data_11337 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11337 _Entry.Title ; Solution structure of the RWD domain of human RWD domain containing protein 3 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-08-10 _Entry.Accession_date 2010-08-10 _Entry.Last_release_date 2011-08-19 _Entry.Original_release_date 2011-08-19 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _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 M. Yoneyama . . . 11337 2 S. Koshiba . . . 11337 3 S. Watabe . . . 11337 4 T. Harada . . . 11337 5 T. Kigawa . . . 11337 6 S. Yokoyama . . . 11337 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 . 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11337 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11337 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 555 11337 '15N chemical shifts' 125 11337 '1H chemical shifts' 897 11337 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-08-19 2010-08-10 original author . 11337 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2EBK 'BMRB Entry Tracking System' 11337 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11337 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Solution structure of the RWD domain of human RWD domain containing protein 3' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year . _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 M. Yoneyama . . . 11337 1 2 S. Koshiba . . . 11337 1 3 S. Watabe . . . 11337 1 4 T. Harada . . . 11337 1 5 T. Kigawa . . . 11337 1 6 S. Yokoyama . . . 11337 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11337 _Assembly.ID 1 _Assembly.Name 'RWD domain-containing protein 3' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 'RWD domain' 1 $entity_1 A . yes native no no . . . 11337 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2ebk . . . . . . 11337 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11337 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'RWD domain' _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 ; GSSGSSGMAEPVQEELSVLA AIFCRPHEWEVLSRSETDGT VFRIHTKAEGFMDADIPLEL VFHLPVNYPSCLPGISINSE QLTRAQCVTVKEKLLEQAES LLSEPMVHELVLWIQQNLRH ILSQPETG ; _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 128 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 2EBK . "Solution Structure Of The Rwd Domain Of Human Rwd Domain Containing Protein 3" . . . . . 100.00 128 100.00 100.00 6.66e-87 . . . . 11337 1 2 no PDB 4Y1L . "Ubc9 Homodimer The Missing Link In Poly-sumo Chain Formation" . . . . . 87.50 113 98.21 99.11 1.48e-73 . . . . 11337 1 3 no DBJ BAF85354 . "unnamed protein product [Homo sapiens]" . . . . . 94.53 195 100.00 100.00 1.90e-81 . . . . 11337 1 4 no DBJ BAF85388 . "unnamed protein product [Homo sapiens]" . . . . . 94.53 195 100.00 100.00 1.90e-81 . . . . 11337 1 5 no DBJ BAG59117 . "unnamed protein product [Homo sapiens]" . . . . . 72.66 180 100.00 100.00 2.27e-59 . . . . 11337 1 6 no DBJ BAI46391 . "RWD domain containing protein 3 [synthetic construct]" . . . . . 94.53 195 100.00 100.00 1.90e-81 . . . . 11337 1 7 no EMBL CAB43254 . "hypothetical protein [Homo sapiens]" . . . . . 94.53 195 100.00 100.00 1.90e-81 . . . . 11337 1 8 no EMBL CAG38524 . "RWDD3 [Homo sapiens]" . . . . . 94.53 195 99.17 100.00 6.45e-81 . . . . 11337 1 9 no EMBL CAL37651 . "hypothetical protein [synthetic construct]" . . . . . 94.53 195 100.00 100.00 1.90e-81 . . . . 11337 1 10 no EMBL CAL38135 . "hypothetical protein, partial [synthetic construct]" . . . . . 94.53 195 100.00 100.00 1.90e-81 . . . . 11337 1 11 no GB AAI25143 . "RWDD3 protein [Homo sapiens]" . . . . . 72.66 185 100.00 100.00 2.83e-59 . . . . 11337 1 12 no GB AIC56138 . "RWDD3, partial [synthetic construct]" . . . . . 94.53 195 99.17 99.17 9.77e-81 . . . . 11337 1 13 no GB AIC63357 . "RWDD3, partial [synthetic construct]" . . . . . 72.66 185 100.00 100.00 2.83e-59 . . . . 11337 1 14 no GB EAW73019 . "RWD domain containing 3, isoform CRA_a [Homo sapiens]" . . . . . 94.53 195 99.17 99.17 1.15e-80 . . . . 11337 1 15 no GB EAW73020 . "RWD domain containing 3, isoform CRA_b [Homo sapiens]" . . . . . 72.66 180 98.92 98.92 1.38e-58 . . . . 11337 1 16 no PIR T08730 . "hypothetical protein DKFZp566K023.1 - human (fragment)" . . . . . 97.66 201 97.60 98.40 1.83e-82 . . . . 11337 1 17 no REF NP_001121614 . "RWD domain-containing protein 3 isoform b [Homo sapiens]" . . . . . 94.53 195 99.17 99.17 1.15e-80 . . . . 11337 1 18 no REF NP_001186611 . "RWD domain-containing protein 3 isoform c [Homo sapiens]" . . . . . 94.53 200 99.17 99.17 1.76e-80 . . . . 11337 1 19 no REF NP_001265176 . "RWD domain-containing protein 3 isoform d [Homo sapiens]" . . . . . 72.66 185 98.92 98.92 1.83e-58 . . . . 11337 1 20 no REF NP_001265177 . "RWD domain-containing protein 3 isoform e [Homo sapiens]" . . . . . 72.66 252 98.92 98.92 1.05e-58 . . . . 11337 1 21 no REF NP_056300 . "RWD domain-containing protein 3 isoform a [Homo sapiens]" . . . . . 94.53 267 99.17 99.17 5.06e-81 . . . . 11337 1 22 no SP Q9Y3V2 . "RecName: Full=RWD domain-containing protein 3; AltName: Full=RWD domain-containing sumoylation enhancer; Short=RSUME" . . . . . 94.53 267 98.35 98.35 3.07e-80 . . . . 11337 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'RWD domain' . 11337 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 . 11337 1 2 . SER . 11337 1 3 . SER . 11337 1 4 . GLY . 11337 1 5 . SER . 11337 1 6 . SER . 11337 1 7 . GLY . 11337 1 8 . MET . 11337 1 9 . ALA . 11337 1 10 . GLU . 11337 1 11 . PRO . 11337 1 12 . VAL . 11337 1 13 . GLN . 11337 1 14 . GLU . 11337 1 15 . GLU . 11337 1 16 . LEU . 11337 1 17 . SER . 11337 1 18 . VAL . 11337 1 19 . LEU . 11337 1 20 . ALA . 11337 1 21 . ALA . 11337 1 22 . ILE . 11337 1 23 . PHE . 11337 1 24 . CYS . 11337 1 25 . ARG . 11337 1 26 . PRO . 11337 1 27 . HIS . 11337 1 28 . GLU . 11337 1 29 . TRP . 11337 1 30 . GLU . 11337 1 31 . VAL . 11337 1 32 . LEU . 11337 1 33 . SER . 11337 1 34 . ARG . 11337 1 35 . SER . 11337 1 36 . GLU . 11337 1 37 . THR . 11337 1 38 . ASP . 11337 1 39 . GLY . 11337 1 40 . THR . 11337 1 41 . VAL . 11337 1 42 . PHE . 11337 1 43 . ARG . 11337 1 44 . ILE . 11337 1 45 . HIS . 11337 1 46 . THR . 11337 1 47 . LYS . 11337 1 48 . ALA . 11337 1 49 . GLU . 11337 1 50 . GLY . 11337 1 51 . PHE . 11337 1 52 . MET . 11337 1 53 . ASP . 11337 1 54 . ALA . 11337 1 55 . ASP . 11337 1 56 . ILE . 11337 1 57 . PRO . 11337 1 58 . LEU . 11337 1 59 . GLU . 11337 1 60 . LEU . 11337 1 61 . VAL . 11337 1 62 . PHE . 11337 1 63 . HIS . 11337 1 64 . LEU . 11337 1 65 . PRO . 11337 1 66 . VAL . 11337 1 67 . ASN . 11337 1 68 . TYR . 11337 1 69 . PRO . 11337 1 70 . SER . 11337 1 71 . CYS . 11337 1 72 . LEU . 11337 1 73 . PRO . 11337 1 74 . GLY . 11337 1 75 . ILE . 11337 1 76 . SER . 11337 1 77 . ILE . 11337 1 78 . ASN . 11337 1 79 . SER . 11337 1 80 . GLU . 11337 1 81 . GLN . 11337 1 82 . LEU . 11337 1 83 . THR . 11337 1 84 . ARG . 11337 1 85 . ALA . 11337 1 86 . GLN . 11337 1 87 . CYS . 11337 1 88 . VAL . 11337 1 89 . THR . 11337 1 90 . VAL . 11337 1 91 . LYS . 11337 1 92 . GLU . 11337 1 93 . LYS . 11337 1 94 . LEU . 11337 1 95 . LEU . 11337 1 96 . GLU . 11337 1 97 . GLN . 11337 1 98 . ALA . 11337 1 99 . GLU . 11337 1 100 . SER . 11337 1 101 . LEU . 11337 1 102 . LEU . 11337 1 103 . SER . 11337 1 104 . GLU . 11337 1 105 . PRO . 11337 1 106 . MET . 11337 1 107 . VAL . 11337 1 108 . HIS . 11337 1 109 . GLU . 11337 1 110 . LEU . 11337 1 111 . VAL . 11337 1 112 . LEU . 11337 1 113 . TRP . 11337 1 114 . ILE . 11337 1 115 . GLN . 11337 1 116 . GLN . 11337 1 117 . ASN . 11337 1 118 . LEU . 11337 1 119 . ARG . 11337 1 120 . HIS . 11337 1 121 . ILE . 11337 1 122 . LEU . 11337 1 123 . SER . 11337 1 124 . GLN . 11337 1 125 . PRO . 11337 1 126 . GLU . 11337 1 127 . THR . 11337 1 128 . GLY . 11337 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 11337 1 . SER 2 2 11337 1 . SER 3 3 11337 1 . GLY 4 4 11337 1 . SER 5 5 11337 1 . SER 6 6 11337 1 . GLY 7 7 11337 1 . MET 8 8 11337 1 . ALA 9 9 11337 1 . GLU 10 10 11337 1 . PRO 11 11 11337 1 . VAL 12 12 11337 1 . GLN 13 13 11337 1 . GLU 14 14 11337 1 . GLU 15 15 11337 1 . LEU 16 16 11337 1 . SER 17 17 11337 1 . VAL 18 18 11337 1 . LEU 19 19 11337 1 . ALA 20 20 11337 1 . ALA 21 21 11337 1 . ILE 22 22 11337 1 . PHE 23 23 11337 1 . CYS 24 24 11337 1 . ARG 25 25 11337 1 . PRO 26 26 11337 1 . HIS 27 27 11337 1 . GLU 28 28 11337 1 . TRP 29 29 11337 1 . GLU 30 30 11337 1 . VAL 31 31 11337 1 . LEU 32 32 11337 1 . SER 33 33 11337 1 . ARG 34 34 11337 1 . SER 35 35 11337 1 . GLU 36 36 11337 1 . THR 37 37 11337 1 . ASP 38 38 11337 1 . GLY 39 39 11337 1 . THR 40 40 11337 1 . VAL 41 41 11337 1 . PHE 42 42 11337 1 . ARG 43 43 11337 1 . ILE 44 44 11337 1 . HIS 45 45 11337 1 . THR 46 46 11337 1 . LYS 47 47 11337 1 . ALA 48 48 11337 1 . GLU 49 49 11337 1 . GLY 50 50 11337 1 . PHE 51 51 11337 1 . MET 52 52 11337 1 . ASP 53 53 11337 1 . ALA 54 54 11337 1 . ASP 55 55 11337 1 . ILE 56 56 11337 1 . PRO 57 57 11337 1 . LEU 58 58 11337 1 . GLU 59 59 11337 1 . LEU 60 60 11337 1 . VAL 61 61 11337 1 . PHE 62 62 11337 1 . HIS 63 63 11337 1 . LEU 64 64 11337 1 . PRO 65 65 11337 1 . VAL 66 66 11337 1 . ASN 67 67 11337 1 . TYR 68 68 11337 1 . PRO 69 69 11337 1 . SER 70 70 11337 1 . CYS 71 71 11337 1 . LEU 72 72 11337 1 . PRO 73 73 11337 1 . GLY 74 74 11337 1 . ILE 75 75 11337 1 . SER 76 76 11337 1 . ILE 77 77 11337 1 . ASN 78 78 11337 1 . SER 79 79 11337 1 . GLU 80 80 11337 1 . GLN 81 81 11337 1 . LEU 82 82 11337 1 . THR 83 83 11337 1 . ARG 84 84 11337 1 . ALA 85 85 11337 1 . GLN 86 86 11337 1 . CYS 87 87 11337 1 . VAL 88 88 11337 1 . THR 89 89 11337 1 . VAL 90 90 11337 1 . LYS 91 91 11337 1 . GLU 92 92 11337 1 . LYS 93 93 11337 1 . LEU 94 94 11337 1 . LEU 95 95 11337 1 . GLU 96 96 11337 1 . GLN 97 97 11337 1 . ALA 98 98 11337 1 . GLU 99 99 11337 1 . SER 100 100 11337 1 . LEU 101 101 11337 1 . LEU 102 102 11337 1 . SER 103 103 11337 1 . GLU 104 104 11337 1 . PRO 105 105 11337 1 . MET 106 106 11337 1 . VAL 107 107 11337 1 . HIS 108 108 11337 1 . GLU 109 109 11337 1 . LEU 110 110 11337 1 . VAL 111 111 11337 1 . LEU 112 112 11337 1 . TRP 113 113 11337 1 . ILE 114 114 11337 1 . GLN 115 115 11337 1 . GLN 116 116 11337 1 . ASN 117 117 11337 1 . LEU 118 118 11337 1 . ARG 119 119 11337 1 . HIS 120 120 11337 1 . ILE 121 121 11337 1 . LEU 122 122 11337 1 . SER 123 123 11337 1 . GLN 124 124 11337 1 . PRO 125 125 11337 1 . GLU 126 126 11337 1 . THR 127 127 11337 1 . GLY 128 128 11337 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 11337 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11337 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 11337 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'cell free synthesis' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . plasmid . . P060313-08 . . . . . . 11337 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11337 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.63mM RWD domain {U-15N,13C;} 20mM d-Tris-HCl(pH {7.0);} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 90% H2O, 10% D2O ; _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 'RWD domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 0.63 . . mM . . . . 11337 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11337 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11337 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11337 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11337 1 6 H2O . . . . . . solvent 90 . . % . . . . 11337 1 7 D2O . . . . . . solvent 10 . . % . . . . 11337 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 11337 _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' 120 0.1 mM 11337 1 pH 7.0 0.05 pH 11337 1 pressure 1 0.001 atm 11337 1 temperature 296 0.1 K 11337 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11337 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11337 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11337 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11337 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20030801 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11337 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11337 2 stop_ save_ save_NMRVIEW _Software.Sf_category software _Software.Sf_framecode NMRVIEW _Software.Entry_ID 11337 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B. A.' . . 11337 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11337 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11337 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9820 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11337 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11337 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11337 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11337 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11337 5 'structure solution' 11337 5 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 11337 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11337 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 800 . . . 11337 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 11337 _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 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11337 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11337 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 11337 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; 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 0.0 . indirect 0.251449530 . . . . . . . . . 