data_18433 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18433 _Entry.Title ; Solution structure of the mouse Rev1 CTD in complex with the Rev1-interacting Region (RIR)of Pol Kappa ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-05-01 _Entry.Accession_date 2012-05-01 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Jiangxin Liu . . . 18433 2 Jessica Wojtaszek . . . 18433 3 Pei Zhou . . . 18433 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 18433 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Protein/peptide complex' . 18433 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18433 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 460 18433 '15N chemical shifts' 132 18433 '1H chemical shifts' 960 18433 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 2 . . 2013-02-08 2012-05-01 update BMRB 'update entry citation' 18433 1 . . 2012-06-18 2012-05-01 original author 'original release' 18433 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 18431 'mouse Rev1 C-terminal domain' 18433 PDB 2LSJ 'BMRB Entry Tracking System' 18433 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18433 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22700975 _Citation.Full_citation . _Citation.Title 'Multifaceted recognition of vertebrate Rev1 by translesion polymerases and .' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full 'The Journal of biological chemistry' _Citation.Journal_volume 287 _Citation.Journal_issue 31 _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 26400 _Citation.Page_last 26408 _Citation.Year 2012 _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 Jessica Wojtaszek . . . 18433 1 2 Jiangxin Liu . . . 18433 1 3 Sanjay Wang . . . 18433 1 4 Su Xue . . . 18433 1 5 Yaohua Walker . . . 18433 1 6 Graham Zhou . C. . 18433 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18433 _Assembly.ID 1 _Assembly.Name 'mouse Rev1 CTD in complex with the RIR of Pol Kappa' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'mouse Rev1 CTD' 1 $Rev1_CTD A . yes native no no . . . 18433 1 2 'RIR of Pol Kappa' 2 $RIR B . yes native no no . . . 18433 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Rev1_CTD _Entity.Sf_category entity _Entity.Sf_framecode Rev1_CTD _Entity.Entry_ID 18433 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSGGGAQDLSSLLPGQSSCF RPAAPNLAGAVEFSDVKTLL KEWITTISDPMEEDILQVVR YCTDLIEEKDLEKLDLVIKY MKRLMQQSVESVWNMAFDFI LDNVQVVLQQTYGSTLKVT ; _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 119 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 11166.953 _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 BMRB 18431 . entity . . . . . 86.55 104 98.06 98.06 3.16e-65 . . . . 18433 1 2 no PDB 2LSG . "Solution Structure Of The Mouse Rev1 C-terminal Domain" . . . . . 86.55 104 98.06 98.06 3.16e-65 . . . . 18433 1 3 no PDB 2LSJ . "Solution Structure Of The Mouse Rev1 Ctd In Complex With The Rev1- Interacting Region (rir)of Pol Kappa" . . . . . 100.00 119 100.00 100.00 3.42e-80 . . . . 18433 1 4 no PDB 4FJO . "Structure Of The Rev1 Ctd-rev3/7-pol Kappa Rir Complex" . . . . . 81.51 97 100.00 100.00 4.23e-62 . . . . 18433 1 5 no DBJ BAB64933 . "deoxycytidyl transferase [Mus musculus]" . . . . . 100.00 1249 97.48 97.48 2.75e-70 . . . . 18433 1 6 no GB AAF23323 . "REV1 protein [Mus musculus]" . . . . . 100.00 1249 97.48 97.48 2.69e-70 . . . . 18433 1 7 no GB AAH58093 . "REV1 homolog (S. cerevisiae) [Mus musculus]" . . . . . 100.00 1249 97.48 97.48 2.75e-70 . . . . 18433 1 8 no GB EDL14541 . "REV1-like (S. cerevisiae) [Mus musculus]" . . . . . 100.00 1249 97.48 97.48 2.75e-70 . . . . 18433 1 9 no REF NP_062516 . "DNA repair protein REV1 [Mus musculus]" . . . . . 100.00 1249 97.48 97.48 2.75e-70 . . . . 18433 1 10 no REF XP_006496216 . "PREDICTED: DNA repair protein REV1 isoform X2 [Mus musculus]" . . . . . 100.00 1306 97.48 97.48 2.82e-70 . . . . 18433 1 11 no REF XP_006496217 . "PREDICTED: DNA repair protein REV1 isoform X3 [Mus musculus]" . . . . . 100.00 1305 97.48 97.48 2.73e-70 . . . . 18433 1 12 no REF XP_006496218 . "PREDICTED: DNA repair protein REV1 isoform X4 [Mus musculus]" . . . . . 100.00 1296 97.48 97.48 2.74e-70 . . . . 18433 1 13 no REF XP_006496219 . "PREDICTED: DNA repair protein REV1 isoform X5 [Mus musculus]" . . . . . 100.00 1264 97.48 97.48 3.99e-70 . . . . 18433 1 14 no SP Q920Q2 . "RecName: Full=DNA repair protein REV1; AltName: Full=Rev1-like terminal deoxycytidyl transferase" . . . . . 100.00 1249 97.48 97.48 2.75e-70 . . . . 18433 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 18433 1 2 . SER . 18433 1 3 . GLY . 18433 1 4 . GLY . 18433 1 5 . GLY . 18433 1 6 . ALA . 18433 1 7 . GLN . 18433 1 8 . ASP . 18433 1 9 . LEU . 18433 1 10 . SER . 18433 1 11 . SER . 18433 1 12 . LEU . 18433 1 13 . LEU . 18433 1 14 . PRO . 18433 1 15 . GLY . 18433 1 16 . GLN . 18433 1 17 . SER . 18433 1 18 . SER . 18433 1 19 . CYS . 18433 1 20 . PHE . 18433 1 21 . ARG . 18433 1 22 . PRO . 18433 1 23 . ALA . 18433 1 24 . ALA . 18433 1 25 . PRO . 18433 1 26 . ASN . 18433 1 27 . LEU . 18433 1 28 . ALA . 18433 1 29 . GLY . 18433 1 30 . ALA . 18433 1 31 . VAL . 18433 1 32 . GLU . 18433 1 33 . PHE . 18433 1 34 . SER . 18433 1 35 . ASP . 18433 1 36 . VAL . 18433 1 37 . LYS . 18433 1 38 . THR . 18433 1 39 . LEU . 18433 1 40 . LEU . 18433 1 41 . LYS . 18433 1 42 . GLU . 18433 1 43 . TRP . 18433 1 44 . ILE . 18433 1 45 . THR . 18433 1 46 . THR . 18433 1 47 . ILE . 18433 1 48 . SER . 18433 1 49 . ASP . 18433 1 50 . PRO . 18433 1 51 . MET . 18433 1 52 . GLU . 18433 1 53 . GLU . 18433 1 54 . ASP . 18433 1 55 . ILE . 18433 1 56 . LEU . 18433 1 57 . GLN . 18433 1 58 . VAL . 18433 1 59 . VAL . 18433 1 60 . ARG . 18433 1 61 . TYR . 18433 1 62 . CYS . 18433 1 63 . THR . 18433 1 64 . ASP . 18433 1 65 . LEU . 18433 1 66 . ILE . 18433 1 67 . GLU . 18433 1 68 . GLU . 18433 1 69 . LYS . 18433 1 70 . ASP . 18433 1 71 . LEU . 18433 1 72 . GLU . 18433 1 73 . LYS . 18433 1 74 . LEU . 18433 1 75 . ASP . 18433 1 76 . LEU . 18433 1 77 . VAL . 18433 1 78 . ILE . 18433 1 79 . LYS . 18433 1 80 . TYR . 18433 1 81 . MET . 18433 1 82 . LYS . 18433 1 83 . ARG . 18433 1 84 . LEU . 18433 1 85 . MET . 18433 1 86 . GLN . 18433 1 87 . GLN . 18433 1 88 . SER . 18433 1 89 . VAL . 18433 1 90 . GLU . 18433 1 91 . SER . 18433 1 92 . VAL . 18433 1 93 . TRP . 18433 1 94 . ASN . 18433 1 95 . MET . 18433 1 96 . ALA . 18433 1 97 . PHE . 18433 1 98 . ASP . 18433 1 99 . PHE . 18433 1 100 . ILE . 18433 1 101 . LEU . 18433 1 102 . ASP . 18433 1 103 . ASN . 18433 1 104 . VAL . 18433 1 105 . GLN . 18433 1 106 . VAL . 18433 1 107 . VAL . 18433 1 108 . LEU . 18433 1 109 . GLN . 18433 1 110 . GLN . 18433 1 111 . THR . 18433 1 112 . TYR . 18433 1 113 . GLY . 18433 1 114 . SER . 18433 1 115 . THR . 18433 1 116 . LEU . 18433 1 117 . LYS . 18433 1 118 . VAL . 18433 1 119 . THR . 18433 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 18433 1 . SER 2 2 18433 1 . GLY 3 3 18433 1 . GLY 4 4 18433 1 . GLY 5 5 18433 1 . ALA 6 6 18433 1 . GLN 7 7 18433 1 . ASP 8 8 18433 1 . LEU 9 9 18433 1 . SER 10 10 18433 1 . SER 11 11 18433 1 . LEU 12 12 18433 1 . LEU 13 13 18433 1 . PRO 14 14 18433 1 . GLY 15 15 18433 1 . GLN 16 16 18433 1 . SER 17 17 18433 1 . SER 18 18 18433 1 . CYS 19 19 18433 1 . PHE 20 20 18433 1 . ARG 21 21 18433 1 . PRO 22 22 18433 1 . ALA 23 23 18433 1 . ALA 24 24 18433 1 . PRO 25 25 18433 1 . ASN 26 26 18433 1 . LEU 27 27 18433 1 . ALA 28 28 18433 1 . GLY 29 29 18433 1 . ALA 30 30 18433 1 . VAL 31 31 18433 1 . GLU 32 32 18433 1 . PHE 33 33 18433 1 . SER 34 34 18433 1 . ASP 35 35 18433 1 . VAL 36 36 18433 1 . LYS 37 37 18433 1 . THR 38 38 18433 1 . LEU 39 39 18433 1 . LEU 40 40 18433 1 . LYS 41 41 18433 1 . GLU 42 42 18433 1 . TRP 43 43 18433 1 . ILE 44 44 18433 1 . THR 45 45 18433 1 . THR 46 46 18433 1 . ILE 47 47 18433 1 . SER 48 48 18433 1 . ASP 49 49 18433 1 . PRO 50 50 18433 1 . MET 51 51 18433 1 . GLU 52 52 18433 1 . GLU 53 53 18433 1 . ASP 54 54 18433 1 . ILE 55 55 18433 1 . LEU 56 56 18433 1 . GLN 57 57 18433 1 . VAL 58 58 18433 1 . VAL 59 59 18433 1 . ARG 60 60 18433 1 . TYR 61 61 18433 1 . CYS 62 62 18433 1 . THR 63 63 18433 1 . ASP 64 64 18433 1 . LEU 65 65 18433 1 . ILE 66 66 18433 1 . GLU 67 67 18433 1 . GLU 68 68 18433 1 . LYS 69 69 18433 1 . ASP 70 70 18433 1 . LEU 71 71 18433 1 . GLU 72 72 18433 1 . LYS 73 73 18433 1 . LEU 74 74 18433 1 . ASP 75 75 18433 1 . LEU 76 76 18433 1 . VAL 77 77 18433 1 . ILE 78 78 18433 1 . LYS 79 79 18433 1 . TYR 80 80 18433 1 . MET 81 81 18433 1 . LYS 82 82 18433 1 . ARG 83 83 18433 1 . LEU 84 84 18433 1 . MET 85 85 18433 1 . GLN 86 86 18433 1 . GLN 87 87 18433 1 . SER 88 88 18433 1 . VAL 89 89 18433 1 . GLU 90 90 18433 1 . SER 91 91 18433 1 . VAL 92 92 18433 1 . TRP 93 93 18433 1 . ASN 94 94 18433 1 . MET 95 95 18433 1 . ALA 96 96 18433 1 . PHE 97 97 18433 1 . ASP 98 98 18433 1 . PHE 99 99 18433 1 . ILE 100 100 18433 1 . LEU 101 101 18433 1 . ASP 102 102 18433 1 . ASN 103 103 18433 1 . VAL 104 104 18433 1 . GLN 105 105 18433 1 . VAL 106 106 18433 1 . VAL 107 107 18433 1 . LEU 108 108 18433 1 . GLN 109 109 18433 1 . GLN 110 110 18433 1 . THR 111 111 18433 1 . TYR 112 112 18433 1 . GLY 113 113 18433 1 . SER 114 114 18433 1 . THR 115 115 18433 1 . LEU 116 116 18433 1 . LYS 117 117 18433 1 . VAL 118 118 18433 1 . THR 119 119 18433 1 stop_ save_ save_RIR _Entity.Sf_category entity _Entity.Sf_framecode RIR _Entity.Entry_ID 18433 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SHMSHKKSFFDKKRSERISN CQDTS ; _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 25 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1747.002 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-30 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 2LSJ . "Solution Structure Of The Mouse Rev1 Ctd In Complex With The Rev1- Interacting Region (rir)of Pol Kappa" . . . . . 100.00 25 100.00 100.00 1.55e-07 . . . . 18433 2 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 1 201 SER . 18433 2 2 202 HIS . 18433 2 3 203 MET . 18433 2 4 204 SER . 18433 2 5 205 HIS . 18433 2 6 206 LYS . 18433 2 7 207 LYS . 18433 2 8 208 SER . 18433 2 9 209 PHE . 18433 2 10 210 PHE . 18433 2 11 211 ASP . 18433 2 12 212 LYS . 18433 2 13 213 LYS . 18433 2 14 214 ARG . 18433 2 15 215 SER . 18433 2 16 216 GLU . 18433 2 17 217 ARG . 18433 2 18 218 ILE . 18433 2 19 219 SER . 18433 2 20 220 ASN . 18433 2 21 221 CYS . 18433 2 22 222 GLN . 18433 2 23 223 ASP . 18433 2 24 224 THR . 18433 2 25 225 SER . 18433 2 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 . SER 1 1 18433 2 . HIS 2 2 18433 2 . MET 3 3 18433 2 . SER 4 4 18433 2 . HIS 5 5 18433 2 . LYS 6 6 18433 2 . LYS 7 7 18433 2 . SER 8 8 18433 2 . PHE 9 9 18433 2 . PHE 10 10 18433 2 . ASP 11 11 18433 2 . LYS 12 12 18433 2 . LYS 13 13 18433 2 . ARG 14 14 18433 2 . SER 15 15 18433 2 . GLU 16 16 18433 2 . ARG 17 17 18433 2 . ILE 18 18 18433 2 . SER 19 19 18433 2 . ASN 20 20 18433 2 . CYS 21 21 18433 2 . GLN 22 22 18433 2 . ASP 23 23 18433 2 . THR 24 24 18433 2 . SER 25 25 18433 2 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 18433 _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 $Rev1_CTD . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . . . . . . . . . 18433 1 2 2 $RIR . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . . . . . . . . . 18433 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 18433 _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 $Rev1_CTD . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pMAL-C2 . . . . . . 18433 1 2 2 $RIR . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET15b . . . . . . 18433 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18433 _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 Rev1_CTD '[U-100% 15N]' . . 1 $Rev1_CTD . . . 0.7 1 mM . . . . 18433 1 2 RIR '[U-100% 15N]' . . 2 $RIR . . . 0.7 1 mM . . . . 18433 1 3 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 18433 1 4 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 18433 1 5 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 18433 1 6 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 18433 1 7 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18433 1 8 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18433 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 18433 _Sample.ID 2 _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 Rev1_CTD '[U-100% 13C; U-100% 15N]' . . 1 $Rev1_CTD . . . 0.7 1 mM . . . . 18433 2 2 RIR '[U-100% 13C; U-100% 15N]' . . 2 $RIR . . . 0.7 1 mM . . . . 18433 2 3 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 18433 2 4 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 18433 2 5 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 18433 2 6 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 18433 2 7 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18433 2 8 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18433 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 18433 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 Rev1_CTD '[U-100% 13C; U-100% 15N]' . . 1 $Rev1_CTD . . . 0.7 1 mM . . . . 18433 3 2 RIR '[U-100% 13C; U-100% 15N]' . . 2 $RIR . . . 0.7 1 mM . . . . 18433 3 3 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 18433 3 4 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 18433 3 5 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 18433 3 6 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 18433 3 7 D2O 'natural abundance' . . . . . . 100 . . % . . . . 18433 3 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 18433 _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' 0.1 . M 18433 1 pH 7 . pH 18433 1 pressure 1 . atm 18433 1 temperature 310 . K 18433 1 stop_ save_ ############################ # Computer software used # ############################ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 18433 _Software.ID 1 _Software.Name TALOS _Software.Version . _Software.Details TALOS+ loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 18433 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 18433 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 18433 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 18433 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 18433 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 18433 _Software.ID 3 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 18433 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 18433 3 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 18433 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18433 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 18433 _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 Varian INOVA . 600 . . . 18433 1 2 spectrometer_2 Varian INOVA . 800 . . . 18433 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 18433 _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 . . . . . . . . . . . . . . . . . . . . . 18433 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 3 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 4 '3D HN(CO)CA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 5 '3D HN(CA)CB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 6 '3D HN(COCA)CB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 7 '3D HA(CA)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 8 '3D HA(CACO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 9 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 10 '3D (HCA)CO(CA)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 11 '4D HCCH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 12 '4D HCCONH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 13 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 14 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 15 '4D 13C-HMQC-NOESY-15N-HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 1 16 '4D 13C-HMQC-NOESY-13C-HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18433 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 18433 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 18433 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18433 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18433 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 18433 _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' . . . 18433 1 2 '2D 1H-13C HSQC' . . . 18433 1 3 '3D HNCA' . . . 18433 1 4 '3D HN(CO)CA' . . . 18433 1 5 '3D HN(CA)CB' . . . 18433 1 6 '3D HN(COCA)CB' . . . 18433 1 7 '3D HA(CA)NH' . . . 