data_16883 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16883 _Entry.Title ; the N-terminal domain of human H-REV107 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-04-20 _Entry.Accession_date 2010-04-20 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'The N-terminal domain represents the residues 1-125 in the sequence of H-REV107.' _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 Xiaobai Ren . . . 16883 2 Bin Xia . . . 16883 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16883 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 518 16883 '15N chemical shifts' 116 16883 '1H chemical shifts' 800 16883 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 3 . . 2010-10-05 2010-04-20 update BMRB 'Update entry citation' 16883 2 . . 2010-09-02 2010-04-20 update author 'correct chemical shift' 16883 1 . . 2010-06-15 2010-04-20 original author 'original release' 16883 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16883 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20526701 _Citation.Full_citation . _Citation.Title '1H, 13C and 15N resonance assignments of human H-REV107 N-terminal domain.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 4 _Citation.Journal_issue 2 _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 175 _Citation.Page_last 178 _Citation.Year 2010 _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 Xiaobai Ren . . . 16883 1 2 Jian Lin . . . 16883 1 3 Changwen Jin . . . 16883 1 4 Bin Xia . . . 16883 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID H-REV107 16883 1 NMR 16883 1 'N-terminal domain' 16883 1 'tumor suppressor' 16883 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16883 _Assembly.ID 1 _Assembly.Name H-REV107N _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 13963 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 H-REV107N 1 $H-REV107N A . yes native no no . . . 16883 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_H-REV107N _Entity.Sf_category entity _Entity.Sf_framecode H-REV107N _Entity.Entry_ID 16883 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name H-REV107N _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 ; MRAPIPEPKPGDLIEIFRPF YRHWAIYVGDGYVVHLAPPS EVAGAGAASVMSALTDKAIV KKELLYDVAGSDKYQVNNKH DDKYSPLPCSKIIQRAEELV GQEVLYKLTSENCEHFVNEL RYGVA ; _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 125 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2KYT . "Solution Struture Of The H-Rev107 N-Terminal Domain" . . . . . 100.00 125 100.00 100.00 5.54e-86 . . . . 16883 1 2 no PDB 4DOT . "Crystal Structure Of Human Hrasls3" . . . . . 100.00 140 100.00 100.00 7.04e-86 . . . . 16883 1 3 no PDB 4FA0 . "Crystal Structure Of Human Adpla To 2.65 A Resolution" . . . . . 100.00 137 100.00 100.00 3.17e-86 . . . . 16883 1 4 no DBJ BAB08108 . "H-REV107 protein homolog [Homo sapiens]" . . . . . 100.00 162 100.00 100.00 1.35e-86 . . . . 16883 1 5 no DBJ BAG35901 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 162 100.00 100.00 1.35e-86 . . . . 16883 1 6 no DBJ BAH08749 . "Ca-independent phospholipase A1/2 [Homo sapiens]" . . . . . 100.00 162 99.20 100.00 2.95e-86 . . . . 16883 1 7 no DBJ BAI46481 . "phospholipase A2, group XVI [synthetic construct]" . . . . . 100.00 162 100.00 100.00 1.35e-86 . . . . 16883 1 8 no EMBL CAA63423 . "orf [Homo sapiens]" . . . . . 100.00 162 99.20 100.00 2.95e-86 . . . . 16883 1 9 no EMBL CAH92805 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 162 100.00 100.00 1.06e-86 . . . . 16883 1 10 no GB AAH01387 . "Phospholipase A2, group XVI [Homo sapiens]" . . . . . 100.00 162 100.00 100.00 1.35e-86 . . . . 16883 1 11 no GB AAI03808 . "Phospholipase A2, group XVI [Homo sapiens]" . . . . . 100.00 162 100.00 100.00 1.35e-86 . . . . 16883 1 12 no GB AAI03809 . "PLA2G16 protein, partial [Homo sapiens]" . . . . . 86.40 193 97.22 97.22 4.44e-67 . . . . 16883 1 13 no GB AAL26892 . "HREV107-3 [Homo sapiens]" . . . . . 100.00 162 100.00 100.00 1.35e-86 . . . . 16883 1 14 no GB ABM83494 . "HRAS-like suppressor 3 [synthetic construct]" . . . . . 100.00 162 100.00 100.00 1.35e-86 . . . . 16883 1 15 no REF NP_001121675 . "HRAS-like suppressor 3 [Homo sapiens]" . . . . . 100.00 162 100.00 100.00 1.35e-86 . . . . 16883 1 16 no REF NP_001128980 . "HRAS-like suppressor 3 [Pongo abelii]" . . . . . 100.00 162 100.00 100.00 1.06e-86 . . . . 16883 1 17 no REF NP_001244356 . "group XVI phospholipase A2 [Macaca mulatta]" . . . . . 100.00 162 97.60 98.40 2.27e-83 . . . . 16883 1 18 no REF NP_009000 . "HRAS-like suppressor 3 [Homo sapiens]" . . . . . 100.00 162 100.00 100.00 1.35e-86 . . . . 16883 1 19 no REF XP_002833696 . "PREDICTED: HRAS-like suppressor 3 [Pongo abelii]" . . . . . 60.80 154 100.00 100.00 3.55e-45 . . . . 16883 1 20 no SP P53816 . "RecName: Full=HRAS-like suppressor 3; Short=HRSL3; AltName: Full=Adipose-specific phospholipase A2; Short=AdPLA; AltName: Full=" . . . . . 100.00 162 100.00 100.00 1.35e-86 . . . . 16883 1 21 no SP Q5R611 . "RecName: Full=HRAS-like suppressor 3; Short=HRSL3; AltName: Full=Group XVI phospholipase A1/A2; AltName: Full=H-rev 107 protein" . . . . . 100.00 162 100.00 100.00 1.06e-86 . . . . 16883 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'phospholipase A1/2' 16883 1 'tumor suppressor' 16883 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 16883 1 2 . ARG . 16883 1 3 . ALA . 16883 1 4 . PRO . 16883 1 5 . ILE . 16883 1 6 . PRO . 16883 1 7 . GLU . 16883 1 8 . PRO . 16883 1 9 . LYS . 16883 1 10 . PRO . 16883 1 11 . GLY . 16883 1 12 . ASP . 16883 1 13 . LEU . 16883 1 14 . ILE . 16883 1 15 . GLU . 16883 1 16 . ILE . 16883 1 17 . PHE . 16883 1 18 . ARG . 16883 1 19 . PRO . 16883 1 20 . PHE . 16883 1 21 . TYR . 16883 1 22 . ARG . 16883 1 23 . HIS . 16883 1 24 . TRP . 16883 1 25 . ALA . 16883 1 26 . ILE . 16883 1 27 . TYR . 16883 1 28 . VAL . 16883 1 29 . GLY . 16883 1 30 . ASP . 16883 1 31 . GLY . 16883 1 32 . TYR . 16883 1 33 . VAL . 16883 1 34 . VAL . 16883 1 35 . HIS . 16883 1 36 . LEU . 16883 1 37 . ALA . 16883 1 38 . PRO . 16883 1 39 . PRO . 16883 1 40 . SER . 16883 1 41 . GLU . 16883 1 42 . VAL . 16883 1 43 . ALA . 16883 1 44 . GLY . 16883 1 45 . ALA . 16883 1 46 . GLY . 16883 1 47 . ALA . 16883 1 48 . ALA . 16883 1 49 . SER . 16883 1 50 . VAL . 16883 1 51 . MET . 16883 1 52 . SER . 16883 1 53 . ALA . 16883 1 54 . LEU . 16883 1 55 . THR . 16883 1 56 . ASP . 16883 1 57 . LYS . 16883 1 58 . ALA . 16883 1 59 . ILE . 16883 1 60 . VAL . 16883 1 61 . LYS . 16883 1 62 . LYS . 16883 1 63 . GLU . 16883 1 64 . LEU . 16883 1 65 . LEU . 16883 1 66 . TYR . 16883 1 67 . ASP . 16883 1 68 . VAL . 16883 1 69 . ALA . 16883 1 70 . GLY . 16883 1 71 . SER . 16883 1 72 . ASP . 16883 1 73 . LYS . 16883 1 74 . TYR . 16883 1 75 . GLN . 16883 1 76 . VAL . 16883 1 77 . ASN . 16883 1 78 . ASN . 16883 1 79 . LYS . 16883 1 80 . HIS . 16883 1 81 . ASP . 16883 1 82 . ASP . 16883 1 83 . LYS . 16883 1 84 . TYR . 16883 1 85 . SER . 16883 1 86 . PRO . 16883 1 87 . LEU . 16883 1 88 . PRO . 16883 1 89 . CYS . 16883 1 90 . SER . 16883 1 91 . LYS . 16883 1 92 . ILE . 16883 1 93 . ILE . 16883 1 94 . GLN . 16883 1 95 . ARG . 16883 1 96 . ALA . 16883 1 97 . GLU . 16883 1 98 . GLU . 16883 1 99 . LEU . 16883 1 100 . VAL . 16883 1 101 . GLY . 16883 1 102 . GLN . 16883 1 103 . GLU . 16883 1 104 . VAL . 16883 1 105 . LEU . 16883 1 106 . TYR . 16883 1 107 . LYS . 16883 1 108 . LEU . 16883 1 109 . THR . 16883 1 110 . SER . 16883 1 111 . GLU . 16883 1 112 . ASN . 16883 1 113 . CYS . 16883 1 114 . GLU . 16883 1 115 . HIS . 16883 1 116 . PHE . 16883 1 117 . VAL . 16883 1 118 . ASN . 16883 1 119 . GLU . 16883 1 120 . LEU . 16883 1 121 . ARG . 16883 1 122 . TYR . 16883 1 123 . GLY . 16883 1 124 . VAL . 16883 1 125 . ALA . 16883 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 16883 1 . ARG 2 2 16883 1 . ALA 3 3 16883 1 . PRO 4 4 16883 1 . ILE 5 5 16883 1 . PRO 6 6 16883 1 . GLU 7 7 16883 1 . PRO 8 8 16883 1 . LYS 9 9 16883 1 . PRO 10 10 16883 1 . GLY 11 11 16883 1 . ASP 12 12 16883 1 . LEU 13 13 16883 1 . ILE 14 14 16883 1 . GLU 15 15 16883 1 . ILE 16 16 16883 1 . PHE 17 17 16883 1 . ARG 18 18 16883 1 . PRO 19 19 16883 1 . PHE 20 20 16883 1 . TYR 21 21 16883 1 . ARG 22 22 16883 1 . HIS 23 23 16883 1 . TRP 24 24 16883 1 . ALA 25 25 16883 1 . ILE 26 26 16883 1 . TYR 27 27 16883 1 . VAL 28 28 16883 1 . GLY 29 29 16883 1 . ASP 30 30 16883 1 . GLY 31 31 16883 1 . TYR 32 32 16883 1 . VAL 33 33 16883 1 . VAL 34 34 16883 1 . HIS 35 35 16883 1 . LEU 36 36 16883 1 . ALA 37 37 16883 1 . PRO 38 38 16883 1 . PRO 39 39 16883 1 . SER 40 40 16883 1 . GLU 41 41 16883 1 . VAL 42 42 16883 1 . ALA 43 43 16883 1 . GLY 44 44 16883 1 . ALA 45 45 16883 1 . GLY 46 46 16883 1 . ALA 47 47 16883 1 . ALA 48 48 16883 1 . SER 49 49 16883 1 . VAL 50 50 16883 1 . MET 51 51 16883 1 . SER 52 52 16883 1 . ALA 53 53 16883 1 . LEU 54 54 16883 1 . THR 55 55 16883 1 . ASP 56 56 16883 1 . LYS 57 57 16883 1 . ALA 58 58 16883 1 . ILE 59 59 16883 1 . VAL 60 60 16883 1 . LYS 61 61 16883 1 . LYS 62 62 16883 1 . GLU 63 63 16883 1 . LEU 64 64 16883 1 . LEU 65 65 16883 1 . TYR 66 66 16883 1 . ASP 67 67 16883 1 . VAL 68 68 16883 1 . ALA 69 69 16883 1 . GLY 70 70 16883 1 . SER 71 71 16883 1 . ASP 72 72 16883 1 . LYS 73 73 16883 1 . TYR 74 74 16883 1 . GLN 75 75 16883 1 . VAL 76 76 16883 1 . ASN 77 77 16883 1 . ASN 78 78 16883 1 . LYS 79 79 16883 1 . HIS 80 80 16883 1 . ASP 81 81 16883 1 . ASP 82 82 16883 1 . LYS 83 83 16883 1 . TYR 84 84 16883 1 . SER 85 85 16883 1 . PRO 86 86 16883 1 . LEU 87 87 16883 1 . PRO 88 88 16883 1 . CYS 89 89 16883 1 . SER 90 90 16883 1 . LYS 91 91 16883 1 . ILE 92 92 16883 1 . ILE 93 93 16883 1 . GLN 94 94 16883 1 . ARG 95 95 16883 1 . ALA 96 96 16883 1 . GLU 97 97 16883 1 . GLU 98 98 16883 1 . LEU 99 99 16883 1 . VAL 100 100 16883 1 . GLY 101 101 16883 1 . GLN 102 102 16883 1 . GLU 103 103 16883 1 . VAL 104 104 16883 1 . LEU 105 105 16883 1 . TYR 106 106 16883 1 . LYS 107 107 16883 1 . LEU 108 108 16883 1 . THR 109 109 16883 1 . SER 110 110 16883 1 . GLU 111 111 16883 1 . ASN 112 112 16883 1 . CYS 113 113 16883 1 . GLU 114 114 16883 1 . HIS 115 115 16883 1 . PHE 116 116 16883 1 . VAL 117 117 16883 1 . ASN 118 118 16883 1 . GLU 119 119 16883 1 . LEU 120 120 16883 1 . ARG 121 121 16883 1 . TYR 122 122 16883 1 . GLY 123 123 16883 1 . VAL 124 124 16883 1 . ALA 125 125 16883 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 16883 _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 $H-REV107N . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 16883 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 16883 _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 $H-REV107N . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pET24a . . . . . . 16883 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16883 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 H-REV107N '[U-13C; U-15N]' . . 1 $H-REV107N . . 1 . . mM . . . . 16883 1 2 'sodium phosphate' 'natural abundance' . . . . . . 30 . . mM . . . . 16883 1 3 'sodium chloride' 'natural abundance' . . . . . . 30 . . mM . . . . 16883 1 4 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 16883 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16883 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16883 1 7 'sodium azide' 'natural abundance' . . . . . . 0.05 . . w/v . . . . 16883 1 8 DSS 'natural abundance' . . . . . . 0.02 . . w/v . . . . 16883 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16883 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 60 . mM 16883 1 pH 7.0 . pH 16883 1 pressure 1 . atm 16883 1 temperature 298 . K 16883 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 16883 _Software.ID 1 _Software.Name NMRPipe _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 16883 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16883 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 16883 _Software.ID 2 _Software.Name NMRView _Software.Version 5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 16883 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16883 2 stop_ save_ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 16883 _Software.ID 3 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16883 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16883 3 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 16883 _Software.ID 4 _Software.Name TOPSPIN _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16883 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16883 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 16883 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details Cryoprobe _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16883 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details Cryoprobe _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16883 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 500 Cryoprobe . . 16883 1 2 spectrometer_2 Bruker Avance . 600 Cryoprobe . . 16883 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 16883 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16883 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16883 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16883 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16883 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16883 1 6 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16883 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16883 1 8 '3D (H)CCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16883 1 9 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16883 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16883 _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 na indirect 0.251449530 . . . . . . . . . 16883 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . . . . . 16883 1 N 15 DSS 'methyl protons' . . . . ppm 0 na indirect 0.101329118 . . . . . . . . . 16883 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16883 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 16883 1 2 '2D 1H-13C HSQC' . . . 