11337 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11337 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11337 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11337 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11337 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11337 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XWINNMR . . 11337 1 2 $NMRPipe . . 11337 1 3 $NMRVIEW . . 11337 1 4 $Kujira . . 11337 1 5 $CYANA . . 11337 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 6 6 SER C C 13 175.048 0.300 . 1 . . . . 6 SER C . 11337 1 2 . 1 1 7 7 GLY H H 1 8.480 0.030 . 1 . . . . 7 GLY H . 11337 1 3 . 1 1 7 7 GLY HA2 H 1 3.970 0.030 . 1 . . . . 7 GLY HA2 . 11337 1 4 . 1 1 7 7 GLY HA3 H 1 3.970 0.030 . 1 . . . . 7 GLY HA3 . 11337 1 5 . 1 1 7 7 GLY C C 13 174.028 0.300 . 1 . . . . 7 GLY C . 11337 1 6 . 1 1 7 7 GLY CA C 13 45.372 0.300 . 1 . . . . 7 GLY CA . 11337 1 7 . 1 1 7 7 GLY N N 15 110.776 0.300 . 1 . . . . 7 GLY N . 11337 1 8 . 1 1 8 8 MET H H 1 8.133 0.030 . 1 . . . . 8 MET H . 11337 1 9 . 1 1 8 8 MET HA H 1 4.514 0.030 . 1 . . . . 8 MET HA . 11337 1 10 . 1 1 8 8 MET HB2 H 1 2.072 0.030 . 2 . . . . 8 MET HB2 . 11337 1 11 . 1 1 8 8 MET HB3 H 1 2.004 0.030 . 2 . . . . 8 MET HB3 . 11337 1 12 . 1 1 8 8 MET HE1 H 1 2.107 0.030 . 1 . . . . 8 MET HE . 11337 1 13 . 1 1 8 8 MET HE2 H 1 2.107 0.030 . 1 . . . . 8 MET HE . 11337 1 14 . 1 1 8 8 MET HE3 H 1 2.107 0.030 . 1 . . . . 8 MET HE . 11337 1 15 . 1 1 8 8 MET HG2 H 1 2.561 0.030 . 1 . . . . 8 MET HG2 . 11337 1 16 . 1 1 8 8 MET HG3 H 1 2.561 0.030 . 1 . . . . 8 MET HG3 . 11337 1 17 . 1 1 8 8 MET C C 13 175.885 0.300 . 1 . . . . 8 MET C . 11337 1 18 . 1 1 8 8 MET CA C 13 55.111 0.300 . 1 . . . . 8 MET CA . 11337 1 19 . 1 1 8 8 MET CB C 13 33.386 0.300 . 1 . . . . 8 MET CB . 11337 1 20 . 1 1 8 8 MET CE C 13 17.246 0.300 . 1 . . . . 8 MET CE . 11337 1 21 . 1 1 8 8 MET CG C 13 31.944 0.300 . 1 . . . . 8 MET CG . 11337 1 22 . 1 1 8 8 MET N N 15 119.586 0.300 . 1 . . . . 8 MET N . 11337 1 23 . 1 1 9 9 ALA H H 1 8.553 0.030 . 1 . . . . 9 ALA H . 11337 1 24 . 1 1 9 9 ALA HA H 1 4.356 0.030 . 1 . . . . 9 ALA HA . 11337 1 25 . 1 1 9 9 ALA HB1 H 1 1.472 0.030 . 1 . . . . 9 ALA HB . 11337 1 26 . 1 1 9 9 ALA HB2 H 1 1.472 0.030 . 1 . . . . 9 ALA HB . 11337 1 27 . 1 1 9 9 ALA HB3 H 1 1.472 0.030 . 1 . . . . 9 ALA HB . 11337 1 28 . 1 1 9 9 ALA C C 13 177.997 0.300 . 1 . . . . 9 ALA C . 11337 1 29 . 1 1 9 9 ALA CA C 13 52.572 0.300 . 1 . . . . 9 ALA CA . 11337 1 30 . 1 1 9 9 ALA CB C 13 19.525 0.300 . 1 . . . . 9 ALA CB . 11337 1 31 . 1 1 9 9 ALA N N 15 125.998 0.300 . 1 . . . . 9 ALA N . 11337 1 32 . 1 1 10 10 GLU H H 1 8.757 0.030 . 1 . . . . 10 GLU H . 11337 1 33 . 1 1 10 10 GLU HA H 1 4.485 0.030 . 1 . . . . 10 GLU HA . 11337 1 34 . 1 1 10 10 GLU HB2 H 1 2.179 0.030 . 2 . . . . 10 GLU HB2 . 11337 1 35 . 1 1 10 10 GLU HB3 H 1 2.052 0.030 . 2 . . . . 10 GLU HB3 . 11337 1 36 . 1 1 10 10 GLU HG2 H 1 2.398 0.030 . 2 . . . . 10 GLU HG2 . 11337 1 37 . 1 1 10 10 GLU HG3 H 1 2.334 0.030 . 2 . . . . 10 GLU HG3 . 11337 1 38 . 1 1 10 10 GLU CA C 13 57.245 0.300 . 1 . . . . 10 GLU CA . 11337 1 39 . 1 1 10 10 GLU CB C 13 28.852 0.300 . 1 . . . . 10 GLU CB . 11337 1 40 . 1 1 10 10 GLU CG C 13 36.562 0.300 . 1 . . . . 10 GLU CG . 11337 1 41 . 1 1 10 10 GLU N N 15 122.437 0.300 . 1 . . . . 10 GLU N . 11337 1 42 . 1 1 11 11 PRO HA H 1 4.435 0.030 . 1 . . . . 11 PRO HA . 11337 1 43 . 1 1 11 11 PRO HB2 H 1 2.408 0.030 . 2 . . . . 11 PRO HB2 . 11337 1 44 . 1 1 11 11 PRO HB3 H 1 1.908 0.030 . 2 . . . . 11 PRO HB3 . 11337 1 45 . 1 1 11 11 PRO HD2 H 1 3.837 0.030 . 1 . . . . 11 PRO HD2 . 11337 1 46 . 1 1 11 11 PRO HD3 H 1 3.837 0.030 . 1 . . . . 11 PRO HD3 . 11337 1 47 . 1 1 11 11 PRO HG2 H 1 2.127 0.030 . 2 . . . . 11 PRO HG2 . 11337 1 48 . 1 1 11 11 PRO HG3 H 1 2.066 0.030 . 2 . . . . 11 PRO HG3 . 11337 1 49 . 1 1 11 11 PRO C C 13 176.965 0.300 . 1 . . . . 11 PRO C . 11337 1 50 . 1 1 11 11 PRO CA C 13 65.318 0.300 . 1 . . . . 11 PRO CA . 11337 1 51 . 1 1 11 11 PRO CB C 13 31.945 0.300 . 1 . . . . 11 PRO CB . 11337 1 52 . 1 1 11 11 PRO CD C 13 50.680 0.300 . 1 . . . . 11 PRO CD . 11337 1 53 . 1 1 11 11 PRO CG C 13 27.944 0.300 . 1 . . . . 11 PRO CG . 11337 1 54 . 1 1 12 12 VAL H H 1 8.152 0.030 . 1 . . . . 12 VAL H . 11337 1 55 . 1 1 12 12 VAL HA H 1 4.062 0.030 . 1 . . . . 12 VAL HA . 11337 1 56 . 1 1 12 12 VAL HB H 1 2.357 0.030 . 1 . . . . 12 VAL HB . 11337 1 57 . 1 1 12 12 VAL HG11 H 1 1.137 0.030 . 1 . . . . 12 VAL HG1 . 11337 1 58 . 1 1 12 12 VAL HG12 H 1 1.137 0.030 . 1 . . . . 12 VAL HG1 . 11337 1 59 . 1 1 12 12 VAL HG13 H 1 1.137 0.030 . 1 . . . . 12 VAL HG1 . 11337 1 60 . 1 1 12 12 VAL HG21 H 1 1.250 0.030 . 1 . . . . 12 VAL HG2 . 11337 1 61 . 1 1 12 12 VAL HG22 H 1 1.250 0.030 . 1 . . . . 12 VAL HG2 . 11337 1 62 . 1 1 12 12 VAL HG23 H 1 1.250 0.030 . 1 . . . . 12 VAL HG2 . 11337 1 63 . 1 1 12 12 VAL C C 13 177.001 0.300 . 1 . . . . 12 VAL C . 11337 1 64 . 1 1 12 12 VAL CA C 13 65.735 0.300 . 1 . . . . 12 VAL CA . 11337 1 65 . 1 1 12 12 VAL CB C 13 31.733 0.300 . 1 . . . . 12 VAL CB . 11337 1 66 . 1 1 12 12 VAL CG1 C 13 21.260 0.300 . 2 . . . . 12 VAL CG1 . 11337 1 67 . 1 1 12 12 VAL CG2 C 13 23.415 0.300 . 2 . . . . 12 VAL CG2 . 11337 1 68 . 1 1 12 12 VAL N N 15 119.744 0.300 . 1 . . . . 12 VAL N . 11337 1 69 . 1 1 13 13 GLN H H 1 8.036 0.030 . 1 . . . . 13 GLN H . 11337 1 70 . 1 1 13 13 GLN HA H 1 4.066 0.030 . 1 . . . . 13 GLN HA . 11337 1 71 . 1 1 13 13 GLN HB2 H 1 2.189 0.030 . 1 . . . . 13 GLN HB2 . 11337 1 72 . 1 1 13 13 GLN HB3 H 1 2.189 0.030 . 1 . . . . 13 GLN HB3 . 11337 1 73 . 1 1 13 13 GLN HE21 H 1 7.574 0.030 . 2 . . . . 13 GLN HE21 . 11337 1 74 . 1 1 13 13 GLN HE22 H 1 6.924 0.030 . 2 . . . . 13 GLN HE22 . 11337 1 75 . 1 1 13 13 GLN HG2 H 1 2.425 0.030 . 1 . . . . 13 GLN HG2 . 11337 1 76 . 1 1 13 13 GLN HG3 H 1 2.425 0.030 . 1 . . . . 13 GLN HG3 . 11337 1 77 . 1 1 13 13 GLN C C 13 178.944 0.300 . 1 . . . . 13 GLN C . 11337 1 78 . 1 1 13 13 GLN CA C 13 58.762 0.300 . 1 . . . . 13 GLN CA . 11337 1 79 . 1 1 13 13 GLN CB C 13 28.458 0.300 . 1 . . . . 13 GLN CB . 11337 1 80 . 1 1 13 13 GLN CG C 13 33.990 0.300 . 1 . . . . 13 GLN CG . 11337 1 81 . 1 1 13 13 GLN N N 15 120.291 0.300 . 1 . . . . 13 GLN N . 11337 1 82 . 1 1 13 13 GLN NE2 N 15 112.748 0.300 . 1 . . . . 13 GLN NE2 . 11337 1 83 . 1 1 14 14 GLU H H 1 8.232 0.030 . 1 . . . . 14 GLU H . 11337 1 84 . 1 1 14 14 GLU HA H 1 4.107 0.030 . 1 . . . . 14 GLU HA . 11337 1 85 . 1 1 14 14 GLU HB2 H 1 2.075 0.030 . 1 . . . . 14 GLU HB2 . 11337 1 86 . 1 1 14 14 GLU HB3 H 1 2.075 0.030 . 1 . . . . 14 GLU HB3 . 11337 1 87 . 1 1 14 14 GLU HG2 H 1 2.304 0.030 . 2 . . . . 14 GLU HG2 . 11337 1 88 . 1 1 14 14 GLU HG3 H 1 2.251 0.030 . 2 . . . . 14 GLU HG3 . 11337 1 89 . 1 1 14 14 GLU C C 13 178.143 0.300 . 1 . . . . 14 GLU C . 11337 1 90 . 1 1 14 14 GLU CA C 13 59.002 0.300 . 1 . . . . 14 GLU CA . 11337 1 91 . 1 1 14 14 GLU CB C 13 29.366 0.300 . 1 . . . . 14 GLU CB . 11337 1 92 . 1 1 14 14 GLU CG C 13 36.071 0.300 . 1 . . . . 14 GLU CG . 11337 1 93 . 1 1 14 14 GLU N N 15 119.520 0.300 . 1 . . . . 14 GLU N . 11337 1 94 . 1 1 15 15 GLU H H 1 8.005 0.030 . 1 . . . . 15 GLU H . 11337 1 95 . 1 1 15 15 GLU HA H 1 4.009 0.030 . 1 . . . . 15 GLU HA . 11337 1 96 . 1 1 15 15 GLU HB2 H 1 2.395 0.030 . 2 . . . . 15 GLU HB2 . 11337 1 97 . 1 1 15 15 GLU HB3 H 1 2.096 0.030 . 2 . . . . 15 GLU HB3 . 11337 1 98 . 1 1 15 15 GLU HG2 H 1 2.253 0.030 . 2 . . . . 15 GLU HG2 . 11337 1 99 . 1 1 15 15 GLU HG3 H 1 2.190 0.030 . 2 . . . . 15 GLU HG3 . 11337 1 100 . 1 1 15 15 GLU C C 13 178.215 0.300 . 1 . . . . 15 GLU C . 11337 1 101 . 1 1 15 15 GLU CA C 13 60.070 0.300 . 1 . . . . 15 GLU CA . 11337 1 102 . 1 1 15 15 GLU CB C 13 29.254 0.300 . 1 . . . . 15 GLU CB . 11337 1 103 . 1 1 15 15 GLU CG C 13 36.344 0.300 . 1 . . . . 15 GLU CG . 11337 1 104 . 1 1 15 15 GLU N N 15 122.225 0.300 . 1 . . . . 15 GLU N . 11337 1 105 . 1 1 16 16 LEU H H 1 8.415 0.030 . 1 . . . . 16 LEU H . 11337 1 106 . 1 1 16 16 LEU HA H 1 3.800 0.030 . 1 . . . . 16 LEU HA . 11337 1 107 . 1 1 16 16 LEU HB2 H 1 1.944 0.030 . 2 . . . . 16 LEU HB2 . 11337 1 108 . 1 1 16 16 LEU HB3 H 1 1.517 0.030 . 2 . . . . 16 LEU HB3 . 11337 1 109 . 1 1 16 16 LEU HD11 H 1 0.945 0.030 . 1 . . . . 16 LEU HD1 . 11337 1 110 . 1 1 16 16 LEU HD12 H 1 0.945 0.030 . 1 . . . . 16 LEU HD1 . 11337 1 111 . 1 1 16 16 LEU HD13 H 1 0.945 0.030 . 1 . . . . 16 LEU HD1 . 11337 1 112 . 1 1 16 16 LEU HD21 H 1 0.754 0.030 . 1 . . . . 16 LEU HD2 . 11337 1 113 . 1 1 16 16 LEU HD22 H 1 0.754 0.030 . 1 . . . . 16 LEU HD2 . 11337 1 114 . 1 1 16 16 LEU HD23 H 1 0.754 0.030 . 1 . . . . 16 LEU HD2 . 11337 1 115 . 1 1 16 16 LEU HG H 1 1.958 0.030 . 1 . . . . 16 LEU HG . 11337 1 116 . 1 1 16 16 LEU C C 13 179.405 0.300 . 1 . . . . 16 LEU C . 11337 1 117 . 1 1 16 16 LEU CA C 13 58.510 0.300 . 1 . . . . 16 LEU CA . 11337 1 118 . 1 1 16 16 LEU CB C 13 41.246 0.300 . 1 . . . . 16 LEU CB . 11337 1 119 . 1 1 16 16 LEU CD1 C 13 26.021 0.300 . 2 . . . . 16 LEU CD1 . 11337 1 120 . 1 1 16 16 LEU CD2 C 13 23.692 0.300 . 2 . . . . 16 LEU CD2 . 11337 1 121 . 1 1 16 16 LEU CG C 13 27.319 0.300 . 1 . . . . 16 LEU CG . 11337 1 122 . 1 1 16 16 LEU N N 15 117.086 0.300 . 1 . . . . 16 LEU N . 11337 1 123 . 1 1 17 17 SER H H 1 7.793 0.030 . 1 . . . . 17 SER H . 11337 1 124 . 1 1 17 17 SER HA H 1 4.032 0.030 . 1 . . . . 17 SER HA . 11337 1 125 . 1 1 17 17 SER HB2 H 1 3.968 0.030 . 2 . . . . 17 SER HB2 . 11337 1 126 . 1 1 17 17 SER HB3 H 1 3.919 0.030 . 2 . . . . 17 SER HB3 . 11337 1 127 . 1 1 17 17 SER C C 13 176.977 0.300 . 1 . . . . 17 SER C . 11337 1 128 . 1 1 17 17 SER CA C 13 61.575 0.300 . 1 . . . . 17 SER CA . 11337 1 129 . 1 1 17 17 SER CB C 13 62.753 0.300 . 1 . . . . 17 SER CB . 11337 1 130 . 1 1 17 17 SER N N 15 114.963 0.300 . 1 . . . . 17 SER N . 11337 1 131 . 1 1 18 18 VAL H H 1 7.885 0.030 . 1 . . . . 18 VAL H . 11337 1 132 . 1 1 18 18 VAL HA H 1 3.529 0.030 . 1 . . . . 18 VAL HA . 11337 1 133 . 1 1 18 18 VAL HB H 1 2.136 0.030 . 1 . . . . 18 VAL HB . 11337 1 134 . 1 1 18 18 VAL HG11 H 1 0.779 0.030 . 1 . . . . 18 VAL HG1 . 11337 1 135 . 1 1 18 18 VAL HG12 H 1 0.779 0.030 . 1 . . . . 18 VAL HG1 . 11337 1 136 . 1 1 18 18 VAL HG13 H 1 0.779 0.030 . 1 . . . . 18 VAL HG1 . 11337 1 137 . 1 1 18 18 VAL HG21 H 1 0.963 0.030 . 1 . . . . 18 VAL HG2 . 11337 1 138 . 1 1 18 18 VAL HG22 H 1 0.963 0.030 . 1 . . . . 18 VAL HG2 . 11337 1 139 . 1 1 18 18 VAL HG23 H 1 0.963 0.030 . 1 . . . . 18 VAL HG2 . 11337 1 140 . 1 1 18 18 VAL C C 13 178.628 0.300 . 1 . . . . 18 VAL C . 11337 1 141 . 1 1 18 18 VAL CA C 13 66.185 0.300 . 1 . . . . 18 VAL CA . 11337 1 142 . 1 1 18 18 VAL CB C 13 31.723 0.300 . 1 . . . . 18 VAL CB . 11337 1 143 . 1 1 18 18 VAL CG1 C 13 21.010 0.300 . 2 . . . . 18 VAL CG1 . 11337 1 144 . 1 1 18 18 VAL CG2 C 13 22.811 0.300 . 2 . . . . 18 VAL CG2 . 11337 1 145 . 1 1 18 18 VAL N N 15 124.549 0.300 . 1 . . . . 18 VAL N . 11337 1 146 . 1 1 19 19 LEU H H 1 8.251 0.030 . 1 . . . . 19 LEU H . 11337 1 147 . 1 1 19 19 LEU HA H 1 3.600 0.030 . 1 . . . . 19 LEU HA . 11337 1 148 . 1 1 19 19 LEU HB2 H 1 1.295 0.030 . 2 . . . . 19 LEU HB2 . 11337 1 149 . 1 1 19 19 LEU HB3 H 1 0.834 0.030 . 2 . . . . 19 LEU HB3 . 11337 1 150 . 1 1 19 19 LEU HD11 H 1 0.747 0.030 . 1 . . . . 19 LEU HD1 . 11337 1 151 . 1 1 19 19 LEU HD12 H 1 0.747 0.030 . 1 . . . . 19 LEU HD1 . 11337 1 152 . 1 1 19 19 LEU HD13 H 1 0.747 0.030 . 1 . . . . 19 LEU HD1 . 11337 1 153 . 1 1 19 19 LEU HD21 H 1 0.858 0.030 . 1 . . . . 19 LEU HD2 . 11337 1 154 . 1 1 19 19 LEU HD22 H 1 0.858 0.030 . 1 . . . . 19 LEU HD2 . 11337 1 155 . 1 1 19 19 LEU HD23 H 1 0.858 0.030 . 1 . . . . 19 LEU HD2 . 11337 1 156 . 1 1 19 19 LEU HG H 1 1.893 0.030 . 1 . . . . 19 LEU HG . 11337 1 157 . 1 1 19 19 LEU C C 13 177.960 0.300 . 1 . . . . 19 LEU C . 11337 1 158 . 1 1 19 19 LEU CA C 13 57.488 0.300 . 1 . . . . 19 LEU CA . 11337 1 159 . 1 1 19 19 LEU CB C 13 42.275 0.300 . 1 . . . . 19 LEU CB . 11337 1 160 . 1 1 19 19 LEU CD1 C 13 26.548 0.300 . 2 . . . . 19 LEU CD1 . 11337 1 161 . 1 1 19 19 LEU CD2 C 13 22.303 0.300 . 2 . . . . 19 LEU CD2 . 11337 1 162 . 1 1 19 19 LEU CG C 13 26.512 0.300 . 1 . . . . 19 LEU CG . 11337 1 163 . 1 1 19 19 LEU N N 15 119.563 0.300 . 1 . . . . 19 LEU N . 11337 1 164 . 1 1 20 20 ALA H H 1 7.013 0.030 . 1 . . . . 20 ALA H . 11337 1 165 . 1 1 20 20 ALA HA H 1 2.552 0.030 . 1 . . . . 20 ALA HA . 11337 1 166 . 1 1 20 20 ALA HB1 H 1 0.779 0.030 . 1 . . . . 20 ALA HB . 11337 1 167 . 1 1 20 20 ALA HB2 H 1 0.779 0.030 . 1 . . . . 20 ALA HB . 11337 1 168 . 1 1 20 20 ALA HB3 H 1 0.779 0.030 . 1 . . . . 20 ALA HB . 11337 1 169 . 1 1 20 20 ALA C C 13 178.470 0.300 . 1 . . . . 20 ALA C . 11337 1 170 . 1 1 20 20 ALA CA C 13 54.002 0.300 . 1 . . . . 20 ALA CA . 11337 1 171 . 1 1 20 20 ALA CB C 13 17.521 0.300 . 1 . . . . 20 ALA CB . 11337 1 172 . 1 1 20 20 ALA N N 15 118.875 0.300 . 1 . . . . 20 ALA N . 11337 1 173 . 1 1 21 21 ALA H H 1 6.775 0.030 . 1 . . . . 21 ALA H . 11337 1 174 . 1 1 21 21 ALA HA H 1 3.981 0.030 . 1 . . . . 21 ALA HA . 11337 1 175 . 1 1 21 21 ALA HB1 H 1 1.326 0.030 . 1 . . . . 21 ALA HB . 11337 1 176 . 