18433 1 8 '3D HA(CACO)NH' . . . 18433 1 9 '3D HNCO' . . . 18433 1 10 '3D (HCA)CO(CA)NH' . . . 18433 1 11 '4D HCCH-TOCSY' . . . 18433 1 12 '4D HCCONH-TOCSY' . . . 18433 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 5 5 GLY H H 1 8.286 0.006 . . . . . . 5 GLY H . 18433 1 2 . 1 1 5 5 GLY HA2 H 1 3.962 0.004 . . . . . . 5 GLY HA2 . 18433 1 3 . 1 1 5 5 GLY HA3 H 1 3.962 0.004 . . . . . . 5 GLY HA3 . 18433 1 4 . 1 1 5 5 GLY CA C 13 45.182 0.016 . . . . . . 5 GLY CA . 18433 1 5 . 1 1 5 5 GLY N N 15 108.925 0.041 . . . . . . 5 GLY N . 18433 1 6 . 1 1 6 6 ALA H H 1 8.189 0.006 . . . . . . 6 ALA H . 18433 1 7 . 1 1 6 6 ALA HA H 1 4.280 0.005 . . . . . . 6 ALA HA . 18433 1 8 . 1 1 6 6 ALA HB1 H 1 1.368 0.007 . . . . . . 6 ALA HB1 . 18433 1 9 . 1 1 6 6 ALA HB2 H 1 1.368 0.007 . . . . . . 6 ALA HB2 . 18433 1 10 . 1 1 6 6 ALA HB3 H 1 1.368 0.007 . . . . . . 6 ALA HB3 . 18433 1 11 . 1 1 6 6 ALA CA C 13 52.520 0.141 . . . . . . 6 ALA CA . 18433 1 12 . 1 1 6 6 ALA CB C 13 19.156 0.036 . . . . . . 6 ALA CB . 18433 1 13 . 1 1 6 6 ALA N N 15 123.712 0.024 . . . . . . 6 ALA N . 18433 1 14 . 1 1 7 7 GLN H H 1 8.298 0.005 . . . . . . 7 GLN H . 18433 1 15 . 1 1 7 7 GLN HA H 1 4.297 0.005 . . . . . . 7 GLN HA . 18433 1 16 . 1 1 7 7 GLN HB2 H 1 1.964 0.000 . . . . . . 7 GLN HB2 . 18433 1 17 . 1 1 7 7 GLN HB3 H 1 2.097 0.000 . . . . . . 7 GLN HB3 . 18433 1 18 . 1 1 7 7 GLN HG2 H 1 2.368 0.006 . . . . . . 7 GLN HG2 . 18433 1 19 . 1 1 7 7 GLN HG3 H 1 2.368 0.006 . . . . . . 7 GLN HG3 . 18433 1 20 . 1 1 7 7 GLN CA C 13 55.798 0.061 . . . . . . 7 GLN CA . 18433 1 21 . 1 1 7 7 GLN CB C 13 29.678 0.022 . . . . . . 7 GLN CB . 18433 1 22 . 1 1 7 7 GLN CG C 13 36.130 0.000 . . . . . . 7 GLN CG . 18433 1 23 . 1 1 7 7 GLN N N 15 118.944 0.023 . . . . . . 7 GLN N . 18433 1 24 . 1 1 8 8 ASP H H 1 8.238 0.005 . . . . . . 8 ASP H . 18433 1 25 . 1 1 8 8 ASP HA H 1 4.598 0.004 . . . . . . 8 ASP HA . 18433 1 26 . 1 1 8 8 ASP HB2 H 1 2.605 0.007 . . . . . . 8 ASP HB2 . 18433 1 27 . 1 1 8 8 ASP HB3 H 1 2.736 0.002 . . . . . . 8 ASP HB3 . 18433 1 28 . 1 1 8 8 ASP CA C 13 54.144 0.079 . . . . . . 8 ASP CA . 18433 1 29 . 1 1 8 8 ASP CB C 13 41.233 0.024 . . . . . . 8 ASP CB . 18433 1 30 . 1 1 8 8 ASP N N 15 121.339 0.007 . . . . . . 8 ASP N . 18433 1 31 . 1 1 9 9 LEU H H 1 8.268 0.005 . . . . . . 9 LEU H . 18433 1 32 . 1 1 9 9 LEU HA H 1 4.294 0.007 . . . . . . 9 LEU HA . 18433 1 33 . 1 1 9 9 LEU HB2 H 1 1.621 0.009 . . . . . . 9 LEU HB2 . 18433 1 34 . 1 1 9 9 LEU HB3 H 1 1.621 0.009 . . . . . . 9 LEU HB3 . 18433 1 35 . 1 1 9 9 LEU CA C 13 55.650 0.058 . . . . . . 9 LEU CA . 18433 1 36 . 1 1 9 9 LEU CB C 13 41.984 0.115 . . . . . . 9 LEU CB . 18433 1 37 . 1 1 9 9 LEU N N 15 123.500 0.010 . . . . . . 9 LEU N . 18433 1 38 . 1 1 10 10 SER H H 1 8.301 0.005 . . . . . . 10 SER H . 18433 1 39 . 1 1 10 10 SER HA H 1 4.318 0.008 . . . . . . 10 SER HA . 18433 1 40 . 1 1 10 10 SER HB2 H 1 3.887 0.006 . . . . . . 10 SER HB2 . 18433 1 41 . 1 1 10 10 SER HB3 H 1 3.887 0.006 . . . . . . 10 SER HB3 . 18433 1 42 . 1 1 10 10 SER CA C 13 59.535 0.114 . . . . . . 10 SER CA . 18433 1 43 . 1 1 10 10 SER CB C 13 63.309 0.001 . . . . . . 10 SER CB . 18433 1 44 . 1 1 10 10 SER N N 15 115.706 0.006 . . . . . . 10 SER N . 18433 1 45 . 1 1 11 11 SER H H 1 8.019 0.005 . . . . . . 11 SER H . 18433 1 46 . 1 1 11 11 SER HA H 1 4.413 0.007 . . . . . . 11 SER HA . 18433 1 47 . 1 1 11 11 SER HB2 H 1 3.854 0.001 . . . . . . 11 SER HB2 . 18433 1 48 . 1 1 11 11 SER HB3 H 1 3.854 0.001 . . . . . . 11 SER HB3 . 18433 1 49 . 1 1 11 11 SER CA C 13 58.523 0.063 . . . . . . 11 SER CA . 18433 1 50 . 1 1 11 11 SER CB C 13 63.577 0.000 . . . . . . 11 SER CB . 18433 1 51 . 1 1 11 11 SER N N 15 116.763 0.013 . . . . . . 11 SER N . 18433 1 52 . 1 1 12 12 LEU H H 1 7.862 0.003 . . . . . . 12 LEU H . 18433 1 53 . 1 1 12 12 LEU HA H 1 4.316 0.010 . . . . . . 12 LEU HA . 18433 1 54 . 1 1 12 12 LEU HB2 H 1 1.561 0.007 . . . . . . 12 LEU HB2 . 18433 1 55 . 1 1 12 12 LEU HB3 H 1 1.606 0.005 . . . . . . 12 LEU HB3 . 18433 1 56 . 1 1 12 12 LEU HG H 1 1.611 0.009 . . . . . . 12 LEU HG . 18433 1 57 . 1 1 12 12 LEU HD11 H 1 0.820 0.009 . . . . . . 12 LEU HD11 . 18433 1 58 . 1 1 12 12 LEU HD12 H 1 0.820 0.009 . . . . . . 12 LEU HD12 . 18433 1 59 . 1 1 12 12 LEU HD13 H 1 0.820 0.009 . . . . . . 12 LEU HD13 . 18433 1 60 . 1 1 12 12 LEU HD21 H 1 0.882 0.004 . . . . . . 12 LEU HD21 . 18433 1 61 . 1 1 12 12 LEU HD22 H 1 0.882 0.004 . . . . . . 12 LEU HD22 . 18433 1 62 . 1 1 12 12 LEU HD23 H 1 0.882 0.004 . . . . . . 12 LEU HD23 . 18433 1 63 . 1 1 12 12 LEU CA C 13 55.265 0.120 . . . . . . 12 LEU CA . 18433 1 64 . 1 1 12 12 LEU CB C 13 42.244 0.061 . . . . . . 12 LEU CB . 18433 1 65 . 1 1 12 12 LEU CG C 13 26.891 0.132 . . . . . . 12 LEU CG . 18433 1 66 . 1 1 12 12 LEU CD1 C 13 23.340 0.068 . . . . . . 12 LEU CD1 . 18433 1 67 . 1 1 12 12 LEU CD2 C 13 24.972 0.108 . . . . . . 12 LEU CD2 . 18433 1 68 . 1 1 12 12 LEU N N 15 122.926 0.018 . . . . . . 12 LEU N . 18433 1 69 . 1 1 13 13 LEU H H 1 7.980 0.003 . . . . . . 13 LEU H . 18433 1 70 . 1 1 13 13 LEU HA H 1 4.587 0.006 . . . . . . 13 LEU HA . 18433 1 71 . 1 1 13 13 LEU HB2 H 1 1.528 0.007 . . . . . . 13 LEU HB2 . 18433 1 72 . 1 1 13 13 LEU HB3 H 1 1.566 0.002 . . . . . . 13 LEU HB3 . 18433 1 73 . 1 1 13 13 LEU HG H 1 1.642 0.005 . . . . . . 13 LEU HG . 18433 1 74 . 1 1 13 13 LEU HD11 H 1 0.874 0.006 . . . . . . 13 LEU HD11 . 18433 1 75 . 1 1 13 13 LEU HD12 H 1 0.874 0.006 . . . . . . 13 LEU HD12 . 18433 1 76 . 1 1 13 13 LEU HD13 H 1 0.874 0.006 . . . . . . 13 LEU HD13 . 18433 1 77 . 1 1 13 13 LEU HD21 H 1 0.898 0.009 . . . . . . 13 LEU HD21 . 18433 1 78 . 1 1 13 13 LEU HD22 H 1 0.898 0.009 . . . . . . 13 LEU HD22 . 18433 1 79 . 1 1 13 13 LEU HD23 H 1 0.898 0.009 . . . . . . 13 LEU HD23 . 18433 1 80 . 1 1 13 13 LEU CA C 13 52.882 0.046 . . . . . . 13 LEU CA . 18433 1 81 . 1 1 13 13 LEU CB C 13 41.508 0.068 . . . . . . 13 LEU CB . 18433 1 82 . 1 1 13 13 LEU CG C 13 26.921 0.044 . . . . . . 13 LEU CG . 18433 1 83 . 1 1 13 13 LEU CD1 C 13 23.220 0.051 . . . . . . 13 LEU CD1 . 18433 1 84 . 1 1 13 13 LEU CD2 C 13 25.262 0.048 . . . . . . 13 LEU CD2 . 18433 1 85 . 1 1 13 13 LEU N N 15 123.305 0.009 . . . . . . 13 LEU N . 18433 1 86 . 1 1 14 14 PRO HA H 1 4.366 0.006 . . . . . . 14 PRO HA . 18433 1 87 . 1 1 14 14 PRO HB2 H 1 1.900 0.004 . . . . . . 14 PRO HB2 . 18433 1 88 . 1 1 14 14 PRO HB3 H 1 2.265 0.004 . . . . . . 14 PRO HB3 . 18433 1 89 . 1 1 14 14 PRO HG2 H 1 1.988 0.003 . . . . . . 14 PRO HG2 . 18433 1 90 . 1 1 14 14 PRO HG3 H 1 2.046 0.001 . . . . . . 14 PRO HG3 . 18433 1 91 . 1 1 14 14 PRO HD2 H 1 3.610 0.011 . . . . . . 14 PRO HD2 . 18433 1 92 . 1 1 14 14 PRO HD3 H 1 3.800 0.006 . . . . . . 14 PRO HD3 . 18433 1 93 . 1 1 14 14 PRO CA C 13 63.559 0.079 . . . . . . 14 PRO CA . 18433 1 94 . 1 1 14 14 PRO CB C 13 31.877 0.066 . . . . . . 14 PRO CB . 18433 1 95 . 1 1 14 14 PRO CG C 13 27.511 0.035 . . . . . . 14 PRO CG . 18433 1 96 . 1 1 14 14 PRO CD C 13 50.531 0.028 . . . . . . 14 PRO CD . 18433 1 97 . 1 1 15 15 GLY H H 1 8.437 0.006 . . . . . . 15 GLY H . 18433 1 98 . 1 1 15 15 GLY HA2 H 1 3.906 0.006 . . . . . . 15 GLY HA2 . 18433 1 99 . 1 1 15 15 GLY HA3 H 1 3.906 0.006 . . . . . . 15 GLY HA3 . 18433 1 100 . 1 1 15 15 GLY CA C 13 45.382 0.018 . . . . . . 15 GLY CA . 18433 1 101 . 1 1 15 15 GLY N N 15 109.337 0.019 . . . . . . 15 GLY N . 18433 1 102 . 1 1 16 16 GLN H H 1 8.077 0.006 . . . . . . 16 GLN H . 18433 1 103 . 1 1 16 16 GLN HA H 1 4.371 0.010 . . . . . . 16 GLN HA . 18433 1 104 . 1 1 16 16 GLN HB2 H 1 2.006 0.015 . . . . . . 16 GLN HB2 . 18433 1 105 . 1 1 16 16 GLN HB3 H 1 2.122 0.007 . . . . . . 16 GLN HB3 . 18433 1 106 . 1 1 16 16 GLN HG2 H 1 2.326 0.006 . . . . . . 16 GLN HG2 . 18433 1 107 . 1 1 16 16 GLN HG3 H 1 2.326 0.006 . . . . . . 16 GLN HG3 . 18433 1 108 . 1 1 16 16 GLN CA C 13 55.896 0.041 . . . . . . 16 GLN CA . 18433 1 109 . 1 1 16 16 GLN CB C 13 29.474 0.019 . . . . . . 16 GLN CB . 18433 1 110 . 1 1 16 16 GLN CG C 13 33.977 0.076 . . . . . . 16 GLN CG . 18433 1 111 . 1 1 16 16 GLN N N 15 119.531 0.015 . . . . . . 16 GLN N . 18433 1 112 . 1 1 19 19 CYS HA H 1 4.442 0.003 . . . . . . 19 CYS HA . 18433 1 113 . 1 1 19 19 CYS HB2 H 1 2.805 0.003 . . . . . . 19 CYS HB2 . 18433 1 114 . 1 1 19 19 CYS HB3 H 1 2.805 0.003 . . . . . . 19 CYS HB3 . 18433 1 115 . 1 1 19 19 CYS CA C 13 58.332 0.045 . . . . . . 19 CYS CA . 18433 1 116 . 1 1 19 19 CYS CB C 13 27.880 0.014 . . . . . . 19 CYS CB . 18433 1 117 . 1 1 20 20 PHE H H 1 8.169 0.005 . . . . . . 20 PHE H . 18433 1 118 . 1 1 20 20 PHE HA H 1 4.590 0.003 . . . . . . 20 PHE HA . 18433 1 119 . 1 1 20 20 PHE HB2 H 1 3.011 0.010 . . . . . . 20 PHE HB2 . 18433 1 120 . 1 1 20 20 PHE HB3 H 1 3.051 0.008 . . . . . . 20 PHE HB3 . 18433 1 121 . 1 1 20 20 PHE HD1 H 1 7.204 0.004 . . . . . . 20 PHE HD1 . 18433 1 122 . 1 1 20 20 PHE HD2 H 1 7.204 0.004 . . . . . . 20 PHE HD2 . 18433 1 123 . 1 1 20 20 PHE HE1 H 1 7.297 0.008 . . . . . . 20 PHE HE1 . 18433 1 124 . 1 1 20 20 PHE HE2 H 1 7.297 0.008 . . . . . . 20 PHE HE2 . 18433 1 125 . 1 1 20 20 PHE CA C 13 57.643 0.077 . . . . . . 20 PHE CA . 18433 1 126 . 1 1 20 20 PHE CB C 13 39.533 0.064 . . . . . . 20 PHE CB . 18433 1 127 . 1 1 20 20 PHE CD1 C 13 131.783 0.045 . . . . . . 20 PHE CD1 . 18433 1 128 . 1 1 20 20 PHE CE1 C 13 131.445 0.145 . . . . . . 20 PHE CE1 . 18433 1 129 . 1 1 20 20 PHE N N 15 122.585 0.001 . . . . . . 20 PHE N . 18433 1 130 . 1 1 21 21 ARG H H 1 8.003 0.004 . . . . . . 21 ARG H . 18433 1 131 . 1 1 21 21 ARG HA H 1 4.544 0.005 . . . . . . 21 ARG HA . 18433 1 132 . 1 1 21 21 ARG HB2 H 1 1.624 0.007 . . . . . . 21 ARG HB2 . 18433 1 133 . 1 1 21 21 ARG HB3 H 1 1.745 0.006 . . . . . . 21 ARG HB3 . 18433 1 134 . 1 1 21 21 ARG HG2 H 1 1.555 0.005 . . . . . . 21 ARG HG2 . 18433 1 135 . 1 1 21 21 ARG HG3 H 1 1.555 0.005 . . . . . . 21 ARG HG3 . 18433 1 136 . 1 1 21 21 ARG HD2 H 1 3.153 0.004 . . . . . . 21 ARG HD2 . 18433 1 137 . 1 1 21 21 ARG HD3 H 1 3.153 0.004 . . . . . . 21 ARG HD3 . 18433 1 138 . 1 1 21 21 ARG CA C 13 53.265 0.060 . . . . . . 21 ARG CA . 18433 1 139 . 1 1 21 21 ARG CB C 13 30.684 0.032 . . . . . . 21 ARG CB . 18433 1 140 . 1 1 21 21 ARG CG C 13 26.647 0.022 . . . . . . 21 ARG CG . 18433 1 141 . 1 1 21 21 ARG CD C 13 43.163 0.033 . . . . . . 21 ARG CD . 18433 1 142 . 1 1 21 21 ARG N N 15 124.420 0.019 . . . . . . 21 ARG N . 18433 1 143 . 1 1 22 22 PRO HA H 1 4.293 0.007 . . . . . . 22 PRO HA . 18433 1 144 . 1 1 22 22 PRO HB2 H 1 1.879 0.008 . . . . . . 22 PRO HB2 . 18433 1 145 . 1 1 22 22 PRO HB3 H 1 2.259 0.006 . . . . . . 22 PRO HB3 . 18433 1 146 . 1 1 22 22 PRO HG2 H 1 1.932 0.011 . . . . . . 22 PRO HG2 . 18433 1 147 . 1 1 22 22 PRO HG3 H 1 1.932 0.011 . . . . . . 22 PRO HG3 . 18433 1 148 . 1 1 22 22 PRO HD2 H 1 3.542 0.004 . . . . . . 22 PRO HD2 . 18433 1 149 . 1 1 22 22 PRO HD3 H 1 3.542 0.004 . . . . . . 22 PRO HD3 . 18433 1 150 . 1 1 22 22 PRO CA C 13 63.011 0.144 . . . . . . 22 PRO CA . 18433 1 151 . 1 1 22 22 PRO CB C 13 31.999 0.076 . . . . . . 22 PRO CB . 18433 1 152 . 1 1 22 22 PRO CG C 13 27.142 0.058 . . . . . . 22 PRO CG . 18433 1 153 . 1 1 22 22 PRO CD C 13 50.512 0.067 . . . . . . 22 PRO CD . 18433 1 154 . 1 1 23 23 ALA H H 1 8.179 0.017 . . . . . A 23 ALA H . 18433 1 155 . 1 1 23 23 ALA HA H 1 4.265 0.004 . . . . . A 23 ALA HA . 18433 1 156 . 1 1 23 23 ALA HB1 H 1 1.318 0.004 . . . . . A 23 ALA HB1 . 18433 1 157 . 1 1 23 23 ALA HB2 H 1 1.318 0.004 . . . . . A 23 ALA HB2 . 18433 1 158 . 1 1 23 23 ALA HB3 H 1 1.318 0.004 . . . . . A 23 ALA HB3 . 18433 1 159 . 1 1 23 23 ALA CA C 13 51.909 0.075 . . . . . A 23 ALA CA . 18433 1 160 . 1 1 23 23 ALA CB C 13 19.256 0.054 . . . . . A 23 ALA CB . 18433 1 161 . 1 1 23 23 ALA N N 15 123.726 0.051 . . . . . A 23 ALA N . 18433 1 162 . 1 1 24 24 ALA H H 1 7.820 0.013 . . . . . A 24 ALA H . 18433 1 163 . 1 1 24 24 ALA HA H 1 4.544 0.010 . . . . . A 24 ALA HA . 18433 1 164 . 1 1 24 24 ALA HB1 H 1 1.310 0.005 . . . . . A 24 ALA HB1 . 18433 1 165 . 1 1 24 24 ALA HB2 H 1 1.310 0.005 . . . . . A 24 ALA HB2 . 18433 1 166 . 1 1 24 24 ALA HB3 H 1 1.310 0.005 . . . . . A 24 ALA HB3 . 18433 1 167 . 1 1 24 24 ALA CA C 13 50.311 0.049 . . . . . A 24 ALA CA . 18433 1 168 . 1 1 24 24 ALA CB C 13 18.597 0.087 . . . . . A 24 ALA CB . 18433 1 169 . 1 1 24 24 ALA N N 15 123.308 0.007 . . . . . A 24 ALA N . 18433 1 170 . 1 1 25 25 PRO HA H 1 4.638 0.005 . . . . . A 25 PRO HA . 18433 1 171 . 1 1 25 25 PRO HB2 H 1 1.904 0.006 . . . . . A 25 PRO HB2 . 18433 1 172 . 1 1 25 25 PRO HB3 H 1 2.146 0.004 . . . . . A 25 PRO HB3 . 18433 1 173 . 1 1 25 25 PRO HG2 H 1 1.794 0.006 . . . . . A 25 PRO HG2 . 18433 1 174 . 1 1 25 25 PRO HG3 H 1 2.000 0.004 . . . . . A 25 PRO HG3 . 18433 1 175 . 1 1 25 25 PRO HD2 H 1 3.566 0.010 . . . . . A 25 PRO HD2 . 18433 1 176 . 1 1 25 25 PRO HD3 H 1 3.862 0.014 . . . . . A 25 PRO HD3 . 18433 1 177 . 1 1 25 25 PRO CA C 13 63.251 0.022 . . . . . A 25 PRO CA . 18433 1 178 . 1 1 25 25 PRO CB C 13 31.862 0.052 . . . . . A 25 PRO CB . 18433 1 179 . 1 1 25 25 PRO CG C 13 28.165 0.026 . . . . . A 25 PRO CG . 18433 1 180 . 1 1 25 25 PRO CD C 13 50.392 0.079 . . . . . A 25 PRO CD . 18433 1 181 . 1 1 26 26 ASN H H 1 9.079 0.015 . . . . . A 26 ASN H . 18433 1 182 . 1 1 26 26 ASN HA H 1 5.227 0.011 . . . . . A 26 ASN HA . 18433 1 183 . 1 1 26 26 ASN HB2 H 1 1.689 0.007 . . . . . A 26 ASN HB2 . 18433 1 184 . 1 1 26 26 ASN HB3 H 1 2.443 0.006 . . . . . A 26 ASN HB3 . 18433 1 185 . 1 1 26 26 ASN HD21 H 1 6.962 0.008 . . . . . A 26 ASN HD21 . 18433 1 186 . 1 1 26 26 ASN HD22 H 1 7.471 0.009 . . . . . A 26 ASN HD22 . 18433 1 187 . 1 1 26 26 ASN CA C 13 52.623 0.050 . . . . . A 26 ASN CA . 18433 1 188 . 1 1 26 26 ASN CB C 13 44.139 0.086 . . . . . A 26 ASN CB . 18433 1 189 . 1 1 26 26 ASN N N 15 120.016 0.014 . . . . . A 26 ASN N . 18433 1 190 . 1 1 26 26 ASN ND2 N 15 115.228 0.012 . . . . . A 26 ASN ND2 . 18433 1 191 . 1 1 27 27 LEU H H 1 8.098 0.012 . . . . . A 27 LEU H . 18433 1 192 . 1 1 27 27 LEU HA H 1 4.237 0.006 . . . . . A 27 LEU HA . 18433 1 193 . 1 1 27 27 LEU HB2 H 1 -0.054 0.005 . . . . . A 27 LEU HB2 . 18433 1 194 . 1 1 27 27 LEU HB3 H 1 1.213 0.007 . . . . . A 27 LEU HB3 . 18433 1 195 . 1 1 27 27 LEU HG H 1 0.643 0.009 . . . . . A 27 LEU HG . 18433 1 196 . 1 1 27 27 LEU HD11 H 1 -0.067 0.007 . . . . . A 27 LEU HD11 . 18433 1 197 . 1 1 27 27 LEU HD12 H 1 -0.067 0.007 . . . . . A 27 LEU HD12 . 18433 1 198 . 1 1 27 27 LEU HD13 H 1 -0.067 0.007 . . . . . A 27 LEU HD13 . 18433 1 199 . 1 1 27 27 LEU HD21 H 1 0.362 0.006 . . . . . A 27 LEU HD21 . 18433 1 200 . 1 1 27 27 LEU HD22 H 1 0.362 0.006 . . . . . A 27 LEU HD22 . 18433 1 201 . 1 1 27 27 LEU HD23 H 1 0.362 0.006 . . . . . A 27 LEU HD23 . 18433 1 202 . 1 1 27 27 LEU CA C 13 52.303 0.155 . . . . . A 27 LEU CA . 18433 1 203 . 1 1 27 27 LEU CB C 13 42.817 0.111 . . . . . A 27 LEU CB . 18433 1 204 . 1 1 27 27 LEU CG C 13 27.091 0.067 . . . . . A 27 LEU CG . 18433 1 205 . 1 1 27 27 LEU CD1 C 13 21.698 0.050 . . . . . A 27 LEU CD1 . 18433 1 206 . 1 1 27 27 LEU CD2 C 13 26.372 0.089 . . . . . A 27 LEU CD2 . 18433 1 207 . 1 1 27 27 LEU N N 15 123.375 0.047 . . . . . A 27 LEU N . 18433 1 208 . 1 1 28 28 ALA H H 1 9.215 0.011 . . . . . A 28 ALA H . 18433 1 209 . 1 1 28 28 ALA HA H 1 3.674 0.006 . . . . . A 28 ALA HA . 18433 1 210 . 1 1 28 28 ALA HB1 H 1 1.486 0.007 . . . . . A 28 ALA HB1 . 18433 1 211 . 1 1 28 28 ALA HB2 H 1 1.486 0.007 . . . . . A 28 ALA HB2 . 18433 1 212 . 1 1 28 28 ALA HB3 H 1 1.486 0.007 . . . . . A 28 ALA HB3 . 18433 1 213 . 1 1 28 28 ALA CA C 13 52.381 0.055 . . . . . A 28 ALA CA . 18433 1 214 . 1 1 28 28 ALA CB C 13 18.929 0.048 . . . . . A 28 ALA CB . 18433 1 215 . 1 1 28 28 ALA N N 15 126.889 0.007 . . . . . A 28 ALA N . 18433 1 216 . 1 1 29 29 GLY H H 1 7.943 0.014 . . . . . A 29 GLY H . 18433 1 217 . 1 1 29 29 GLY HA2 H 1 3.257 0.009 . . . . . A 29 GLY HA2 . 18433 1 218 . 1 1 29 29 GLY HA3 H 1 4.167 0.006 . . . . . A 29 GLY HA3 . 18433 1 219 . 1 1 29 29 GLY CA C 13 44.838 0.049 . . . . . A 29 GLY CA . 18433 1 220 . 1 1 29 29 GLY N N 15 102.532 0.034 . . . . . A 29 GLY N . 18433 1 221 . 1 1 30 30 ALA H H 1 8.040 0.013 . . . . . A 30 ALA H . 18433 1 222 . 1 1 30 30 ALA HA H 1 4.251 0.006 . . . . . A 30 ALA HA . 18433 1 223 . 1 1 30 30 ALA HB1 H 1 1.267 0.012 . . . . . A 30 ALA HB1 . 18433 1 224 . 1 1 30 30 ALA HB2 H 1 1.267 0.012 . . . . . A 30 ALA HB2 . 18433 1 225 . 1 1 30 30 ALA HB3 H 1 1.267 0.012 . . . . . A 30 ALA HB3 . 18433 1 226 . 