 1 8.342 0.006 . 1 . . . . 38 TYR H . 6755 1 346 . 1 1 60 60 TYR HA H 1 4.363 0.006 . 1 . . . . 38 TYR HA . 6755 1 347 . 1 1 60 60 TYR HB2 H 1 2.553 0.006 . 1 . . . . 38 TYR HB2 . 6755 1 348 . 1 1 60 60 TYR HB3 H 1 2.525 0.006 . 1 . . . . 38 TYR HB3 . 6755 1 349 . 1 1 60 60 TYR HD1 H 1 6.456 0.006 . 1 . . . . 38 TYR HD . 6755 1 350 . 1 1 60 60 TYR HD2 H 1 6.456 0.006 . 1 . . . . 38 TYR HD . 6755 1 351 . 1 1 60 60 TYR CA C 13 55.33 0.3 . 1 . . . . 38 TYR CA . 6755 1 352 . 1 1 60 60 TYR CB C 13 43.335 0.3 . 1 . . . . 38 TYR CB . 6755 1 353 . 1 1 60 60 TYR N N 15 118.359 0.17 . 1 . . . . 38 TYR N . 6755 1 354 . 1 1 61 61 ASN H H 1 8.284 0.006 . 1 . . . . 39 ASN H . 6755 1 355 . 1 1 61 61 ASN HA H 1 4.447 0.006 . 1 . . . . 39 ASN HA . 6755 1 356 . 1 1 61 61 ASN HB2 H 1 1.601 0.006 . 1 . . . . 39 ASN HB2 . 6755 1 357 . 1 1 61 61 ASN HB3 H 1 1.379 0.006 . 1 . . . . 39 ASN HB3 . 6755 1 358 . 1 1 61 61 ASN CA C 13 52.71 0.3 . 1 . . . . 39 ASN CA . 6755 1 359 . 1 1 61 61 ASN CB C 13 44.068 0.3 . 1 . . . . 39 ASN CB . 6755 1 360 . 1 1 61 61 ASN N N 15 116.267 0.17 . 1 . . . . 39 ASN N . 6755 1 361 . 1 1 62 62 ILE H H 1 9.162 0.006 . 1 . . . . 40 ILE H . 6755 1 362 . 1 1 62 62 ILE HA H 1 4.386 0.006 . 1 . . . . 40 ILE HA . 6755 1 363 . 1 1 62 62 ILE HB H 1 1.318 0.006 . 1 . . . . 40 ILE HB . 6755 1 364 . 1 1 62 62 ILE HG12 H 1 0.647 0.006 . 1 . . . . 40 ILE HG1 . 6755 1 365 . 1 1 62 62 ILE HG13 H 1 0.647 0.006 . 1 . . . . 40 ILE HG1 . 6755 1 366 . 1 1 62 62 ILE HG21 H 1 0.729 0.006 . 1 . . . . 40 ILE HG2 . 6755 1 367 . 1 1 62 62 ILE HG22 H 1 0.729 0.006 . 1 . . . . 40 ILE HG2 . 6755 1 368 . 1 1 62 62 ILE HG23 H 1 0.729 0.006 . 1 . . . . 40 ILE HG2 . 6755 1 369 . 1 1 62 62 ILE HD11 H 1 0.66 0.006 . 1 . . . . 40 ILE HD1 . 6755 1 370 . 1 1 62 62 ILE HD12 H 1 0.66 0.006 . 1 . . . . 40 ILE HD1 . 6755 1 371 . 1 1 62 62 ILE HD13 H 1 0.66 0.006 . 1 . . . . 40 ILE HD1 . 6755 1 372 . 1 1 62 62 ILE CA C 13 61.025 0.3 . 1 . . . . 40 ILE CA . 6755 1 373 . 1 1 62 62 ILE CB C 13 40.92 0.3 . 1 . . . . 40 ILE CB . 6755 1 374 . 1 1 62 62 ILE CG1 C 13 27.6 0.3 . 1 . . . . 40 ILE CG1 . 6755 1 375 . 1 1 62 62 ILE CG2 C 13 19.631 0.3 . 1 . . . . 40 ILE CG2 . 6755 1 376 . 1 1 62 62 ILE CD1 C 13 14.209 0.3 . 1 . . . . 40 ILE CD1 . 6755 1 377 . 1 1 62 62 ILE N N 15 120.557 0.17 . 1 . . . . 40 ILE N . 6755 1 378 . 1 1 63 63 PHE H H 1 8.904 0.006 . 1 . . . . 41 PHE H . 6755 1 379 . 1 1 63 63 PHE HA H 1 5.316 0.006 . 1 . . . . 41 PHE HA . 6755 1 380 . 1 1 63 63 PHE HB2 H 1 2.718 0.006 . 1 . . . . 41 PHE HB2 . 6755 1 381 . 1 1 63 63 PHE HB3 H 1 2.63 0.006 . 1 . . . . 41 PHE HB3 . 6755 1 382 . 1 1 63 63 PHE HD1 H 1 7.02 0.006 . 1 . . . . 41 PHE HD . 6755 1 383 . 1 1 63 63 PHE HD2 H 1 7.02 0.006 . 1 . . . . 41 PHE HD . 6755 1 384 . 1 1 63 63 PHE HE1 H 1 6.824 0.006 . 1 . . . . 41 PHE QE . 6755 1 385 . 1 1 63 63 PHE HE2 H 1 6.824 0.006 . 1 . . . . 41 PHE QE . 6755 1 386 . 1 1 63 63 PHE CA C 13 55.038 0.3 . 1 . . . . 41 PHE CA . 6755 1 387 . 1 1 63 63 PHE CB C 13 41.14 0.3 . 1 . . . . 41 PHE CB . 6755 1 388 . 1 1 63 63 PHE N N 15 123.947 0.17 . 1 . . . . 41 PHE N . 6755 1 389 . 1 1 64 64 LEU H H 1 8.623 0.006 . 1 . . . . 42 LEU H . 6755 1 390 . 1 1 64 64 LEU HA H 1 4.398 0.006 . 1 . . . . 42 LEU HA . 6755 1 391 . 1 1 64 64 LEU HB2 H 1 1.392 0.006 . 1 . . . . 42 LEU HB . 6755 1 392 . 1 1 64 64 LEU HB3 H 1 1.392 0.006 . 1 . . . . 42 LEU HB . 6755 1 393 . 1 1 64 64 LEU HG H 1 1.558 0.006 . 1 . . . . 42 LEU HG . 6755 1 394 . 1 1 64 64 LEU HD11 H 1 0.76 0.006 . 1 . . . . 42 LEU HD1 . 6755 1 395 . 1 1 64 64 LEU HD12 H 1 0.76 0.006 . 1 . . . . 42 LEU HD1 . 6755 1 396 . 1 1 64 64 LEU HD13 H 1 0.76 0.006 . 1 . . . . 42 LEU HD1 . 6755 1 397 . 1 1 64 64 LEU HD21 H 1 0.704 0.006 . 1 . . . . 42 LEU HD2 . 6755 1 398 . 1 1 64 64 LEU HD22 H 1 0.704 0.006 . 1 . . . . 42 LEU HD2 . 6755 1 399 . 1 1 64 64 LEU HD23 H 1 0.704 0.006 . 1 . . . . 42 LEU HD2 . 6755 1 400 . 1 1 64 64 LEU CA C 13 54.38 0.3 . 1 . . . . 42 LEU CA . 6755 1 401 . 1 1 64 64 LEU CB C 13 42.72 0.3 . 1 . . . . 42 LEU CB . 6755 1 402 . 1 1 64 64 LEU CG C 13 26.945 0.3 . 1 . . . . 42 LEU CG . 6755 1 403 . 1 1 64 64 LEU CD1 C 13 25.34 0.3 . 1 . . . . 42 LEU CD1 . 6755 1 404 . 1 1 64 64 LEU CD2 C 13 23.5 0.3 . 1 . . . . 42 LEU CD2 . 6755 1 405 . 1 1 64 64 LEU N N 15 127.025 0.17 . 1 . . . . 42 LEU N . 6755 1 406 . 1 1 65 65 VAL H H 1 8.814 0.006 . 1 . . . . 43 VAL H . 6755 1 407 . 1 1 65 65 VAL HA H 1 4.043 0.006 . 1 . . . . 43 VAL HA . 6755 1 408 . 1 1 65 65 VAL HB H 1 1.172 0.006 . 1 . . . . 43 VAL HB . 6755 1 409 . 1 1 65 65 VAL HG11 H 1 0.563 0.006 . 1 . . . . 43 VAL HG1 . 6755 1 410 . 1 1 65 65 VAL HG12 H 1 0.563 0.006 . 1 . . . . 43 VAL HG1 . 6755 1 411 . 1 1 65 65 VAL HG13 H 1 0.563 0.006 . 1 . . . . 43 VAL HG1 . 6755 1 412 . 1 1 65 65 VAL HG21 H 1 0.402 0.006 . 1 . . . . 43 VAL HG2 . 6755 1 413 . 1 1 65 65 VAL HG22 H 1 0.402 0.006 . 1 . . . . 43 VAL HG2 . 6755 1 414 . 1 1 65 65 VAL HG23 H 1 0.402 0.006 . 1 . . . . 43 VAL HG2 . 6755 1 415 . 1 1 65 65 VAL CA C 13 61.69 0.3 . 1 . . . . 43 VAL CA . 6755 1 416 . 1 1 65 65 VAL CB C 13 32.314 0.3 . 1 . . . . 43 VAL CB . 6755 1 417 . 1 1 65 65 VAL CG1 C 13 21.862 0.3 . 1 . . . . 43 VAL CG1 . 6755 1 418 . 1 1 65 65 VAL CG2 C 13 20.531 0.3 . 1 . . . . 43 VAL CG2 . 6755 1 419 . 1 1 65 65 VAL N N 15 128.207 0.17 . 1 . . . . 43 VAL N . 6755 1 420 . 1 1 66 66 ASP H H 1 7.895 0.006 . 1 . . . . 44 ASP H . 6755 1 421 . 1 1 66 66 ASP HA H 1 5.05 0.006 . 1 . . . . 44 ASP HA . 6755 1 422 . 1 1 66 66 ASP HB2 H 1 2.571 0.006 . 1 . . . . 44 ASP HB2 . 6755 1 423 . 1 1 66 66 ASP HB3 H 1 2.06 0.006 . 1 . . . . 44 ASP HB3 . 6755 1 424 . 1 1 66 66 ASP CA C 13 52.098 0.3 . 1 . . . . 44 ASP CA . 6755 1 425 . 1 1 66 66 ASP CB C 13 41.693 0.3 . 1 . . . . 44 ASP CB . 6755 1 426 . 1 1 66 66 ASP N N 15 125.56 0.17 . 1 . . . . 44 ASP N . 6755 1 427 . 1 1 67 67 LEU H H 1 7.931 0.006 . 1 . . . . 45 LEU H . 6755 1 428 . 1 1 67 67 LEU HA H 1 4.306 0.006 . 1 . . . . 45 LEU HA . 6755 1 429 . 1 1 67 67 LEU HB2 H 1 1.157 0.006 . 1 . . . . 45 LEU HB2 . 6755 1 430 . 1 1 67 67 LEU HB3 H 1 0.904 0.006 . 1 . . . . 45 LEU HB3 . 6755 1 431 . 1 1 67 67 LEU HG H 1 0.46 0.006 . 1 . . . . 45 LEU HG . 6755 1 432 . 1 1 67 67 LEU CA C 13 53.802 0.3 . 1 . . . . 45 LEU CA . 6755 1 433 . 1 1 67 67 LEU CB C 13 45.889 0.3 . 1 . . . . 45 LEU CB . 6755 1 434 . 1 1 67 67 LEU CG C 13 24.002 0.3 . 1 . . . . 45 LEU CG . 6755 1 435 . 1 1 67 67 LEU CD2 C 13 24.152 0.3 . 1 . . . . 45 LEU CD2 . 6755 1 436 . 1 1 67 67 LEU N N 15 122.218 0.17 . 1 . . . . 45 LEU N . 6755 1 437 . 1 1 68 68 TYR H H 1 8.811 0.006 . 1 . . . . 46 TYR H . 6755 1 438 . 1 1 68 68 TYR HA H 1 4.266 0.006 . 1 . . . . 46 TYR HA . 6755 1 439 . 1 1 68 68 TYR HB2 H 1 3.232 0.006 . 1 . . . . 46 TYR HB2 . 6755 1 440 . 1 1 68 68 TYR HB3 H 1 3.048 0.006 . 1 . . . . 46 TYR HB3 . 6755 1 441 . 1 1 68 68 TYR HD1 H 1 6.995 0.006 . 1 . . . . 46 TYR HD . 6755 1 442 . 1 1 68 68 TYR HD2 H 1 6.995 0.006 . 1 . . . . 46 TYR HD . 6755 1 443 . 1 1 68 68 TYR HE1 H 1 6.759 0.006 . 1 . . . . 46 TYR QE . 6755 1 444 . 1 1 68 68 TYR HE2 H 1 6.759 0.006 . 1 . . . . 46 TYR QE . 6755 1 445 . 1 1 68 68 TYR CA C 13 57.546 0.3 . 1 . . . . 46 TYR CA . 6755 1 446 . 1 1 68 68 TYR CB C 13 35.663 0.3 . 1 . . . . 46 TYR CB . 6755 1 447 . 1 1 68 68 TYR N N 15 120.83 0.17 . 1 . . . . 46 TYR N . 6755 1 448 . 1 1 69 69 GLY HA2 H 1 4.136 0.006 . 1 . . . . 47 GLY HA2 . 6755 1 449 . 1 1 69 69 GLY HA3 H 1 3.636 0.006 . 1 . . . . 47 GLY HA3 . 6755 1 450 . 1 1 69 69 GLY CA C 13 45.5 0.3 . 1 . . . . 47 GLY CA . 6755 1 451 . 1 1 70 70 GLN H H 1 7.766 0.006 . 1 . . . . 48 GLN H . 6755 1 452 . 1 1 70 70 GLN HA H 1 4.545 0.006 . 1 . . . . 48 GLN HA . 6755 1 453 . 1 1 70 70 GLN HB2 H 1 2.076 0.006 . 1 . . . . 48 GLN HB . 6755 1 454 . 1 1 70 70 GLN HB3 H 1 2.076 0.006 . 1 . . . . 48 GLN HB . 6755 1 455 . 1 1 70 70 GLN HG2 H 1 2.279 0.006 . 1 . . . . 48 GLN HG . 6755 1 456 . 1 1 70 70 GLN HG3 H 1 2.279 0.006 . 1 . . . . 48 GLN HG . 6755 1 457 . 1 1 70 70 GLN CA C 13 55.039 0.3 . 1 . . . . 48 GLN CA . 6755 1 458 . 1 1 70 70 GLN CB C 13 31.332 0.3 . 1 . . . . 48 GLN CB . 6755 1 459 . 1 1 70 70 GLN CG C 13 33.81 0.3 . 1 . . . . 48 GLN CG . 6755 1 460 . 1 1 70 70 GLN N N 15 120.17 0.17 . 1 . . . . 48 GLN N . 6755 1 461 . 1 1 71 71 LYS H H 1 8.186 0.006 . 1 . . . . 49 LYS H . 6755 1 462 . 1 1 71 71 LYS HA H 1 5.55 0.006 . 1 . . . . 49 LYS HA . 6755 1 463 . 1 1 71 71 LYS HB2 H 1 1.528 0.006 . 1 . . . . 49 LYS HB2 . 6755 1 464 . 1 1 71 71 LYS HB3 H 1 1.394 0.006 . 1 . . . . 49 LYS HB3 . 6755 1 465 . 1 1 71 71 LYS HG2 H 1 1.238 0.006 . 1 . . . . 49 LYS HG2 . 6755 1 466 . 1 1 71 71 LYS HG3 H 1 1.077 0.006 . 1 . . . . 49 LYS HG3 . 6755 1 467 . 1 1 71 71 LYS HD2 H 1 1.436 0.006 . 1 . . . . 