16883 1 3 '3D HNCACB' . . . 16883 1 4 '3D CBCA(CO)NH' . . . 16883 1 5 '3D HNCO' . . . 16883 1 6 '3D HCCH-TOCSY' . . . 16883 1 7 '3D HBHA(CO)NH' . . . 16883 1 8 '3D (H)CCH-COSY' . . . 16883 1 9 '3D HCCH-COSY' . . . 16883 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HE1 H 1 1.964 . . 1 . . . . 1 M HE1 . 16883 1 2 . 1 1 1 1 MET HE2 H 1 1.964 . . 1 . . . . 1 M HE1 . 16883 1 3 . 1 1 1 1 MET HE3 H 1 1.964 . . 1 . . . . 1 M HE1 . 16883 1 4 . 1 1 1 1 MET CE C 13 17.096 . . 1 . . . . 1 M CE . 16883 1 5 . 1 1 2 2 ARG H H 1 8.249 . . 1 . . . . 2 R HN . 16883 1 6 . 1 1 2 2 ARG HA H 1 4.302 . . 1 . . . . 2 R HA . 16883 1 7 . 1 1 2 2 ARG HB2 H 1 1.701 . . 2 . . . . 2 R HB1 . 16883 1 8 . 1 1 2 2 ARG HB3 H 1 1.754 . . 2 . . . . 2 R HB2 . 16883 1 9 . 1 1 2 2 ARG HD2 H 1 3.062 . . 2 . . . . 2 R HD1 . 16883 1 10 . 1 1 2 2 ARG HD3 H 1 3.123 . . 2 . . . . 2 R HD2 . 16883 1 11 . 1 1 2 2 ARG HG2 H 1 1.573 . . 2 . . . . 2 R HG2 . 16883 1 12 . 1 1 2 2 ARG CA C 13 56.240 . . 1 . . . . 2 R CA . 16883 1 13 . 1 1 2 2 ARG CB C 13 31.030 . . 1 . . . . 2 R CB . 16883 1 14 . 1 1 2 2 ARG CD C 13 43.634 . . 1 . . . . 2 R CD . 16883 1 15 . 1 1 2 2 ARG CG C 13 27.355 . . 1 . . . . 2 R CG . 16883 1 16 . 1 1 2 2 ARG N N 15 127.164 . . 1 . . . . 2 R N . 16883 1 17 . 1 1 3 3 ALA H H 1 8.408 . . 1 . . . . 3 A HN . 16883 1 18 . 1 1 3 3 ALA HA H 1 4.540 . . 1 . . . . 3 A HA . 16883 1 19 . 1 1 3 3 ALA HB1 H 1 1.324 . . 1 . . . . 3 A HB1 . 16883 1 20 . 1 1 3 3 ALA HB2 H 1 1.324 . . 1 . . . . 3 A HB1 . 16883 1 21 . 1 1 3 3 ALA HB3 H 1 1.324 . . 1 . . . . 3 A HB1 . 16883 1 22 . 1 1 3 3 ALA CA C 13 50.825 . . 1 . . . . 3 A CA . 16883 1 23 . 1 1 3 3 ALA CB C 13 18.360 . . 1 . . . . 3 A CB . 16883 1 24 . 1 1 3 3 ALA N N 15 128.388 . . 1 . . . . 3 A N . 16883 1 25 . 1 1 4 4 PRO HA H 1 4.396 . . 1 . . . . 4 P HA . 16883 1 26 . 1 1 4 4 PRO HB2 H 1 1.823 . . 2 . . . . 4 P HB1 . 16883 1 27 . 1 1 4 4 PRO HB3 H 1 2.203 . . 2 . . . . 4 P HB2 . 16883 1 28 . 1 1 4 4 PRO HD2 H 1 3.540 . . 2 . . . . 4 P HD1 . 16883 1 29 . 1 1 4 4 PRO HD3 H 1 3.814 . . 2 . . . . 4 P HD2 . 16883 1 30 . 1 1 4 4 PRO HG2 H 1 1.949 . . 2 . . . . 4 P HG1 . 16883 1 31 . 1 1 4 4 PRO HG3 H 1 1.897 . . 2 . . . . 4 P HG2 . 16883 1 32 . 1 1 4 4 PRO C C 13 176.626 . . 1 . . . . 4 P C . 16883 1 33 . 1 1 4 4 PRO CA C 13 63.310 . . 1 . . . . 4 P CA . 16883 1 34 . 1 1 4 4 PRO CB C 13 32.129 . . 1 . . . . 4 P CB . 16883 1 35 . 1 1 4 4 PRO CD C 13 51.110 . . 1 . . . . 4 P CD . 16883 1 36 . 1 1 4 4 PRO CG C 13 27.894 . . 1 . . . . 4 P CG . 16883 1 37 . 1 1 5 5 ILE H H 1 7.971 . . 1 . . . . 5 I HN . 16883 1 38 . 1 1 5 5 ILE HA H 1 4.410 . . 1 . . . . 5 I HA . 16883 1 39 . 1 1 5 5 ILE HB H 1 1.797 . . 1 . . . . 5 I HB . 16883 1 40 . 1 1 5 5 ILE HD11 H 1 0.761 . . 1 . . . . 5 I HD11 . 16883 1 41 . 1 1 5 5 ILE HD12 H 1 0.761 . . 1 . . . . 5 I HD11 . 16883 1 42 . 1 1 5 5 ILE HD13 H 1 0.761 . . 1 . . . . 5 I HD11 . 16883 1 43 . 1 1 5 5 ILE HG12 H 1 1.028 . . 1 . . . . 5 I HG11 . 16883 1 44 . 1 1 5 5 ILE HG13 H 1 1.409 . . 1 . . . . 5 I HG12 . 16883 1 45 . 1 1 5 5 ILE HG21 H 1 0.876 . . 1 . . . . 5 I HG21 . 16883 1 46 . 1 1 5 5 ILE HG22 H 1 0.876 . . 1 . . . . 5 I HG21 . 16883 1 47 . 1 1 5 5 ILE HG23 H 1 0.876 . . 1 . . . . 5 I HG21 . 16883 1 48 . 1 1 5 5 ILE C C 13 174.738 . . 1 . . . . 5 I C . 16883 1 49 . 1 1 5 5 ILE CA C 13 58.870 . . 1 . . . . 5 I CA . 16883 1 50 . 1 1 5 5 ILE CB C 13 39.016 . . 1 . . . . 5 I CB . 16883 1 51 . 1 1 5 5 ILE CD1 C 13 13.206 . . 1 . . . . 5 I CD1 . 16883 1 52 . 1 1 5 5 ILE CG1 C 13 27.179 . . 2 . . . . 5 I CG1 . 16883 1 53 . 1 1 5 5 ILE CG2 C 13 17.683 . . 1 . . . . 5 I CG2 . 16883 1 54 . 1 1 5 5 ILE N N 15 122.100 . . 1 . . . . 5 I N . 16883 1 55 . 1 1 6 6 PRO HA H 1 4.311 . . 1 . . . . 6 P HA . 16883 1 56 . 1 1 6 6 PRO HB2 H 1 1.746 . . 2 . . . . 6 P HB1 . 16883 1 57 . 1 1 6 6 PRO HB3 H 1 2.241 . . 2 . . . . 6 P HB2 . 16883 1 58 . 1 1 6 6 PRO HD2 H 1 4.089 . . 2 . . . . 6 P HD1 . 16883 1 59 . 1 1 6 6 PRO HD3 H 1 3.690 . . 2 . . . . 6 P HD2 . 16883 1 60 . 1 1 6 6 PRO HG2 H 1 2.041 . . 2 . . . . 6 P HG1 . 16883 1 61 . 1 1 6 6 PRO HG3 H 1 1.954 . . 2 . . . . 6 P HG2 . 16883 1 62 . 1 1 6 6 PRO CA C 13 63.230 . . 1 . . . . 6 P CA . 16883 1 63 . 1 1 6 6 PRO CB C 13 32.320 . . 1 . . . . 6 P CB . 16883 1 64 . 1 1 6 6 PRO CD C 13 50.673 . . 1 . . . . 6 P CD . 16883 1 65 . 1 1 6 6 PRO CG C 13 27.700 . . 1 . . . . 6 P CG . 16883 1 66 . 1 1 7 7 GLU H H 1 8.380 . . 1 . . . . 7 E HN . 16883 1 67 . 1 1 7 7 GLU HA H 1 4.424 . . 1 . . . . 7 E HA . 16883 1 68 . 1 1 7 7 GLU HB2 H 1 1.889 . . 2 . . . . 7 E HB2 . 16883 1 69 . 1 1 7 7 GLU HG2 H 1 2.316 . . 2 . . . . 7 E HG1 . 16883 1 70 . 1 1 7 7 GLU HG3 H 1 2.498 . . 2 . . . . 7 E HG2 . 16883 1 71 . 1 1 7 7 GLU CA C 13 54.502 . . 1 . . . . 7 E CA . 16883 1 72 . 1 1 7 7 GLU CB C 13 30.320 . . 1 . . . . 7 E CB . 16883 1 73 . 1 1 7 7 GLU CG C 13 35.503 . . 1 . . . . 7 E CG . 16883 1 74 . 1 1 7 7 GLU N N 15 124.355 . . 1 . . . . 7 E N . 16883 1 75 . 1 1 8 8 PRO HA H 1 4.245 . . 1 . . . . 8 P HA . 16883 1 76 . 1 1 8 8 PRO HB2 H 1 0.578 . . 2 . . . . 8 P HB1 . 16883 1 77 . 1 1 8 8 PRO HB3 H 1 1.809 . . 2 . . . . 8 P HB2 . 16883 1 78 . 1 1 8 8 PRO HD2 H 1 2.803 . . 2 . . . . 8 P HD1 . 16883 1 79 . 1 1 8 8 PRO HD3 H 1 2.854 . . 2 . . . . 8 P HD2 . 16883 1 80 . 1 1 8 8 PRO HG2 H 1 1.003 . . 2 . . . . 8 P HG1 . 16883 1 81 . 1 1 8 8 PRO HG3 H 1 1.310 . . 2 . . . . 8 P HG2 . 16883 1 82 . 1 1 8 8 PRO CA C 13 62.440 . . 1 . . . . 8 P CA . 16883 1 83 . 1 1 8 8 PRO CB C 13 31.600 . . 1 . . . . 8 P CB . 16883 1 84 . 1 1 8 8 PRO CD C 13 50.677 . . 1 . . . . 8 P CD . 16883 1 85 . 1 1 8 8 PRO CG C 13 27.412 . . 1 . . . . 8 P CG . 16883 1 86 . 1 1 9 9 LYS H H 1 9.059 . . 1 . . . . 9 K HN . 16883 1 87 . 1 1 9 9 LYS HA H 1 4.745 . . 1 . . . . 9 K HA . 16883 1 88 . 1 1 9 9 LYS HB2 H 1 1.762 . . 2 . . . . 9 K HB2 . 16883 1 89 . 1 1 9 9 LYS HD2 H 1 1.715 . . 2 . . . . 9 K HD2 . 16883 1 90 . 1 1 9 9 LYS HE2 H 1 3.057 . . 2 . . . . 9 K HE2 . 16883 1 91 . 1 1 9 9 LYS HG2 H 1 1.529 . . 2 . . . . 9 K HG2 . 16883 1 92 . 1 1 9 9 LYS CA C 13 53.050 . . 1 . . . . 9 K CA . 16883 1 93 . 1 1 9 9 LYS CB C 13 32.370 . . 1 . . . . 9 K CB . 16883 1 94 . 1 1 9 9 LYS CD C 13 29.144 . . 1 . . . . 9 K CD . 16883 1 95 . 1 1 9 9 LYS CE C 13 42.589 . . 1 . . . . 9 K CE . 16883 1 96 . 1 1 9 9 LYS CG C 13 24.842 . . 1 . . . . 9 K CG . 16883 1 97 . 1 1 9 9 LYS N N 15 121.550 . . 1 . . . . 9 K N . 16883 1 98 . 1 1 10 10 PRO HA H 1 3.961 . . 1 . . . . 10 P HA . 16883 1 99 . 1 1 10 10 PRO HB2 H 1 1.996 . . 2 . . . . 10 P HB1 . 16883 1 100 . 1 1 10 10 PRO HB3 H 1 1.928 . . 2 . . . . 10 P HB2 . 16883 1 101 . 1 1 10 10 PRO HD2 H 1 3.915 . . 2 . . . . 10 P HD1 . 16883 1 102 . 1 1 10 10 PRO HD3 H 1 4.147 . . 2 . . . . 10 P HD2 . 16883 1 103 . 1 1 10 10 PRO HG2 H 1 2.093 . . 2 . . . . 10 P HG2 . 16883 1 104 . 1 1 10 10 PRO C C 13 176.978 . . 1 . . . . 10 P C . 16883 1 105 . 1 1 10 10 PRO CA C 13 64.949 . . 1 . . . . 10 P CA . 16883 1 106 . 1 1 10 10 PRO CB C 13 32.005 . . 1 . . . . 10 P CB . 16883 1 107 . 1 1 10 10 PRO CD C 13 51.127 . . 1 . . . . 10 P CD . 16883 1 108 . 1 1 10 10 PRO CG C 13 28.689 . . 1 . . . . 10 P CG . 16883 1 109 . 1 1 11 11 GLY H H 1 9.571 . . 1 . . . . 11 G HN . 16883 1 110 . 1 1 11 11 GLY HA2 H 1 4.252 . . 2 . . . . 11 G HA1 . 16883 1 111 . 1 1 11 11 GLY HA3 H 1 3.302 . . 2 . . . . 11 G HA2 . 16883 1 112 . 1 1 11 11 GLY C C 13 172.948 . . 1 . . . . 11 G C . 16883 1 113 . 1 1 11 11 GLY CA C 13 45.340 . . 1 . . . . 11 G CA . 16883 1 114 . 1 1 11 11 GLY N N 15 114.490 . . 1 . . . . 11 G N . 16883 1 115 . 1 1 12 12 ASP H H 1 8.329 . . 1 . . . . 12 D HN . 16883 1 116 . 1 1 12 12 ASP HA H 1 4.925 . . 1 . . . . 12 D HA . 16883 1 117 . 1 1 12 12 ASP HB2 H 1 2.856 . . 2 . . . . 12 D HB1 . 16883 1 118 . 1 1 12 12 ASP HB3 H 1 2.577 . . 2 . . . . 12 D HB2 . 16883 1 119 . 1 1 12 12 ASP C C 13 176.379 . . 1 . . . . 12 D C . 16883 1 120 . 1 1 12 12 ASP CA C 13 55.490 . . 1 . . . . 12 D CA . 16883 1 121 . 1 1 12 12 ASP CB C 13 42.870 . . 1 . . . . 12 D CB . 16883 1 122 . 1 1 12 12 ASP N N 15 121.570 . . 1 . . . . 12 D N . 16883 1 123 . 1 1 13 13 LEU H H 1 9.391 . . 1 . . . . 13 L HN . 16883 1 124 . 1 1 13 13 LEU HA H 1 4.824 . . 1 . . . . 13 L HA . 16883 1 125 . 1 1 13 13 LEU HB2 H 1 1.563 . . 2 . . . . 13 L HB1 . 16883 1 126 . 1 1 13 13 LEU HB3 H 1 2.616 . . 2 . . . . 13 L HB2 . 16883 1 127 . 1 1 13 13 LEU HD11 H 1 2.211 . . 2 . . . . 13 L HD11 . 16883 1 128 . 1 1 13 13 LEU HD12 H 1 2.211 . . 2 . . . . 13 L HD11 . 16883 1 129 . 1 1 13 13 LEU HD13 H 1 2.211 . . 2 . . . . 13 L HD11 . 16883 1 130 . 1 1 13 13 LEU HD21 H 1 0.814 . . 2 . . . . 13 L HD21 . 16883 1 131 . 1 1 13 13 LEU HD22 H 1 0.814 . . 2 . . . . 13 L HD21 . 16883 1 132 . 1 1 13 13 LEU HD23 H 1 0.814 . . 2 . . . . 13 L HD21 . 16883 1 133 . 1 1 13 13 LEU HG H 1 1.209 . . 1 . . . . 13 L HG . 16883 1 134 . 1 1 13 13 LEU CA C 13 54.660 . . 1 . . . . 13 L CA . 16883 1 135 . 1 1 13 13 LEU CB C 13 41.566 . . 1 . . . . 13 L CB . 16883 1 136 . 1 1 13 13 LEU CD1 C 13 26.045 . . 1 . . . . 13 L CD1 . 16883 1 137 . 1 1 13 13 LEU CD2 C 13 23.323 . . 1 . . . . 13 L CD2 . 16883 1 138 . 1 1 13 13 LEU CG C 13 26.590 . . 1 . . . . 13 L CG . 16883 1 139 . 1 1 13 13 LEU N N 15 121.170 . . 1 . . . . 13 L N . 16883 1 140 . 1 1 14 14 ILE H H 1 9.254 . . 1 . . . . 14 I HN . 16883 1 141 . 1 1 14 14 ILE HA H 1 4.541 . . 1 . . . . 14 I HA . 16883 1 142 . 1 1 14 14 ILE HB H 1 1.712 . . 1 . . . . 14 I HB . 16883 1 143 . 1 1 14 14 ILE HD11 H 1 0.591 . . 1 . . . . 14 I HD11 . 16883 1 144 . 1 1 14 14 ILE HD12 H 1 0.591 . . 1 . . . . 14 I HD11 . 16883 1 145 . 1 1 14 14 ILE HD13 H 1 0.591 . . 1 . . . . 14 I HD11 . 16883 1 146 . 1 1 14 14 ILE HG12 H 1 1.159 . . 1 . . . . 14 I HG11 . 16883 1 147 . 1 1 14 14 ILE HG13 H 1 1.490 . . 1 . . . . 14 I HG12 . 16883 1 148 . 1 1 14 14 ILE HG21 H 1 0.558 . . 1 . . . . 14 I HG21 . 16883 1 149 . 1 1 14 14 ILE HG22 H 1 0.558 . . 1 . . . . 14 I HG21 . 16883 1 150 . 1 1 14 14 ILE HG23 H 1 0.558 . . 1 . . . . 14 I HG21 . 16883 1 151 . 1 1 14 14 ILE C C 13 172.932 . . 1 . . . . 14 I C . 16883 1 152 . 1 1 14 14 ILE CA C 13 58.330 . . 1 . . . . 14 I CA . 16883 1 153 . 1 1 14 14 ILE CB C 13 38.800 . . 1 . . . . 14 I CB . 16883 1 154 . 1 1 14 14 ILE CD1 C 13 11.828 . . 1 . . . . 14 I CD1 . 16883 1 155 . 1 1 14 14 ILE CG1 C 13 27.015 . . 2 . . . . 14 I CG1 . 16883 1 156 . 1 1 14 14 ILE CG2 C 13 17.984 . . 1 . . . . 14 I CG2 . 16883 1 157 . 1 1 14 14 ILE N N 15 123.480 . . 1 . . . . 14 I N . 16883 1 158 . 1 1 15 15 GLU H H 1 8.671 . . 1 . . . . 15 E HN . 16883 1 159 . 1 1 15 15 GLU HA H 1 3.398 . . 1 . . . . 15 E HA . 16883 1 160 . 1 1 15 15 GLU HB2 H 1 1.491 . . 2 . . . . 15 E HB1 . 16883 1 161 . 1 1 15 15 GLU HB3 H 1 0.507 . . 2 . . . . 15 E HB2 . 16883 1 162 . 1 1 15 15 GLU HG2 H 1 0.908 . . 2 . . . . 15 E HG1 . 16883 1 163 . 1 1 15 15 GLU HG3 H 1 0.605 . . 2 . . . . 15 E HG2 . 16883 1 164 . 1 1 15 15 GLU C C 13 174.905 . . 1 . . . . 15 E C . 16883 1 165 . 1 1 15 15 GLU CA C 13 54.703 . . 1 . . . . 15 E CA . 16883 1 166 . 1 1 15 15 GLU CB C 13 32.000 . . 1 . . . . 15 E CB . 16883 1 167 . 1 1 15 15 GLU CG C 13 35.929 . . 1 . . . . 15 E CG . 16883 1 168 . 1 1 15 15 GLU N N 15 130.480 . . 1 . . . . 15 E N . 16883 1 169 . 1 1 16 16 ILE H H 1 8.599 . . 1 . . . . 16 I HN . 16883 1 170 . 1 1 16 16 ILE HA H 1 4.379 . . 1 . . . . 16 I HA . 16883 1 171 . 1 1 16 16 ILE HB H 1 1.533 . . 1 . . . . 16 I HB . 16883 1 172 . 1 1 16 16 ILE HD11 H 1 0.466 . . 1 . . . . 16 I HD11 . 16883 1 173 . 1 1 16 16 ILE HD12 H 1 0.466 . . 1 . . . . 16 I HD11 . 16883 1 174 . 1 1 16 16 ILE HD13 H 1 0.466 . . 1 . . . . 16 I HD11 . 16883 1 175 . 1 1 16 16 ILE HG12 H 1 1.350 . . 1 . . . . 16 I HG11 . 16883 1 176 . 1 1 16 16 ILE HG21 H 1 0.818 . . 1 . . . . 16 I HG21 . 16883 1 177 . 1 1 16 16 ILE HG22 H 1 0.818 . . 1 . . . . 16 I HG21 . 16883 1 178 . 1 1 16 16 ILE HG23 H 1 0.818 . . 1 . . . . 16 I HG21 . 16883 1 179 . 1 1 16 16 ILE C C 13 175.806 . . 1 . . . . 16 I C . 16883 1 180 . 1 1 16 16 ILE CA C 13 61.020 . . 1 . . . . 16 I CA . 16883 1 181 . 1 1 16 16 ILE CB C 13 40.290 . . 1 . . . . 16 I CB . 16883 1 182 . 1 1 16 16 ILE CD1 C 13 15.005 . . 1 . . . . 16 I CD1 . 16883 1 183 . 1 1 16 16 ILE CG1 C 13 28.594 . . 2 . . . . 16 I CG1 . 16883 1 184 . 1 1 16 16 ILE CG2 C 13 18.449 . . 1 . . . . 16 I CG2 . 16883 1 185 . 1 1 16 16 ILE N N 15 125.500 . . 1 . . . . 16 I N . 16883 1 186 . 1 1 17 17 PHE H H 1 9.073 . . 1 . . . . 17 F HN . 16883 1 187 . 1 1 17 17 PHE HA H 1 4.388 . . 1 . . . . 17 F HA . 16883 1 188 . 1 1 17 17 PHE HB2 H 1 2.871 . . 2 . . . . 17 F HB1 . 16883 1 189 . 1 1 17 17 PHE HB3 H 1 2.940 . . 2 . . . . 17 F HB2 . 16883 1 190 . 1 1 17 17 PHE HD1 H 1 6.980 . . 3 . . . . 17 F HD1 . 16883 1 191 . 1 1 17 17 PHE HE1 H 1 7.021 . . 3 . . . . 17 F HE1 . 16883 1 192 . 1 1 17 17 PHE C C 13 176.100 . . 1 . . . . 17 F C . 16883 1 193 . 1 1 17 17 PHE CA C 13 57.050 . . 1 . . . . 17 F CA . 16883 1 194 . 1 1 17 17 PHE CB C 13 36.890 . . 1 . . . . 17 F CB . 16883 1 195 . 1 1 17 17 PHE CD1 C 13 131.358 . . 3 . . . . 17 F CD1 . 16883 1 196 . 1 1 17 17 PHE CE1 C 13 130.463 . . 3 . . . . 17 F CE1 . 16883 1 197 . 1 1 17 17 PHE N N 15 130.190 . . 1 . . . . 17 F N . 16883 1 198 . 1 1 18 18 ARG H H 1 7.321 . . 1 . . . . 18 R HN . 16883 1 199 . 1 1 18 18 ARG HA H 1 4.374 . . 1 . . . . 18 R HA . 16883 1 200 . 1 1 18 18 ARG HB2 H 1 1.663 . . 2 . . . . 18 R HB2 . 16883 1 201 . 1 1 18 18 ARG HD2 H 1 2.840 . . 2 . . . . 18 R HD1 . 16883 1 202 . 1 1 18 18 ARG HD3 H 1 3.223 . . 2 . . . . 18 R HD2 . 16883 1 203 . 1 1 18 18 ARG HG2 H 1 1.367 . . 2 . . . . 18 R HG1 . 16883 1 204 . 1 1 18 18 ARG HG3 H 1 1.555 . . 2 . . . . 18 R HG2 . 16883 1 205 . 1 1 18 18 ARG C C 13 174.954 . . 1 . . . . 18 R C . 16883 1 206 . 1 1 18 18 ARG CA C 13 55.800 . . 1 . . . . 18 R CA . 16883 1 207 . 1 1 18 18 ARG CB C 13 27.560 . . 1 . . . . 18 R CB . 16883 1 208 . 1 1 18 18 ARG CD C 13 44.364 . . 1 . . . . 18 R CD . 16883 1 209 . 1 1 18 18 ARG CG C 13 28.560 . . 1 . . . . 