1 1 30 30 ALA CA C 13 52.148 0.097 . . . . . A 30 ALA CA . 18433 1 227 . 1 1 30 30 ALA CB C 13 19.434 0.133 . . . . . A 30 ALA CB . 18433 1 228 . 1 1 30 30 ALA N N 15 125.002 0.010 . . . . . A 30 ALA N . 18433 1 229 . 1 1 31 31 VAL H H 1 8.415 0.009 . . . . . A 31 VAL H . 18433 1 230 . 1 1 31 31 VAL HA H 1 4.268 0.009 . . . . . A 31 VAL HA . 18433 1 231 . 1 1 31 31 VAL HB H 1 1.894 0.005 . . . . . A 31 VAL HB . 18433 1 232 . 1 1 31 31 VAL HG11 H 1 0.885 0.010 . . . . . A 31 VAL HG11 . 18433 1 233 . 1 1 31 31 VAL HG12 H 1 0.885 0.010 . . . . . A 31 VAL HG12 . 18433 1 234 . 1 1 31 31 VAL HG13 H 1 0.885 0.010 . . . . . A 31 VAL HG13 . 18433 1 235 . 1 1 31 31 VAL HG21 H 1 0.870 0.009 . . . . . A 31 VAL HG21 . 18433 1 236 . 1 1 31 31 VAL HG22 H 1 0.870 0.009 . . . . . A 31 VAL HG22 . 18433 1 237 . 1 1 31 31 VAL HG23 H 1 0.870 0.009 . . . . . A 31 VAL HG23 . 18433 1 238 . 1 1 31 31 VAL CA C 13 62.397 0.032 . . . . . A 31 VAL CA . 18433 1 239 . 1 1 31 31 VAL CB C 13 34.958 0.032 . . . . . A 31 VAL CB . 18433 1 240 . 1 1 31 31 VAL CG1 C 13 21.096 0.094 . . . . . A 31 VAL CG1 . 18433 1 241 . 1 1 31 31 VAL CG2 C 13 20.945 0.086 . . . . . A 31 VAL CG2 . 18433 1 242 . 1 1 31 31 VAL N N 15 119.492 0.086 . . . . . A 31 VAL N . 18433 1 243 . 1 1 32 32 GLU H H 1 8.757 0.010 . . . . . A 32 GLU H . 18433 1 244 . 1 1 32 32 GLU HA H 1 4.274 0.005 . . . . . A 32 GLU HA . 18433 1 245 . 1 1 32 32 GLU HB2 H 1 1.992 0.009 . . . . . A 32 GLU HB2 . 18433 1 246 . 1 1 32 32 GLU HB3 H 1 2.256 0.007 . . . . . A 32 GLU HB3 . 18433 1 247 . 1 1 32 32 GLU HG2 H 1 2.389 0.007 . . . . . A 32 GLU HG2 . 18433 1 248 . 1 1 32 32 GLU HG3 H 1 2.491 0.006 . . . . . A 32 GLU HG3 . 18433 1 249 . 1 1 32 32 GLU CA C 13 56.196 0.058 . . . . . A 32 GLU CA . 18433 1 250 . 1 1 32 32 GLU CB C 13 29.339 0.097 . . . . . A 32 GLU CB . 18433 1 251 . 1 1 32 32 GLU CG C 13 36.101 0.028 . . . . . A 32 GLU CG . 18433 1 252 . 1 1 32 32 GLU N N 15 122.142 0.052 . . . . . A 32 GLU N . 18433 1 253 . 1 1 33 33 PHE HA H 1 4.255 0.006 . . . . . A 33 PHE HA . 18433 1 254 . 1 1 33 33 PHE HB2 H 1 3.052 0.013 . . . . . A 33 PHE HB2 . 18433 1 255 . 1 1 33 33 PHE HB3 H 1 3.236 0.005 . . . . . A 33 PHE HB3 . 18433 1 256 . 1 1 33 33 PHE HD1 H 1 7.187 0.008 . . . . . A 33 PHE HD1 . 18433 1 257 . 1 1 33 33 PHE HD2 H 1 7.187 0.008 . . . . . A 33 PHE HD2 . 18433 1 258 . 1 1 33 33 PHE HE1 H 1 7.125 0.006 . . . . . A 33 PHE HE1 . 18433 1 259 . 1 1 33 33 PHE HE2 H 1 7.125 0.006 . . . . . A 33 PHE HE2 . 18433 1 260 . 1 1 33 33 PHE HZ H 1 6.949 0.004 . . . . . A 33 PHE HZ . 18433 1 261 . 1 1 33 33 PHE CA C 13 61.336 0.156 . . . . . A 33 PHE CA . 18433 1 262 . 1 1 33 33 PHE CB C 13 38.644 0.077 . . . . . A 33 PHE CB . 18433 1 263 . 1 1 33 33 PHE CD1 C 13 131.499 0.024 . . . . . A 33 PHE CD1 . 18433 1 264 . 1 1 33 33 PHE CE1 C 13 130.932 0.132 . . . . . A 33 PHE CE1 . 18433 1 265 . 1 1 33 33 PHE CZ C 13 129.432 0.115 . . . . . A 33 PHE CZ . 18433 1 266 . 1 1 34 34 SER H H 1 8.902 0.006 . . . . . A 34 SER H . 18433 1 267 . 1 1 34 34 SER HA H 1 3.652 0.009 . . . . . A 34 SER HA . 18433 1 268 . 1 1 34 34 SER HB2 H 1 3.839 0.005 . . . . . A 34 SER HB2 . 18433 1 269 . 1 1 34 34 SER HB3 H 1 3.839 0.005 . . . . . A 34 SER HB3 . 18433 1 270 . 1 1 34 34 SER CA C 13 61.642 0.029 . . . . . A 34 SER CA . 18433 1 271 . 1 1 34 34 SER CB C 13 61.807 0.034 . . . . . A 34 SER CB . 18433 1 272 . 1 1 34 34 SER N N 15 112.028 0.016 . . . . . A 34 SER N . 18433 1 273 . 1 1 35 35 ASP H H 1 6.930 0.016 . . . . . A 35 ASP H . 18433 1 274 . 1 1 35 35 ASP HA H 1 4.498 0.005 . . . . . A 35 ASP HA . 18433 1 275 . 1 1 35 35 ASP HB2 H 1 2.665 0.013 . . . . . A 35 ASP HB2 . 18433 1 276 . 1 1 35 35 ASP HB3 H 1 2.792 0.009 . . . . . A 35 ASP HB3 . 18433 1 277 . 1 1 35 35 ASP CA C 13 56.560 0.041 . . . . . A 35 ASP CA . 18433 1 278 . 1 1 35 35 ASP CB C 13 41.227 0.066 . . . . . A 35 ASP CB . 18433 1 279 . 1 1 35 35 ASP N N 15 121.321 0.024 . . . . . A 35 ASP N . 18433 1 280 . 1 1 36 36 VAL H H 1 8.014 0.005 . . . . . A 36 VAL H . 18433 1 281 . 1 1 36 36 VAL HA H 1 3.248 0.007 . . . . . A 36 VAL HA . 18433 1 282 . 1 1 36 36 VAL HB H 1 2.021 0.008 . . . . . A 36 VAL HB . 18433 1 283 . 1 1 36 36 VAL HG11 H 1 0.739 0.008 . . . . . A 36 VAL HG11 . 18433 1 284 . 1 1 36 36 VAL HG12 H 1 0.739 0.008 . . . . . A 36 VAL HG12 . 18433 1 285 . 1 1 36 36 VAL HG13 H 1 0.739 0.008 . . . . . A 36 VAL HG13 . 18433 1 286 . 1 1 36 36 VAL HG21 H 1 0.794 0.011 . . . . . A 36 VAL HG21 . 18433 1 287 . 1 1 36 36 VAL HG22 H 1 0.794 0.011 . . . . . A 36 VAL HG22 . 18433 1 288 . 1 1 36 36 VAL HG23 H 1 0.794 0.011 . . . . . A 36 VAL HG23 . 18433 1 289 . 1 1 36 36 VAL CA C 13 67.358 0.030 . . . . . A 36 VAL CA . 18433 1 290 . 1 1 36 36 VAL CB C 13 32.092 0.054 . . . . . A 36 VAL CB . 18433 1 291 . 1 1 36 36 VAL CG1 C 13 22.297 0.061 . . . . . A 36 VAL CG1 . 18433 1 292 . 1 1 36 36 VAL CG2 C 13 20.662 0.167 . . . . . A 36 VAL CG2 . 18433 1 293 . 1 1 36 36 VAL N N 15 123.532 0.044 . . . . . A 36 VAL N . 18433 1 294 . 1 1 37 37 LYS H H 1 8.384 0.005 . . . . . A 37 LYS H . 18433 1 295 . 1 1 37 37 LYS HA H 1 3.467 0.007 . . . . . A 37 LYS HA . 18433 1 296 . 1 1 37 37 LYS HB2 H 1 0.976 0.004 . . . . . A 37 LYS HB2 . 18433 1 297 . 1 1 37 37 LYS HB3 H 1 1.070 0.008 . . . . . A 37 LYS HB3 . 18433 1 298 . 1 1 37 37 LYS HG2 H 1 0.110 0.009 . . . . . A 37 LYS HG2 . 18433 1 299 . 1 1 37 37 LYS HG3 H 1 0.330 0.006 . . . . . A 37 LYS HG3 . 18433 1 300 . 1 1 37 37 LYS HD2 H 1 0.845 0.006 . . . . . A 37 LYS HD2 . 18433 1 301 . 1 1 37 37 LYS HD3 H 1 0.967 0.004 . . . . . A 37 LYS HD3 . 18433 1 302 . 1 1 37 37 LYS HE2 H 1 2.174 0.006 . . . . . A 37 LYS HE2 . 18433 1 303 . 1 1 37 37 LYS HE3 H 1 2.319 0.006 . . . . . A 37 LYS HE3 . 18433 1 304 . 1 1 37 37 LYS CA C 13 60.249 0.059 . . . . . A 37 LYS CA . 18433 1 305 . 1 1 37 37 LYS CB C 13 31.309 0.031 . . . . . A 37 LYS CB . 18433 1 306 . 1 1 37 37 LYS CG C 13 24.126 0.062 . . . . . A 37 LYS CG . 18433 1 307 . 1 1 37 37 LYS CD C 13 29.514 0.051 . . . . . A 37 LYS CD . 18433 1 308 . 1 1 37 37 LYS CE C 13 40.825 0.034 . . . . . A 37 LYS CE . 18433 1 309 . 1 1 37 37 LYS N N 15 118.036 0.025 . . . . . A 37 LYS N . 18433 1 310 . 1 1 38 38 THR H H 1 7.344 0.007 . . . . . A 38 THR H . 18433 1 311 . 1 1 38 38 THR HA H 1 3.872 0.006 . . . . . A 38 THR HA . 18433 1 312 . 1 1 38 38 THR HB H 1 4.290 0.006 . . . . . A 38 THR HB . 18433 1 313 . 1 1 38 38 THR HG21 H 1 1.282 0.007 . . . . . A 38 THR HG21 . 18433 1 314 . 1 1 38 38 THR HG22 H 1 1.282 0.007 . . . . . A 38 THR HG22 . 18433 1 315 . 1 1 38 38 THR HG23 H 1 1.282 0.007 . . . . . A 38 THR HG23 . 18433 1 316 . 1 1 38 38 THR CA C 13 66.652 0.063 . . . . . A 38 THR CA . 18433 1 317 . 1 1 38 38 THR CB C 13 68.664 0.074 . . . . . A 38 THR CB . 18433 1 318 . 1 1 38 38 THR CG2 C 13 21.862 0.031 . . . . . A 38 THR CG2 . 18433 1 319 . 1 1 38 38 THR N N 15 115.765 0.047 . . . . . A 38 THR N . 18433 1 320 . 1 1 39 39 LEU H H 1 7.701 0.013 . . . . . A 39 LEU H . 18433 1 321 . 1 1 39 39 LEU HA H 1 4.347 0.008 . . . . . A 39 LEU HA . 18433 1 322 . 1 1 39 39 LEU HB2 H 1 1.620 0.006 . . . . . A 39 LEU HB2 . 18433 1 323 . 1 1 39 39 LEU HB3 H 1 2.084 0.006 . . . . . A 39 LEU HB3 . 18433 1 324 . 1 1 39 39 LEU HG H 1 1.803 0.006 . . . . . A 39 LEU HG . 18433 1 325 . 1 1 39 39 LEU HD11 H 1 0.896 0.008 . . . . . A 39 LEU HD11 . 18433 1 326 . 1 1 39 39 LEU HD12 H 1 0.896 0.008 . . . . . A 39 LEU HD12 . 18433 1 327 . 1 1 39 39 LEU HD13 H 1 0.896 0.008 . . . . . A 39 LEU HD13 . 18433 1 328 . 1 1 39 39 LEU HD21 H 1 0.910 0.005 . . . . . A 39 LEU HD21 . 18433 1 329 . 1 1 39 39 LEU HD22 H 1 0.910 0.005 . . . . . A 39 LEU HD22 . 18433 1 330 . 1 1 39 39 LEU HD23 H 1 0.910 0.005 . . . . . A 39 LEU HD23 . 18433 1 331 . 1 1 39 39 LEU CA C 13 58.257 0.073 . . . . . A 39 LEU CA . 18433 1 332 . 1 1 39 39 LEU CB C 13 43.306 0.054 . . . . . A 39 LEU CB . 18433 1 333 . 1 1 39 39 LEU CG C 13 27.158 0.076 . . . . . A 39 LEU CG . 18433 1 334 . 1 1 39 39 LEU CD1 C 13 25.034 0.060 . . . . . A 39 LEU CD1 . 18433 1 335 . 1 1 39 39 LEU CD2 C 13 26.816 0.162 . . . . . A 39 LEU CD2 . 18433 1 336 . 1 1 39 39 LEU N N 15 123.362 0.053 . . . . . A 39 LEU N . 18433 1 337 . 1 1 40 40 LEU H H 1 8.434 0.015 . . . . . A 40 LEU H . 18433 1 338 . 1 1 40 40 LEU HA H 1 4.375 0.010 . . . . . A 40 LEU HA . 18433 1 339 . 1 1 40 40 LEU HB2 H 1 1.438 0.008 . . . . . A 40 LEU HB2 . 18433 1 340 . 1 1 40 40 LEU HB3 H 1 2.288 0.007 . . . . . A 40 LEU HB3 . 18433 1 341 . 1 1 40 40 LEU HG H 1 1.959 0.009 . . . . . A 40 LEU HG . 18433 1 342 . 1 1 40 40 LEU HD11 H 1 1.012 0.006 . . . . . A 40 LEU HD11 . 18433 1 343 . 1 1 40 40 LEU HD12 H 1 1.012 0.006 . . . . . A 40 LEU HD12 . 18433 1 344 . 1 1 40 40 LEU HD13 H 1 1.012 0.006 . . . . . A 40 LEU HD13 . 18433 1 345 . 1 1 40 40 LEU HD21 H 1 1.165 0.008 . . . . . A 40 LEU HD21 . 18433 1 346 . 1 1 40 40 LEU HD22 H 1 1.165 0.008 . . . . . A 40 LEU HD22 . 18433 1 347 . 1 1 40 40 LEU HD23 H 1 1.165 0.008 . . . . . A 40 LEU HD23 . 18433 1 348 . 1 1 40 40 LEU CA C 13 58.311 0.066 . . . . . A 40 LEU CA . 18433 1 349 . 1 1 40 40 LEU CB C 13 42.788 0.042 . . . . . A 40 LEU CB . 18433 1 350 . 1 1 40 40 LEU CG C 13 26.756 0.015 . . . . . A 40 LEU CG . 18433 1 351 . 1 1 40 40 LEU CD1 C 13 26.895 0.051 . . . . . A 40 LEU CD1 . 18433 1 352 . 1 1 40 40 LEU CD2 C 13 23.658 0.159 . . . . . A 40 LEU CD2 . 18433 1 353 . 1 1 40 40 LEU N N 15 118.128 0.022 . . . . . A 40 LEU N . 18433 1 354 . 1 1 41 41 LYS H H 1 8.571 0.012 . . . . . A 41 LYS H . 18433 1 355 . 1 1 41 41 LYS HA H 1 3.862 0.008 . . . . . A 41 LYS HA . 18433 1 356 . 1 1 41 41 LYS HB2 H 1 1.985 0.007 . . . . . A 41 LYS HB2 . 18433 1 357 . 1 1 41 41 LYS HB3 H 1 2.330 0.008 . . . . . A 41 LYS HB3 . 18433 1 358 . 1 1 41 41 LYS HG2 H 1 1.320 0.009 . . . . . A 41 LYS HG2 . 18433 1 359 . 1 1 41 41 LYS HG3 H 1 1.320 0.009 . . . . . A 41 LYS HG3 . 18433 1 360 . 1 1 41 41 LYS HD2 H 1 1.651 0.008 . . . . . A 41 LYS HD2 . 18433 1 361 . 1 1 41 41 LYS HD3 H 1 1.726 0.003 . . . . . A 41 LYS HD3 . 18433 1 362 . 1 1 41 41 LYS HE2 H 1 2.925 0.005 . . . . . A 41 LYS HE2 . 18433 1 363 . 1 1 41 41 LYS HE3 H 1 2.925 0.005 . . . . . A 41 LYS HE3 . 18433 1 364 . 1 1 41 41 LYS CA C 13 59.896 0.094 . . . . . A 41 LYS CA . 18433 1 365 . 1 1 41 41 LYS CB C 13 31.696 0.066 . . . . . A 41 LYS CB . 18433 1 366 . 1 1 41 41 LYS CG C 13 25.037 0.040 . . . . . A 41 LYS CG . 18433 1 367 . 1 1 41 41 LYS CD C 13 29.258 0.023 . . . . . A 41 LYS CD . 18433 1 368 . 1 1 41 41 LYS CE C 13 41.880 0.061 . . . . . A 41 LYS CE . 18433 1 369 . 1 1 41 41 LYS N N 15 117.838 0.032 . . . . . A 41 LYS N . 18433 1 370 . 1 1 42 42 GLU H H 1 8.276 0.006 . . . . . A 42 GLU H . 18433 1 371 . 1 1 42 42 GLU HA H 1 3.891 0.006 . . . . . A 42 GLU HA . 18433 1 372 . 1 1 42 42 GLU HB2 H 1 2.314 0.011 . . . . . A 42 GLU HB2 . 18433 1 373 . 1 1 42 42 GLU HB3 H 1 2.314 0.011 . . . . . A 42 GLU HB3 . 18433 1 374 . 1 1 42 42 GLU HG2 H 1 2.276 0.008 . . . . . A 42 GLU HG2 . 18433 1 375 . 1 1 42 42 GLU HG3 H 1 2.487 0.007 . . . . . A 42 GLU HG3 . 18433 1 376 . 1 1 42 42 GLU CA C 13 59.946 0.029 . . . . . A 42 GLU CA . 18433 1 377 . 1 1 42 42 GLU CB C 13 29.603 0.092 . . . . . A 42 GLU CB . 18433 1 378 . 1 1 42 42 GLU CG C 13 36.492 0.061 . . . . . A 42 GLU CG . 18433 1 379 . 1 1 42 42 GLU N N 15 122.248 0.038 . . . . . A 42 GLU N . 18433 1 380 . 1 1 43 43 TRP H H 1 8.318 0.018 . . . . . A 43 TRP H . 18433 1 381 . 1 1 43 43 TRP HA H 1 3.025 0.005 . . . . . A 43 TRP HA . 18433 1 382 . 1 1 43 43 TRP HB2 H 1 2.649 0.008 . . . . . A 43 TRP HB2 . 18433 1 383 . 1 1 43 43 TRP HB3 H 1 3.531 0.004 . . . . . A 43 TRP HB3 . 18433 1 384 . 1 1 43 43 TRP HD1 H 1 6.125 0.006 . . . . . A 43 TRP HD1 . 18433 1 385 . 1 1 43 43 TRP HE1 H 1 10.606 0.004 . . . . . A 43 TRP HE1 . 18433 1 386 . 1 1 43 43 TRP HE3 H 1 7.646 0.004 . . . . . A 43 TRP HE3 . 18433 1 387 . 1 1 43 43 TRP HZ2 H 1 7.304 0.004 . . . . . A 43 TRP HZ2 . 18433 1 388 . 1 1 43 43 TRP HZ3 H 1 7.059 0.008 . . . . . A 43 TRP HZ3 . 18433 1 389 . 1 1 43 43 TRP HH2 H 1 7.092 0.007 . . . . . A 43 TRP HH2 . 18433 1 390 . 1 1 43 43 TRP CA C 13 58.805 0.025 . . . . . A 43 TRP CA . 18433 1 391 . 1 1 43 43 TRP CB C 13 28.652 0.036 . . . . . A 43 TRP CB . 18433 1 392 . 1 1 43 43 TRP CD1 C 13 126.173 0.148 . . . . . A 43 TRP CD1 . 18433 1 393 . 1 1 43 43 TRP CE3 C 13 121.304 0.081 . . . . . A 43 TRP CE3 . 18433 1 394 . 1 1 43 43 TRP CZ2 C 13 114.195 0.094 . . . . . A 43 TRP CZ2 . 18433 1 395 . 1 1 43 43 TRP CZ3 C 13 121.220 0.051 . . . . . A 43 TRP CZ3 . 18433 1 396 . 1 1 43 43 TRP CH2 C 13 122.908 0.020 . . . . . A 43 TRP CH2 . 18433 1 397 . 1 1 43 43 TRP N N 15 123.115 0.013 . . . . . A 43 TRP N . 18433 1 398 . 1 1 43 43 TRP NE1 N 15 128.390 0.000 . . . . . A 43 TRP NE1 . 18433 1 399 . 1 1 44 44 ILE H H 1 7.567 0.006 . . . . . A 44 ILE H . 18433 1 400 . 1 1 44 44 ILE HA H 1 2.539 0.007 . . . . . A 44 ILE HA . 18433 1 401 . 1 1 44 44 ILE HB H 1 0.943 0.007 . . . . . A 44 ILE HB . 18433 1 402 . 1 1 44 44 ILE HG12 H 1 -0.374 0.006 . . . . . A 44 ILE HG12 . 18433 1 403 . 1 1 44 44 ILE HG13 H 1 0.998 0.007 . . . . . A 44 ILE HG13 . 18433 1 404 . 1 1 44 44 ILE HG21 H 1 -0.290 0.007 . . . . . A 44 ILE HG21 . 18433 1 405 . 1 1 44 44 ILE HG22 H 1 -0.290 0.007 . . . . . A 44 ILE HG22 . 18433 1 406 . 1 1 44 44 ILE HG23 H 1 -0.290 0.007 . . . . . A 44 ILE HG23 . 18433 1 407 . 1 1 44 44 ILE HD11 H 1 0.498 0.009 . . . . . A 44 ILE HD11 . 18433 1 408 . 1 1 44 44 ILE HD12 H 1 0.498 0.009 . . . . . A 44 ILE HD12 . 18433 1 409 . 1 1 44 44 ILE HD13 H 1 0.498 0.009 . . . . . A 44 ILE HD13 . 18433 1 410 . 1 1 44 44 ILE CA C 13 62.441 0.052 . . . . . A 44 ILE CA . 18433 1 411 . 1 1 44 44 ILE CB C 13 38.393 0.071 . . . . . A 44 ILE CB . 18433 1 412 . 1 1 44 44 ILE CG1 C 13 29.396 0.122 . . . . . A 44 ILE CG1 . 18433 1 413 . 1 1 44 44 ILE CG2 C 13 16.807 0.132 . . . . . A 44 ILE CG2 . 18433 1 414 . 1 1 44 44 ILE CD1 C 13 15.932 0.066 . . . . . A 44 ILE CD1 . 18433 1 415 . 1 1 44 44 ILE N N 15 112.941 0.038 . . . . . A 44 ILE N . 18433 1 416 . 1 1 45 45 THR H H 1 7.653 0.011 . . . . . A 45 THR H . 18433 1 417 . 1 1 45 45 THR HA H 1 4.080 0.004 . . . . . A 45 THR HA . 18433 1 418 . 1 1 45 45 THR HB H 1 4.208 0.007 . . . . . A 45 THR HB . 18433 1 419 . 1 1 45 45 THR HG21 H 1 1.166 0.007 . . . . . A 45 THR HG21 . 18433 1 420 . 1 1 45 45 THR HG22 H 1 1.166 0.007 . . . . . A 45 THR HG22 . 18433 1 421 . 1 1 45 45 THR HG23 H 1 1.166 0.007 . . . . . A 45 THR HG23 . 18433 1 422 . 1 1 45 45 THR CA C 13 63.681 0.044 . . . . . A 45 THR CA . 18433 1 423 . 1 1 45 45 THR CB C 13 70.147 0.071 . . . . . A 45 THR CB . 18433 1 424 . 1 1 45 45 THR CG2 C 13 21.281 0.049 . . . . . A 45 THR CG2 . 18433 1 425 . 1 1 45 45 THR N N 15 106.451 0.050 . . . . . A 45 THR N . 18433 1 426 . 1 1 46 46 THR H H 1 7.502 0.015 . . . . . A 46 THR H . 18433 1 427 . 1 1 46 46 THR HA H 1 4.557 0.006 . . . . . A 46 THR HA . 18433 1 428 . 1 1 46 46 THR HB H 1 4.274 0.007 . . . . . A 46 THR HB . 18433 1 429 . 1 1 46 46 THR HG21 H 1 1.330 0.005 . . . . . A 46 THR HG21 . 18433 1 430 . 1 1 46 46 THR HG22 H 1 1.330 0.005 . . . . . A 46 THR HG22 . 18433 1 431 . 1 1 46 46 THR HG23 H 1 1.330 0.005 . . . . . A 46 THR HG23 . 18433 1 432 . 1 1 46 46 THR CA C 13 62.972 0.048 . . . . . A 46 THR CA . 18433 1 433 . 1 1 46 46 THR CB C 13 71.039 0.067 . . . . . A 46 THR CB . 18433 1 434 . 1 1 46 46 THR CG2 C 13 21.134 0.074 . . . . . A 46 THR CG2 . 18433 1 435 . 1 1 46 46 THR N N 15 110.600 0.048 . . . . . A 46 THR N . 18433 1 436 . 1 1 47 47 ILE H H 1 7.533 0.006 . . . . . A 47 ILE H . 18433 1 437 . 1 1 47 47 ILE HA H 1 4.473 0.012 . . . . . A 47 ILE HA . 18433 1 438 . 1 1 47 47 ILE HB H 1 2.541 0.008 . . . . . A 47 ILE HB . 18433 1 439 . 1 1 47 47 ILE HG12 H 1 1.328 0.006 . . . . . A 47 ILE HG12 . 18433 1 440 . 1 1 47 47 ILE HG13 H 1 1.663 0.009 . . . . . A 47 ILE HG13 . 18433 1 441 . 1 1 47 47 ILE HG21 H 1 0.849 0.007 . . . . . A 47 ILE HG21 . 18433 1 442 . 1 1 47 47 ILE HG22 H 1 0.849 0.007 . . . . . A 47 ILE HG22 . 18433 1 443 . 1 1 47 47 ILE HG23 H 1 0.849 0.007 . . . . . A 47 ILE HG23 . 18433 1 444 . 1 1 47 47 ILE HD11 H 1 0.958 0.007 . . . . . A 47 ILE HD11 . 18433 1 445 . 1 1 47 47 ILE HD12 H 1 0.958 0.007 . . . . . A 47 ILE HD12 . 18433 1 446 . 1 1 47 47 ILE HD13 H 1 0.958 0.007 . . . . . A 47 ILE HD13 . 18433 1 447 . 1 1 47 47 ILE CA C 13 58.603 0.105 . . . . . A 47 ILE CA . 18433 1 448 . 1 1 47 47 ILE CB C 13 36.501 0.054 . . . . . A 47 ILE CB . 18433 1 449 . 1 1 47 47 ILE CG1 C 13 28.019 0.057 . . . . . A 47 ILE CG1 . 18433 1 450 . 