49 LYS HD . 6755 1 468 . 1 1 71 71 LYS HD3 H 1 1.436 0.006 . 1 . . . . 49 LYS HD . 6755 1 469 . 1 1 71 71 LYS HE2 H 1 2.751 0.006 . 1 . . . . 49 LYS QE . 6755 1 470 . 1 1 71 71 LYS HE3 H 1 2.751 0.006 . 1 . . . . 49 LYS QE . 6755 1 471 . 1 1 71 71 LYS CA C 13 54.794 0.3 . 1 . . . . 49 LYS CA . 6755 1 472 . 1 1 71 71 LYS CB C 13 35.352 0.3 . 1 . . . . 49 LYS CB . 6755 1 473 . 1 1 71 71 LYS CG C 13 25.378 0.3 . 1 . . . . 49 LYS CG . 6755 1 474 . 1 1 71 71 LYS CD C 13 30.03 0.3 . 1 . . . . 49 LYS CD . 6755 1 475 . 1 1 71 71 LYS CE C 13 42.039 0.3 . 1 . . . . 49 LYS CE . 6755 1 476 . 1 1 71 71 LYS N N 15 121.337 0.17 . 1 . . . . 49 LYS N . 6755 1 477 . 1 1 72 72 TYR H H 1 8.436 0.006 . 1 . . . . 50 TYR H . 6755 1 478 . 1 1 72 72 TYR HA H 1 4.675 0.006 . 1 . . . . 50 TYR HA . 6755 1 479 . 1 1 72 72 TYR HB2 H 1 3.086 0.006 . 1 . . . . 50 TYR HB2 . 6755 1 480 . 1 1 72 72 TYR HB3 H 1 2.886 0.006 . 1 . . . . 50 TYR HB3 . 6755 1 481 . 1 1 72 72 TYR HD1 H 1 7.168 0.006 . 1 . . . . 50 TYR HD . 6755 1 482 . 1 1 72 72 TYR HD2 H 1 7.168 0.006 . 1 . . . . 50 TYR HD . 6755 1 483 . 1 1 72 72 TYR HE1 H 1 6.851 0.006 . 1 . . . . 50 TYR QE . 6755 1 484 . 1 1 72 72 TYR HE2 H 1 6.851 0.006 . 1 . . . . 50 TYR QE . 6755 1 485 . 1 1 72 72 TYR CA C 13 56.349 0.3 . 1 . . . . 50 TYR CA . 6755 1 486 . 1 1 72 72 TYR CB C 13 39.44 0.3 . 1 . . . . 50 TYR CB . 6755 1 487 . 1 1 72 72 TYR N N 15 120.046 0.17 . 1 . . . . 50 TYR N . 6755 1 488 . 1 1 73 73 PHE H H 1 8.74 0.006 . 1 . . . . 51 PHE H . 6755 1 489 . 1 1 73 73 PHE HA H 1 5.602 0.006 . 1 . . . . 51 PHE HA . 6755 1 490 . 1 1 73 73 PHE HB2 H 1 3.152 0.006 . 1 . . . . 51 PHE HB2 . 6755 1 491 . 1 1 73 73 PHE HB3 H 1 2.771 0.006 . 1 . . . . 51 PHE HB3 . 6755 1 492 . 1 1 73 73 PHE HD1 H 1 7.174 0.006 . 1 . . . . 51 PHE HD . 6755 1 493 . 1 1 73 73 PHE HD2 H 1 7.174 0.006 . 1 . . . . 51 PHE HD . 6755 1 494 . 1 1 73 73 PHE HE1 H 1 7.026 0.006 . 1 . . . . 51 PHE QE . 6755 1 495 . 1 1 73 73 PHE HE2 H 1 7.026 0.006 . 1 . . . . 51 PHE QE . 6755 1 496 . 1 1 73 73 PHE CA C 13 57.344 0.3 . 1 . . . . 51 PHE CA . 6755 1 497 . 1 1 73 73 PHE CB C 13 41.86 0.3 . 1 . . . . 51 PHE CB . 6755 1 498 . 1 1 73 73 PHE N N 15 116.506 0.17 . 1 . . . . 51 PHE N . 6755 1 499 . 1 1 74 74 ARG H H 1 9.522 0.006 . 1 . . . . 52 ARG H . 6755 1 500 . 1 1 74 74 ARG HA H 1 5.068 0.006 . 1 . . . . 52 ARG HA . 6755 1 501 . 1 1 74 74 ARG HB2 H 1 1.497 0.006 . 1 . . . . 52 ARG HB2 . 6755 1 502 . 1 1 74 74 ARG HB3 H 1 1.36 0.006 . 1 . . . . 52 ARG HB3 . 6755 1 503 . 1 1 74 74 ARG HG2 H 1 1.512 0.006 . 1 . . . . 52 ARG HG . 6755 1 504 . 1 1 74 74 ARG HG3 H 1 1.512 0.006 . 1 . . . . 52 ARG HG . 6755 1 505 . 1 1 74 74 ARG HD2 H 1 3.003 0.006 . 1 . . . . 52 ARG HD2 . 6755 1 506 . 1 1 74 74 ARG HD3 H 1 2.93 0.006 . 1 . . . . 52 ARG HD3 . 6755 1 507 . 1 1 74 74 ARG CA C 13 55.58 0.3 . 1 . . . . 52 ARG CA . 6755 1 508 . 1 1 74 74 ARG CB C 13 33.32 0.3 . 1 . . . . 52 ARG CB . 6755 1 509 . 1 1 74 74 ARG CG C 13 28.26 0.3 . 1 . . . . 52 ARG CG . 6755 1 510 . 1 1 74 74 ARG CD C 13 43.97 0.3 . 1 . . . . 52 ARG CD . 6755 1 511 . 1 1 74 74 ARG N N 15 121.638 0.17 . 1 . . . . 52 ARG N . 6755 1 512 . 1 1 75 75 ILE H H 1 9.217 0.006 . 1 . . . . 53 ILE H . 6755 1 513 . 1 1 75 75 ILE HA H 1 4.408 0.006 . 1 . . . . 53 ILE HA . 6755 1 514 . 1 1 75 75 ILE HB H 1 1.508 0.006 . 1 . . . . 53 ILE HB . 6755 1 515 . 1 1 75 75 ILE HG12 H 1 1.428 0.006 . 1 . . . . 53 ILE HG1 . 6755 1 516 . 1 1 75 75 ILE HG13 H 1 1.428 0.006 . 1 . . . . 53 ILE HG1 . 6755 1 517 . 1 1 75 75 ILE HG21 H 1 0.096 0.006 . 1 . . . . 53 ILE HG2 . 6755 1 518 . 1 1 75 75 ILE HG22 H 1 0.096 0.006 . 1 . . . . 53 ILE HG2 . 6755 1 519 . 1 1 75 75 ILE HG23 H 1 0.096 0.006 . 1 . . . . 53 ILE HG2 . 6755 1 520 . 1 1 75 75 ILE HD11 H 1 0.13 0.006 . 1 . . . . 53 ILE HD1 . 6755 1 521 . 1 1 75 75 ILE HD12 H 1 0.13 0.006 . 1 . . . . 53 ILE HD1 . 6755 1 522 . 1 1 75 75 ILE HD13 H 1 0.13 0.006 . 1 . . . . 53 ILE HD1 . 6755 1 523 . 1 1 75 75 ILE CA C 13 61.08 0.3 . 1 . . . . 53 ILE CA . 6755 1 524 . 1 1 75 75 ILE CB C 13 39.88 0.3 . 1 . . . . 53 ILE CB . 6755 1 525 . 1 1 75 75 ILE CG1 C 13 28.67 0.3 . 1 . . . . 53 ILE CG1 . 6755 1 526 . 1 1 75 75 ILE CG2 C 13 20.279 0.3 . 1 . . . . 53 ILE CG2 . 6755 1 527 . 1 1 75 75 ILE CD1 C 13 16.824 0.3 . 1 . . . . 53 ILE CD1 . 6755 1 528 . 1 1 75 75 ILE N N 15 124.806 0.17 . 1 . . . . 53 ILE N . 6755 1 529 . 1 1 76 76 LEU H H 1 8.487 0.006 . 1 . . . . 54 LEU H . 6755 1 530 . 1 1 76 76 LEU HA H 1 4.926 0.006 . 1 . . . . 54 LEU HA . 6755 1 531 . 1 1 76 76 LEU HB2 H 1 1.329 0.006 . 1 . . . . 54 LEU HB . 6755 1 532 . 1 1 76 76 LEU HB3 H 1 1.329 0.006 . 1 . . . . 54 LEU HB . 6755 1 533 . 1 1 76 76 LEU CA C 13 55.432 0.3 . 1 . . . . 54 LEU CA . 6755 1 534 . 1 1 76 76 LEU CB C 13 44.2 0.3 . 1 . . . . 54 LEU CB . 6755 1 535 . 1 1 76 76 LEU CG C 13 25.046 0.3 . 1 . . . . 54 LEU CG . 6755 1 536 . 1 1 76 76 LEU CD1 C 13 23.069 0.3 . 1 . . . . 54 LEU CD1 . 6755 1 537 . 1 1 76 76 LEU N N 15 130.515 0.17 . 1 . . . . 54 LEU N . 6755 1 538 . 1 1 76 76 LEU HD11 H 1 0.484 0.006 . 1 . . . . 54 LEU QHD . 6755 1 539 . 1 1 76 76 LEU HD12 H 1 0.484 0.006 . 1 . . . . 54 LEU QHD . 6755 1 540 . 1 1 76 76 LEU HD13 H 1 0.484 0.006 . 1 . . . . 54 LEU QHD . 6755 1 541 . 1 1 77 77 PHE H H 1 9.448 0.006 . 1 . . . . 55 PHE H . 6755 1 542 . 1 1 77 77 PHE HA H 1 5.082 0.006 . 1 . . . . 55 PHE HA . 6755 1 543 . 1 1 77 77 PHE HB2 H 1 3.248 0.006 . 1 . . . . 55 PHE HB2 . 6755 1 544 . 1 1 77 77 PHE HB3 H 1 2.706 0.006 . 1 . . . . 55 PHE HB3 . 6755 1 545 . 1 1 77 77 PHE HD1 H 1 7.086 0.006 . 1 . . . . 55 PHE HD . 6755 1 546 . 1 1 77 77 PHE HD2 H 1 7.086 0.006 . 1 . . . . 55 PHE HD . 6755 1 547 . 1 1 77 77 PHE HE1 H 1 6.866 0.006 . 1 . . . . 55 PHE QE . 6755 1 548 . 1 1 77 77 PHE HE2 H 1 6.866 0.006 . 1 . . . . 55 PHE QE . 6755 1 549 . 1 1 77 77 PHE CA C 13 55.936 0.3 . 1 . . . . 55 PHE CA . 6755 1 550 . 1 1 77 77 PHE CB C 13 40.331 0.3 . 1 . . . . 55 PHE CB . 6755 1 551 . 1 1 77 77 PHE N N 15 120.773 0.17 . 1 . . . . 55 PHE N . 6755 1 552 . 1 1 78 78 GLN H H 1 9.956 0.006 . 1 . . . . 56 GLN H . 6755 1 553 . 1 1 78 78 GLN HA H 1 4.82 0.006 . 1 . . . . 56 GLN HA . 6755 1 554 . 1 1 78 78 GLN HB2 H 1 1.845 0.006 . 1 . . . . 56 GLN HB . 6755 1 555 . 1 1 78 78 GLN HB3 H 1 1.845 0.006 . 1 . . . . 56 GLN HB . 6755 1 556 . 1 1 78 78 GLN CA C 13 55.23 0.3 . 1 . . . . 56 GLN CA . 6755 1 557 . 1 1 78 78 GLN CB C 13 32.597 0.3 . 1 . . . . 56 GLN CB . 6755 1 558 . 1 1 78 78 GLN N N 15 125.746 0.17 . 1 . . . . 56 GLN N . 6755 1 559 . 1 1 79 79 SER H H 1 8.054 0.006 . 1 . . . . 57 SER H . 6755 1 560 . 1 1 79 79 SER HA H 1 4.069 0.006 . 1 . . . . 57 SER HA . 6755 1 561 . 1 1 79 79 SER HB2 H 1 3.925 0.006 . 1 . . . . 57 SER HB . 6755 1 562 . 1 1 79 79 SER HB3 H 1 3.925 0.006 . 1 . . . . 57 SER HB . 6755 1 563 . 1 1 79 79 SER CA C 13 57.479 0.3 . 1 . . . . 57 SER CA . 6755 1 564 . 1 1 79 79 SER CB C 13 64.359 0.3 . 1 . . . . 57 SER CB . 6755 1 565 . 1 1 79 79 SER N N 15 119.453 0.17 . 1 . . . . 57 SER N . 6755 1 566 . 1 1 80 80 LYS HA H 1 4.057 0.006 . 1 . . . . 58 LYS HA . 6755 1 567 . 1 1 80 80 LYS HB2 H 1 1.802 0.006 . 1 . . . . 58 LYS HB . 6755 1 568 . 1 1 80 80 LYS HB3 H 1 1.802 0.006 . 1 . . . . 58 LYS HB . 6755 1 569 . 1 1 80 80 LYS HG2 H 1 1.479 0.006 . 1 . . . . 58 LYS HG . 6755 1 570 . 1 1 80 80 LYS HG3 H 1 1.479 0.006 . 1 . . . . 58 LYS HG . 6755 1 571 . 1 1 80 80 LYS HD2 H 1 1.666 0.006 . 1 . . . . 58 LYS HD . 6755 1 572 . 1 1 80 80 LYS HD3 H 1 1.666 0.006 . 1 . . . . 58 LYS HD . 6755 1 573 . 1 1 80 80 LYS HE2 H 1 2.91 0.006 . 1 . . . . 58 LYS QE . 6755 1 574 . 1 1 80 80 LYS HE3 H 1 2.91 0.006 . 1 . . . . 58 LYS QE . 6755 1 575 . 1 1 80 80 LYS CA C 13 59.317 0.3 . 1 . . . . 58 LYS CA . 6755 1 576 . 1 1 80 80 LYS CB C 13 32.33 0.3 . 1 . . . . 58 LYS CB . 6755 1 577 . 1 1 80 80 LYS CG C 13 25.217 0.3 . 1 . . . . 58 LYS CG . 6755 1 578 . 1 1 80 80 LYS CD C 13 29.63 0.3 . 1 . . . . 58 LYS CD . 6755 1 579 . 1 1 80 80 LYS CE C 13 41.99 0.3 . 1 . . . . 58 LYS CE . 6755 1 580 . 1 1 81 81 LYS H H 1 8.017 0.006 . 1 . . . . 59 LYS H . 6755 1 581 . 1 1 81 81 LYS HA H 1 4.27 0.006 . 1 . . . . 59 LYS HA . 6755 1 582 . 1 1 81 81 LYS HB2 H 1 1.826 0.006 . 1 . . . . 59 LYS HB . 6755 1 583 . 1 1 81 81 LYS HB3 H 1 1.826 0.006 . 1 . . . . 59 LYS HB . 6755 1 584 . 1 1 81 81 LYS HG2 H 1 1.281 0.006 . 1 . . . . 59 LYS HG . 6755 1 585 . 1 1 81 81 LYS HG3 H 1 1.281 0.006 . 1 . . . . 59 LYS HG . 6755 1 586 . 1 1 81 81 LYS HD2 H 1 1.569 0.006 . 1 . . . . 59 LYS HD . 6755 1 587 . 1 1 81 81 LYS HD3 H 1 1.569 0.006 . 1 . . . . 59 LYS HD . 6755 1 588 . 1 1 81 81 LYS HE2 H 1 2.896 0.006 . 1 . . . . 59 LYS QE . 6755 1 589 . 1 1 81 81 LYS HE3 H 1 2.896 0.006 . 1 . . . . 59 LYS QE . 6755 1 590 . 1 1 81 81 LYS CA C 13 55.04 0.3 . 