1 1 21 21 ALA HB2 H 1 1.326 0.030 . 1 . . . . 21 ALA HB . 11337 1 177 . 1 1 21 21 ALA HB3 H 1 1.326 0.030 . 1 . . . . 21 ALA HB . 11337 1 178 . 1 1 21 21 ALA C C 13 179.696 0.300 . 1 . . . . 21 ALA C . 11337 1 179 . 1 1 21 21 ALA CA C 13 53.367 0.300 . 1 . . . . 21 ALA CA . 11337 1 180 . 1 1 21 21 ALA CB C 13 18.295 0.300 . 1 . . . . 21 ALA CB . 11337 1 181 . 1 1 21 21 ALA N N 15 116.594 0.300 . 1 . . . . 21 ALA N . 11337 1 182 . 1 1 22 22 ILE H H 1 7.461 0.030 . 1 . . . . 22 ILE H . 11337 1 183 . 1 1 22 22 ILE HA H 1 3.511 0.030 . 1 . . . . 22 ILE HA . 11337 1 184 . 1 1 22 22 ILE HB H 1 1.182 0.030 . 1 . . . . 22 ILE HB . 11337 1 185 . 1 1 22 22 ILE HD11 H 1 0.160 0.030 . 1 . . . . 22 ILE HD1 . 11337 1 186 . 1 1 22 22 ILE HD12 H 1 0.160 0.030 . 1 . . . . 22 ILE HD1 . 11337 1 187 . 1 1 22 22 ILE HD13 H 1 0.160 0.030 . 1 . . . . 22 ILE HD1 . 11337 1 188 . 1 1 22 22 ILE HG12 H 1 1.373 0.030 . 2 . . . . 22 ILE HG12 . 11337 1 189 . 1 1 22 22 ILE HG13 H 1 0.663 0.030 . 2 . . . . 22 ILE HG13 . 11337 1 190 . 1 1 22 22 ILE HG21 H 1 -0.134 0.030 . 1 . . . . 22 ILE HG2 . 11337 1 191 . 1 1 22 22 ILE HG22 H 1 -0.134 0.030 . 1 . . . . 22 ILE HG2 . 11337 1 192 . 1 1 22 22 ILE HG23 H 1 -0.134 0.030 . 1 . . . . 22 ILE HG2 . 11337 1 193 . 1 1 22 22 ILE C C 13 177.997 0.300 . 1 . . . . 22 ILE C . 11337 1 194 . 1 1 22 22 ILE CA C 13 63.939 0.300 . 1 . . . . 22 ILE CA . 11337 1 195 . 1 1 22 22 ILE CB C 13 39.085 0.300 . 1 . . . . 22 ILE CB . 11337 1 196 . 1 1 22 22 ILE CD1 C 13 12.868 0.300 . 1 . . . . 22 ILE CD1 . 11337 1 197 . 1 1 22 22 ILE CG1 C 13 27.776 0.300 . 1 . . . . 22 ILE CG1 . 11337 1 198 . 1 1 22 22 ILE CG2 C 13 15.960 0.300 . 1 . . . . 22 ILE CG2 . 11337 1 199 . 1 1 22 22 ILE N N 15 119.278 0.300 . 1 . . . . 22 ILE N . 11337 1 200 . 1 1 23 23 PHE H H 1 8.214 0.030 . 1 . . . . 23 PHE H . 11337 1 201 . 1 1 23 23 PHE HA H 1 4.739 0.030 . 1 . . . . 23 PHE HA . 11337 1 202 . 1 1 23 23 PHE HB2 H 1 3.359 0.030 . 2 . . . . 23 PHE HB2 . 11337 1 203 . 1 1 23 23 PHE HB3 H 1 2.881 0.030 . 2 . . . . 23 PHE HB3 . 11337 1 204 . 1 1 23 23 PHE HD1 H 1 7.375 0.030 . 1 . . . . 23 PHE HD1 . 11337 1 205 . 1 1 23 23 PHE HD2 H 1 7.375 0.030 . 1 . . . . 23 PHE HD2 . 11337 1 206 . 1 1 23 23 PHE HE1 H 1 7.247 0.030 . 1 . . . . 23 PHE HE1 . 11337 1 207 . 1 1 23 23 PHE HE2 H 1 7.247 0.030 . 1 . . . . 23 PHE HE2 . 11337 1 208 . 1 1 23 23 PHE HZ H 1 7.239 0.030 . 1 . . . . 23 PHE HZ . 11337 1 209 . 1 1 23 23 PHE C C 13 175.375 0.300 . 1 . . . . 23 PHE C . 11337 1 210 . 1 1 23 23 PHE CA C 13 57.885 0.300 . 1 . . . . 23 PHE CA . 11337 1 211 . 1 1 23 23 PHE CB C 13 36.844 0.300 . 1 . . . . 23 PHE CB . 11337 1 212 . 1 1 23 23 PHE CD1 C 13 132.260 0.300 . 1 . . . . 23 PHE CD1 . 11337 1 213 . 1 1 23 23 PHE CD2 C 13 132.260 0.300 . 1 . . . . 23 PHE CD2 . 11337 1 214 . 1 1 23 23 PHE CE1 C 13 130.491 0.300 . 1 . . . . 23 PHE CE1 . 11337 1 215 . 1 1 23 23 PHE CE2 C 13 130.491 0.300 . 1 . . . . 23 PHE CE2 . 11337 1 216 . 1 1 23 23 PHE CZ C 13 128.654 0.300 . 1 . . . . 23 PHE CZ . 11337 1 217 . 1 1 23 23 PHE N N 15 123.052 0.300 . 1 . . . . 23 PHE N . 11337 1 218 . 1 1 24 24 CYS H H 1 7.017 0.030 . 1 . . . . 24 CYS H . 11337 1 219 . 1 1 24 24 CYS HA H 1 4.767 0.030 . 1 . . . . 24 CYS HA . 11337 1 220 . 1 1 24 24 CYS HB2 H 1 3.273 0.030 . 2 . . . . 24 CYS HB2 . 11337 1 221 . 1 1 24 24 CYS HB3 H 1 2.802 0.030 . 2 . . . . 24 CYS HB3 . 11337 1 222 . 1 1 24 24 CYS C C 13 176.383 0.300 . 1 . . . . 24 CYS C . 11337 1 223 . 1 1 24 24 CYS CA C 13 57.081 0.300 . 1 . . . . 24 CYS CA . 11337 1 224 . 1 1 24 24 CYS CB C 13 28.851 0.300 . 1 . . . . 24 CYS CB . 11337 1 225 . 1 1 24 24 CYS N N 15 110.161 0.300 . 1 . . . . 24 CYS N . 11337 1 226 . 1 1 25 25 ARG H H 1 8.737 0.030 . 1 . . . . 25 ARG H . 11337 1 227 . 1 1 25 25 ARG HA H 1 4.623 0.030 . 1 . . . . 25 ARG HA . 11337 1 228 . 1 1 25 25 ARG HB2 H 1 1.984 0.030 . 2 . . . . 25 ARG HB2 . 11337 1 229 . 1 1 25 25 ARG HB3 H 1 1.665 0.030 . 2 . . . . 25 ARG HB3 . 11337 1 230 . 1 1 25 25 ARG HD2 H 1 3.325 0.030 . 2 . . . . 25 ARG HD2 . 11337 1 231 . 1 1 25 25 ARG HD3 H 1 3.246 0.030 . 2 . . . . 25 ARG HD3 . 11337 1 232 . 1 1 25 25 ARG HG2 H 1 1.857 0.030 . 2 . . . . 25 ARG HG2 . 11337 1 233 . 1 1 25 25 ARG HG3 H 1 1.787 0.030 . 2 . . . . 25 ARG HG3 . 11337 1 234 . 1 1 25 25 ARG C C 13 174.756 0.300 . 1 . . . . 25 ARG C . 11337 1 235 . 1 1 25 25 ARG CA C 13 55.656 0.300 . 1 . . . . 25 ARG CA . 11337 1 236 . 1 1 25 25 ARG CB C 13 27.469 0.300 . 1 . . . . 25 ARG CB . 11337 1 237 . 1 1 25 25 ARG CD C 13 43.200 0.300 . 1 . . . . 25 ARG CD . 11337 1 238 . 1 1 25 25 ARG CG C 13 28.113 0.300 . 1 . . . . 25 ARG CG . 11337 1 239 . 1 1 25 25 ARG N N 15 126.591 0.300 . 1 . . . . 25 ARG N . 11337 1 240 . 1 1 26 26 PRO HA H 1 4.217 0.030 . 1 . . . . 26 PRO HA . 11337 1 241 . 1 1 26 26 PRO HB2 H 1 2.095 0.030 . 2 . . . . 26 PRO HB2 . 11337 1 242 . 1 1 26 26 PRO HB3 H 1 1.772 0.030 . 2 . . . . 26 PRO HB3 . 11337 1 243 . 1 1 26 26 PRO HD2 H 1 3.902 0.030 . 2 . . . . 26 PRO HD2 . 11337 1 244 . 1 1 26 26 PRO HD3 H 1 3.645 0.030 . 2 . . . . 26 PRO HD3 . 11337 1 245 . 1 1 26 26 PRO HG2 H 1 2.175 0.030 . 2 . . . . 26 PRO HG2 . 11337 1 246 . 1 1 26 26 PRO HG3 H 1 2.029 0.030 . 2 . . . . 26 PRO HG3 . 11337 1 247 . 1 1 26 26 PRO C C 13 177.208 0.300 . 1 . . . . 26 PRO C . 11337 1 248 . 1 1 26 26 PRO CA C 13 65.209 0.300 . 1 . . . . 26 PRO CA . 11337 1 249 . 1 1 26 26 PRO CB C 13 31.489 0.300 . 1 . . . . 26 PRO CB . 11337 1 250 . 1 1 26 26 PRO CD C 13 50.308 0.300 . 1 . . . . 26 PRO CD . 11337 1 251 . 1 1 26 26 PRO CG C 13 27.963 0.300 . 1 . . . . 26 PRO CG . 11337 1 252 . 1 1 27 27 HIS H H 1 8.766 0.030 . 1 . . . . 27 HIS H . 11337 1 253 . 1 1 27 27 HIS HA H 1 4.359 0.030 . 1 . . . . 27 HIS HA . 11337 1 254 . 1 1 27 27 HIS HB2 H 1 3.441 0.030 . 2 . . . . 27 HIS HB2 . 11337 1 255 . 1 1 27 27 HIS HB3 H 1 3.276 0.030 . 2 . . . . 27 HIS HB3 . 11337 1 256 . 1 1 27 27 HIS HD2 H 1 6.931 0.030 . 1 . . . . 27 HIS HD2 . 11337 1 257 . 1 1 27 27 HIS C C 13 175.557 0.300 . 1 . . . . 27 HIS C . 11337 1 258 . 1 1 27 27 HIS CA C 13 57.749 0.300 . 1 . . . . 27 HIS CA . 11337 1 259 . 1 1 27 27 HIS CB C 13 28.045 0.300 . 1 . . . . 27 HIS CB . 11337 1 260 . 1 1 27 27 HIS CD2 C 13 120.440 0.300 . 1 . . . . 27 HIS CD2 . 11337 1 261 . 1 1 27 27 HIS N N 15 115.497 0.300 . 1 . . . . 27 HIS N . 11337 1 262 . 1 1 28 28 GLU H H 1 8.030 0.030 . 1 . . . . 28 GLU H . 11337 1 263 . 1 1 28 28 GLU HA H 1 4.496 0.030 . 1 . . . . 28 GLU HA . 11337 1 264 . 1 1 28 28 GLU HB2 H 1 2.426 0.030 . 2 . . . . 28 GLU HB2 . 11337 1 265 . 1 1 28 28 GLU HB3 H 1 2.318 0.030 . 2 . . . . 28 GLU HB3 . 11337 1 266 . 1 1 28 28 GLU HG2 H 1 2.573 0.030 . 2 . . . . 28 GLU HG2 . 11337 1 267 . 1 1 28 28 GLU HG3 H 1 2.383 0.030 . 2 . . . . 28 GLU HG3 . 11337 1 268 . 1 1 28 28 GLU C C 13 175.048 0.300 . 1 . . . . 28 GLU C . 11337 1 269 . 1 1 28 28 GLU CA C 13 59.781 0.300 . 1 . . . . 28 GLU CA . 11337 1 270 . 1 1 28 28 GLU CB C 13 31.880 0.300 . 1 . . . . 28 GLU CB . 11337 1 271 . 1 1 28 28 GLU CG C 13 38.388 0.300 . 1 . . . . 28 GLU CG . 11337 1 272 . 1 1 28 28 GLU N N 15 119.290 0.300 . 1 . . . . 28 GLU N . 11337 1 273 . 1 1 29 29 TRP H H 1 7.778 0.030 . 1 . . . . 29 TRP H . 11337 1 274 . 1 1 29 29 TRP HA H 1 5.478 0.030 . 1 . . . . 29 TRP HA . 11337 1 275 . 1 1 29 29 TRP HB2 H 1 3.713 0.030 . 2 . . . . 29 TRP HB2 . 11337 1 276 . 1 1 29 29 TRP HB3 H 1 3.238 0.030 . 2 . . . . 29 TRP HB3 . 11337 1 277 . 1 1 29 29 TRP HD1 H 1 7.087 0.030 . 1 . . . . 29 TRP HD1 . 11337 1 278 . 1 1 29 29 TRP HE1 H 1 9.561 0.030 . 1 . . . . 29 TRP HE1 . 11337 1 279 . 1 1 29 29 TRP HE3 H 1 7.360 0.030 . 1 . . . . 29 TRP HE3 . 11337 1 280 . 1 1 29 29 TRP HH2 H 1 5.763 0.030 . 1 . . . . 29 TRP HH2 . 11337 1 281 . 1 1 29 29 TRP HZ2 H 1 6.798 0.030 . 1 . . . . 29 TRP HZ2 . 11337 1 282 . 1 1 29 29 TRP HZ3 H 1 6.361 0.030 . 1 . . . . 29 TRP HZ3 . 11337 1 283 . 1 1 29 29 TRP C C 13 175.703 0.300 . 1 . . . . 29 TRP C . 11337 1 284 . 1 1 29 29 TRP CA C 13 56.118 0.300 . 1 . . . . 29 TRP CA . 11337 1 285 . 1 1 29 29 TRP CB C 13 33.501 0.300 . 1 . . . . 29 TRP CB . 11337 1 286 . 1 1 29 29 TRP CD1 C 13 125.814 0.300 . 1 . . . . 29 TRP CD1 . 11337 1 287 . 1 1 29 29 TRP CE3 C 13 119.128 0.300 . 1 . . . . 29 TRP CE3 . 11337 1 288 . 1 1 29 29 TRP CH2 C 13 123.968 0.300 . 1 . . . . 29 TRP CH2 . 11337 1 289 . 1 1 29 29 TRP CZ2 C 13 113.185 0.300 . 1 . . . . 29 TRP CZ2 . 11337 1 290 . 1 1 29 29 TRP CZ3 C 13 122.472 0.300 . 1 . . . . 29 TRP CZ3 . 11337 1 291 . 1 1 29 29 TRP N N 15 116.977 0.300 . 1 . . . . 29 TRP N . 11337 1 292 . 1 1 29 29 TRP NE1 N 15 127.765 0.300 . 1 . . . . 29 TRP NE1 . 11337 1 293 . 1 1 30 30 GLU H H 1 7.684 0.030 . 1 . . . . 30 GLU H . 11337 1 294 . 1 1 30 30 GLU HA H 1 4.064 0.030 . 1 . . . . 30 GLU HA . 11337 1 295 . 1 1 30 30 GLU HB2 H 1 1.881 0.030 . 2 . . . . 30 GLU HB2 . 11337 1 296 . 1 1 30 30 GLU HB3 H 1 1.712 0.030 . 2 . . . . 30 GLU HB3 . 11337 1 297 . 1 1 30 30 GLU HG2 H 1 2.152 0.030 . 2 . . . . 30 GLU HG2 . 11337 1 298 . 1 1 30 30 GLU HG3 H 1 1.878 0.030 . 2 . . . . 30 GLU HG3 . 11337 1 299 . 1 1 30 30 GLU C C 13 174.076 0.300 . 1 . . . . 30 GLU C . 11337 1 300 . 1 1 30 30 GLU CA C 13 55.904 0.300 . 1 . . . . 30 GLU CA . 11337 1 301 . 1 1 30 30 GLU CB C 13 33.689 0.300 . 1 . . . . 30 GLU CB . 11337 1 302 . 1 1 30 30 GLU CG C 13 35.794 0.300 . 1 . . . . 30 GLU CG . 11337 1 303 . 1 1 30 30 GLU N N 15 125.490 0.300 . 1 . . . . 30 GLU N . 11337 1 304 . 1 1 31 31 VAL H H 1 8.775 0.030 . 1 . . . . 31 VAL H . 11337 1 305 . 1 1 31 31 VAL HA H 1 3.812 0.030 . 1 . . . . 31 VAL HA . 11337 1 306 . 1 1 31 31 VAL HB H 1 1.946 0.030 . 1 . . . . 31 VAL HB . 11337 1 307 . 1 1 31 31 VAL HG11 H 1 0.875 0.030 . 1 . . . . 31 VAL HG1 . 11337 1 308 . 1 1 31 31 VAL HG12 H 1 0.875 0.030 . 1 . . . . 31 VAL HG1 . 11337 1 309 . 1 1 31 31 VAL HG13 H 1 0.875 0.030 . 1 . . . . 31 VAL HG1 . 11337 1 310 . 1 1 31 31 VAL HG21 H 1 0.860 0.030 . 1 . . . . 31 VAL HG2 . 11337 1 311 . 1 1 31 31 VAL HG22 H 1 0.860 0.030 . 1 . . . . 31 VAL HG2 . 11337 1 312 . 1 1 31 31 VAL HG23 H 1 0.860 0.030 . 1 . . . . 31 VAL HG2 . 11337 1 313 . 1 1 31 31 VAL C C 13 175.910 0.300 . 1 . . . . 31 VAL C . 11337 1 314 . 1 1 31 31 VAL CA C 13 63.273 0.300 . 1 . . . . 31 VAL CA . 11337 1 315 . 1 1 31 31 VAL CB C 13 31.465 0.300 . 1 . . . . 31 VAL CB . 11337 1 316 . 1 1 31 31 VAL CG1 C 13 21.612 0.300 . 2 . . . . 31 VAL CG1 . 11337 1 317 . 1 1 31 31 VAL CG2 C 13 21.390 0.300 . 2 . . . . 31 VAL CG2 . 11337 1 318 . 1 1 31 31 VAL N N 15 126.844 0.300 . 1 . . . . 31 VAL N . 11337 1 319 . 1 1 32 32 LEU H H 1 9.147 0.030 . 1 . . . . 32 LEU H . 11337 1 320 . 1 1 32 32 LEU HA H 1 4.286 0.030 . 1 . . . . 32 LEU HA . 11337 1 321 . 1 1 32 32 LEU HB2 H 1 1.434 0.030 . 2 . . . . 32 LEU HB2 . 11337 1 322 . 1 1 32 32 LEU HB3 H 1 1.345 0.030 . 2 . . . . 32 LEU HB3 . 11337 1 323 . 1 1 32 32 LEU HD11 H 1 0.669 0.030 . 1 . . . . 32 LEU HD1 . 11337 1 324 . 1 1 32 32 LEU HD12 H 1 0.669 0.030 . 1 . . . . 32 LEU HD1 . 11337 1 325 . 1 1 32 32 LEU HD13 H 1 0.669 0.030 . 1 . . . . 32 LEU HD1 . 11337 1 326 . 1 1 32 32 LEU HD21 H 1 0.624 0.030 . 1 . . . . 32 LEU HD2 . 11337 1 327 . 1 1 32 32 LEU HD22 H 1 0.624 0.030 . 1 . . . . 32 LEU HD2 . 11337 1 328 . 1 1 32 32 LEU HD23 H 1 0.624 0.030 . 1 . . . . 32 LEU HD2 . 11337 1 329 . 1 1 32 32 LEU HG H 1 1.411 0.030 . 1 . . . . 32 LEU HG . 11337 1 330 . 1 1 32 32 LEU C C 13 177.451 0.300 . 1 . . . . 32 LEU C . 11337 1 331 . 1 1 32 32 LEU CA C 13 56.202 0.300 . 1 . . . . 32 LEU CA . 11337 1 332 . 1 1 32 32 LEU CB C 13 41.979 0.300 . 1 . . . . 32 LEU CB . 11337 1 333 . 1 1 32 32 LEU CD1 C 13 25.023 0.300 . 2 . . . . 32 LEU CD1 . 11337 1 334 . 1 1 32 32 LEU CD2 C 13 22.432 0.300 . 2 . . . . 32 LEU CD2 . 11337 1 335 . 1 1 32 32 LEU CG C 13 27.667 0.300 . 1 . . . . 32 LEU CG . 11337 1 336 . 1 1 32 32 LEU N N 15 130.003 0.300 . 1 . . . . 32 LEU N . 11337 1 337 . 1 1 33 33 SER H H 1 7.897 0.030 . 1 . . . . 33 SER H . 11337 1 338 . 1 1 33 33 SER HA H 1 4.496 0.030 . 1 . . . . 33 SER HA . 11337 1 339 . 1 1 33 33 SER HB2 H 1 3.717 0.030 . 1 . . . . 33 SER HB2 . 11337 1 340 . 1 1 33 33 SER HB3 H 1 3.717 0.030 . 1 . . . . 33 SER HB3 . 11337 1 341 . 1 1 33 33 SER C C 13 172.378 0.300 . 1 . . . . 33 SER C . 11337 1 342 . 1 1 33 33 SER CA C 13 58.242 0.300 . 1 . . . . 33 SER CA . 11337 1 343 . 1 1 33 33 SER CB C 13 64.131 0.300 . 1 . . . . 33 SER CB . 11337 1 344 . 1 1 33 33 SER N N 15 110.964 0.300 . 1 . . . . 33 SER N . 11337 1 345 . 1 1 34 34 ARG H H 1 8.434 0.030 . 1 . . . . 34 ARG H . 11337 1 346 . 1 1 34 34 ARG HA H 1 4.789 0.030 . 1 . . . . 34 ARG HA . 11337 1 347 . 1 1 34 34 ARG HB2 H 1 1.772 0.030 . 2 . . . . 34 ARG HB2 . 11337 1 348 . 1 1 34 34 ARG HB3 H 1 1.639 0.030 . 2 . . . . 34 ARG HB3 . 11337 1 349 . 1 1 34 34 ARG HD2 H 1 3.148 0.030 . 1 . . . . 34 ARG HD2 . 11337 1 350 . 1 1 34 34 ARG HD3 H 1 3.148 0.030 . 1 . . . . 34 ARG HD3 . 11337 1 351 . 1 1 34 34 ARG HG2 H 1 1.621 0.030 . 2 . . . . 34 ARG HG2 . 11337 1 352 . 1 1 34 34 ARG HG3 H 1 1.543 0.030 . 2 . . . . 34 ARG HG3 . 11337 1 353 . 1 1 34 34 ARG C C 13 174.684 0.300 . 1 . . . . 34 ARG C . 11337 1 354 . 1 1 34 34 ARG CA C 13 56.093 0.300 . 1 . . . . 34 ARG CA . 11337 1 355 . 1 1 34 34 ARG CB C 13 32.906 0.300 . 1 . . . . 34 ARG CB . 11337 1 356 . 1 1 34 34 ARG CD C 13 43.788 0.300 . 1 . . . . 34 ARG CD . 11337 1 357 . 1 1 34 34 ARG CG C 13 27.195 0.300 . 