1 1 47 47 ILE CG2 C 13 18.097 0.053 . . . . . A 47 ILE CG2 . 18433 1 451 . 1 1 47 47 ILE CD1 C 13 11.002 0.070 . . . . . A 47 ILE CD1 . 18433 1 452 . 1 1 47 47 ILE N N 15 124.370 0.029 . . . . . A 47 ILE N . 18433 1 453 . 1 1 48 48 SER H H 1 8.423 0.005 . . . . . A 48 SER H . 18433 1 454 . 1 1 48 48 SER HA H 1 4.498 0.012 . . . . . A 48 SER HA . 18433 1 455 . 1 1 48 48 SER HB2 H 1 3.875 0.009 . . . . . A 48 SER HB2 . 18433 1 456 . 1 1 48 48 SER HB3 H 1 3.875 0.009 . . . . . A 48 SER HB3 . 18433 1 457 . 1 1 48 48 SER CA C 13 59.280 0.065 . . . . . A 48 SER CA . 18433 1 458 . 1 1 48 48 SER CB C 13 63.813 0.060 . . . . . A 48 SER CB . 18433 1 459 . 1 1 48 48 SER N N 15 119.846 0.014 . . . . . A 48 SER N . 18433 1 460 . 1 1 49 49 ASP H H 1 7.298 0.011 . . . . . A 49 ASP H . 18433 1 461 . 1 1 49 49 ASP HA H 1 4.799 0.004 . . . . . A 49 ASP HA . 18433 1 462 . 1 1 49 49 ASP HB2 H 1 2.327 0.004 . . . . . A 49 ASP HB2 . 18433 1 463 . 1 1 49 49 ASP HB3 H 1 2.506 0.009 . . . . . A 49 ASP HB3 . 18433 1 464 . 1 1 49 49 ASP CA C 13 50.804 0.033 . . . . . A 49 ASP CA . 18433 1 465 . 1 1 49 49 ASP CB C 13 41.481 0.048 . . . . . A 49 ASP CB . 18433 1 466 . 1 1 49 49 ASP N N 15 119.475 0.082 . . . . . A 49 ASP N . 18433 1 467 . 1 1 50 50 PRO HA H 1 4.168 0.008 . . . . . A 50 PRO HA . 18433 1 468 . 1 1 50 50 PRO HB2 H 1 1.433 0.008 . . . . . A 50 PRO HB2 . 18433 1 469 . 1 1 50 50 PRO HB3 H 1 1.433 0.008 . . . . . A 50 PRO HB3 . 18433 1 470 . 1 1 50 50 PRO HG2 H 1 -0.187 0.007 . . . . . A 50 PRO HG2 . 18433 1 471 . 1 1 50 50 PRO HG3 H 1 1.173 0.008 . . . . . A 50 PRO HG3 . 18433 1 472 . 1 1 50 50 PRO HD2 H 1 1.957 0.009 . . . . . A 50 PRO HD2 . 18433 1 473 . 1 1 50 50 PRO HD3 H 1 3.125 0.006 . . . . . A 50 PRO HD3 . 18433 1 474 . 1 1 50 50 PRO CA C 13 61.912 0.106 . . . . . A 50 PRO CA . 18433 1 475 . 1 1 50 50 PRO CB C 13 31.747 0.068 . . . . . A 50 PRO CB . 18433 1 476 . 1 1 50 50 PRO CG C 13 25.582 0.052 . . . . . A 50 PRO CG . 18433 1 477 . 1 1 50 50 PRO CD C 13 49.777 0.034 . . . . . A 50 PRO CD . 18433 1 478 . 1 1 51 51 MET H H 1 9.258 0.019 . . . . . A 51 MET H . 18433 1 479 . 1 1 51 51 MET HA H 1 4.492 0.008 . . . . . A 51 MET HA . 18433 1 480 . 1 1 51 51 MET HB2 H 1 2.325 0.007 . . . . . A 51 MET HB2 . 18433 1 481 . 1 1 51 51 MET HB3 H 1 2.498 0.009 . . . . . A 51 MET HB3 . 18433 1 482 . 1 1 51 51 MET HG2 H 1 2.761 0.005 . . . . . A 51 MET HG2 . 18433 1 483 . 1 1 51 51 MET HG3 H 1 2.871 0.006 . . . . . A 51 MET HG3 . 18433 1 484 . 1 1 51 51 MET HE1 H 1 2.079 0.003 . . . . . A 51 MET HE1 . 18433 1 485 . 1 1 51 51 MET HE2 H 1 2.079 0.003 . . . . . A 51 MET HE2 . 18433 1 486 . 1 1 51 51 MET HE3 H 1 2.079 0.003 . . . . . A 51 MET HE3 . 18433 1 487 . 1 1 51 51 MET CA C 13 55.165 0.083 . . . . . A 51 MET CA . 18433 1 488 . 1 1 51 51 MET CB C 13 33.974 0.053 . . . . . A 51 MET CB . 18433 1 489 . 1 1 51 51 MET CG C 13 32.448 0.025 . . . . . A 51 MET CG . 18433 1 490 . 1 1 51 51 MET CE C 13 17.332 0.006 . . . . . A 51 MET CE . 18433 1 491 . 1 1 51 51 MET N N 15 121.983 0.161 . . . . . A 51 MET N . 18433 1 492 . 1 1 52 52 GLU HA H 1 3.832 0.013 . . . . . A 52 GLU HA . 18433 1 493 . 1 1 52 52 GLU HB2 H 1 2.010 0.004 . . . . . A 52 GLU HB2 . 18433 1 494 . 1 1 52 52 GLU HB3 H 1 2.116 0.010 . . . . . A 52 GLU HB3 . 18433 1 495 . 1 1 52 52 GLU HG2 H 1 2.182 0.003 . . . . . A 52 GLU HG2 . 18433 1 496 . 1 1 52 52 GLU HG3 H 1 2.182 0.003 . . . . . A 52 GLU HG3 . 18433 1 497 . 1 1 52 52 GLU CA C 13 60.499 0.039 . . . . . A 52 GLU CA . 18433 1 498 . 1 1 52 52 GLU CB C 13 29.723 0.046 . . . . . A 52 GLU CB . 18433 1 499 . 1 1 52 52 GLU CG C 13 36.482 0.036 . . . . . A 52 GLU CG . 18433 1 500 . 1 1 53 53 GLU H H 1 9.834 0.035 . . . . . A 53 GLU H . 18433 1 501 . 1 1 53 53 GLU HA H 1 4.065 0.012 . . . . . A 53 GLU HA . 18433 1 502 . 1 1 53 53 GLU HB2 H 1 2.056 0.017 . . . . . A 53 GLU HB2 . 18433 1 503 . 1 1 53 53 GLU HB3 H 1 2.056 0.017 . . . . . A 53 GLU HB3 . 18433 1 504 . 1 1 53 53 GLU HG2 H 1 2.186 0.005 . . . . . A 53 GLU HG2 . 18433 1 505 . 1 1 53 53 GLU HG3 H 1 2.409 0.005 . . . . . A 53 GLU HG3 . 18433 1 506 . 1 1 53 53 GLU CA C 13 60.171 0.105 . . . . . A 53 GLU CA . 18433 1 507 . 1 1 53 53 GLU CB C 13 29.644 0.072 . . . . . A 53 GLU CB . 18433 1 508 . 1 1 53 53 GLU CG C 13 36.438 0.050 . . . . . A 53 GLU CG . 18433 1 509 . 1 1 53 53 GLU N N 15 116.755 0.065 . . . . . A 53 GLU N . 18433 1 510 . 1 1 54 54 ASP H H 1 7.348 0.005 . . . . . A 54 ASP H . 18433 1 511 . 1 1 54 54 ASP HA H 1 4.998 0.006 . . . . . A 54 ASP HA . 18433 1 512 . 1 1 54 54 ASP HB2 H 1 2.652 0.007 . . . . . A 54 ASP HB2 . 18433 1 513 . 1 1 54 54 ASP HB3 H 1 3.169 0.007 . . . . . A 54 ASP HB3 . 18433 1 514 . 1 1 54 54 ASP CA C 13 58.061 0.093 . . . . . A 54 ASP CA . 18433 1 515 . 1 1 54 54 ASP CB C 13 42.266 0.104 . . . . . A 54 ASP CB . 18433 1 516 . 1 1 54 54 ASP N N 15 117.972 0.123 . . . . . A 54 ASP N . 18433 1 517 . 1 1 55 55 ILE H H 1 8.081 0.005 . . . . . A 55 ILE H . 18433 1 518 . 1 1 55 55 ILE HA H 1 3.935 0.008 . . . . . A 55 ILE HA . 18433 1 519 . 1 1 55 55 ILE HB H 1 2.164 0.009 . . . . . A 55 ILE HB . 18433 1 520 . 1 1 55 55 ILE HG12 H 1 1.204 0.011 . . . . . A 55 ILE HG12 . 18433 1 521 . 1 1 55 55 ILE HG13 H 1 2.124 0.013 . . . . . A 55 ILE HG13 . 18433 1 522 . 1 1 55 55 ILE HG21 H 1 1.112 0.007 . . . . . A 55 ILE HG21 . 18433 1 523 . 1 1 55 55 ILE HG22 H 1 1.112 0.007 . . . . . A 55 ILE HG22 . 18433 1 524 . 1 1 55 55 ILE HG23 H 1 1.112 0.007 . . . . . A 55 ILE HG23 . 18433 1 525 . 1 1 55 55 ILE HD11 H 1 0.757 0.008 . . . . . A 55 ILE HD11 . 18433 1 526 . 1 1 55 55 ILE HD12 H 1 0.757 0.008 . . . . . A 55 ILE HD12 . 18433 1 527 . 1 1 55 55 ILE HD13 H 1 0.757 0.008 . . . . . A 55 ILE HD13 . 18433 1 528 . 1 1 55 55 ILE CA C 13 66.531 0.077 . . . . . A 55 ILE CA . 18433 1 529 . 1 1 55 55 ILE CB C 13 38.139 0.067 . . . . . A 55 ILE CB . 18433 1 530 . 1 1 55 55 ILE CG1 C 13 29.820 0.052 . . . . . A 55 ILE CG1 . 18433 1 531 . 1 1 55 55 ILE CG2 C 13 18.285 0.061 . . . . . A 55 ILE CG2 . 18433 1 532 . 1 1 55 55 ILE CD1 C 13 13.460 0.045 . . . . . A 55 ILE CD1 . 18433 1 533 . 1 1 55 55 ILE N N 15 122.004 0.045 . . . . . A 55 ILE N . 18433 1 534 . 1 1 56 56 LEU H H 1 8.770 0.006 . . . . . A 56 LEU H . 18433 1 535 . 1 1 56 56 LEU HA H 1 4.150 0.007 . . . . . A 56 LEU HA . 18433 1 536 . 1 1 56 56 LEU HB2 H 1 1.582 0.006 . . . . . A 56 LEU HB2 . 18433 1 537 . 1 1 56 56 LEU HB3 H 1 1.943 0.007 . . . . . A 56 LEU HB3 . 18433 1 538 . 1 1 56 56 LEU HG H 1 1.902 0.008 . . . . . A 56 LEU HG . 18433 1 539 . 1 1 56 56 LEU HD11 H 1 0.963 0.005 . . . . . A 56 LEU HD11 . 18433 1 540 . 1 1 56 56 LEU HD12 H 1 0.963 0.005 . . . . . A 56 LEU HD12 . 18433 1 541 . 1 1 56 56 LEU HD13 H 1 0.963 0.005 . . . . . A 56 LEU HD13 . 18433 1 542 . 1 1 56 56 LEU HD21 H 1 1.026 0.008 . . . . . A 56 LEU HD21 . 18433 1 543 . 1 1 56 56 LEU HD22 H 1 1.026 0.008 . . . . . A 56 LEU HD22 . 18433 1 544 . 1 1 56 56 LEU HD23 H 1 1.026 0.008 . . . . . A 56 LEU HD23 . 18433 1 545 . 1 1 56 56 LEU CA C 13 57.935 0.063 . . . . . A 56 LEU CA . 18433 1 546 . 1 1 56 56 LEU CB C 13 40.977 0.058 . . . . . A 56 LEU CB . 18433 1 547 . 1 1 56 56 LEU CG C 13 27.138 0.050 . . . . . A 56 LEU CG . 18433 1 548 . 1 1 56 56 LEU CD1 C 13 25.103 0.046 . . . . . A 56 LEU CD1 . 18433 1 549 . 1 1 56 56 LEU CD2 C 13 22.302 0.054 . . . . . A 56 LEU CD2 . 18433 1 550 . 1 1 56 56 LEU N N 15 117.547 0.040 . . . . . A 56 LEU N . 18433 1 551 . 1 1 57 57 GLN H H 1 7.734 0.014 . . . . . A 57 GLN H . 18433 1 552 . 1 1 57 57 GLN HA H 1 4.066 0.007 . . . . . A 57 GLN HA . 18433 1 553 . 1 1 57 57 GLN HB2 H 1 1.941 0.007 . . . . . A 57 GLN HB2 . 18433 1 554 . 1 1 57 57 GLN HB3 H 1 2.183 0.004 . . . . . A 57 GLN HB3 . 18433 1 555 . 1 1 57 57 GLN HG2 H 1 2.295 0.008 . . . . . A 57 GLN HG2 . 18433 1 556 . 1 1 57 57 GLN HG3 H 1 2.973 0.010 . . . . . A 57 GLN HG3 . 18433 1 557 . 1 1 57 57 GLN HE21 H 1 6.717 0.008 . . . . . A 57 GLN HE21 . 18433 1 558 . 1 1 57 57 GLN HE22 H 1 6.989 0.010 . . . . . A 57 GLN HE22 . 18433 1 559 . 1 1 57 57 GLN CA C 13 60.371 0.142 . . . . . A 57 GLN CA . 18433 1 560 . 1 1 57 57 GLN CB C 13 27.940 0.081 . . . . . A 57 GLN CB . 18433 1 561 . 1 1 57 57 GLN CG C 13 35.331 0.114 . . . . . A 57 GLN CG . 18433 1 562 . 1 1 57 57 GLN N N 15 119.917 0.016 . . . . . A 57 GLN N . 18433 1 563 . 1 1 57 57 GLN NE2 N 15 112.601 0.003 . . . . . A 57 GLN NE2 . 18433 1 564 . 1 1 58 58 VAL H H 1 7.727 0.013 . . . . . A 58 VAL H . 18433 1 565 . 1 1 58 58 VAL HA H 1 3.615 0.005 . . . . . A 58 VAL HA . 18433 1 566 . 1 1 58 58 VAL HB H 1 2.515 0.008 . . . . . A 58 VAL HB . 18433 1 567 . 1 1 58 58 VAL HG11 H 1 0.906 0.007 . . . . . A 58 VAL HG11 . 18433 1 568 . 1 1 58 58 VAL HG12 H 1 0.906 0.007 . . . . . A 58 VAL HG12 . 18433 1 569 . 1 1 58 58 VAL HG13 H 1 0.906 0.007 . . . . . A 58 VAL HG13 . 18433 1 570 . 1 1 58 58 VAL HG21 H 1 1.161 0.008 . . . . . A 58 VAL HG21 . 18433 1 571 . 1 1 58 58 VAL HG22 H 1 1.161 0.008 . . . . . A 58 VAL HG22 . 18433 1 572 . 1 1 58 58 VAL HG23 H 1 1.161 0.008 . . . . . A 58 VAL HG23 . 18433 1 573 . 1 1 58 58 VAL CA C 13 67.230 0.052 . . . . . A 58 VAL CA . 18433 1 574 . 1 1 58 58 VAL CB C 13 31.272 0.089 . . . . . A 58 VAL CB . 18433 1 575 . 1 1 58 58 VAL CG1 C 13 24.725 0.089 . . . . . A 58 VAL CG1 . 18433 1 576 . 1 1 58 58 VAL CG2 C 13 22.855 0.078 . . . . . A 58 VAL CG2 . 18433 1 577 . 1 1 58 58 VAL N N 15 122.347 0.036 . . . . . A 58 VAL N . 18433 1 578 . 1 1 59 59 VAL H H 1 8.341 0.013 . . . . . A 59 VAL H . 18433 1 579 . 1 1 59 59 VAL HA H 1 3.406 0.006 . . . . . A 59 VAL HA . 18433 1 580 . 1 1 59 59 VAL HB H 1 2.361 0.008 . . . . . A 59 VAL HB . 18433 1 581 . 1 1 59 59 VAL HG11 H 1 0.869 0.006 . . . . . A 59 VAL HG11 . 18433 1 582 . 1 1 59 59 VAL HG12 H 1 0.869 0.006 . . . . . A 59 VAL HG12 . 18433 1 583 . 1 1 59 59 VAL HG13 H 1 0.869 0.006 . . . . . A 59 VAL HG13 . 18433 1 584 . 1 1 59 59 VAL HG21 H 1 1.235 0.007 . . . . . A 59 VAL HG21 . 18433 1 585 . 1 1 59 59 VAL HG22 H 1 1.235 0.007 . . . . . A 59 VAL HG22 . 18433 1 586 . 1 1 59 59 VAL HG23 H 1 1.235 0.007 . . . . . A 59 VAL HG23 . 18433 1 587 . 1 1 59 59 VAL CA C 13 68.048 0.049 . . . . . A 59 VAL CA . 18433 1 588 . 1 1 59 59 VAL CB C 13 31.542 0.064 . . . . . A 59 VAL CB . 18433 1 589 . 1 1 59 59 VAL CG1 C 13 21.701 0.065 . . . . . A 59 VAL CG1 . 18433 1 590 . 1 1 59 59 VAL CG2 C 13 24.766 0.067 . . . . . A 59 VAL CG2 . 18433 1 591 . 1 1 59 59 VAL N N 15 121.131 0.026 . . . . . A 59 VAL N . 18433 1 592 . 1 1 60 60 ARG H H 1 8.457 0.005 . . . . . A 60 ARG H . 18433 1 593 . 1 1 60 60 ARG HA H 1 4.115 0.008 . . . . . A 60 ARG HA . 18433 1 594 . 1 1 60 60 ARG HB2 H 1 1.951 0.004 . . . . . A 60 ARG HB2 . 18433 1 595 . 1 1 60 60 ARG HB3 H 1 2.030 0.006 . . . . . A 60 ARG HB3 . 18433 1 596 . 1 1 60 60 ARG HG2 H 1 1.665 0.009 . . . . . A 60 ARG HG2 . 18433 1 597 . 1 1 60 60 ARG HG3 H 1 1.814 0.014 . . . . . A 60 ARG HG3 . 18433 1 598 . 1 1 60 60 ARG HD2 H 1 3.231 0.004 . . . . . A 60 ARG HD2 . 18433 1 599 . 1 1 60 60 ARG HD3 H 1 3.231 0.004 . . . . . A 60 ARG HD3 . 18433 1 600 . 1 1 60 60 ARG CA C 13 58.413 0.082 . . . . . A 60 ARG CA . 18433 1 601 . 1 1 60 60 ARG CB C 13 29.741 0.058 . . . . . A 60 ARG CB . 18433 1 602 . 1 1 60 60 ARG CG C 13 26.643 0.067 . . . . . A 60 ARG CG . 18433 1 603 . 1 1 60 60 ARG CD C 13 43.005 0.040 . . . . . A 60 ARG CD . 18433 1 604 . 1 1 60 60 ARG N N 15 120.942 0.031 . . . . . A 60 ARG N . 18433 1 605 . 1 1 61 61 TYR H H 1 7.833 0.016 . . . . . A 61 TYR H . 18433 1 606 . 1 1 61 61 TYR HA H 1 4.566 0.005 . . . . . A 61 TYR HA . 18433 1 607 . 1 1 61 61 TYR HB2 H 1 3.080 0.005 . . . . . A 61 TYR HB2 . 18433 1 608 . 1 1 61 61 TYR HB3 H 1 3.145 0.014 . . . . . A 61 TYR HB3 . 18433 1 609 . 1 1 61 61 TYR HD1 H 1 6.903 0.005 . . . . . A 61 TYR HD1 . 18433 1 610 . 1 1 61 61 TYR HD2 H 1 6.903 0.005 . . . . . A 61 TYR HD2 . 18433 1 611 . 1 1 61 61 TYR HE1 H 1 6.452 0.005 . . . . . A 61 TYR HE1 . 18433 1 612 . 1 1 61 61 TYR HE2 H 1 6.452 0.005 . . . . . A 61 TYR HE2 . 18433 1 613 . 1 1 61 61 TYR CA C 13 60.754 0.077 . . . . . A 61 TYR CA . 18433 1 614 . 1 1 61 61 TYR CB C 13 38.353 0.141 . . . . . A 61 TYR CB . 18433 1 615 . 1 1 61 61 TYR CD2 C 13 132.554 0.085 . . . . . A 61 TYR CD2 . 18433 1 616 . 1 1 61 61 TYR CE2 C 13 117.035 0.117 . . . . . A 61 TYR CE2 . 18433 1 617 . 1 1 61 61 TYR N N 15 120.718 0.053 . . . . . A 61 TYR N . 18433 1 618 . 1 1 62 62 CYS H H 1 8.079 0.015 . . . . . A 62 CYS H . 18433 1 619 . 1 1 62 62 CYS HA H 1 3.673 0.006 . . . . . A 62 CYS HA . 18433 1 620 . 1 1 62 62 CYS HB2 H 1 2.381 0.005 . . . . . A 62 CYS HB2 . 18433 1 621 . 1 1 62 62 CYS HB3 H 1 3.158 0.007 . . . . . A 62 CYS HB3 . 18433 1 622 . 1 1 62 62 CYS CA C 13 64.281 0.032 . . . . . A 62 CYS CA . 18433 1 623 . 1 1 62 62 CYS CB C 13 27.717 0.037 . . . . . A 62 CYS CB . 18433 1 624 . 1 1 62 62 CYS N N 15 114.924 0.027 . . . . . A 62 CYS N . 18433 1 625 . 1 1 63 63 THR H H 1 8.721 0.006 . . . . . A 63 THR H . 18433 1 626 . 1 1 63 63 THR HA H 1 3.852 0.007 . . . . . A 63 THR HA . 18433 1 627 . 1 1 63 63 THR HB H 1 4.438 0.006 . . . . . A 63 THR HB . 18433 1 628 . 1 1 63 63 THR HG21 H 1 1.222 0.008 . . . . . A 63 THR HG21 . 18433 1 629 . 1 1 63 63 THR HG22 H 1 1.222 0.008 . . . . . A 63 THR HG22 . 18433 1 630 . 1 1 63 63 THR HG23 H 1 1.222 0.008 . . . . . A 63 THR HG23 . 18433 1 631 . 1 1 63 63 THR CA C 13 66.871 0.051 . . . . . A 63 THR CA . 18433 1 632 . 1 1 63 63 THR CB C 13 67.762 0.046 . . . . . A 63 THR CB . 18433 1 633 . 1 1 63 63 THR CG2 C 13 21.293 0.051 . . . . . A 63 THR CG2 . 18433 1 634 . 1 1 63 63 THR N N 15 114.103 0.004 . . . . . A 63 THR N . 18433 1 635 . 1 1 64 64 ASP H H 1 8.771 0.011 . . . . . A 64 ASP H . 18433 1 636 . 1 1 64 64 ASP HA H 1 4.421 0.008 . . . . . A 64 ASP HA . 18433 1 637 . 1 1 64 64 ASP HB2 H 1 2.477 0.006 . . . . . A 64 ASP HB2 . 18433 1 638 . 1 1 64 64 ASP HB3 H 1 3.133 0.008 . . . . . A 64 ASP HB3 . 18433 1 639 . 1 1 64 64 ASP CA C 13 57.784 0.058 . . . . . A 64 ASP CA . 18433 1 640 . 1 1 64 64 ASP CB C 13 39.241 0.114 . . . . . A 64 ASP CB . 18433 1 641 . 1 1 64 64 ASP N N 15 126.664 0.046 . . . . . A 64 ASP N . 18433 1 642 . 1 1 65 65 LEU H H 1 7.850 0.012 . . . . . A 65 LEU H . 18433 1 643 . 1 1 65 65 LEU HA H 1 3.872 0.004 . . . . . A 65 LEU HA . 18433 1 644 . 1 1 65 65 LEU HB2 H 1 1.242 0.010 . . . . . A 65 LEU HB2 . 18433 1 645 . 1 1 65 65 LEU HB3 H 1 2.103 0.008 . . . . . A 65 LEU HB3 . 18433 1 646 . 1 1 65 65 LEU HG H 1 1.278 0.012 . . . . . A 65 LEU HG . 18433 1 647 . 1 1 65 65 LEU HD11 H 1 0.436 0.006 . . . . . A 65 LEU HD11 . 18433 1 648 . 1 1 65 65 LEU HD12 H 1 0.436 0.006 . . . . . A 65 LEU HD12 . 18433 1 649 . 1 1 65 65 LEU HD13 H 1 0.436 0.006 . . . . . A 65 LEU HD13 . 18433 1 650 . 1 1 65 65 LEU HD21 H 1 0.767 0.009 . . . . . A 65 LEU HD21 . 18433 1 651 . 1 1 65 65 LEU HD22 H 1 0.767 0.009 . . . . . A 65 LEU HD22 . 18433 1 652 . 1 1 65 65 LEU HD23 H 1 0.767 0.009 . . . . . A 65 LEU HD23 . 18433 1 653 . 1 1 65 65 LEU CA C 13 58.251 0.075 . . . . . A 65 LEU CA . 18433 1 654 . 1 1 65 65 LEU CB C 13 41.490 0.081 . . . . . A 65 LEU CB . 18433 1 655 . 1 1 65 65 LEU CG C 13 25.546 0.117 . . . . . A 65 LEU CG . 18433 1 656 . 1 1 65 65 LEU CD1 C 13 25.189 0.146 . . . . . A 65 LEU CD1 . 18433 1 657 . 1 1 65 65 LEU CD2 C 13 22.880 0.093 . . . . . A 65 LEU CD2 . 18433 1 658 . 1 1 65 65 LEU N N 15 119.722 0.022 . . . . . A 65 LEU N . 18433 1 659 . 1 1 66 66 ILE H H 1 7.636 0.006 . . . . . A 66 ILE H . 18433 1 660 . 1 1 66 66 ILE HA H 1 3.398 0.009 . . . . . A 66 ILE HA . 18433 1 661 . 1 1 66 66 ILE HB H 1 2.130 0.007 . . . . . A 66 ILE HB . 18433 1 662 . 1 1 66 66 ILE HG12 H 1 0.700 0.006 . . . . . A 66 ILE HG12 . 18433 1 663 . 1 1 66 66 ILE HG13 H 1 2.028 0.008 . . . . . A 66 ILE HG13 . 18433 1 664 . 1 1 66 66 ILE HG21 H 1 0.917 0.006 . . . . . A 66 ILE HG21 . 18433 1 665 . 1 1 66 66 ILE HG22 H 1 0.917 0.006 . . . . . A 66 ILE HG22 . 18433 1 666 . 1 1 66 66 ILE HG23 H 1 0.917 0.006 . . . . . A 66 ILE HG23 . 18433 1 667 . 1 1 66 66 ILE HD11 H 1 0.818 0.008 . . . . . A 66 ILE HD11 . 18433 1 668 . 1 1 66 66 ILE HD12 H 1 0.818 0.008 . . . . . A 66 ILE HD12 . 18433 1 669 . 1 1 66 66 ILE HD13 H 1 0.818 0.008 . . . . . A 66 ILE HD13 . 18433 1 670 . 1 1 66 66 ILE CA C 13 66.198 0.070 . . . . . A 66 ILE CA . 18433 1 671 . 1 1 66 66 ILE CB C 13 37.730 0.061 . . . . . A 66 ILE CB . 18433 1 672 . 1 1 66 66 ILE CG1 C 13 30.907 0.086 . . . . . A 66 ILE CG1 . 18433 1 673 . 1 1 66 66 ILE CG2 C 13 17.841 0.083 . . . . . A 66 ILE CG2 . 18433 1 674 . 1 1 66 66 ILE CD1 C 13 14.995 0.061 . . . . . A 66 ILE CD1 . 