1 . . . . 59 LYS CA . 6755 1 591 . 1 1 81 81 LYS CB C 13 32.857 0.3 . 1 . . . . 59 LYS CB . 6755 1 592 . 1 1 81 81 LYS CG C 13 24.94 0.3 . 1 . . . . 59 LYS CG . 6755 1 593 . 1 1 81 81 LYS CD C 13 29.49 0.3 . 1 . . . . 59 LYS CD . 6755 1 594 . 1 1 81 81 LYS CE C 13 41.95 0.3 . 1 . . . . 59 LYS CE . 6755 1 595 . 1 1 81 81 LYS N N 15 115.595 0.17 . 1 . . . . 59 LYS N . 6755 1 596 . 1 1 82 82 LEU H H 1 6.8 0.006 . 1 . . . . 60 LEU H . 6755 1 597 . 1 1 82 82 LEU HA H 1 4.661 0.006 . 1 . . . . 60 LEU HA . 6755 1 598 . 1 1 82 82 LEU HB2 H 1 1.382 0.006 . 1 . . . . 60 LEU HB2 . 6755 1 599 . 1 1 82 82 LEU HB3 H 1 1.283 0.006 . 1 . . . . 60 LEU HB3 . 6755 1 600 . 1 1 82 82 LEU HG H 1 1.209 0.006 . 1 . . . . 60 LEU HG . 6755 1 601 . 1 1 82 82 LEU HD11 H 1 0.792 0.006 . 1 . . . . 60 LEU HD1 . 6755 1 602 . 1 1 82 82 LEU HD12 H 1 0.792 0.006 . 1 . . . . 60 LEU HD1 . 6755 1 603 . 1 1 82 82 LEU HD13 H 1 0.792 0.006 . 1 . . . . 60 LEU HD1 . 6755 1 604 . 1 1 82 82 LEU HD21 H 1 0.698 0.006 . 1 . . . . 60 LEU HD2 . 6755 1 605 . 1 1 82 82 LEU HD22 H 1 0.698 0.006 . 1 . . . . 60 LEU HD2 . 6755 1 606 . 1 1 82 82 LEU HD23 H 1 0.698 0.006 . 1 . . . . 60 LEU HD2 . 6755 1 607 . 1 1 82 82 LEU CA C 13 53.159 0.3 . 1 . . . . 60 LEU CA . 6755 1 608 . 1 1 82 82 LEU CB C 13 42.43 0.3 . 1 . . . . 60 LEU CB . 6755 1 609 . 1 1 82 82 LEU CG C 13 26 0.3 . 1 . . . . 60 LEU CG . 6755 1 610 . 1 1 82 82 LEU CD1 C 13 24.517 0.3 . 1 . . . . 60 LEU CD1 . 6755 1 611 . 1 1 82 82 LEU CD2 C 13 23 0.3 . 1 . . . . 60 LEU CD2 . 6755 1 612 . 1 1 82 82 LEU N N 15 111.6 0.17 . 1 . . . . 60 LEU N . 6755 1 613 . 1 1 83 83 SER H H 1 6.918 0.006 . 1 . . . . 61 SER H . 6755 1 614 . 1 1 83 83 SER HA H 1 4.276 0.006 . 1 . . . . 61 SER HA . 6755 1 615 . 1 1 83 83 SER HB2 H 1 3.89 0.006 . 1 . . . . 61 SER HB . 6755 1 616 . 1 1 83 83 SER HB3 H 1 3.89 0.006 . 1 . . . . 61 SER HB . 6755 1 617 . 1 1 83 83 SER CA C 13 58.519 0.3 . 1 . . . . 61 SER CA . 6755 1 618 . 1 1 83 83 SER CB C 13 65.533 0.3 . 1 . . . . 61 SER CB . 6755 1 619 . 1 1 83 83 SER N N 15 115.411 0.17 . 1 . . . . 61 SER N . 6755 1 620 . 1 1 84 84 GLU H H 1 9.475 0.006 . 1 . . . . 62 GLU H . 6755 1 621 . 1 1 84 84 GLU HA H 1 3.808 0.006 . 1 . . . . 62 GLU HA . 6755 1 622 . 1 1 84 84 GLU HB2 H 1 2.159 0.006 . 1 . . . . 62 GLU HB2 . 6755 1 623 . 1 1 84 84 GLU HB3 H 1 2.002 0.006 . 1 . . . . 62 GLU HB3 . 6755 1 624 . 1 1 84 84 GLU HG2 H 1 2.271 0.006 . 1 . . . . 62 GLU HG . 6755 1 625 . 1 1 84 84 GLU HG3 H 1 2.271 0.006 . 1 . . . . 62 GLU HG . 6755 1 626 . 1 1 84 84 GLU CA C 13 58.78 0.3 . 1 . . . . 62 GLU CA . 6755 1 627 . 1 1 84 84 GLU CB C 13 28.36 0.3 . 1 . . . . 62 GLU CB . 6755 1 628 . 1 1 84 84 GLU N N 15 118.556 0.17 . 1 . . . . 62 GLU N . 6755 1 629 . 1 1 85 85 LEU H H 1 7.661 0.006 . 1 . . . . 63 LEU H . 6755 1 630 . 1 1 85 85 LEU HA H 1 4.193 0.006 . 1 . . . . 63 LEU HA . 6755 1 631 . 1 1 85 85 LEU HB2 H 1 1.389 0.006 . 1 . . . . 63 LEU HB2 . 6755 1 632 . 1 1 85 85 LEU HB3 H 1 1.267 0.006 . 1 . . . . 63 LEU HB3 . 6755 1 633 . 1 1 85 85 LEU HD11 H 1 0.815 0.006 . 1 . . . . 63 LEU HD1 . 6755 1 634 . 1 1 85 85 LEU HD12 H 1 0.815 0.006 . 1 . . . . 63 LEU HD1 . 6755 1 635 . 1 1 85 85 LEU HD13 H 1 0.815 0.006 . 1 . . . . 63 LEU HD1 . 6755 1 636 . 1 1 85 85 LEU HD21 H 1 0.716 0.006 . 1 . . . . 63 LEU HD2 . 6755 1 637 . 1 1 85 85 LEU HD22 H 1 0.716 0.006 . 1 . . . . 63 LEU HD2 . 6755 1 638 . 1 1 85 85 LEU HD23 H 1 0.716 0.006 . 1 . . . . 63 LEU HD2 . 6755 1 639 . 1 1 85 85 LEU CA C 13 55.2 0.3 . 1 . . . . 63 LEU CA . 6755 1 640 . 1 1 85 85 LEU CB C 13 41.49 0.3 . 1 . . . . 63 LEU CB . 6755 1 641 . 1 1 85 85 LEU CD1 C 13 24.703 0.3 . 1 . . . . 63 LEU CD1 . 6755 1 642 . 1 1 85 85 LEU CD2 C 13 22.69 0.3 . 1 . . . . 63 LEU CD2 . 6755 1 643 . 1 1 85 85 LEU N N 15 118.6 0.17 . 1 . . . . 63 LEU N . 6755 1 644 . 1 1 86 86 HIS H H 1 7.846 0.006 . 1 . . . . 64 HIS H . 6755 1 645 . 1 1 86 86 HIS HA H 1 5.165 0.006 . 1 . . . . 64 HIS HA . 6755 1 646 . 1 1 86 86 HIS HB2 H 1 3.448 0.006 . 1 . . . . 64 HIS HB2 . 6755 1 647 . 1 1 86 86 HIS HB3 H 1 3.081 0.006 . 1 . . . . 64 HIS HB3 . 6755 1 648 . 1 1 86 86 HIS HD1 H 1 7.19 0.006 . 1 . . . . 64 HIS HD1 . 6755 1 649 . 1 1 86 86 HIS HE1 H 1 6.931 0.006 . 1 . . . . 64 HIS HE1 . 6755 1 650 . 1 1 86 86 HIS CA C 13 54.2 0.3 . 1 . . . . 64 HIS CA . 6755 1 651 . 1 1 86 86 HIS CB C 13 30.049 0.3 . 1 . . . . 64 HIS CB . 6755 1 652 . 1 1 86 86 HIS N N 15 119.45 0.17 . 1 . . . . 64 HIS N . 6755 1 653 . 1 1 87 87 PRO HA H 1 4.129 0.006 . 1 . . . . 65 PRO HA . 6755 1 654 . 1 1 87 87 PRO HB2 H 1 2.261 0.006 . 1 . . . . 65 PRO HB . 6755 1 655 . 1 1 87 87 PRO HB3 H 1 2.261 0.006 . 1 . . . . 65 PRO HB . 6755 1 656 . 1 1 87 87 PRO HG2 H 1 1.991 0.006 . 1 . . . . 65 PRO HG . 6755 1 657 . 1 1 87 87 PRO HG3 H 1 1.991 0.006 . 1 . . . . 65 PRO HG . 6755 1 658 . 1 1 87 87 PRO HD2 H 1 3.711 0.006 . 1 . . . . 65 PRO HD . 6755 1 659 . 1 1 87 87 PRO HD3 H 1 3.711 0.006 . 1 . . . . 65 PRO HD . 6755 1 660 . 1 1 87 87 PRO CA C 13 65.533 0.3 . 1 . . . . 65 PRO CA . 6755 1 661 . 1 1 87 87 PRO CB C 13 31.41 0.3 . 1 . . . . 65 PRO CB . 6755 1 662 . 1 1 87 87 PRO CG C 13 27.26 0.3 . 1 . . . . 65 PRO CG . 6755 1 663 . 1 1 87 87 PRO CD C 13 50.538 0.3 . 1 . . . . 65 PRO CD . 6755 1 664 . 1 1 88 88 GLU H H 1 9.027 0.006 . 1 . . . . 66 GLU H . 6755 1 665 . 1 1 88 88 GLU HA H 1 4.049 0.006 . 1 . . . . 66 GLU HA . 6755 1 666 . 1 1 88 88 GLU HB2 H 1 1.991 0.006 . 1 . . . . 66 GLU HB2 . 6755 1 667 . 1 1 88 88 GLU HB3 H 1 1.915 0.006 . 1 . . . . 66 GLU HB3 . 6755 1 668 . 1 1 88 88 GLU HG2 H 1 2.282 0.006 . 1 . . . . 66 GLU HG . 6755 1 669 . 1 1 88 88 GLU HG3 H 1 2.282 0.006 . 1 . . . . 66 GLU HG . 6755 1 670 . 1 1 88 88 GLU CA C 13 59.83 0.3 . 1 . . . . 66 GLU CA . 6755 1 671 . 1 1 88 88 GLU CB C 13 28.64 0.3 . 1 . . . . 66 GLU CB . 6755 1 672 . 1 1 88 88 GLU CG C 13 36.49 0.3 . 1 . . . . 66 GLU CG . 6755 1 673 . 1 1 88 88 GLU N N 15 120.018 0.17 . 1 . . . . 66 GLU N . 6755 1 674 . 1 1 89 89 GLU H H 1 8.696 0.006 . 1 . . . . 67 GLU H . 6755 1 675 . 1 1 89 89 GLU HA H 1 3.868 0.006 . 1 . . . . 67 GLU HA . 6755 1 676 . 1 1 89 89 GLU HB2 H 1 1.681 0.006 . 1 . . . . 67 GLU HB . 6755 1 677 . 1 1 89 89 GLU HB3 H 1 1.681 0.006 . 1 . . . . 67 GLU HB . 6755 1 678 . 1 1 89 89 GLU HG2 H 1 2.572 0.006 . 1 . . . . 67 GLU HG2 . 6755 1 679 . 1 1 89 89 GLU HG3 H 1 2.244 0.006 . 1 . . . . 67 GLU HG3 . 6755 1 680 . 1 1 89 89 GLU CA C 13 60.903 0.3 . 1 . . . . 67 GLU CA . 6755 1 681 . 1 1 89 89 GLU CB C 13 29.2 0.3 . 1 . . . . 67 GLU CB . 6755 1 682 . 1 1 89 89 GLU CG C 13 37.74 0.3 . 1 . . . . 67 GLU CG . 6755 1 683 . 1 1 89 89 GLU N N 15 122.434 0.17 . 1 . . . . 67 GLU N . 6755 1 684 . 1 1 90 90 ARG H H 1 7.743 0.006 . 1 . . . . 68 ARG H . 6755 1 685 . 1 1 90 90 ARG HA H 1 3.589 0.006 . 1 . . . . 68 ARG HA . 6755 1 686 . 1 1 90 90 ARG HB2 H 1 1.781 0.006 . 1 . . . . 68 ARG HB . 6755 1 687 . 1 1 90 90 ARG HB3 H 1 1.781 0.006 . 1 . . . . 68 ARG HB . 6755 1 688 . 1 1 90 90 ARG HG2 H 1 1.842 0.006 . 1 . . . . 68 ARG HG . 6755 1 689 . 1 1 90 90 ARG HG3 H 1 1.842 0.006 . 1 . . . . 68 ARG HG . 6755 1 690 . 1 1 90 90 ARG HD2 H 1 3.075 0.006 . 1 . . . . 68 ARG HD2 . 6755 1 691 . 1 1 90 90 ARG HD3 H 1 2.699 0.006 . 1 . . . . 68 ARG HD3 . 6755 1 692 . 1 1 90 90 ARG CA C 13 59.989 0.3 . 1 . . . . 68 ARG CA . 6755 1 693 . 1 1 90 90 ARG CB C 13 31.33 0.3 . 1 . . . . 68 ARG CB . 6755 1 694 . 1 1 90 90 ARG CG C 13 28.88 0.3 . 1 . . . . 68 ARG CG . 6755 1 695 . 1 1 90 90 ARG CD C 13 44.265 0.3 . 1 . . . . 68 ARG CD . 6755 1 696 . 1 1 90 90 ARG N N 15 115.971 0.17 . 1 . . . . 68 ARG N . 6755 1 697 . 1 1 91 91 LYS H H 1 7.625 0.006 . 1 . . . . 69 LYS H . 6755 1 698 . 1 1 91 91 LYS HA H 1 3.881 0.006 . 1 . . . . 69 LYS HA . 6755 1 699 . 1 1 91 91 LYS HB2 H 1 1.876 0.006 . 1 . . . . 69 LYS HB . 6755 1 700 . 1 1 91 91 LYS HB3 H 1 1.876 0.006 . 1 . . . . 69 LYS HB . 6755 1 701 . 1 1 91 91 LYS HG2 H 1 1.429 0.006 . 1 . . . . 69 LYS HG2 . 6755 1 702 . 1 1 91 91 LYS HG3 H 1 1.262 0.006 . 1 . . . . 69 LYS HG3 . 6755 1 703 . 1 1 91 91 LYS HD2 H 1 1.638 0.006 . 1 . . . . 69 LYS HD . 6755 1 704 . 1 1 91 91 LYS HD3 H 1 1.638 0.006 . 1 . . . . 69 LYS HD . 6755 1 705 . 1 1 91 91 LYS HE2 H 1 2.916 0.006 . 1 . . . . 69 LYS QE . 6755 1 706 . 1 1 91 91 LYS HE3 H 1 2.916 0.006 . 1 . . . . 69 LYS QE . 6755 1 707 . 1 1 91 91 LYS CA C 13 59.718 0.3 . 1 . . . . 69 LYS CA . 6755 1 708 . 1 1 91 91 LYS CB C 13 32.52 0.3 . 1 . . . . 69 LYS CB . 6755 1 709 . 1 1 91 91 LYS N N 15 118.523 0.17 . 1 . . . . 69 LYS N . 6755 1 710 . 1 1 92 92 LYS H H 1 7.78 0.006 . 1 . . . . 70 LYS H . 6755 1 711 . 1 1 92 92 LYS HA H 1 4.083 0.006 . 1 . . . . 70 LYS HA . 6755 1 712 . 1 1 92 92 LYS HB2 H 1 1.838 0.006 . 1 . . . . 70 LYS HB . 6755 1 713 . 1 1 92 92 LYS HB3 H 1 1.838 0.006 . 