1 . . . . 34 ARG CG . 11337 1 358 . 1 1 34 34 ARG N N 15 121.424 0.300 . 1 . . . . 34 ARG N . 11337 1 359 . 1 1 35 35 SER H H 1 8.166 0.030 . 1 . . . . 35 SER H . 11337 1 360 . 1 1 35 35 SER HA H 1 4.831 0.030 . 1 . . . . 35 SER HA . 11337 1 361 . 1 1 35 35 SER HB2 H 1 4.138 0.030 . 2 . . . . 35 SER HB2 . 11337 1 362 . 1 1 35 35 SER HB3 H 1 3.783 0.030 . 2 . . . . 35 SER HB3 . 11337 1 363 . 1 1 35 35 SER C C 13 175.873 0.300 . 1 . . . . 35 SER C . 11337 1 364 . 1 1 35 35 SER CA C 13 56.256 0.300 . 1 . . . . 35 SER CA . 11337 1 365 . 1 1 35 35 SER CB C 13 64.280 0.300 . 1 . . . . 35 SER CB . 11337 1 366 . 1 1 35 35 SER N N 15 117.534 0.300 . 1 . . . . 35 SER N . 11337 1 367 . 1 1 36 36 GLU HA H 1 4.192 0.030 . 1 . . . . 36 GLU HA . 11337 1 368 . 1 1 36 36 GLU HB2 H 1 2.155 0.030 . 2 . . . . 36 GLU HB2 . 11337 1 369 . 1 1 36 36 GLU HB3 H 1 2.093 0.030 . 2 . . . . 36 GLU HB3 . 11337 1 370 . 1 1 36 36 GLU HG2 H 1 2.398 0.030 . 2 . . . . 36 GLU HG2 . 11337 1 371 . 1 1 36 36 GLU HG3 H 1 2.337 0.030 . 2 . . . . 36 GLU HG3 . 11337 1 372 . 1 1 36 36 GLU C C 13 176.334 0.300 . 1 . . . . 36 GLU C . 11337 1 373 . 1 1 36 36 GLU CA C 13 58.615 0.300 . 1 . . . . 36 GLU CA . 11337 1 374 . 1 1 36 36 GLU CB C 13 29.828 0.300 . 1 . . . . 36 GLU CB . 11337 1 375 . 1 1 36 36 GLU CG C 13 36.539 0.300 . 1 . . . . 36 GLU CG . 11337 1 376 . 1 1 37 37 THR H H 1 7.868 0.030 . 1 . . . . 37 THR H . 11337 1 377 . 1 1 37 37 THR HA H 1 4.438 0.030 . 1 . . . . 37 THR HA . 11337 1 378 . 1 1 37 37 THR HB H 1 4.129 0.030 . 1 . . . . 37 THR HB . 11337 1 379 . 1 1 37 37 THR HG21 H 1 1.190 0.030 . 1 . . . . 37 THR HG2 . 11337 1 380 . 1 1 37 37 THR HG22 H 1 1.190 0.030 . 1 . . . . 37 THR HG2 . 11337 1 381 . 1 1 37 37 THR HG23 H 1 1.190 0.030 . 1 . . . . 37 THR HG2 . 11337 1 382 . 1 1 37 37 THR C C 13 176.213 0.300 . 1 . . . . 37 THR C . 11337 1 383 . 1 1 37 37 THR CA C 13 62.639 0.300 . 1 . . . . 37 THR CA . 11337 1 384 . 1 1 37 37 THR CB C 13 69.380 0.300 . 1 . . . . 37 THR CB . 11337 1 385 . 1 1 37 37 THR CG2 C 13 22.015 0.300 . 1 . . . . 37 THR CG2 . 11337 1 386 . 1 1 37 37 THR N N 15 107.107 0.300 . 1 . . . . 37 THR N . 11337 1 387 . 1 1 38 38 ASP H H 1 8.178 0.030 . 1 . . . . 38 ASP H . 11337 1 388 . 1 1 38 38 ASP HA H 1 4.940 0.030 . 1 . . . . 38 ASP HA . 11337 1 389 . 1 1 38 38 ASP HB2 H 1 2.777 0.030 . 2 . . . . 38 ASP HB2 . 11337 1 390 . 1 1 38 38 ASP HB3 H 1 2.380 0.030 . 2 . . . . 38 ASP HB3 . 11337 1 391 . 1 1 38 38 ASP C C 13 176.107 0.300 . 1 . . . . 38 ASP C . 11337 1 392 . 1 1 38 38 ASP CA C 13 54.761 0.300 . 1 . . . . 38 ASP CA . 11337 1 393 . 1 1 38 38 ASP CB C 13 42.277 0.300 . 1 . . . . 38 ASP CB . 11337 1 394 . 1 1 38 38 ASP N N 15 119.828 0.300 . 1 . . . . 38 ASP N . 11337 1 395 . 1 1 39 39 GLY H H 1 7.722 0.030 . 1 . . . . 39 GLY H . 11337 1 396 . 1 1 39 39 GLY HA2 H 1 4.925 0.030 . 2 . . . . 39 GLY HA2 . 11337 1 397 . 1 1 39 39 GLY HA3 H 1 3.922 0.030 . 2 . . . . 39 GLY HA3 . 11337 1 398 . 1 1 39 39 GLY C C 13 175.023 0.300 . 1 . . . . 39 GLY C . 11337 1 399 . 1 1 39 39 GLY CA C 13 44.683 0.300 . 1 . . . . 39 GLY CA . 11337 1 400 . 1 1 39 39 GLY N N 15 108.643 0.300 . 1 . . . . 39 GLY N . 11337 1 401 . 1 1 40 40 THR H H 1 8.239 0.030 . 1 . . . . 40 THR H . 11337 1 402 . 1 1 40 40 THR HA H 1 5.122 0.030 . 1 . . . . 40 THR HA . 11337 1 403 . 1 1 40 40 THR HB H 1 3.901 0.030 . 1 . . . . 40 THR HB . 11337 1 404 . 1 1 40 40 THR HG21 H 1 1.440 0.030 . 1 . . . . 40 THR HG2 . 11337 1 405 . 1 1 40 40 THR HG22 H 1 1.440 0.030 . 1 . . . . 40 THR HG2 . 11337 1 406 . 1 1 40 40 THR HG23 H 1 1.440 0.030 . 1 . . . . 40 THR HG2 . 11337 1 407 . 1 1 40 40 THR C C 13 172.523 0.300 . 1 . . . . 40 THR C . 11337 1 408 . 1 1 40 40 THR CA C 13 62.612 0.300 . 1 . . . . 40 THR CA . 11337 1 409 . 1 1 40 40 THR CB C 13 71.945 0.300 . 1 . . . . 40 THR CB . 11337 1 410 . 1 1 40 40 THR CG2 C 13 21.780 0.300 . 1 . . . . 40 THR CG2 . 11337 1 411 . 1 1 40 40 THR N N 15 119.273 0.300 . 1 . . . . 40 THR N . 11337 1 412 . 1 1 41 41 VAL H H 1 8.885 0.030 . 1 . . . . 41 VAL H . 11337 1 413 . 1 1 41 41 VAL HA H 1 5.382 0.030 . 1 . . . . 41 VAL HA . 11337 1 414 . 1 1 41 41 VAL HB H 1 1.847 0.030 . 1 . . . . 41 VAL HB . 11337 1 415 . 1 1 41 41 VAL HG11 H 1 0.629 0.030 . 1 . . . . 41 VAL HG1 . 11337 1 416 . 1 1 41 41 VAL HG12 H 1 0.629 0.030 . 1 . . . . 41 VAL HG1 . 11337 1 417 . 1 1 41 41 VAL HG13 H 1 0.629 0.030 . 1 . . . . 41 VAL HG1 . 11337 1 418 . 1 1 41 41 VAL HG21 H 1 0.560 0.030 . 1 . . . . 41 VAL HG2 . 11337 1 419 . 1 1 41 41 VAL HG22 H 1 0.560 0.030 . 1 . . . . 41 VAL HG2 . 11337 1 420 . 1 1 41 41 VAL HG23 H 1 0.560 0.030 . 1 . . . . 41 VAL HG2 . 11337 1 421 . 1 1 41 41 VAL C C 13 175.655 0.300 . 1 . . . . 41 VAL C . 11337 1 422 . 1 1 41 41 VAL CA C 13 60.336 0.300 . 1 . . . . 41 VAL CA . 11337 1 423 . 1 1 41 41 VAL CB C 13 33.492 0.300 . 1 . . . . 41 VAL CB . 11337 1 424 . 1 1 41 41 VAL CG1 C 13 21.475 0.300 . 2 . . . . 41 VAL CG1 . 11337 1 425 . 1 1 41 41 VAL CG2 C 13 21.133 0.300 . 2 . . . . 41 VAL CG2 . 11337 1 426 . 1 1 41 41 VAL N N 15 127.516 0.300 . 1 . . . . 41 VAL N . 11337 1 427 . 1 1 42 42 PHE H H 1 8.733 0.030 . 1 . . . . 42 PHE H . 11337 1 428 . 1 1 42 42 PHE HA H 1 5.098 0.030 . 1 . . . . 42 PHE HA . 11337 1 429 . 1 1 42 42 PHE HB2 H 1 2.535 0.030 . 2 . . . . 42 PHE HB2 . 11337 1 430 . 1 1 42 42 PHE HB3 H 1 2.317 0.030 . 2 . . . . 42 PHE HB3 . 11337 1 431 . 1 1 42 42 PHE HD1 H 1 6.708 0.030 . 1 . . . . 42 PHE HD1 . 11337 1 432 . 1 1 42 42 PHE HD2 H 1 6.708 0.030 . 1 . . . . 42 PHE HD2 . 11337 1 433 . 1 1 42 42 PHE HE1 H 1 7.018 0.030 . 1 . . . . 42 PHE HE1 . 11337 1 434 . 1 1 42 42 PHE HE2 H 1 7.018 0.030 . 1 . . . . 42 PHE HE2 . 11337 1 435 . 1 1 42 42 PHE HZ H 1 6.800 0.030 . 1 . . . . 42 PHE HZ . 11337 1 436 . 1 1 42 42 PHE C C 13 170.557 0.300 . 1 . . . . 42 PHE C . 11337 1 437 . 1 1 42 42 PHE CA C 13 55.343 0.300 . 1 . . . . 42 PHE CA . 11337 1 438 . 1 1 42 42 PHE CB C 13 42.341 0.300 . 1 . . . . 42 PHE CB . 11337 1 439 . 1 1 42 42 PHE CD1 C 13 132.951 0.300 . 1 . . . . 42 PHE CD1 . 11337 1 440 . 1 1 42 42 PHE CD2 C 13 132.951 0.300 . 1 . . . . 42 PHE CD2 . 11337 1 441 . 1 1 42 42 PHE CE1 C 13 130.185 0.300 . 1 . . . . 42 PHE CE1 . 11337 1 442 . 1 1 42 42 PHE CE2 C 13 130.185 0.300 . 1 . . . . 42 PHE CE2 . 11337 1 443 . 1 1 42 42 PHE CZ C 13 128.908 0.300 . 1 . . . . 42 PHE CZ . 11337 1 444 . 1 1 42 42 PHE N N 15 123.328 0.300 . 1 . . . . 42 PHE N . 11337 1 445 . 1 1 43 43 ARG H H 1 9.032 0.030 . 1 . . . . 43 ARG H . 11337 1 446 . 1 1 43 43 ARG HA H 1 5.514 0.030 . 1 . . . . 43 ARG HA . 11337 1 447 . 1 1 43 43 ARG HB2 H 1 1.604 0.030 . 2 . . . . 43 ARG HB2 . 11337 1 448 . 1 1 43 43 ARG HB3 H 1 1.418 0.030 . 2 . . . . 43 ARG HB3 . 11337 1 449 . 1 1 43 43 ARG HD2 H 1 3.056 0.030 . 2 . . . . 43 ARG HD2 . 11337 1 450 . 1 1 43 43 ARG HD3 H 1 2.912 0.030 . 2 . . . . 43 ARG HD3 . 11337 1 451 . 1 1 43 43 ARG HG2 H 1 1.331 0.030 . 2 . . . . 43 ARG HG2 . 11337 1 452 . 1 1 43 43 ARG HG3 H 1 1.192 0.030 . 2 . . . . 43 ARG HG3 . 11337 1 453 . 1 1 43 43 ARG C C 13 174.259 0.300 . 1 . . . . 43 ARG C . 11337 1 454 . 1 1 43 43 ARG CA C 13 53.552 0.300 . 1 . . . . 43 ARG CA . 11337 1 455 . 1 1 43 43 ARG CB C 13 35.121 0.300 . 1 . . . . 43 ARG CB . 11337 1 456 . 1 1 43 43 ARG CD C 13 43.701 0.300 . 1 . . . . 43 ARG CD . 11337 1 457 . 1 1 43 43 ARG CG C 13 26.539 0.300 . 1 . . . . 43 ARG CG . 11337 1 458 . 1 1 43 43 ARG N N 15 119.695 0.300 . 1 . . . . 43 ARG N . 11337 1 459 . 1 1 44 44 ILE H H 1 9.195 0.030 . 1 . . . . 44 ILE H . 11337 1 460 . 1 1 44 44 ILE HA H 1 5.169 0.030 . 1 . . . . 44 ILE HA . 11337 1 461 . 1 1 44 44 ILE HB H 1 1.539 0.030 . 1 . . . . 44 ILE HB . 11337 1 462 . 1 1 44 44 ILE HD11 H 1 0.348 0.030 . 1 . . . . 44 ILE HD1 . 11337 1 463 . 1 1 44 44 ILE HD12 H 1 0.348 0.030 . 1 . . . . 44 ILE HD1 . 11337 1 464 . 1 1 44 44 ILE HD13 H 1 0.348 0.030 . 1 . . . . 44 ILE HD1 . 11337 1 465 . 1 1 44 44 ILE HG12 H 1 1.159 0.030 . 2 . . . . 44 ILE HG12 . 11337 1 466 . 1 1 44 44 ILE HG13 H 1 1.919 0.030 . 2 . . . . 44 ILE HG13 . 11337 1 467 . 1 1 44 44 ILE HG21 H 1 0.849 0.030 . 1 . . . . 44 ILE HG2 . 11337 1 468 . 1 1 44 44 ILE HG22 H 1 0.849 0.030 . 1 . . . . 44 ILE HG2 . 11337 1 469 . 1 1 44 44 ILE HG23 H 1 0.849 0.030 . 1 . . . . 44 ILE HG2 . 11337 1 470 . 1 1 44 44 ILE C C 13 175.533 0.300 . 1 . . . . 44 ILE C . 11337 1 471 . 1 1 44 44 ILE CA C 13 59.324 0.300 . 1 . . . . 44 ILE CA . 11337 1 472 . 1 1 44 44 ILE CB C 13 43.287 0.300 . 1 . . . . 44 ILE CB . 11337 1 473 . 1 1 44 44 ILE CD1 C 13 16.475 0.300 . 1 . . . . 44 ILE CD1 . 11337 1 474 . 1 1 44 44 ILE CG1 C 13 28.632 0.300 . 1 . . . . 44 ILE CG1 . 11337 1 475 . 1 1 44 44 ILE CG2 C 13 15.718 0.300 . 1 . . . . 44 ILE CG2 . 11337 1 476 . 1 1 44 44 ILE N N 15 124.867 0.300 . 1 . . . . 44 ILE N . 11337 1 477 . 1 1 45 45 HIS H H 1 8.676 0.030 . 1 . . . . 45 HIS H . 11337 1 478 . 1 1 45 45 HIS HA H 1 5.429 0.030 . 1 . . . . 45 HIS HA . 11337 1 479 . 1 1 45 45 HIS HB2 H 1 3.288 0.030 . 2 . . . . 45 HIS HB2 . 11337 1 480 . 1 1 45 45 HIS HB3 H 1 3.201 0.030 . 2 . . . . 45 HIS HB3 . 11337 1 481 . 1 1 45 45 HIS HD2 H 1 7.094 0.030 . 1 . . . . 45 HIS HD2 . 11337 1 482 . 1 1 45 45 HIS C C 13 174.501 0.300 . 1 . . . . 45 HIS C . 11337 1 483 . 1 1 45 45 HIS CA C 13 55.176 0.300 . 1 . . . . 45 HIS CA . 11337 1 484 . 1 1 45 45 HIS CB C 13 31.382 0.300 . 1 . . . . 45 HIS CB . 11337 1 485 . 1 1 45 45 HIS CD2 C 13 120.115 0.300 . 1 . . . . 45 HIS CD2 . 11337 1 486 . 1 1 45 45 HIS N N 15 126.325 0.300 . 1 . . . . 45 HIS N . 11337 1 487 . 1 1 46 46 THR H H 1 8.760 0.030 . 1 . . . . 46 THR H . 11337 1 488 . 1 1 46 46 THR HA H 1 4.965 0.030 . 1 . . . . 46 THR HA . 11337 1 489 . 1 1 46 46 THR HB H 1 4.057 0.030 . 1 . . . . 46 THR HB . 11337 1 490 . 1 1 46 46 THR HG21 H 1 1.028 0.030 . 1 . . . . 46 THR HG2 . 11337 1 491 . 1 1 46 46 THR HG22 H 1 1.028 0.030 . 1 . . . . 46 THR HG2 . 11337 1 492 . 1 1 46 46 THR HG23 H 1 1.028 0.030 . 1 . . . . 46 THR HG2 . 11337 1 493 . 1 1 46 46 THR C C 13 172.292 0.300 . 1 . . . . 46 THR C . 11337 1 494 . 1 1 46 46 THR CA C 13 58.730 0.300 . 1 . . . . 46 THR CA . 11337 1 495 . 1 1 46 46 THR CB C 13 69.333 0.300 . 1 . . . . 46 THR CB . 11337 1 496 . 1 1 46 46 THR CG2 C 13 17.629 0.300 . 1 . . . . 46 THR CG2 . 11337 1 497 . 1 1 46 46 THR N N 15 117.826 0.300 . 1 . . . . 46 THR N . 11337 1 498 . 1 1 47 47 LYS H H 1 8.880 0.030 . 1 . . . . 47 LYS H . 11337 1 499 . 1 1 47 47 LYS HA H 1 5.324 0.030 . 1 . . . . 47 LYS HA . 11337 1 500 . 1 1 47 47 LYS HB2 H 1 1.690 0.030 . 2 . . . . 47 LYS HB2 . 11337 1 501 . 1 1 47 47 LYS HB3 H 1 1.583 0.030 . 2 . . . . 47 LYS HB3 . 11337 1 502 . 1 1 47 47 LYS HD2 H 1 1.594 0.030 . 2 . . . . 47 LYS HD2 . 11337 1 503 . 1 1 47 47 LYS HD3 H 1 1.538 0.030 . 2 . . . . 47 LYS HD3 . 11337 1 504 . 1 1 47 47 LYS HE2 H 1 2.925 0.030 . 1 . . . . 47 LYS HE2 . 11337 1 505 . 1 1 47 47 LYS HE3 H 1 2.925 0.030 . 1 . . . . 47 LYS HE3 . 11337 1 506 . 1 1 47 47 LYS HG2 H 1 1.341 0.030 . 2 . . . . 47 LYS HG2 . 11337 1 507 . 1 1 47 47 LYS HG3 H 1 1.280 0.030 . 2 . . . . 47 LYS HG3 . 11337 1 508 . 1 1 47 47 LYS C C 13 174.538 0.300 . 1 . . . . 47 LYS C . 11337 1 509 . 1 1 47 47 LYS CA C 13 54.637 0.300 . 1 . . . . 47 LYS CA . 11337 1 510 . 1 1 47 47 LYS CB C 13 35.936 0.300 . 1 . . . . 47 LYS CB . 11337 1 511 . 1 1 47 47 LYS CD C 13 29.552 0.300 . 1 . . . . 47 LYS CD . 11337 1 512 . 1 1 47 47 LYS CE C 13 42.255 0.300 . 1 . . . . 47 LYS CE . 11337 1 513 . 1 1 47 47 LYS CG C 13 24.249 0.300 . 1 . . . . 47 LYS CG . 11337 1 514 . 1 1 47 47 LYS N N 15 121.280 0.300 . 1 . . . . 47 LYS N . 11337 1 515 . 1 1 48 48 ALA H H 1 8.839 0.030 . 1 . . . . 48 ALA H . 11337 1 516 . 1 1 48 48 ALA HA H 1 4.789 0.030 . 1 . . . . 48 ALA HA . 11337 1 517 . 1 1 48 48 ALA HB1 H 1 1.426 0.030 . 1 . . . . 48 ALA HB . 11337 1 518 . 1 1 48 48 ALA HB2 H 1 1.426 0.030 . 1 . . . . 48 ALA HB . 11337 1 519 . 1 1 48 48 ALA HB3 H 1 1.426 0.030 . 1 . . . . 48 ALA HB . 11337 1 520 . 1 1 48 48 ALA C C 13 175.642 0.300 . 1 . . . . 48 ALA C . 11337 1 521 . 1 1 48 48 ALA CA C 13 49.880 0.300 . 1 . . . . 48 ALA CA . 11337 1 522 . 1 1 48 48 ALA CB C 13 24.227 0.300 . 1 . . . . 48 ALA CB . 11337 1 523 . 1 1 48 48 ALA N N 15 122.874 0.300 . 1 . . . . 48 ALA N . 11337 1 524 . 1 1 49 49 GLU H H 1 8.446 0.030 . 1 . . . . 49 GLU H . 11337 1 525 . 1 1 49 49 GLU HA H 1 4.279 0.030 . 1 . . . . 49 GLU HA . 11337 1 526 . 1 1 49 49 GLU HB2 H 1 1.928 0.030 . 1 . . . . 49 GLU HB2 . 11337 1 527 . 1 1 49 49 GLU HB3 H 1 1.928 0.030 . 1 . . . . 49 GLU HB3 . 11337 1 528 . 1 1 49 49 GLU HG2 H 1 2.260 0.030 . 1 . . . . 49 GLU HG2 . 11337 1 529 . 1 1 49 49 GLU HG3 H 1 2.260 0.030 . 1 . . . . 49 GLU HG3 . 11337 1 530 . 1 1 49 49 GLU C C 13 176.893 0.300 . 1 . . . . 49 GLU C . 11337 1 531 . 1 1 49 49 GLU CA C 13 57.200 0.300 . 1 . . . . 49 GLU CA . 11337 1 532 . 1 1 49 49 GLU CB C 13 30.158 0.300 . 1 . . . . 49 GLU CB . 11337 1 533 . 1 1 49 49 GLU CG C 13 36.329 0.300 . 1 . . . . 49 GLU CG . 11337 1 534 . 1 1 49 49 GLU N N 15 121.505 0.300 . 1 . . . . 49 GLU N . 11337 1 535 . 1 1 50 50 GLY H H 1 8.583 0.030 . 1 . . . . 50 GLY H . 11337 1 536 . 1 1 50 50 GLY HA2 H 1 4.059 0.030 . 2 . . . . 50 GLY HA2 . 11337 1 537 . 1 1 50 50 GLY HA3 H 1 3.615 0.030 . 2 . . . . 50 GLY HA3 . 11337 1 538 . 1 1 50 50 GLY C C 13 173.530 0.300 . 1 . . . . 50 GLY C . 11337 1 539 . 1 1 50 50 GLY CA C 13 44.143 0.300 . 