18433 1 675 . 1 1 66 66 ILE N N 15 119.189 0.011 . . . . . A 66 ILE N . 18433 1 676 . 1 1 67 67 GLU H H 1 8.512 0.014 . . . . . A 67 GLU H . 18433 1 677 . 1 1 67 67 GLU HA H 1 3.995 0.006 . . . . . A 67 GLU HA . 18433 1 678 . 1 1 67 67 GLU HB2 H 1 2.154 0.007 . . . . . A 67 GLU HB2 . 18433 1 679 . 1 1 67 67 GLU HB3 H 1 2.229 0.012 . . . . . A 67 GLU HB3 . 18433 1 680 . 1 1 67 67 GLU HG2 H 1 2.258 0.007 . . . . . A 67 GLU HG2 . 18433 1 681 . 1 1 67 67 GLU HG3 H 1 2.453 0.007 . . . . . A 67 GLU HG3 . 18433 1 682 . 1 1 67 67 GLU CA C 13 59.595 0.033 . . . . . A 67 GLU CA . 18433 1 683 . 1 1 67 67 GLU CB C 13 29.183 0.076 . . . . . A 67 GLU CB . 18433 1 684 . 1 1 67 67 GLU CG C 13 36.451 0.039 . . . . . A 67 GLU CG . 18433 1 685 . 1 1 67 67 GLU N N 15 123.166 0.059 . . . . . A 67 GLU N . 18433 1 686 . 1 1 68 68 GLU H H 1 7.633 0.005 . . . . . A 68 GLU H . 18433 1 687 . 1 1 68 68 GLU HA H 1 4.295 0.007 . . . . . A 68 GLU HA . 18433 1 688 . 1 1 68 68 GLU HB2 H 1 1.917 0.008 . . . . . A 68 GLU HB2 . 18433 1 689 . 1 1 68 68 GLU HB3 H 1 2.260 0.012 . . . . . A 68 GLU HB3 . 18433 1 690 . 1 1 68 68 GLU HG2 H 1 2.368 0.005 . . . . . A 68 GLU HG2 . 18433 1 691 . 1 1 68 68 GLU HG3 H 1 2.368 0.005 . . . . . A 68 GLU HG3 . 18433 1 692 . 1 1 68 68 GLU CA C 13 55.778 0.065 . . . . . A 68 GLU CA . 18433 1 693 . 1 1 68 68 GLU CB C 13 29.535 0.046 . . . . . A 68 GLU CB . 18433 1 694 . 1 1 68 68 GLU CG C 13 36.125 0.045 . . . . . A 68 GLU CG . 18433 1 695 . 1 1 68 68 GLU N N 15 116.524 0.028 . . . . . A 68 GLU N . 18433 1 696 . 1 1 69 69 LYS H H 1 8.066 0.014 . . . . . A 69 LYS H . 18433 1 697 . 1 1 69 69 LYS HA H 1 3.645 0.006 . . . . . A 69 LYS HA . 18433 1 698 . 1 1 69 69 LYS HB2 H 1 2.072 0.006 . . . . . A 69 LYS HB2 . 18433 1 699 . 1 1 69 69 LYS HB3 H 1 2.146 0.003 . . . . . A 69 LYS HB3 . 18433 1 700 . 1 1 69 69 LYS HG2 H 1 1.278 0.006 . . . . . A 69 LYS HG2 . 18433 1 701 . 1 1 69 69 LYS HG3 H 1 1.442 0.007 . . . . . A 69 LYS HG3 . 18433 1 702 . 1 1 69 69 LYS HD2 H 1 1.631 0.008 . . . . . A 69 LYS HD2 . 18433 1 703 . 1 1 69 69 LYS HD3 H 1 1.727 0.003 . . . . . A 69 LYS HD3 . 18433 1 704 . 1 1 69 69 LYS HE2 H 1 2.864 0.009 . . . . . A 69 LYS HE2 . 18433 1 705 . 1 1 69 69 LYS HE3 H 1 2.923 0.005 . . . . . A 69 LYS HE3 . 18433 1 706 . 1 1 69 69 LYS CA C 13 57.369 0.063 . . . . . A 69 LYS CA . 18433 1 707 . 1 1 69 69 LYS CB C 13 29.800 0.083 . . . . . A 69 LYS CB . 18433 1 708 . 1 1 69 69 LYS CG C 13 25.940 0.038 . . . . . A 69 LYS CG . 18433 1 709 . 1 1 69 69 LYS CD C 13 29.211 0.037 . . . . . A 69 LYS CD . 18433 1 710 . 1 1 69 69 LYS CE C 13 42.232 0.140 . . . . . A 69 LYS CE . 18433 1 711 . 1 1 69 69 LYS N N 15 116.625 0.022 . . . . . A 69 LYS N . 18433 1 712 . 1 1 70 70 ASP H H 1 8.483 0.011 . . . . . A 70 ASP H . 18433 1 713 . 1 1 70 70 ASP HA H 1 5.040 0.006 . . . . . A 70 ASP HA . 18433 1 714 . 1 1 70 70 ASP HB2 H 1 2.224 0.003 . . . . . A 70 ASP HB2 . 18433 1 715 . 1 1 70 70 ASP HB3 H 1 3.035 0.009 . . . . . A 70 ASP HB3 . 18433 1 716 . 1 1 70 70 ASP CA C 13 51.396 0.064 . . . . . A 70 ASP CA . 18433 1 717 . 1 1 70 70 ASP CB C 13 38.761 0.056 . . . . . A 70 ASP CB . 18433 1 718 . 1 1 70 70 ASP N N 15 122.727 0.028 . . . . . A 70 ASP N . 18433 1 719 . 1 1 71 71 LEU H H 1 7.515 0.010 . . . . . A 71 LEU H . 18433 1 720 . 1 1 71 71 LEU HA H 1 3.881 0.006 . . . . . A 71 LEU HA . 18433 1 721 . 1 1 71 71 LEU HB2 H 1 1.430 0.005 . . . . . A 71 LEU HB2 . 18433 1 722 . 1 1 71 71 LEU HB3 H 1 1.682 0.006 . . . . . A 71 LEU HB3 . 18433 1 723 . 1 1 71 71 LEU HG H 1 1.453 0.005 . . . . . A 71 LEU HG . 18433 1 724 . 1 1 71 71 LEU HD11 H 1 0.615 0.003 . . . . . A 71 LEU HD11 . 18433 1 725 . 1 1 71 71 LEU HD12 H 1 0.615 0.003 . . . . . A 71 LEU HD12 . 18433 1 726 . 1 1 71 71 LEU HD13 H 1 0.615 0.003 . . . . . A 71 LEU HD13 . 18433 1 727 . 1 1 71 71 LEU HD21 H 1 0.609 0.007 . . . . . A 71 LEU HD21 . 18433 1 728 . 1 1 71 71 LEU HD22 H 1 0.609 0.007 . . . . . A 71 LEU HD22 . 18433 1 729 . 1 1 71 71 LEU HD23 H 1 0.609 0.007 . . . . . A 71 LEU HD23 . 18433 1 730 . 1 1 71 71 LEU CA C 13 56.512 0.044 . . . . . A 71 LEU CA . 18433 1 731 . 1 1 71 71 LEU CB C 13 40.247 0.031 . . . . . A 71 LEU CB . 18433 1 732 . 1 1 71 71 LEU CG C 13 27.620 0.047 . . . . . A 71 LEU CG . 18433 1 733 . 1 1 71 71 LEU CD1 C 13 22.442 0.069 . . . . . A 71 LEU CD1 . 18433 1 734 . 1 1 71 71 LEU CD2 C 13 24.679 0.138 . . . . . A 71 LEU CD2 . 18433 1 735 . 1 1 71 71 LEU N N 15 119.712 0.017 . . . . . A 71 LEU N . 18433 1 736 . 1 1 72 72 GLU H H 1 8.561 0.014 . . . . . A 72 GLU H . 18433 1 737 . 1 1 72 72 GLU HA H 1 4.048 0.008 . . . . . A 72 GLU HA . 18433 1 738 . 1 1 72 72 GLU HB2 H 1 1.978 0.007 . . . . . A 72 GLU HB2 . 18433 1 739 . 1 1 72 72 GLU HB3 H 1 2.071 0.005 . . . . . A 72 GLU HB3 . 18433 1 740 . 1 1 72 72 GLU HG2 H 1 2.149 0.005 . . . . . A 72 GLU HG2 . 18433 1 741 . 1 1 72 72 GLU HG3 H 1 2.270 0.009 . . . . . A 72 GLU HG3 . 18433 1 742 . 1 1 72 72 GLU CA C 13 59.506 0.066 . . . . . A 72 GLU CA . 18433 1 743 . 1 1 72 72 GLU CB C 13 29.319 0.046 . . . . . A 72 GLU CB . 18433 1 744 . 1 1 72 72 GLU CG C 13 36.475 0.049 . . . . . A 72 GLU CG . 18433 1 745 . 1 1 72 72 GLU N N 15 121.320 0.024 . . . . . A 72 GLU N . 18433 1 746 . 1 1 73 73 LYS H H 1 7.448 0.018 . . . . . A 73 LYS H . 18433 1 747 . 1 1 73 73 LYS HA H 1 3.737 0.008 . . . . . A 73 LYS HA . 18433 1 748 . 1 1 73 73 LYS HB2 H 1 1.529 0.007 . . . . . A 73 LYS HB2 . 18433 1 749 . 1 1 73 73 LYS HB3 H 1 1.768 0.004 . . . . . A 73 LYS HB3 . 18433 1 750 . 1 1 73 73 LYS HG2 H 1 1.323 0.006 . . . . . A 73 LYS HG2 . 18433 1 751 . 1 1 73 73 LYS HG3 H 1 1.323 0.006 . . . . . A 73 LYS HG3 . 18433 1 752 . 1 1 73 73 LYS HD2 H 1 1.588 0.006 . . . . . A 73 LYS HD2 . 18433 1 753 . 1 1 73 73 LYS HD3 H 1 1.782 0.004 . . . . . A 73 LYS HD3 . 18433 1 754 . 1 1 73 73 LYS HE2 H 1 3.014 0.006 . . . . . A 73 LYS HE2 . 18433 1 755 . 1 1 73 73 LYS HE3 H 1 3.039 0.007 . . . . . A 73 LYS HE3 . 18433 1 756 . 1 1 73 73 LYS CA C 13 59.508 0.084 . . . . . A 73 LYS CA . 18433 1 757 . 1 1 73 73 LYS CB C 13 32.369 0.032 . . . . . A 73 LYS CB . 18433 1 758 . 1 1 73 73 LYS CG C 13 25.479 0.058 . . . . . A 73 LYS CG . 18433 1 759 . 1 1 73 73 LYS CD C 13 28.766 0.068 . . . . . A 73 LYS CD . 18433 1 760 . 1 1 73 73 LYS CE C 13 41.379 0.051 . . . . . A 73 LYS CE . 18433 1 761 . 1 1 73 73 LYS N N 15 119.338 0.033 . . . . . A 73 LYS N . 18433 1 762 . 1 1 74 74 LEU H H 1 7.516 0.006 . . . . . A 74 LEU H . 18433 1 763 . 1 1 74 74 LEU HA H 1 3.880 0.008 . . . . . A 74 LEU HA . 18433 1 764 . 1 1 74 74 LEU HB2 H 1 1.303 0.010 . . . . . A 74 LEU HB2 . 18433 1 765 . 1 1 74 74 LEU HB3 H 1 1.945 0.010 . . . . . A 74 LEU HB3 . 18433 1 766 . 1 1 74 74 LEU HG H 1 1.563 0.010 . . . . . A 74 LEU HG . 18433 1 767 . 1 1 74 74 LEU HD11 H 1 0.846 0.007 . . . . . A 74 LEU HD11 . 18433 1 768 . 1 1 74 74 LEU HD12 H 1 0.846 0.007 . . . . . A 74 LEU HD12 . 18433 1 769 . 1 1 74 74 LEU HD13 H 1 0.846 0.007 . . . . . A 74 LEU HD13 . 18433 1 770 . 1 1 74 74 LEU HD21 H 1 0.934 0.006 . . . . . A 74 LEU HD21 . 18433 1 771 . 1 1 74 74 LEU HD22 H 1 0.934 0.006 . . . . . A 74 LEU HD22 . 18433 1 772 . 1 1 74 74 LEU HD23 H 1 0.934 0.006 . . . . . A 74 LEU HD23 . 18433 1 773 . 1 1 74 74 LEU CA C 13 57.942 0.097 . . . . . A 74 LEU CA . 18433 1 774 . 1 1 74 74 LEU CB C 13 41.496 0.089 . . . . . A 74 LEU CB . 18433 1 775 . 1 1 74 74 LEU CG C 13 26.847 0.043 . . . . . A 74 LEU CG . 18433 1 776 . 1 1 74 74 LEU CD1 C 13 26.493 0.082 . . . . . A 74 LEU CD1 . 18433 1 777 . 1 1 74 74 LEU CD2 C 13 23.382 0.048 . . . . . A 74 LEU CD2 . 18433 1 778 . 1 1 74 74 LEU N N 15 117.830 0.031 . . . . . A 74 LEU N . 18433 1 779 . 1 1 75 75 ASP H H 1 7.828 0.018 . . . . . A 75 ASP H . 18433 1 780 . 1 1 75 75 ASP HA H 1 4.242 0.008 . . . . . A 75 ASP HA . 18433 1 781 . 1 1 75 75 ASP HB2 H 1 2.704 0.008 . . . . . A 75 ASP HB2 . 18433 1 782 . 1 1 75 75 ASP HB3 H 1 2.704 0.008 . . . . . A 75 ASP HB3 . 18433 1 783 . 1 1 75 75 ASP CA C 13 57.852 0.076 . . . . . A 75 ASP CA . 18433 1 784 . 1 1 75 75 ASP CB C 13 42.323 0.054 . . . . . A 75 ASP CB . 18433 1 785 . 1 1 75 75 ASP N N 15 117.736 0.037 . . . . . A 75 ASP N . 18433 1 786 . 1 1 76 76 LEU H H 1 7.454 0.015 . . . . . A 76 LEU H . 18433 1 787 . 1 1 76 76 LEU HA H 1 3.910 0.010 . . . . . A 76 LEU HA . 18433 1 788 . 1 1 76 76 LEU HB2 H 1 0.916 0.005 . . . . . A 76 LEU HB2 . 18433 1 789 . 1 1 76 76 LEU HB3 H 1 1.597 0.006 . . . . . A 76 LEU HB3 . 18433 1 790 . 1 1 76 76 LEU HG H 1 1.731 0.007 . . . . . A 76 LEU HG . 18433 1 791 . 1 1 76 76 LEU HD11 H 1 0.548 0.006 . . . . . A 76 LEU HD11 . 18433 1 792 . 1 1 76 76 LEU HD12 H 1 0.548 0.006 . . . . . A 76 LEU HD12 . 18433 1 793 . 1 1 76 76 LEU HD13 H 1 0.548 0.006 . . . . . A 76 LEU HD13 . 18433 1 794 . 1 1 76 76 LEU HD21 H 1 0.702 0.006 . . . . . A 76 LEU HD21 . 18433 1 795 . 1 1 76 76 LEU HD22 H 1 0.702 0.006 . . . . . A 76 LEU HD22 . 18433 1 796 . 1 1 76 76 LEU HD23 H 1 0.702 0.006 . . . . . A 76 LEU HD23 . 18433 1 797 . 1 1 76 76 LEU CA C 13 57.957 0.031 . . . . . A 76 LEU CA . 18433 1 798 . 1 1 76 76 LEU CB C 13 41.827 0.040 . . . . . A 76 LEU CB . 18433 1 799 . 1 1 76 76 LEU CG C 13 26.119 0.044 . . . . . A 76 LEU CG . 18433 1 800 . 1 1 76 76 LEU CD1 C 13 25.112 0.041 . . . . . A 76 LEU CD1 . 18433 1 801 . 1 1 76 76 LEU CD2 C 13 22.446 0.045 . . . . . A 76 LEU CD2 . 18433 1 802 . 1 1 76 76 LEU N N 15 116.254 0.120 . . . . . A 76 LEU N . 18433 1 803 . 1 1 77 77 VAL H H 1 8.626 0.010 . . . . . A 77 VAL H . 18433 1 804 . 1 1 77 77 VAL HA H 1 3.964 0.009 . . . . . A 77 VAL HA . 18433 1 805 . 1 1 77 77 VAL HB H 1 2.466 0.007 . . . . . A 77 VAL HB . 18433 1 806 . 1 1 77 77 VAL HG11 H 1 1.231 0.013 . . . . . A 77 VAL HG11 . 18433 1 807 . 1 1 77 77 VAL HG12 H 1 1.231 0.013 . . . . . A 77 VAL HG12 . 18433 1 808 . 1 1 77 77 VAL HG13 H 1 1.231 0.013 . . . . . A 77 VAL HG13 . 18433 1 809 . 1 1 77 77 VAL HG21 H 1 1.317 0.006 . . . . . A 77 VAL HG21 . 18433 1 810 . 1 1 77 77 VAL HG22 H 1 1.317 0.006 . . . . . A 77 VAL HG22 . 18433 1 811 . 1 1 77 77 VAL HG23 H 1 1.317 0.006 . . . . . A 77 VAL HG23 . 18433 1 812 . 1 1 77 77 VAL CA C 13 66.879 0.030 . . . . . A 77 VAL CA . 18433 1 813 . 1 1 77 77 VAL CB C 13 32.019 0.075 . . . . . A 77 VAL CB . 18433 1 814 . 1 1 77 77 VAL CG1 C 13 21.225 0.076 . . . . . A 77 VAL CG1 . 18433 1 815 . 1 1 77 77 VAL CG2 C 13 24.255 0.099 . . . . . A 77 VAL CG2 . 18433 1 816 . 1 1 77 77 VAL N N 15 120.653 0.040 . . . . . A 77 VAL N . 18433 1 817 . 1 1 78 78 ILE H H 1 8.755 0.012 . . . . . A 78 ILE H . 18433 1 818 . 1 1 78 78 ILE HA H 1 3.986 0.008 . . . . . A 78 ILE HA . 18433 1 819 . 1 1 78 78 ILE HB H 1 2.296 0.006 . . . . . A 78 ILE HB . 18433 1 820 . 1 1 78 78 ILE HG12 H 1 1.524 0.008 . . . . . A 78 ILE HG12 . 18433 1 821 . 1 1 78 78 ILE HG13 H 1 1.629 0.007 . . . . . A 78 ILE HG13 . 18433 1 822 . 1 1 78 78 ILE HG21 H 1 1.056 0.006 . . . . . A 78 ILE HG21 . 18433 1 823 . 1 1 78 78 ILE HG22 H 1 1.056 0.006 . . . . . A 78 ILE HG22 . 18433 1 824 . 1 1 78 78 ILE HG23 H 1 1.056 0.006 . . . . . A 78 ILE HG23 . 18433 1 825 . 1 1 78 78 ILE HD11 H 1 0.816 0.005 . . . . . A 78 ILE HD11 . 18433 1 826 . 1 1 78 78 ILE HD12 H 1 0.816 0.005 . . . . . A 78 ILE HD12 . 18433 1 827 . 1 1 78 78 ILE HD13 H 1 0.816 0.005 . . . . . A 78 ILE HD13 . 18433 1 828 . 1 1 78 78 ILE CA C 13 63.840 0.042 . . . . . A 78 ILE CA . 18433 1 829 . 1 1 78 78 ILE CB C 13 35.672 0.070 . . . . . A 78 ILE CB . 18433 1 830 . 1 1 78 78 ILE CG1 C 13 28.041 0.206 . . . . . A 78 ILE CG1 . 18433 1 831 . 1 1 78 78 ILE CG2 C 13 17.680 0.047 . . . . . A 78 ILE CG2 . 18433 1 832 . 1 1 78 78 ILE CD1 C 13 10.566 0.072 . . . . . A 78 ILE CD1 . 18433 1 833 . 1 1 78 78 ILE N N 15 122.189 0.037 . . . . . A 78 ILE N . 18433 1 834 . 1 1 79 79 LYS H H 1 8.413 0.003 . . . . . A 79 LYS H . 18433 1 835 . 1 1 79 79 LYS HA H 1 3.881 0.006 . . . . . A 79 LYS HA . 18433 1 836 . 1 1 79 79 LYS HB2 H 1 1.864 0.009 . . . . . A 79 LYS HB2 . 18433 1 837 . 1 1 79 79 LYS HB3 H 1 1.967 0.007 . . . . . A 79 LYS HB3 . 18433 1 838 . 1 1 79 79 LYS HG2 H 1 1.457 0.005 . . . . . A 79 LYS HG2 . 18433 1 839 . 1 1 79 79 LYS HG3 H 1 1.733 0.006 . . . . . A 79 LYS HG3 . 18433 1 840 . 1 1 79 79 LYS HD2 H 1 1.625 0.012 . . . . . A 79 LYS HD2 . 18433 1 841 . 1 1 79 79 LYS HD3 H 1 1.625 0.012 . . . . . A 79 LYS HD3 . 18433 1 842 . 1 1 79 79 LYS HE2 H 1 2.984 0.005 . . . . . A 79 LYS HE2 . 18433 1 843 . 1 1 79 79 LYS HE3 H 1 2.984 0.005 . . . . . A 79 LYS HE3 . 18433 1 844 . 1 1 79 79 LYS CA C 13 60.438 0.129 . . . . . A 79 LYS CA . 18433 1 845 . 1 1 79 79 LYS CB C 13 32.622 0.051 . . . . . A 79 LYS CB . 18433 1 846 . 1 1 79 79 LYS CG C 13 27.133 0.084 . . . . . A 79 LYS CG . 18433 1 847 . 1 1 79 79 LYS CD C 13 29.120 0.077 . . . . . A 79 LYS CD . 18433 1 848 . 1 1 79 79 LYS CE C 13 41.901 0.045 . . . . . A 79 LYS CE . 18433 1 849 . 1 1 79 79 LYS N N 15 119.030 0.050 . . . . . A 79 LYS N . 18433 1 850 . 1 1 80 80 TYR H H 1 8.205 0.015 . . . . . A 80 TYR H . 18433 1 851 . 1 1 80 80 TYR HA H 1 4.308 0.006 . . . . . A 80 TYR HA . 18433 1 852 . 1 1 80 80 TYR HB2 H 1 3.124 0.008 . . . . . A 80 TYR HB2 . 18433 1 853 . 1 1 80 80 TYR HB3 H 1 3.488 0.005 . . . . . A 80 TYR HB3 . 18433 1 854 . 1 1 80 80 TYR HD1 H 1 7.062 0.010 . . . . . A 80 TYR HD1 . 18433 1 855 . 1 1 80 80 TYR HD2 H 1 7.062 0.010 . . . . . A 80 TYR HD2 . 18433 1 856 . 1 1 80 80 TYR HE1 H 1 6.871 0.010 . . . . . A 80 TYR HE1 . 18433 1 857 . 1 1 80 80 TYR HE2 H 1 6.871 0.010 . . . . . A 80 TYR HE2 . 18433 1 858 . 1 1 80 80 TYR CA C 13 62.004 0.081 . . . . . A 80 TYR CA . 18433 1 859 . 1 1 80 80 TYR CB C 13 39.011 0.041 . . . . . A 80 TYR CB . 18433 1 860 . 1 1 80 80 TYR CD1 C 13 131.960 0.049 . . . . . A 80 TYR CD1 . 18433 1 861 . 1 1 80 80 TYR CE1 C 13 119.378 0.103 . . . . . A 80 TYR CE1 . 18433 1 862 . 1 1 80 80 TYR N N 15 121.226 0.023 . . . . . A 80 TYR N . 18433 1 863 . 1 1 81 81 MET H H 1 8.578 0.016 . . . . . A 81 MET H . 18433 1 864 . 1 1 81 81 MET HA H 1 3.711 0.007 . . . . . A 81 MET HA . 18433 1 865 . 1 1 81 81 MET HB2 H 1 2.403 0.005 . . . . . A 81 MET HB2 . 18433 1 866 . 1 1 81 81 MET HB3 H 1 2.703 0.009 . . . . . A 81 MET HB3 . 18433 1 867 . 1 1 81 81 MET HG2 H 1 2.496 0.010 . . . . . A 81 MET HG2 . 18433 1 868 . 1 1 81 81 MET HG3 H 1 3.283 0.006 . . . . . A 81 MET HG3 . 18433 1 869 . 1 1 81 81 MET HE1 H 1 2.152 0.007 . . . . . A 81 MET HE1 . 18433 1 870 . 1 1 81 81 MET HE2 H 1 2.152 0.007 . . . . . A 81 MET HE2 . 18433 1 871 . 1 1 81 81 MET HE3 H 1 2.152 0.007 . . . . . A 81 MET HE3 . 18433 1 872 . 1 1 81 81 MET CA C 13 60.733 0.080 . . . . . A 81 MET CA . 18433 1 873 . 1 1 81 81 MET CB C 13 33.894 0.042 . . . . . A 81 MET CB . 18433 1 874 . 1 1 81 81 MET CG C 13 33.863 0.054 . . . . . A 81 MET CG . 18433 1 875 . 1 1 81 81 MET CE C 13 16.993 0.063 . . . . . A 81 MET CE . 18433 1 876 . 1 1 81 81 MET N N 15 116.428 0.028 . . . . . A 81 MET N . 18433 1 877 . 1 1 82 82 LYS H H 1 8.594 0.012 . . . . . A 82 LYS H . 18433 1 878 . 1 1 82 82 LYS HA H 1 2.693 0.010 . . . . . A 82 LYS HA . 18433 1 879 . 1 1 82 82 LYS HB2 H 1 1.679 0.006 . . . . . A 82 LYS HB2 . 18433 1 880 . 1 1 82 82 LYS HB3 H 1 1.679 0.006 . . . . . A 82 LYS HB3 . 18433 1 881 . 1 1 82 82 LYS HG2 H 1 0.654 0.011 . . . . . A 82 LYS HG2 . 18433 1 882 . 1 1 82 82 LYS HG3 H 1 0.962 0.008 . . . . . A 82 LYS HG3 . 18433 1 883 . 1 1 82 82 LYS HD2 H 1 1.501 0.009 . . . . . A 82 LYS HD2 . 18433 1 884 . 1 1 82 82 LYS HD3 H 1 1.501 0.009 . . . . . A 82 LYS HD3 . 18433 1 885 . 1 1 82 82 LYS HE2 H 1 2.886 0.007 . . . . . A 82 LYS HE2 . 18433 1 886 . 1 1 82 82 LYS HE3 H 1 2.886 0.007 . . . . . A 82 LYS HE3 . 18433 1 887 . 1 1 82 82 LYS CA C 13 59.983 0.053 . . . . . A 82 LYS CA . 18433 1 888 . 1 1 82 82 LYS CB C 13 32.791 0.143 . . . . . A 82 LYS CB . 18433 1 889 . 1 1 82 82 LYS CG C 13 24.570 0.106 . . . . . A 82 LYS CG . 18433 1 890 . 1 1 82 82 LYS CD C 13 29.514 0.024 . . . . . A 82 LYS CD . 18433 1 891 . 1 1 82 82 LYS CE C 13 41.932 0.066 . . . . . A 82 LYS CE . 18433 1 892 . 1 1 82 82 LYS N N 15 119.778 0.068 . . . . . A 82 LYS N . 18433 1 893 . 1 1 83 83 ARG H H 1 7.145 0.018 . . . . . A 83 ARG H . 18433 1 894 . 1 1 83 83 ARG HA H 1 3.854 0.005 . . . . . A 83 ARG HA . 18433 1 895 . 1 1 83 83 ARG HB2 H 1 1.803 0.006 . . . . . A 83 ARG HB2 . 18433 1 896 . 1 1 83 83 ARG HB3 H 1 1.803 0.006 . . . . . A 83 ARG HB3 . 18433 1 897 . 1 1 83 83 ARG HG2 H 1 1.467 0.009 . . . . . A 83 ARG HG2 . 18433 1 898 . 1 1 83 83 ARG HG3 H 1 1.603 0.008 . . . . . A 83 ARG HG3 . 18433 1 899 . 