18 R CG . 16883 1 210 . 1 1 18 18 ARG N N 15 123.790 . . 1 . . . . 18 R N . 16883 1 211 . 1 1 19 19 PRO HA H 1 3.969 . . 1 . . . . 19 P HA . 16883 1 212 . 1 1 19 19 PRO HB2 H 1 1.915 . . 2 . . . . 19 P HB1 . 16883 1 213 . 1 1 19 19 PRO HB3 H 1 1.392 . . 2 . . . . 19 P HB2 . 16883 1 214 . 1 1 19 19 PRO HD2 H 1 3.562 . . 2 . . . . 19 P HD1 . 16883 1 215 . 1 1 19 19 PRO HD3 H 1 3.668 . . 2 . . . . 19 P HD2 . 16883 1 216 . 1 1 19 19 PRO HG2 H 1 1.910 . . 2 . . . . 19 P HG1 . 16883 1 217 . 1 1 19 19 PRO HG3 H 1 2.051 . . 2 . . . . 19 P HG2 . 16883 1 218 . 1 1 19 19 PRO C C 13 178.124 . . 1 . . . . 19 P C . 16883 1 219 . 1 1 19 19 PRO CA C 13 66.337 . . 1 . . . . 19 P CA . 16883 1 220 . 1 1 19 19 PRO CB C 13 31.664 . . 1 . . . . 19 P CB . 16883 1 221 . 1 1 19 19 PRO CD C 13 50.653 . . 1 . . . . 19 P CD . 16883 1 222 . 1 1 19 19 PRO CG C 13 28.293 . . 1 . . . . 19 P CG . 16883 1 223 . 1 1 20 20 PHE H H 1 8.189 . . 1 . . . . 20 F HN . 16883 1 224 . 1 1 20 20 PHE HA H 1 4.766 . . 1 . . . . 20 F HA . 16883 1 225 . 1 1 20 20 PHE HB2 H 1 3.042 . . 2 . . . . 20 F HB1 . 16883 1 226 . 1 1 20 20 PHE HB3 H 1 3.448 . . 2 . . . . 20 F HB2 . 16883 1 227 . 1 1 20 20 PHE HD1 H 1 7.286 . . 3 . . . . 20 F HD1 . 16883 1 228 . 1 1 20 20 PHE C C 13 175.511 . . 1 . . . . 20 F C . 16883 1 229 . 1 1 20 20 PHE CA C 13 58.130 . . 1 . . . . 20 F CA . 16883 1 230 . 1 1 20 20 PHE CB C 13 39.660 . . 1 . . . . 20 F CB . 16883 1 231 . 1 1 20 20 PHE CD1 C 13 132.135 . . 3 . . . . 20 F CD1 . 16883 1 232 . 1 1 20 20 PHE N N 15 112.550 . . 1 . . . . 20 F N . 16883 1 233 . 1 1 21 21 TYR H H 1 7.372 . . 1 . . . . 21 Y HN . 16883 1 234 . 1 1 21 21 TYR HA H 1 4.782 . . 1 . . . . 21 Y HA . 16883 1 235 . 1 1 21 21 TYR HB2 H 1 3.350 . . 2 . . . . 21 Y HB1 . 16883 1 236 . 1 1 21 21 TYR HB3 H 1 3.115 . . 2 . . . . 21 Y HB2 . 16883 1 237 . 1 1 21 21 TYR HD1 H 1 7.020 . . 3 . . . . 21 Y HD1 . 16883 1 238 . 1 1 21 21 TYR HE1 H 1 6.900 . . 3 . . . . 21 Y HE1 . 16883 1 239 . 1 1 21 21 TYR C C 13 172.283 . . 1 . . . . 21 Y C . 16883 1 240 . 1 1 21 21 TYR CA C 13 57.270 . . 1 . . . . 21 Y CA . 16883 1 241 . 1 1 21 21 TYR CB C 13 39.449 . . 1 . . . . 21 Y CB . 16883 1 242 . 1 1 21 21 TYR CD1 C 13 133.981 . . 3 . . . . 21 Y CD1 . 16883 1 243 . 1 1 21 21 TYR CE1 C 13 118.297 . . 3 . . . . 21 Y CE1 . 16883 1 244 . 1 1 21 21 TYR N N 15 117.630 . . 1 . . . . 21 Y N . 16883 1 245 . 1 1 22 22 ARG H H 1 8.418 . . 1 . . . . 22 R HN . 16883 1 246 . 1 1 22 22 ARG HA H 1 4.731 . . 1 . . . . 22 R HA . 16883 1 247 . 1 1 22 22 ARG HB2 H 1 1.833 . . 2 . . . . 22 R HB1 . 16883 1 248 . 1 1 22 22 ARG HB3 H 1 1.587 . . 2 . . . . 22 R HB2 . 16883 1 249 . 1 1 22 22 ARG HD2 H 1 3.549 . . 2 . . . . 22 R HD1 . 16883 1 250 . 1 1 22 22 ARG HD3 H 1 4.564 . . 2 . . . . 22 R HD2 . 16883 1 251 . 1 1 22 22 ARG HG2 H 1 1.577 . . 2 . . . . 22 R HG2 . 16883 1 252 . 1 1 22 22 ARG C C 13 175.885 . . 1 . . . . 22 R C . 16883 1 253 . 1 1 22 22 ARG CA C 13 53.820 . . 1 . . . . 22 R CA . 16883 1 254 . 1 1 22 22 ARG CB C 13 31.000 . . 1 . . . . 22 R CB . 16883 1 255 . 1 1 22 22 ARG CD C 13 44.360 . . 1 . . . . 22 R CD . 16883 1 256 . 1 1 22 22 ARG CG C 13 27.444 . . 1 . . . . 22 R CG . 16883 1 257 . 1 1 22 22 ARG N N 15 120.060 . . 1 . . . . 22 R N . 16883 1 258 . 1 1 23 23 HIS H H 1 8.879 . . 1 . . . . 23 H HN . 16883 1 259 . 1 1 23 23 HIS HA H 1 5.392 . . 1 . . . . 23 H HA . 16883 1 260 . 1 1 23 23 HIS HB2 H 1 2.721 . . 2 . . . . 23 H HB1 . 16883 1 261 . 1 1 23 23 HIS HB3 H 1 2.813 . . 2 . . . . 23 H HB2 . 16883 1 262 . 1 1 23 23 HIS HD2 H 1 6.461 . . 1 . . . . 23 H HD2 . 16883 1 263 . 1 1 23 23 HIS HE1 H 1 8.501 . . 1 . . . . 23 H HE1 . 16883 1 264 . 1 1 23 23 HIS C C 13 172.820 . . 1 . . . . 23 H C . 16883 1 265 . 1 1 23 23 HIS CA C 13 55.010 . . 1 . . . . 23 H CA . 16883 1 266 . 1 1 23 23 HIS CB C 13 34.700 . . 1 . . . . 23 H CB . 16883 1 267 . 1 1 23 23 HIS CD2 C 13 114.244 . . 1 . . . . 23 H CD2 . 16883 1 268 . 1 1 23 23 HIS CE1 C 13 141.744 . . 1 . . . . 23 H CE1 . 16883 1 269 . 1 1 23 23 HIS N N 15 125.590 . . 1 . . . . 23 H N . 16883 1 270 . 1 1 24 24 TRP H H 1 6.192 . . 1 . . . . 24 W HN . 16883 1 271 . 1 1 24 24 TRP HA H 1 5.613 . . 1 . . . . 24 W HA . 16883 1 272 . 1 1 24 24 TRP HB2 H 1 3.320 . . 2 . . . . 24 W HB1 . 16883 1 273 . 1 1 24 24 TRP HB3 H 1 2.427 . . 2 . . . . 24 W HB2 . 16883 1 274 . 1 1 24 24 TRP HD1 H 1 7.078 . . 1 . . . . 24 W HD1 . 16883 1 275 . 1 1 24 24 TRP HE1 H 1 9.913 . . 1 . . . . 24 W HE1 . 16883 1 276 . 1 1 24 24 TRP HE3 H 1 5.602 . . 1 . . . . 24 W HE3 . 16883 1 277 . 1 1 24 24 TRP HH2 H 1 7.080 . . 1 . . . . 24 W HH2 . 16883 1 278 . 1 1 24 24 TRP HZ2 H 1 7.255 . . 1 . . . . 24 W HZ2 . 16883 1 279 . 1 1 24 24 TRP HZ3 H 1 7.495 . . 1 . . . . 24 W HZ3 . 16883 1 280 . 1 1 24 24 TRP C C 13 174.044 . . 1 . . . . 24 W C . 16883 1 281 . 1 1 24 24 TRP CA C 13 56.107 . . 1 . . . . 24 W CA . 16883 1 282 . 1 1 24 24 TRP CB C 13 34.444 . . 1 . . . . 24 W CB . 16883 1 283 . 1 1 24 24 TRP CD1 C 13 125.736 . . 1 . . . . 24 W CD1 . 16883 1 284 . 1 1 24 24 TRP CE3 C 13 115.826 . . 1 . . . . 24 W CE3 . 16883 1 285 . 1 1 24 24 TRP CH2 C 13 125.659 . . 1 . . . . 24 W CH2 . 16883 1 286 . 1 1 24 24 TRP CZ2 C 13 114.514 . . 1 . . . . 24 W CZ2 . 16883 1 287 . 1 1 24 24 TRP CZ3 C 13 120.441 . . 1 . . . . 24 W CZ3 . 16883 1 288 . 1 1 24 24 TRP N N 15 122.691 . . 1 . . . . 24 W N . 16883 1 289 . 1 1 24 24 TRP NE1 N 15 130.270 . . 1 . . . . 24 W NE1 . 16883 1 290 . 1 1 25 25 ALA H H 1 9.399 . . 1 . . . . 25 A HN . 16883 1 291 . 1 1 25 25 ALA HA H 1 4.993 . . 1 . . . . 25 A HA . 16883 1 292 . 1 1 25 25 ALA HB1 H 1 1.152 . . 1 . . . . 25 A HB1 . 16883 1 293 . 1 1 25 25 ALA HB2 H 1 1.152 . . 1 . . . . 25 A HB1 . 16883 1 294 . 1 1 25 25 ALA HB3 H 1 1.152 . . 1 . . . . 25 A HB1 . 16883 1 295 . 1 1 25 25 ALA C C 13 174.293 . . 1 . . . . 25 A C . 16883 1 296 . 1 1 25 25 ALA CA C 13 50.310 . . 1 . . . . 25 A CA . 16883 1 297 . 1 1 25 25 ALA CB C 13 23.470 . . 1 . . . . 25 A CB . 16883 1 298 . 1 1 25 25 ALA N N 15 123.370 . . 1 . . . . 25 A N . 16883 1 299 . 1 1 26 26 ILE H H 1 9.176 . . 1 . . . . 26 I HN . 16883 1 300 . 1 1 26 26 ILE HA H 1 5.509 . . 1 . . . . 26 I HA . 16883 1 301 . 1 1 26 26 ILE HB H 1 1.469 . . 1 . . . . 26 I HB . 16883 1 302 . 1 1 26 26 ILE HD11 H 1 0.709 . . 1 . . . . 26 I HD11 . 16883 1 303 . 1 1 26 26 ILE HD12 H 1 0.709 . . 1 . . . . 26 I HD11 . 16883 1 304 . 1 1 26 26 ILE HD13 H 1 0.709 . . 1 . . . . 26 I HD11 . 16883 1 305 . 1 1 26 26 ILE HG12 H 1 1.600 . . 1 . . . . 26 I HG11 . 16883 1 306 . 1 1 26 26 ILE HG13 H 1 0.704 . . 1 . . . . 26 I HG12 . 16883 1 307 . 1 1 26 26 ILE HG21 H 1 0.892 . . 2 . . . . 26 I HG21 . 16883 1 308 . 1 1 26 26 ILE HG22 H 1 0.892 . . 2 . . . . 26 I HG21 . 16883 1 309 . 1 1 26 26 ILE HG23 H 1 0.892 . . 2 . . . . 26 I HG21 . 16883 1 310 . 1 1 26 26 ILE C C 13 174.101 . . 1 . . . . 26 I C . 16883 1 311 . 1 1 26 26 ILE CA C 13 59.120 . . 1 . . . . 26 I CA . 16883 1 312 . 1 1 26 26 ILE CB C 13 43.420 . . 1 . . . . 26 I CB . 16883 1 313 . 1 1 26 26 ILE CD1 C 13 16.553 . . 1 . . . . 26 I CD1 . 16883 1 314 . 1 1 26 26 ILE CG1 C 13 29.236 . . 2 . . . . 26 I CG1 . 16883 1 315 . 1 1 26 26 ILE CG2 C 13 15.687 . . 1 . . . . 26 I CG2 . 16883 1 316 . 1 1 26 26 ILE N N 15 119.960 . . 1 . . . . 26 I N . 16883 1 317 . 1 1 27 27 TYR H H 1 9.595 . . 1 . . . . 27 Y HN . 16883 1 318 . 1 1 27 27 TYR HA H 1 4.699 . . 1 . . . . 27 Y HA . 16883 1 319 . 1 1 27 27 TYR HB2 H 1 2.733 . . 2 . . . . 27 Y HB1 . 16883 1 320 . 1 1 27 27 TYR HB3 H 1 3.256 . . 2 . . . . 27 Y HB2 . 16883 1 321 . 1 1 27 27 TYR HD1 H 1 6.628 . . 3 . . . . 27 Y HD1 . 16883 1 322 . 1 1 27 27 TYR C C 13 176.728 . . 1 . . . . 27 Y C . 16883 1 323 . 1 1 27 27 TYR CA C 13 60.040 . . 1 . . . . 27 Y CA . 16883 1 324 . 1 1 27 27 TYR CB C 13 39.120 . . 1 . . . . 27 Y CB . 16883 1 325 . 1 1 27 27 TYR CD1 C 13 133.245 . . 3 . . . . 27 Y CD1 . 16883 1 326 . 1 1 27 27 TYR N N 15 129.950 . . 1 . . . . 27 Y N . 16883 1 327 . 1 1 28 28 VAL H H 1 8.396 . . 1 . . . . 28 V HN . 16883 1 328 . 1 1 28 28 VAL HA H 1 4.653 . . 1 . . . . 28 V HA . 16883 1 329 . 1 1 28 28 VAL HB H 1 2.472 . . 1 . . . . 28 V HB . 16883 1 330 . 1 1 28 28 VAL HG11 H 1 0.770 . . 2 . . . . 28 V HG11 . 16883 1 331 . 1 1 28 28 VAL HG12 H 1 0.770 . . 2 . . . . 28 V HG11 . 16883 1 332 . 1 1 28 28 VAL HG13 H 1 0.770 . . 2 . . . . 28 V HG11 . 16883 1 333 . 1 1 28 28 VAL HG21 H 1 0.591 . . 2 . . . . 28 V HG21 . 16883 1 334 . 1 1 28 28 VAL HG22 H 1 0.591 . . 2 . . . . 28 V HG21 . 16883 1 335 . 1 1 28 28 VAL HG23 H 1 0.591 . . 2 . . . . 28 V HG21 . 16883 1 336 . 1 1 28 28 VAL C C 13 174.725 . . 1 . . . . 28 V C . 16883 1 337 . 1 1 28 28 VAL CA C 13 60.800 . . 1 . . . . 28 V CA . 16883 1 338 . 1 1 28 28 VAL CB C 13 32.516 . . 1 . . . . 28 V CB . 16883 1 339 . 1 1 28 28 VAL CG1 C 13 21.596 . . 1 . . . . 28 V CG1 . 16883 1 340 . 1 1 28 28 VAL CG2 C 13 19.510 . . 1 . . . . 28 V CG2 . 16883 1 341 . 1 1 28 28 VAL N N 15 119.070 . . 1 . . . . 28 V N . 16883 1 342 . 1 1 29 29 GLY C C 13 177.428 . . 1 . . . . 29 G C . 16883 1 343 . 1 1 30 30 ASP HA H 1 4.386 . . 1 . . . . 30 D HA . 16883 1 344 . 1 1 30 30 ASP HB2 H 1 2.698 . . 2 . . . . 30 D HB1 . 16883 1 345 . 1 1 30 30 ASP HB3 H 1 3.096 . . 2 . . . . 30 D HB2 . 16883 1 346 . 1 1 30 30 ASP C C 13 174.444 . . 1 . . . . 30 D C . 16883 1 347 . 1 1 30 30 ASP CA C 13 55.970 . . 1 . . . . 30 D CA . 16883 1 348 . 1 1 30 30 ASP CB C 13 40.170 . . 1 . . . . 30 D CB . 16883 1 349 . 1 1 31 31 GLY H H 1 8.021 . . 1 . . . . 31 G HN . 16883 1 350 . 1 1 31 31 GLY HA2 H 1 4.138 . . 2 . . . . 31 G HA1 . 16883 1 351 . 1 1 31 31 GLY HA3 H 1 3.810 . . 2 . . . . 31 G HA2 . 16883 1 352 . 1 1 31 31 GLY C C 13 174.685 . . 1 . . . . 31 G C . 16883 1 353 . 1 1 31 31 GLY CA C 13 45.441 . . 1 . . . . 31 G CA . 16883 1 354 . 1 1 31 31 GLY N N 15 100.231 . . 1 . . . . 31 G N . 16883 1 355 . 1 1 32 32 TYR H H 1 7.865 . . 1 . . . . 32 Y HN . 16883 1 356 . 1 1 32 32 TYR HA H 1 4.720 . . 1 . . . . 32 Y HA . 16883 1 357 . 1 1 32 32 TYR HB2 H 1 2.830 . . 2 . . . . 32 Y HB1 . 16883 1 358 . 1 1 32 32 TYR HB3 H 1 2.434 . . 2 . . . . 32 Y HB2 . 16883 1 359 . 1 1 32 32 TYR HD1 H 1 6.750 . . 3 . . . . 32 Y HD1 . 16883 1 360 . 1 1 32 32 TYR HE1 H 1 7.000 . . 3 . . . . 32 Y HE1 . 16883 1 361 . 1 1 32 32 TYR C C 13 175.028 . . 1 . . . . 32 Y C . 16883 1 362 . 1 1 32 32 TYR CA C 13 59.820 . . 1 . . . . 32 Y CA . 16883 1 363 . 1 1 32 32 TYR CB C 13 42.000 . . 1 . . . . 32 Y CB . 16883 1 364 . 1 1 32 32 TYR CD1 C 13 133.419 . . 3 . . . . 32 Y CD1 . 16883 1 365 . 1 1 32 32 TYR CE1 C 13 117.960 . . 3 . . . . 32 Y CE1 . 16883 1 366 . 1 1 32 32 TYR N N 15 120.940 . . 1 . . . . 32 Y N . 16883 1 367 . 1 1 33 33 VAL H H 1 9.220 . . 1 . . . . 33 V HN . 16883 1 368 . 1 1 33 33 VAL HA H 1 5.414 . . 1 . . . . 33 V HA . 16883 1 369 . 1 1 33 33 VAL HB H 1 2.059 . . 1 . . . . 33 V HB . 16883 1 370 . 1 1 33 33 VAL HG11 H 1 0.812 . . 2 . . . . 33 V HG11 . 16883 1 371 . 1 1 33 33 VAL HG12 H 1 0.812 . . 2 . . . . 33 V HG11 . 16883 1 372 . 1 1 33 33 VAL HG13 H 1 0.812 . . 2 . . . . 33 V HG11 . 16883 1 373 . 1 1 33 33 VAL HG21 H 1 0.384 . . 2 . . . . 33 V HG21 . 16883 1 374 . 1 1 33 33 VAL HG22 H 1 0.384 . . 2 . . . . 33 V HG21 . 16883 1 375 . 1 1 33 33 VAL HG23 H 1 0.384 . . 2 . . . . 33 V HG21 . 16883 1 376 . 1 1 33 33 VAL C C 13 174.609 . . 1 . . . . 33 V C . 16883 1 377 . 1 1 33 33 VAL CA C 13 57.810 . . 1 . . . . 33 V CA . 16883 1 378 . 1 1 33 33 VAL CB C 13 35.430 . . 1 . . . . 33 V CB . 16883 1 379 . 1 1 33 33 VAL CG1 C 13 24.283 . . 1 . . . . 33 V CG1 . 16883 1 380 . 1 1 33 33 VAL CG2 C 13 18.329 . . 1 . . . . 33 V CG2 . 16883 1 381 . 1 1 33 33 VAL N N 15 110.760 . . 1 . . . . 33 V N . 16883 1 382 . 1 1 34 34 VAL H H 1 8.928 . . 1 . . . . 34 V HN . 16883 1 383 . 1 1 34 34 VAL HA H 1 5.535 . . 1 . . . . 34 V HA . 16883 1 384 . 1 1 34 34 VAL HB H 1 1.633 . . 1 . . . . 34 V HB . 16883 1 385 . 1 1 34 34 VAL HG11 H 1 0.983 . . 2 . . . . 34 V HG11 . 16883 1 386 . 1 1 34 34 VAL HG12 H 1 0.983 . . 2 . . . . 34 V HG11 . 16883 1 387 . 1 1 34 34 VAL HG13 H 1 0.983 . . 2 . . . . 34 V HG11 . 16883 1 388 . 1 1 34 34 VAL HG21 H 1 0.814 . . 2 . . . . 34 V HG21 . 16883 1 389 . 1 1 34 34 VAL HG22 H 1 0.814 . . 2 . . . . 34 V HG21 . 16883 1 390 . 1 1 34 34 VAL HG23 H 1 0.814 . . 2 . . . . 34 V HG21 . 16883 1 391 . 1 1 34 34 VAL C C 13 175.029 . . 1 . . . . 34 V C . 16883 1 392 . 1 1 34 34 VAL CA C 13 61.450 . . 1 . . . . 34 V CA . 16883 1 393 . 1 1 34 34 VAL CB C 13 34.250 . . 1 . . . . 34 V CB . 16883 1 394 . 1 1 34 34 VAL CG1 C 13 21.437 . . 1 . . . . 34 V CG1 . 16883 1 395 . 1 1 34 34 VAL CG2 C 13 23.243 . . 1 . . . . 34 V CG2 . 16883 1 396 . 1 1 34 34 VAL N N 15 120.660 . . 1 . . . . 34 V N . 16883 1 397 . 1 1 35 35 HIS H H 1 9.264 . . 1 . . . . 35 H HN . 16883 1 398 . 1 1 35 35 HIS HA H 1 5.091 . . 1 . . . . 35 H HA . 16883 1 399 . 1 1 35 35 HIS HB2 H 1 3.551 . . 2 . . . . 35 H HB2 . 16883 1 400 . 1 1 35 35 HIS HD2 H 1 6.969 . . 1 . . . . 35 H HD2 . 16883 1 401 . 1 1 35 35 HIS HE1 H 1 7.683 . . 1 . . . . 35 H HE1 . 16883 1 402 . 1 1 35 35 HIS C C 13 171.643 . . 1 . . . . 35 H C . 16883 1 403 . 1 1 35 35 HIS CA C 13 55.000 . . 1 . . . . 35 H CA . 16883 1 404 . 1 1 35 35 HIS CB C 13 35.040 . . 1 . . . . 35 H CB . 16883 1 405 . 1 1 35 35 HIS CD2 C 13 114.368 . . 1 . . . . 35 H CD2 . 16883 1 406 . 1 1 35 35 HIS CE1 C 13 137.268 . . 1 . . . . 35 H CE1 . 16883 1 407 . 1 1 35 35 HIS N N 15 124.520 . . 1 . . . . 35 H N . 16883 1 408 . 1 1 36 36 LEU H H 1 8.049 . . 1 . . . . 36 L HN . 16883 1 409 . 1 1 36 36 LEU HA H 1 4.590 . . 1 . . . . 36 L HA . 16883 1 410 . 1 1 36 36 LEU HB2 H 1 0.875 . . 2 . . . . 36 L HB1 . 16883 1 411 . 1 1 36 36 LEU HB3 H 1 1.904 . . 2 . . . . 36 L HB2 . 16883 1 412 . 1 1 36 36 LEU HD11 H 1 -0.183 . . 2 . . . . 36 L HD11 . 16883 1 413 . 1 1 36 36 LEU HD12 H 1 -0.183 . . 2 . . . . 36 L HD11 . 16883 1 414 . 1 1 36 36 LEU HD13 H 1 -0.183 . . 2 . . . . 36 L HD11 . 16883 1 415 . 1 1 36 36 LEU HD21 H 1 1.056 . . 2 . . . . 36 L HD21 . 16883 1 416 . 1 1 36 36 LEU HD22 H 1 1.056 . . 2 . . . . 