1 . . . . 70 LYS HB . 6755 1 714 . 1 1 92 92 LYS HG2 H 1 1.523 0.006 . 1 . . . . 70 LYS HG2 . 6755 1 715 . 1 1 92 92 LYS HG3 H 1 1.317 0.006 . 1 . . . . 70 LYS HG3 . 6755 1 716 . 1 1 92 92 LYS HE2 H 1 2.934 0.006 . 1 . . . . 70 LYS QE . 6755 1 717 . 1 1 92 92 LYS HE3 H 1 2.934 0.006 . 1 . . . . 70 LYS QE . 6755 1 718 . 1 1 92 92 LYS CA C 13 59.7 0.3 . 1 . . . . 70 LYS CA . 6755 1 719 . 1 1 92 92 LYS CB C 13 32.602 0.3 . 1 . . . . 70 LYS CB . 6755 1 720 . 1 1 92 92 LYS CG C 13 25.556 0.3 . 1 . . . . 70 LYS CG . 6755 1 721 . 1 1 92 92 LYS CE C 13 41.87 0.3 . 1 . . . . 70 LYS CE . 6755 1 722 . 1 1 92 92 LYS N N 15 117.84 0.17 . 1 . . . . 70 LYS N . 6755 1 723 . 1 1 93 93 VAL H H 1 7.784 0.006 . 1 . . . . 71 VAL H . 6755 1 724 . 1 1 93 93 VAL HA H 1 3.28 0.006 . 1 . . . . 71 VAL HA . 6755 1 725 . 1 1 93 93 VAL HB H 1 1.466 0.006 . 1 . . . . 71 VAL HB . 6755 1 726 . 1 1 93 93 VAL HG11 H 1 0.086 0.006 . 1 . . . . 71 VAL HG1 . 6755 1 727 . 1 1 93 93 VAL HG12 H 1 0.086 0.006 . 1 . . . . 71 VAL HG1 . 6755 1 728 . 1 1 93 93 VAL HG13 H 1 0.086 0.006 . 1 . . . . 71 VAL HG1 . 6755 1 729 . 1 1 93 93 VAL HG21 H 1 -0.162 0.006 . 1 . . . . 71 VAL HG2 . 6755 1 730 . 1 1 93 93 VAL HG22 H 1 -0.162 0.006 . 1 . . . . 71 VAL HG2 . 6755 1 731 . 1 1 93 93 VAL HG23 H 1 -0.162 0.006 . 1 . . . . 71 VAL HG2 . 6755 1 732 . 1 1 93 93 VAL CA C 13 66.232 0.3 . 1 . . . . 71 VAL CA . 6755 1 733 . 1 1 93 93 VAL CB C 13 30.45 0.3 . 1 . . . . 71 VAL CB . 6755 1 734 . 1 1 93 93 VAL CG1 C 13 20.923 0.3 . 1 . . . . 71 VAL CG1 . 6755 1 735 . 1 1 93 93 VAL CG2 C 13 21.731 0.3 . 1 . . . . 71 VAL CG2 . 6755 1 736 . 1 1 93 93 VAL N N 15 120.044 0.17 . 1 . . . . 71 VAL N . 6755 1 737 . 1 1 94 94 ARG H H 1 7.864 0.006 . 1 . . . . 72 ARG H . 6755 1 738 . 1 1 94 94 ARG HA H 1 3.821 0.006 . 1 . . . . 72 ARG HA . 6755 1 739 . 1 1 94 94 ARG HB2 H 1 1.959 0.006 . 1 . . . . 72 ARG HB2 . 6755 1 740 . 1 1 94 94 ARG HB3 H 1 1.826 0.006 . 1 . . . . 72 ARG HB3 . 6755 1 741 . 1 1 94 94 ARG HG2 H 1 1.678 0.006 . 1 . . . . 72 ARG HG . 6755 1 742 . 1 1 94 94 ARG HG3 H 1 1.678 0.006 . 1 . . . . 72 ARG HG . 6755 1 743 . 1 1 94 94 ARG HD2 H 1 3.214 0.006 . 1 . . . . 72 ARG HD . 6755 1 744 . 1 1 94 94 ARG HD3 H 1 3.214 0.006 . 1 . . . . 72 ARG HD . 6755 1 745 . 1 1 94 94 ARG CA C 13 59.81 0.3 . 1 . . . . 72 ARG CA . 6755 1 746 . 1 1 94 94 ARG CB C 13 30.16 0.3 . 1 . . . . 72 ARG CB . 6755 1 747 . 1 1 94 94 ARG CG C 13 27.65 0.3 . 1 . . . . 72 ARG CG . 6755 1 748 . 1 1 94 94 ARG CD C 13 43.16 0.3 . 1 . . . . 72 ARG CD . 6755 1 749 . 1 1 94 94 ARG N N 15 119.647 0.17 . 1 . . . . 72 ARG N . 6755 1 750 . 1 1 95 95 GLU H H 1 8.572 0.006 . 1 . . . . 73 GLU H . 6755 1 751 . 1 1 95 95 GLU HA H 1 4.138 0.006 . 1 . . . . 73 GLU HA . 6755 1 752 . 1 1 95 95 GLU HB2 H 1 2.135 0.006 . 1 . . . . 73 GLU HB2 . 6755 1 753 . 1 1 95 95 GLU HB3 H 1 2.022 0.006 . 1 . . . . 73 GLU HB3 . 6755 1 754 . 1 1 95 95 GLU HG2 H 1 2.572 0.006 . 1 . . . . 73 GLU HG2 . 6755 1 755 . 1 1 95 95 GLU HG3 H 1 2.288 0.006 . 1 . . . . 73 GLU HG3 . 6755 1 756 . 1 1 95 95 GLU CA C 13 59.52 0.3 . 1 . . . . 73 GLU CA . 6755 1 757 . 1 1 95 95 GLU CB C 13 29.23 0.3 . 1 . . . . 73 GLU CB . 6755 1 758 . 1 1 95 95 GLU CG C 13 37.153 0.3 . 1 . . . . 73 GLU CG . 6755 1 759 . 1 1 95 95 GLU N N 15 117.639 0.17 . 1 . . . . 73 GLU N . 6755 1 760 . 1 1 96 96 LYS H H 1 8.062 0.006 . 1 . . . . 74 LYS H . 6755 1 761 . 1 1 96 96 LYS HA H 1 4.277 0.006 . 1 . . . . 74 LYS HA . 6755 1 762 . 1 1 96 96 LYS HB2 H 1 2.264 0.006 . 1 . . . . 74 LYS HB . 6755 1 763 . 1 1 96 96 LYS HB3 H 1 2.264 0.006 . 1 . . . . 74 LYS HB . 6755 1 764 . 1 1 96 96 LYS HG2 H 1 1.615 0.006 . 1 . . . . 74 LYS HG . 6755 1 765 . 1 1 96 96 LYS HG3 H 1 1.615 0.006 . 1 . . . . 74 LYS HG . 6755 1 766 . 1 1 96 96 LYS HD2 H 1 1.748 0.006 . 1 . . . . 74 LYS HD2 . 6755 1 767 . 1 1 96 96 LYS HD3 H 1 1.64 0.006 . 1 . . . . 74 LYS HD3 . 6755 1 768 . 1 1 96 96 LYS HE2 H 1 2.838 0.006 . 1 . . . . 74 LYS HE2 . 6755 1 769 . 1 1 96 96 LYS HE3 H 1 2.703 0.006 . 1 . . . . 74 LYS HE3 . 6755 1 770 . 1 1 96 96 LYS CA C 13 57.07 0.3 . 1 . . . . 74 LYS CA . 6755 1 771 . 1 1 96 96 LYS CB C 13 31.13 0.3 . 1 . . . . 74 LYS CB . 6755 1 772 . 1 1 96 96 LYS CG C 13 24.01 0.3 . 1 . . . . 74 LYS CG . 6755 1 773 . 1 1 96 96 LYS CD C 13 27.12 0.3 . 1 . . . . 74 LYS CD . 6755 1 774 . 1 1 96 96 LYS CE C 13 41.84 0.3 . 1 . . . . 74 LYS CE . 6755 1 775 . 1 1 96 96 LYS N N 15 121.724 0.17 . 1 . . . . 74 LYS N . 6755 1 776 . 1 1 97 97 PHE H H 1 8.717 0.006 . 1 . . . . 75 PHE H . 6755 1 777 . 1 1 97 97 PHE HA H 1 4.09 0.006 . 1 . . . . 75 PHE HA . 6755 1 778 . 1 1 97 97 PHE HB2 H 1 3.392 0.006 . 1 . . . . 75 PHE HB2 . 6755 1 779 . 1 1 97 97 PHE HB3 H 1 2.867 0.006 . 1 . . . . 75 PHE HB3 . 6755 1 780 . 1 1 97 97 PHE HD1 H 1 7.115 0.006 . 1 . . . . 75 PHE HD . 6755 1 781 . 1 1 97 97 PHE HD2 H 1 7.115 0.006 . 1 . . . . 75 PHE HD . 6755 1 782 . 1 1 97 97 PHE HE1 H 1 6.913 0.006 . 1 . . . . 75 PHE QE . 6755 1 783 . 1 1 97 97 PHE HE2 H 1 6.913 0.006 . 1 . . . . 75 PHE QE . 6755 1 784 . 1 1 97 97 PHE CA C 13 62.259 0.3 . 1 . . . . 75 PHE CA . 6755 1 785 . 1 1 97 97 PHE CB C 13 39.094 0.3 . 1 . . . . 75 PHE CB . 6755 1 786 . 1 1 97 97 PHE N N 15 121.667 0.17 . 1 . . . . 75 PHE N . 6755 1 787 . 1 1 98 98 ASP H H 1 8.24 0.006 . 1 . . . . 76 ASP H . 6755 1 788 . 1 1 98 98 ASP HA H 1 4.369 0.006 . 1 . . . . 76 ASP HA . 6755 1 789 . 1 1 98 98 ASP HB2 H 1 2.882 0.006 . 1 . . . . 76 ASP HB2 . 6755 1 790 . 1 1 98 98 ASP HB3 H 1 2.711 0.006 . 1 . . . . 76 ASP HB3 . 6755 1 791 . 1 1 98 98 ASP CA C 13 57.869 0.3 . 1 . . . . 76 ASP CA . 6755 1 792 . 1 1 98 98 ASP CB C 13 40.335 0.3 . 1 . . . . 76 ASP CB . 6755 1 793 . 1 1 98 98 ASP N N 15 119.158 0.17 . 1 . . . . 76 ASP N . 6755 1 794 . 1 1 99 99 GLU H H 1 8.353 0.006 . 1 . . . . 77 GLU H . 6755 1 795 . 1 1 99 99 GLU HA H 1 3.802 0.006 . 1 . . . . 77 GLU HA . 6755 1 796 . 1 1 99 99 GLU HB2 H 1 2.148 0.006 . 1 . . . . 77 GLU HB . 6755 1 797 . 1 1 99 99 GLU HB3 H 1 2.148 0.006 . 1 . . . . 77 GLU HB . 6755 1 798 . 1 1 99 99 GLU HG2 H 1 2.299 0.006 . 1 . . . . 77 GLU HG2 . 6755 1 799 . 1 1 99 99 GLU HG3 H 1 2.11 0.006 . 1 . . . . 77 GLU HG3 . 6755 1 800 . 1 1 99 99 GLU CA C 13 60.19 0.3 . 1 . . . . 77 GLU CA . 6755 1 801 . 1 1 99 99 GLU CB C 13 29.895 0.3 . 1 . . . . 77 GLU CB . 6755 1 802 . 1 1 99 99 GLU CG C 13 36.122 0.3 . 1 . . . . 77 GLU CG . 6755 1 803 . 1 1 99 99 GLU N N 15 122.449 0.17 . 1 . . . . 77 GLU N . 6755 1 804 . 1 1 100 100 ASN H H 1 8.955 0.006 . 1 . . . . 78 ASN H . 6755 1 805 . 1 1 100 100 ASN HA H 1 4.373 0.006 . 1 . . . . 78 ASN HA . 6755 1 806 . 1 1 100 100 ASN HB2 H 1 2.524 0.006 . 1 . . . . 78 ASN HB2 . 6755 1 807 . 1 1 100 100 ASN HB3 H 1 2.036 0.006 . 1 . . . . 78 ASN HB3 . 6755 1 808 . 1 1 100 100 ASN CA C 13 55.91 0.3 . 1 . . . . 78 ASN CA . 6755 1 809 . 1 1 100 100 ASN CB C 13 36.872 0.3 . 1 . . . . 78 ASN CB . 6755 1 810 . 1 1 100 100 ASN N N 15 120.491 0.17 . 1 . . . . 78 ASN N . 6755 1 811 . 1 1 101 101 SER H H 1 8.257 0.006 . 1 . . . . 79 SER H . 6755 1 812 . 1 1 101 101 SER HA H 1 4.046 0.006 . 1 . . . . 79 SER HA . 6755 1 813 . 1 1 101 101 SER HB2 H 1 3.901 0.006 . 1 . . . . 79 SER HB . 6755 1 814 . 1 1 101 101 SER HB3 H 1 3.901 0.006 . 1 . . . . 79 SER HB . 6755 1 815 . 1 1 101 101 SER CA C 13 61.129 0.3 . 1 . . . . 79 SER CA . 6755 1 816 . 1 1 101 101 SER CB C 13 62.519 0.3 . 1 . . . . 79 SER CB . 6755 1 817 . 1 1 101 101 SER N N 15 115.385 0.17 . 1 . . . . 79 SER N . 6755 1 818 . 1 1 102 102 ARG H H 1 7.303 0.006 . 1 . . . . 80 ARG H . 6755 1 819 . 1 1 102 102 ARG HA H 1 4.379 0.006 . 1 . . . . 80 ARG HA . 6755 1 820 . 1 1 102 102 ARG HB2 H 1 1.986 0.006 . 1 . . . . 80 ARG HB2 . 6755 1 821 . 1 1 102 102 ARG HB3 H 1 1.803 0.006 . 1 . . . . 80 ARG HB3 . 6755 1 822 . 1 1 102 102 ARG HG2 H 1 1.829 0.006 . 1 . . . . 80 ARG HG2 . 6755 1 823 . 1 1 102 102 ARG HG3 H 1 1.578 0.006 . 1 . . . . 80 ARG HG3 . 6755 1 824 . 1 1 102 102 ARG HD2 H 1 3.241 0.006 . 1 . . . . 80 ARG HD2 . 6755 1 825 . 1 1 102 102 ARG HD3 H 1 3.065 0.006 . 1 . . . . 80 ARG HD3 . 6755 1 826 . 1 1 102 102 ARG CA C 13 56.08 0.3 . 1 . . . . 80 ARG CA . 6755 1 827 . 1 1 102 102 ARG CB C 13 31.05 0.3 . 1 . . . . 80 ARG CB . 6755 1 828 . 1 1 102 102 ARG CG C 13 28.22 0.3 . 1 . . . . 80 ARG CG . 6755 1 829 . 1 1 102 102 ARG CD C 13 43.681 0.3 . 1 . . . . 80 ARG CD . 6755 1 830 . 1 1 102 102 ARG N N 15 120.163 0.17 . 1 . . . . 80 ARG N . 6755 1 831 . 1 1 103 103 MET H H 1 7.186 0.006 . 1 . . . . 81 MET H . 6755 1 832 . 1 1 103 103 MET HA H 1 4.108 0.006 . 1 . . . . 81 MET HA . 6755 1 833 . 1 1 103 103 MET HB2 H 1 2.135 0.006 . 1 . . . . 81 MET HB2 . 6755 1 834 . 1 1 103 103 MET HB3 H 1 2.012 0.006 . 1 . . . . 81 MET HB3 . 6755 1 835 . 