1 1 83 83 ARG HD2 H 1 3.139 0.011 . . . . . A 83 ARG HD2 . 18433 1 900 . 1 1 83 83 ARG HD3 H 1 3.139 0.011 . . . . . A 83 ARG HD3 . 18433 1 901 . 1 1 83 83 ARG CA C 13 58.481 0.073 . . . . . A 83 ARG CA . 18433 1 902 . 1 1 83 83 ARG CB C 13 29.602 0.062 . . . . . A 83 ARG CB . 18433 1 903 . 1 1 83 83 ARG CG C 13 27.039 0.062 . . . . . A 83 ARG CG . 18433 1 904 . 1 1 83 83 ARG CD C 13 43.382 0.068 . . . . . A 83 ARG CD . 18433 1 905 . 1 1 83 83 ARG N N 15 116.474 0.074 . . . . . A 83 ARG N . 18433 1 906 . 1 1 84 84 LEU H H 1 7.284 0.018 . . . . . A 84 LEU H . 18433 1 907 . 1 1 84 84 LEU HA H 1 3.828 0.007 . . . . . A 84 LEU HA . 18433 1 908 . 1 1 84 84 LEU HB2 H 1 1.038 0.006 . . . . . A 84 LEU HB2 . 18433 1 909 . 1 1 84 84 LEU HB3 H 1 1.370 0.005 . . . . . A 84 LEU HB3 . 18433 1 910 . 1 1 84 84 LEU HG H 1 1.176 0.007 . . . . . A 84 LEU HG . 18433 1 911 . 1 1 84 84 LEU HD11 H 1 0.448 0.015 . . . . . A 84 LEU HD11 . 18433 1 912 . 1 1 84 84 LEU HD12 H 1 0.448 0.015 . . . . . A 84 LEU HD12 . 18433 1 913 . 1 1 84 84 LEU HD13 H 1 0.448 0.015 . . . . . A 84 LEU HD13 . 18433 1 914 . 1 1 84 84 LEU HD21 H 1 0.522 0.005 . . . . . A 84 LEU HD21 . 18433 1 915 . 1 1 84 84 LEU HD22 H 1 0.522 0.005 . . . . . A 84 LEU HD22 . 18433 1 916 . 1 1 84 84 LEU HD23 H 1 0.522 0.005 . . . . . A 84 LEU HD23 . 18433 1 917 . 1 1 84 84 LEU CA C 13 56.934 0.077 . . . . . A 84 LEU CA . 18433 1 918 . 1 1 84 84 LEU CB C 13 43.039 0.079 . . . . . A 84 LEU CB . 18433 1 919 . 1 1 84 84 LEU CG C 13 26.938 0.054 . . . . . A 84 LEU CG . 18433 1 920 . 1 1 84 84 LEU CD1 C 13 25.724 0.046 . . . . . A 84 LEU CD1 . 18433 1 921 . 1 1 84 84 LEU CD2 C 13 22.609 0.053 . . . . . A 84 LEU CD2 . 18433 1 922 . 1 1 84 84 LEU N N 15 116.576 0.073 . . . . . A 84 LEU N . 18433 1 923 . 1 1 85 85 MET H H 1 8.683 0.007 . . . . . A 85 MET H . 18433 1 924 . 1 1 85 85 MET HA H 1 3.756 0.015 . . . . . A 85 MET HA . 18433 1 925 . 1 1 85 85 MET HB2 H 1 1.928 0.007 . . . . . A 85 MET HB2 . 18433 1 926 . 1 1 85 85 MET HB3 H 1 2.323 0.008 . . . . . A 85 MET HB3 . 18433 1 927 . 1 1 85 85 MET HG2 H 1 2.346 0.008 . . . . . A 85 MET HG2 . 18433 1 928 . 1 1 85 85 MET HG3 H 1 2.797 0.011 . . . . . A 85 MET HG3 . 18433 1 929 . 1 1 85 85 MET HE1 H 1 2.304 0.007 . . . . . A 85 MET HE1 . 18433 1 930 . 1 1 85 85 MET HE2 H 1 2.304 0.007 . . . . . A 85 MET HE2 . 18433 1 931 . 1 1 85 85 MET HE3 H 1 2.304 0.007 . . . . . A 85 MET HE3 . 18433 1 932 . 1 1 85 85 MET CA C 13 59.260 0.136 . . . . . A 85 MET CA . 18433 1 933 . 1 1 85 85 MET CB C 13 32.487 0.116 . . . . . A 85 MET CB . 18433 1 934 . 1 1 85 85 MET CG C 13 34.975 0.129 . . . . . A 85 MET CG . 18433 1 935 . 1 1 85 85 MET CE C 13 19.015 0.036 . . . . . A 85 MET CE . 18433 1 936 . 1 1 85 85 MET N N 15 115.841 0.043 . . . . . A 85 MET N . 18433 1 937 . 1 1 86 86 GLN H H 1 7.513 0.012 . . . . . A 86 GLN H . 18433 1 938 . 1 1 86 86 GLN HA H 1 4.361 0.007 . . . . . A 86 GLN HA . 18433 1 939 . 1 1 86 86 GLN HB2 H 1 1.935 0.003 . . . . . A 86 GLN HB2 . 18433 1 940 . 1 1 86 86 GLN HB3 H 1 2.007 0.007 . . . . . A 86 GLN HB3 . 18433 1 941 . 1 1 86 86 GLN HG2 H 1 2.251 0.006 . . . . . A 86 GLN HG2 . 18433 1 942 . 1 1 86 86 GLN HG3 H 1 2.251 0.006 . . . . . A 86 GLN HG3 . 18433 1 943 . 1 1 86 86 GLN HE21 H 1 6.853 0.005 . . . . . A 86 GLN HE21 . 18433 1 944 . 1 1 86 86 GLN HE22 H 1 7.618 0.004 . . . . . A 86 GLN HE22 . 18433 1 945 . 1 1 86 86 GLN CA C 13 56.857 0.030 . . . . . A 86 GLN CA . 18433 1 946 . 1 1 86 86 GLN CB C 13 27.630 0.068 . . . . . A 86 GLN CB . 18433 1 947 . 1 1 86 86 GLN CG C 13 34.302 0.087 . . . . . A 86 GLN CG . 18433 1 948 . 1 1 86 86 GLN N N 15 114.640 0.034 . . . . . A 86 GLN N . 18433 1 949 . 1 1 86 86 GLN NE2 N 15 112.319 0.011 . . . . . A 86 GLN NE2 . 18433 1 950 . 1 1 87 87 GLN H H 1 7.277 0.016 . . . . . A 87 GLN H . 18433 1 951 . 1 1 87 87 GLN HA H 1 4.222 0.007 . . . . . A 87 GLN HA . 18433 1 952 . 1 1 87 87 GLN HB2 H 1 2.029 0.013 . . . . . A 87 GLN HB2 . 18433 1 953 . 1 1 87 87 GLN HB3 H 1 2.114 0.017 . . . . . A 87 GLN HB3 . 18433 1 954 . 1 1 87 87 GLN HG2 H 1 2.342 0.006 . . . . . A 87 GLN HG2 . 18433 1 955 . 1 1 87 87 GLN HG3 H 1 2.342 0.006 . . . . . A 87 GLN HG3 . 18433 1 956 . 1 1 87 87 GLN HE21 H 1 6.650 0.006 . . . . . A 87 GLN HE21 . 18433 1 957 . 1 1 87 87 GLN HE22 H 1 7.323 0.006 . . . . . A 87 GLN HE22 . 18433 1 958 . 1 1 87 87 GLN CA C 13 56.334 0.075 . . . . . A 87 GLN CA . 18433 1 959 . 1 1 87 87 GLN CB C 13 29.139 0.065 . . . . . A 87 GLN CB . 18433 1 960 . 1 1 87 87 GLN CG C 13 33.998 0.128 . . . . . A 87 GLN CG . 18433 1 961 . 1 1 87 87 GLN N N 15 117.352 0.047 . . . . . A 87 GLN N . 18433 1 962 . 1 1 87 87 GLN NE2 N 15 111.001 0.006 . . . . . A 87 GLN NE2 . 18433 1 963 . 1 1 88 88 SER H H 1 7.482 0.017 . . . . . A 88 SER H . 18433 1 964 . 1 1 88 88 SER HA H 1 4.431 0.014 . . . . . A 88 SER HA . 18433 1 965 . 1 1 88 88 SER HB2 H 1 3.843 0.008 . . . . . A 88 SER HB2 . 18433 1 966 . 1 1 88 88 SER HB3 H 1 3.843 0.008 . . . . . A 88 SER HB3 . 18433 1 967 . 1 1 88 88 SER CA C 13 58.372 0.182 . . . . . A 88 SER CA . 18433 1 968 . 1 1 88 88 SER CB C 13 63.525 0.114 . . . . . A 88 SER CB . 18433 1 969 . 1 1 88 88 SER N N 15 113.778 0.045 . . . . . A 88 SER N . 18433 1 970 . 1 1 89 89 VAL H H 1 8.188 0.006 . . . . . A 89 VAL H . 18433 1 971 . 1 1 89 89 VAL HA H 1 4.163 0.008 . . . . . A 89 VAL HA . 18433 1 972 . 1 1 89 89 VAL HB H 1 2.239 0.008 . . . . . A 89 VAL HB . 18433 1 973 . 1 1 89 89 VAL HG11 H 1 0.959 0.007 . . . . . A 89 VAL HG11 . 18433 1 974 . 1 1 89 89 VAL HG12 H 1 0.959 0.007 . . . . . A 89 VAL HG12 . 18433 1 975 . 1 1 89 89 VAL HG13 H 1 0.959 0.007 . . . . . A 89 VAL HG13 . 18433 1 976 . 1 1 89 89 VAL HG21 H 1 0.976 0.005 . . . . . A 89 VAL HG21 . 18433 1 977 . 1 1 89 89 VAL HG22 H 1 0.976 0.005 . . . . . A 89 VAL HG22 . 18433 1 978 . 1 1 89 89 VAL HG23 H 1 0.976 0.005 . . . . . A 89 VAL HG23 . 18433 1 979 . 1 1 89 89 VAL CA C 13 62.661 0.057 . . . . . A 89 VAL CA . 18433 1 980 . 1 1 89 89 VAL CB C 13 31.972 0.037 . . . . . A 89 VAL CB . 18433 1 981 . 1 1 89 89 VAL CG1 C 13 19.794 0.047 . . . . . A 89 VAL CG1 . 18433 1 982 . 1 1 89 89 VAL CG2 C 13 21.273 0.075 . . . . . A 89 VAL CG2 . 18433 1 983 . 1 1 89 89 VAL N N 15 120.934 0.030 . . . . . A 89 VAL N . 18433 1 984 . 1 1 90 90 GLU H H 1 8.411 0.003 . . . . . A 90 GLU H . 18433 1 985 . 1 1 90 90 GLU HA H 1 4.441 0.007 . . . . . A 90 GLU HA . 18433 1 986 . 1 1 90 90 GLU HB2 H 1 2.102 0.007 . . . . . A 90 GLU HB2 . 18433 1 987 . 1 1 90 90 GLU HB3 H 1 2.201 0.010 . . . . . A 90 GLU HB3 . 18433 1 988 . 1 1 90 90 GLU HG2 H 1 2.339 0.014 . . . . . A 90 GLU HG2 . 18433 1 989 . 1 1 90 90 GLU HG3 H 1 2.339 0.014 . . . . . A 90 GLU HG3 . 18433 1 990 . 1 1 90 90 GLU CA C 13 55.945 0.063 . . . . . A 90 GLU CA . 18433 1 991 . 1 1 90 90 GLU CB C 13 29.607 0.039 . . . . . A 90 GLU CB . 18433 1 992 . 1 1 90 90 GLU CG C 13 35.942 0.064 . . . . . A 90 GLU CG . 18433 1 993 . 1 1 90 90 GLU N N 15 120.714 0.082 . . . . . A 90 GLU N . 18433 1 994 . 1 1 91 91 SER HA H 1 4.451 0.004 . . . . . A 91 SER HA . 18433 1 995 . 1 1 91 91 SER HB2 H 1 3.972 0.010 . . . . . A 91 SER HB2 . 18433 1 996 . 1 1 91 91 SER HB3 H 1 4.100 0.004 . . . . . A 91 SER HB3 . 18433 1 997 . 1 1 91 91 SER CA C 13 59.681 0.033 . . . . . A 91 SER CA . 18433 1 998 . 1 1 91 91 SER CB C 13 63.893 0.081 . . . . . A 91 SER CB . 18433 1 999 . 1 1 92 92 VAL HA H 1 4.012 0.009 . . . . . A 92 VAL HA . 18433 1 1000 . 1 1 92 92 VAL HB H 1 1.995 0.003 . . . . . A 92 VAL HB . 18433 1 1001 . 1 1 92 92 VAL HG11 H 1 0.674 0.015 . . . . . A 92 VAL HG11 . 18433 1 1002 . 1 1 92 92 VAL HG12 H 1 0.674 0.015 . . . . . A 92 VAL HG12 . 18433 1 1003 . 1 1 92 92 VAL HG13 H 1 0.674 0.015 . . . . . A 92 VAL HG13 . 18433 1 1004 . 1 1 92 92 VAL HG21 H 1 0.719 0.011 . . . . . A 92 VAL HG21 . 18433 1 1005 . 1 1 92 92 VAL HG22 H 1 0.719 0.011 . . . . . A 92 VAL HG22 . 18433 1 1006 . 1 1 92 92 VAL HG23 H 1 0.719 0.011 . . . . . A 92 VAL HG23 . 18433 1 1007 . 1 1 92 92 VAL CA C 13 64.738 0.255 . . . . . A 92 VAL CA . 18433 1 1008 . 1 1 92 92 VAL CB C 13 31.013 0.051 . . . . . A 92 VAL CB . 18433 1 1009 . 1 1 92 92 VAL CG1 C 13 20.739 0.140 . . . . . A 92 VAL CG1 . 18433 1 1010 . 1 1 92 92 VAL CG2 C 13 20.556 0.087 . . . . . A 92 VAL CG2 . 18433 1 1011 . 1 1 93 93 TRP H H 1 7.551 0.019 . . . . . A 93 TRP H . 18433 1 1012 . 1 1 93 93 TRP HA H 1 4.499 0.013 . . . . . A 93 TRP HA . 18433 1 1013 . 1 1 93 93 TRP HB2 H 1 3.189 0.007 . . . . . A 93 TRP HB2 . 18433 1 1014 . 1 1 93 93 TRP HB3 H 1 3.273 0.007 . . . . . A 93 TRP HB3 . 18433 1 1015 . 1 1 93 93 TRP HD1 H 1 7.263 0.007 . . . . . A 93 TRP HD1 . 18433 1 1016 . 1 1 93 93 TRP HE1 H 1 9.536 0.009 . . . . . A 93 TRP HE1 . 18433 1 1017 . 1 1 93 93 TRP HE3 H 1 7.295 0.006 . . . . . A 93 TRP HE3 . 18433 1 1018 . 1 1 93 93 TRP HZ2 H 1 7.085 0.008 . . . . . A 93 TRP HZ2 . 18433 1 1019 . 1 1 93 93 TRP HZ3 H 1 5.244 0.006 . . . . . A 93 TRP HZ3 . 18433 1 1020 . 1 1 93 93 TRP HH2 H 1 4.372 0.005 . . . . . A 93 TRP HH2 . 18433 1 1021 . 1 1 93 93 TRP CA C 13 59.676 0.107 . . . . . A 93 TRP CA . 18433 1 1022 . 1 1 93 93 TRP CB C 13 29.857 0.137 . . . . . A 93 TRP CB . 18433 1 1023 . 1 1 93 93 TRP CD1 C 13 126.228 0.107 . . . . . A 93 TRP CD1 . 18433 1 1024 . 1 1 93 93 TRP CE3 C 13 118.419 0.039 . . . . . A 93 TRP CE3 . 18433 1 1025 . 1 1 93 93 TRP CZ2 C 13 116.283 0.127 . . . . . A 93 TRP CZ2 . 18433 1 1026 . 1 1 93 93 TRP CZ3 C 13 121.471 0.056 . . . . . A 93 TRP CZ3 . 18433 1 1027 . 1 1 93 93 TRP CH2 C 13 124.035 0.057 . . . . . A 93 TRP CH2 . 18433 1 1028 . 1 1 93 93 TRP N N 15 121.614 0.015 . . . . . A 93 TRP N . 18433 1 1029 . 1 1 93 93 TRP NE1 N 15 127.915 0.012 . . . . . A 93 TRP NE1 . 18433 1 1030 . 1 1 94 94 ASN H H 1 7.794 0.013 . . . . . A 94 ASN H . 18433 1 1031 . 1 1 94 94 ASN HA H 1 4.395 0.007 . . . . . A 94 ASN HA . 18433 1 1032 . 1 1 94 94 ASN HB2 H 1 2.998 0.007 . . . . . A 94 ASN HB2 . 18433 1 1033 . 1 1 94 94 ASN HB3 H 1 2.998 0.007 . . . . . A 94 ASN HB3 . 18433 1 1034 . 1 1 94 94 ASN HD21 H 1 7.124 0.006 . . . . . A 94 ASN HD21 . 18433 1 1035 . 1 1 94 94 ASN HD22 H 1 7.545 0.006 . . . . . A 94 ASN HD22 . 18433 1 1036 . 1 1 94 94 ASN CA C 13 57.238 0.035 . . . . . A 94 ASN CA . 18433 1 1037 . 1 1 94 94 ASN CB C 13 38.747 0.178 . . . . . A 94 ASN CB . 18433 1 1038 . 1 1 94 94 ASN N N 15 119.013 0.056 . . . . . A 94 ASN N . 18433 1 1039 . 1 1 94 94 ASN ND2 N 15 112.978 0.004 . . . . . A 94 ASN ND2 . 18433 1 1040 . 1 1 95 95 MET H H 1 7.751 0.012 . . . . . A 95 MET H . 18433 1 1041 . 1 1 95 95 MET HA H 1 4.346 0.009 . . . . . A 95 MET HA . 18433 1 1042 . 1 1 95 95 MET HB2 H 1 2.179 0.008 . . . . . A 95 MET HB2 . 18433 1 1043 . 1 1 95 95 MET HB3 H 1 2.179 0.008 . . . . . A 95 MET HB3 . 18433 1 1044 . 1 1 95 95 MET HG2 H 1 2.648 0.009 . . . . . A 95 MET HG2 . 18433 1 1045 . 1 1 95 95 MET HG3 H 1 2.750 0.008 . . . . . A 95 MET HG3 . 18433 1 1046 . 1 1 95 95 MET HE1 H 1 2.085 0.005 . . . . . A 95 MET HE1 . 18433 1 1047 . 1 1 95 95 MET HE2 H 1 2.085 0.005 . . . . . A 95 MET HE2 . 18433 1 1048 . 1 1 95 95 MET HE3 H 1 2.085 0.005 . . . . . A 95 MET HE3 . 18433 1 1049 . 1 1 95 95 MET CA C 13 58.445 0.081 . . . . . A 95 MET CA . 18433 1 1050 . 1 1 95 95 MET CB C 13 32.436 0.108 . . . . . A 95 MET CB . 18433 1 1051 . 1 1 95 95 MET CG C 13 32.273 0.054 . . . . . A 95 MET CG . 18433 1 1052 . 1 1 95 95 MET CE C 13 17.329 0.019 . . . . . A 95 MET CE . 18433 1 1053 . 1 1 95 95 MET N N 15 117.158 0.050 . . . . . A 95 MET N . 18433 1 1054 . 1 1 96 96 ALA H H 1 7.920 0.011 . . . . . A 96 ALA H . 18433 1 1055 . 1 1 96 96 ALA HA H 1 4.207 0.012 . . . . . A 96 ALA HA . 18433 1 1056 . 1 1 96 96 ALA HB1 H 1 1.552 0.012 . . . . . A 96 ALA HB1 . 18433 1 1057 . 1 1 96 96 ALA HB2 H 1 1.552 0.012 . . . . . A 96 ALA HB2 . 18433 1 1058 . 1 1 96 96 ALA HB3 H 1 1.552 0.012 . . . . . A 96 ALA HB3 . 18433 1 1059 . 1 1 96 96 ALA CA C 13 55.445 0.104 . . . . . A 96 ALA CA . 18433 1 1060 . 1 1 96 96 ALA CB C 13 17.505 0.068 . . . . . A 96 ALA CB . 18433 1 1061 . 1 1 96 96 ALA N N 15 123.406 0.005 . . . . . A 96 ALA N . 18433 1 1062 . 1 1 97 97 PHE H H 1 8.431 0.007 . . . . . A 97 PHE H . 18433 1 1063 . 1 1 97 97 PHE HA H 1 4.204 0.007 . . . . . A 97 PHE HA . 18433 1 1064 . 1 1 97 97 PHE HB2 H 1 3.187 0.007 . . . . . A 97 PHE HB2 . 18433 1 1065 . 1 1 97 97 PHE HB3 H 1 3.592 0.007 . . . . . A 97 PHE HB3 . 18433 1 1066 . 1 1 97 97 PHE HD1 H 1 7.467 0.010 . . . . . A 97 PHE HD1 . 18433 1 1067 . 1 1 97 97 PHE HD2 H 1 7.467 0.010 . . . . . A 97 PHE HD2 . 18433 1 1068 . 1 1 97 97 PHE HE1 H 1 7.392 0.005 . . . . . A 97 PHE HE1 . 18433 1 1069 . 1 1 97 97 PHE HE2 H 1 7.392 0.005 . . . . . A 97 PHE HE2 . 18433 1 1070 . 1 1 97 97 PHE HZ H 1 7.093 0.009 . . . . . A 97 PHE HZ . 18433 1 1071 . 1 1 97 97 PHE CA C 13 62.853 0.077 . . . . . A 97 PHE CA . 18433 1 1072 . 1 1 97 97 PHE CB C 13 38.147 0.044 . . . . . A 97 PHE CB . 18433 1 1073 . 1 1 97 97 PHE CD2 C 13 131.735 0.075 . . . . . A 97 PHE CD2 . 18433 1 1074 . 1 1 97 97 PHE CE2 C 13 130.847 0.070 . . . . . A 97 PHE CE2 . 18433 1 1075 . 1 1 97 97 PHE CZ C 13 129.506 0.006 . . . . . A 97 PHE CZ . 18433 1 1076 . 1 1 97 97 PHE N N 15 117.830 0.031 . . . . . A 97 PHE N . 18433 1 1077 . 1 1 98 98 ASP H H 1 7.805 0.010 . . . . . A 98 ASP H . 18433 1 1078 . 1 1 98 98 ASP HA H 1 4.248 0.008 . . . . . A 98 ASP HA . 18433 1 1079 . 1 1 98 98 ASP HB2 H 1 2.744 0.015 . . . . . A 98 ASP HB2 . 18433 1 1080 . 1 1 98 98 ASP HB3 H 1 2.804 0.008 . . . . . A 98 ASP HB3 . 18433 1 1081 . 1 1 98 98 ASP CA C 13 57.702 0.111 . . . . . A 98 ASP CA . 18433 1 1082 . 1 1 98 98 ASP CB C 13 40.400 0.092 . . . . . A 98 ASP CB . 18433 1 1083 . 1 1 98 98 ASP N N 15 118.570 0.058 . . . . . A 98 ASP N . 18433 1 1084 . 1 1 99 99 PHE H H 1 7.920 0.015 . . . . . A 99 PHE H . 18433 1 1085 . 1 1 99 99 PHE HA H 1 4.294 0.014 . . . . . A 99 PHE HA . 18433 1 1086 . 1 1 99 99 PHE HB2 H 1 3.268 0.013 . . . . . A 99 PHE HB2 . 18433 1 1087 . 1 1 99 99 PHE HB3 H 1 3.356 0.020 . . . . . A 99 PHE HB3 . 18433 1 1088 . 1 1 99 99 PHE HD1 H 1 7.170 0.005 . . . . . A 99 PHE HD1 . 18433 1 1089 . 1 1 99 99 PHE HD2 H 1 7.170 0.005 . . . . . A 99 PHE HD2 . 18433 1 1090 . 1 1 99 99 PHE HE1 H 1 7.279 0.005 . . . . . A 99 PHE HE1 . 18433 1 1091 . 1 1 99 99 PHE HE2 H 1 7.279 0.005 . . . . . A 99 PHE HE2 . 18433 1 1092 . 1 1 99 99 PHE HZ H 1 7.358 0.003 . . . . . A 99 PHE HZ . 18433 1 1093 . 1 1 99 99 PHE CA C 13 61.183 0.144 . . . . . A 99 PHE CA . 18433 1 1094 . 1 1 99 99 PHE CB C 13 39.482 0.159 . . . . . A 99 PHE CB . 18433 1 1095 . 1 1 99 99 PHE CD2 C 13 132.200 0.080 . . . . . A 99 PHE CD2 . 18433 1 1096 . 1 1 99 99 PHE CE2 C 13 131.394 0.116 . . . . . A 99 PHE CE2 . 18433 1 1097 . 1 1 99 99 PHE CZ C 13 130.000 0.001 . . . . . A 99 PHE CZ . 18433 1 1098 . 1 1 99 99 PHE N N 15 119.874 0.065 . . . . . A 99 PHE N . 18433 1 1099 . 1 1 100 100 ILE H H 1 8.573 0.011 . . . . . A 100 ILE H . 18433 1 1100 . 1 1 100 100 ILE HA H 1 3.403 0.014 . . . . . A 100 ILE HA . 18433 1 1101 . 1 1 100 100 ILE HB H 1 1.972 0.011 . . . . . A 100 ILE HB . 18433 1 1102 . 1 1 100 100 ILE HG12 H 1 1.089 0.008 . . . . . A 100 ILE HG12 . 18433 1 1103 . 1 1 100 100 ILE HG13 H 1 2.267 0.015 . . . . . A 100 ILE HG13 . 18433 1 1104 . 1 1 100 100 ILE HG21 H 1 0.846 0.015 . . . . . A 100 ILE HG21 . 18433 1 1105 . 1 1 100 100 ILE HG22 H 1 0.846 0.015 . . . . . A 100 ILE HG22 . 18433 1 1106 . 1 1 100 100 ILE HG23 H 1 0.846 0.015 . . . . . A 100 ILE HG23 . 18433 1 1107 . 1 1 100 100 ILE HD11 H 1 1.243 0.007 . . . . . A 100 ILE HD11 . 18433 1 1108 . 1 1 100 100 ILE HD12 H 1 1.243 0.007 . . . . . A 100 ILE HD12 . 18433 1 1109 . 1 1 100 100 ILE HD13 H 1 1.243 0.007 . . . . . A 100 ILE HD13 . 18433 1 1110 . 1 1 100 100 ILE CA C 13 66.097 0.087 . . . . . A 100 ILE CA . 18433 1 1111 . 1 1 100 100 ILE CB C 13 38.692 0.147 . . . . . A 100 ILE CB . 18433 1 1112 . 1 1 100 100 ILE CG1 C 13 30.223 0.035 . . . . . A 100 ILE CG1 . 18433 1 1113 . 1 1 100 100 ILE CG2 C 13 16.965 0.092 . . . . . A 100 ILE CG2 . 18433 1 1114 . 1 1 100 100 ILE CD1 C 13 14.450 0.076 . . . . . A 100 ILE CD1 . 18433 1 1115 . 1 1 100 100 ILE N N 15 122.589 0.073 . . . . . A 100 ILE N . 18433 1 1116 . 1 1 101 101 LEU H H 1 8.716 0.005 . . . . . A 101 LEU H . 18433 1 1117 . 1 1 101 101 LEU HA H 1 3.714 0.009 . . . . . A 101 LEU HA . 18433 1 1118 . 1 1 101 101 LEU HB2 H 1 0.960 0.018 . . . . . A 101 LEU HB2 . 18433 1 1119 . 1 1 101 101 LEU HB3 H 1 1.559 0.006 . . . . . A 101 LEU HB3 . 18433 1 1120 . 1 1 101 101 LEU HG H 1 1.551 0.005 . . . . . A 101 LEU HG . 