36 L HD21 . 16883 1 417 . 1 1 36 36 LEU HD23 H 1 1.056 . . 2 . . . . 36 L HD21 . 16883 1 418 . 1 1 36 36 LEU HG H 1 0.598 . . 1 . . . . 36 L HG . 16883 1 419 . 1 1 36 36 LEU C C 13 174.925 . . 1 . . . . 36 L C . 16883 1 420 . 1 1 36 36 LEU CA C 13 53.880 . . 1 . . . . 36 L CA . 16883 1 421 . 1 1 36 36 LEU CB C 13 43.790 . . 1 . . . . 36 L CB . 16883 1 422 . 1 1 36 36 LEU CD1 C 13 23.738 . . 1 . . . . 36 L CD1 . 16883 1 423 . 1 1 36 36 LEU CD2 C 13 27.139 . . 1 . . . . 36 L CD2 . 16883 1 424 . 1 1 36 36 LEU CG C 13 25.643 . . 1 . . . . 36 L CG . 16883 1 425 . 1 1 36 36 LEU N N 15 118.900 . . 1 . . . . 36 L N . 16883 1 426 . 1 1 37 37 ALA H H 1 8.642 . . 1 . . . . 37 A HN . 16883 1 427 . 1 1 37 37 ALA HA H 1 4.729 . . 1 . . . . 37 A HA . 16883 1 428 . 1 1 37 37 ALA HB1 H 1 1.031 . . 1 . . . . 37 A HB1 . 16883 1 429 . 1 1 37 37 ALA HB2 H 1 1.031 . . 1 . . . . 37 A HB1 . 16883 1 430 . 1 1 37 37 ALA HB3 H 1 1.031 . . 1 . . . . 37 A HB1 . 16883 1 431 . 1 1 37 37 ALA C C 13 175.422 . . 1 . . . . 37 A C . 16883 1 432 . 1 1 37 37 ALA CA C 13 49.570 . . 1 . . . . 37 A CA . 16883 1 433 . 1 1 37 37 ALA CB C 13 21.590 . . 1 . . . . 37 A CB . 16883 1 434 . 1 1 37 37 ALA N N 15 122.840 . . 1 . . . . 37 A N . 16883 1 435 . 1 1 38 38 PRO HA H 1 4.812 . . 1 . . . . 38 P HA . 16883 1 436 . 1 1 38 38 PRO HB2 H 1 1.846 . . 2 . . . . 38 P HB1 . 16883 1 437 . 1 1 38 38 PRO HB3 H 1 2.377 . . 2 . . . . 38 P HB2 . 16883 1 438 . 1 1 38 38 PRO HD2 H 1 3.574 . . 2 . . . . 38 P HD1 . 16883 1 439 . 1 1 38 38 PRO HD3 H 1 3.685 . . 2 . . . . 38 P HD2 . 16883 1 440 . 1 1 38 38 PRO HG2 H 1 1.951 . . 2 . . . . 38 P HG1 . 16883 1 441 . 1 1 38 38 PRO HG3 H 1 2.039 . . 2 . . . . 38 P HG2 . 16883 1 442 . 1 1 38 38 PRO CA C 13 61.273 . . 1 . . . . 38 P CA . 16883 1 443 . 1 1 38 38 PRO CB C 13 31.240 . . 1 . . . . 38 P CB . 16883 1 444 . 1 1 38 38 PRO CD C 13 50.700 . . 1 . . . . 38 P CD . 16883 1 445 . 1 1 38 38 PRO CG C 13 27.707 . . 1 . . . . 38 P CG . 16883 1 446 . 1 1 39 39 PRO HA H 1 4.318 . . 1 . . . . 39 P HA . 16883 1 447 . 1 1 39 39 PRO HB2 H 1 2.168 . . 2 . . . . 39 P HB1 . 16883 1 448 . 1 1 39 39 PRO HB3 H 1 1.951 . . 2 . . . . 39 P HB2 . 16883 1 449 . 1 1 39 39 PRO HD2 H 1 3.669 . . 2 . . . . 39 P HD1 . 16883 1 450 . 1 1 39 39 PRO HD3 H 1 3.829 . . 2 . . . . 39 P HD2 . 16883 1 451 . 1 1 39 39 PRO HG2 H 1 1.837 . . 2 . . . . 39 P HG1 . 16883 1 452 . 1 1 39 39 PRO HG3 H 1 1.986 . . 2 . . . . 39 P HG2 . 16883 1 453 . 1 1 39 39 PRO CA C 13 63.341 . . 1 . . . . 39 P CA . 16883 1 454 . 1 1 39 39 PRO CB C 13 32.259 . . 1 . . . . 39 P CB . 16883 1 455 . 1 1 39 39 PRO CD C 13 50.688 . . 1 . . . . 39 P CD . 16883 1 456 . 1 1 39 39 PRO CG C 13 27.998 . . 1 . . . . 39 P CG . 16883 1 457 . 1 1 40 40 SER H H 1 8.302 . . 1 . . . . 40 S HN . 16883 1 458 . 1 1 40 40 SER HA H 1 4.356 . . 1 . . . . 40 S HA . 16883 1 459 . 1 1 40 40 SER HB2 H 1 3.867 . . 2 . . . . 40 S HB1 . 16883 1 460 . 1 1 40 40 SER HB3 H 1 3.804 . . 2 . . . . 40 S HB2 . 16883 1 461 . 1 1 40 40 SER C C 13 174.544 . . 1 . . . . 40 S C . 16883 1 462 . 1 1 40 40 SER CA C 13 58.990 . . 1 . . . . 40 S CA . 16883 1 463 . 1 1 40 40 SER CB C 13 64.260 . . 1 . . . . 40 S CB . 16883 1 464 . 1 1 40 40 SER N N 15 115.880 . . 1 . . . . 40 S N . 16883 1 465 . 1 1 41 41 GLU H H 1 8.476 . . 1 . . . . 41 E HN . 16883 1 466 . 1 1 41 41 GLU HA H 1 4.300 . . 1 . . . . 41 E HA . 16883 1 467 . 1 1 41 41 GLU HB2 H 1 2.012 . . 2 . . . . 41 E HB1 . 16883 1 468 . 1 1 41 41 GLU HB3 H 1 1.890 . . 2 . . . . 41 E HB2 . 16883 1 469 . 1 1 41 41 GLU HG2 H 1 2.188 . . 2 . . . . 41 E HG1 . 16883 1 470 . 1 1 41 41 GLU HG3 H 1 2.215 . . 2 . . . . 41 E HG2 . 16883 1 471 . 1 1 41 41 GLU C C 13 176.497 . . 1 . . . . 41 E C . 16883 1 472 . 1 1 41 41 GLU CA C 13 57.010 . . 1 . . . . 41 E CA . 16883 1 473 . 1 1 41 41 GLU CB C 13 30.690 . . 1 . . . . 41 E CB . 16883 1 474 . 1 1 41 41 GLU CG C 13 36.723 . . 1 . . . . 41 E CG . 16883 1 475 . 1 1 41 41 GLU N N 15 123.300 . . 1 . . . . 41 E N . 16883 1 476 . 1 1 42 42 VAL H H 1 8.162 . . 1 . . . . 42 V HN . 16883 1 477 . 1 1 42 42 VAL HA H 1 4.088 . . 1 . . . . 42 V HA . 16883 1 478 . 1 1 42 42 VAL HB H 1 2.029 . . 1 . . . . 42 V HB . 16883 1 479 . 1 1 42 42 VAL HG21 H 1 0.897 . . 2 . . . . 42 V HG21 . 16883 1 480 . 1 1 42 42 VAL HG22 H 1 0.897 . . 2 . . . . 42 V HG21 . 16883 1 481 . 1 1 42 42 VAL HG23 H 1 0.897 . . 2 . . . . 42 V HG21 . 16883 1 482 . 1 1 42 42 VAL C C 13 176.132 . . 1 . . . . 42 V C . 16883 1 483 . 1 1 42 42 VAL CA C 13 62.490 . . 1 . . . . 42 V CA . 16883 1 484 . 1 1 42 42 VAL CB C 13 33.100 . . 1 . . . . 42 V CB . 16883 1 485 . 1 1 42 42 VAL CG2 C 13 21.071 . . 1 . . . . 42 V CG2 . 16883 1 486 . 1 1 42 42 VAL N N 15 122.380 . . 1 . . . . 42 V N . 16883 1 487 . 1 1 43 43 ALA H H 1 8.406 . . 1 . . . . 43 A HN . 16883 1 488 . 1 1 43 43 ALA HA H 1 4.291 . . 1 . . . . 43 A HA . 16883 1 489 . 1 1 43 43 ALA HB1 H 1 1.367 . . 1 . . . . 43 A HB1 . 16883 1 490 . 1 1 43 43 ALA HB2 H 1 1.367 . . 1 . . . . 43 A HB1 . 16883 1 491 . 1 1 43 43 ALA HB3 H 1 1.367 . . 1 . . . . 43 A HB1 . 16883 1 492 . 1 1 43 43 ALA C C 13 178.432 . . 1 . . . . 43 A C . 16883 1 493 . 1 1 43 43 ALA CA C 13 53.070 . . 1 . . . . 43 A CA . 16883 1 494 . 1 1 43 43 ALA CB C 13 19.440 . . 1 . . . . 43 A CB . 16883 1 495 . 1 1 43 43 ALA N N 15 128.860 . . 1 . . . . 43 A N . 16883 1 496 . 1 1 44 44 GLY H H 1 8.415 . . 1 . . . . 44 G HN . 16883 1 497 . 1 1 44 44 GLY HA2 H 1 3.907 . . 2 . . . . 44 G HA2 . 16883 1 498 . 1 1 44 44 GLY C C 13 174.362 . . 1 . . . . 44 G C . 16883 1 499 . 1 1 44 44 GLY CA C 13 45.610 . . 1 . . . . 44 G CA . 16883 1 500 . 1 1 44 44 GLY N N 15 108.990 . . 1 . . . . 44 G N . 16883 1 501 . 1 1 45 45 ALA HA H 1 4.290 . . 1 . . . . 45 A HA . 16883 1 502 . 1 1 45 45 ALA HB1 H 1 1.346 . . 1 . . . . 45 A HB1 . 16883 1 503 . 1 1 45 45 ALA HB2 H 1 1.346 . . 1 . . . . 45 A HB1 . 16883 1 504 . 1 1 45 45 ALA HB3 H 1 1.346 . . 1 . . . . 45 A HB1 . 16883 1 505 . 1 1 45 45 ALA C C 13 178.451 . . 1 . . . . 45 A C . 16883 1 506 . 1 1 45 45 ALA CA C 13 53.070 . . 1 . . . . 45 A CA . 16883 1 507 . 1 1 45 45 ALA CB C 13 19.300 . . 1 . . . . 45 A CB . 16883 1 508 . 1 1 46 46 GLY H H 1 8.393 . . 1 . . . . 46 G HN . 16883 1 509 . 1 1 46 46 GLY HA2 H 1 3.922 . . 2 . . . . 46 G HA2 . 16883 1 510 . 1 1 46 46 GLY C C 13 174.285 . . 1 . . . . 46 G C . 16883 1 511 . 1 1 46 46 GLY CA C 13 45.550 . . 1 . . . . 46 G CA . 16883 1 512 . 1 1 46 46 GLY N N 15 109.480 . . 1 . . . . 46 G N . 16883 1 513 . 1 1 48 48 ALA HA H 1 4.290 . . 1 . . . . 48 A HA . 16883 1 514 . 1 1 48 48 ALA HB1 H 1 1.378 . . 1 . . . . 48 A HB1 . 16883 1 515 . 1 1 48 48 ALA HB2 H 1 1.378 . . 1 . . . . 48 A HB1 . 16883 1 516 . 1 1 48 48 ALA HB3 H 1 1.378 . . 1 . . . . 48 A HB1 . 16883 1 517 . 1 1 48 48 ALA C C 13 178.193 . . 1 . . . . 48 A C . 16883 1 518 . 1 1 48 48 ALA CA C 13 53.248 . . 1 . . . . 48 A CA . 16883 1 519 . 1 1 48 48 ALA CB C 13 19.239 . . 1 . . . . 48 A CB . 16883 1 520 . 1 1 49 49 SER H H 1 8.129 . . 1 . . . . 49 S HN . 16883 1 521 . 1 1 49 49 SER HA H 1 4.391 . . 1 . . . . 49 S HA . 16883 1 522 . 1 1 49 49 SER HB2 H 1 3.816 . . 2 . . . . 49 S HB1 . 16883 1 523 . 1 1 49 49 SER HB3 H 1 3.866 . . 2 . . . . 49 S HB2 . 16883 1 524 . 1 1 49 49 SER C C 13 175.040 . . 1 . . . . 49 S C . 16883 1 525 . 1 1 49 49 SER CA C 13 58.990 . . 1 . . . . 49 S CA . 16883 1 526 . 1 1 49 49 SER CB C 13 64.071 . . 1 . . . . 49 S CB . 16883 1 527 . 1 1 49 49 SER N N 15 115.040 . . 1 . . . . 49 S N . 16883 1 528 . 1 1 50 50 VAL H H 1 7.979 . . 1 . . . . 50 V HN . 16883 1 529 . 1 1 50 50 VAL HA H 1 4.109 . . 1 . . . . 50 V HA . 16883 1 530 . 1 1 50 50 VAL HB H 1 2.100 . . 1 . . . . 50 V HB . 16883 1 531 . 1 1 50 50 VAL HG21 H 1 0.913 . . 2 . . . . 50 V HG21 . 16883 1 532 . 1 1 50 50 VAL HG22 H 1 0.913 . . 2 . . . . 50 V HG21 . 16883 1 533 . 1 1 50 50 VAL HG23 H 1 0.913 . . 2 . . . . 50 V HG21 . 16883 1 534 . 1 1 50 50 VAL C C 13 176.624 . . 1 . . . . 50 V C . 16883 1 535 . 1 1 50 50 VAL CA C 13 63.090 . . 1 . . . . 50 V CA . 16883 1 536 . 1 1 50 50 VAL CB C 13 32.890 . . 1 . . . . 50 V CB . 16883 1 537 . 1 1 50 50 VAL CG2 C 13 21.370 . . 1 . . . . 50 V CG2 . 16883 1 538 . 1 1 50 50 VAL N N 15 121.610 . . 1 . . . . 50 V N . 16883 1 539 . 1 1 51 51 MET H H 1 8.309 . . 1 . . . . 51 M HN . 16883 1 540 . 1 1 51 51 MET HA H 1 4.440 . . 1 . . . . 51 M HA . 16883 1 541 . 1 1 51 51 MET HB2 H 1 1.977 . . 2 . . . . 51 M HB1 . 16883 1 542 . 1 1 51 51 MET HB3 H 1 2.065 . . 2 . . . . 51 M HB2 . 16883 1 543 . 1 1 51 51 MET HE1 H 1 2.044 . . 1 . . . . 51 M HE1 . 16883 1 544 . 1 1 51 51 MET HE2 H 1 2.044 . . 1 . . . . 51 M HE1 . 16883 1 545 . 1 1 51 51 MET HE3 H 1 2.044 . . 1 . . . . 51 M HE1 . 16883 1 546 . 1 1 51 51 MET HG2 H 1 2.581 . . 2 . . . . 51 M HG1 . 16883 1 547 . 1 1 51 51 MET HG3 H 1 2.503 . . 2 . . . . 51 M HG2 . 16883 1 548 . 1 1 51 51 MET C C 13 176.744 . . 1 . . . . 51 M C . 16883 1 549 . 1 1 51 51 MET CA C 13 56.280 . . 1 . . . . 51 M CA . 16883 1 550 . 1 1 51 51 MET CB C 13 32.870 . . 1 . . . . 51 M CB . 16883 1 551 . 1 1 51 51 MET CE C 13 17.170 . . 1 . . . . 51 M CE . 16883 1 552 . 1 1 51 51 MET CG C 13 32.345 . . 1 . . . . 51 M CG . 16883 1 553 . 1 1 51 51 MET N N 15 123.120 . . 1 . . . . 51 M N . 16883 1 554 . 1 1 52 52 SER H H 1 8.173 . . 1 . . . . 52 S HN . 16883 1 555 . 1 1 52 52 SER HA H 1 4.357 . . 1 . . . . 52 S HA . 16883 1 556 . 1 1 52 52 SER HB2 H 1 3.813 . . 2 . . . . 52 S HB1 . 16883 1 557 . 1 1 52 52 SER HB3 H 1 3.866 . . 2 . . . . 52 S HB2 . 16883 1 558 . 1 1 52 52 SER C C 13 174.448 . . 1 . . . . 52 S C . 16883 1 559 . 1 1 52 52 SER CA C 13 59.070 . . 1 . . . . 52 S CA . 16883 1 560 . 1 1 52 52 SER CB C 13 64.090 . . 1 . . . . 52 S CB . 16883 1 561 . 1 1 52 52 SER N N 15 117.240 . . 1 . . . . 52 S N . 16883 1 562 . 1 1 53 53 ALA H H 1 8.201 . . 1 . . . . 53 A HN . 16883 1 563 . 1 1 53 53 ALA HA H 1 4.323 . . 1 . . . . 53 A HA . 16883 1 564 . 1 1 53 53 ALA HB1 H 1 1.373 . . 1 . . . . 53 A HB1 . 16883 1 565 . 1 1 53 53 ALA HB2 H 1 1.373 . . 1 . . . . 53 A HB1 . 16883 1 566 . 1 1 53 53 ALA HB3 H 1 1.373 . . 1 . . . . 53 A HB1 . 16883 1 567 . 1 1 53 53 ALA C C 13 177.874 . . 1 . . . . 53 A C . 16883 1 568 . 1 1 53 53 ALA CA C 13 53.050 . . 1 . . . . 53 A CA . 16883 1 569 . 1 1 53 53 ALA CB C 13 19.570 . . 1 . . . . 53 A CB . 16883 1 570 . 1 1 53 53 ALA N N 15 125.800 . . 1 . . . . 53 A N . 16883 1 571 . 1 1 54 54 LEU H H 1 8.091 . . 1 . . . . 54 L HN . 16883 1 572 . 1 1 54 54 LEU HA H 1 4.331 . . 1 . . . . 54 L HA . 16883 1 573 . 1 1 54 54 LEU HB2 H 1 1.584 . . 2 . . . . 54 L HB1 . 16883 1 574 . 1 1 54 54 LEU HB3 H 1 1.653 . . 2 . . . . 54 L HB2 . 16883 1 575 . 1 1 54 54 LEU HD11 H 1 0.826 . . 2 . . . . 54 L HD11 . 16883 1 576 . 1 1 54 54 LEU HD12 H 1 0.826 . . 2 . . . . 54 L HD11 . 16883 1 577 . 1 1 54 54 LEU HD13 H 1 0.826 . . 2 . . . . 54 L HD11 . 16883 1 578 . 1 1 54 54 LEU HD21 H 1 0.894 . . 2 . . . . 54 L HD21 . 16883 1 579 . 1 1 54 54 LEU HD22 H 1 0.894 . . 2 . . . . 54 L HD21 . 16883 1 580 . 1 1 54 54 LEU HD23 H 1 0.894 . . 2 . . . . 54 L HD21 . 16883 1 581 . 1 1 54 54 LEU HG H 1 1.630 . . 1 . . . . 54 L HG . 16883 1 582 . 1 1 54 54 LEU C C 13 177.635 . . 1 . . . . 54 L C . 16883 1 583 . 1 1 54 54 LEU CA C 13 55.780 . . 1 . . . . 54 L CA . 16883 1 584 . 1 1 54 54 LEU CB C 13 42.610 . . 1 . . . . 54 L CB . 16883 1 585 . 1 1 54 54 LEU CD1 C 13 23.739 . . 1 . . . . 54 L CD1 . 16883 1 586 . 1 1 54 54 LEU CD2 C 13 25.440 . . 1 . . . . 54 L CD2 . 16883 1 587 . 1 1 54 54 LEU CG C 13 27.075 . . 1 . . . . 54 L CG . 16883 1 588 . 1 1 54 54 LEU N N 15 120.870 . . 1 . . . . 54 L N . 16883 1 589 . 1 1 55 55 THR H H 1 7.827 . . 1 . . . . 55 T HN . 16883 1 590 . 1 1 55 55 THR HA H 1 4.342 . . 1 . . . . 55 T HA . 16883 1 591 . 1 1 55 55 THR HB H 1 4.235 . . 1 . . . . 55 T HB . 16883 1 592 . 1 1 55 55 THR HG21 H 1 1.170 . . 1 . . . . 55 T HG21 . 16883 1 593 . 1 1 55 55 THR HG22 H 1 1.170 . . 1 . . . . 55 T HG21 . 16883 1 594 . 1 1 55 55 THR HG23 H 1 1.170 . . 1 . . . . 55 T HG21 . 16883 1 595 . 1 1 55 55 THR C C 13 174.239 . . 1 . . . . 55 T C . 16883 1 596 . 1 1 55 55 THR CA C 13 62.050 . . 1 . . . . 55 T CA . 16883 1 597 . 1 1 55 55 THR CB C 13 70.066 . . 1 . . . . 55 T CB . 16883 1 598 . 1 1 55 55 THR CG2 C 13 21.850 . . 1 . . . . 55 T CG2 . 16883 1 599 . 1 1 55 55 THR N N 15 113.510 . . 1 . . . . 55 T N . 16883 1 600 . 1 1 56 56 ASP H H 1 8.181 . . 1 . . . . 56 D HN . 16883 1 601 . 1 1 56 56 ASP HA H 1 4.582 . . 1 . . . . 56 D HA . 16883 1 602 . 1 1 56 56 ASP HB2 H 1 2.594 . . 2 . . . . 56 D HB1 . 16883 1 603 . 1 1 56 56 ASP HB3 H 1 2.568 . . 2 . . . . 56 D HB2 . 16883 1 604 . 1 1 56 56 ASP C C 13 174.478 . . 1 . . . . 56 D C . 16883 1 605 . 1 1 56 56 ASP CA C 13 54.750 . . 1 . . . . 56 D CA . 16883 1 606 . 1 1 56 56 ASP CB C 13 41.350 . . 1 . . . . 56 D CB . 16883 1 607 . 1 1 56 56 ASP N N 15 123.580 . . 1 . . . . 56 D N . 16883 1 608 . 1 1 57 57 LYS H H 1 7.558 . . 1 . . . . 57 K HN . 16883 1 609 . 1 1 57 57 LYS HA H 1 4.634 . . 1 . . . . 57 K HA . 16883 1 610 . 1 1 57 57 LYS HB2 H 1 1.738 . . 2 . . . . 57 K HB1 . 16883 1 611 . 1 1 57 57 LYS HB3 H 1 1.608 . . 2 . . . . 57 K HB2 . 16883 1 612 . 1 1 57 57 LYS HD2 H 1 1.507 . . 2 . . . . 57 K HD2 . 16883 1 613 . 1 1 57 57 LYS HE2 H 1 2.821 . . 2 . . . . 57 K HE2 . 16883 1 614 . 1 1 57 57 LYS HG2 H 1 1.267 . . 2 . . . . 57 K HG1 . 16883 1 615 . 1 1 57 57 LYS HG3 H 1 1.241 . . 2 . . . . 57 K HG2 . 16883 1 616 . 1 1 57 57 LYS CA C 13 55.910 . . 1 . . . . 57 K CA . 16883 1 617 . 1 1 57 57 LYS CB C 13 35.600 . . 1 . . . . 57 K CB . 16883 1 618 . 1 1 57 57 LYS CD C 13 29.574 . . 1 . . . . 57 K CD . 16883 1 619 . 1 1 57 57 LYS CE C 13 42.280 . . 1 . . . . 57 K CE . 16883 1 620 . 1 1 57 57 LYS CG C 13 24.823 . . 1 . . . . 57 K CG . 16883 1 621 . 1 1 57 57 LYS N N 15 119.070 . . 1 . . . . 57 K N . 16883 1 622 . 1 1 58 58 ALA H H 1 8.423 . . 1 . . . . 58 A HN . 16883 1 623 . 1 1 58 58 ALA HA H 1 4.574 . . 1 . . . . 58 A HA . 16883 1 624 . 1 1 58 58 ALA HB1 H 1 1.158 . . 1 . . . . 58 A HB1 . 16883 1 625 . 