1 . . . . 50 GLY CA . 11337 1 540 . 1 1 50 50 GLY N N 15 111.214 0.300 . 1 . . . . 50 GLY N . 11337 1 541 . 1 1 51 51 PHE H H 1 8.140 0.030 . 1 . . . . 51 PHE H . 11337 1 542 . 1 1 51 51 PHE HA H 1 4.561 0.030 . 1 . . . . 51 PHE HA . 11337 1 543 . 1 1 51 51 PHE HB2 H 1 3.109 0.030 . 2 . . . . 51 PHE HB2 . 11337 1 544 . 1 1 51 51 PHE HB3 H 1 2.977 0.030 . 2 . . . . 51 PHE HB3 . 11337 1 545 . 1 1 51 51 PHE HD1 H 1 7.236 0.030 . 1 . . . . 51 PHE HD1 . 11337 1 546 . 1 1 51 51 PHE HD2 H 1 7.236 0.030 . 1 . . . . 51 PHE HD2 . 11337 1 547 . 1 1 51 51 PHE HE1 H 1 7.314 0.030 . 1 . . . . 51 PHE HE1 . 11337 1 548 . 1 1 51 51 PHE HE2 H 1 7.314 0.030 . 1 . . . . 51 PHE HE2 . 11337 1 549 . 1 1 51 51 PHE HZ H 1 7.234 0.030 . 1 . . . . 51 PHE HZ . 11337 1 550 . 1 1 51 51 PHE C C 13 176.164 0.300 . 1 . . . . 51 PHE C . 11337 1 551 . 1 1 51 51 PHE CA C 13 57.927 0.300 . 1 . . . . 51 PHE CA . 11337 1 552 . 1 1 51 51 PHE CB C 13 39.621 0.300 . 1 . . . . 51 PHE CB . 11337 1 553 . 1 1 51 51 PHE CD1 C 13 131.745 0.300 . 1 . . . . 51 PHE CD1 . 11337 1 554 . 1 1 51 51 PHE CD2 C 13 131.745 0.300 . 1 . . . . 51 PHE CD2 . 11337 1 555 . 1 1 51 51 PHE CE1 C 13 131.703 0.300 . 1 . . . . 51 PHE CE1 . 11337 1 556 . 1 1 51 51 PHE CE2 C 13 131.703 0.300 . 1 . . . . 51 PHE CE2 . 11337 1 557 . 1 1 51 51 PHE CZ C 13 129.940 0.300 . 1 . . . . 51 PHE CZ . 11337 1 558 . 1 1 51 51 PHE N N 15 119.252 0.300 . 1 . . . . 51 PHE N . 11337 1 559 . 1 1 52 52 MET H H 1 8.750 0.030 . 1 . . . . 52 MET H . 11337 1 560 . 1 1 52 52 MET HA H 1 4.217 0.030 . 1 . . . . 52 MET HA . 11337 1 561 . 1 1 52 52 MET HB2 H 1 2.134 0.030 . 2 . . . . 52 MET HB2 . 11337 1 562 . 1 1 52 52 MET HB3 H 1 1.921 0.030 . 2 . . . . 52 MET HB3 . 11337 1 563 . 1 1 52 52 MET HE1 H 1 2.047 0.030 . 1 . . . . 52 MET HE . 11337 1 564 . 1 1 52 52 MET HE2 H 1 2.047 0.030 . 1 . . . . 52 MET HE . 11337 1 565 . 1 1 52 52 MET HE3 H 1 2.047 0.030 . 1 . . . . 52 MET HE . 11337 1 566 . 1 1 52 52 MET HG2 H 1 2.318 0.030 . 2 . . . . 52 MET HG2 . 11337 1 567 . 1 1 52 52 MET HG3 H 1 2.245 0.030 . 2 . . . . 52 MET HG3 . 11337 1 568 . 1 1 52 52 MET C C 13 175.230 0.300 . 1 . . . . 52 MET C . 11337 1 569 . 1 1 52 52 MET CA C 13 55.883 0.300 . 1 . . . . 52 MET CA . 11337 1 570 . 1 1 52 52 MET CB C 13 31.011 0.300 . 1 . . . . 52 MET CB . 11337 1 571 . 1 1 52 52 MET CE C 13 16.776 0.300 . 1 . . . . 52 MET CE . 11337 1 572 . 1 1 52 52 MET CG C 13 32.090 0.300 . 1 . . . . 52 MET CG . 11337 1 573 . 1 1 52 52 MET N N 15 120.607 0.300 . 1 . . . . 52 MET N . 11337 1 574 . 1 1 53 53 ASP H H 1 8.241 0.030 . 1 . . . . 53 ASP H . 11337 1 575 . 1 1 53 53 ASP HA H 1 4.352 0.030 . 1 . . . . 53 ASP HA . 11337 1 576 . 1 1 53 53 ASP HB2 H 1 2.790 0.030 . 2 . . . . 53 ASP HB2 . 11337 1 577 . 1 1 53 53 ASP HB3 H 1 2.726 0.030 . 2 . . . . 53 ASP HB3 . 11337 1 578 . 1 1 53 53 ASP C C 13 174.889 0.300 . 1 . . . . 53 ASP C . 11337 1 579 . 1 1 53 53 ASP CA C 13 55.185 0.300 . 1 . . . . 53 ASP CA . 11337 1 580 . 1 1 53 53 ASP CB C 13 40.321 0.300 . 1 . . . . 53 ASP CB . 11337 1 581 . 1 1 53 53 ASP N N 15 115.932 0.300 . 1 . . . . 53 ASP N . 11337 1 582 . 1 1 54 54 ALA H H 1 7.647 0.030 . 1 . . . . 54 ALA H . 11337 1 583 . 1 1 54 54 ALA HA H 1 4.451 0.030 . 1 . . . . 54 ALA HA . 11337 1 584 . 1 1 54 54 ALA HB1 H 1 1.352 0.030 . 1 . . . . 54 ALA HB . 11337 1 585 . 1 1 54 54 ALA HB2 H 1 1.352 0.030 . 1 . . . . 54 ALA HB . 11337 1 586 . 1 1 54 54 ALA HB3 H 1 1.352 0.030 . 1 . . . . 54 ALA HB . 11337 1 587 . 1 1 54 54 ALA C C 13 176.516 0.300 . 1 . . . . 54 ALA C . 11337 1 588 . 1 1 54 54 ALA CA C 13 51.669 0.300 . 1 . . . . 54 ALA CA . 11337 1 589 . 1 1 54 54 ALA CB C 13 20.350 0.300 . 1 . . . . 54 ALA CB . 11337 1 590 . 1 1 54 54 ALA N N 15 122.189 0.300 . 1 . . . . 54 ALA N . 11337 1 591 . 1 1 55 55 ASP H H 1 8.326 0.030 . 1 . . . . 55 ASP H . 11337 1 592 . 1 1 55 55 ASP HA H 1 4.702 0.030 . 1 . . . . 55 ASP HA . 11337 1 593 . 1 1 55 55 ASP HB2 H 1 2.439 0.030 . 2 . . . . 55 ASP HB2 . 11337 1 594 . 1 1 55 55 ASP HB3 H 1 2.390 0.030 . 2 . . . . 55 ASP HB3 . 11337 1 595 . 1 1 55 55 ASP C C 13 176.018 0.300 . 1 . . . . 55 ASP C . 11337 1 596 . 1 1 55 55 ASP CA C 13 54.156 0.300 . 1 . . . . 55 ASP CA . 11337 1 597 . 1 1 55 55 ASP CB C 13 42.038 0.300 . 1 . . . . 55 ASP CB . 11337 1 598 . 1 1 55 55 ASP N N 15 121.173 0.300 . 1 . . . . 55 ASP N . 11337 1 599 . 1 1 56 56 ILE H H 1 8.823 0.030 . 1 . . . . 56 ILE H . 11337 1 600 . 1 1 56 56 ILE HA H 1 4.505 0.030 . 1 . . . . 56 ILE HA . 11337 1 601 . 1 1 56 56 ILE HB H 1 1.706 0.030 . 1 . . . . 56 ILE HB . 11337 1 602 . 1 1 56 56 ILE HD11 H 1 0.688 0.030 . 1 . . . . 56 ILE HD1 . 11337 1 603 . 1 1 56 56 ILE HD12 H 1 0.688 0.030 . 1 . . . . 56 ILE HD1 . 11337 1 604 . 1 1 56 56 ILE HD13 H 1 0.688 0.030 . 1 . . . . 56 ILE HD1 . 11337 1 605 . 1 1 56 56 ILE HG12 H 1 1.369 0.030 . 2 . . . . 56 ILE HG12 . 11337 1 606 . 1 1 56 56 ILE HG13 H 1 1.108 0.030 . 2 . . . . 56 ILE HG13 . 11337 1 607 . 1 1 56 56 ILE HG21 H 1 0.709 0.030 . 1 . . . . 56 ILE HG2 . 11337 1 608 . 1 1 56 56 ILE HG22 H 1 0.709 0.030 . 1 . . . . 56 ILE HG2 . 11337 1 609 . 1 1 56 56 ILE HG23 H 1 0.709 0.030 . 1 . . . . 56 ILE HG2 . 11337 1 610 . 1 1 56 56 ILE C C 13 173.882 0.300 . 1 . . . . 56 ILE C . 11337 1 611 . 1 1 56 56 ILE CA C 13 57.771 0.300 . 1 . . . . 56 ILE CA . 11337 1 612 . 1 1 56 56 ILE CB C 13 39.848 0.300 . 1 . . . . 56 ILE CB . 11337 1 613 . 1 1 56 56 ILE CD1 C 13 12.843 0.300 . 1 . . . . 56 ILE CD1 . 11337 1 614 . 1 1 56 56 ILE CG1 C 13 27.093 0.300 . 1 . . . . 56 ILE CG1 . 11337 1 615 . 1 1 56 56 ILE CG2 C 13 16.989 0.300 . 1 . . . . 56 ILE CG2 . 11337 1 616 . 1 1 56 56 ILE N N 15 122.546 0.300 . 1 . . . . 56 ILE N . 11337 1 617 . 1 1 57 57 PRO HA H 1 4.769 0.030 . 1 . . . . 57 PRO HA . 11337 1 618 . 1 1 57 57 PRO HB2 H 1 2.306 0.030 . 2 . . . . 57 PRO HB2 . 11337 1 619 . 1 1 57 57 PRO HB3 H 1 2.115 0.030 . 2 . . . . 57 PRO HB3 . 11337 1 620 . 1 1 57 57 PRO HD2 H 1 3.940 0.030 . 2 . . . . 57 PRO HD2 . 11337 1 621 . 1 1 57 57 PRO HD3 H 1 3.562 0.030 . 2 . . . . 57 PRO HD3 . 11337 1 622 . 1 1 57 57 PRO HG2 H 1 2.199 0.030 . 2 . . . . 57 PRO HG2 . 11337 1 623 . 1 1 57 57 PRO HG3 H 1 2.031 0.030 . 2 . . . . 57 PRO HG3 . 11337 1 624 . 1 1 57 57 PRO C C 13 175.606 0.300 . 1 . . . . 57 PRO C . 11337 1 625 . 1 1 57 57 PRO CA C 13 62.436 0.300 . 1 . . . . 57 PRO CA . 11337 1 626 . 1 1 57 57 PRO CB C 13 32.198 0.300 . 1 . . . . 57 PRO CB . 11337 1 627 . 1 1 57 57 PRO CD C 13 51.367 0.300 . 1 . . . . 57 PRO CD . 11337 1 628 . 1 1 57 57 PRO CG C 13 27.543 0.300 . 1 . . . . 57 PRO CG . 11337 1 629 . 1 1 58 58 LEU H H 1 8.754 0.030 . 1 . . . . 58 LEU H . 11337 1 630 . 1 1 58 58 LEU HA H 1 4.768 0.030 . 1 . . . . 58 LEU HA . 11337 1 631 . 1 1 58 58 LEU HB2 H 1 1.440 0.030 . 2 . . . . 58 LEU HB2 . 11337 1 632 . 1 1 58 58 LEU HB3 H 1 1.225 0.030 . 2 . . . . 58 LEU HB3 . 11337 1 633 . 1 1 58 58 LEU HD11 H 1 0.744 0.030 . 1 . . . . 58 LEU HD1 . 11337 1 634 . 1 1 58 58 LEU HD12 H 1 0.744 0.030 . 1 . . . . 58 LEU HD1 . 11337 1 635 . 1 1 58 58 LEU HD13 H 1 0.744 0.030 . 1 . . . . 58 LEU HD1 . 11337 1 636 . 1 1 58 58 LEU HD21 H 1 0.753 0.030 . 1 . . . . 58 LEU HD2 . 11337 1 637 . 1 1 58 58 LEU HD22 H 1 0.753 0.030 . 1 . . . . 58 LEU HD2 . 11337 1 638 . 1 1 58 58 LEU HD23 H 1 0.753 0.030 . 1 . . . . 58 LEU HD2 . 11337 1 639 . 1 1 58 58 LEU HG H 1 1.624 0.030 . 1 . . . . 58 LEU HG . 11337 1 640 . 1 1 58 58 LEU C C 13 173.922 0.300 . 1 . . . . 58 LEU C . 11337 1 641 . 1 1 58 58 LEU CA C 13 54.349 0.300 . 1 . . . . 58 LEU CA . 11337 1 642 . 1 1 58 58 LEU CB C 13 46.819 0.300 . 1 . . . . 58 LEU CB . 11337 1 643 . 1 1 58 58 LEU CD1 C 13 26.775 0.300 . 2 . . . . 58 LEU CD1 . 11337 1 644 . 1 1 58 58 LEU CD2 C 13 24.744 0.300 . 2 . . . . 58 LEU CD2 . 11337 1 645 . 1 1 58 58 LEU CG C 13 26.223 0.300 . 1 . . . . 58 LEU CG . 11337 1 646 . 1 1 58 58 LEU N N 15 122.442 0.300 . 1 . . . . 58 LEU N . 11337 1 647 . 1 1 59 59 GLU H H 1 8.695 0.030 . 1 . . . . 59 GLU H . 11337 1 648 . 1 1 59 59 GLU HA H 1 4.987 0.030 . 1 . . . . 59 GLU HA . 11337 1 649 . 1 1 59 59 GLU HB2 H 1 1.970 0.030 . 2 . . . . 59 GLU HB2 . 11337 1 650 . 1 1 59 59 GLU HB3 H 1 1.845 0.030 . 2 . . . . 59 GLU HB3 . 11337 1 651 . 1 1 59 59 GLU HG2 H 1 1.727 0.030 . 1 . . . . 59 GLU HG2 . 11337 1 652 . 1 1 59 59 GLU HG3 H 1 1.727 0.030 . 1 . . . . 59 GLU HG3 . 11337 1 653 . 1 1 59 59 GLU C C 13 174.708 0.300 . 1 . . . . 59 GLU C . 11337 1 654 . 1 1 59 59 GLU CA C 13 54.506 0.300 . 1 . . . . 59 GLU CA . 11337 1 655 . 1 1 59 59 GLU CB C 13 31.732 0.300 . 1 . . . . 59 GLU CB . 11337 1 656 . 1 1 59 59 GLU CG C 13 36.853 0.300 . 1 . . . . 59 GLU CG . 11337 1 657 . 1 1 59 59 GLU N N 15 123.658 0.300 . 1 . . . . 59 GLU N . 11337 1 658 . 1 1 60 60 LEU H H 1 9.094 0.030 . 1 . . . . 60 LEU H . 11337 1 659 . 1 1 60 60 LEU HA H 1 4.954 0.030 . 1 . . . . 60 LEU HA . 11337 1 660 . 1 1 60 60 LEU HB2 H 1 1.825 0.030 . 2 . . . . 60 LEU HB2 . 11337 1 661 . 1 1 60 60 LEU HB3 H 1 1.156 0.030 . 2 . . . . 60 LEU HB3 . 11337 1 662 . 1 1 60 60 LEU HD11 H 1 0.904 0.030 . 1 . . . . 60 LEU HD1 . 11337 1 663 . 1 1 60 60 LEU HD12 H 1 0.904 0.030 . 1 . . . . 60 LEU HD1 . 11337 1 664 . 1 1 60 60 LEU HD13 H 1 0.904 0.030 . 1 . . . . 60 LEU HD1 . 11337 1 665 . 1 1 60 60 LEU HD21 H 1 0.776 0.030 . 1 . . . . 60 LEU HD2 . 11337 1 666 . 1 1 60 60 LEU HD22 H 1 0.776 0.030 . 1 . . . . 60 LEU HD2 . 11337 1 667 . 1 1 60 60 LEU HD23 H 1 0.776 0.030 . 1 . . . . 60 LEU HD2 . 11337 1 668 . 1 1 60 60 LEU HG H 1 1.515 0.030 . 1 . . . . 60 LEU HG . 11337 1 669 . 1 1 60 60 LEU C C 13 174.684 0.300 . 1 . . . . 60 LEU C . 11337 1 670 . 1 1 60 60 LEU CA C 13 53.552 0.300 . 1 . . . . 60 LEU CA . 11337 1 671 . 1 1 60 60 LEU CB C 13 44.481 0.300 . 1 . . . . 60 LEU CB . 11337 1 672 . 1 1 60 60 LEU CD1 C 13 27.561 0.300 . 2 . . . . 60 LEU CD1 . 11337 1 673 . 1 1 60 60 LEU CD2 C 13 26.163 0.300 . 2 . . . . 60 LEU CD2 . 11337 1 674 . 1 1 60 60 LEU CG C 13 27.598 0.300 . 1 . . . . 60 LEU CG . 11337 1 675 . 1 1 60 60 LEU N N 15 126.052 0.300 . 1 . . . . 60 LEU N . 11337 1 676 . 1 1 61 61 VAL H H 1 8.588 0.030 . 1 . . . . 61 VAL H . 11337 1 677 . 1 1 61 61 VAL HA H 1 4.626 0.030 . 1 . . . . 61 VAL HA . 11337 1 678 . 1 1 61 61 VAL HB H 1 1.725 0.030 . 1 . . . . 61 VAL HB . 11337 1 679 . 1 1 61 61 VAL HG11 H 1 0.517 0.030 . 1 . . . . 61 VAL HG1 . 11337 1 680 . 1 1 61 61 VAL HG12 H 1 0.517 0.030 . 1 . . . . 61 VAL HG1 . 11337 1 681 . 1 1 61 61 VAL HG13 H 1 0.517 0.030 . 1 . . . . 61 VAL HG1 . 11337 1 682 . 1 1 61 61 VAL HG21 H 1 0.647 0.030 . 1 . . . . 61 VAL HG2 . 11337 1 683 . 1 1 61 61 VAL HG22 H 1 0.647 0.030 . 1 . . . . 61 VAL HG2 . 11337 1 684 . 1 1 61 61 VAL HG23 H 1 0.647 0.030 . 1 . . . . 61 VAL HG2 . 11337 1 685 . 1 1 61 61 VAL C C 13 175.897 0.300 . 1 . . . . 61 VAL C . 11337 1 686 . 1 1 61 61 VAL CA C 13 61.113 0.300 . 1 . . . . 61 VAL CA . 11337 1 687 . 1 1 61 61 VAL CB C 13 32.577 0.300 . 1 . . . . 61 VAL CB . 11337 1 688 . 1 1 61 61 VAL CG1 C 13 21.242 0.300 . 2 . . . . 61 VAL CG1 . 11337 1 689 . 1 1 61 61 VAL CG2 C 13 20.875 0.300 . 2 . . . . 61 VAL CG2 . 11337 1 690 . 1 1 61 61 VAL N N 15 123.139 0.300 . 1 . . . . 61 VAL N . 11337 1 691 . 1 1 62 62 PHE H H 1 8.656 0.030 . 1 . . . . 62 PHE H . 11337 1 692 . 1 1 62 62 PHE HA H 1 4.965 0.030 . 1 . . . . 62 PHE HA . 11337 1 693 . 1 1 62 62 PHE HB2 H 1 1.990 0.030 . 2 . . . . 62 PHE HB2 . 11337 1 694 . 1 1 62 62 PHE HB3 H 1 1.430 0.030 . 2 . . . . 62 PHE HB3 . 11337 1 695 . 1 1 62 62 PHE HD1 H 1 6.815 0.030 . 1 . . . . 62 PHE HD1 . 11337 1 696 . 1 1 62 62 PHE HD2 H 1 6.815 0.030 . 1 . . . . 62 PHE HD2 . 11337 1 697 . 1 1 62 62 PHE HE1 H 1 7.020 0.030 . 1 . . . . 62 PHE HE1 . 11337 1 698 . 1 1 62 62 PHE HE2 H 1 7.020 0.030 . 1 . . . . 62 PHE HE2 . 11337 1 699 . 1 1 62 62 PHE HZ H 1 6.956 0.030 . 1 . . . . 62 PHE HZ . 11337 1 700 . 1 1 62 62 PHE C C 13 173.324 0.300 . 1 . . . . 62 PHE C . 11337 1 701 . 1 1 62 62 PHE CA C 13 56.029 0.300 . 1 . . . . 62 PHE CA . 11337 1 702 . 1 1 62 62 PHE CB C 13 42.875 0.300 . 1 . . . . 62 PHE CB . 11337 1 703 . 1 1 62 62 PHE CD1 C 13 132.229 0.300 . 1 . . . . 62 PHE CD1 . 11337 1 704 . 1 1 62 62 PHE CD2 C 13 132.229 0.300 . 1 . . . . 62 PHE CD2 . 11337 1 705 . 1 1 62 62 PHE CE1 C 13 130.713 0.300 . 1 . . . . 62 PHE CE1 . 11337 1 706 . 1 1 62 62 PHE CE2 C 13 130.713 0.300 . 1 . . . . 62 PHE CE2 . 11337 1 707 . 1 1 62 62 PHE CZ C 13 127.681 0.300 . 1 . . . . 62 PHE CZ . 11337 1 708 . 1 1 62 62 PHE N N 15 126.424 0.300 . 1 . . . . 62 PHE N . 11337 1 709 . 1 1 63 63 HIS H H 1 8.912 0.030 . 1 . . . . 63 HIS H . 11337 1 710 . 1 1 63 63 HIS HA H 1 5.270 0.030 . 1 . . . . 63 HIS HA . 11337 1 711 . 1 1 63 63 HIS HB2 H 1 2.857 0.030 . 2 . . . . 63 HIS HB2 . 11337 1 712 . 1 1 63 63 HIS HB3 H 1 2.796 0.030 . 2 . . . . 63 HIS HB3 . 11337 1 713 . 1 1 63 63 HIS HD2 H 1 6.515 0.030 . 1 . . . . 63 HIS HD2 . 11337 1 714 . 1 1 63 63 HIS HE1 H 1 7.729 0.030 . 1 . . . . 63 HIS HE1 . 11337 1 715 . 1 1 63 63 HIS C C 13 174.380 0.300 . 1 . . . . 63 HIS C . 11337 1 716 . 1 1 63 63 HIS CA C 13 52.481 0.300 . 1 . . . . 63 HIS CA . 11337 1 717 . 1 1 63 63 HIS CB C 13 33.771 0.300 . 1 . . . . 63 HIS CB . 11337 1 718 . 1 1 63 63 HIS CD2 C 13 116.582 0.300 . 1 . . . . 63 HIS CD2 . 11337 1 719 . 1 1 63 63 HIS CE1 C 13 137.933 0.300 . 1 . . . . 63 HIS CE1 . 11337 1 720 . 1 1 63 63 HIS N N 15 119.975 0.300 . 1 . . . . 63 HIS N . 11337 1 721 . 