18433 1 1121 . 1 1 101 101 LEU HD11 H 1 0.855 0.013 . . . . . A 101 LEU HD11 . 18433 1 1122 . 1 1 101 101 LEU HD12 H 1 0.855 0.013 . . . . . A 101 LEU HD12 . 18433 1 1123 . 1 1 101 101 LEU HD13 H 1 0.855 0.013 . . . . . A 101 LEU HD13 . 18433 1 1124 . 1 1 101 101 LEU HD21 H 1 0.925 0.006 . . . . . A 101 LEU HD21 . 18433 1 1125 . 1 1 101 101 LEU HD22 H 1 0.925 0.006 . . . . . A 101 LEU HD22 . 18433 1 1126 . 1 1 101 101 LEU HD23 H 1 0.925 0.006 . . . . . A 101 LEU HD23 . 18433 1 1127 . 1 1 101 101 LEU CA C 13 57.998 0.080 . . . . . A 101 LEU CA . 18433 1 1128 . 1 1 101 101 LEU CB C 13 40.707 0.068 . . . . . A 101 LEU CB . 18433 1 1129 . 1 1 101 101 LEU CG C 13 27.027 0.251 . . . . . A 101 LEU CG . 18433 1 1130 . 1 1 101 101 LEU CD1 C 13 23.845 0.210 . . . . . A 101 LEU CD1 . 18433 1 1131 . 1 1 101 101 LEU CD2 C 13 25.424 0.120 . . . . . A 101 LEU CD2 . 18433 1 1132 . 1 1 101 101 LEU N N 15 119.531 0.029 . . . . . A 101 LEU N . 18433 1 1133 . 1 1 102 102 ASP H H 1 8.343 0.015 . . . . . A 102 ASP H . 18433 1 1134 . 1 1 102 102 ASP HA H 1 4.251 0.008 . . . . . A 102 ASP HA . 18433 1 1135 . 1 1 102 102 ASP HB2 H 1 2.463 0.007 . . . . . A 102 ASP HB2 . 18433 1 1136 . 1 1 102 102 ASP HB3 H 1 2.736 0.014 . . . . . A 102 ASP HB3 . 18433 1 1137 . 1 1 102 102 ASP CA C 13 57.493 0.126 . . . . . A 102 ASP CA . 18433 1 1138 . 1 1 102 102 ASP CB C 13 40.779 0.035 . . . . . A 102 ASP CB . 18433 1 1139 . 1 1 102 102 ASP N N 15 118.371 0.062 . . . . . A 102 ASP N . 18433 1 1140 . 1 1 103 103 ASN H H 1 7.393 0.009 . . . . . A 103 ASN H . 18433 1 1141 . 1 1 103 103 ASN HA H 1 4.133 0.016 . . . . . A 103 ASN HA . 18433 1 1142 . 1 1 103 103 ASN HB2 H 1 2.247 0.006 . . . . . A 103 ASN HB2 . 18433 1 1143 . 1 1 103 103 ASN HB3 H 1 2.608 0.005 . . . . . A 103 ASN HB3 . 18433 1 1144 . 1 1 103 103 ASN HD21 H 1 5.417 0.009 . . . . . A 103 ASN HD21 . 18433 1 1145 . 1 1 103 103 ASN HD22 H 1 6.709 0.008 . . . . . A 103 ASN HD22 . 18433 1 1146 . 1 1 103 103 ASN CA C 13 57.079 0.107 . . . . . A 103 ASN CA . 18433 1 1147 . 1 1 103 103 ASN CB C 13 39.990 0.050 . . . . . A 103 ASN CB . 18433 1 1148 . 1 1 103 103 ASN N N 15 115.409 0.013 . . . . . A 103 ASN N . 18433 1 1149 . 1 1 103 103 ASN ND2 N 15 112.414 0.006 . . . . . A 103 ASN ND2 . 18433 1 1150 . 1 1 104 104 VAL H H 1 8.299 0.015 . . . . . A 104 VAL H . 18433 1 1151 . 1 1 104 104 VAL HA H 1 3.417 0.008 . . . . . A 104 VAL HA . 18433 1 1152 . 1 1 104 104 VAL HB H 1 2.264 0.014 . . . . . A 104 VAL HB . 18433 1 1153 . 1 1 104 104 VAL HG11 H 1 0.902 0.008 . . . . . A 104 VAL HG11 . 18433 1 1154 . 1 1 104 104 VAL HG12 H 1 0.902 0.008 . . . . . A 104 VAL HG12 . 18433 1 1155 . 1 1 104 104 VAL HG13 H 1 0.902 0.008 . . . . . A 104 VAL HG13 . 18433 1 1156 . 1 1 104 104 VAL HG21 H 1 1.059 0.014 . . . . . A 104 VAL HG21 . 18433 1 1157 . 1 1 104 104 VAL HG22 H 1 1.059 0.014 . . . . . A 104 VAL HG22 . 18433 1 1158 . 1 1 104 104 VAL HG23 H 1 1.059 0.014 . . . . . A 104 VAL HG23 . 18433 1 1159 . 1 1 104 104 VAL CA C 13 66.949 0.117 . . . . . A 104 VAL CA . 18433 1 1160 . 1 1 104 104 VAL CB C 13 31.822 0.047 . . . . . A 104 VAL CB . 18433 1 1161 . 1 1 104 104 VAL CG1 C 13 21.770 0.110 . . . . . A 104 VAL CG1 . 18433 1 1162 . 1 1 104 104 VAL CG2 C 13 23.819 0.044 . . . . . A 104 VAL CG2 . 18433 1 1163 . 1 1 104 104 VAL N N 15 119.972 0.061 . . . . . A 104 VAL N . 18433 1 1164 . 1 1 105 105 GLN H H 1 8.763 0.005 . . . . . A 105 GLN H . 18433 1 1165 . 1 1 105 105 GLN HA H 1 4.394 0.011 . . . . . A 105 GLN HA . 18433 1 1166 . 1 1 105 105 GLN HB2 H 1 2.072 0.010 . . . . . A 105 GLN HB2 . 18433 1 1167 . 1 1 105 105 GLN HB3 H 1 2.200 0.007 . . . . . A 105 GLN HB3 . 18433 1 1168 . 1 1 105 105 GLN HG2 H 1 2.437 0.007 . . . . . A 105 GLN HG2 . 18433 1 1169 . 1 1 105 105 GLN HG3 H 1 2.494 0.004 . . . . . A 105 GLN HG3 . 18433 1 1170 . 1 1 105 105 GLN HE21 H 1 7.090 0.009 . . . . . A 105 GLN HE21 . 18433 1 1171 . 1 1 105 105 GLN HE22 H 1 7.232 0.011 . . . . . A 105 GLN HE22 . 18433 1 1172 . 1 1 105 105 GLN CA C 13 59.020 0.053 . . . . . A 105 GLN CA . 18433 1 1173 . 1 1 105 105 GLN CB C 13 28.590 0.035 . . . . . A 105 GLN CB . 18433 1 1174 . 1 1 105 105 GLN CG C 13 33.224 0.062 . . . . . A 105 GLN CG . 18433 1 1175 . 1 1 105 105 GLN N N 15 118.449 0.034 . . . . . A 105 GLN N . 18433 1 1176 . 1 1 105 105 GLN NE2 N 15 109.969 0.007 . . . . . A 105 GLN NE2 . 18433 1 1177 . 1 1 106 106 VAL H H 1 7.607 0.015 . . . . . A 106 VAL H . 18433 1 1178 . 1 1 106 106 VAL HA H 1 3.714 0.006 . . . . . A 106 VAL HA . 18433 1 1179 . 1 1 106 106 VAL HB H 1 2.107 0.009 . . . . . A 106 VAL HB . 18433 1 1180 . 1 1 106 106 VAL HG11 H 1 0.897 0.011 . . . . . A 106 VAL HG11 . 18433 1 1181 . 1 1 106 106 VAL HG12 H 1 0.897 0.011 . . . . . A 106 VAL HG12 . 18433 1 1182 . 1 1 106 106 VAL HG13 H 1 0.897 0.011 . . . . . A 106 VAL HG13 . 18433 1 1183 . 1 1 106 106 VAL HG21 H 1 1.041 0.009 . . . . . A 106 VAL HG21 . 18433 1 1184 . 1 1 106 106 VAL HG22 H 1 1.041 0.009 . . . . . A 106 VAL HG22 . 18433 1 1185 . 1 1 106 106 VAL HG23 H 1 1.041 0.009 . . . . . A 106 VAL HG23 . 18433 1 1186 . 1 1 106 106 VAL CA C 13 66.408 0.047 . . . . . A 106 VAL CA . 18433 1 1187 . 1 1 106 106 VAL CB C 13 31.697 0.029 . . . . . A 106 VAL CB . 18433 1 1188 . 1 1 106 106 VAL CG1 C 13 20.947 0.084 . . . . . A 106 VAL CG1 . 18433 1 1189 . 1 1 106 106 VAL CG2 C 13 22.545 0.086 . . . . . A 106 VAL CG2 . 18433 1 1190 . 1 1 106 106 VAL N N 15 118.643 0.042 . . . . . A 106 VAL N . 18433 1 1191 . 1 1 107 107 VAL H H 1 7.329 0.015 . . . . . A 107 VAL H . 18433 1 1192 . 1 1 107 107 VAL HA H 1 3.729 0.006 . . . . . A 107 VAL HA . 18433 1 1193 . 1 1 107 107 VAL HB H 1 2.061 0.007 . . . . . A 107 VAL HB . 18433 1 1194 . 1 1 107 107 VAL HG11 H 1 1.012 0.009 . . . . . A 107 VAL HG11 . 18433 1 1195 . 1 1 107 107 VAL HG12 H 1 1.012 0.009 . . . . . A 107 VAL HG12 . 18433 1 1196 . 1 1 107 107 VAL HG13 H 1 1.012 0.009 . . . . . A 107 VAL HG13 . 18433 1 1197 . 1 1 107 107 VAL HG21 H 1 1.046 0.011 . . . . . A 107 VAL HG21 . 18433 1 1198 . 1 1 107 107 VAL HG22 H 1 1.046 0.011 . . . . . A 107 VAL HG22 . 18433 1 1199 . 1 1 107 107 VAL HG23 H 1 1.046 0.011 . . . . . A 107 VAL HG23 . 18433 1 1200 . 1 1 107 107 VAL CA C 13 66.373 0.052 . . . . . A 107 VAL CA . 18433 1 1201 . 1 1 107 107 VAL CB C 13 31.318 0.113 . . . . . A 107 VAL CB . 18433 1 1202 . 1 1 107 107 VAL CG1 C 13 22.377 0.114 . . . . . A 107 VAL CG1 . 18433 1 1203 . 1 1 107 107 VAL CG2 C 13 22.511 0.097 . . . . . A 107 VAL CG2 . 18433 1 1204 . 1 1 107 107 VAL N N 15 120.205 0.009 . . . . . A 107 VAL N . 18433 1 1205 . 1 1 108 108 LEU H H 1 8.742 0.007 . . . . . A 108 LEU H . 18433 1 1206 . 1 1 108 108 LEU HA H 1 4.023 0.014 . . . . . A 108 LEU HA . 18433 1 1207 . 1 1 108 108 LEU HB2 H 1 1.834 0.009 . . . . . A 108 LEU HB2 . 18433 1 1208 . 1 1 108 108 LEU HB3 H 1 1.865 0.006 . . . . . A 108 LEU HB3 . 18433 1 1209 . 1 1 108 108 LEU HG H 1 1.756 0.018 . . . . . A 108 LEU HG . 18433 1 1210 . 1 1 108 108 LEU HD11 H 1 0.798 0.010 . . . . . A 108 LEU HD11 . 18433 1 1211 . 1 1 108 108 LEU HD12 H 1 0.798 0.010 . . . . . A 108 LEU HD12 . 18433 1 1212 . 1 1 108 108 LEU HD13 H 1 0.798 0.010 . . . . . A 108 LEU HD13 . 18433 1 1213 . 1 1 108 108 LEU HD21 H 1 0.836 0.008 . . . . . A 108 LEU HD21 . 18433 1 1214 . 1 1 108 108 LEU HD22 H 1 0.836 0.008 . . . . . A 108 LEU HD22 . 18433 1 1215 . 1 1 108 108 LEU HD23 H 1 0.836 0.008 . . . . . A 108 LEU HD23 . 18433 1 1216 . 1 1 108 108 LEU CA C 13 58.902 0.102 . . . . . A 108 LEU CA . 18433 1 1217 . 1 1 108 108 LEU CB C 13 41.975 0.057 . . . . . A 108 LEU CB . 18433 1 1218 . 1 1 108 108 LEU CG C 13 26.661 0.088 . . . . . A 108 LEU CG . 18433 1 1219 . 1 1 108 108 LEU CD1 C 13 24.887 0.080 . . . . . A 108 LEU CD1 . 18433 1 1220 . 1 1 108 108 LEU CD2 C 13 26.302 0.139 . . . . . A 108 LEU CD2 . 18433 1 1221 . 1 1 108 108 LEU N N 15 123.706 0.078 . . . . . A 108 LEU N . 18433 1 1222 . 1 1 109 109 GLN H H 1 8.456 0.013 . . . . . A 109 GLN H . 18433 1 1223 . 1 1 109 109 GLN HA H 1 3.981 0.010 . . . . . A 109 GLN HA . 18433 1 1224 . 1 1 109 109 GLN HB2 H 1 2.113 0.006 . . . . . A 109 GLN HB2 . 18433 1 1225 . 1 1 109 109 GLN HB3 H 1 2.181 0.013 . . . . . A 109 GLN HB3 . 18433 1 1226 . 1 1 109 109 GLN HG2 H 1 2.332 0.008 . . . . . A 109 GLN HG2 . 18433 1 1227 . 1 1 109 109 GLN HG3 H 1 2.398 0.006 . . . . . A 109 GLN HG3 . 18433 1 1228 . 1 1 109 109 GLN HE21 H 1 6.654 0.006 . . . . . A 109 GLN HE21 . 18433 1 1229 . 1 1 109 109 GLN HE22 H 1 7.244 0.004 . . . . . A 109 GLN HE22 . 18433 1 1230 . 1 1 109 109 GLN CA C 13 59.066 0.059 . . . . . A 109 GLN CA . 18433 1 1231 . 1 1 109 109 GLN CB C 13 28.267 0.065 . . . . . A 109 GLN CB . 18433 1 1232 . 1 1 109 109 GLN CG C 13 34.052 0.118 . . . . . A 109 GLN CG . 18433 1 1233 . 1 1 109 109 GLN N N 15 119.622 0.024 . . . . . A 109 GLN N . 18433 1 1234 . 1 1 109 109 GLN NE2 N 15 110.622 0.012 . . . . . A 109 GLN NE2 . 18433 1 1235 . 1 1 110 110 GLN H H 1 8.060 0.006 . . . . . A 110 GLN H . 18433 1 1236 . 1 1 110 110 GLN HA H 1 4.074 0.006 . . . . . A 110 GLN HA . 18433 1 1237 . 1 1 110 110 GLN HB2 H 1 2.111 0.007 . . . . . A 110 GLN HB2 . 18433 1 1238 . 1 1 110 110 GLN HB3 H 1 2.201 0.008 . . . . . A 110 GLN HB3 . 18433 1 1239 . 1 1 110 110 GLN HG2 H 1 2.415 0.015 . . . . . A 110 GLN HG2 . 18433 1 1240 . 1 1 110 110 GLN HG3 H 1 2.546 0.007 . . . . . A 110 GLN HG3 . 18433 1 1241 . 1 1 110 110 GLN HE21 H 1 6.706 0.004 . . . . . A 110 GLN HE21 . 18433 1 1242 . 1 1 110 110 GLN HE22 H 1 7.309 0.006 . . . . . A 110 GLN HE22 . 18433 1 1243 . 1 1 110 110 GLN CA C 13 58.076 0.057 . . . . . A 110 GLN CA . 18433 1 1244 . 1 1 110 110 GLN CB C 13 28.692 0.050 . . . . . A 110 GLN CB . 18433 1 1245 . 1 1 110 110 GLN CG C 13 34.011 0.059 . . . . . A 110 GLN CG . 18433 1 1246 . 1 1 110 110 GLN N N 15 117.492 0.009 . . . . . A 110 GLN N . 18433 1 1247 . 1 1 110 110 GLN NE2 N 15 110.817 0.004 . . . . . A 110 GLN NE2 . 18433 1 1248 . 1 1 111 111 THR H H 1 7.934 0.005 . . . . . A 111 THR H . 18433 1 1249 . 1 1 111 111 THR HA H 1 4.017 0.013 . . . . . A 111 THR HA . 18433 1 1250 . 1 1 111 111 THR HB H 1 3.767 0.005 . . . . . A 111 THR HB . 18433 1 1251 . 1 1 111 111 THR HG21 H 1 0.672 0.006 . . . . . A 111 THR HG21 . 18433 1 1252 . 1 1 111 111 THR HG22 H 1 0.672 0.006 . . . . . A 111 THR HG22 . 18433 1 1253 . 1 1 111 111 THR HG23 H 1 0.672 0.006 . . . . . A 111 THR HG23 . 18433 1 1254 . 1 1 111 111 THR CA C 13 65.020 0.168 . . . . . A 111 THR CA . 18433 1 1255 . 1 1 111 111 THR CB C 13 69.543 0.128 . . . . . A 111 THR CB . 18433 1 1256 . 1 1 111 111 THR CG2 C 13 20.879 0.083 . . . . . A 111 THR CG2 . 18433 1 1257 . 1 1 111 111 THR N N 15 112.944 0.038 . . . . . A 111 THR N . 18433 1 1258 . 1 1 112 112 TYR H H 1 8.404 0.005 . . . . . A 112 TYR H . 18433 1 1259 . 1 1 112 112 TYR HA H 1 4.697 0.009 . . . . . A 112 TYR HA . 18433 1 1260 . 1 1 112 112 TYR HB2 H 1 2.760 0.007 . . . . . A 112 TYR HB2 . 18433 1 1261 . 1 1 112 112 TYR HB3 H 1 3.256 0.007 . . . . . A 112 TYR HB3 . 18433 1 1262 . 1 1 112 112 TYR HD1 H 1 7.152 0.005 . . . . . A 112 TYR HD1 . 18433 1 1263 . 1 1 112 112 TYR HD2 H 1 7.152 0.005 . . . . . A 112 TYR HD2 . 18433 1 1264 . 1 1 112 112 TYR HE1 H 1 6.804 0.006 . . . . . A 112 TYR HE1 . 18433 1 1265 . 1 1 112 112 TYR HE2 H 1 6.804 0.006 . . . . . A 112 TYR HE2 . 18433 1 1266 . 1 1 112 112 TYR CA C 13 58.420 0.048 . . . . . A 112 TYR CA . 18433 1 1267 . 1 1 112 112 TYR CB C 13 40.341 0.067 . . . . . A 112 TYR CB . 18433 1 1268 . 1 1 112 112 TYR CD1 C 13 132.836 0.046 . . . . . A 112 TYR CD1 . 18433 1 1269 . 1 1 112 112 TYR CE1 C 13 118.369 0.094 . . . . . A 112 TYR CE1 . 18433 1 1270 . 1 1 112 112 TYR N N 15 118.273 0.066 . . . . . A 112 TYR N . 18433 1 1271 . 1 1 113 113 GLY H H 1 7.990 0.004 . . . . . A 113 GLY H . 18433 1 1272 . 1 1 113 113 GLY HA2 H 1 4.049 0.013 . . . . . A 113 GLY HA2 . 18433 1 1273 . 1 1 113 113 GLY HA3 H 1 4.143 0.008 . . . . . A 113 GLY HA3 . 18433 1 1274 . 1 1 113 113 GLY CA C 13 46.009 0.065 . . . . . A 113 GLY CA . 18433 1 1275 . 1 1 113 113 GLY N N 15 109.593 0.011 . . . . . A 113 GLY N . 18433 1 1276 . 1 1 114 114 SER H H 1 7.636 0.007 . . . . . A 114 SER H . 18433 1 1277 . 1 1 114 114 SER HA H 1 4.630 0.008 . . . . . A 114 SER HA . 18433 1 1278 . 1 1 114 114 SER HB2 H 1 3.753 0.013 . . . . . A 114 SER HB2 . 18433 1 1279 . 1 1 114 114 SER HB3 H 1 3.812 0.011 . . . . . A 114 SER HB3 . 18433 1 1280 . 1 1 114 114 SER CA C 13 57.356 0.048 . . . . . A 114 SER CA . 18433 1 1281 . 1 1 114 114 SER CB C 13 64.543 0.043 . . . . . A 114 SER CB . 18433 1 1282 . 1 1 114 114 SER N N 15 113.965 0.031 . . . . . A 114 SER N . 18433 1 1283 . 1 1 115 115 THR H H 1 7.828 0.015 . . . . . A 115 THR H . 18433 1 1284 . 1 1 115 115 THR HA H 1 4.406 0.009 . . . . . A 115 THR HA . 18433 1 1285 . 1 1 115 115 THR HB H 1 4.244 0.014 . . . . . A 115 THR HB . 18433 1 1286 . 1 1 115 115 THR HG21 H 1 1.176 0.004 . . . . . A 115 THR HG21 . 18433 1 1287 . 1 1 115 115 THR HG22 H 1 1.176 0.004 . . . . . A 115 THR HG22 . 18433 1 1288 . 1 1 115 115 THR HG23 H 1 1.176 0.004 . . . . . A 115 THR HG23 . 18433 1 1289 . 1 1 115 115 THR CA C 13 61.125 0.066 . . . . . A 115 THR CA . 18433 1 1290 . 1 1 115 115 THR CB C 13 70.288 0.121 . . . . . A 115 THR CB . 18433 1 1291 . 1 1 115 115 THR CG2 C 13 21.875 0.152 . . . . . A 115 THR CG2 . 18433 1 1292 . 1 1 115 115 THR N N 15 110.456 0.058 . . . . . A 115 THR N . 18433 1 1293 . 1 1 116 116 LEU H H 1 8.741 0.008 . . . . . A 116 LEU H . 18433 1 1294 . 1 1 116 116 LEU HA H 1 4.306 0.006 . . . . . A 116 LEU HA . 18433 1 1295 . 1 1 116 116 LEU HB2 H 1 1.480 0.009 . . . . . A 116 LEU HB2 . 18433 1 1296 . 1 1 116 116 LEU HB3 H 1 1.480 0.009 . . . . . A 116 LEU HB3 . 18433 1 1297 . 1 1 116 116 LEU HG H 1 1.509 0.010 . . . . . A 116 LEU HG . 18433 1 1298 . 1 1 116 116 LEU HD11 H 1 0.760 0.010 . . . . . A 116 LEU HD11 . 18433 1 1299 . 1 1 116 116 LEU HD12 H 1 0.760 0.010 . . . . . A 116 LEU HD12 . 18433 1 1300 . 1 1 116 116 LEU HD13 H 1 0.760 0.010 . . . . . A 116 LEU HD13 . 18433 1 1301 . 1 1 116 116 LEU HD21 H 1 0.778 0.011 . . . . . A 116 LEU HD21 . 18433 1 1302 . 1 1 116 116 LEU HD22 H 1 0.778 0.011 . . . . . A 116 LEU HD22 . 18433 1 1303 . 1 1 116 116 LEU HD23 H 1 0.778 0.011 . . . . . A 116 LEU HD23 . 18433 1 1304 . 1 1 116 116 LEU CA C 13 54.883 0.031 . . . . . A 116 LEU CA . 18433 1 1305 . 1 1 116 116 LEU CB C 13 42.795 0.095 . . . . . A 116 LEU CB . 18433 1 1306 . 1 1 116 116 LEU CG C 13 26.776 0.091 . . . . . A 116 LEU CG . 18433 1 1307 . 1 1 116 116 LEU CD1 C 13 23.846 0.064 . . . . . A 116 LEU CD1 . 18433 1 1308 . 1 1 116 116 LEU CD2 C 13 24.836 0.072 . . . . . A 116 LEU CD2 . 18433 1 1309 . 1 1 116 116 LEU N N 15 123.832 0.030 . . . . . A 116 LEU N . 18433 1 1310 . 1 1 117 117 LYS H H 1 8.479 0.011 . . . . . A 117 LYS H . 18433 1 1311 . 1 1 117 117 LYS HA H 1 4.413 0.009 . . . . . A 117 LYS HA . 18433 1 1312 . 1 1 117 117 LYS HB2 H 1 1.705 0.007 . . . . . A 117 LYS HB2 . 18433 1 1313 . 1 1 117 117 LYS HB3 H 1 1.797 0.012 . . . . . A 117 LYS HB3 . 18433 1 1314 . 1 1 117 117 LYS HG2 H 1 1.328 0.007 . . . . . A 117 LYS HG2 . 18433 1 1315 . 1 1 117 117 LYS HG3 H 1 1.403 0.013 . . . . . A 117 LYS HG3 . 18433 1 1316 . 1 1 117 117 LYS HD2 H 1 1.641 0.007 . . . . . A 117 LYS HD2 . 18433 1 1317 . 1 1 117 117 LYS HD3 H 1 1.641 0.007 . . . . . A 117 LYS HD3 . 18433 1 1318 . 1 1 117 117 LYS HE2 H 1 2.952 0.017 . . . . . A 117 LYS HE2 . 18433 1 1319 . 1 1 117 117 LYS HE3 H 1 2.952 0.017 . . . . . A 117 LYS HE3 . 18433 1 1320 . 1 1 117 117 LYS CA C 13 55.551 0.167 . . . . . A 117 LYS CA . 18433 1 1321 . 1 1 117 117 LYS CB C 13 32.551 0.079 . . . . . A 117 LYS CB . 18433 1 1322 . 1 1 117 117 LYS CG C 13 24.523 0.196 . . . . . A 117 LYS CG . 18433 1 1323 . 1 1 117 117 LYS CD C 13 29.177 0.144 . . . . . A 117 LYS CD . 18433 1 1324 . 1 1 117 117 LYS CE C 13 41.865 0.054 . . . . . A 117 LYS CE . 18433 1 1325 . 1 1 117 117 LYS N N 15 124.713 0.009 . . . . . A 117 LYS N . 18433 1 1326 . 1 1 118 118 VAL H H 1 8.268 0.005 . . . . . A 118 VAL H . 18433 1 1327 . 1 1 118 118 VAL HA H 1 4.242 0.006 . . . . . A 118 VAL HA . 18433 1 1328 . 1 1 118 118 VAL HB H 1 2.132 0.009 . . . . . A 118 VAL HB . 18433 1 1329 . 1 1 118 118 VAL HG11 H 1 0.902 0.006 . . . . . A 118 VAL HG11 . 18433 1 1330 . 1 1 118 118 VAL HG12 H 1 0.902 0.006 . . . . . A 118 VAL HG12 . 18433 1 1331 . 1 1 118 118 VAL HG13 H 1 0.902 0.006 . . . . . A 118 VAL HG13 . 18433 1 1332 . 1 1 118 118 VAL HG21 H 1 0.925 0.005 . . . . . A 118 VAL HG21 . 18433 1 1333 . 