1 1 58 58 ALA HB2 H 1 1.158 . . 1 . . . . 58 A HB1 . 16883 1 626 . 1 1 58 58 ALA HB3 H 1 1.158 . . 1 . . . . 58 A HB1 . 16883 1 627 . 1 1 58 58 ALA C C 13 174.792 . . 1 . . . . 58 A C . 16883 1 628 . 1 1 58 58 ALA CA C 13 51.225 . . 1 . . . . 58 A CA . 16883 1 629 . 1 1 58 58 ALA CB C 13 22.810 . . 1 . . . . 58 A CB . 16883 1 630 . 1 1 58 58 ALA N N 15 122.860 . . 1 . . . . 58 A N . 16883 1 631 . 1 1 59 59 ILE H H 1 8.848 . . 1 . . . . 59 I HN . 16883 1 632 . 1 1 59 59 ILE HA H 1 4.910 . . 1 . . . . 59 I HA . 16883 1 633 . 1 1 59 59 ILE HB H 1 1.505 . . 1 . . . . 59 I HB . 16883 1 634 . 1 1 59 59 ILE HD11 H 1 0.769 . . 1 . . . . 59 I HD11 . 16883 1 635 . 1 1 59 59 ILE HD12 H 1 0.769 . . 1 . . . . 59 I HD11 . 16883 1 636 . 1 1 59 59 ILE HD13 H 1 0.769 . . 1 . . . . 59 I HD11 . 16883 1 637 . 1 1 59 59 ILE HG12 H 1 1.001 . . 1 . . . . 59 I HG11 . 16883 1 638 . 1 1 59 59 ILE HG13 H 1 1.249 . . 1 . . . . 59 I HG12 . 16883 1 639 . 1 1 59 59 ILE HG21 H 1 0.703 . . 2 . . . . 59 I HG21 . 16883 1 640 . 1 1 59 59 ILE HG22 H 1 0.703 . . 2 . . . . 59 I HG21 . 16883 1 641 . 1 1 59 59 ILE HG23 H 1 0.703 . . 2 . . . . 59 I HG21 . 16883 1 642 . 1 1 59 59 ILE C C 13 174.568 . . 1 . . . . 59 I C . 16883 1 643 . 1 1 59 59 ILE CA C 13 58.650 . . 1 . . . . 59 I CA . 16883 1 644 . 1 1 59 59 ILE CB C 13 41.840 . . 1 . . . . 59 I CB . 16883 1 645 . 1 1 59 59 ILE CD1 C 13 13.337 . . 1 . . . . 59 I CD1 . 16883 1 646 . 1 1 59 59 ILE CG1 C 13 28.014 . . 2 . . . . 59 I CG1 . 16883 1 647 . 1 1 59 59 ILE CG2 C 13 17.433 . . 1 . . . . 59 I CG2 . 16883 1 648 . 1 1 59 59 ILE N N 15 119.000 . . 1 . . . . 59 I N . 16883 1 649 . 1 1 60 60 VAL H H 1 8.095 . . 1 . . . . 60 V HN . 16883 1 650 . 1 1 60 60 VAL HA H 1 4.116 . . 1 . . . . 60 V HA . 16883 1 651 . 1 1 60 60 VAL HB H 1 2.389 . . 1 . . . . 60 V HB . 16883 1 652 . 1 1 60 60 VAL HG11 H 1 0.859 . . 2 . . . . 60 V HG11 . 16883 1 653 . 1 1 60 60 VAL HG12 H 1 0.859 . . 2 . . . . 60 V HG11 . 16883 1 654 . 1 1 60 60 VAL HG13 H 1 0.859 . . 2 . . . . 60 V HG11 . 16883 1 655 . 1 1 60 60 VAL HG21 H 1 0.729 . . 2 . . . . 60 V HG21 . 16883 1 656 . 1 1 60 60 VAL HG22 H 1 0.729 . . 2 . . . . 60 V HG21 . 16883 1 657 . 1 1 60 60 VAL HG23 H 1 0.729 . . 2 . . . . 60 V HG21 . 16883 1 658 . 1 1 60 60 VAL C C 13 177.095 . . 1 . . . . 60 V C . 16883 1 659 . 1 1 60 60 VAL CA C 13 63.070 . . 1 . . . . 60 V CA . 16883 1 660 . 1 1 60 60 VAL CB C 13 31.070 . . 1 . . . . 60 V CB . 16883 1 661 . 1 1 60 60 VAL CG1 C 13 23.414 . . 1 . . . . 60 V CG1 . 16883 1 662 . 1 1 60 60 VAL CG2 C 13 21.632 . . 1 . . . . 60 V CG2 . 16883 1 663 . 1 1 60 60 VAL N N 15 124.850 . . 1 . . . . 60 V N . 16883 1 664 . 1 1 61 61 LYS H H 1 9.249 . . 1 . . . . 61 K HN . 16883 1 665 . 1 1 61 61 LYS HA H 1 4.824 . . 1 . . . . 61 K HA . 16883 1 666 . 1 1 61 61 LYS HB2 H 1 1.680 . . 2 . . . . 61 K HB1 . 16883 1 667 . 1 1 61 61 LYS HB3 H 1 1.457 . . 2 . . . . 61 K HB2 . 16883 1 668 . 1 1 61 61 LYS HD2 H 1 1.500 . . 2 . . . . 61 K HD2 . 16883 1 669 . 1 1 61 61 LYS HE2 H 1 2.736 . . 2 . . . . 61 K HE1 . 16883 1 670 . 1 1 61 61 LYS HE3 H 1 2.825 . . 2 . . . . 61 K HE2 . 16883 1 671 . 1 1 61 61 LYS HG2 H 1 1.198 . . 2 . . . . 61 K HG1 . 16883 1 672 . 1 1 61 61 LYS HG3 H 1 1.329 . . 2 . . . . 61 K HG2 . 16883 1 673 . 1 1 61 61 LYS C C 13 174.153 . . 1 . . . . 61 K C . 16883 1 674 . 1 1 61 61 LYS CA C 13 55.630 . . 1 . . . . 61 K CA . 16883 1 675 . 1 1 61 61 LYS CB C 13 37.770 . . 1 . . . . 61 K CB . 16883 1 676 . 1 1 61 61 LYS CD C 13 29.838 . . 1 . . . . 61 K CD . 16883 1 677 . 1 1 61 61 LYS CE C 13 42.354 . . 1 . . . . 61 K CE . 16883 1 678 . 1 1 61 61 LYS CG C 13 25.957 . . 1 . . . . 61 K CG . 16883 1 679 . 1 1 61 61 LYS N N 15 130.360 . . 1 . . . . 61 K N . 16883 1 680 . 1 1 62 62 LYS H H 1 8.695 . . 1 . . . . 62 K HN . 16883 1 681 . 1 1 62 62 LYS HA H 1 5.742 . . 1 . . . . 62 K HA . 16883 1 682 . 1 1 62 62 LYS HB2 H 1 1.865 . . 2 . . . . 62 K HB1 . 16883 1 683 . 1 1 62 62 LYS HB3 H 1 1.531 . . 2 . . . . 62 K HB2 . 16883 1 684 . 1 1 62 62 LYS HD2 H 1 1.406 . . 2 . . . . 62 K HD1 . 16883 1 685 . 1 1 62 62 LYS HD3 H 1 1.327 . . 2 . . . . 62 K HD2 . 16883 1 686 . 1 1 62 62 LYS HE2 H 1 1.876 . . 2 . . . . 62 K HE1 . 16883 1 687 . 1 1 62 62 LYS HE3 H 1 2.150 . . 2 . . . . 62 K HE2 . 16883 1 688 . 1 1 62 62 LYS HG2 H 1 0.920 . . 2 . . . . 62 K HG1 . 16883 1 689 . 1 1 62 62 LYS HG3 H 1 1.069 . . 2 . . . . 62 K HG2 . 16883 1 690 . 1 1 62 62 LYS C C 13 176.200 . . 1 . . . . 62 K C . 16883 1 691 . 1 1 62 62 LYS CA C 13 55.033 . . 1 . . . . 62 K CA . 16883 1 692 . 1 1 62 62 LYS CB C 13 35.668 . . 1 . . . . 62 K CB . 16883 1 693 . 1 1 62 62 LYS CD C 13 30.147 . . 1 . . . . 62 K CD . 16883 1 694 . 1 1 62 62 LYS CE C 13 41.853 . . 1 . . . . 62 K CE . 16883 1 695 . 1 1 62 62 LYS CG C 13 26.009 . . 1 . . . . 62 K CG . 16883 1 696 . 1 1 62 62 LYS N N 15 124.790 . . 1 . . . . 62 K N . 16883 1 697 . 1 1 63 63 GLU H H 1 8.989 . . 1 . . . . 63 E HN . 16883 1 698 . 1 1 63 63 GLU HA H 1 4.910 . . 1 . . . . 63 E HA . 16883 1 699 . 1 1 63 63 GLU HB2 H 1 2.145 . . 2 . . . . 63 E HB1 . 16883 1 700 . 1 1 63 63 GLU HB3 H 1 1.607 . . 2 . . . . 63 E HB2 . 16883 1 701 . 1 1 63 63 GLU HG2 H 1 2.345 . . 2 . . . . 63 E HG1 . 16883 1 702 . 1 1 63 63 GLU HG3 H 1 2.147 . . 2 . . . . 63 E HG2 . 16883 1 703 . 1 1 63 63 GLU C C 13 174.786 . . 1 . . . . 63 E C . 16883 1 704 . 1 1 63 63 GLU CA C 13 54.890 . . 1 . . . . 63 E CA . 16883 1 705 . 1 1 63 63 GLU CB C 13 37.380 . . 1 . . . . 63 E CB . 16883 1 706 . 1 1 63 63 GLU CG C 13 39.458 . . 1 . . . . 63 E CG . 16883 1 707 . 1 1 63 63 GLU N N 15 125.440 . . 1 . . . . 63 E N . 16883 1 708 . 1 1 64 64 LEU H H 1 9.276 . . 1 . . . . 64 L HN . 16883 1 709 . 1 1 64 64 LEU HA H 1 3.954 . . 1 . . . . 64 L HA . 16883 1 710 . 1 1 64 64 LEU HB2 H 1 1.199 . . 2 . . . . 64 L HB1 . 16883 1 711 . 1 1 64 64 LEU HB3 H 1 1.675 . . 2 . . . . 64 L HB2 . 16883 1 712 . 1 1 64 64 LEU HD11 H 1 0.031 . . 2 . . . . 64 L HD11 . 16883 1 713 . 1 1 64 64 LEU HD12 H 1 0.031 . . 2 . . . . 64 L HD11 . 16883 1 714 . 1 1 64 64 LEU HD13 H 1 0.031 . . 2 . . . . 64 L HD11 . 16883 1 715 . 1 1 64 64 LEU HD21 H 1 0.809 . . 2 . . . . 64 L HD21 . 16883 1 716 . 1 1 64 64 LEU HD22 H 1 0.809 . . 2 . . . . 64 L HD21 . 16883 1 717 . 1 1 64 64 LEU HD23 H 1 0.809 . . 2 . . . . 64 L HD21 . 16883 1 718 . 1 1 64 64 LEU HG H 1 1.372 . . 1 . . . . 64 L HG . 16883 1 719 . 1 1 64 64 LEU C C 13 178.628 . . 1 . . . . 64 L C . 16883 1 720 . 1 1 64 64 LEU CA C 13 55.570 . . 1 . . . . 64 L CA . 16883 1 721 . 1 1 64 64 LEU CB C 13 41.400 . . 1 . . . . 64 L CB . 16883 1 722 . 1 1 64 64 LEU CD1 C 13 22.098 . . 1 . . . . 64 L CD1 . 16883 1 723 . 1 1 64 64 LEU CD2 C 13 25.700 . . 1 . . . . 64 L CD2 . 16883 1 724 . 1 1 64 64 LEU CG C 13 27.496 . . 1 . . . . 64 L CG . 16883 1 725 . 1 1 64 64 LEU N N 15 124.120 . . 1 . . . . 64 L N . 16883 1 726 . 1 1 65 65 LEU H H 1 9.017 . . 1 . . . . 65 L HN . 16883 1 727 . 1 1 65 65 LEU HA H 1 3.583 . . 1 . . . . 65 L HA . 16883 1 728 . 1 1 65 65 LEU HB2 H 1 1.721 . . 2 . . . . 65 L HB1 . 16883 1 729 . 1 1 65 65 LEU HB3 H 1 1.194 . . 2 . . . . 65 L HB2 . 16883 1 730 . 1 1 65 65 LEU HD11 H 1 0.229 . . 2 . . . . 65 L HD11 . 16883 1 731 . 1 1 65 65 LEU HD12 H 1 0.229 . . 2 . . . . 65 L HD11 . 16883 1 732 . 1 1 65 65 LEU HD13 H 1 0.229 . . 2 . . . . 65 L HD11 . 16883 1 733 . 1 1 65 65 LEU HD21 H 1 0.477 . . 2 . . . . 65 L HD21 . 16883 1 734 . 1 1 65 65 LEU HD22 H 1 0.477 . . 2 . . . . 65 L HD21 . 16883 1 735 . 1 1 65 65 LEU HD23 H 1 0.477 . . 2 . . . . 65 L HD21 . 16883 1 736 . 1 1 65 65 LEU HG H 1 1.024 . . 1 . . . . 65 L HG . 16883 1 737 . 1 1 65 65 LEU C C 13 177.181 . . 1 . . . . 65 L C . 16883 1 738 . 1 1 65 65 LEU CA C 13 58.470 . . 1 . . . . 65 L CA . 16883 1 739 . 1 1 65 65 LEU CB C 13 41.026 . . 1 . . . . 65 L CB . 16883 1 740 . 1 1 65 65 LEU CD1 C 13 22.108 . . 1 . . . . 65 L CD1 . 16883 1 741 . 1 1 65 65 LEU CD2 C 13 25.528 . . 1 . . . . 65 L CD2 . 16883 1 742 . 1 1 65 65 LEU CG C 13 27.157 . . 1 . . . . 65 L CG . 16883 1 743 . 1 1 65 65 LEU N N 15 126.330 . . 1 . . . . 65 L N . 16883 1 744 . 1 1 66 66 TYR H H 1 8.408 . . 1 . . . . 66 Y HN . 16883 1 745 . 1 1 66 66 TYR HA H 1 4.119 . . 1 . . . . 66 Y HA . 16883 1 746 . 1 1 66 66 TYR HB2 H 1 2.973 . . 2 . . . . 66 Y HB1 . 16883 1 747 . 1 1 66 66 TYR HB3 H 1 2.779 . . 2 . . . . 66 Y HB2 . 16883 1 748 . 1 1 66 66 TYR HD1 H 1 7.059 . . 3 . . . . 66 Y HD1 . 16883 1 749 . 1 1 66 66 TYR HE1 H 1 6.797 . . 3 . . . . 66 Y HE1 . 16883 1 750 . 1 1 66 66 TYR C C 13 178.619 . . 1 . . . . 66 Y C . 16883 1 751 . 1 1 66 66 TYR CA C 13 60.890 . . 1 . . . . 66 Y CA . 16883 1 752 . 1 1 66 66 TYR CB C 13 38.700 . . 1 . . . . 66 Y CB . 16883 1 753 . 1 1 66 66 TYR CD1 C 13 133.098 . . 3 . . . . 66 Y CD1 . 16883 1 754 . 1 1 66 66 TYR CE1 C 13 118.441 . . 3 . . . . 66 Y CE1 . 16883 1 755 . 1 1 66 66 TYR N N 15 115.880 . . 1 . . . . 66 Y N . 16883 1 756 . 1 1 67 67 ASP H H 1 6.736 . . 1 . . . . 67 D HN . 16883 1 757 . 1 1 67 67 ASP HA H 1 4.433 . . 1 . . . . 67 D HA . 16883 1 758 . 1 1 67 67 ASP HB2 H 1 2.675 . . 2 . . . . 67 D HB1 . 16883 1 759 . 1 1 67 67 ASP HB3 H 1 2.702 . . 2 . . . . 67 D HB2 . 16883 1 760 . 1 1 67 67 ASP C C 13 177.728 . . 1 . . . . 67 D C . 16883 1 761 . 1 1 67 67 ASP CA C 13 56.900 . . 1 . . . . 67 D CA . 16883 1 762 . 1 1 67 67 ASP CB C 13 40.990 . . 1 . . . . 67 D CB . 16883 1 763 . 1 1 67 67 ASP N N 15 119.010 . . 1 . . . . 67 D N . 16883 1 764 . 1 1 68 68 VAL H H 1 7.827 . . 1 . . . . 68 V HN . 16883 1 765 . 1 1 68 68 VAL HA H 1 3.473 . . 1 . . . . 68 V HA . 16883 1 766 . 1 1 68 68 VAL HB H 1 1.462 . . 1 . . . . 68 V HB . 16883 1 767 . 1 1 68 68 VAL HG11 H 1 0.411 . . 2 . . . . 68 V HG11 . 16883 1 768 . 1 1 68 68 VAL HG12 H 1 0.411 . . 2 . . . . 68 V HG11 . 16883 1 769 . 1 1 68 68 VAL HG13 H 1 0.411 . . 2 . . . . 68 V HG11 . 16883 1 770 . 1 1 68 68 VAL HG21 H 1 0.419 . . 2 . . . . 68 V HG21 . 16883 1 771 . 1 1 68 68 VAL HG22 H 1 0.419 . . 2 . . . . 68 V HG21 . 16883 1 772 . 1 1 68 68 VAL HG23 H 1 0.419 . . 2 . . . . 68 V HG21 . 16883 1 773 . 1 1 68 68 VAL C C 13 178.445 . . 1 . . . . 68 V C . 16883 1 774 . 1 1 68 68 VAL CA C 13 65.810 . . 1 . . . . 68 V CA . 16883 1 775 . 1 1 68 68 VAL CB C 13 32.800 . . 1 . . . . 68 V CB . 16883 1 776 . 1 1 68 68 VAL CG1 C 13 23.011 . . 1 . . . . 68 V CG1 . 16883 1 777 . 1 1 68 68 VAL CG2 C 13 21.104 . . 1 . . . . 68 V CG2 . 16883 1 778 . 1 1 68 68 VAL N N 15 121.520 . . 1 . . . . 68 V N . 16883 1 779 . 1 1 69 69 ALA H H 1 8.789 . . 1 . . . . 69 A HN . 16883 1 780 . 1 1 69 69 ALA HA H 1 3.784 . . 1 . . . . 69 A HA . 16883 1 781 . 1 1 69 69 ALA HB1 H 1 1.134 . . 1 . . . . 69 A HB1 . 16883 1 782 . 1 1 69 69 ALA HB2 H 1 1.134 . . 1 . . . . 69 A HB1 . 16883 1 783 . 1 1 69 69 ALA HB3 H 1 1.134 . . 1 . . . . 69 A HB1 . 16883 1 784 . 1 1 69 69 ALA C C 13 178.501 . . 1 . . . . 69 A C . 16883 1 785 . 1 1 69 69 ALA CA C 13 55.410 . . 1 . . . . 69 A CA . 16883 1 786 . 1 1 69 69 ALA CB C 13 18.750 . . 1 . . . . 69 A CB . 16883 1 787 . 1 1 69 69 ALA N N 15 121.410 . . 1 . . . . 69 A N . 16883 1 788 . 1 1 70 70 GLY H H 1 7.054 . . 1 . . . . 70 G HN . 16883 1 789 . 1 1 70 70 GLY HA2 H 1 3.850 . . 2 . . . . 70 G HA1 . 16883 1 790 . 1 1 70 70 GLY HA3 H 1 3.687 . . 2 . . . . 70 G HA2 . 16883 1 791 . 1 1 70 70 GLY C C 13 175.961 . . 1 . . . . 70 G C . 16883 1 792 . 1 1 70 70 GLY CA C 13 47.100 . . 1 . . . . 70 G CA . 16883 1 793 . 1 1 70 70 GLY N N 15 104.260 . . 1 . . . . 70 G N . 16883 1 794 . 1 1 71 71 SER H H 1 8.978 . . 1 . . . . 71 S HN . 16883 1 795 . 1 1 71 71 SER HA H 1 4.473 . . 1 . . . . 71 S HA . 16883 1 796 . 1 1 71 71 SER HB2 H 1 3.961 . . 2 . . . . 71 S HB1 . 16883 1 797 . 1 1 71 71 SER HB3 H 1 3.824 . . 2 . . . . 71 S HB2 . 16883 1 798 . 1 1 71 71 SER C C 13 174.420 . . 1 . . . . 71 S C . 16883 1 799 . 1 1 71 71 SER CA C 13 58.480 . . 1 . . . . 71 S CA . 16883 1 800 . 1 1 71 71 SER CB C 13 63.840 . . 1 . . . . 71 S CB . 16883 1 801 . 1 1 71 71 SER N N 15 123.330 . . 1 . . . . 71 S N . 16883 1 802 . 1 1 72 72 ASP H H 1 8.184 . . 1 . . . . 72 D HN . 16883 1 803 . 1 1 72 72 ASP HA H 1 4.686 . . 1 . . . . 72 D HA . 16883 1 804 . 1 1 72 72 ASP HB2 H 1 2.575 . . 2 . . . . 72 D HB1 . 16883 1 805 . 1 1 72 72 ASP HB3 H 1 2.674 . . 2 . . . . 72 D HB2 . 16883 1 806 . 1 1 72 72 ASP C C 13 175.516 . . 1 . . . . 72 D C . 16883 1 807 . 1 1 72 72 ASP CA C 13 55.370 . . 1 . . . . 72 D CA . 16883 1 808 . 1 1 72 72 ASP CB C 13 42.210 . . 1 . . . . 72 D CB . 16883 1 809 . 1 1 72 72 ASP N N 15 124.480 . . 1 . . . . 72 D N . 16883 1 810 . 1 1 73 73 LYS H H 1 8.613 . . 1 . . . . 73 K HN . 16883 1 811 . 1 1 73 73 LYS HA H 1 4.123 . . 1 . . . . 73 K HA . 16883 1 812 . 1 1 73 73 LYS HB2 H 1 1.700 . . 2 . . . . 73 K HB1 . 16883 1 813 . 1 1 73 73 LYS HB3 H 1 1.631 . . 2 . . . . 73 K HB2 . 16883 1 814 . 1 1 73 73 LYS HD2 H 1 1.391 . . 2 . . . . 73 K HD1 . 16883 1 815 . 1 1 73 73 LYS HD3 H 1 1.283 . . 2 . . . . 73 K HD2 . 16883 1 816 . 1 1 73 73 LYS HE2 H 1 2.564 . . 2 . . . . 73 K HE1 . 16883 1 817 . 1 1 73 73 LYS HG2 H 1 1.368 . . 2 . . . . 73 K HG1 . 16883 1 818 . 1 1 73 73 LYS HG3 H 1 1.135 . . 2 . . . . 73 K HG2 . 16883 1 819 . 1 1 73 73 LYS C C 13 174.810 . . 1 . . . . 73 K C . 16883 1 820 . 1 1 73 73 LYS CA C 13 56.413 . . 1 . . . . 73 K CA . 16883 1 821 . 1 1 73 73 LYS CB C 13 33.370 . . 1 . . . . 73 K CB . 16883 1 822 . 1 1 73 73 LYS CD C 13 29.271 . . 1 . . . . 73 K CD . 16883 1 823 . 1 1 73 73 LYS CE C 13 42.360 . . 1 . . . . 73 K CE . 16883 1 824 . 1 1 73 73 LYS CG C 13 25.436 . . 1 . . . . 73 K CG . 16883 1 825 . 1 1 73 73 LYS N N 15 122.059 . . 1 . . . . 73 K N . 16883 1 826 . 1 1 74 74 TYR H H 1 7.595 . . 1 . . . . 74 Y HN . 16883 1 827 . 1 1 74 74 TYR HA H 1 5.704 . . 1 . . . . 74 Y HA . 16883 1 828 . 1 1 74 74 TYR HB2 H 1 2.608 . . 2 . . . . 74 Y HB2 . 16883 1 829 . 1 1 74 74 TYR HD1 H 1 6.692 . . 3 . . . . 74 Y HD1 . 16883 1 830 . 1 1 74 74 TYR HE1 H 1 6.588 . . 3 . . . . 74 Y HE1 . 16883 1 831 . 1 1 74 74 TYR C C 13 173.663 . . 1 . . . . 74 Y C . 16883 1 832 . 1 1 74 74 TYR CA C 13 55.290 . . 1 . . . . 74 Y CA . 