1 1 64 64 LEU H H 1 9.636 0.030 . 1 . . . . 64 LEU H . 11337 1 722 . 1 1 64 64 LEU HA H 1 4.563 0.030 . 1 . . . . 64 LEU HA . 11337 1 723 . 1 1 64 64 LEU HB2 H 1 1.952 0.030 . 2 . . . . 64 LEU HB2 . 11337 1 724 . 1 1 64 64 LEU HB3 H 1 0.911 0.030 . 2 . . . . 64 LEU HB3 . 11337 1 725 . 1 1 64 64 LEU HD11 H 1 0.741 0.030 . 1 . . . . 64 LEU HD1 . 11337 1 726 . 1 1 64 64 LEU HD12 H 1 0.741 0.030 . 1 . . . . 64 LEU HD1 . 11337 1 727 . 1 1 64 64 LEU HD13 H 1 0.741 0.030 . 1 . . . . 64 LEU HD1 . 11337 1 728 . 1 1 64 64 LEU HD21 H 1 0.048 0.030 . 1 . . . . 64 LEU HD2 . 11337 1 729 . 1 1 64 64 LEU HD22 H 1 0.048 0.030 . 1 . . . . 64 LEU HD2 . 11337 1 730 . 1 1 64 64 LEU HD23 H 1 0.048 0.030 . 1 . . . . 64 LEU HD2 . 11337 1 731 . 1 1 64 64 LEU HG H 1 1.356 0.030 . 1 . . . . 64 LEU HG . 11337 1 732 . 1 1 64 64 LEU C C 13 173.737 0.300 . 1 . . . . 64 LEU C . 11337 1 733 . 1 1 64 64 LEU CA C 13 50.404 0.300 . 1 . . . . 64 LEU CA . 11337 1 734 . 1 1 64 64 LEU CB C 13 39.991 0.300 . 1 . . . . 64 LEU CB . 11337 1 735 . 1 1 64 64 LEU CD1 C 13 25.446 0.300 . 2 . . . . 64 LEU CD1 . 11337 1 736 . 1 1 64 64 LEU CD2 C 13 21.269 0.300 . 2 . . . . 64 LEU CD2 . 11337 1 737 . 1 1 64 64 LEU CG C 13 26.294 0.300 . 1 . . . . 64 LEU CG . 11337 1 738 . 1 1 64 64 LEU N N 15 127.229 0.300 . 1 . . . . 64 LEU N . 11337 1 739 . 1 1 65 65 PRO HA H 1 4.445 0.030 . 1 . . . . 65 PRO HA . 11337 1 740 . 1 1 65 65 PRO HB2 H 1 2.271 0.030 . 2 . . . . 65 PRO HB2 . 11337 1 741 . 1 1 65 65 PRO HB3 H 1 1.990 0.030 . 2 . . . . 65 PRO HB3 . 11337 1 742 . 1 1 65 65 PRO HD2 H 1 3.977 0.030 . 2 . . . . 65 PRO HD2 . 11337 1 743 . 1 1 65 65 PRO HD3 H 1 3.344 0.030 . 2 . . . . 65 PRO HD3 . 11337 1 744 . 1 1 65 65 PRO HG2 H 1 1.767 0.030 . 2 . . . . 65 PRO HG2 . 11337 1 745 . 1 1 65 65 PRO HG3 H 1 1.656 0.030 . 2 . . . . 65 PRO HG3 . 11337 1 746 . 1 1 65 65 PRO CA C 13 61.857 0.300 . 1 . . . . 65 PRO CA . 11337 1 747 . 1 1 65 65 PRO CB C 13 32.709 0.300 . 1 . . . . 65 PRO CB . 11337 1 748 . 1 1 65 65 PRO CD C 13 51.605 0.300 . 1 . . . . 65 PRO CD . 11337 1 749 . 1 1 65 65 PRO CG C 13 27.332 0.300 . 1 . . . . 65 PRO CG . 11337 1 750 . 1 1 66 66 VAL H H 1 8.720 0.030 . 1 . . . . 66 VAL H . 11337 1 751 . 1 1 66 66 VAL HA H 1 3.931 0.030 . 1 . . . . 66 VAL HA . 11337 1 752 . 1 1 66 66 VAL HB H 1 2.141 0.030 . 1 . . . . 66 VAL HB . 11337 1 753 . 1 1 66 66 VAL HG11 H 1 0.966 0.030 . 1 . . . . 66 VAL HG1 . 11337 1 754 . 1 1 66 66 VAL HG12 H 1 0.966 0.030 . 1 . . . . 66 VAL HG1 . 11337 1 755 . 1 1 66 66 VAL HG13 H 1 0.966 0.030 . 1 . . . . 66 VAL HG1 . 11337 1 756 . 1 1 66 66 VAL HG21 H 1 0.967 0.030 . 1 . . . . 66 VAL HG2 . 11337 1 757 . 1 1 66 66 VAL HG22 H 1 0.967 0.030 . 1 . . . . 66 VAL HG2 . 11337 1 758 . 1 1 66 66 VAL HG23 H 1 0.967 0.030 . 1 . . . . 66 VAL HG2 . 11337 1 759 . 1 1 66 66 VAL CA C 13 65.930 0.300 . 1 . . . . 66 VAL CA . 11337 1 760 . 1 1 66 66 VAL CB C 13 31.400 0.300 . 1 . . . . 66 VAL CB . 11337 1 761 . 1 1 66 66 VAL CG1 C 13 20.873 0.300 . 2 . . . . 66 VAL CG1 . 11337 1 762 . 1 1 66 66 VAL CG2 C 13 21.124 0.300 . 2 . . . . 66 VAL CG2 . 11337 1 763 . 1 1 66 66 VAL N N 15 117.371 0.300 . 1 . . . . 66 VAL N . 11337 1 764 . 1 1 67 67 ASN H H 1 8.250 0.030 . 1 . . . . 67 ASN H . 11337 1 765 . 1 1 67 67 ASN HA H 1 4.844 0.030 . 1 . . . . 67 ASN HA . 11337 1 766 . 1 1 67 67 ASN HB2 H 1 2.842 0.030 . 1 . . . . 67 ASN HB2 . 11337 1 767 . 1 1 67 67 ASN HB3 H 1 2.842 0.030 . 1 . . . . 67 ASN HB3 . 11337 1 768 . 1 1 67 67 ASN HD21 H 1 7.552 0.030 . 2 . . . . 67 ASN HD21 . 11337 1 769 . 1 1 67 67 ASN HD22 H 1 6.803 0.030 . 2 . . . . 67 ASN HD22 . 11337 1 770 . 1 1 67 67 ASN CA C 13 52.926 0.300 . 1 . . . . 67 ASN CA . 11337 1 771 . 1 1 67 67 ASN CB C 13 37.355 0.300 . 1 . . . . 67 ASN CB . 11337 1 772 . 1 1 67 67 ASN N N 15 113.149 0.300 . 1 . . . . 67 ASN N . 11337 1 773 . 1 1 67 67 ASN ND2 N 15 112.023 0.300 . 1 . . . . 67 ASN ND2 . 11337 1 774 . 1 1 68 68 TYR H H 1 7.953 0.030 . 1 . . . . 68 TYR H . 11337 1 775 . 1 1 68 68 TYR HA H 1 4.708 0.030 . 1 . . . . 68 TYR HA . 11337 1 776 . 1 1 68 68 TYR HB2 H 1 3.240 0.030 . 2 . . . . 68 TYR HB2 . 11337 1 777 . 1 1 68 68 TYR HB3 H 1 2.829 0.030 . 2 . . . . 68 TYR HB3 . 11337 1 778 . 1 1 68 68 TYR HD1 H 1 7.272 0.030 . 3 . . . . 68 TYR HD1 . 11337 1 779 . 1 1 68 68 TYR HD2 H 1 7.031 0.030 . 3 . . . . 68 TYR HD2 . 11337 1 780 . 1 1 68 68 TYR HE1 H 1 6.950 0.030 . 3 . . . . 68 TYR HE1 . 11337 1 781 . 1 1 68 68 TYR HE2 H 1 7.311 0.030 . 3 . . . . 68 TYR HE2 . 11337 1 782 . 1 1 68 68 TYR CA C 13 57.210 0.300 . 1 . . . . 68 TYR CA . 11337 1 783 . 1 1 68 68 TYR CB C 13 38.562 0.300 . 1 . . . . 68 TYR CB . 11337 1 784 . 1 1 68 68 TYR CD1 C 13 133.160 0.300 . 3 . . . . 68 TYR CD1 . 11337 1 785 . 1 1 68 68 TYR CD2 C 13 134.938 0.300 . 3 . . . . 68 TYR CD2 . 11337 1 786 . 1 1 68 68 TYR CE1 C 13 118.109 0.300 . 3 . . . . 68 TYR CE1 . 11337 1 787 . 1 1 68 68 TYR CE2 C 13 120.172 0.300 . 3 . . . . 68 TYR CE2 . 11337 1 788 . 1 1 68 68 TYR N N 15 126.198 0.300 . 1 . . . . 68 TYR N . 11337 1 789 . 1 1 69 69 PRO HA H 1 4.150 0.030 . 1 . . . . 69 PRO HA . 11337 1 790 . 1 1 69 69 PRO HB2 H 1 1.945 0.030 . 2 . . . . 69 PRO HB2 . 11337 1 791 . 1 1 69 69 PRO HB3 H 1 0.382 0.030 . 2 . . . . 69 PRO HB3 . 11337 1 792 . 1 1 69 69 PRO HD2 H 1 3.298 0.030 . 2 . . . . 69 PRO HD2 . 11337 1 793 . 1 1 69 69 PRO HD3 H 1 3.157 0.030 . 2 . . . . 69 PRO HD3 . 11337 1 794 . 1 1 69 69 PRO HG2 H 1 1.007 0.030 . 2 . . . . 69 PRO HG2 . 11337 1 795 . 1 1 69 69 PRO HG3 H 1 1.242 0.030 . 2 . . . . 69 PRO HG3 . 11337 1 796 . 1 1 69 69 PRO C C 13 175.169 0.300 . 1 . . . . 69 PRO C . 11337 1 797 . 1 1 69 69 PRO CA C 13 64.176 0.300 . 1 . . . . 69 PRO CA . 11337 1 798 . 1 1 69 69 PRO CB C 13 31.588 0.300 . 1 . . . . 69 PRO CB . 11337 1 799 . 1 1 69 69 PRO CD C 13 49.157 0.300 . 1 . . . . 69 PRO CD . 11337 1 800 . 1 1 69 69 PRO CG C 13 23.703 0.300 . 1 . . . . 69 PRO CG . 11337 1 801 . 1 1 70 70 SER H H 1 8.876 0.030 . 1 . . . . 70 SER H . 11337 1 802 . 1 1 70 70 SER HA H 1 4.347 0.030 . 1 . . . . 70 SER HA . 11337 1 803 . 1 1 70 70 SER HB2 H 1 3.996 0.030 . 1 . . . . 70 SER HB2 . 11337 1 804 . 1 1 70 70 SER HB3 H 1 3.996 0.030 . 1 . . . . 70 SER HB3 . 11337 1 805 . 1 1 70 70 SER C C 13 172.621 0.300 . 1 . . . . 70 SER C . 11337 1 806 . 1 1 70 70 SER CA C 13 60.739 0.300 . 1 . . . . 70 SER CA . 11337 1 807 . 1 1 70 70 SER CB C 13 62.712 0.300 . 1 . . . . 70 SER CB . 11337 1 808 . 1 1 70 70 SER N N 15 121.071 0.300 . 1 . . . . 70 SER N . 11337 1 809 . 1 1 71 71 CYS H H 1 7.311 0.030 . 1 . . . . 71 CYS H . 11337 1 810 . 1 1 71 71 CYS HA H 1 4.698 0.030 . 1 . . . . 71 CYS HA . 11337 1 811 . 1 1 71 71 CYS HB2 H 1 3.128 0.030 . 2 . . . . 71 CYS HB2 . 11337 1 812 . 1 1 71 71 CYS HB3 H 1 2.591 0.030 . 2 . . . . 71 CYS HB3 . 11337 1 813 . 1 1 71 71 CYS C C 13 171.127 0.300 . 1 . . . . 71 CYS C . 11337 1 814 . 1 1 71 71 CYS CA C 13 54.337 0.300 . 1 . . . . 71 CYS CA . 11337 1 815 . 1 1 71 71 CYS CB C 13 31.324 0.300 . 1 . . . . 71 CYS CB . 11337 1 816 . 1 1 71 71 CYS N N 15 114.986 0.300 . 1 . . . . 71 CYS N . 11337 1 817 . 1 1 72 72 LEU H H 1 8.137 0.030 . 1 . . . . 72 LEU H . 11337 1 818 . 1 1 72 72 LEU HA H 1 4.277 0.030 . 1 . . . . 72 LEU HA . 11337 1 819 . 1 1 72 72 LEU HB2 H 1 1.669 0.030 . 2 . . . . 72 LEU HB2 . 11337 1 820 . 1 1 72 72 LEU HB3 H 1 1.477 0.030 . 2 . . . . 72 LEU HB3 . 11337 1 821 . 1 1 72 72 LEU HD11 H 1 1.008 0.030 . 1 . . . . 72 LEU HD1 . 11337 1 822 . 1 1 72 72 LEU HD12 H 1 1.008 0.030 . 1 . . . . 72 LEU HD1 . 11337 1 823 . 1 1 72 72 LEU HD13 H 1 1.008 0.030 . 1 . . . . 72 LEU HD1 . 11337 1 824 . 1 1 72 72 LEU HD21 H 1 0.851 0.030 . 1 . . . . 72 LEU HD2 . 11337 1 825 . 1 1 72 72 LEU HD22 H 1 0.851 0.030 . 1 . . . . 72 LEU HD2 . 11337 1 826 . 1 1 72 72 LEU HD23 H 1 0.851 0.030 . 1 . . . . 72 LEU HD2 . 11337 1 827 . 1 1 72 72 LEU HG H 1 1.839 0.030 . 1 . . . . 72 LEU HG . 11337 1 828 . 1 1 72 72 LEU C C 13 175.339 0.300 . 1 . . . . 72 LEU C . 11337 1 829 . 1 1 72 72 LEU CA C 13 53.175 0.300 . 1 . . . . 72 LEU CA . 11337 1 830 . 1 1 72 72 LEU CB C 13 41.484 0.300 . 1 . . . . 72 LEU CB . 11337 1 831 . 1 1 72 72 LEU CD1 C 13 26.118 0.300 . 2 . . . . 72 LEU CD1 . 11337 1 832 . 1 1 72 72 LEU CD2 C 13 24.218 0.300 . 2 . . . . 72 LEU CD2 . 11337 1 833 . 1 1 72 72 LEU CG C 13 27.055 0.300 . 1 . . . . 72 LEU CG . 11337 1 834 . 1 1 72 72 LEU N N 15 117.548 0.300 . 1 . . . . 72 LEU N . 11337 1 835 . 1 1 73 73 PRO HA H 1 4.837 0.030 . 1 . . . . 73 PRO HA . 11337 1 836 . 1 1 73 73 PRO HB2 H 1 2.092 0.030 . 2 . . . . 73 PRO HB2 . 11337 1 837 . 1 1 73 73 PRO HB3 H 1 2.025 0.030 . 2 . . . . 73 PRO HB3 . 11337 1 838 . 1 1 73 73 PRO HD2 H 1 4.169 0.030 . 2 . . . . 73 PRO HD2 . 11337 1 839 . 1 1 73 73 PRO HD3 H 1 3.609 0.030 . 2 . . . . 73 PRO HD3 . 11337 1 840 . 1 1 73 73 PRO HG2 H 1 1.946 0.030 . 2 . . . . 73 PRO HG2 . 11337 1 841 . 1 1 73 73 PRO HG3 H 1 2.107 0.030 . 2 . . . . 73 PRO HG3 . 11337 1 842 . 1 1 73 73 PRO C C 13 176.723 0.300 . 1 . . . . 73 PRO C . 11337 1 843 . 1 1 73 73 PRO CA C 13 62.070 0.300 . 1 . . . . 73 PRO CA . 11337 1 844 . 1 1 73 73 PRO CB C 13 32.203 0.300 . 1 . . . . 73 PRO CB . 11337 1 845 . 1 1 73 73 PRO CD C 13 50.262 0.300 . 1 . . . . 73 PRO CD . 11337 1 846 . 1 1 73 73 PRO CG C 13 25.746 0.300 . 1 . . . . 73 PRO CG . 11337 1 847 . 1 1 74 74 GLY H H 1 9.432 0.030 . 1 . . . . 74 GLY H . 11337 1 848 . 1 1 74 74 GLY HA2 H 1 4.449 0.030 . 2 . . . . 74 GLY HA2 . 11337 1 849 . 1 1 74 74 GLY HA3 H 1 3.701 0.030 . 2 . . . . 74 GLY HA3 . 11337 1 850 . 1 1 74 74 GLY C C 13 173.846 0.300 . 1 . . . . 74 GLY C . 11337 1 851 . 1 1 74 74 GLY CA C 13 45.424 0.300 . 1 . . . . 74 GLY CA . 11337 1 852 . 1 1 74 74 GLY N N 15 107.279 0.300 . 1 . . . . 74 GLY N . 11337 1 853 . 1 1 75 75 ILE H H 1 8.028 0.030 . 1 . . . . 75 ILE H . 11337 1 854 . 1 1 75 75 ILE HA H 1 4.614 0.030 . 1 . . . . 75 ILE HA . 11337 1 855 . 1 1 75 75 ILE HB H 1 1.264 0.030 . 1 . . . . 75 ILE HB . 11337 1 856 . 1 1 75 75 ILE HD11 H 1 0.594 0.030 . 1 . . . . 75 ILE HD1 . 11337 1 857 . 1 1 75 75 ILE HD12 H 1 0.594 0.030 . 1 . . . . 75 ILE HD1 . 11337 1 858 . 1 1 75 75 ILE HD13 H 1 0.594 0.030 . 1 . . . . 75 ILE HD1 . 11337 1 859 . 1 1 75 75 ILE HG12 H 1 1.338 0.030 . 2 . . . . 75 ILE HG12 . 11337 1 860 . 1 1 75 75 ILE HG13 H 1 0.605 0.030 . 2 . . . . 75 ILE HG13 . 11337 1 861 . 1 1 75 75 ILE HG21 H 1 0.343 0.030 . 1 . . . . 75 ILE HG2 . 11337 1 862 . 1 1 75 75 ILE HG22 H 1 0.343 0.030 . 1 . . . . 75 ILE HG2 . 11337 1 863 . 1 1 75 75 ILE HG23 H 1 0.343 0.030 . 1 . . . . 75 ILE HG2 . 11337 1 864 . 1 1 75 75 ILE C C 13 174.489 0.300 . 1 . . . . 75 ILE C . 11337 1 865 . 1 1 75 75 ILE CA C 13 60.502 0.300 . 1 . . . . 75 ILE CA . 11337 1 866 . 1 1 75 75 ILE CB C 13 42.545 0.300 . 1 . . . . 75 ILE CB . 11337 1 867 . 1 1 75 75 ILE CD1 C 13 14.671 0.300 . 1 . . . . 75 ILE CD1 . 11337 1 868 . 1 1 75 75 ILE CG1 C 13 26.797 0.300 . 1 . . . . 75 ILE CG1 . 11337 1 869 . 1 1 75 75 ILE CG2 C 13 16.843 0.300 . 1 . . . . 75 ILE CG2 . 11337 1 870 . 1 1 75 75 ILE N N 15 122.181 0.300 . 1 . . . . 75 ILE N . 11337 1 871 . 1 1 76 76 SER H H 1 8.481 0.030 . 1 . . . . 76 SER H . 11337 1 872 . 1 1 76 76 SER HA H 1 4.651 0.030 . 1 . . . . 76 SER HA . 11337 1 873 . 1 1 76 76 SER HB2 H 1 3.674 0.030 . 2 . . . . 76 SER HB2 . 11337 1 874 . 1 1 76 76 SER HB3 H 1 3.525 0.030 . 2 . . . . 76 SER HB3 . 11337 1 875 . 1 1 76 76 SER C C 13 172.038 0.300 . 1 . . . . 76 SER C . 11337 1 876 . 1 1 76 76 SER CA C 13 57.040 0.300 . 1 . . . . 76 SER CA . 11337 1 877 . 1 1 76 76 SER CB C 13 64.960 0.300 . 1 . . . . 76 SER CB . 11337 1 878 . 1 1 76 76 SER N N 15 120.750 0.300 . 1 . . . . 76 SER N . 11337 1 879 . 1 1 77 77 ILE H H 1 8.445 0.030 . 1 . . . . 77 ILE H . 11337 1 880 . 1 1 77 77 ILE HA H 1 4.935 0.030 . 1 . . . . 77 ILE HA . 11337 1 881 . 1 1 77 77 ILE HB H 1 1.740 0.030 . 1 . . . . 77 ILE HB . 11337 1 882 . 1 1 77 77 ILE HD11 H 1 0.663 0.030 . 1 . . . . 77 ILE HD1 . 11337 1 883 . 1 1 77 77 ILE HD12 H 1 0.663 0.030 . 1 . . . . 77 ILE HD1 . 11337 1 884 . 1 1 77 77 ILE HD13 H 1 0.663 0.030 . 1 . . . . 77 ILE HD1 . 11337 1 885 . 1 1 77 77 ILE HG12 H 1 1.290 0.030 . 2 . . . . 77 ILE HG12 . 11337 1 886 . 1 1 77 77 ILE HG13 H 1 1.114 0.030 . 2 . . . . 77 ILE HG13 . 11337 1 887 . 1 1 77 77 ILE HG21 H 1 0.749 0.030 . 1 . . . . 77 ILE HG2 . 11337 1 888 . 1 1 77 77 ILE HG22 H 1 0.749 0.030 . 1 . . . . 77 ILE HG2 . 11337 1 889 . 1 1 77 77 ILE HG23 H 1 0.749 0.030 . 1 . . . . 77 ILE HG2 . 11337 1 890 . 1 1 77 77 ILE C C 13 173.749 0.300 . 1 . . . . 77 ILE C . 11337 1 891 . 1 1 77 77 ILE CA C 13 58.495 0.300 . 1 . . . . 77 ILE CA . 11337 1 892 . 1 1 77 77 ILE CB C 13 39.779 0.300 . 1 . . . . 77 ILE CB . 11337 1 893 . 1 1 77 77 ILE CD1 C 13 12.883 0.300 . 1 . . . . 77 ILE CD1 . 11337 1 894 . 1 1 77 77 ILE CG1 C 13 27.055 0.300 . 1 . . . . 77 ILE CG1 . 11337 1 895 . 1 1 77 77 ILE CG2 C 13 17.154 0.300 . 1 . . . . 77 ILE CG2 . 11337 1 896 . 1 1 77 77 ILE N N 15 124.204 0.300 . 1 . . . . 77 ILE N . 11337 1 897 . 1 1 78 78 ASN H H 1 8.764 0.030 . 1 . . . . 78 ASN H . 11337 1 898 . 1 1 78 78 ASN HA H 1 5.221 0.030 . 1 . . . . 78 ASN HA . 11337 1 899 . 1 1 78 78 ASN HB2 H 1 2.630 0.030 . 1 . . . . 78 ASN HB2 . 11337 1 900 . 1 1 78 78 ASN HB3 H 1 2.630 0.030 . 1 . . . . 78 ASN HB3 . 11337 1 901 . 1 1 78 78 ASN HD21 H 1 7.689 0.030 . 2 . . . . 78 ASN HD21 . 11337 1 902 . 