1 1 103 103 MET HG2 H 1 2.698 0.006 . 1 . . . . 81 MET HG2 . 6755 1 836 . 1 1 103 103 MET HG3 H 1 2.609 0.006 . 1 . . . . 81 MET HG3 . 6755 1 837 . 1 1 103 103 MET HE1 H 1 1.929 0.006 . 1 . . . . 81 MET QE . 6755 1 838 . 1 1 103 103 MET HE2 H 1 1.929 0.006 . 1 . . . . 81 MET QE . 6755 1 839 . 1 1 103 103 MET HE3 H 1 1.929 0.006 . 1 . . . . 81 MET QE . 6755 1 840 . 1 1 103 103 MET CA C 13 56.85 0.3 . 1 . . . . 81 MET CA . 6755 1 841 . 1 1 103 103 MET CB C 13 34.591 0.3 . 1 . . . . 81 MET CB . 6755 1 842 . 1 1 103 103 MET CG C 13 32.066 0.3 . 1 . . . . 81 MET CG . 6755 1 843 . 1 1 103 103 MET CE C 13 16.237 0.3 . 1 . . . . 81 MET CE . 6755 1 844 . 1 1 103 103 MET N N 15 120.919 0.17 . 1 . . . . 81 MET N . 6755 1 845 . 1 1 104 104 GLN H H 1 8.814 0.006 . 1 . . . . 82 GLN H . 6755 1 846 . 1 1 104 104 GLN HA H 1 4.118 0.006 . 1 . . . . 82 GLN HA . 6755 1 847 . 1 1 104 104 GLN HB2 H 1 2.166 0.006 . 1 . . . . 82 GLN HB2 . 6755 1 848 . 1 1 104 104 GLN HB3 H 1 1.961 0.006 . 1 . . . . 82 GLN HB3 . 6755 1 849 . 1 1 104 104 GLN HG2 H 1 2.541 0.006 . 1 . . . . 82 GLN HG . 6755 1 850 . 1 1 104 104 GLN HG3 H 1 2.541 0.006 . 1 . . . . 82 GLN HG . 6755 1 851 . 1 1 104 104 GLN CA C 13 57.18 0.3 . 1 . . . . 82 GLN CA . 6755 1 852 . 1 1 104 104 GLN CB C 13 28.814 0.3 . 1 . . . . 82 GLN CB . 6755 1 853 . 1 1 104 104 GLN CG C 13 34.15 0.3 . 1 . . . . 82 GLN CG . 6755 1 854 . 1 1 104 104 GLN N N 15 122.888 0.17 . 1 . . . . 82 GLN N . 6755 1 855 . 1 1 105 105 TYR H H 1 8.852 0.006 . 1 . . . . 83 TYR H . 6755 1 856 . 1 1 105 105 TYR HA H 1 3.927 0.006 . 1 . . . . 83 TYR HA . 6755 1 857 . 1 1 105 105 TYR HB2 H 1 3.173 0.006 . 1 . . . . 83 TYR HB2 . 6755 1 858 . 1 1 105 105 TYR HB3 H 1 2.976 0.006 . 1 . . . . 83 TYR HB3 . 6755 1 859 . 1 1 105 105 TYR HD1 H 1 6.989 0.006 . 1 . . . . 83 TYR HD . 6755 1 860 . 1 1 105 105 TYR HD2 H 1 6.989 0.006 . 1 . . . . 83 TYR HD . 6755 1 861 . 1 1 105 105 TYR HE1 H 1 6.765 0.006 . 1 . . . . 83 TYR QE . 6755 1 862 . 1 1 105 105 TYR HE2 H 1 6.765 0.006 . 1 . . . . 83 TYR QE . 6755 1 863 . 1 1 105 105 TYR CA C 13 62.149 0.3 . 1 . . . . 83 TYR CA . 6755 1 864 . 1 1 105 105 TYR CB C 13 38.668 0.3 . 1 . . . . 83 TYR CB . 6755 1 865 . 1 1 105 105 TYR N N 15 127.683 0.17 . 1 . . . . 83 TYR N . 6755 1 866 . 1 1 106 106 SER H H 1 8.797 0.006 . 1 . . . . 84 SER H . 6755 1 867 . 1 1 106 106 SER HA H 1 3.937 0.006 . 1 . . . . 84 SER HA . 6755 1 868 . 1 1 106 106 SER HB2 H 1 3.208 0.006 . 1 . . . . 84 SER HB2 . 6755 1 869 . 1 1 106 106 SER HB3 H 1 3.061 0.006 . 1 . . . . 84 SER HB3 . 6755 1 870 . 1 1 106 106 SER CA C 13 61.879 0.3 . 1 . . . . 84 SER CA . 6755 1 871 . 1 1 106 106 SER CB C 13 63.096 0.3 . 1 . . . . 84 SER CB . 6755 1 872 . 1 1 106 106 SER N N 15 111.004 0.17 . 1 . . . . 84 SER N . 6755 1 873 . 1 1 107 107 GLU H H 1 6.955 0.006 . 1 . . . . 85 GLU H . 6755 1 874 . 1 1 107 107 GLU HA H 1 4.041 0.006 . 1 . . . . 85 GLU HA . 6755 1 875 . 1 1 107 107 GLU HB2 H 1 2.064 0.006 . 1 . . . . 85 GLU HB . 6755 1 876 . 1 1 107 107 GLU HB3 H 1 2.064 0.006 . 1 . . . . 85 GLU HB . 6755 1 877 . 1 1 107 107 GLU HG2 H 1 2.26 0.006 . 1 . . . . 85 GLU HG . 6755 1 878 . 1 1 107 107 GLU HG3 H 1 2.26 0.006 . 1 . . . . 85 GLU HG . 6755 1 879 . 1 1 107 107 GLU CA C 13 58.94 0.3 . 1 . . . . 85 GLU CA . 6755 1 880 . 1 1 107 107 GLU CB C 13 29.697 0.3 . 1 . . . . 85 GLU CB . 6755 1 881 . 1 1 107 107 GLU CG C 13 36.42 0.3 . 1 . . . . 85 GLU CG . 6755 1 882 . 1 1 107 107 GLU N N 15 123.316 0.17 . 1 . . . . 85 GLU N . 6755 1 883 . 1 1 108 108 LEU H H 1 7.928 0.006 . 1 . . . . 86 LEU H . 6755 1 884 . 1 1 108 108 LEU HA H 1 3.921 0.006 . 1 . . . . 86 LEU HA . 6755 1 885 . 1 1 108 108 LEU HB2 H 1 1.613 0.006 . 1 . . . . 86 LEU HB2 . 6755 1 886 . 1 1 108 108 LEU HB3 H 1 1.384 0.006 . 1 . . . . 86 LEU HB3 . 6755 1 887 . 1 1 108 108 LEU HG H 1 1.17 0.006 . 1 . . . . 86 LEU HG . 6755 1 888 . 1 1 108 108 LEU CA C 13 58.212 0.3 . 1 . . . . 86 LEU CA . 6755 1 889 . 1 1 108 108 LEU CB C 13 41.045 0.3 . 1 . . . . 86 LEU CB . 6755 1 890 . 1 1 108 108 LEU CG C 13 26.387 0.3 . 1 . . . . 86 LEU CG . 6755 1 891 . 1 1 108 108 LEU CD1 C 13 22.68 0.3 . 1 . . . . 86 LEU CD1 . 6755 1 892 . 1 1 108 108 LEU N N 15 122.631 0.17 . 1 . . . . 86 LEU N . 6755 1 893 . 1 1 108 108 LEU HD11 H 1 0.595 0.006 . 1 . . . . 86 LEU QHD . 6755 1 894 . 1 1 108 108 LEU HD12 H 1 0.595 0.006 . 1 . . . . 86 LEU QHD . 6755 1 895 . 1 1 108 108 LEU HD13 H 1 0.595 0.006 . 1 . . . . 86 LEU QHD . 6755 1 896 . 1 1 109 109 MET H H 1 8.27 0.006 . 1 . . . . 87 MET H . 6755 1 897 . 1 1 109 109 MET HA H 1 4.242 0.006 . 1 . . . . 87 MET HA . 6755 1 898 . 1 1 109 109 MET HB2 H 1 1.924 0.006 . 1 . . . . 87 MET HB2 . 6755 1 899 . 1 1 109 109 MET HB3 H 1 1.632 0.006 . 1 . . . . 87 MET HB3 . 6755 1 900 . 1 1 109 109 MET HE1 H 1 1.57 0.006 . 1 . . . . 87 MET QE . 6755 1 901 . 1 1 109 109 MET HE2 H 1 1.57 0.006 . 1 . . . . 87 MET QE . 6755 1 902 . 1 1 109 109 MET HE3 H 1 1.57 0.006 . 1 . . . . 87 MET QE . 6755 1 903 . 1 1 109 109 MET CA C 13 56.62 0.3 . 1 . . . . 87 MET CA . 6755 1 904 . 1 1 109 109 MET CB C 13 30.05 0.3 . 1 . . . . 87 MET CB . 6755 1 905 . 1 1 109 109 MET CE C 13 16.577 0.3 . 1 . . . . 87 MET CE . 6755 1 906 . 1 1 109 109 MET N N 15 114.849 0.17 . 1 . . . . 87 MET N . 6755 1 907 . 1 1 110 110 THR H H 1 7.866 0.006 . 1 . . . . 88 THR H . 6755 1 908 . 1 1 110 110 THR HA H 1 3.931 0.006 . 1 . . . . 88 THR HA . 6755 1 909 . 1 1 110 110 THR HB H 1 4.183 0.006 . 1 . . . . 88 THR HB . 6755 1 910 . 1 1 110 110 THR HG21 H 1 1.101 0.006 . 1 . . . . 88 THR HG2 . 6755 1 911 . 1 1 110 110 THR HG22 H 1 1.101 0.006 . 1 . . . . 88 THR HG2 . 6755 1 912 . 1 1 110 110 THR HG23 H 1 1.101 0.006 . 1 . . . . 88 THR HG2 . 6755 1 913 . 1 1 110 110 THR CA C 13 67.103 0.3 . 1 . . . . 88 THR CA . 6755 1 914 . 1 1 110 110 THR CB C 13 68.705 0.3 . 1 . . . . 88 THR CB . 6755 1 915 . 1 1 110 110 THR N N 15 117.725 0.17 . 1 . . . . 88 THR N . 6755 1 916 . 1 1 111 111 LYS H H 1 7.554 0.006 . 1 . . . . 89 LYS H . 6755 1 917 . 1 1 111 111 LYS HA H 1 4.067 0.006 . 1 . . . . 89 LYS HA . 6755 1 918 . 1 1 111 111 LYS HB2 H 1 1.839 0.006 . 1 . . . . 89 LYS HB . 6755 1 919 . 1 1 111 111 LYS HB3 H 1 1.839 0.006 . 1 . . . . 89 LYS HB . 6755 1 920 . 1 1 111 111 LYS HG2 H 1 1.322 0.006 . 1 . . . . 89 LYS HG . 6755 1 921 . 1 1 111 111 LYS HG3 H 1 1.322 0.006 . 1 . . . . 89 LYS HG . 6755 1 922 . 1 1 111 111 LYS HD2 H 1 1.531 0.006 . 1 . . . . 89 LYS HD . 6755 1 923 . 1 1 111 111 LYS HD3 H 1 1.531 0.006 . 1 . . . . 89 LYS HD . 6755 1 924 . 1 1 111 111 LYS HE2 H 1 2.879 0.006 . 1 . . . . 89 LYS QE . 6755 1 925 . 1 1 111 111 LYS HE3 H 1 2.879 0.006 . 1 . . . . 89 LYS QE . 6755 1 926 . 1 1 111 111 LYS CA C 13 60.15 0.3 . 1 . . . . 89 LYS CA . 6755 1 927 . 1 1 111 111 LYS CB C 13 32.5 0.3 . 1 . . . . 89 LYS CB . 6755 1 928 . 1 1 111 111 LYS CG C 13 25.529 0.3 . 1 . . . . 89 LYS CG . 6755 1 929 . 1 1 111 111 LYS CD C 13 29.42 0.3 . 1 . . . . 89 LYS CD . 6755 1 930 . 1 1 111 111 LYS CE C 13 41.87 0.3 . 1 . . . . 89 LYS CE . 6755 1 931 . 1 1 111 111 LYS N N 15 122.235 0.17 . 1 . . . . 89 LYS N . 6755 1 932 . 1 1 112 112 TYR H H 1 8.326 0.006 . 1 . . . . 90 TYR H . 6755 1 933 . 1 1 112 112 TYR HA H 1 4.023 0.006 . 1 . . . . 90 TYR HA . 6755 1 934 . 1 1 112 112 TYR HB2 H 1 2.852 0.006 . 1 . . . . 90 TYR HB . 6755 1 935 . 1 1 112 112 TYR HB3 H 1 2.852 0.006 . 1 . . . . 90 TYR HB . 6755 1 936 . 1 1 112 112 TYR HD1 H 1 6.894 0.006 . 1 . . . . 90 TYR HD . 6755 1 937 . 1 1 112 112 TYR HD2 H 1 6.894 0.006 . 1 . . . . 90 TYR HD . 6755 1 938 . 1 1 112 112 TYR HE1 H 1 6.693 0.006 . 1 . . . . 90 TYR QE . 6755 1 939 . 1 1 112 112 TYR HE2 H 1 6.693 0.006 . 1 . . . . 90 TYR QE . 6755 1 940 . 1 1 112 112 TYR CA C 13 60.499 0.3 . 1 . . . . 90 TYR CA . 6755 1 941 . 1 1 112 112 TYR CB C 13 38.788 0.3 . 1 . . . . 90 TYR CB . 6755 1 942 . 1 1 112 112 TYR N N 15 119.187 0.17 . 1 . . . . 90 TYR N . 6755 1 943 . 1 1 113 113 HIS H H 1 8.61 0.006 . 1 . . . . 91 HIS H . 6755 1 944 . 1 1 113 113 HIS HA H 1 4.413 0.006 . 1 . . . . 91 HIS HA . 6755 1 945 . 1 1 113 113 HIS HB2 H 1 3.779 0.006 . 1 . . . . 91 HIS HB2 . 6755 1 946 . 1 1 113 113 HIS HB3 H 1 3.098 0.006 . 1 . . . . 91 HIS HB3 . 6755 1 947 . 1 1 113 113 HIS HD1 H 1 6.913 0.006 . 1 . . . . 91 HIS HD1 . 6755 1 948 . 1 1 113 113 HIS CA C 13 59.636 0.3 . 1 . . . . 91 HIS CA . 6755 1 949 . 1 1 113 113 HIS CB C 13 29.33 0.3 . 1 . . . . 91 HIS CB . 6755 1 950 . 1 1 113 113 HIS N N 15 117.576 0.17 . 1 . . . . 91 HIS N . 6755 1 951 . 1 1 114 114 ASP H H 1 8.383 0.006 . 1 . . . . 92 ASP H . 6755 1 952 . 1 1 114 114 ASP HA H 1 4.36 0.006 . 1 . . . . 92 ASP HA . 6755 1 953 . 1 1 114 114 ASP HB2 H 1 2.828 0.006 . 1 . . . . 92 ASP HB2 . 6755 1 954 . 1 1 114 114 ASP HB3 H 1 2.611 0.006 . 1 . . . . 92 ASP HB3 . 