16883 1 833 . 1 1 74 74 TYR CB C 13 42.720 . . 1 . . . . 74 Y CB . 16883 1 834 . 1 1 74 74 TYR CD1 C 13 133.339 . . 3 . . . . 74 Y CD1 . 16883 1 835 . 1 1 74 74 TYR CE1 C 13 117.844 . . 3 . . . . 74 Y CE1 . 16883 1 836 . 1 1 74 74 TYR N N 15 116.820 . . 1 . . . . 74 Y N . 16883 1 837 . 1 1 75 75 GLN H H 1 8.869 . . 1 . . . . 75 Q HN . 16883 1 838 . 1 1 75 75 GLN HA H 1 4.636 . . 1 . . . . 75 Q HA . 16883 1 839 . 1 1 75 75 GLN HB2 H 1 1.988 . . 2 . . . . 75 Q HB1 . 16883 1 840 . 1 1 75 75 GLN HB3 H 1 2.047 . . 2 . . . . 75 Q HB2 . 16883 1 841 . 1 1 75 75 GLN HE21 H 1 6.818 . . 2 . . . . 75 Q HE21 . 16883 1 842 . 1 1 75 75 GLN HE22 H 1 7.866 . . 2 . . . . 75 Q HE22 . 16883 1 843 . 1 1 75 75 GLN HG2 H 1 2.130 . . 2 . . . . 75 Q HG2 . 16883 1 844 . 1 1 75 75 GLN C C 13 174.400 . . 1 . . . . 75 Q C . 16883 1 845 . 1 1 75 75 GLN CA C 13 53.900 . . 1 . . . . 75 Q CA . 16883 1 846 . 1 1 75 75 GLN CB C 13 31.680 . . 1 . . . . 75 Q CB . 16883 1 847 . 1 1 75 75 GLN CG C 13 32.035 . . 1 . . . . 75 Q CG . 16883 1 848 . 1 1 75 75 GLN N N 15 115.850 . . 1 . . . . 75 Q N . 16883 1 849 . 1 1 75 75 GLN NE2 N 15 112.427 . . 1 . . . . 75 Q NE2 . 16883 1 850 . 1 1 76 76 VAL H H 1 8.679 . . 1 . . . . 76 V HN . 16883 1 851 . 1 1 76 76 VAL HA H 1 4.595 . . 1 . . . . 76 V HA . 16883 1 852 . 1 1 76 76 VAL HB H 1 1.886 . . 1 . . . . 76 V HB . 16883 1 853 . 1 1 76 76 VAL HG11 H 1 0.895 . . 2 . . . . 76 V HG11 . 16883 1 854 . 1 1 76 76 VAL HG12 H 1 0.895 . . 2 . . . . 76 V HG11 . 16883 1 855 . 1 1 76 76 VAL HG13 H 1 0.895 . . 2 . . . . 76 V HG11 . 16883 1 856 . 1 1 76 76 VAL HG21 H 1 0.945 . . 2 . . . . 76 V HG21 . 16883 1 857 . 1 1 76 76 VAL HG22 H 1 0.945 . . 2 . . . . 76 V HG21 . 16883 1 858 . 1 1 76 76 VAL HG23 H 1 0.945 . . 2 . . . . 76 V HG21 . 16883 1 859 . 1 1 76 76 VAL C C 13 177.233 . . 1 . . . . 76 V C . 16883 1 860 . 1 1 76 76 VAL CA C 13 63.440 . . 1 . . . . 76 V CA . 16883 1 861 . 1 1 76 76 VAL CB C 13 32.060 . . 1 . . . . 76 V CB . 16883 1 862 . 1 1 76 76 VAL CG1 C 13 21.944 . . 1 . . . . 76 V CG1 . 16883 1 863 . 1 1 76 76 VAL CG2 C 13 20.685 . . 1 . . . . 76 V CG2 . 16883 1 864 . 1 1 76 76 VAL N N 15 124.360 . . 1 . . . . 76 V N . 16883 1 865 . 1 1 77 77 ASN H H 1 8.806 . . 1 . . . . 77 N HN . 16883 1 866 . 1 1 77 77 ASN HA H 1 4.748 . . 1 . . . . 77 N HA . 16883 1 867 . 1 1 77 77 ASN HB2 H 1 3.250 . . 2 . . . . 77 N HB1 . 16883 1 868 . 1 1 77 77 ASN HB3 H 1 2.526 . . 2 . . . . 77 N HB2 . 16883 1 869 . 1 1 77 77 ASN HD21 H 1 6.654 . . 2 . . . . 77 N HD21 . 16883 1 870 . 1 1 77 77 ASN HD22 H 1 8.228 . . 2 . . . . 77 N HD22 . 16883 1 871 . 1 1 77 77 ASN C C 13 174.441 . . 1 . . . . 77 N C . 16883 1 872 . 1 1 77 77 ASN CA C 13 52.530 . . 1 . . . . 77 N CA . 16883 1 873 . 1 1 77 77 ASN CB C 13 38.980 . . 1 . . . . 77 N CB . 16883 1 874 . 1 1 77 77 ASN N N 15 127.050 . . 1 . . . . 77 N N . 16883 1 875 . 1 1 77 77 ASN ND2 N 15 110.004 . . 1 . . . . 77 N ND2 . 16883 1 876 . 1 1 78 78 ASN H H 1 8.766 . . 1 . . . . 78 N HN . 16883 1 877 . 1 1 78 78 ASN HA H 1 5.200 . . 1 . . . . 78 N HA . 16883 1 878 . 1 1 78 78 ASN HB2 H 1 2.962 . . 2 . . . . 78 N HB1 . 16883 1 879 . 1 1 78 78 ASN HB3 H 1 2.635 . . 2 . . . . 78 N HB2 . 16883 1 880 . 1 1 78 78 ASN HD21 H 1 7.115 . . 2 . . . . 78 N HD21 . 16883 1 881 . 1 1 78 78 ASN HD22 H 1 7.064 . . 2 . . . . 78 N HD22 . 16883 1 882 . 1 1 78 78 ASN C C 13 178.370 . . 1 . . . . 78 N C . 16883 1 883 . 1 1 78 78 ASN CA C 13 52.860 . . 1 . . . . 78 N CA . 16883 1 884 . 1 1 78 78 ASN CB C 13 36.280 . . 1 . . . . 78 N CB . 16883 1 885 . 1 1 78 78 ASN N N 15 125.510 . . 1 . . . . 78 N N . 16883 1 886 . 1 1 78 78 ASN ND2 N 15 112.400 . . 1 . . . . 78 N ND2 . 16883 1 887 . 1 1 79 79 LYS H H 1 7.791 . . 1 . . . . 79 K HN . 16883 1 888 . 1 1 79 79 LYS HA H 1 3.748 . . 1 . . . . 79 K HA . 16883 1 889 . 1 1 79 79 LYS HB2 H 1 1.534 . . 2 . . . . 79 K HB1 . 16883 1 890 . 1 1 79 79 LYS HB3 H 1 1.407 . . 2 . . . . 79 K HB2 . 16883 1 891 . 1 1 79 79 LYS HD2 H 1 1.515 . . 2 . . . . 79 K HD2 . 16883 1 892 . 1 1 79 79 LYS HE2 H 1 2.839 . . 2 . . . . 79 K HE2 . 16883 1 893 . 1 1 79 79 LYS HG2 H 1 0.951 . . 2 . . . . 79 K HG1 . 16883 1 894 . 1 1 79 79 LYS HG3 H 1 0.684 . . 2 . . . . 79 K HG2 . 16883 1 895 . 1 1 79 79 LYS C C 13 177.017 . . 1 . . . . 79 K C . 16883 1 896 . 1 1 79 79 LYS CA C 13 60.550 . . 1 . . . . 79 K CA . 16883 1 897 . 1 1 79 79 LYS CB C 13 34.260 . . 1 . . . . 79 K CB . 16883 1 898 . 1 1 79 79 LYS CD C 13 30.051 . . 1 . . . . 79 K CD . 16883 1 899 . 1 1 79 79 LYS CE C 13 42.328 . . 1 . . . . 79 K CE . 16883 1 900 . 1 1 79 79 LYS CG C 13 24.288 . . 1 . . . . 79 K CG . 16883 1 901 . 1 1 79 79 LYS N N 15 122.531 . . 1 . . . . 79 K N . 16883 1 902 . 1 1 80 80 HIS H H 1 7.645 . . 1 . . . . 80 H HN . 16883 1 903 . 1 1 80 80 HIS HA H 1 5.099 . . 1 . . . . 80 H HA . 16883 1 904 . 1 1 80 80 HIS HB2 H 1 3.017 . . 2 . . . . 80 H HB1 . 16883 1 905 . 1 1 80 80 HIS HB3 H 1 2.351 . . 2 . . . . 80 H HB2 . 16883 1 906 . 1 1 80 80 HIS HD2 H 1 7.088 . . 1 . . . . 80 H HD2 . 16883 1 907 . 1 1 80 80 HIS HE1 H 1 7.697 . . 1 . . . . 80 H HE1 . 16883 1 908 . 1 1 80 80 HIS C C 13 176.169 . . 1 . . . . 80 H C . 16883 1 909 . 1 1 80 80 HIS CA C 13 55.500 . . 1 . . . . 80 H CA . 16883 1 910 . 1 1 80 80 HIS CB C 13 30.680 . . 1 . . . . 80 H CB . 16883 1 911 . 1 1 80 80 HIS CD2 C 13 125.659 . . 1 . . . . 80 H CD2 . 16883 1 912 . 1 1 80 80 HIS CE1 C 13 138.359 . . 1 . . . . 80 H CE1 . 16883 1 913 . 1 1 80 80 HIS N N 15 114.510 . . 1 . . . . 80 H N . 16883 1 914 . 1 1 81 81 ASP H H 1 7.747 . . 1 . . . . 81 D HN . 16883 1 915 . 1 1 81 81 ASP HA H 1 5.050 . . 1 . . . . 81 D HA . 16883 1 916 . 1 1 81 81 ASP HB2 H 1 2.884 . . 2 . . . . 81 D HB2 . 16883 1 917 . 1 1 81 81 ASP C C 13 176.025 . . 1 . . . . 81 D C . 16883 1 918 . 1 1 81 81 ASP CA C 13 56.690 . . 1 . . . . 81 D CA . 16883 1 919 . 1 1 81 81 ASP CB C 13 40.120 . . 1 . . . . 81 D CB . 16883 1 920 . 1 1 81 81 ASP N N 15 122.312 . . 1 . . . . 81 D N . 16883 1 921 . 1 1 82 82 ASP H H 1 8.410 . . 1 . . . . 82 D HN . 16883 1 922 . 1 1 82 82 ASP HA H 1 4.342 . . 1 . . . . 82 D HA . 16883 1 923 . 1 1 82 82 ASP HB2 H 1 2.651 . . 2 . . . . 82 D HB2 . 16883 1 924 . 1 1 82 82 ASP C C 13 176.448 . . 1 . . . . 82 D C . 16883 1 925 . 1 1 82 82 ASP CA C 13 55.230 . . 1 . . . . 82 D CA . 16883 1 926 . 1 1 82 82 ASP CB C 13 39.620 . . 1 . . . . 82 D CB . 16883 1 927 . 1 1 82 82 ASP N N 15 116.930 . . 1 . . . . 82 D N . 16883 1 928 . 1 1 83 83 LYS H H 1 7.559 . . 1 . . . . 83 K HN . 16883 1 929 . 1 1 83 83 LYS HA H 1 4.204 . . 1 . . . . 83 K HA . 16883 1 930 . 1 1 83 83 LYS HB2 H 1 1.090 . . 2 . . . . 83 K HB2 . 16883 1 931 . 1 1 83 83 LYS HD2 H 1 1.288 . . 2 . . . . 83 K HD2 . 16883 1 932 . 1 1 83 83 LYS HE2 H 1 2.699 . . 2 . . . . 83 K HE1 . 16883 1 933 . 1 1 83 83 LYS HE3 H 1 2.748 . . 2 . . . . 83 K HE2 . 16883 1 934 . 1 1 83 83 LYS HG2 H 1 0.843 . . 2 . . . . 83 K HG1 . 16883 1 935 . 1 1 83 83 LYS HG3 H 1 0.737 . . 2 . . . . 83 K HG2 . 16883 1 936 . 1 1 83 83 LYS C C 13 175.322 . . 1 . . . . 83 K C . 16883 1 937 . 1 1 83 83 LYS CA C 13 56.920 . . 1 . . . . 83 K CA . 16883 1 938 . 1 1 83 83 LYS CB C 13 34.560 . . 1 . . . . 83 K CB . 16883 1 939 . 1 1 83 83 LYS CD C 13 28.823 . . 1 . . . . 83 K CD . 16883 1 940 . 1 1 83 83 LYS CE C 13 41.289 . . 1 . . . . 83 K CE . 16883 1 941 . 1 1 83 83 LYS CG C 13 23.222 . . 1 . . . . 83 K CG . 16883 1 942 . 1 1 83 83 LYS N N 15 120.570 . . 1 . . . . 83 K N . 16883 1 943 . 1 1 84 84 TYR H H 1 7.961 . . 1 . . . . 84 Y HN . 16883 1 944 . 1 1 84 84 TYR HA H 1 4.909 . . 1 . . . . 84 Y HA . 16883 1 945 . 1 1 84 84 TYR HB2 H 1 2.986 . . 2 . . . . 84 Y HB1 . 16883 1 946 . 1 1 84 84 TYR HB3 H 1 2.097 . . 2 . . . . 84 Y HB2 . 16883 1 947 . 1 1 84 84 TYR HD1 H 1 6.486 . . 3 . . . . 84 Y HD1 . 16883 1 948 . 1 1 84 84 TYR HE1 H 1 6.351 . . 3 . . . . 84 Y HE1 . 16883 1 949 . 1 1 84 84 TYR C C 13 174.648 . . 1 . . . . 84 Y C . 16883 1 950 . 1 1 84 84 TYR CA C 13 54.470 . . 1 . . . . 84 Y CA . 16883 1 951 . 1 1 84 84 TYR CB C 13 41.250 . . 1 . . . . 84 Y CB . 16883 1 952 . 1 1 84 84 TYR CD1 C 13 133.078 . . 3 . . . . 84 Y CD1 . 16883 1 953 . 1 1 84 84 TYR CE1 C 13 117.457 . . 3 . . . . 84 Y CE1 . 16883 1 954 . 1 1 84 84 TYR N N 15 120.440 . . 1 . . . . 84 Y N . 16883 1 955 . 1 1 85 85 SER H H 1 8.434 . . 1 . . . . 85 S HN . 16883 1 956 . 1 1 85 85 SER HA H 1 4.966 . . 1 . . . . 85 S HA . 16883 1 957 . 1 1 85 85 SER HB2 H 1 3.791 . . 2 . . . . 85 S HB1 . 16883 1 958 . 1 1 85 85 SER HB3 H 1 3.912 . . 2 . . . . 85 S HB2 . 16883 1 959 . 1 1 85 85 SER C C 13 173.469 . . 1 . . . . 85 S C . 16883 1 960 . 1 1 85 85 SER CA C 13 56.430 . . 1 . . . . 85 S CA . 16883 1 961 . 1 1 85 85 SER CB C 13 63.820 . . 1 . . . . 85 S CB . 16883 1 962 . 1 1 85 85 SER N N 15 116.320 . . 1 . . . . 85 S N . 16883 1 963 . 1 1 86 86 PRO HA H 1 4.464 . . 1 . . . . 86 P HA . 16883 1 964 . 1 1 86 86 PRO HB2 H 1 1.968 . . 2 . . . . 86 P HB1 . 16883 1 965 . 1 1 86 86 PRO HB3 H 1 1.894 . . 2 . . . . 86 P HB2 . 16883 1 966 . 1 1 86 86 PRO HD2 H 1 3.384 . . 2 . . . . 86 P HD1 . 16883 1 967 . 1 1 86 86 PRO HD3 H 1 3.864 . . 2 . . . . 86 P HD2 . 16883 1 968 . 1 1 86 86 PRO HG2 H 1 2.093 . . 2 . . . . 86 P HG2 . 16883 1 969 . 1 1 86 86 PRO CA C 13 63.050 . . 1 . . . . 86 P CA . 16883 1 970 . 1 1 86 86 PRO CB C 13 32.140 . . 1 . . . . 86 P CB . 16883 1 971 . 1 1 86 86 PRO CD C 13 50.400 . . 1 . . . . 86 P CD . 16883 1 972 . 1 1 86 86 PRO CG C 13 28.662 . . 1 . . . . 86 P CG . 16883 1 973 . 1 1 87 87 LEU H H 1 8.505 . . 1 . . . . 87 L HN . 16883 1 974 . 1 1 87 87 LEU HA H 1 4.353 . . 1 . . . . 87 L HA . 16883 1 975 . 1 1 87 87 LEU HB2 H 1 1.195 . . 2 . . . . 87 L HB1 . 16883 1 976 . 1 1 87 87 LEU HB3 H 1 1.490 . . 2 . . . . 87 L HB2 . 16883 1 977 . 1 1 87 87 LEU HD11 H 1 0.833 . . 2 . . . . 87 L HD11 . 16883 1 978 . 1 1 87 87 LEU HD12 H 1 0.833 . . 2 . . . . 87 L HD11 . 16883 1 979 . 1 1 87 87 LEU HD13 H 1 0.833 . . 2 . . . . 87 L HD11 . 16883 1 980 . 1 1 87 87 LEU HD21 H 1 0.655 . . 2 . . . . 87 L HD21 . 16883 1 981 . 1 1 87 87 LEU HD22 H 1 0.655 . . 2 . . . . 87 L HD21 . 16883 1 982 . 1 1 87 87 LEU HD23 H 1 0.655 . . 2 . . . . 87 L HD21 . 16883 1 983 . 1 1 87 87 LEU HG H 1 1.502 . . 1 . . . . 87 L HG . 16883 1 984 . 1 1 87 87 LEU CA C 13 54.120 . . 1 . . . . 87 L CA . 16883 1 985 . 1 1 87 87 LEU CB C 13 41.089 . . 1 . . . . 87 L CB . 16883 1 986 . 1 1 87 87 LEU CD1 C 13 23.313 . . 1 . . . . 87 L CD1 . 16883 1 987 . 1 1 87 87 LEU CD2 C 13 25.772 . . 1 . . . . 87 L CD2 . 16883 1 988 . 1 1 87 87 LEU CG C 13 27.992 . . 1 . . . . 87 L CG . 16883 1 989 . 1 1 87 87 LEU N N 15 124.710 . . 1 . . . . 87 L N . 16883 1 990 . 1 1 89 89 CYS HA H 1 3.886 . . 1 . . . . 89 C HA . 16883 1 991 . 1 1 89 89 CYS HB2 H 1 2.918 . . 2 . . . . 89 C HB2 . 16883 1 992 . 1 1 89 89 CYS C C 13 176.162 . . 1 . . . . 89 C C . 16883 1 993 . 1 1 89 89 CYS CA C 13 63.553 . . 1 . . . . 89 C CA . 16883 1 994 . 1 1 89 89 CYS CB C 13 26.904 . . 1 . . . . 89 C CB . 16883 1 995 . 1 1 90 90 SER H H 1 8.663 . . 1 . . . . 90 S HN . 16883 1 996 . 1 1 90 90 SER HA H 1 4.055 . . 1 . . . . 90 S HA . 16883 1 997 . 1 1 90 90 SER HB2 H 1 3.836 . . 2 . . . . 90 S HB1 . 16883 1 998 . 1 1 90 90 SER HB3 H 1 3.880 . . 2 . . . . 90 S HB2 . 16883 1 999 . 1 1 90 90 SER C C 13 177.057 . . 1 . . . . 90 S C . 16883 1 1000 . 1 1 90 90 SER CA C 13 61.611 . . 1 . . . . 90 S CA . 16883 1 1001 . 1 1 90 90 SER CB C 13 62.130 . . 1 . . . . 90 S CB . 16883 1 1002 . 1 1 90 90 SER N N 15 113.490 . . 1 . . . . 90 S N . 16883 1 1003 . 1 1 91 91 LYS H H 1 7.154 . . 1 . . . . 91 K HN . 16883 1 1004 . 1 1 91 91 LYS HA H 1 4.202 . . 1 . . . . 91 K HA . 16883 1 1005 . 1 1 91 91 LYS HB2 H 1 1.921 . . 2 . . . . 91 K HB2 . 16883 1 1006 . 1 1 91 91 LYS HD2 H 1 1.680 . . 2 . . . . 91 K HD2 . 16883 1 1007 . 1 1 91 91 LYS HE2 H 1 2.942 . . 2 . . . . 91 K HE2 . 16883 1 1008 . 1 1 91 91 LYS HG2 H 1 1.450 . . 2 . . . . 91 K HG1 . 16883 1 1009 . 1 1 91 91 LYS HG3 H 1 1.509 . . 2 . . . . 91 K HG2 . 16883 1 1010 . 1 1 91 91 LYS C C 13 178.877 . . 1 . . . . 91 K C . 16883 1 1011 . 1 1 91 91 LYS CA C 13 58.330 . . 1 . . . . 91 K CA . 16883 1 1012 . 1 1 91 91 LYS CB C 13 32.680 . . 1 . . . . 91 K CB . 16883 1 1013 . 1 1 91 91 LYS CD C 13 29.053 . . 1 . . . . 91 K CD . 16883 1 1014 . 1 1 91 91 LYS CE C 13 42.282 . . 1 . . . . 91 K CE . 16883 1 1015 . 1 1 91 91 LYS CG C 13 25.505 . . 1 . . . . 91 K CG . 16883 1 1016 . 1 1 91 91 LYS N N 15 122.660 . . 1 . . . . 91 K N . 16883 1 1017 . 1 1 92 92 ILE H H 1 7.719 . . 1 . . . . 92 I HN . 16883 1 1018 . 1 1 92 92 ILE HA H 1 3.415 . . 1 . . . . 92 I HA . 16883 1 1019 . 1 1 92 92 ILE HB H 1 1.818 . . 1 . . . . 92 I HB . 16883 1 1020 . 1 1 92 92 ILE HD11 H 1 0.933 . . 1 . . . . 92 I HD11 . 16883 1 1021 . 1 1 92 92 ILE HD12 H 1 0.933 . . 1 . . . . 92 I HD11 . 16883 1 1022 . 1 1 92 92 ILE HD13 H 1 0.933 . . 1 . . . . 92 I HD11 . 16883 1 1023 . 1 1 92 92 ILE HG12 H 1 1.573 . . 1 . . . . 92 I HG11 . 16883 1 1024 . 1 1 92 92 ILE HG13 H 1 1.319 . . 1 . . . . 92 I HG12 . 16883 1 1025 . 1 1 92 92 ILE HG21 H 1 0.679 . . 2 . . . . 92 I HG21 . 16883 1 1026 . 1 1 92 92 ILE HG22 H 1 0.679 . . 2 . . . . 92 I HG21 . 16883 1 1027 . 1 1 92 92 ILE HG23 H 1 0.679 . . 2 . . . . 92 I HG21 . 16883 1 1028 . 1 1 92 92 ILE C C 13 177.621 . . 1 . . . . 92 I C . 16883 1 1029 . 1 1 92 92 ILE CA C 13 66.500 . . 1 . . . . 92 I CA . 16883 1 1030 . 1 1 92 92 ILE CB C 13 38.890 . . 1 . . . . 92 I CB . 16883 1 1031 . 1 1 92 92 ILE CD1 C 13 15.040 . . 1 . . . . 92 I CD1 . 16883 1 1032 . 1 1 92 92 ILE CG1 C 13 27.226 . . 2 . . . . 92 I CG1 . 16883 1 1033 . 1 1 92 92 ILE CG2 C 13 17.879 . . 1 . . . . 92 I CG2 . 16883 1 1034 . 1 1 92 92 ILE N N 15 121.350 . . 1 . . . . 92 I N . 16883 1 1035 . 1 1 93 93 ILE H H 1 8.033 . . 1 . . . . 93 I HN . 16883 1 1036 . 1 1 93 93 ILE HA H 1 3.514 . . 1 . . . . 93 I HA . 16883 1 1037 . 1 1 93 93 ILE HB H 1 1.879 . . 1 . . . . 93 I HB . 16883 1 1038 . 1 1 93 93 ILE HD11 H 1 0.787 . . 1 . . . . 93 I HD11 . 16883 1 1039 . 1 1 93 93 ILE HD12 H 1 0.787 . . 1 . . . . 93 I HD11 . 