1 1 78 78 ASN HD22 H 1 6.823 0.030 . 2 . . . . 78 ASN HD22 . 11337 1 903 . 1 1 78 78 ASN C C 13 173.775 0.300 . 1 . . . . 78 ASN C . 11337 1 904 . 1 1 78 78 ASN CA C 13 52.032 0.300 . 1 . . . . 78 ASN CA . 11337 1 905 . 1 1 78 78 ASN CB C 13 42.526 0.300 . 1 . . . . 78 ASN CB . 11337 1 906 . 1 1 78 78 ASN N N 15 122.472 0.300 . 1 . . . . 78 ASN N . 11337 1 907 . 1 1 78 78 ASN ND2 N 15 114.206 0.300 . 1 . . . . 78 ASN ND2 . 11337 1 908 . 1 1 79 79 SER H H 1 8.064 0.030 . 1 . . . . 79 SER H . 11337 1 909 . 1 1 79 79 SER HA H 1 4.469 0.030 . 1 . . . . 79 SER HA . 11337 1 910 . 1 1 79 79 SER HB2 H 1 4.290 0.030 . 2 . . . . 79 SER HB2 . 11337 1 911 . 1 1 79 79 SER HB3 H 1 3.123 0.030 . 2 . . . . 79 SER HB3 . 11337 1 912 . 1 1 79 79 SER C C 13 175.109 0.300 . 1 . . . . 79 SER C . 11337 1 913 . 1 1 79 79 SER CA C 13 58.386 0.300 . 1 . . . . 79 SER CA . 11337 1 914 . 1 1 79 79 SER CB C 13 65.218 0.300 . 1 . . . . 79 SER CB . 11337 1 915 . 1 1 79 79 SER N N 15 113.957 0.300 . 1 . . . . 79 SER N . 11337 1 916 . 1 1 80 80 GLU H H 1 9.321 0.030 . 1 . . . . 80 GLU H . 11337 1 917 . 1 1 80 80 GLU HA H 1 4.325 0.030 . 1 . . . . 80 GLU HA . 11337 1 918 . 1 1 80 80 GLU HB2 H 1 2.146 0.030 . 2 . . . . 80 GLU HB2 . 11337 1 919 . 1 1 80 80 GLU HB3 H 1 2.016 0.030 . 2 . . . . 80 GLU HB3 . 11337 1 920 . 1 1 80 80 GLU HG2 H 1 2.371 0.030 . 2 . . . . 80 GLU HG2 . 11337 1 921 . 1 1 80 80 GLU HG3 H 1 2.327 0.030 . 2 . . . . 80 GLU HG3 . 11337 1 922 . 1 1 80 80 GLU C C 13 176.893 0.300 . 1 . . . . 80 GLU C . 11337 1 923 . 1 1 80 80 GLU CA C 13 58.188 0.300 . 1 . . . . 80 GLU CA . 11337 1 924 . 1 1 80 80 GLU CB C 13 29.742 0.300 . 1 . . . . 80 GLU CB . 11337 1 925 . 1 1 80 80 GLU CG C 13 36.514 0.300 . 1 . . . . 80 GLU CG . 11337 1 926 . 1 1 80 80 GLU N N 15 127.466 0.300 . 1 . . . . 80 GLU N . 11337 1 927 . 1 1 81 81 GLN H H 1 8.050 0.030 . 1 . . . . 81 GLN H . 11337 1 928 . 1 1 81 81 GLN HA H 1 4.454 0.030 . 1 . . . . 81 GLN HA . 11337 1 929 . 1 1 81 81 GLN HB2 H 1 2.472 0.030 . 2 . . . . 81 GLN HB2 . 11337 1 930 . 1 1 81 81 GLN HB3 H 1 1.651 0.030 . 2 . . . . 81 GLN HB3 . 11337 1 931 . 1 1 81 81 GLN HE21 H 1 7.607 0.030 . 2 . . . . 81 GLN HE21 . 11337 1 932 . 1 1 81 81 GLN HE22 H 1 6.811 0.030 . 2 . . . . 81 GLN HE22 . 11337 1 933 . 1 1 81 81 GLN HG2 H 1 2.376 0.030 . 1 . . . . 81 GLN HG2 . 11337 1 934 . 1 1 81 81 GLN HG3 H 1 2.376 0.030 . 1 . . . . 81 GLN HG3 . 11337 1 935 . 1 1 81 81 GLN C C 13 174.356 0.300 . 1 . . . . 81 GLN C . 11337 1 936 . 1 1 81 81 GLN CA C 13 55.537 0.300 . 1 . . . . 81 GLN CA . 11337 1 937 . 1 1 81 81 GLN CB C 13 30.407 0.300 . 1 . . . . 81 GLN CB . 11337 1 938 . 1 1 81 81 GLN CG C 13 34.525 0.300 . 1 . . . . 81 GLN CG . 11337 1 939 . 1 1 81 81 GLN N N 15 115.590 0.300 . 1 . . . . 81 GLN N . 11337 1 940 . 1 1 81 81 GLN NE2 N 15 111.279 0.300 . 1 . . . . 81 GLN NE2 . 11337 1 941 . 1 1 82 82 LEU H H 1 6.989 0.030 . 1 . . . . 82 LEU H . 11337 1 942 . 1 1 82 82 LEU HA H 1 4.990 0.030 . 1 . . . . 82 LEU HA . 11337 1 943 . 1 1 82 82 LEU HB2 H 1 1.695 0.030 . 2 . . . . 82 LEU HB2 . 11337 1 944 . 1 1 82 82 LEU HB3 H 1 1.532 0.030 . 2 . . . . 82 LEU HB3 . 11337 1 945 . 1 1 82 82 LEU HD11 H 1 0.727 0.030 . 1 . . . . 82 LEU HD1 . 11337 1 946 . 1 1 82 82 LEU HD12 H 1 0.727 0.030 . 1 . . . . 82 LEU HD1 . 11337 1 947 . 1 1 82 82 LEU HD13 H 1 0.727 0.030 . 1 . . . . 82 LEU HD1 . 11337 1 948 . 1 1 82 82 LEU HD21 H 1 0.855 0.030 . 1 . . . . 82 LEU HD2 . 11337 1 949 . 1 1 82 82 LEU HD22 H 1 0.855 0.030 . 1 . . . . 82 LEU HD2 . 11337 1 950 . 1 1 82 82 LEU HD23 H 1 0.855 0.030 . 1 . . . . 82 LEU HD2 . 11337 1 951 . 1 1 82 82 LEU HG H 1 1.587 0.030 . 1 . . . . 82 LEU HG . 11337 1 952 . 1 1 82 82 LEU C C 13 177.196 0.300 . 1 . . . . 82 LEU C . 11337 1 953 . 1 1 82 82 LEU CA C 13 53.111 0.300 . 1 . . . . 82 LEU CA . 11337 1 954 . 1 1 82 82 LEU CB C 13 46.006 0.300 . 1 . . . . 82 LEU CB . 11337 1 955 . 1 1 82 82 LEU CD1 C 13 25.512 0.300 . 2 . . . . 82 LEU CD1 . 11337 1 956 . 1 1 82 82 LEU CD2 C 13 24.104 0.300 . 2 . . . . 82 LEU CD2 . 11337 1 957 . 1 1 82 82 LEU CG C 13 26.970 0.300 . 1 . . . . 82 LEU CG . 11337 1 958 . 1 1 82 82 LEU N N 15 116.745 0.300 . 1 . . . . 82 LEU N . 11337 1 959 . 1 1 83 83 THR H H 1 8.989 0.030 . 1 . . . . 83 THR H . 11337 1 960 . 1 1 83 83 THR HA H 1 4.489 0.030 . 1 . . . . 83 THR HA . 11337 1 961 . 1 1 83 83 THR HB H 1 4.777 0.030 . 1 . . . . 83 THR HB . 11337 1 962 . 1 1 83 83 THR HG21 H 1 1.302 0.030 . 1 . . . . 83 THR HG2 . 11337 1 963 . 1 1 83 83 THR HG22 H 1 1.302 0.030 . 1 . . . . 83 THR HG2 . 11337 1 964 . 1 1 83 83 THR HG23 H 1 1.302 0.030 . 1 . . . . 83 THR HG2 . 11337 1 965 . 1 1 83 83 THR C C 13 176.213 0.300 . 1 . . . . 83 THR C . 11337 1 966 . 1 1 83 83 THR CA C 13 60.566 0.300 . 1 . . . . 83 THR CA . 11337 1 967 . 1 1 83 83 THR CB C 13 70.928 0.300 . 1 . . . . 83 THR CB . 11337 1 968 . 1 1 83 83 THR CG2 C 13 21.763 0.300 . 1 . . . . 83 THR CG2 . 11337 1 969 . 1 1 83 83 THR N N 15 112.275 0.300 . 1 . . . . 83 THR N . 11337 1 970 . 1 1 84 84 ARG H H 1 9.021 0.030 . 1 . . . . 84 ARG H . 11337 1 971 . 1 1 84 84 ARG HA H 1 4.086 0.030 . 1 . . . . 84 ARG HA . 11337 1 972 . 1 1 84 84 ARG HB2 H 1 2.007 0.030 . 2 . . . . 84 ARG HB2 . 11337 1 973 . 1 1 84 84 ARG HB3 H 1 1.916 0.030 . 2 . . . . 84 ARG HB3 . 11337 1 974 . 1 1 84 84 ARG HD2 H 1 3.285 0.030 . 1 . . . . 84 ARG HD2 . 11337 1 975 . 1 1 84 84 ARG HD3 H 1 3.285 0.030 . 1 . . . . 84 ARG HD3 . 11337 1 976 . 1 1 84 84 ARG HG2 H 1 1.787 0.030 . 1 . . . . 84 ARG HG2 . 11337 1 977 . 1 1 84 84 ARG HG3 H 1 1.787 0.030 . 1 . . . . 84 ARG HG3 . 11337 1 978 . 1 1 84 84 ARG C C 13 178.956 0.300 . 1 . . . . 84 ARG C . 11337 1 979 . 1 1 84 84 ARG CA C 13 59.751 0.300 . 1 . . . . 84 ARG CA . 11337 1 980 . 1 1 84 84 ARG CB C 13 29.149 0.300 . 1 . . . . 84 ARG CB . 11337 1 981 . 1 1 84 84 ARG CD C 13 42.870 0.300 . 1 . . . . 84 ARG CD . 11337 1 982 . 1 1 84 84 ARG CG C 13 26.443 0.300 . 1 . . . . 84 ARG CG . 11337 1 983 . 1 1 84 84 ARG N N 15 122.416 0.300 . 1 . . . . 84 ARG N . 11337 1 984 . 1 1 85 85 ALA H H 1 8.437 0.030 . 1 . . . . 85 ALA H . 11337 1 985 . 1 1 85 85 ALA HA H 1 4.101 0.030 . 1 . . . . 85 ALA HA . 11337 1 986 . 1 1 85 85 ALA HB1 H 1 1.416 0.030 . 1 . . . . 85 ALA HB . 11337 1 987 . 1 1 85 85 ALA HB2 H 1 1.416 0.030 . 1 . . . . 85 ALA HB . 11337 1 988 . 1 1 85 85 ALA HB3 H 1 1.416 0.030 . 1 . . . . 85 ALA HB . 11337 1 989 . 1 1 85 85 ALA C C 13 181.189 0.300 . 1 . . . . 85 ALA C . 11337 1 990 . 1 1 85 85 ALA CA C 13 55.225 0.300 . 1 . . . . 85 ALA CA . 11337 1 991 . 1 1 85 85 ALA CB C 13 18.282 0.300 . 1 . . . . 85 ALA CB . 11337 1 992 . 1 1 85 85 ALA N N 15 119.977 0.300 . 1 . . . . 85 ALA N . 11337 1 993 . 1 1 86 86 GLN H H 1 7.878 0.030 . 1 . . . . 86 GLN H . 11337 1 994 . 1 1 86 86 GLN HA H 1 4.101 0.030 . 1 . . . . 86 GLN HA . 11337 1 995 . 1 1 86 86 GLN HB2 H 1 2.610 0.030 . 2 . . . . 86 GLN HB2 . 11337 1 996 . 1 1 86 86 GLN HB3 H 1 1.736 0.030 . 2 . . . . 86 GLN HB3 . 11337 1 997 . 1 1 86 86 GLN HE21 H 1 7.885 0.030 . 2 . . . . 86 GLN HE21 . 11337 1 998 . 1 1 86 86 GLN HE22 H 1 6.811 0.030 . 2 . . . . 86 GLN HE22 . 11337 1 999 . 1 1 86 86 GLN HG2 H 1 2.611 0.030 . 2 . . . . 86 GLN HG2 . 11337 1 1000 . 1 1 86 86 GLN HG3 H 1 2.438 0.030 . 2 . . . . 86 GLN HG3 . 11337 1 1001 . 1 1 86 86 GLN C C 13 178.555 0.300 . 1 . . . . 86 GLN C . 11337 1 1002 . 1 1 86 86 GLN CA C 13 58.972 0.300 . 1 . . . . 86 GLN CA . 11337 1 1003 . 1 1 86 86 GLN CB C 13 29.116 0.300 . 1 . . . . 86 GLN CB . 11337 1 1004 . 1 1 86 86 GLN CG C 13 35.153 0.300 . 1 . . . . 86 GLN CG . 11337 1 1005 . 1 1 86 86 GLN N N 15 118.063 0.300 . 1 . . . . 86 GLN N . 11337 1 1006 . 1 1 86 86 GLN NE2 N 15 111.273 0.300 . 1 . . . . 86 GLN NE2 . 11337 1 1007 . 1 1 87 87 CYS H H 1 8.256 0.030 . 1 . . . . 87 CYS H . 11337 1 1008 . 1 1 87 87 CYS HA H 1 3.832 0.030 . 1 . . . . 87 CYS HA . 11337 1 1009 . 1 1 87 87 CYS HB2 H 1 3.377 0.030 . 2 . . . . 87 CYS HB2 . 11337 1 1010 . 1 1 87 87 CYS HB3 H 1 2.778 0.030 . 2 . . . . 87 CYS HB3 . 11337 1 1011 . 1 1 87 87 CYS C C 13 177.463 0.300 . 1 . . . . 87 CYS C . 11337 1 1012 . 1 1 87 87 CYS CA C 13 65.232 0.300 . 1 . . . . 87 CYS CA . 11337 1 1013 . 1 1 87 87 CYS CB C 13 27.098 0.300 . 1 . . . . 87 CYS CB . 11337 1 1014 . 1 1 87 87 CYS N N 15 117.532 0.300 . 1 . . . . 87 CYS N . 11337 1 1015 . 1 1 88 88 VAL H H 1 8.035 0.030 . 1 . . . . 88 VAL H . 11337 1 1016 . 1 1 88 88 VAL HA H 1 3.612 0.030 . 1 . . . . 88 VAL HA . 11337 1 1017 . 1 1 88 88 VAL HB H 1 2.271 0.030 . 1 . . . . 88 VAL HB . 11337 1 1018 . 1 1 88 88 VAL HG11 H 1 1.085 0.030 . 1 . . . . 88 VAL HG1 . 11337 1 1019 . 1 1 88 88 VAL HG12 H 1 1.085 0.030 . 1 . . . . 88 VAL HG1 . 11337 1 1020 . 1 1 88 88 VAL HG13 H 1 1.085 0.030 . 1 . . . . 88 VAL HG1 . 11337 1 1021 . 1 1 88 88 VAL HG21 H 1 0.955 0.030 . 1 . . . . 88 VAL HG2 . 11337 1 1022 . 1 1 88 88 VAL HG22 H 1 0.955 0.030 . 1 . . . . 88 VAL HG2 . 11337 1 1023 . 1 1 88 88 VAL HG23 H 1 0.955 0.030 . 1 . . . . 88 VAL HG2 . 11337 1 1024 . 1 1 88 88 VAL C C 13 177.657 0.300 . 1 . . . . 88 VAL C . 11337 1 1025 . 1 1 88 88 VAL CA C 13 67.284 0.300 . 1 . . . . 88 VAL CA . 11337 1 1026 . 1 1 88 88 VAL CB C 13 31.382 0.300 . 1 . . . . 88 VAL CB . 11337 1 1027 . 1 1 88 88 VAL CG1 C 13 22.861 0.300 . 2 . . . . 88 VAL CG1 . 11337 1 1028 . 1 1 88 88 VAL CG2 C 13 21.515 0.300 . 2 . . . . 88 VAL CG2 . 11337 1 1029 . 1 1 88 88 VAL N N 15 121.660 0.300 . 1 . . . . 88 VAL N . 11337 1 1030 . 1 1 89 89 THR H H 1 7.999 0.030 . 1 . . . . 89 THR H . 11337 1 1031 . 1 1 89 89 THR HA H 1 3.981 0.030 . 1 . . . . 89 THR HA . 11337 1 1032 . 1 1 89 89 THR HB H 1 4.253 0.030 . 1 . . . . 89 THR HB . 11337 1 1033 . 1 1 89 89 THR HG21 H 1 1.227 0.030 . 1 . . . . 89 THR HG2 . 11337 1 1034 . 1 1 89 89 THR HG22 H 1 1.227 0.030 . 1 . . . . 89 THR HG2 . 11337 1 1035 . 1 1 89 89 THR HG23 H 1 1.227 0.030 . 1 . . . . 89 THR HG2 . 11337 1 1036 . 1 1 89 89 THR C C 13 176.383 0.300 . 1 . . . . 89 THR C . 11337 1 1037 . 1 1 89 89 THR CA C 13 67.120 0.300 . 1 . . . . 89 THR CA . 11337 1 1038 . 1 1 89 89 THR CB C 13 68.663 0.300 . 1 . . . . 89 THR CB . 11337 1 1039 . 1 1 89 89 THR CG2 C 13 22.062 0.300 . 1 . . . . 89 THR CG2 . 11337 1 1040 . 1 1 89 89 THR N N 15 118.506 0.300 . 1 . . . . 89 THR N . 11337 1 1041 . 1 1 90 90 VAL H H 1 8.399 0.030 . 1 . . . . 90 VAL H . 11337 1 1042 . 1 1 90 90 VAL HA H 1 3.452 0.030 . 1 . . . . 90 VAL HA . 11337 1 1043 . 1 1 90 90 VAL HB H 1 2.143 0.030 . 1 . . . . 90 VAL HB . 11337 1 1044 . 1 1 90 90 VAL HG11 H 1 0.913 0.030 . 1 . . . . 90 VAL HG1 . 11337 1 1045 . 1 1 90 90 VAL HG12 H 1 0.913 0.030 . 1 . . . . 90 VAL HG1 . 11337 1 1046 . 1 1 90 90 VAL HG13 H 1 0.913 0.030 . 1 . . . . 90 VAL HG1 . 11337 1 1047 . 1 1 90 90 VAL HG21 H 1 1.013 0.030 . 1 . . . . 90 VAL HG2 . 11337 1 1048 . 1 1 90 90 VAL HG22 H 1 1.013 0.030 . 1 . . . . 90 VAL HG2 . 11337 1 1049 . 1 1 90 90 VAL HG23 H 1 1.013 0.030 . 1 . . . . 90 VAL HG2 . 11337 1 1050 . 1 1 90 90 VAL C C 13 176.710 0.300 . 1 . . . . 90 VAL C . 11337 1 1051 . 1 1 90 90 VAL CA C 13 67.615 0.300 . 1 . . . . 90 VAL CA . 11337 1 1052 . 1 1 90 90 VAL CB C 13 31.294 0.300 . 1 . . . . 90 VAL CB . 11337 1 1053 . 1 1 90 90 VAL CG1 C 13 22.491 0.300 . 2 . . . . 90 VAL CG1 . 11337 1 1054 . 1 1 90 90 VAL CG2 C 13 23.707 0.300 . 2 . . . . 90 VAL CG2 . 11337 1 1055 . 1 1 90 90 VAL N N 15 119.526 0.300 . 1 . . . . 90 VAL N . 11337 1 1056 . 1 1 91 91 LYS H H 1 7.969 0.030 . 1 . . . . 91 LYS H . 11337 1 1057 . 1 1 91 91 LYS HA H 1 3.637 0.030 . 1 . . . . 91 LYS HA . 11337 1 1058 . 1 1 91 91 LYS HB2 H 1 2.171 0.030 . 2 . . . . 91 LYS HB2 . 11337 1 1059 . 1 1 91 91 LYS HB3 H 1 1.858 0.030 . 2 . . . . 91 LYS HB3 . 11337 1 1060 . 1 1 91 91 LYS HD2 H 1 1.817 0.030 . 2 . . . . 91 LYS HD2 . 11337 1 1061 . 1 1 91 91 LYS HD3 H 1 1.736 0.030 . 2 . . . . 91 LYS HD3 . 11337 1 1062 . 1 1 91 91 LYS HE2 H 1 3.120 0.030 . 2 . . . . 91 LYS HE2 . 11337 1 1063 . 1 1 91 91 LYS HE3 H 1 3.056 0.030 . 2 . . . . 91 LYS HE3 . 11337 1 1064 . 1 1 91 91 LYS HG2 H 1 1.406 0.030 . 2 . . . . 91 LYS HG2 . 11337 1 1065 . 1 1 91 91 LYS HG3 H 1 1.244 0.030 . 2 . . . . 91 LYS HG3 . 11337 1 1066 . 1 1 91 91 LYS C C 13 177.536 0.300 . 1 . . . . 91 LYS C . 11337 1 1067 . 1 1 91 91 LYS CA C 13 60.829 0.300 . 1 . . . . 91 LYS CA . 11337 1 1068 . 1 1 91 91 LYS CB C 13 31.959 0.300 . 1 . . . . 91 LYS CB . 11337 1 1069 . 1 1 91 91 LYS CD C 13 30.162 0.300 . 1 . . . . 91 LYS CD . 11337 1 1070 . 1 1 91 91 LYS CE C 13 42.547 0.300 . 1 . . . . 91 LYS CE . 11337 1 1071 . 1 1 91 91 LYS CG C 13 24.743 0.300 . 1 . . . . 91 LYS CG . 11337 1 1072 . 1 1 91 91 LYS N N 15 120.399 0.300 . 1 . . . . 91 LYS N . 11337 1 1073 . 1 1 92 92 GLU H H 1 8.443 0.030 . 1 . . . . 92 GLU H . 11337 1 1074 . 1 1 92 92 GLU HA H 1 3.930 0.030 . 1 . . . . 92 GLU HA . 11337 1 1075 . 1 1 92 92 GLU HB2 H 1 2.320 0.030 . 2 . . . . 92 GLU HB2 . 11337 1 1076 . 1 1 92 92 GLU HB3 H 1 2.083 0.030 . 2 . . . . 92 GLU HB3 . 11337 1 1077 . 1 1 92 92 GLU HG2 H 1 2.572 0.030 . 2 . . . . 92 GLU HG2 . 11337 1 1078 . 1 1 92 92 GLU HG3 H 1 2.236 0.030 . 2 . . . . 92 GLU HG3 . 11337 1 1079 . 1 1 92 92 GLU C C 13 180.545 0.300 . 1 . . . . 92 GLU C . 11337 1 1080 . 1 1 92 92 GLU CA C 13 59.821 0.300 . 1 . . . . 92 GLU CA . 11337 1 1081 . 1 1 92 92 GLU CB C 13 29.445 0.300 . 1 . . . . 92 GLU CB . 11337 1 1082 . 1 1 92 92 GLU CG C 13 36.730 0.300 . 1 . . . . 92 GLU CG . 