1 1 118 118 VAL HG22 H 1 0.925 0.005 . . . . . A 118 VAL HG22 . 18433 1 1334 . 1 1 118 118 VAL HG23 H 1 0.925 0.005 . . . . . A 118 VAL HG23 . 18433 1 1335 . 1 1 118 118 VAL CA C 13 61.955 0.087 . . . . . A 118 VAL CA . 18433 1 1336 . 1 1 118 118 VAL CB C 13 32.837 0.113 . . . . . A 118 VAL CB . 18433 1 1337 . 1 1 118 118 VAL CG1 C 13 20.491 0.089 . . . . . A 118 VAL CG1 . 18433 1 1338 . 1 1 118 118 VAL CG2 C 13 21.584 0.066 . . . . . A 118 VAL CG2 . 18433 1 1339 . 1 1 118 118 VAL N N 15 122.419 0.051 . . . . . A 118 VAL N . 18433 1 1340 . 1 1 119 119 THR H H 1 7.636 0.013 . . . . . A 119 THR H . 18433 1 1341 . 1 1 119 119 THR HA H 1 4.135 0.008 . . . . . A 119 THR HA . 18433 1 1342 . 1 1 119 119 THR HB H 1 4.213 0.007 . . . . . A 119 THR HB . 18433 1 1343 . 1 1 119 119 THR HG21 H 1 1.127 0.005 . . . . . A 119 THR HG21 . 18433 1 1344 . 1 1 119 119 THR HG22 H 1 1.127 0.005 . . . . . A 119 THR HG22 . 18433 1 1345 . 1 1 119 119 THR HG23 H 1 1.127 0.005 . . . . . A 119 THR HG23 . 18433 1 1346 . 1 1 119 119 THR CA C 13 62.858 0.053 . . . . . A 119 THR CA . 18433 1 1347 . 1 1 119 119 THR CB C 13 70.413 0.226 . . . . . A 119 THR CB . 18433 1 1348 . 1 1 119 119 THR CG2 C 13 21.800 0.112 . . . . . A 119 THR CG2 . 18433 1 1349 . 1 1 119 119 THR N N 15 122.034 0.051 . . . . . A 119 THR N . 18433 1 1350 . 2 2 5 5 HIS HA H 1 4.634 0.005 . . . . . . 205 HIS HA . 18433 1 1351 . 2 2 5 5 HIS HB2 H 1 3.084 0.005 . . . . . . 205 HIS HB2 . 18433 1 1352 . 2 2 5 5 HIS HB3 H 1 3.145 0.005 . . . . . . 205 HIS HB3 . 18433 1 1353 . 2 2 5 5 HIS HD2 H 1 7.026 0.013 . . . . . . 205 HIS HD2 . 18433 1 1354 . 2 2 5 5 HIS CA C 13 56.314 0.005 . . . . . . 205 HIS CA . 18433 1 1355 . 2 2 5 5 HIS CB C 13 30.814 0.015 . . . . . . 205 HIS CB . 18433 1 1356 . 2 2 5 5 HIS CD2 C 13 119.637 0.140 . . . . . . 205 HIS CD2 . 18433 1 1357 . 2 2 7 7 LYS HA H 1 4.416 0.004 . . . . . . 207 LYS HA . 18433 1 1358 . 2 2 7 7 LYS HB2 H 1 1.699 0.010 . . . . . . 207 LYS HB2 . 18433 1 1359 . 2 2 7 7 LYS HB3 H 1 1.852 0.003 . . . . . . 207 LYS HB3 . 18433 1 1360 . 2 2 7 7 LYS HG2 H 1 1.413 0.005 . . . . . . 207 LYS HG2 . 18433 1 1361 . 2 2 7 7 LYS HG3 H 1 1.468 0.007 . . . . . . 207 LYS HG3 . 18433 1 1362 . 2 2 7 7 LYS HD2 H 1 1.644 0.009 . . . . . . 207 LYS HD2 . 18433 1 1363 . 2 2 7 7 LYS HD3 H 1 1.644 0.009 . . . . . . 207 LYS HD3 . 18433 1 1364 . 2 2 7 7 LYS HE2 H 1 2.958 0.006 . . . . . . 207 LYS HE2 . 18433 1 1365 . 2 2 7 7 LYS HE3 H 1 2.958 0.006 . . . . . . 207 LYS HE3 . 18433 1 1366 . 2 2 7 7 LYS CA C 13 55.370 0.000 . . . . . . 207 LYS CA . 18433 1 1367 . 2 2 7 7 LYS CB C 13 34.230 0.000 . . . . . . 207 LYS CB . 18433 1 1368 . 2 2 7 7 LYS CG C 13 24.741 0.028 . . . . . . 207 LYS CG . 18433 1 1369 . 2 2 7 7 LYS CD C 13 28.820 0.000 . . . . . . 207 LYS CD . 18433 1 1370 . 2 2 8 8 SER HA H 1 4.838 0.006 . . . . . . 208 SER HA . 18433 1 1371 . 2 2 8 8 SER HB2 H 1 3.712 0.004 . . . . . . 208 SER HB2 . 18433 1 1372 . 2 2 8 8 SER HB3 H 1 4.189 0.004 . . . . . . 208 SER HB3 . 18433 1 1373 . 2 2 8 8 SER CA C 13 57.820 0.065 . . . . . . 208 SER CA . 18433 1 1374 . 2 2 8 8 SER CB C 13 63.516 0.021 . . . . . . 208 SER CB . 18433 1 1375 . 2 2 9 9 PHE H H 1 10.847 0.007 . . . . . . 209 PHE H . 18433 1 1376 . 2 2 9 9 PHE HA H 1 4.098 0.007 . . . . . . 209 PHE HA . 18433 1 1377 . 2 2 9 9 PHE HB2 H 1 2.249 0.008 . . . . . . 209 PHE HB2 . 18433 1 1378 . 2 2 9 9 PHE HB3 H 1 3.241 0.003 . . . . . . 209 PHE HB3 . 18433 1 1379 . 2 2 9 9 PHE HD1 H 1 6.094 0.011 . . . . . . 209 PHE HD1 . 18433 1 1380 . 2 2 9 9 PHE HD2 H 1 6.094 0.011 . . . . . . 209 PHE HD2 . 18433 1 1381 . 2 2 9 9 PHE HE1 H 1 7.054 0.007 . . . . . . 209 PHE HE1 . 18433 1 1382 . 2 2 9 9 PHE HE2 H 1 7.054 0.007 . . . . . . 209 PHE HE2 . 18433 1 1383 . 2 2 9 9 PHE HZ H 1 7.048 0.008 . . . . . . 209 PHE HZ . 18433 1 1384 . 2 2 9 9 PHE CA C 13 61.723 0.136 . . . . . . 209 PHE CA . 18433 1 1385 . 2 2 9 9 PHE CB C 13 40.063 0.071 . . . . . . 209 PHE CB . 18433 1 1386 . 2 2 9 9 PHE CD1 C 13 132.023 0.041 . . . . . . 209 PHE CD1 . 18433 1 1387 . 2 2 9 9 PHE CE1 C 13 130.788 0.049 . . . . . . 209 PHE CE1 . 18433 1 1388 . 2 2 9 9 PHE CZ C 13 129.013 0.047 . . . . . . 209 PHE CZ . 18433 1 1389 . 2 2 9 9 PHE N N 15 108.560 0.000 . . . . . . 209 PHE N . 18433 1 1390 . 2 2 10 10 PHE H H 1 8.270 0.003 . . . . . . 210 PHE H . 18433 1 1391 . 2 2 10 10 PHE HA H 1 3.862 0.007 . . . . . . 210 PHE HA . 18433 1 1392 . 2 2 10 10 PHE HB2 H 1 2.741 0.009 . . . . . . 210 PHE HB2 . 18433 1 1393 . 2 2 10 10 PHE HB3 H 1 3.009 0.005 . . . . . . 210 PHE HB3 . 18433 1 1394 . 2 2 10 10 PHE HD1 H 1 7.018 0.008 . . . . . . 210 PHE HD1 . 18433 1 1395 . 2 2 10 10 PHE HD2 H 1 7.018 0.008 . . . . . . 210 PHE HD2 . 18433 1 1396 . 2 2 10 10 PHE HE1 H 1 6.220 0.008 . . . . . . 210 PHE HE1 . 18433 1 1397 . 2 2 10 10 PHE HE2 H 1 6.220 0.008 . . . . . . 210 PHE HE2 . 18433 1 1398 . 2 2 10 10 PHE HZ H 1 6.301 0.002 . . . . . . 210 PHE HZ . 18433 1 1399 . 2 2 10 10 PHE CA C 13 62.002 0.057 . . . . . . 210 PHE CA . 18433 1 1400 . 2 2 10 10 PHE CB C 13 37.240 0.019 . . . . . . 210 PHE CB . 18433 1 1401 . 2 2 10 10 PHE CD1 C 13 130.433 0.067 . . . . . . 210 PHE CD1 . 18433 1 1402 . 2 2 10 10 PHE CE1 C 13 130.430 0.070 . . . . . . 210 PHE CE1 . 18433 1 1403 . 2 2 10 10 PHE CZ C 13 129.412 0.035 . . . . . . 210 PHE CZ . 18433 1 1404 . 2 2 10 10 PHE N N 15 117.200 0.020 . . . . . . 210 PHE N . 18433 1 1405 . 2 2 11 11 ASP H H 1 8.523 0.012 . . . . . . 211 ASP H . 18433 1 1406 . 2 2 11 11 ASP HA H 1 4.387 0.005 . . . . . . 211 ASP HA . 18433 1 1407 . 2 2 11 11 ASP HB2 H 1 2.614 0.008 . . . . . . 211 ASP HB2 . 18433 1 1408 . 2 2 11 11 ASP HB3 H 1 2.614 0.008 . . . . . . 211 ASP HB3 . 18433 1 1409 . 2 2 11 11 ASP CA C 13 57.288 0.120 . . . . . . 211 ASP CA . 18433 1 1410 . 2 2 11 11 ASP CB C 13 39.670 0.047 . . . . . . 211 ASP CB . 18433 1 1411 . 2 2 11 11 ASP N N 15 121.690 0.049 . . . . . . 211 ASP N . 18433 1 1412 . 2 2 12 12 LYS H H 1 7.505 0.013 . . . . . . 212 LYS H . 18433 1 1413 . 2 2 12 12 LYS HA H 1 3.945 0.006 . . . . . . 212 LYS HA . 18433 1 1414 . 2 2 12 12 LYS HB2 H 1 1.817 0.012 . . . . . . 212 LYS HB2 . 18433 1 1415 . 2 2 12 12 LYS HB3 H 1 1.857 0.010 . . . . . . 212 LYS HB3 . 18433 1 1416 . 2 2 12 12 LYS HG2 H 1 1.237 0.012 . . . . . . 212 LYS HG2 . 18433 1 1417 . 2 2 12 12 LYS HG3 H 1 1.431 0.008 . . . . . . 212 LYS HG3 . 18433 1 1418 . 2 2 12 12 LYS HD2 H 1 1.606 0.008 . . . . . . 212 LYS HD2 . 18433 1 1419 . 2 2 12 12 LYS HD3 H 1 1.606 0.008 . . . . . . 212 LYS HD3 . 18433 1 1420 . 2 2 12 12 LYS HE2 H 1 2.914 0.007 . . . . . . 212 LYS HE2 . 18433 1 1421 . 2 2 12 12 LYS HE3 H 1 2.914 0.007 . . . . . . 212 LYS HE3 . 18433 1 1422 . 2 2 12 12 LYS CA C 13 59.456 0.097 . . . . . . 212 LYS CA . 18433 1 1423 . 2 2 12 12 LYS CB C 13 31.806 0.138 . . . . . . 212 LYS CB . 18433 1 1424 . 2 2 12 12 LYS CG C 13 24.840 0.039 . . . . . . 212 LYS CG . 18433 1 1425 . 2 2 12 12 LYS CD C 13 29.206 0.075 . . . . . . 212 LYS CD . 18433 1 1426 . 2 2 12 12 LYS CE C 13 41.762 0.024 . . . . . . 212 LYS CE . 18433 1 1427 . 2 2 12 12 LYS N N 15 122.063 0.044 . . . . . . 212 LYS N . 18433 1 1428 . 2 2 13 13 LYS H H 1 7.766 0.009 . . . . . . 213 LYS H . 18433 1 1429 . 2 2 13 13 LYS HA H 1 3.856 0.006 . . . . . . 213 LYS HA . 18433 1 1430 . 2 2 13 13 LYS HB2 H 1 1.618 0.002 . . . . . . 213 LYS HB2 . 18433 1 1431 . 2 2 13 13 LYS HB3 H 1 1.720 0.003 . . . . . . 213 LYS HB3 . 18433 1 1432 . 2 2 13 13 LYS HG2 H 1 0.684 0.007 . . . . . . 213 LYS HG2 . 18433 1 1433 . 2 2 13 13 LYS HG3 H 1 0.684 0.007 . . . . . . 213 LYS HG3 . 18433 1 1434 . 2 2 13 13 LYS HD2 H 1 1.324 0.003 . . . . . . 213 LYS HD2 . 18433 1 1435 . 2 2 13 13 LYS HD3 H 1 1.324 0.003 . . . . . . 213 LYS HD3 . 18433 1 1436 . 2 2 13 13 LYS HE2 H 1 2.409 0.003 . . . . . . 213 LYS HE2 . 18433 1 1437 . 2 2 13 13 LYS HE3 H 1 2.658 0.005 . . . . . . 213 LYS HE3 . 18433 1 1438 . 2 2 13 13 LYS CA C 13 56.698 0.100 . . . . . . 213 LYS CA . 18433 1 1439 . 2 2 13 13 LYS CB C 13 30.318 0.062 . . . . . . 213 LYS CB . 18433 1 1440 . 2 2 13 13 LYS CG C 13 23.069 0.051 . . . . . . 213 LYS CG . 18433 1 1441 . 2 2 13 13 LYS CD C 13 26.306 0.048 . . . . . . 213 LYS CD . 18433 1 1442 . 2 2 13 13 LYS CE C 13 41.596 0.059 . . . . . . 213 LYS CE . 18433 1 1443 . 2 2 13 13 LYS N N 15 117.678 0.019 . . . . . . 213 LYS N . 18433 1 1444 . 2 2 14 14 ARG H H 1 8.420 0.008 . . . . . . 214 ARG H . 18433 1 1445 . 2 2 14 14 ARG HA H 1 3.948 0.005 . . . . . . 214 ARG HA . 18433 1 1446 . 2 2 14 14 ARG HB2 H 1 1.724 0.010 . . . . . . 214 ARG HB2 . 18433 1 1447 . 2 2 14 14 ARG HB3 H 1 1.858 0.007 . . . . . . 214 ARG HB3 . 18433 1 1448 . 2 2 14 14 ARG HG2 H 1 1.314 0.005 . . . . . . 214 ARG HG2 . 18433 1 1449 . 2 2 14 14 ARG HG3 H 1 1.415 0.008 . . . . . . 214 ARG HG3 . 18433 1 1450 . 2 2 14 14 ARG HD2 H 1 3.072 0.005 . . . . . . 214 ARG HD2 . 18433 1 1451 . 2 2 14 14 ARG HD3 H 1 3.239 0.013 . . . . . . 214 ARG HD3 . 18433 1 1452 . 2 2 14 14 ARG CA C 13 59.482 0.047 . . . . . . 214 ARG CA . 18433 1 1453 . 2 2 14 14 ARG CB C 13 30.525 0.094 . . . . . . 214 ARG CB . 18433 1 1454 . 2 2 14 14 ARG CG C 13 27.871 0.100 . . . . . . 214 ARG CG . 18433 1 1455 . 2 2 14 14 ARG CD C 13 42.913 0.066 . . . . . . 214 ARG CD . 18433 1 1456 . 2 2 14 14 ARG N N 15 121.500 0.042 . . . . . . 214 ARG N . 18433 1 1457 . 2 2 15 15 SER H H 1 7.721 0.011 . . . . . . 215 SER H . 18433 1 1458 . 2 2 15 15 SER HA H 1 4.194 0.006 . . . . . . 215 SER HA . 18433 1 1459 . 2 2 15 15 SER HB2 H 1 3.949 0.005 . . . . . . 215 SER HB2 . 18433 1 1460 . 2 2 15 15 SER HB3 H 1 3.949 0.005 . . . . . . 215 SER HB3 . 18433 1 1461 . 2 2 15 15 SER CA C 13 61.061 0.033 . . . . . . 215 SER CA . 18433 1 1462 . 2 2 15 15 SER CB C 13 63.090 0.043 . . . . . . 215 SER CB . 18433 1 1463 . 2 2 15 15 SER N N 15 113.617 0.030 . . . . . . 215 SER N . 18433 1 1464 . 2 2 16 16 GLU H H 1 7.778 0.018 . . . . . . 216 GLU H . 18433 1 1465 . 2 2 16 16 GLU HA H 1 4.086 0.008 . . . . . . 216 GLU HA . 18433 1 1466 . 2 2 16 16 GLU HB2 H 1 2.031 0.005 . . . . . . 216 GLU HB2 . 18433 1 1467 . 2 2 16 16 GLU HB3 H 1 2.031 0.005 . . . . . . 216 GLU HB3 . 18433 1 1468 . 2 2 16 16 GLU HG2 H 1 2.175 0.007 . . . . . . 216 GLU HG2 . 18433 1 1469 . 2 2 16 16 GLU HG3 H 1 2.408 0.005 . . . . . . 216 GLU HG3 . 18433 1 1470 . 2 2 16 16 GLU CA C 13 57.969 0.051 . . . . . . 216 GLU CA . 18433 1 1471 . 2 2 16 16 GLU CB C 13 29.962 0.064 . . . . . . 216 GLU CB . 18433 1 1472 . 2 2 16 16 GLU CG C 13 36.426 0.088 . . . . . . 216 GLU CG . 18433 1 1473 . 2 2 16 16 GLU N N 15 121.086 0.072 . . . . . . 216 GLU N . 18433 1 1474 . 2 2 17 17 ARG H H 1 7.612 0.005 . . . . . . 217 ARG H . 18433 1 1475 . 2 2 17 17 ARG HA H 1 4.162 0.009 . . . . . . 217 ARG HA . 18433 1 1476 . 2 2 17 17 ARG HB2 H 1 1.904 0.007 . . . . . . 217 ARG HB2 . 18433 1 1477 . 2 2 17 17 ARG HB3 H 1 1.904 0.007 . . . . . . 217 ARG HB3 . 18433 1 1478 . 2 2 17 17 ARG HG2 H 1 1.584 0.006 . . . . . . 217 ARG HG2 . 18433 1 1479 . 2 2 17 17 ARG HG3 H 1 1.727 0.008 . . . . . . 217 ARG HG3 . 18433 1 1480 . 2 2 17 17 ARG HD2 H 1 3.218 0.007 . . . . . . 217 ARG HD2 . 18433 1 1481 . 2 2 17 17 ARG HD3 H 1 3.218 0.007 . . . . . . 217 ARG HD3 . 18433 1 1482 . 2 2 17 17 ARG CA C 13 57.834 0.130 . . . . . . 217 ARG CA . 18433 1 1483 . 2 2 17 17 ARG CB C 13 30.553 0.032 . . . . . . 217 ARG CB . 18433 1 1484 . 2 2 17 17 ARG CG C 13 27.791 0.090 . . . . . . 217 ARG CG . 18433 1 1485 . 2 2 17 17 ARG CD C 13 43.006 0.067 . . . . . . 217 ARG CD . 18433 1 1486 . 2 2 17 17 ARG N N 15 119.273 0.003 . . . . . . 217 ARG N . 18433 1 1487 . 2 2 18 18 ILE H H 1 7.790 0.004 . . . . . . 218 ILE H . 18433 1 1488 . 2 2 18 18 ILE HA H 1 4.079 0.006 . . . . . . 218 ILE HA . 18433 1 1489 . 2 2 18 18 ILE HB H 1 1.913 0.004 . . . . . . 218 ILE HB . 18433 1 1490 . 2 2 18 18 ILE HG12 H 1 1.197 0.008 . . . . . . 218 ILE HG12 . 18433 1 1491 . 2 2 18 18 ILE HG13 H 1 1.510 0.005 . . . . . . 218 ILE HG13 . 18433 1 1492 . 2 2 18 18 ILE HG21 H 1 0.886 0.007 . . . . . . 218 ILE HG21 . 18433 1 1493 . 2 2 18 18 ILE HG22 H 1 0.886 0.007 . . . . . . 218 ILE HG22 . 18433 1 1494 . 2 2 18 18 ILE HG23 H 1 0.886 0.007 . . . . . . 218 ILE HG23 . 18433 1 1495 . 2 2 18 18 ILE HD11 H 1 0.813 0.005 . . . . . . 218 ILE HD11 . 18433 1 1496 . 2 2 18 18 ILE HD12 H 1 0.813 0.005 . . . . . . 218 ILE HD12 . 18433 1 1497 . 2 2 18 18 ILE HD13 H 1 0.813 0.005 . . . . . . 218 ILE HD13 . 18433 1 1498 . 2 2 18 18 ILE CA C 13 62.367 0.143 . . . . . . 218 ILE CA . 18433 1 1499 . 2 2 18 18 ILE CB C 13 38.441 0.056 . . . . . . 218 ILE CB . 18433 1 1500 . 2 2 18 18 ILE CG1 C 13 27.618 0.068 . . . . . . 218 ILE CG1 . 18433 1 1501 . 2 2 18 18 ILE CG2 C 13 17.487 0.063 . . . . . . 218 ILE CG2 . 18433 1 1502 . 2 2 18 18 ILE CD1 C 13 13.050 0.053 . . . . . . 218 ILE CD1 . 18433 1 1503 . 2 2 18 18 ILE N N 15 118.978 0.000 . . . . . . 218 ILE N . 18433 1 1504 . 2 2 19 19 SER H H 1 8.029 0.005 . . . . . . 219 SER H . 18433 1 1505 . 2 2 19 19 SER HA H 1 4.411 0.012 . . . . . . 219 SER HA . 18433 1 1506 . 2 2 19 19 SER HB2 H 1 3.845 0.002 . . . . . . 219 SER HB2 . 18433 1 1507 . 2 2 19 19 SER HB3 H 1 3.845 0.002 . . . . . . 219 SER HB3 . 18433 1 1508 . 2 2 19 19 SER CA C 13 58.456 0.000 . . . . . . 219 SER CA . 18433 1 1509 . 2 2 19 19 SER CB C 13 63.843 0.033 . . . . . . 219 SER CB . 18433 1 1510 . 2 2 19 19 SER N N 15 117.441 0.035 . . . . . . 219 SER N . 18433 1 1511 . 2 2 20 20 ASN H H 1 8.213 0.007 . . . . . . 220 ASN H . 18433 1 1512 . 2 2 20 20 ASN HA H 1 4.734 0.005 . . . . . . 220 ASN HA . 18433 1 1513 . 2 2 20 20 ASN HB2 H 1 2.783 0.000 . . . . . . 220 ASN HB2 . 18433 1 1514 . 2 2 20 20 ASN HB3 H 1 2.865 0.005 . . . . . . 220 ASN HB3 . 18433 1 1515 . 2 2 20 20 ASN CA C 13 53.341 0.015 . . . . . . 220 ASN CA . 18433 1 1516 . 2 2 20 20 ASN CB C 13 38.719 0.014 . . . . . . 220 ASN CB . 18433 1 1517 . 2 2 20 20 ASN N N 15 120.084 0.022 . . . . . . 220 ASN N . 18433 1 1518 . 2 2 21 21 CYS H H 1 8.140 0.005 . . . . . . 221 CYS H . 18433 1 1519 . 2 2 21 21 CYS HA H 1 4.463 0.005 . . . . . . 221 CYS HA . 18433 1 1520 . 2 2 21 21 CYS HB2 H 1 2.920 0.005 . . . . . . 221 CYS HB2 . 18433 1 1521 . 2 2 21 21 CYS HB3 H 1 2.920 0.005 . . . . . . 221 CYS HB3 . 18433 1 1522 . 2 2 21 21 CYS CA C 13 58.651 0.129 . . . . . . 221 CYS CA . 18433 1 1523 . 2 2 21 21 CYS CB C 13 27.580 0.078 . . . . . . 221 CYS CB . 18433 1 1524 . 2 2 21 21 CYS N N 15 118.834 0.032 . . . . . . 221 CYS N . 18433 1 1525 . 2 2 22 22 GLN H H 1 8.348 0.005 . . . . . . 222 GLN H . 18433 1 1526 . 2 2 22 22 GLN HA H 1 4.293 0.000 . . . . . . 222 GLN HA . 18433 1 1527 . 2 2 22 22 GLN HB2 H 1 1.656 0.000 . . . . . . 222 GLN HB2 . 18433 1 1528 . 2 2 22 22 GLN HB3 H 1 1.656 0.000 . . . . . . 222 GLN HB3 . 18433 1 1529 . 2 2 22 22 GLN CA C 13 55.900 0.000 . . . . . . 222 GLN CA . 18433 1 1530 . 2 2 22 22 GLN CB C 13 29.134 0.000 . . . . . . 222 GLN CB . 18433 1 1531 . 2 2 22 22 GLN N N 15 122.118 0.018 . . . . . . 222 GLN N . 18433 1 1532 . 2 2 23 23 ASP H H 1 8.308 0.005 . . . . . . 223 ASP H . 18433 1 1533 . 2 2 23 23 ASP HA H 1 4.664 0.006 . . . . . . 223 ASP HA . 18433 1 1534 . 2 2 23 23 ASP HB2 H 1 2.615 0.004 . . . . . . 223 ASP HB2 . 18433 1 1535 . 2 2 23 23 ASP HB3 H 1 2.731 0.004 . . . . . . 223 ASP HB3 . 18433 1 1536 . 2 2 23 23 ASP CA C 13 54.554 0.083 . . . . . . 223 ASP CA . 18433 1 1537 . 2 2 23 23 ASP CB C 13 41.257 0.033 . . . . . . 223 ASP CB . 18433 1 1538 . 2 2 23 23 ASP N N 15 121.582 0.014 . . . . . . 223 ASP N . 18433 1 1539 . 2 2 24 24 THR H H 1 8.056 0.006 . . . . . . 224 THR H . 18433 1 1540 . 2 2 24 24 THR HA H 1 4.400 0.004 . . . . . . 224 THR HA . 18433 1 1541 . 2 2 24 24 THR HB H 1 4.314 0.004 . . . . . . 224 THR HB . 18433 1 1542 . 2 2 24 24 THR HG21 H 1 1.167 0.005 . . . . . . 224 THR HG21 . 18433 1 1543 . 2 2 24 24 THR HG22 H 1 1.167 0.005 . . . . . . 224 THR HG22 . 18433 1 1544 . 2 2 24 24 THR HG23 H 1 1.167 0.005 . . . . . . 224 THR HG23 . 18433 1 1545 . 2 2 24 24 THR CA C 13 61.197 0.048 . . . . . . 224 THR CA . 18433 1 1546 . 2 2 24 24 THR CB C 13 69.572 0.025 . . . . . . 224 THR CB . 18433 1 1547 . 2 2 24 24 THR CG2 C 13 21.269 0.069 . . . . . . 224 THR CG2 . 18433 1 1548 . 2 2 24 24 THR N N 15 113.896 0.027 . . . . . . 224 THR N . 18433 1 1549 . 2 2 25 25 SER H H 1 7.957 0.004 . . . . . . 225 SER H . 18433 1 1550 . 2 2 25 25 SER HA H 1 4.227 0.002 . . . . . . 225 SER HA . 18433 1 1551 . 2 2 25 25 SER CA C 13 60.168 0.062 . . . . . . 225 SER CA . 18433 1 1552 . 2 2 25 25 SER N N 15 123.678 0.013 . . . . . . 225 SER N . 18433 1 stop_ save_