16883 1 1040 . 1 1 93 93 ILE HD13 H 1 0.787 . . 1 . . . . 93 I HD11 . 16883 1 1041 . 1 1 93 93 ILE HG12 H 1 1.390 . . 1 . . . . 93 I HG11 . 16883 1 1042 . 1 1 93 93 ILE HG13 H 1 1.509 . . 1 . . . . 93 I HG12 . 16883 1 1043 . 1 1 93 93 ILE HG21 H 1 0.909 . . 2 . . . . 93 I HG21 . 16883 1 1044 . 1 1 93 93 ILE HG22 H 1 0.909 . . 2 . . . . 93 I HG21 . 16883 1 1045 . 1 1 93 93 ILE HG23 H 1 0.909 . . 2 . . . . 93 I HG21 . 16883 1 1046 . 1 1 93 93 ILE CA C 13 65.080 . . 1 . . . . 93 I CA . 16883 1 1047 . 1 1 93 93 ILE CB C 13 37.630 . . 1 . . . . 93 I CB . 16883 1 1048 . 1 1 93 93 ILE CD1 C 13 13.098 . . 1 . . . . 93 I CD1 . 16883 1 1049 . 1 1 93 93 ILE CG1 C 13 28.773 . . 2 . . . . 93 I CG1 . 16883 1 1050 . 1 1 93 93 ILE CG2 C 13 18.800 . . 1 . . . . 93 I CG2 . 16883 1 1051 . 1 1 93 93 ILE N N 15 115.840 . . 1 . . . . 93 I N . 16883 1 1052 . 1 1 94 94 GLN H H 1 7.556 . . 1 . . . . 94 Q HN . 16883 1 1053 . 1 1 94 94 GLN HA H 1 3.978 . . 1 . . . . 94 Q HA . 16883 1 1054 . 1 1 94 94 GLN HB2 H 1 2.172 . . 2 . . . . 94 Q HB1 . 16883 1 1055 . 1 1 94 94 GLN HB3 H 1 2.058 . . 2 . . . . 94 Q HB2 . 16883 1 1056 . 1 1 94 94 GLN HE21 H 1 7.569 . . 2 . . . . 94 Q HE21 . 16883 1 1057 . 1 1 94 94 GLN HE22 H 1 6.737 . . 2 . . . . 94 Q HE22 . 16883 1 1058 . 1 1 94 94 GLN HG2 H 1 2.468 . . 2 . . . . 94 Q HG1 . 16883 1 1059 . 1 1 94 94 GLN HG3 H 1 2.276 . . 2 . . . . 94 Q HG2 . 16883 1 1060 . 1 1 94 94 GLN C C 13 178.785 . . 1 . . . . 94 Q C . 16883 1 1061 . 1 1 94 94 GLN CA C 13 59.530 . . 1 . . . . 94 Q CA . 16883 1 1062 . 1 1 94 94 GLN CB C 13 28.820 . . 1 . . . . 94 Q CB . 16883 1 1063 . 1 1 94 94 GLN CG C 13 33.851 . . 1 . . . . 94 Q CG . 16883 1 1064 . 1 1 94 94 GLN N N 15 118.820 . . 1 . . . . 94 Q N . 16883 1 1065 . 1 1 94 94 GLN NE2 N 15 112.264 . . 1 . . . . 94 Q NE2 . 16883 1 1066 . 1 1 95 95 ARG H H 1 7.664 . . 1 . . . . 95 R HN . 16883 1 1067 . 1 1 95 95 ARG HA H 1 3.996 . . 1 . . . . 95 R HA . 16883 1 1068 . 1 1 95 95 ARG HB2 H 1 1.794 . . 2 . . . . 95 R HB1 . 16883 1 1069 . 1 1 95 95 ARG HB3 H 1 1.876 . . 2 . . . . 95 R HB2 . 16883 1 1070 . 1 1 95 95 ARG HD2 H 1 3.014 . . 2 . . . . 95 R HD1 . 16883 1 1071 . 1 1 95 95 ARG HD3 H 1 3.302 . . 2 . . . . 95 R HD2 . 16883 1 1072 . 1 1 95 95 ARG HG2 H 1 1.592 . . 2 . . . . 95 R HG1 . 16883 1 1073 . 1 1 95 95 ARG HG3 H 1 1.684 . . 2 . . . . 95 R HG2 . 16883 1 1074 . 1 1 95 95 ARG C C 13 178.025 . . 1 . . . . 95 R C . 16883 1 1075 . 1 1 95 95 ARG CA C 13 58.810 . . 1 . . . . 95 R CA . 16883 1 1076 . 1 1 95 95 ARG CB C 13 30.050 . . 1 . . . . 95 R CB . 16883 1 1077 . 1 1 95 95 ARG CD C 13 43.779 . . 1 . . . . 95 R CD . 16883 1 1078 . 1 1 95 95 ARG CG C 13 27.873 . . 1 . . . . 95 R CG . 16883 1 1079 . 1 1 95 95 ARG N N 15 119.170 . . 1 . . . . 95 R N . 16883 1 1080 . 1 1 96 96 ALA H H 1 8.237 . . 1 . . . . 96 A HN . 16883 1 1081 . 1 1 96 96 ALA HA H 1 3.818 . . 1 . . . . 96 A HA . 16883 1 1082 . 1 1 96 96 ALA HB1 H 1 1.281 . . 1 . . . . 96 A HB1 . 16883 1 1083 . 1 1 96 96 ALA HB2 H 1 1.281 . . 1 . . . . 96 A HB1 . 16883 1 1084 . 1 1 96 96 ALA HB3 H 1 1.281 . . 1 . . . . 96 A HB1 . 16883 1 1085 . 1 1 96 96 ALA C C 13 178.882 . . 1 . . . . 96 A C . 16883 1 1086 . 1 1 96 96 ALA CA C 13 55.880 . . 1 . . . . 96 A CA . 16883 1 1087 . 1 1 96 96 ALA CB C 13 18.620 . . 1 . . . . 96 A CB . 16883 1 1088 . 1 1 96 96 ALA N N 15 120.520 . . 1 . . . . 96 A N . 16883 1 1089 . 1 1 97 97 GLU H H 1 8.267 . . 1 . . . . 97 E HN . 16883 1 1090 . 1 1 97 97 GLU HA H 1 3.913 . . 1 . . . . 97 E HA . 16883 1 1091 . 1 1 97 97 GLU HB2 H 1 1.970 . . 2 . . . . 97 E HB1 . 16883 1 1092 . 1 1 97 97 GLU HB3 H 1 1.991 . . 2 . . . . 97 E HB2 . 16883 1 1093 . 1 1 97 97 GLU HG2 H 1 2.360 . . 2 . . . . 97 E HG1 . 16883 1 1094 . 1 1 97 97 GLU HG3 H 1 2.117 . . 2 . . . . 97 E HG2 . 16883 1 1095 . 1 1 97 97 GLU C C 13 180.577 . . 1 . . . . 97 E C . 16883 1 1096 . 1 1 97 97 GLU CA C 13 59.680 . . 1 . . . . 97 E CA . 16883 1 1097 . 1 1 97 97 GLU CB C 13 29.370 . . 1 . . . . 97 E CB . 16883 1 1098 . 1 1 97 97 GLU CG C 13 37.041 . . 1 . . . . 97 E CG . 16883 1 1099 . 1 1 97 97 GLU N N 15 113.500 . . 1 . . . . 97 E N . 16883 1 1100 . 1 1 98 98 GLU H H 1 7.828 . . 1 . . . . 98 E HN . 16883 1 1101 . 1 1 98 98 GLU HA H 1 4.058 . . 1 . . . . 98 E HA . 16883 1 1102 . 1 1 98 98 GLU HB2 H 1 2.221 . . 2 . . . . 98 E HB1 . 16883 1 1103 . 1 1 98 98 GLU HB3 H 1 2.058 . . 2 . . . . 98 E HB2 . 16883 1 1104 . 1 1 98 98 GLU HG2 H 1 2.428 . . 2 . . . . 98 E HG1 . 16883 1 1105 . 1 1 98 98 GLU HG3 H 1 2.358 . . 2 . . . . 98 E HG2 . 16883 1 1106 . 1 1 98 98 GLU C C 13 178.049 . . 1 . . . . 98 E C . 16883 1 1107 . 1 1 98 98 GLU CA C 13 58.860 . . 1 . . . . 98 E CA . 16883 1 1108 . 1 1 98 98 GLU CB C 13 30.100 . . 1 . . . . 98 E CB . 16883 1 1109 . 1 1 98 98 GLU CG C 13 36.862 . . 1 . . . . 98 E CG . 16883 1 1110 . 1 1 98 98 GLU N N 15 119.430 . . 1 . . . . 98 E N . 16883 1 1111 . 1 1 99 99 LEU H H 1 7.280 . . 1 . . . . 99 L HN . 16883 1 1112 . 1 1 99 99 LEU HA H 1 4.210 . . 1 . . . . 99 L HA . 16883 1 1113 . 1 1 99 99 LEU HB2 H 1 1.984 . . 2 . . . . 99 L HB1 . 16883 1 1114 . 1 1 99 99 LEU HB3 H 1 1.616 . . 2 . . . . 99 L HB2 . 16883 1 1115 . 1 1 99 99 LEU HD11 H 1 0.834 . . 2 . . . . 99 L HD11 . 16883 1 1116 . 1 1 99 99 LEU HD12 H 1 0.834 . . 2 . . . . 99 L HD11 . 16883 1 1117 . 1 1 99 99 LEU HD13 H 1 0.834 . . 2 . . . . 99 L HD11 . 16883 1 1118 . 1 1 99 99 LEU HD21 H 1 0.920 . . 2 . . . . 99 L HD21 . 16883 1 1119 . 1 1 99 99 LEU HD22 H 1 0.920 . . 2 . . . . 99 L HD21 . 16883 1 1120 . 1 1 99 99 LEU HD23 H 1 0.920 . . 2 . . . . 99 L HD21 . 16883 1 1121 . 1 1 99 99 LEU HG H 1 1.859 . . 1 . . . . 99 L HG . 16883 1 1122 . 1 1 99 99 LEU C C 13 176.824 . . 1 . . . . 99 L C . 16883 1 1123 . 1 1 99 99 LEU CA C 13 55.610 . . 1 . . . . 99 L CA . 16883 1 1124 . 1 1 99 99 LEU CB C 13 44.600 . . 1 . . . . 99 L CB . 16883 1 1125 . 1 1 99 99 LEU CD1 C 13 22.317 . . 1 . . . . 99 L CD1 . 16883 1 1126 . 1 1 99 99 LEU CD2 C 13 27.329 . . 1 . . . . 99 L CD2 . 16883 1 1127 . 1 1 99 99 LEU CG C 13 27.074 . . 1 . . . . 99 L CG . 16883 1 1128 . 1 1 99 99 LEU N N 15 117.910 . . 1 . . . . 99 L N . 16883 1 1129 . 1 1 100 100 VAL H H 1 7.063 . . 1 . . . . 100 V HN . 16883 1 1130 . 1 1 100 100 VAL HA H 1 3.170 . . 1 . . . . 100 V HA . 16883 1 1131 . 1 1 100 100 VAL HB H 1 2.067 . . 1 . . . . 100 V HB . 16883 1 1132 . 1 1 100 100 VAL HG11 H 1 1.137 . . 2 . . . . 100 V HG11 . 16883 1 1133 . 1 1 100 100 VAL HG12 H 1 1.137 . . 2 . . . . 100 V HG11 . 16883 1 1134 . 1 1 100 100 VAL HG13 H 1 1.137 . . 2 . . . . 100 V HG11 . 16883 1 1135 . 1 1 100 100 VAL HG21 H 1 0.969 . . 2 . . . . 100 V HG21 . 16883 1 1136 . 1 1 100 100 VAL HG22 H 1 0.969 . . 2 . . . . 100 V HG21 . 16883 1 1137 . 1 1 100 100 VAL HG23 H 1 0.969 . . 2 . . . . 100 V HG21 . 16883 1 1138 . 1 1 100 100 VAL C C 13 177.782 . . 1 . . . . 100 V C . 16883 1 1139 . 1 1 100 100 VAL CA C 13 66.560 . . 1 . . . . 100 V CA . 16883 1 1140 . 1 1 100 100 VAL CB C 13 31.767 . . 1 . . . . 100 V CB . 16883 1 1141 . 1 1 100 100 VAL CG1 C 13 25.331 . . 1 . . . . 100 V CG1 . 16883 1 1142 . 1 1 100 100 VAL CG2 C 13 22.443 . . 1 . . . . 100 V CG2 . 16883 1 1143 . 1 1 100 100 VAL N N 15 119.440 . . 1 . . . . 100 V N . 16883 1 1144 . 1 1 101 101 GLY H H 1 9.067 . . 1 . . . . 101 G HN . 16883 1 1145 . 1 1 101 101 GLY HA2 H 1 3.603 . . 2 . . . . 101 G HA1 . 16883 1 1146 . 1 1 101 101 GLY HA3 H 1 4.442 . . 2 . . . . 101 G HA2 . 16883 1 1147 . 1 1 101 101 GLY C C 13 174.619 . . 1 . . . . 101 G C . 16883 1 1148 . 1 1 101 101 GLY CA C 13 45.068 . . 1 . . . . 101 G CA . 16883 1 1149 . 1 1 101 101 GLY N N 15 117.030 . . 1 . . . . 101 G N . 16883 1 1150 . 1 1 102 102 GLN H H 1 8.393 . . 1 . . . . 102 Q HN . 16883 1 1151 . 1 1 102 102 GLN HA H 1 4.306 . . 1 . . . . 102 Q HA . 16883 1 1152 . 1 1 102 102 GLN HB2 H 1 2.143 . . 2 . . . . 102 Q HB2 . 16883 1 1153 . 1 1 102 102 GLN HE21 H 1 7.463 . . 2 . . . . 102 Q HE21 . 16883 1 1154 . 1 1 102 102 GLN HE22 H 1 6.907 . . 2 . . . . 102 Q HE22 . 16883 1 1155 . 1 1 102 102 GLN HG2 H 1 2.322 . . 2 . . . . 102 Q HG1 . 16883 1 1156 . 1 1 102 102 GLN HG3 H 1 2.370 . . 2 . . . . 102 Q HG2 . 16883 1 1157 . 1 1 102 102 GLN C C 13 175.041 . . 1 . . . . 102 Q C . 16883 1 1158 . 1 1 102 102 GLN CA C 13 56.290 . . 1 . . . . 102 Q CA . 16883 1 1159 . 1 1 102 102 GLN CB C 13 29.350 . . 1 . . . . 102 Q CB . 16883 1 1160 . 1 1 102 102 GLN CG C 13 34.651 . . 1 . . . . 102 Q CG . 16883 1 1161 . 1 1 102 102 GLN N N 15 120.530 . . 1 . . . . 102 Q N . 16883 1 1162 . 1 1 102 102 GLN NE2 N 15 114.060 . . 1 . . . . 102 Q NE2 . 16883 1 1163 . 1 1 103 103 GLU H H 1 8.310 . . 1 . . . . 103 E HN . 16883 1 1164 . 1 1 103 103 GLU HA H 1 5.001 . . 1 . . . . 103 E HA . 16883 1 1165 . 1 1 103 103 GLU HB2 H 1 1.863 . . 2 . . . . 103 E HB2 . 16883 1 1166 . 1 1 103 103 GLU HG2 H 1 2.283 . . 2 . . . . 103 E HG1 . 16883 1 1167 . 1 1 103 103 GLU HG3 H 1 2.052 . . 2 . . . . 103 E HG2 . 16883 1 1168 . 1 1 103 103 GLU C C 13 177.304 . . 1 . . . . 103 E C . 16883 1 1169 . 1 1 103 103 GLU CA C 13 55.260 . . 1 . . . . 103 E CA . 16883 1 1170 . 1 1 103 103 GLU CB C 13 31.660 . . 1 . . . . 103 E CB . 16883 1 1171 . 1 1 103 103 GLU CG C 13 37.033 . . 1 . . . . 103 E CG . 16883 1 1172 . 1 1 103 103 GLU N N 15 120.460 . . 1 . . . . 103 E N . 16883 1 1173 . 1 1 104 104 VAL H H 1 8.442 . . 1 . . . . 104 V HN . 16883 1 1174 . 1 1 104 104 VAL HA H 1 4.454 . . 1 . . . . 104 V HA . 16883 1 1175 . 1 1 104 104 VAL HB H 1 1.685 . . 1 . . . . 104 V HB . 16883 1 1176 . 1 1 104 104 VAL HG11 H 1 0.651 . . 2 . . . . 104 V HG11 . 16883 1 1177 . 1 1 104 104 VAL HG12 H 1 0.651 . . 2 . . . . 104 V HG11 . 16883 1 1178 . 1 1 104 104 VAL HG13 H 1 0.651 . . 2 . . . . 104 V HG11 . 16883 1 1179 . 1 1 104 104 VAL HG21 H 1 0.454 . . 2 . . . . 104 V HG21 . 16883 1 1180 . 1 1 104 104 VAL HG22 H 1 0.454 . . 2 . . . . 104 V HG21 . 16883 1 1181 . 1 1 104 104 VAL HG23 H 1 0.454 . . 2 . . . . 104 V HG21 . 16883 1 1182 . 1 1 104 104 VAL C C 13 176.073 . . 1 . . . . 104 V C . 16883 1 1183 . 1 1 104 104 VAL CA C 13 60.010 . . 1 . . . . 104 V CA . 16883 1 1184 . 1 1 104 104 VAL CB C 13 34.390 . . 1 . . . . 104 V CB . 16883 1 1185 . 1 1 104 104 VAL CG1 C 13 21.624 . . 1 . . . . 104 V CG1 . 16883 1 1186 . 1 1 104 104 VAL CG2 C 13 20.383 . . 1 . . . . 104 V CG2 . 16883 1 1187 . 1 1 104 104 VAL N N 15 118.470 . . 1 . . . . 104 V N . 16883 1 1188 . 1 1 105 105 LEU H H 1 8.398 . . 1 . . . . 105 L HN . 16883 1 1189 . 1 1 105 105 LEU HA H 1 4.438 . . 1 . . . . 105 L HA . 16883 1 1190 . 1 1 105 105 LEU HB2 H 1 1.544 . . 2 . . . . 105 L HB2 . 16883 1 1191 . 1 1 105 105 LEU HD11 H 1 0.879 . . 2 . . . . 105 L HD11 . 16883 1 1192 . 1 1 105 105 LEU HD12 H 1 0.879 . . 2 . . . . 105 L HD11 . 16883 1 1193 . 1 1 105 105 LEU HD13 H 1 0.879 . . 2 . . . . 105 L HD11 . 16883 1 1194 . 1 1 105 105 LEU HD21 H 1 0.741 . . 2 . . . . 105 L HD21 . 16883 1 1195 . 1 1 105 105 LEU HD22 H 1 0.741 . . 2 . . . . 105 L HD21 . 16883 1 1196 . 1 1 105 105 LEU HD23 H 1 0.741 . . 2 . . . . 105 L HD21 . 16883 1 1197 . 1 1 105 105 LEU HG H 1 1.563 . . 1 . . . . 105 L HG . 16883 1 1198 . 1 1 105 105 LEU C C 13 174.685 . . 1 . . . . 105 L C . 16883 1 1199 . 1 1 105 105 LEU CA C 13 54.550 . . 1 . . . . 105 L CA . 16883 1 1200 . 1 1 105 105 LEU CB C 13 40.469 . . 1 . . . . 105 L CB . 16883 1 1201 . 1 1 105 105 LEU CD1 C 13 25.409 . . 1 . . . . 105 L CD1 . 16883 1 1202 . 1 1 105 105 LEU CD2 C 13 23.278 . . 1 . . . . 105 L CD2 . 16883 1 1203 . 1 1 105 105 LEU CG C 13 27.111 . . 1 . . . . 105 L CG . 16883 1 1204 . 1 1 105 105 LEU N N 15 124.360 . . 1 . . . . 105 L N . 16883 1 1205 . 1 1 106 106 TYR H H 1 7.002 . . 1 . . . . 106 Y HN . 16883 1 1206 . 1 1 106 106 TYR HA H 1 4.589 . . 1 . . . . 106 Y HA . 16883 1 1207 . 1 1 106 106 TYR HB2 H 1 2.981 . . 2 . . . . 106 Y HB1 . 16883 1 1208 . 1 1 106 106 TYR HB3 H 1 2.722 . . 2 . . . . 106 Y HB2 . 16883 1 1209 . 1 1 106 106 TYR HD1 H 1 6.843 . . 3 . . . . 106 Y HD1 . 16883 1 1210 . 1 1 106 106 TYR HE1 H 1 6.701 . . 3 . . . . 106 Y HE1 . 16883 1 1211 . 1 1 106 106 TYR C C 13 174.159 . . 1 . . . . 106 Y C . 16883 1 1212 . 1 1 106 106 TYR CA C 13 55.780 . . 1 . . . . 106 Y CA . 16883 1 1213 . 1 1 106 106 TYR CB C 13 40.190 . . 1 . . . . 106 Y CB . 16883 1 1214 . 1 1 106 106 TYR CD1 C 13 133.318 . . 3 . . . . 106 Y CD1 . 16883 1 1215 . 1 1 106 106 TYR CE1 C 13 118.180 . . 3 . . . . 106 Y CE1 . 16883 1 1216 . 1 1 106 106 TYR N N 15 118.110 . . 1 . . . . 106 Y N . 16883 1 1217 . 1 1 107 107 LYS H H 1 8.003 . . 1 . . . . 107 K HN . 16883 1 1218 . 1 1 107 107 LYS HA H 1 4.213 . . 1 . . . . 107 K HA . 16883 1 1219 . 1 1 107 107 LYS HB2 H 1 1.677 . . 2 . . . . 107 K HB2 . 16883 1 1220 . 1 1 107 107 LYS HD2 H 1 1.615 . . 2 . . . . 107 K HD2 . 16883 1 1221 . 1 1 107 107 LYS HE2 H 1 2.939 . . 2 . . . . 107 K HE2 . 16883 1 1222 . 1 1 107 107 LYS HG2 H 1 1.391 . . 2 . . . . 107 K HG1 . 16883 1 1223 . 1 1 107 107 LYS HG3 H 1 1.471 . . 2 . . . . 107 K HG2 . 16883 1 1224 . 1 1 107 107 LYS C C 13 177.342 . . 1 . . . . 107 K C . 16883 1 1225 . 1 1 107 107 LYS CA C 13 56.144 . . 1 . . . . 107 K CA . 16883 1 1226 . 1 1 107 107 LYS CB C 13 34.220 . . 1 . . . . 107 K CB . 16883 1 1227 . 1 1 107 107 LYS CD C 13 29.383 . . 1 . . . . 107 K CD . 16883 1 1228 . 1 1 107 107 LYS CE C 13 42.383 . . 1 . . . . 107 K CE . 16883 1 1229 . 1 1 107 107 LYS CG C 13 25.358 . . 1 . . . . 107 K CG . 16883 1 1230 . 1 1 107 107 LYS N N 15 118.000 . . 1 . . . . 107 K N . 16883 1 1231 . 1 1 108 108 LEU H H 1 8.609 . . 1 . . . . 108 L HN . 16883 1 1232 . 1 1 108 108 LEU HA H 1 4.210 . . 1 . . . . 108 L HA . 16883 1 1233 . 1 1 108 108 LEU HB2 H 1 1.709 . . 2 . . . . 108 L HB1 . 16883 1 1234 . 1 1 108 108 LEU HB3 H 1 1.332 . . 2 . . . . 108 L HB2 . 16883 1 1235 . 1 1 108 108 LEU HD11 H 1 0.727 . . 2 . . . . 108 L HD11 . 16883 1 1236 . 1 1 108 108 LEU HD12 H 1 0.727 . . 2 . . . . 108 L HD11 . 16883 1 1237 . 1 1 108 108 LEU HD13 H 1 0.727 . . 2 . . . . 108 L HD11 . 16883 1 1238 . 1 1 108 108 LEU HD21 H 1 1.160 . . 2 . . . . 108 L HD21 . 16883 1 1239 . 