6755 1 955 . 1 1 114 114 ASP CA C 13 57.89 0.3 . 1 . . . . 92 ASP CA . 6755 1 956 . 1 1 114 114 ASP CB C 13 40.418 0.3 . 1 . . . . 92 ASP CB . 6755 1 957 . 1 1 114 114 ASP N N 15 121.327 0.17 . 1 . . . . 92 ASP N . 6755 1 958 . 1 1 115 115 LEU H H 1 8.098 0.006 . 1 . . . . 93 LEU H . 6755 1 959 . 1 1 115 115 LEU HA H 1 3.923 0.006 . 1 . . . . 93 LEU HA . 6755 1 960 . 1 1 115 115 LEU HB2 H 1 1.938 0.006 . 1 . . . . 93 LEU HB2 . 6755 1 961 . 1 1 115 115 LEU HB3 H 1 1.82 0.006 . 1 . . . . 93 LEU HB3 . 6755 1 962 . 1 1 115 115 LEU HG H 1 0.841 0.006 . 1 . . . . 93 LEU HG . 6755 1 963 . 1 1 115 115 LEU HD11 H 1 0.851 0.006 . 1 . . . . 93 LEU HD1 . 6755 1 964 . 1 1 115 115 LEU HD12 H 1 0.851 0.006 . 1 . . . . 93 LEU HD1 . 6755 1 965 . 1 1 115 115 LEU HD13 H 1 0.851 0.006 . 1 . . . . 93 LEU HD1 . 6755 1 966 . 1 1 115 115 LEU HD21 H 1 0.8 0.006 . 1 . . . . 93 LEU HD2 . 6755 1 967 . 1 1 115 115 LEU HD22 H 1 0.8 0.006 . 1 . . . . 93 LEU HD2 . 6755 1 968 . 1 1 115 115 LEU HD23 H 1 0.8 0.006 . 1 . . . . 93 LEU HD2 . 6755 1 969 . 1 1 115 115 LEU CA C 13 58.08 0.3 . 1 . . . . 93 LEU CA . 6755 1 970 . 1 1 115 115 LEU CB C 13 41.92 0.3 . 1 . . . . 93 LEU CB . 6755 1 971 . 1 1 115 115 LEU CG C 13 26.467 0.3 . 1 . . . . 93 LEU CG . 6755 1 972 . 1 1 115 115 LEU CD1 C 13 22.89 0.3 . 1 . . . . 93 LEU CD1 . 6755 1 973 . 1 1 115 115 LEU N N 15 120.452 0.17 . 1 . . . . 93 LEU N . 6755 1 974 . 1 1 116 116 LYS H H 1 8.23 0.006 . 1 . . . . 94 LYS H . 6755 1 975 . 1 1 116 116 LYS HA H 1 4.176 0.006 . 1 . . . . 94 LYS HA . 6755 1 976 . 1 1 116 116 LYS HB2 H 1 1.498 0.006 . 1 . . . . 94 LYS HB . 6755 1 977 . 1 1 116 116 LYS HB3 H 1 1.498 0.006 . 1 . . . . 94 LYS HB . 6755 1 978 . 1 1 116 116 LYS HG2 H 1 0.985 0.006 . 1 . . . . 94 LYS HG . 6755 1 979 . 1 1 116 116 LYS HG3 H 1 0.985 0.006 . 1 . . . . 94 LYS HG . 6755 1 980 . 1 1 116 116 LYS HD2 H 1 1.256 0.006 . 1 . . . . 94 LYS HD . 6755 1 981 . 1 1 116 116 LYS HD3 H 1 1.256 0.006 . 1 . . . . 94 LYS HD . 6755 1 982 . 1 1 116 116 LYS HE2 H 1 2.599 0.006 . 1 . . . . 94 LYS HE2 . 6755 1 983 . 1 1 116 116 LYS HE3 H 1 2.281 0.006 . 1 . . . . 94 LYS HE3 . 6755 1 984 . 1 1 116 116 LYS CA C 13 60.007 0.3 . 1 . . . . 94 LYS CA . 6755 1 985 . 1 1 116 116 LYS CB C 13 32.006 0.3 . 1 . . . . 94 LYS CB . 6755 1 986 . 1 1 116 116 LYS CG C 13 25.081 0.3 . 1 . . . . 94 LYS CG . 6755 1 987 . 1 1 116 116 LYS CD C 13 29.459 0.3 . 1 . . . . 94 LYS CD . 6755 1 988 . 1 1 116 116 LYS CE C 13 41.109 0.3 . 1 . . . . 94 LYS CE . 6755 1 989 . 1 1 116 116 LYS N N 15 120.702 0.17 . 1 . . . . 94 LYS N . 6755 1 990 . 1 1 117 117 LYS H H 1 8.083 0.006 . 1 . . . . 95 LYS H . 6755 1 991 . 1 1 117 117 LYS HA H 1 3.961 0.006 . 1 . . . . 95 LYS HA . 6755 1 992 . 1 1 117 117 LYS HB2 H 1 1.923 0.006 . 1 . . . . 95 LYS HB . 6755 1 993 . 1 1 117 117 LYS HB3 H 1 1.923 0.006 . 1 . . . . 95 LYS HB . 6755 1 994 . 1 1 117 117 LYS HG2 H 1 1.422 0.006 . 1 . . . . 95 LYS HG . 6755 1 995 . 1 1 117 117 LYS HG3 H 1 1.422 0.006 . 1 . . . . 95 LYS HG . 6755 1 996 . 1 1 117 117 LYS HD2 H 1 1.632 0.006 . 1 . . . . 95 LYS HD . 6755 1 997 . 1 1 117 117 LYS HD3 H 1 1.632 0.006 . 1 . . . . 95 LYS HD . 6755 1 998 . 1 1 117 117 LYS HE2 H 1 2.903 0.006 . 1 . . . . 95 LYS QE . 6755 1 999 . 1 1 117 117 LYS HE3 H 1 2.903 0.006 . 1 . . . . 95 LYS QE . 6755 1 1000 . 1 1 117 117 LYS CA C 13 59.55 0.3 . 1 . . . . 95 LYS CA . 6755 1 1001 . 1 1 117 117 LYS CB C 13 31.876 0.3 . 1 . . . . 95 LYS CB . 6755 1 1002 . 1 1 117 117 LYS CG C 13 25.016 0.3 . 1 . . . . 95 LYS CG . 6755 1 1003 . 1 1 117 117 LYS CD C 13 29.404 0.3 . 1 . . . . 95 LYS CD . 6755 1 1004 . 1 1 117 117 LYS CE C 13 41.912 0.3 . 1 . . . . 95 LYS CE . 6755 1 1005 . 1 1 117 117 LYS N N 15 122.709 0.17 . 1 . . . . 95 LYS N . 6755 1 1006 . 1 1 118 118 GLN H H 1 7.559 0.006 . 1 . . . . 96 GLN H . 6755 1 1007 . 1 1 118 118 GLN HA H 1 4.229 0.006 . 1 . . . . 96 GLN HA . 6755 1 1008 . 1 1 118 118 GLN HB2 H 1 2.318 0.006 . 1 . . . . 96 GLN HB2 . 6755 1 1009 . 1 1 118 118 GLN HB3 H 1 1.988 0.006 . 1 . . . . 96 GLN HB3 . 6755 1 1010 . 1 1 118 118 GLN HG2 H 1 2.557 0.006 . 1 . . . . 96 GLN HG . 6755 1 1011 . 1 1 118 118 GLN HG3 H 1 2.557 0.006 . 1 . . . . 96 GLN HG . 6755 1 1012 . 1 1 118 118 GLN CA C 13 56.62 0.3 . 1 . . . . 96 GLN CA . 6755 1 1013 . 1 1 118 118 GLN CB C 13 30.08 0.3 . 1 . . . . 96 GLN CB . 6755 1 1014 . 1 1 118 118 GLN CG C 13 34.13 0.3 . 1 . . . . 96 GLN CG . 6755 1 1015 . 1 1 118 118 GLN N N 15 114.692 0.17 . 1 . . . . 96 GLN N . 6755 1 1016 . 1 1 119 119 GLY HA2 H 1 4.147 0.006 . 1 . . . . 97 GLY HA2 . 6755 1 1017 . 1 1 119 119 GLY HA3 H 1 3.802 0.006 . 1 . . . . 97 GLY HA3 . 6755 1 1018 . 1 1 119 119 GLY CA C 13 45.59 0.3 . 1 . . . . 97 GLY CA . 6755 1 1019 . 1 1 120 120 LYS H H 1 7.911 0.006 . 1 . . . . 98 LYS H . 6755 1 1020 . 1 1 120 120 LYS HA H 1 4.18 0.006 . 1 . . . . 98 LYS HA . 6755 1 1021 . 1 1 120 120 LYS HB2 H 1 1.922 0.006 . 1 . . . . 98 LYS HB2 . 6755 1 1022 . 1 1 120 120 LYS HB3 H 1 1.64 0.006 . 1 . . . . 98 LYS HB3 . 6755 1 1023 . 1 1 120 120 LYS HG2 H 1 1.403 0.006 . 1 . . . . 98 LYS HG2 . 6755 1 1024 . 1 1 120 120 LYS HG3 H 1 1.343 0.006 . 1 . . . . 98 LYS HG3 . 6755 1 1025 . 1 1 120 120 LYS HD2 H 1 1.652 0.006 . 1 . . . . 98 LYS HD2 . 6755 1 1026 . 1 1 120 120 LYS HD3 H 1 1.589 0.006 . 1 . . . . 98 LYS HD3 . 6755 1 1027 . 1 1 120 120 LYS HE2 H 1 2.928 0.006 . 1 . . . . 98 LYS QE . 6755 1 1028 . 1 1 120 120 LYS HE3 H 1 2.928 0.006 . 1 . . . . 98 LYS QE . 6755 1 1029 . 1 1 120 120 LYS CA C 13 57.139 0.3 . 1 . . . . 98 LYS CA . 6755 1 1030 . 1 1 120 120 LYS CB C 13 33.756 0.3 . 1 . . . . 98 LYS CB . 6755 1 1031 . 1 1 120 120 LYS CG C 13 25.43 0.3 . 1 . . . . 98 LYS CG . 6755 1 1032 . 1 1 120 120 LYS CD C 13 29.04 0.3 . 1 . . . . 98 LYS CD . 6755 1 1033 . 1 1 120 120 LYS N N 15 117.782 0.17 . 1 . . . . 98 LYS N . 6755 1 1034 . 1 1 121 121 ILE H H 1 6.863 0.006 . 1 . . . . 99 ILE H . 6755 1 1035 . 1 1 121 121 ILE HA H 1 4.439 0.006 . 1 . . . . 99 ILE HA . 6755 1 1036 . 1 1 121 121 ILE HB H 1 1.383 0.006 . 1 . . . . 99 ILE HB . 6755 1 1037 . 1 1 121 121 ILE HG12 H 1 1.273 0.006 . 1 . . . . 99 ILE HG1 . 6755 1 1038 . 1 1 121 121 ILE HG13 H 1 1.273 0.006 . 1 . . . . 99 ILE HG1 . 6755 1 1039 . 1 1 121 121 ILE HG21 H 1 0.838 0.006 . 1 . . . . 99 ILE HG2 . 6755 1 1040 . 1 1 121 121 ILE HG22 H 1 0.838 0.006 . 1 . . . . 99 ILE HG2 . 6755 1 1041 . 1 1 121 121 ILE HG23 H 1 0.838 0.006 . 1 . . . . 99 ILE HG2 . 6755 1 1042 . 1 1 121 121 ILE HD11 H 1 0.923 0.006 . 1 . . . . 99 ILE HD1 . 6755 1 1043 . 1 1 121 121 ILE HD12 H 1 0.923 0.006 . 1 . . . . 99 ILE HD1 . 6755 1 1044 . 1 1 121 121 ILE HD13 H 1 0.923 0.006 . 1 . . . . 99 ILE HD1 . 6755 1 1045 . 1 1 121 121 ILE CA C 13 59.19 0.3 . 1 . . . . 99 ILE CA . 6755 1 1046 . 1 1 121 121 ILE CB C 13 42.023 0.3 . 1 . . . . 99 ILE CB . 6755 1 1047 . 1 1 121 121 ILE CG1 C 13 27.088 0.3 . 1 . . . . 99 ILE CG1 . 6755 1 1048 . 1 1 121 121 ILE CG2 C 13 18.062 0.3 . 1 . . . . 99 ILE CG2 . 6755 1 1049 . 1 1 121 121 ILE CD1 C 13 15.047 0.3 . 1 . . . . 99 ILE CD1 . 6755 1 1050 . 1 1 121 121 ILE N N 15 114.528 0.17 . 1 . . . . 99 ILE N . 6755 1 1051 . 1 1 122 122 LYS H H 1 8.395 0.006 . 1 . . . . 100 LYS H . 6755 1 1052 . 1 1 122 122 LYS HA H 1 4.265 0.006 . 1 . . . . 100 LYS HA . 6755 1 1053 . 1 1 122 122 LYS HB2 H 1 1.714 0.006 . 1 . . . . 100 LYS HB2 . 6755 1 1054 . 1 1 122 122 LYS HB3 H 1 1.531 0.006 . 1 . . . . 100 LYS HB3 . 6755 1 1055 . 1 1 122 122 LYS HG2 H 1 1.266 0.006 . 1 . . . . 100 LYS HG . 6755 1 1056 . 1 1 122 122 LYS HG3 H 1 1.266 0.006 . 1 . . . . 100 LYS HG . 6755 1 1057 . 1 1 122 122 LYS HD2 H 1 1.565 0.006 . 1 . . . . 100 LYS HD . 6755 1 1058 . 1 1 122 122 LYS HD3 H 1 1.565 0.006 . 1 . . . . 100 LYS HD . 6755 1 1059 . 1 1 122 122 LYS HE2 H 1 2.893 0.006 . 1 . . . . 100 LYS QE . 6755 1 1060 . 1 1 122 122 LYS HE3 H 1 2.893 0.006 . 1 . . . . 100 LYS QE . 6755 1 1061 . 1 1 122 122 LYS CA C 13 55.261 0.3 . 1 . . . . 100 LYS CA . 6755 1 1062 . 1 1 122 122 LYS CB C 13 35.387 0.3 . 1 . . . . 100 LYS CB . 6755 1 1063 . 1 1 122 122 LYS CG C 13 24.63 0.3 . 1 . . . . 100 LYS CG . 6755 1 1064 . 1 1 122 122 LYS CD C 13 29.36 0.3 . 1 . . . . 100 LYS CD . 6755 1 1065 . 1 1 122 122 LYS CE C 13 41.97 0.3 . 1 . . . . 100 LYS CE . 6755 1 1066 . 1 1 122 122 LYS N N 15 124.56 0.17 . 1 . . . . 100 LYS N . 6755 1 1067 . 1 1 123 123 ASP H H 1 8.195 0.006 . 1 . . . . 101 ASP H . 6755 1 1068 . 1 1 123 123 ASP HA H 1 4.448 0.006 . 1 . . . . 101 ASP HA . 6755 1 1069 . 1 1 123 123 ASP HB2 H 1 2.395 0.006 . 1 . . . . 101 ASP HB2 . 6755 1 1070 . 1 1 123 123 ASP HB3 H 1 2.301 0.006 . 1 . . . . 101 ASP HB3 . 6755 1 1071 . 1 1 123 123 ASP CA C 13 55.4 0.3 . 1 . . . . 101 ASP CA . 6755 1 1072 . 1 1 123 123 ASP CB C 13 40.43 0.3 . 1 . . . . 