1 1 108 108 LEU HD22 H 1 1.160 . . 2 . . . . 108 L HD21 . 16883 1 1240 . 1 1 108 108 LEU HD23 H 1 1.160 . . 2 . . . . 108 L HD21 . 16883 1 1241 . 1 1 108 108 LEU HG H 1 1.458 . . 1 . . . . 108 L HG . 16883 1 1242 . 1 1 108 108 LEU C C 13 175.350 . . 1 . . . . 108 L C . 16883 1 1243 . 1 1 108 108 LEU CA C 13 56.160 . . 1 . . . . 108 L CA . 16883 1 1244 . 1 1 108 108 LEU CB C 13 40.825 . . 1 . . . . 108 L CB . 16883 1 1245 . 1 1 108 108 LEU CD1 C 13 25.582 . . 1 . . . . 108 L CD1 . 16883 1 1246 . 1 1 108 108 LEU CD2 C 13 22.873 . . 1 . . . . 108 L CD2 . 16883 1 1247 . 1 1 108 108 LEU CG C 13 27.682 . . 1 . . . . 108 L CG . 16883 1 1248 . 1 1 108 108 LEU N N 15 125.010 . . 1 . . . . 108 L N . 16883 1 1249 . 1 1 109 109 THR H H 1 7.617 . . 1 . . . . 109 T HN . 16883 1 1250 . 1 1 109 109 THR HA H 1 4.620 . . 1 . . . . 109 T HA . 16883 1 1251 . 1 1 109 109 THR HB H 1 4.643 . . 1 . . . . 109 T HB . 16883 1 1252 . 1 1 109 109 THR HG21 H 1 1.131 . . 1 . . . . 109 T HG21 . 16883 1 1253 . 1 1 109 109 THR HG22 H 1 1.131 . . 1 . . . . 109 T HG21 . 16883 1 1254 . 1 1 109 109 THR HG23 H 1 1.131 . . 1 . . . . 109 T HG21 . 16883 1 1255 . 1 1 109 109 THR CA C 13 59.170 . . 1 . . . . 109 T CA . 16883 1 1256 . 1 1 109 109 THR CB C 13 73.100 . . 1 . . . . 109 T CB . 16883 1 1257 . 1 1 109 109 THR CG2 C 13 22.461 . . 1 . . . . 109 T CG2 . 16883 1 1258 . 1 1 109 109 THR N N 15 117.600 . . 1 . . . . 109 T N . 16883 1 1259 . 1 1 110 110 SER HA H 1 4.750 . . 1 . . . . 110 S HA . 16883 1 1260 . 1 1 110 110 SER HB2 H 1 4.136 . . 2 . . . . 110 S HB2 . 16883 1 1261 . 1 1 110 110 SER C C 13 177.223 . . 1 . . . . 110 S C . 16883 1 1262 . 1 1 110 110 SER CA C 13 63.190 . . 1 . . . . 110 S CA . 16883 1 1263 . 1 1 110 110 SER CB C 13 63.500 . . 1 . . . . 110 S CB . 16883 1 1264 . 1 1 111 111 GLU H H 1 8.965 . . 1 . . . . 111 E HN . 16883 1 1265 . 1 1 111 111 GLU HA H 1 4.092 . . 1 . . . . 111 E HA . 16883 1 1266 . 1 1 111 111 GLU HB2 H 1 1.997 . . 2 . . . . 111 E HB1 . 16883 1 1267 . 1 1 111 111 GLU HB3 H 1 1.861 . . 2 . . . . 111 E HB2 . 16883 1 1268 . 1 1 111 111 GLU HG2 H 1 2.276 . . 2 . . . . 111 E HG1 . 16883 1 1269 . 1 1 111 111 GLU HG3 H 1 2.307 . . 2 . . . . 111 E HG2 . 16883 1 1270 . 1 1 111 111 GLU C C 13 179.208 . . 1 . . . . 111 E C . 16883 1 1271 . 1 1 111 111 GLU CA C 13 60.300 . . 1 . . . . 111 E CA . 16883 1 1272 . 1 1 111 111 GLU CB C 13 29.310 . . 1 . . . . 111 E CB . 16883 1 1273 . 1 1 111 111 GLU CG C 13 37.048 . . 1 . . . . 111 E CG . 16883 1 1274 . 1 1 111 111 GLU N N 15 119.910 . . 1 . . . . 111 E N . 16883 1 1275 . 1 1 112 112 ASN H H 1 8.048 . . 1 . . . . 112 N HN . 16883 1 1276 . 1 1 112 112 ASN HA H 1 4.530 . . 1 . . . . 112 N HA . 16883 1 1277 . 1 1 112 112 ASN HB2 H 1 3.056 . . 2 . . . . 112 N HB1 . 16883 1 1278 . 1 1 112 112 ASN HB3 H 1 2.617 . . 2 . . . . 112 N HB2 . 16883 1 1279 . 1 1 112 112 ASN HD21 H 1 8.579 . . 2 . . . . 112 N HD21 . 16883 1 1280 . 1 1 112 112 ASN HD22 H 1 7.034 . . 2 . . . . 112 N HD22 . 16883 1 1281 . 1 1 112 112 ASN C C 13 178.569 . . 1 . . . . 112 N C . 16883 1 1282 . 1 1 112 112 ASN CA C 13 55.630 . . 1 . . . . 112 N CA . 16883 1 1283 . 1 1 112 112 ASN CB C 13 37.650 . . 1 . . . . 112 N CB . 16883 1 1284 . 1 1 112 112 ASN N N 15 120.140 . . 1 . . . . 112 N N . 16883 1 1285 . 1 1 112 112 ASN ND2 N 15 113.075 . . 1 . . . . 112 N ND2 . 16883 1 1286 . 1 1 113 113 CYS H H 1 8.778 . . 1 . . . . 113 C HN . 16883 1 1287 . 1 1 113 113 CYS HA H 1 4.322 . . 1 . . . . 113 C HA . 16883 1 1288 . 1 1 113 113 CYS HB2 H 1 3.672 . . 2 . . . . 113 C HB1 . 16883 1 1289 . 1 1 113 113 CYS HB3 H 1 3.363 . . 2 . . . . 113 C HB2 . 16883 1 1290 . 1 1 113 113 CYS CA C 13 64.830 . . 1 . . . . 113 C CA . 16883 1 1291 . 1 1 113 113 CYS CB C 13 27.320 . . 1 . . . . 113 C CB . 16883 1 1292 . 1 1 113 113 CYS N N 15 121.070 . . 1 . . . . 113 C N . 16883 1 1293 . 1 1 114 114 GLU H H 1 8.101 . . 1 . . . . 114 E HN . 16883 1 1294 . 1 1 114 114 GLU HA H 1 3.174 . . 1 . . . . 114 E HA . 16883 1 1295 . 1 1 114 114 GLU HB2 H 1 1.689 . . 2 . . . . 114 E HB1 . 16883 1 1296 . 1 1 114 114 GLU HB3 H 1 1.359 . . 2 . . . . 114 E HB2 . 16883 1 1297 . 1 1 114 114 GLU HG2 H 1 0.528 . . 2 . . . . 114 E HG1 . 16883 1 1298 . 1 1 114 114 GLU HG3 H 1 1.448 . . 2 . . . . 114 E HG2 . 16883 1 1299 . 1 1 114 114 GLU C C 13 178.065 . . 1 . . . . 114 E C . 16883 1 1300 . 1 1 114 114 GLU CA C 13 59.610 . . 1 . . . . 114 E CA . 16883 1 1301 . 1 1 114 114 GLU CB C 13 29.540 . . 1 . . . . 114 E CB . 16883 1 1302 . 1 1 114 114 GLU CG C 13 35.192 . . 1 . . . . 114 E CG . 16883 1 1303 . 1 1 114 114 GLU N N 15 122.000 . . 1 . . . . 114 E N . 16883 1 1304 . 1 1 115 115 HIS H H 1 8.239 . . 1 . . . . 115 H HN . 16883 1 1305 . 1 1 115 115 HIS HA H 1 4.184 . . 1 . . . . 115 H HA . 16883 1 1306 . 1 1 115 115 HIS HB2 H 1 3.212 . . 2 . . . . 115 H HB2 . 16883 1 1307 . 1 1 115 115 HIS HD2 H 1 6.978 . . 1 . . . . 115 H HD2 . 16883 1 1308 . 1 1 115 115 HIS HE1 H 1 7.998 . . 1 . . . . 115 H HE1 . 16883 1 1309 . 1 1 115 115 HIS C C 13 177.187 . . 1 . . . . 115 H C . 16883 1 1310 . 1 1 115 115 HIS CA C 13 60.340 . . 1 . . . . 115 H CA . 16883 1 1311 . 1 1 115 115 HIS CB C 13 30.226 . . 1 . . . . 115 H CB . 16883 1 1312 . 1 1 115 115 HIS CD2 C 13 114.400 . . 1 . . . . 115 H CD2 . 16883 1 1313 . 1 1 115 115 HIS CE1 C 13 137.520 . . 1 . . . . 115 H CE1 . 16883 1 1314 . 1 1 115 115 HIS N N 15 119.750 . . 1 . . . . 115 H N . 16883 1 1315 . 1 1 116 116 PHE H H 1 8.134 . . 1 . . . . 116 F HN . 16883 1 1316 . 1 1 116 116 PHE HA H 1 4.252 . . 1 . . . . 116 F HA . 16883 1 1317 . 1 1 116 116 PHE HB2 H 1 3.496 . . 2 . . . . 116 F HB1 . 16883 1 1318 . 1 1 116 116 PHE HB3 H 1 3.127 . . 2 . . . . 116 F HB2 . 16883 1 1319 . 1 1 116 116 PHE HD1 H 1 7.270 . . 3 . . . . 116 F HD1 . 16883 1 1320 . 1 1 116 116 PHE HE1 H 1 7.006 . . 3 . . . . 116 F HE1 . 16883 1 1321 . 1 1 116 116 PHE C C 13 177.340 . . 1 . . . . 116 F C . 16883 1 1322 . 1 1 116 116 PHE CA C 13 61.780 . . 1 . . . . 116 F CA . 16883 1 1323 . 1 1 116 116 PHE CB C 13 40.020 . . 1 . . . . 116 F CB . 16883 1 1324 . 1 1 116 116 PHE CD1 C 13 132.222 . . 3 . . . . 116 F CD1 . 16883 1 1325 . 1 1 116 116 PHE CE1 C 13 130.693 . . 3 . . . . 116 F CE1 . 16883 1 1326 . 1 1 116 116 PHE N N 15 118.770 . . 1 . . . . 116 F N . 16883 1 1327 . 1 1 117 117 VAL H H 1 7.409 . . 1 . . . . 117 V HN . 16883 1 1328 . 1 1 117 117 VAL HA H 1 3.794 . . 1 . . . . 117 V HA . 16883 1 1329 . 1 1 117 117 VAL HB H 1 2.313 . . 1 . . . . 117 V HB . 16883 1 1330 . 1 1 117 117 VAL HG11 H 1 1.264 . . 2 . . . . 117 V HG11 . 16883 1 1331 . 1 1 117 117 VAL HG12 H 1 1.264 . . 2 . . . . 117 V HG11 . 16883 1 1332 . 1 1 117 117 VAL HG13 H 1 1.264 . . 2 . . . . 117 V HG11 . 16883 1 1333 . 1 1 117 117 VAL HG21 H 1 1.163 . . 2 . . . . 117 V HG21 . 16883 1 1334 . 1 1 117 117 VAL HG22 H 1 1.163 . . 2 . . . . 117 V HG21 . 16883 1 1335 . 1 1 117 117 VAL HG23 H 1 1.163 . . 2 . . . . 117 V HG21 . 16883 1 1336 . 1 1 117 117 VAL C C 13 177.986 . . 1 . . . . 117 V C . 16883 1 1337 . 1 1 117 117 VAL CA C 13 65.080 . . 1 . . . . 117 V CA . 16883 1 1338 . 1 1 117 117 VAL CB C 13 30.820 . . 1 . . . . 117 V CB . 16883 1 1339 . 1 1 117 117 VAL CG1 C 13 21.042 . . 1 . . . . 117 V CG1 . 16883 1 1340 . 1 1 117 117 VAL CG2 C 13 22.754 . . 1 . . . . 117 V CG2 . 16883 1 1341 . 1 1 117 117 VAL N N 15 109.400 . . 1 . . . . 117 V N . 16883 1 1342 . 1 1 118 118 ASN H H 1 8.246 . . 1 . . . . 118 N HN . 16883 1 1343 . 1 1 118 118 ASN HA H 1 4.440 . . 1 . . . . 118 N HA . 16883 1 1344 . 1 1 118 118 ASN HB2 H 1 2.949 . . 2 . . . . 118 N HB1 . 16883 1 1345 . 1 1 118 118 ASN HB3 H 1 2.742 . . 2 . . . . 118 N HB2 . 16883 1 1346 . 1 1 118 118 ASN HD21 H 1 6.899 . . 2 . . . . 118 N HD21 . 16883 1 1347 . 1 1 118 118 ASN CA C 13 57.050 . . 1 . . . . 118 N CA . 16883 1 1348 . 1 1 118 118 ASN CB C 13 38.960 . . 1 . . . . 118 N CB . 16883 1 1349 . 1 1 118 118 ASN N N 15 123.283 . . 1 . . . . 118 N N . 16883 1 1350 . 1 1 118 118 ASN ND2 N 15 108.629 . . 1 . . . . 118 N ND2 . 16883 1 1351 . 1 1 119 119 GLU H H 1 8.084 . . 1 . . . . 119 E HN . 16883 1 1352 . 1 1 119 119 GLU HA H 1 3.657 . . 1 . . . . 119 E HA . 16883 1 1353 . 1 1 119 119 GLU HB2 H 1 1.993 . . 2 . . . . 119 E HB1 . 16883 1 1354 . 1 1 119 119 GLU HB3 H 1 1.843 . . 2 . . . . 119 E HB2 . 16883 1 1355 . 1 1 119 119 GLU HG2 H 1 1.869 . . 2 . . . . 119 E HG1 . 16883 1 1356 . 1 1 119 119 GLU HG3 H 1 2.036 . . 2 . . . . 119 E HG2 . 16883 1 1357 . 1 1 119 119 GLU C C 13 180.273 . . 1 . . . . 119 E C . 16883 1 1358 . 1 1 119 119 GLU CA C 13 60.070 . . 1 . . . . 119 E CA . 16883 1 1359 . 1 1 119 119 GLU CB C 13 29.160 . . 1 . . . . 119 E CB . 16883 1 1360 . 1 1 119 119 GLU CG C 13 37.304 . . 1 . . . . 119 E CG . 16883 1 1361 . 1 1 119 119 GLU N N 15 120.870 . . 1 . . . . 119 E N . 16883 1 1362 . 1 1 120 120 LEU H H 1 6.837 . . 1 . . . . 120 L HN . 16883 1 1363 . 1 1 120 120 LEU HA H 1 3.863 . . 1 . . . . 120 L HA . 16883 1 1364 . 1 1 120 120 LEU HB2 H 1 1.750 . . 2 . . . . 120 L HB1 . 16883 1 1365 . 1 1 120 120 LEU HB3 H 1 0.944 . . 2 . . . . 120 L HB2 . 16883 1 1366 . 1 1 120 120 LEU HD11 H 1 0.492 . . 2 . . . . 120 L HD11 . 16883 1 1367 . 1 1 120 120 LEU HD12 H 1 0.492 . . 2 . . . . 120 L HD11 . 16883 1 1368 . 1 1 120 120 LEU HD13 H 1 0.492 . . 2 . . . . 120 L HD11 . 16883 1 1369 . 1 1 120 120 LEU HD21 H 1 0.330 . . 2 . . . . 120 L HD21 . 16883 1 1370 . 1 1 120 120 LEU HD22 H 1 0.330 . . 2 . . . . 120 L HD21 . 16883 1 1371 . 1 1 120 120 LEU HD23 H 1 0.330 . . 2 . . . . 120 L HD21 . 16883 1 1372 . 1 1 120 120 LEU HG H 1 1.254 . . 1 . . . . 120 L HG . 16883 1 1373 . 1 1 120 120 LEU C C 13 176.704 . . 1 . . . . 120 L C . 16883 1 1374 . 1 1 120 120 LEU CA C 13 57.760 . . 1 . . . . 120 L CA . 16883 1 1375 . 1 1 120 120 LEU CB C 13 42.580 . . 1 . . . . 120 L CB . 16883 1 1376 . 1 1 120 120 LEU CD1 C 13 23.060 . . 1 . . . . 120 L CD1 . 16883 1 1377 . 1 1 120 120 LEU CD2 C 13 26.811 . . 1 . . . . 120 L CD2 . 16883 1 1378 . 1 1 120 120 LEU CG C 13 26.672 . . 1 . . . . 120 L CG . 16883 1 1379 . 1 1 120 120 LEU N N 15 119.050 . . 1 . . . . 120 L N . 16883 1 1380 . 1 1 121 121 ARG H H 1 7.549 . . 1 . . . . 121 R HN . 16883 1 1381 . 1 1 121 121 ARG HA H 1 3.871 . . 1 . . . . 121 R HA . 16883 1 1382 . 1 1 121 121 ARG HB2 H 1 1.003 . . 2 . . . . 121 R HB1 . 16883 1 1383 . 1 1 121 121 ARG HB3 H 1 1.464 . . 2 . . . . 121 R HB2 . 16883 1 1384 . 1 1 121 121 ARG HD2 H 1 2.662 . . 2 . . . . 121 R HD1 . 16883 1 1385 . 1 1 121 121 ARG HD3 H 1 3.140 . . 2 . . . . 121 R HD2 . 16883 1 1386 . 1 1 121 121 ARG HG2 H 1 0.016 . . 2 . . . . 121 R HG2 . 16883 1 1387 . 1 1 121 121 ARG C C 13 175.307 . . 1 . . . . 121 R C . 16883 1 1388 . 1 1 121 121 ARG CA C 13 59.028 . . 1 . . . . 121 R CA . 16883 1 1389 . 1 1 121 121 ARG CB C 13 31.030 . . 1 . . . . 121 R CB . 16883 1 1390 . 1 1 121 121 ARG CD C 13 44.360 . . 1 . . . . 121 R CD . 16883 1 1391 . 1 1 121 121 ARG CG C 13 29.053 . . 1 . . . . 121 R CG . 16883 1 1392 . 1 1 121 121 ARG N N 15 115.790 . . 1 . . . . 121 R N . 16883 1 1393 . 1 1 122 122 TYR H H 1 8.225 . . 1 . . . . 122 Y HN . 16883 1 1394 . 1 1 122 122 TYR HA H 1 4.675 . . 1 . . . . 122 Y HA . 16883 1 1395 . 1 1 122 122 TYR HB2 H 1 2.909 . . 2 . . . . 122 Y HB1 . 16883 1 1396 . 1 1 122 122 TYR HB3 H 1 2.675 . . 2 . . . . 122 Y HB2 . 16883 1 1397 . 1 1 122 122 TYR HD1 H 1 6.841 . . 3 . . . . 122 Y HD1 . 16883 1 1398 . 1 1 122 122 TYR HE1 H 1 6.699 . . 3 . . . . 122 Y HE1 . 16883 1 1399 . 1 1 122 122 TYR C C 13 177.450 . . 1 . . . . 122 Y C . 16883 1 1400 . 1 1 122 122 TYR CA C 13 57.980 . . 1 . . . . 122 Y CA . 16883 1 1401 . 1 1 122 122 TYR CB C 13 40.370 . . 1 . . . . 122 Y CB . 16883 1 1402 . 1 1 122 122 TYR CD1 C 13 133.284 . . 3 . . . . 122 Y CD1 . 16883 1 1403 . 1 1 122 122 TYR CE1 C 13 118.159 . . 3 . . . . 122 Y CE1 . 16883 1 1404 . 1 1 122 122 TYR N N 15 111.200 . . 1 . . . . 122 Y N . 16883 1 1405 . 1 1 123 123 GLY H H 1 7.703 . . 1 . . . . 123 G HN . 16883 1 1406 . 1 1 123 123 GLY HA2 H 1 3.807 . . 2 . . . . 123 G HA1 . 16883 1 1407 . 1 1 123 123 GLY HA3 H 1 4.072 . . 2 . . . . 123 G HA2 . 16883 1 1408 . 1 1 123 123 GLY C C 13 172.785 . . 1 . . . . 123 G C . 16883 1 1409 . 1 1 123 123 GLY CA C 13 45.822 . . 1 . . . . 123 G CA . 16883 1 1410 . 1 1 123 123 GLY N N 15 109.180 . . 1 . . . . 123 G N . 16883 1 1411 . 1 1 124 124 VAL H H 1 7.127 . . 1 . . . . 124 V HN . 16883 1 1412 . 1 1 124 124 VAL HA H 1 4.037 . . 1 . . . . 124 V HA . 16883 1 1413 . 1 1 124 124 VAL HB H 1 1.720 . . 1 . . . . 124 V HB . 16883 1 1414 . 1 1 124 124 VAL HG11 H 1 0.582 . . 2 . . . . 124 V HG11 . 16883 1 1415 . 1 1 124 124 VAL HG12 H 1 0.582 . . 2 . . . . 124 V HG11 . 16883 1 1416 . 1 1 124 124 VAL HG13 H 1 0.582 . . 2 . . . . 124 V HG11 . 16883 1 1417 . 1 1 124 124 VAL HG21 H 1 0.503 . . 2 . . . . 124 V HG21 . 16883 1 1418 . 1 1 124 124 VAL HG22 H 1 0.503 . . 2 . . . . 124 V HG21 . 16883 1 1419 . 1 1 124 124 VAL HG23 H 1 0.503 . . 2 . . . . 124 V HG21 . 16883 1 1420 . 1 1 124 124 VAL C C 13 173.708 . . 1 . . . . 124 V C . 16883 1 1421 . 1 1 124 124 VAL CA C 13 61.320 . . 1 . . . . 124 V CA . 16883 1 1422 . 1 1 124 124 VAL CB C 13 33.900 . . 1 . . . . 124 V CB . 16883 1 1423 . 1 1 124 124 VAL CG1 C 13 20.837 . . 1 . . . . 124 V CG1 . 16883 1 1424 . 1 1 124 124 VAL CG2 C 13 19.937 . . 1 . . . . 124 V CG2 . 16883 1 1425 . 1 1 124 124 VAL N N 15 117.200 . . 1 . . . . 124 V N . 16883 1 1426 . 1 1 125 125 ALA H H 1 7.819 . . 1 . . . . 125 A HN . 16883 1 1427 . 1 1 125 125 ALA HA H 1 4.025 . . 1 . . . . 125 A HA . 16883 1 1428 . 1 1 125 125 ALA HB1 H 1 1.115 . . 1 . . . . 125 A HB1 . 16883 1 1429 . 1 1 125 125 ALA HB2 H 1 1.115 . . 1 . . . . 125 A HB1 . 16883 1 1430 . 1 1 125 125 ALA HB3 H 1 1.115 . . 1 . . . . 125 A HB1 . 16883 1 1431 . 1 1 125 125 ALA C C 13 182.629 . . 1 . . . . 125 A C . 16883 1 1432 . 1 1 125 125 ALA CA C 13 53.920 . . 1 . . . . 125 A CA . 16883 1 1433 . 1 1 125 125 ALA CB C 13 20.660 . . 1 . . . . 125 A CB . 16883 1 1434 . 1 1 125 125 ALA N N 15 132.579 . . 1 . . . . 125 A N . 16883 1 stop_ save_