101 ASP CB . 6755 1 1073 . 1 1 123 123 ASP N N 15 120.683 0.17 . 1 . . . . 101 ASP N . 6755 1 1074 . 1 1 124 124 ARG H H 1 8.599 0.006 . 1 . . . . 102 ARG H . 6755 1 1075 . 1 1 124 124 ARG HA H 1 4.513 0.006 . 1 . . . . 102 ARG HA . 6755 1 1076 . 1 1 124 124 ARG N N 15 121.202 0.17 . 1 . . . . 102 ARG N . 6755 1 1077 . 1 1 125 125 PRO HA H 1 4.291 0.006 . 1 . . . . 103 PRO HA . 6755 1 1078 . 1 1 125 125 PRO HB2 H 1 1.976 0.006 . 1 . . . . 103 PRO HB2 . 6755 1 1079 . 1 1 125 125 PRO HB3 H 1 1.704 0.006 . 1 . . . . 103 PRO HB3 . 6755 1 1080 . 1 1 125 125 PRO HG2 H 1 1.966 0.006 . 1 . . . . 103 PRO HG2 . 6755 1 1081 . 1 1 125 125 PRO HG3 H 1 1.862 0.006 . 1 . . . . 103 PRO HG3 . 6755 1 1082 . 1 1 125 125 PRO HD2 H 1 3.596 0.006 . 1 . . . . 103 PRO HD2 . 6755 1 1083 . 1 1 125 125 PRO HD3 H 1 3.227 0.006 . 1 . . . . 103 PRO HD3 . 6755 1 1084 . 1 1 125 125 PRO CA C 13 61.757 0.3 . 1 . . . . 103 PRO CA . 6755 1 1085 . 1 1 125 125 PRO CB C 13 30.76 0.3 . 1 . . . . 103 PRO CB . 6755 1 1086 . 1 1 125 125 PRO CG C 13 27.289 0.3 . 1 . . . . 103 PRO CG . 6755 1 1087 . 1 1 125 125 PRO CD C 13 49.367 0.3 . 1 . . . . 103 PRO CD . 6755 1 1088 . 1 1 126 126 VAL H H 1 8.436 0.006 . 1 . . . . 104 VAL HN . 6755 1 1089 . 1 1 126 126 VAL HA H 1 3.763 0.006 . 1 . . . . 104 VAL HA . 6755 1 1090 . 1 1 126 126 VAL HB H 1 1.843 0.006 . 1 . . . . 104 VAL HB . 6755 1 1091 . 1 1 126 126 VAL HG11 H 1 0.739 0.006 . 1 . . . . 104 VAL HG1 . 6755 1 1092 . 1 1 126 126 VAL HG12 H 1 0.739 0.006 . 1 . . . . 104 VAL HG1 . 6755 1 1093 . 1 1 126 126 VAL HG13 H 1 0.739 0.006 . 1 . . . . 104 VAL HG1 . 6755 1 1094 . 1 1 126 126 VAL HG21 H 1 0.705 0.006 . 1 . . . . 104 VAL HG2 . 6755 1 1095 . 1 1 126 126 VAL HG22 H 1 0.705 0.006 . 1 . . . . 104 VAL HG2 . 6755 1 1096 . 1 1 126 126 VAL HG23 H 1 0.705 0.006 . 1 . . . . 104 VAL HG2 . 6755 1 1097 . 1 1 126 126 VAL CA C 13 62.84 0.3 . 1 . . . . 104 VAL CA . 6755 1 1098 . 1 1 126 126 VAL CB C 13 31.495 0.3 . 1 . . . . 104 VAL CB . 6755 1 1099 . 1 1 126 126 VAL CG1 C 13 21.934 0.3 . 1 . . . . 104 VAL CG1 . 6755 1 1100 . 1 1 126 126 VAL CG2 C 13 21.63 0.3 . 1 . . . . 104 VAL CG2 . 6755 1 1101 . 1 1 126 126 VAL N N 15 127.579 0.17 . 1 . . . . 104 VAL N . 6755 1 1102 . 1 1 127 127 LYS H H 1 7.864 0.006 . 1 . . . . 105 LYS H . 6755 1 1103 . 1 1 127 127 LYS HA H 1 4.434 0.006 . 1 . . . . 105 LYS HA . 6755 1 1104 . 1 1 127 127 LYS HB2 H 1 1.542 0.006 . 1 . . . . 105 LYS HB2 . 6755 1 1105 . 1 1 127 127 LYS HB3 H 1 1.311 0.006 . 1 . . . . 105 LYS HB3 . 6755 1 1106 . 1 1 127 127 LYS HG2 H 1 1.286 0.006 . 1 . . . . 105 LYS HG . 6755 1 1107 . 1 1 127 127 LYS HG3 H 1 1.286 0.006 . 1 . . . . 105 LYS HG . 6755 1 1108 . 1 1 127 127 LYS HD2 H 1 1.595 0.006 . 1 . . . . 105 LYS HD . 6755 1 1109 . 1 1 127 127 LYS HD3 H 1 1.595 0.006 . 1 . . . . 105 LYS HD . 6755 1 1110 . 1 1 127 127 LYS HE2 H 1 3.013 0.006 . 1 . . . . 105 LYS QE . 6755 1 1111 . 1 1 127 127 LYS HE3 H 1 3.013 0.006 . 1 . . . . 105 LYS QE . 6755 1 1112 . 1 1 127 127 LYS CA C 13 54.91 0.3 . 1 . . . . 105 LYS CA . 6755 1 1113 . 1 1 127 127 LYS CB C 13 33.48 0.3 . 1 . . . . 105 LYS CB . 6755 1 1114 . 1 1 127 127 LYS CG C 13 25.21 0.3 . 1 . . . . 105 LYS CG . 6755 1 1115 . 1 1 127 127 LYS CD C 13 29.44 0.3 . 1 . . . . 105 LYS CD . 6755 1 1116 . 1 1 127 127 LYS CE C 13 41.99 0.3 . 1 . . . . 105 LYS CE . 6755 1 1117 . 1 1 127 127 LYS N N 15 130.636 0.17 . 1 . . . . 105 LYS N . 6755 1 1118 . 1 1 128 128 GLU H H 1 8.769 0.006 . 1 . . . . 106 GLU H . 6755 1 1119 . 1 1 128 128 GLU HA H 1 4.865 0.006 . 1 . . . . 106 GLU HA . 6755 1 1120 . 1 1 128 128 GLU HB2 H 1 1.988 0.006 . 1 . . . . 106 GLU HB . 6755 1 1121 . 1 1 128 128 GLU HB3 H 1 1.988 0.006 . 1 . . . . 106 GLU HB . 6755 1 1122 . 1 1 128 128 GLU HG2 H 1 2.283 0.006 . 1 . . . . 106 GLU HG . 6755 1 1123 . 1 1 128 128 GLU HG3 H 1 2.283 0.006 . 1 . . . . 106 GLU HG . 6755 1 1124 . 1 1 128 128 GLU CA C 13 56.301 0.3 . 1 . . . . 106 GLU CA . 6755 1 1125 . 1 1 128 128 GLU CB C 13 30.21 0.3 . 1 . . . . 106 GLU CB . 6755 1 1126 . 1 1 128 128 GLU CG C 13 36.784 0.3 . 1 . . . . 106 GLU CG . 6755 1 1127 . 1 1 128 128 GLU N N 15 128.351 0.17 . 1 . . . . 106 GLU N . 6755 1 1128 . 1 1 129 129 VAL H H 1 8.803 0.006 . 1 . . . . 107 VAL H . 6755 1 1129 . 1 1 129 129 VAL HA H 1 4.315 0.006 . 1 . . . . 107 VAL HA . 6755 1 1130 . 1 1 129 129 VAL HB H 1 1.947 0.006 . 1 . . . . 107 VAL HB . 6755 1 1131 . 1 1 129 129 VAL HG11 H 1 1.016 0.006 . 1 . . . . 107 VAL HG1 . 6755 1 1132 . 1 1 129 129 VAL HG12 H 1 1.016 0.006 . 1 . . . . 107 VAL HG1 . 6755 1 1133 . 1 1 129 129 VAL HG13 H 1 1.016 0.006 . 1 . . . . 107 VAL HG1 . 6755 1 1134 . 1 1 129 129 VAL HG21 H 1 0.961 0.006 . 1 . . . . 107 VAL HG2 . 6755 1 1135 . 1 1 129 129 VAL HG22 H 1 0.961 0.006 . 1 . . . . 107 VAL HG2 . 6755 1 1136 . 1 1 129 129 VAL HG23 H 1 0.961 0.006 . 1 . . . . 107 VAL HG2 . 6755 1 1137 . 1 1 129 129 VAL CA C 13 61.527 0.3 . 1 . . . . 107 VAL CA . 6755 1 1138 . 1 1 129 129 VAL CB C 13 35.332 0.3 . 1 . . . . 107 VAL CB . 6755 1 1139 . 1 1 129 129 VAL CG1 C 13 22.346 0.3 . 1 . . . . 107 VAL CG1 . 6755 1 1140 . 1 1 129 129 VAL CG2 C 13 21.88 0.3 . 1 . . . . 107 VAL CG2 . 6755 1 1141 . 1 1 129 129 VAL N N 15 123.77 0.17 . 1 . . . . 107 VAL N . 6755 1 1142 . 1 1 130 130 HIS HA H 1 5.116 0.006 . 1 . . . . 108 HIS HA . 6755 1 1143 . 1 1 130 130 HIS HB2 H 1 3.434 0.006 . 1 . . . . 108 HIS HB2 . 6755 1 1144 . 1 1 130 130 HIS HB3 H 1 3.054 0.006 . 1 . . . . 108 HIS HB3 . 6755 1 1145 . 1 1 130 130 HIS HD1 H 1 7.16 0.006 . 1 . . . . 108 HIS HD1 . 6755 1 1146 . 1 1 130 130 HIS HE1 H 1 6.942 0.006 . 1 . . . . 108 HIS HE1 . 6755 1 1147 . 1 1 130 130 HIS CA C 13 54.581 0.3 . 1 . . . . 108 HIS CA . 6755 1 1148 . 1 1 130 130 HIS CB C 13 30.34 0.3 . 1 . . . . 108 HIS CB . 6755 1 1149 . 1 1 131 131 GLU H H 1 7.369 0.006 . 1 . . . . 109 GLU H . 6755 1 1150 . 1 1 131 131 GLU HA H 1 4.486 0.006 . 1 . . . . 109 GLU HA . 6755 1 1151 . 1 1 131 131 GLU HB2 H 1 2.061 0.006 . 1 . . . . 109 GLU HB2 . 6755 1 1152 . 1 1 131 131 GLU HB3 H 1 1.894 0.006 . 1 . . . . 109 GLU HB3 . 6755 1 1153 . 1 1 131 131 GLU HG2 H 1 2.203 0.006 . 1 . . . . 109 GLU HG2 . 6755 1 1154 . 1 1 131 131 GLU HG3 H 1 2.09 0.006 . 1 . . . . 109 GLU HG3 . 6755 1 1155 . 1 1 131 131 GLU CA C 13 54.93 0.3 . 1 . . . . 109 GLU CA . 6755 1 1156 . 1 1 131 131 GLU CB C 13 33.201 0.3 . 1 . . . . 109 GLU CB . 6755 1 1157 . 1 1 131 131 GLU CG C 13 36.006 0.3 . 1 . . . . 109 GLU CG . 6755 1 1158 . 1 1 131 131 GLU N N 15 117.381 0.17 . 1 . . . . 109 GLU N . 6755 1 1159 . 1 1 132 132 GLU H H 1 8.706 0.006 . 1 . . . . 110 GLU H . 6755 1 1160 . 1 1 132 132 GLU HA H 1 4.146 0.006 . 1 . . . . 110 GLU HA . 6755 1 1161 . 1 1 132 132 GLU HB2 H 1 1.972 0.006 . 1 . . . . 110 GLU HB2 . 6755 1 1162 . 1 1 132 132 GLU HB3 H 1 1.864 0.006 . 1 . . . . 110 GLU HB3 . 6755 1 1163 . 1 1 132 132 GLU HG2 H 1 2.249 0.006 . 1 . . . . 110 GLU HG2 . 6755 1 1164 . 1 1 132 132 GLU HG3 H 1 2.113 0.006 . 1 . . . . 110 GLU HG3 . 6755 1 1165 . 1 1 132 132 GLU CA C 13 56.78 0.3 . 1 . . . . 110 GLU CA . 6755 1 1166 . 1 1 132 132 GLU CB C 13 29.804 0.3 . 1 . . . . 110 GLU CB . 6755 1 1167 . 1 1 132 132 GLU CG C 13 36.423 0.3 . 1 . . . . 110 GLU CG . 6755 1 1168 . 1 1 132 132 GLU N N 15 121.203 0.17 . 1 . . . . 110 GLU N . 6755 1 1169 . 1 1 133 133 TYR H H 1 7.611 0.006 . 1 . . . . 111 TYR H . 6755 1 1170 . 1 1 133 133 TYR HA H 1 4.574 0.006 . 1 . . . . 111 TYR HA . 6755 1 1171 . 1 1 133 133 TYR HB2 H 1 3.148 0.006 . 1 . . . . 111 TYR HB2 . 6755 1 1172 . 1 1 133 133 TYR HB3 H 1 2.899 0.006 . 1 . . . . 111 TYR HB3 . 6755 1 1173 . 1 1 133 133 TYR HD1 H 1 7.014 0.006 . 1 . . . . 111 TYR HD . 6755 1 1174 . 1 1 133 133 TYR HD2 H 1 7.014 0.006 . 1 . . . . 111 TYR HD . 6755 1 1175 . 1 1 133 133 TYR HE1 H 1 6.77 0.006 . 1 . . . . 111 TYR QE . 6755 1 1176 . 1 1 133 133 TYR HE2 H 1 6.77 0.006 . 1 . . . . 111 TYR QE . 6755 1 1177 . 1 1 133 133 TYR CA C 13 56.33 0.3 . 1 . . . . 111 TYR CA . 6755 1 1178 . 1 1 133 133 TYR CB C 13 38.06 0.3 . 1 . . . . 111 TYR CB . 6755 1 1179 . 1 1 133 133 TYR N N 15 122.134 0.17 . 1 . . . . 111 TYR N . 6755 1 1180 . 1 1 134 134 ASP H H 1 8.474 0.006 . 1 . . . . 112 ASP H . 6755 1 1181 . 1 1 134 134 ASP HA H 1 4.404 0.006 . 1 . . . . 112 ASP HA . 6755 1 1182 . 1 1 134 134 ASP HB2 H 1 2.906 0.006 . 1 . . . . 112 ASP HB2 . 6755 1 1183 . 1 1 134 134 ASP HB3 H 1 2.508 0.006 . 1 . . . . 112 ASP HB3 . 6755 1 1184 . 1 1 134 134 ASP CA C 13 54.16 0.3 . 1 . . . . 112 ASP CA . 6755 1 1185 . 1 1 134 134 ASP CB C 13 40.42 0.3 . 1 . . . . 112 ASP CB . 6755 1 1186 . 1 1 134 134 ASP N N 15 118.352 0.17 . 1 . . . . 112 ASP N . 6755 1 1187 . 1 1 135 135 LEU H H 1 8.004 0.006 . 1 . . . . 113 LEU H . 6755 1 1188 . 1 1 135 135 LEU HA H 1 3.454 0.006 . 1 . . . . 113 LEU HA . 6755 1 1189 . 1 1 135 135 LEU HB2 H 1 0.932 0.006 . 1 . . . . 113 LEU HB . 6755 1 1190 . 1 1 135 135 LEU HB3 H 1 0.932 0.006 . 1 . . . . 113 LEU HB . 6755 1 1191 . 1 1 135 135 LEU HG H 1 1.146 0.006 . 1 . . . . 113 LEU HG . 6755 1 1192 . 1 1 135 135 LEU HD11 H 1 0.009 0.006 . 1 . . . . 113 LEU HD1 . 6755 1 1193 . 1 1 135 135 LEU HD12 H 1 0.009 0.006 . 1 . . . . 113 LEU HD1 . 6755 1 1194 . 1 1 135 135 LEU HD13 H 1 0.009 0.006 . 1 . . . . 113 LEU HD1 . 6755 1 1195 . 1 1 135 135 LEU HD21 H 1 -0.262 0.006 . 1 . . . . 113 LEU HD2 . 6755 1 1196 . 1 1 135 135 LEU HD22 H 1 -0.262 0.006 . 1 . . . . 113 LEU HD2 . 6755 1 1197 . 1 1 135 135 LEU HD23 H 1 -0.262 0.006 . 1 . . . . 113 LEU HD2 . 6755 1 1198 . 1 1 135 135 LEU CA C 13 56.796 0.3 . 1 . . . . 113 LEU CA . 6755 1 1199 . 1 1 135 135 LEU CB C 13 40.714 0.3 . 1 . . . . 113 LEU CB . 6755 1 1200 . 1 1 135 135 LEU CD1 C 13 24.759 0.3 . 1 . . . . 113 LEU CD1 . 6755 1 1201 . 1 1 135 135 LEU CD2 C 13 21.423 0.3 . 1 . . . . 113 LEU CD2 . 6755 1 1202 . 1 1 135 135 LEU N N 15 127.457 0.17 . 1 . . . . 113 LEU N . 6755 1 1203 . 1 1 136 136 TRP H H 1 8.104 0.006 . 1 . . . . 114 TRP H . 6755 1 1204 . 1 1 136 136 TRP HA H 1 3.955 0.006 . 1 . . . . 114 TRP HA . 6755 1 1205 . 1 1 136 136 TRP HB2 H 1 3.231 0.006 . 1 . . . . 114 TRP HB2 . 6755 1 1206 . 1 1 136 136 TRP HB3 H 1 3.012 0.006 . 1 . . . . 114 TRP HB3 . 6755 1 1207 . 1 1 136 136 TRP HD1 H 1 6.815 0.006 . 1 . . . . 114 TRP HD1 . 6755 1 1208 . 1 1 136 136 TRP HE1 H 1 10.566 0.006 . 1 . . . . 114 TRP HE1 . 6755 1 1209 . 1 1 136 136 TRP CA C 13 59.022 0.3 . 1 . . . . 114 TRP CA . 6755 1 1210 . 1 1 136 136 TRP CB C 13 27.972 0.3 . 1 . . . . 114 TRP CB . 6755 1 1211 . 1 1 136 136 TRP N N 15 119.258 0.17 . 1 . . . . 114 TRP N . 6755 1 1212 . 1 1 136 136 TRP NE1 N 15 130.224 0.17 . 1 . . . . 114 TRP NE1 . 6755 1 1213 . 1 1 137 137 GLU H H 1 7.768 0.006 . 1 . . . . 115 GLU H . 6755 1 1214 . 1 1 137 137 GLU HA H 1 4.515 0.006 . 1 . . . . 115 GLU HA . 6755 1 1215 . 1 1 137 137 GLU HB2 H 1 2.387 0.006 . 1 . . . . 115 GLU HB2 . 6755 1 1216 . 1 1 137 137 GLU HB3 H 1 1.994 0.006 . 1 . . . . 115 GLU HB3 . 6755 1 1217 . 1 1 137 137 GLU HG2 H 1 2.297 0.006 . 1 . . . . 115 GLU HG2 . 6755 1 1218 . 1 1 137 137 GLU HG3 H 1 2.087 0.006 . 1 . . . . 115 GLU HG3 . 6755 1 1219 . 1 1 137 137 GLU CA C 13 54.9 0.3 . 1 . . . . 115 GLU CA . 6755 1 1220 . 1 1 137 137 GLU CB C 13 29.81 0.3 . 1 . . . . 115 GLU CB . 6755 1 1221 . 1 1 137 137 GLU CG C 13 36.062 0.3 . 1 . . . . 115 GLU CG . 6755 1 1222 . 1 1 137 137 GLU N N 15 114.903 0.17 . 1 . . . . 115 GLU N . 6755 1 1223 . 1 1 138 138 ASP H H 1 7.379 0.006 . 1 . . . . 116 ASP H . 6755 1 1224 . 1 1 138 138 ASP HA H 1 4.79 0.006 . 1 . . . . 116 ASP HA . 6755 1 1225 . 1 1 138 138 ASP HB2 H 1 2.894 0.006 . 1 . . . . 116 ASP HB . 6755 1 1226 . 1 1 138 138 ASP HB3 H 1 2.894 0.006 . 1 . . . . 116 ASP HB . 6755 1 1227 . 1 1 138 138 ASP CA C 13 54.081 0.3 . 1 . . . . 116 ASP CA . 6755 1 1228 . 1 1 138 138 ASP CB C 13 44.77 0.3 . 1 . . . . 116 ASP CB . 6755 1 1229 . 1 1 138 138 ASP N N 15 122.314 0.17 . 1 . . . . 116 ASP N . 6755 1 1230 . 1 1 139 139 PRO HA H 1 4.452 0.006 . 1 . . . . 117 PRO HA . 6755 1 1231 . 1 1 139 139 PRO HB2 H 1 2.372 0.006 . 1 . . . . 117 PRO HB2 . 6755 1 1232 . 1 1 139 139 PRO HB3 H 1 1.892 0.006 . 1 . . . . 117 PRO HB3 . 6755 1 1233 . 1 1 139 139 PRO HG2 H 1 1.983 0.006 . 1 . . . . 117 PRO HG2 . 6755 1 1234 . 1 1 139 139 PRO HG3 H 1 1.872 0.006 . 1 . . . . 117 PRO HG3 . 6755 1 1235 . 1 1 139 139 PRO HD2 H 1 3.823 0.006 . 1 . . . . 117 PRO HD2 . 6755 1 1236 . 1 1 139 139 PRO HD3 H 1 3.63 0.006 . 1 . . . . 117 PRO HD3 . 6755 1 1237 . 1 1 139 139 PRO CA C 13 65.036 0.3 . 1 . . . . 117 PRO CA . 6755 1 1238 . 1 1 139 139 PRO CB C 13 32.19 0.3 . 1 . . . . 117 PRO CB . 6755 1 1239 . 1 1 139 139 PRO CG C 13 27.08 0.3 . 1 . . . . 117 PRO CG . 6755 1 1240 . 1 1 139 139 PRO CD C 13 51.536 0.3 . 1 . . . . 117 PRO CD . 6755 1 1241 . 1 1 140 140 ILE H H 1 9.683 0.006 . 1 . . . . 118 ILE H . 6755 1 1242 . 1 1 140 140 ILE HA H 1 3.872 0.006 . 1 . . . . 118 ILE HA . 6755 1 1243 . 1 1 140 140 ILE HB H 1 1.577 0.006 . 1 . . . . 118 ILE HB . 6755 1 1244 . 1 1 140 140 ILE HG12 H 1 1.073 0.006 . 1 . . . . 118 ILE HG1 . 6755 1 1245 . 1 1 140 140 ILE HG13 H 1 1.073 0.006 . 1 . . . . 118 ILE HG1 . 6755 1 1246 . 1 1 140 140 ILE HG21 H 1 0.77 0.006 . 1 . . . . 118 ILE HG2 . 6755 1 1247 . 1 1 140 140 ILE HG22 H 1 0.77 0.006 . 1 . . . . 118 ILE HG2 . 6755 1 1248 . 1 1 140 140 ILE HG23 H 1 0.77 0.006 . 1 . . . . 118 ILE HG2 . 6755 1 1249 . 1 1 140 140 ILE HD11 H 1 0.386 0.006 . 1 . . . . 118 ILE HD1 . 6755 1 1250 . 1 1 140 140 ILE HD12 H 1 0.386 0.006 . 1 . . . . 118 ILE HD1 . 6755 1 1251 . 1 1 140 140 ILE HD13 H 1 0.386 0.006 . 1 . . . . 118 ILE HD1 . 6755 1 1252 . 1 1 140 140 ILE CA C 13 63.58 0.3 . 1 . . . . 118 ILE CA . 6755 1 1253 . 1 1 140 140 ILE CB C 13 37.726 0.3 . 1 . . . . 118 ILE CB . 6755 1 1254 . 1 1 140 140 ILE CG1 C 13 28.777 0.3 . 1 . . . . 118 ILE CG1 . 6755 1 1255 . 1 1 140 140 ILE CD1 C 13 14.619 0.3 . 1 . . . . 118 ILE CD1 . 6755 1 1256 . 1 1 140 140 ILE N N 15 122.084 0.17 . 1 . . . . 118 ILE N . 6755 1 1257 . 1 1 141 141 TRP H H 1 7.304 0.006 . 1 . . . . 119 TRP H . 6755 1 1258 . 1 1 141 141 TRP HA H 1 4.272 0.006 . 1 . . . . 119 TRP HA . 6755 1 1259 . 1 1 141 141 TRP HB2 H 1 3.453 0.006 . 1 . . . . 119 TRP HB . 6755 1 1260 . 1 1 141 141 TRP HB3 H 1 3.453 0.006 . 1 . . . . 119 TRP HB . 6755 1 1261 . 1 1 141 141 TRP HE1 H 1 9.792 0.006 . 1 . . . . 119 TRP HE1 . 6755 1 1262 . 1 1 141 141 TRP CA C 13 58.506 0.3 . 1 . . . . 119 TRP CA . 6755 1 1263 . 1 1 141 141 TRP CB C 13 29.377 0.3 . 1 . . . . 119 TRP CB . 6755 1 1264 . 1 1 141 141 TRP N N 15 120.379 0.17 . 1 . . . . 119 TRP N . 6755 1 1265 . 1 1 141 141 TRP NE1 N 15 127.539 0.17 . 1 . . . . 119 TRP NE1 . 6755 1 1266 . 1 1 142 142 GLN H H 1 7.884 0.006 . 1 . . . . 120 GLN H . 6755 1 1267 . 1 1 142 142 GLN HA H 1 4.285 0.006 . 1 . . . . 120 GLN HA . 6755 1 1268 . 1 1 142 142 GLN HB2 H 1 2.155 0.006 . 1 . . . . 120 GLN HB2 . 6755 1 1269 . 1 1 142 142 GLN HB3 H 1 1.96 0.006 . 1 . . . . 120 GLN HB3 . 6755 1 1270 . 1 1 142 142 GLN HG2 H 1 2.543 0.006 . 1 . . . . 120 GLN HG . 6755 1 1271 . 1 1 142 142 GLN HG3 H 1 2.543 0.006 . 1 . . . . 120 GLN HG . 6755 1 1272 . 1 1 142 142 GLN CA C 13 56 0.3 . 1 . . . . 120 GLN CA . 6755 1 1273 . 1 1 142 142 GLN CB C 13 28.88 0.3 . 1 . . . . 120 GLN CB . 6755 1 1274 . 1 1 142 142 GLN CG C 13 34.22 0.3 . 1 . . . . 120 GLN CG . 6755 1 1275 . 1 1 142 142 GLN N N 15 116.78 0.17 . 1 . . . . 120 GLN N . 6755 1 1276 . 1 1 143 143 TYR H H 1 7.598 0.006 . 1 . . . . 121 TYR H . 6755 1 1277 . 1 1 143 143 TYR HA H 1 4.522 0.006 . 1 . . . . 121 TYR HA . 6755 1 1278 . 1 1 143 143 TYR HB2 H 1 2.908 0.006 . 1 . . . . 121 TYR HB2 . 6755 1 1279 . 1 1 143 143 TYR HB3 H 1 2.755 0.006 . 1 . . . . 121 TYR HB3 . 6755 1 1280 . 1 1 143 143 TYR HD1 H 1 7.042 0.006 . 1 . . . . 121 TYR HD . 6755 1 1281 . 1 1 143 143 TYR HD2 H 1 7.042 0.006 . 1 . . . . 121 TYR HD . 6755 1 1282 . 1 1 143 143 TYR HE1 H 1 6.679 0.006 . 1 . . . . 121 TYR QE . 6755 1 1283 . 1 1 143 143 TYR HE2 H 1 6.679 0.006 . 1 . . . . 121 TYR QE . 6755 1 1284 . 1 1 143 143 TYR CA C 13 58.02 0.3 . 1 . . . . 121 TYR CA . 6755 1 1285 . 1 1 143 143 TYR CB C 13 38.29 0.3 . 1 . . . . 121 TYR CB . 6755 1 1286 . 1 1 143 143 TYR N N 15 120.297 0.17 . 1 . . . . 121 TYR N . 6755 1 1287 . 1 1 144 144 ILE H H 1 7.982 0.006 . 1 . . . . 122 ILE H . 6755 1 1288 . 1 1 144 144 ILE HA H 1 4.096 0.006 . 1 . . . . 122 ILE HA . 6755 1 1289 . 1 1 144 144 ILE HB H 1 1.802 0.006 . 1 . . . . 122 ILE HB . 6755 1 1290 . 1 1 144 144 ILE HG12 H 1 1.382 0.006 . 1 . . . . 122 ILE HG12 . 6755 1 1291 . 1 1 144 144 ILE HG13 H 1 1.123 0.006 . 1 . . . . 122 ILE HG13 . 6755 1 1292 . 1 1 144 144 ILE HG21 H 1 0.838 0.006 . 1 . . . . 122 ILE HG2 . 6755 1 1293 . 1 1 144 144 ILE HG22 H 1 0.838 0.006 . 1 . . . . 122 ILE HG2 . 6755 1 1294 . 1 1 144 144 ILE HG23 H 1 0.838 0.006 . 1 . . . . 122 ILE HG2 . 6755 1 1295 . 1 1 144 144 ILE HD11 H 1 0.794 0.006 . 1 . . . . 122 ILE HD1 . 6755 1 1296 . 1 1 144 144 ILE HD12 H 1 0.794 0.006 . 1 . . . . 122 ILE HD1 . 6755 1 1297 . 1 1 144 144 ILE HD13 H 1 0.794 0.006 . 1 . . . . 122 ILE HD1 . 6755 1 1298 . 1 1 144 144 ILE CA C 13 61.15 0.3 . 1 . . . . 122 ILE CA . 6755 1 1299 . 1 1 144 144 ILE CB C 13 38.741 0.3 . 1 . . . . 122 ILE CB . 6755 1 1300 . 1 1 144 144 ILE CG1 C 13 27.141 0.3 . 1 . . . . 122 ILE CG1 . 6755 1 1301 . 1 1 144 144 ILE CG2 C 13 17.429 0.3 . 1 . . . . 122 ILE CG2 . 6755 1 1302 . 1 1 144 144 ILE CD1 C 13 13.04 0.3 . 1 . . . . 122 ILE CD1 . 6755 1 1303 . 1 1 144 144 ILE N N 15 124.427 0.17 . 1 . . . . 122 ILE N . 6755 1 stop_ save_