11337 1 1083 . 1 1 92 92 GLU N N 15 117.576 0.300 . 1 . . . . 92 GLU N . 11337 1 1084 . 1 1 93 93 LYS H H 1 8.376 0.030 . 1 . . . . 93 LYS H . 11337 1 1085 . 1 1 93 93 LYS HA H 1 4.202 0.030 . 1 . . . . 93 LYS HA . 11337 1 1086 . 1 1 93 93 LYS HB2 H 1 2.237 0.030 . 2 . . . . 93 LYS HB2 . 11337 1 1087 . 1 1 93 93 LYS HB3 H 1 2.096 0.030 . 2 . . . . 93 LYS HB3 . 11337 1 1088 . 1 1 93 93 LYS HD2 H 1 1.820 0.030 . 2 . . . . 93 LYS HD2 . 11337 1 1089 . 1 1 93 93 LYS HD3 H 1 1.740 0.030 . 2 . . . . 93 LYS HD3 . 11337 1 1090 . 1 1 93 93 LYS HE2 H 1 3.080 0.030 . 2 . . . . 93 LYS HE2 . 11337 1 1091 . 1 1 93 93 LYS HE3 H 1 2.955 0.030 . 2 . . . . 93 LYS HE3 . 11337 1 1092 . 1 1 93 93 LYS HG2 H 1 1.906 0.030 . 2 . . . . 93 LYS HG2 . 11337 1 1093 . 1 1 93 93 LYS HG3 H 1 1.595 0.030 . 2 . . . . 93 LYS HG3 . 11337 1 1094 . 1 1 93 93 LYS C C 13 179.854 0.300 . 1 . . . . 93 LYS C . 11337 1 1095 . 1 1 93 93 LYS CA C 13 57.639 0.300 . 1 . . . . 93 LYS CA . 11337 1 1096 . 1 1 93 93 LYS CB C 13 31.547 0.300 . 1 . . . . 93 LYS CB . 11337 1 1097 . 1 1 93 93 LYS CD C 13 27.710 0.300 . 1 . . . . 93 LYS CD . 11337 1 1098 . 1 1 93 93 LYS CE C 13 42.298 0.300 . 1 . . . . 93 LYS CE . 11337 1 1099 . 1 1 93 93 LYS CG C 13 24.931 0.300 . 1 . . . . 93 LYS CG . 11337 1 1100 . 1 1 93 93 LYS N N 15 118.385 0.300 . 1 . . . . 93 LYS N . 11337 1 1101 . 1 1 94 94 LEU H H 1 8.709 0.030 . 1 . . . . 94 LEU H . 11337 1 1102 . 1 1 94 94 LEU HA H 1 3.793 0.030 . 1 . . . . 94 LEU HA . 11337 1 1103 . 1 1 94 94 LEU HB2 H 1 1.987 0.030 . 2 . . . . 94 LEU HB2 . 11337 1 1104 . 1 1 94 94 LEU HB3 H 1 1.550 0.030 . 2 . . . . 94 LEU HB3 . 11337 1 1105 . 1 1 94 94 LEU HD11 H 1 0.974 0.030 . 1 . . . . 94 LEU HD1 . 11337 1 1106 . 1 1 94 94 LEU HD12 H 1 0.974 0.030 . 1 . . . . 94 LEU HD1 . 11337 1 1107 . 1 1 94 94 LEU HD13 H 1 0.974 0.030 . 1 . . . . 94 LEU HD1 . 11337 1 1108 . 1 1 94 94 LEU HD21 H 1 1.063 0.030 . 1 . . . . 94 LEU HD2 . 11337 1 1109 . 1 1 94 94 LEU HD22 H 1 1.063 0.030 . 1 . . . . 94 LEU HD2 . 11337 1 1110 . 1 1 94 94 LEU HD23 H 1 1.063 0.030 . 1 . . . . 94 LEU HD2 . 11337 1 1111 . 1 1 94 94 LEU HG H 1 1.787 0.030 . 1 . . . . 94 LEU HG . 11337 1 1112 . 1 1 94 94 LEU C C 13 178.968 0.300 . 1 . . . . 94 LEU C . 11337 1 1113 . 1 1 94 94 LEU CA C 13 57.963 0.300 . 1 . . . . 94 LEU CA . 11337 1 1114 . 1 1 94 94 LEU CB C 13 43.051 0.300 . 1 . . . . 94 LEU CB . 11337 1 1115 . 1 1 94 94 LEU CD1 C 13 26.932 0.300 . 2 . . . . 94 LEU CD1 . 11337 1 1116 . 1 1 94 94 LEU CD2 C 13 26.393 0.300 . 2 . . . . 94 LEU CD2 . 11337 1 1117 . 1 1 94 94 LEU CG C 13 27.113 0.300 . 1 . . . . 94 LEU CG . 11337 1 1118 . 1 1 94 94 LEU N N 15 122.382 0.300 . 1 . . . . 94 LEU N . 11337 1 1119 . 1 1 95 95 LEU H H 1 8.444 0.030 . 1 . . . . 95 LEU H . 11337 1 1120 . 1 1 95 95 LEU HA H 1 4.026 0.030 . 1 . . . . 95 LEU HA . 11337 1 1121 . 1 1 95 95 LEU HB2 H 1 1.936 0.030 . 2 . . . . 95 LEU HB2 . 11337 1 1122 . 1 1 95 95 LEU HB3 H 1 1.484 0.030 . 2 . . . . 95 LEU HB3 . 11337 1 1123 . 1 1 95 95 LEU HD11 H 1 0.958 0.030 . 1 . . . . 95 LEU HD1 . 11337 1 1124 . 1 1 95 95 LEU HD12 H 1 0.958 0.030 . 1 . . . . 95 LEU HD1 . 11337 1 1125 . 1 1 95 95 LEU HD13 H 1 0.958 0.030 . 1 . . . . 95 LEU HD1 . 11337 1 1126 . 1 1 95 95 LEU HD21 H 1 0.941 0.030 . 1 . . . . 95 LEU HD2 . 11337 1 1127 . 1 1 95 95 LEU HD22 H 1 0.941 0.030 . 1 . . . . 95 LEU HD2 . 11337 1 1128 . 1 1 95 95 LEU HD23 H 1 0.941 0.030 . 1 . . . . 95 LEU HD2 . 11337 1 1129 . 1 1 95 95 LEU HG H 1 1.765 0.030 . 1 . . . . 95 LEU HG . 11337 1 1130 . 1 1 95 95 LEU C C 13 179.477 0.300 . 1 . . . . 95 LEU C . 11337 1 1131 . 1 1 95 95 LEU CA C 13 57.730 0.300 . 1 . . . . 95 LEU CA . 11337 1 1132 . 1 1 95 95 LEU CB C 13 41.474 0.300 . 1 . . . . 95 LEU CB . 11337 1 1133 . 1 1 95 95 LEU CD1 C 13 26.200 0.300 . 2 . . . . 95 LEU CD1 . 11337 1 1134 . 1 1 95 95 LEU CD2 C 13 23.176 0.300 . 2 . . . . 95 LEU CD2 . 11337 1 1135 . 1 1 95 95 LEU CG C 13 27.504 0.300 . 1 . . . . 95 LEU CG . 11337 1 1136 . 1 1 95 95 LEU N N 15 119.574 0.300 . 1 . . . . 95 LEU N . 11337 1 1137 . 1 1 96 96 GLU H H 1 7.609 0.030 . 1 . . . . 96 GLU H . 11337 1 1138 . 1 1 96 96 GLU HA H 1 4.058 0.030 . 1 . . . . 96 GLU HA . 11337 1 1139 . 1 1 96 96 GLU HB2 H 1 2.137 0.030 . 2 . . . . 96 GLU HB2 . 11337 1 1140 . 1 1 96 96 GLU HB3 H 1 2.092 0.030 . 2 . . . . 96 GLU HB3 . 11337 1 1141 . 1 1 96 96 GLU HG2 H 1 2.426 0.030 . 2 . . . . 96 GLU HG2 . 11337 1 1142 . 1 1 96 96 GLU HG3 H 1 2.113 0.030 . 2 . . . . 96 GLU HG3 . 11337 1 1143 . 1 1 96 96 GLU C C 13 179.672 0.300 . 1 . . . . 96 GLU C . 11337 1 1144 . 1 1 96 96 GLU CA C 13 59.275 0.300 . 1 . . . . 96 GLU CA . 11337 1 1145 . 1 1 96 96 GLU CB C 13 29.775 0.300 . 1 . . . . 96 GLU CB . 11337 1 1146 . 1 1 96 96 GLU CG C 13 36.262 0.300 . 1 . . . . 96 GLU CG . 11337 1 1147 . 1 1 96 96 GLU N N 15 119.784 0.300 . 1 . . . . 96 GLU N . 11337 1 1148 . 1 1 97 97 GLN H H 1 7.321 0.030 . 1 . . . . 97 GLN H . 11337 1 1149 . 1 1 97 97 GLN HA H 1 3.752 0.030 . 1 . . . . 97 GLN HA . 11337 1 1150 . 1 1 97 97 GLN HB2 H 1 1.397 0.030 . 2 . . . . 97 GLN HB2 . 11337 1 1151 . 1 1 97 97 GLN HB3 H 1 1.314 0.030 . 2 . . . . 97 GLN HB3 . 11337 1 1152 . 1 1 97 97 GLN HE21 H 1 7.067 0.030 . 2 . . . . 97 GLN HE21 . 11337 1 1153 . 1 1 97 97 GLN HE22 H 1 6.559 0.030 . 2 . . . . 97 GLN HE22 . 11337 1 1154 . 1 1 97 97 GLN HG2 H 1 1.070 0.030 . 2 . . . . 97 GLN HG2 . 11337 1 1155 . 1 1 97 97 GLN HG3 H 1 0.585 0.030 . 2 . . . . 97 GLN HG3 . 11337 1 1156 . 1 1 97 97 GLN C C 13 178.725 0.300 . 1 . . . . 97 GLN C . 11337 1 1157 . 1 1 97 97 GLN CA C 13 57.379 0.300 . 1 . . . . 97 GLN CA . 11337 1 1158 . 1 1 97 97 GLN CB C 13 26.522 0.300 . 1 . . . . 97 GLN CB . 11337 1 1159 . 1 1 97 97 GLN CG C 13 30.675 0.300 . 1 . . . . 97 GLN CG . 11337 1 1160 . 1 1 97 97 GLN N N 15 118.897 0.300 . 1 . . . . 97 GLN N . 11337 1 1161 . 1 1 97 97 GLN NE2 N 15 111.531 0.300 . 1 . . . . 97 GLN NE2 . 11337 1 1162 . 1 1 98 98 ALA H H 1 8.461 0.030 . 1 . . . . 98 ALA H . 11337 1 1163 . 1 1 98 98 ALA HA H 1 3.974 0.030 . 1 . . . . 98 ALA HA . 11337 1 1164 . 1 1 98 98 ALA HB1 H 1 1.600 0.030 . 1 . . . . 98 ALA HB . 11337 1 1165 . 1 1 98 98 ALA HB2 H 1 1.600 0.030 . 1 . . . . 98 ALA HB . 11337 1 1166 . 1 1 98 98 ALA HB3 H 1 1.600 0.030 . 1 . . . . 98 ALA HB . 11337 1 1167 . 1 1 98 98 ALA C C 13 178.191 0.300 . 1 . . . . 98 ALA C . 11337 1 1168 . 1 1 98 98 ALA CA C 13 54.799 0.300 . 1 . . . . 98 ALA CA . 11337 1 1169 . 1 1 98 98 ALA CB C 13 18.968 0.300 . 1 . . . . 98 ALA CB . 11337 1 1170 . 1 1 98 98 ALA N N 15 122.340 0.300 . 1 . . . . 98 ALA N . 11337 1 1171 . 1 1 99 99 GLU H H 1 7.506 0.030 . 1 . . . . 99 GLU H . 11337 1 1172 . 1 1 99 99 GLU HA H 1 3.858 0.030 . 1 . . . . 99 GLU HA . 11337 1 1173 . 1 1 99 99 GLU HB2 H 1 2.131 0.030 . 2 . . . . 99 GLU HB2 . 11337 1 1174 . 1 1 99 99 GLU HB3 H 1 2.096 0.030 . 2 . . . . 99 GLU HB3 . 11337 1 1175 . 1 1 99 99 GLU HG2 H 1 2.504 0.030 . 2 . . . . 99 GLU HG2 . 11337 1 1176 . 1 1 99 99 GLU HG3 H 1 2.314 0.030 . 2 . . . . 99 GLU HG3 . 11337 1 1177 . 1 1 99 99 GLU C C 13 178.737 0.300 . 1 . . . . 99 GLU C . 11337 1 1178 . 1 1 99 99 GLU CA C 13 59.605 0.300 . 1 . . . . 99 GLU CA . 11337 1 1179 . 1 1 99 99 GLU CB C 13 29.628 0.300 . 1 . . . . 99 GLU CB . 11337 1 1180 . 1 1 99 99 GLU CG C 13 36.440 0.300 . 1 . . . . 99 GLU CG . 11337 1 1181 . 1 1 99 99 GLU N N 15 115.907 0.300 . 1 . . . . 99 GLU N . 11337 1 1182 . 1 1 100 100 SER H H 1 7.371 0.030 . 1 . . . . 100 SER H . 11337 1 1183 . 1 1 100 100 SER HA H 1 4.369 0.030 . 1 . . . . 100 SER HA . 11337 1 1184 . 1 1 100 100 SER HB2 H 1 3.965 0.030 . 1 . . . . 100 SER HB2 . 11337 1 1185 . 1 1 100 100 SER HB3 H 1 3.965 0.030 . 1 . . . . 100 SER HB3 . 11337 1 1186 . 1 1 100 100 SER C C 13 174.331 0.300 . 1 . . . . 100 SER C . 11337 1 1187 . 1 1 100 100 SER CA C 13 60.329 0.300 . 1 . . . . 100 SER CA . 11337 1 1188 . 1 1 100 100 SER CB C 13 63.698 0.300 . 1 . . . . 100 SER CB . 11337 1 1189 . 1 1 100 100 SER N N 15 112.401 0.300 . 1 . . . . 100 SER N . 11337 1 1190 . 1 1 101 101 LEU H H 1 7.570 0.030 . 1 . . . . 101 LEU H . 11337 1 1191 . 1 1 101 101 LEU HA H 1 4.439 0.030 . 1 . . . . 101 LEU HA . 11337 1 1192 . 1 1 101 101 LEU HB2 H 1 1.925 0.030 . 2 . . . . 101 LEU HB2 . 11337 1 1193 . 1 1 101 101 LEU HB3 H 1 1.870 0.030 . 2 . . . . 101 LEU HB3 . 11337 1 1194 . 1 1 101 101 LEU HD11 H 1 0.840 0.030 . 1 . . . . 101 LEU HD1 . 11337 1 1195 . 1 1 101 101 LEU HD12 H 1 0.840 0.030 . 1 . . . . 101 LEU HD1 . 11337 1 1196 . 1 1 101 101 LEU HD13 H 1 0.840 0.030 . 1 . . . . 101 LEU HD1 . 11337 1 1197 . 1 1 101 101 LEU HD21 H 1 0.785 0.030 . 1 . . . . 101 LEU HD2 . 11337 1 1198 . 1 1 101 101 LEU HD22 H 1 0.785 0.030 . 1 . . . . 101 LEU HD2 . 11337 1 1199 . 1 1 101 101 LEU HD23 H 1 0.785 0.030 . 1 . . . . 101 LEU HD2 . 11337 1 1200 . 1 1 101 101 LEU HG H 1 1.597 0.030 . 1 . . . . 101 LEU HG . 11337 1 1201 . 1 1 101 101 LEU C C 13 175.375 0.300 . 1 . . . . 101 LEU C . 11337 1 1202 . 1 1 101 101 LEU CA C 13 54.120 0.300 . 1 . . . . 101 LEU CA . 11337 1 1203 . 1 1 101 101 LEU CB C 13 43.011 0.300 . 1 . . . . 101 LEU CB . 11337 1 1204 . 1 1 101 101 LEU CD1 C 13 26.290 0.300 . 2 . . . . 101 LEU CD1 . 11337 1 1205 . 1 1 101 101 LEU CD2 C 13 22.382 0.300 . 2 . . . . 101 LEU CD2 . 11337 1 1206 . 1 1 101 101 LEU CG C 13 26.271 0.300 . 1 . . . . 101 LEU CG . 11337 1 1207 . 1 1 101 101 LEU N N 15 122.359 0.300 . 1 . . . . 101 LEU N . 11337 1 1208 . 1 1 102 102 LEU H H 1 6.724 0.030 . 1 . . . . 102 LEU H . 11337 1 1209 . 1 1 102 102 LEU HA H 1 3.833 0.030 . 1 . . . . 102 LEU HA . 11337 1 1210 . 1 1 102 102 LEU HB2 H 1 1.697 0.030 . 2 . . . . 102 LEU HB2 . 11337 1 1211 . 1 1 102 102 LEU HB3 H 1 1.481 0.030 . 2 . . . . 102 LEU HB3 . 11337 1 1212 . 1 1 102 102 LEU HD11 H 1 0.918 0.030 . 1 . . . . 102 LEU HD1 . 11337 1 1213 . 1 1 102 102 LEU HD12 H 1 0.918 0.030 . 1 . . . . 102 LEU HD1 . 11337 1 1214 . 1 1 102 102 LEU HD13 H 1 0.918 0.030 . 1 . . . . 102 LEU HD1 . 11337 1 1215 . 1 1 102 102 LEU HD21 H 1 0.694 0.030 . 1 . . . . 102 LEU HD2 . 11337 1 1216 . 1 1 102 102 LEU HD22 H 1 0.694 0.030 . 1 . . . . 102 LEU HD2 . 11337 1 1217 . 1 1 102 102 LEU HD23 H 1 0.694 0.030 . 1 . . . . 102 LEU HD2 . 11337 1 1218 . 1 1 102 102 LEU HG H 1 1.828 0.030 . 1 . . . . 102 LEU HG . 11337 1 1219 . 1 1 102 102 LEU C C 13 177.742 0.300 . 1 . . . . 102 LEU C . 11337 1 1220 . 1 1 102 102 LEU CA C 13 57.276 0.300 . 1 . . . . 102 LEU CA . 11337 1 1221 . 1 1 102 102 LEU CB C 13 42.957 0.300 . 1 . . . . 102 LEU CB . 11337 1 1222 . 1 1 102 102 LEU CD1 C 13 25.414 0.300 . 2 . . . . 102 LEU CD1 . 11337 1 1223 . 1 1 102 102 LEU CD2 C 13 23.802 0.300 . 2 . . . . 102 LEU CD2 . 11337 1 1224 . 1 1 102 102 LEU CG C 13 26.982 0.300 . 1 . . . . 102 LEU CG . 11337 1 1225 . 1 1 102 102 LEU N N 15 117.734 0.300 . 1 . . . . 102 LEU N . 11337 1 1226 . 1 1 103 103 SER H H 1 8.188 0.030 . 1 . . . . 103 SER H . 11337 1 1227 . 1 1 103 103 SER HA H 1 3.551 0.030 . 1 . . . . 103 SER HA . 11337 1 1228 . 1 1 103 103 SER HB2 H 1 4.215 0.030 . 2 . . . . 103 SER HB2 . 11337 1 1229 . 1 1 103 103 SER HB3 H 1 3.957 0.030 . 2 . . . . 103 SER HB3 . 11337 1 1230 . 1 1 103 103 SER CA C 13 62.139 0.300 . 1 . . . . 103 SER CA . 11337 1 1231 . 1 1 103 103 SER CB C 13 62.416 0.300 . 1 . . . . 103 SER CB . 11337 1 1232 . 1 1 103 103 SER N N 15 112.929 0.300 . 1 . . . . 103 SER N . 11337 1 1233 . 1 1 104 104 GLU H H 1 8.095 0.030 . 1 . . . . 104 GLU H . 11337 1 1234 . 1 1 104 104 GLU HA H 1 4.764 0.030 . 1 . . . . 104 GLU HA . 11337 1 1235 . 1 1 104 104 GLU HB2 H 1 2.000 0.030 . 2 . . . . 104 GLU HB2 . 11337 1 1236 . 1 1 104 104 GLU HB3 H 1 1.867 0.030 . 2 . . . . 104 GLU HB3 . 11337 1 1237 . 1 1 104 104 GLU HG2 H 1 2.154 0.030 . 1 . . . . 104 GLU HG2 . 11337 1 1238 . 1 1 104 104 GLU HG3 H 1 2.154 0.030 . 1 . . . . 104 GLU HG3 . 11337 1 1239 . 1 1 104 104 GLU CA C 13 53.503 0.300 . 1 . . . . 104 GLU CA . 11337 1 1240 . 1 1 104 104 GLU CB C 13 31.341 0.300 . 1 . . . . 104 GLU CB . 11337 1 1241 . 1 1 104 104 GLU CG C 13 35.564 0.300 . 1 . . . . 104 GLU CG . 11337 1 1242 . 1 1 104 104 GLU N N 15 122.718 0.300 . 1 . . . . 104 GLU N . 11337 1 1243 . 1 1 105 105 PRO HA H 1 4.268 0.030 . 1 . . . . 105 PRO HA . 11337 1 1244 . 1 1 105 105 PRO HB2 H 1 2.302 0.030 . 2 . . . . 105 PRO HB2 . 11337 1 1245 . 1 1 105 105 PRO HB3 H 1 1.944 0.030 . 2 . . . . 105 PRO HB3 . 11337 1 1246 . 1 1 105 105 PRO HD2 H 1 3.710 0.030 . 1 . . . . 105 PRO HD2 . 11337 1 1247 . 1 1 105 105 PRO HD3 H 1 3.710 0.030 . 1 . . . . 105 PRO HD3 . 11337 1 1248 . 1 1 105 105 PRO HG2 H 1 2.217 0.030 . 2 . . . . 105 PRO HG2 . 11337 1 1249 . 1 1 105 105 PRO HG3 H 1 1.844 0.030 . 2 . . . . 105 PRO HG3 . 11337 1 1250 . 1 1 105 105 PRO C C 13 178.567 0.300 . 1 . . . . 105 PRO C . 11337 1 1251 . 1 1 105 105 PRO CA C 13 64.043 0.300 . 1 . . . . 105 PRO CA . 11337 1 1252 . 1 1 105 105 PRO CB C 13 31.044 0.300 . 1 . . . . 105 PRO CB . 11337 1 1253 . 1 1 105 105 PRO CD C 13 49.998 0.300 . 1 . . . . 105 PRO CD . 11337 1 1254 . 1 1 105 105 PRO CG C 13 28.263 0.300 . 1 . . . . 105 PRO CG . 11337 1 1255 . 1 1 106 106 MET H H 1 8.372 0.030 . 1 . . . . 106 MET H . 11337 1 1256 . 1 1 106 106 MET HA H 1 4.976 0.030 . 1 . . . . 106 MET HA . 11337 1 1257 . 1 1 106 106 MET HB2 H 1 2.219 0.030 . 1 . . . . 106 MET HB2 . 11337 1 1258 . 1 1 106 106 MET HB3 H 1 2.219 0.030 . 1 . . . . 106 MET HB3 . 11337 1 1259 . 1 1 106 106 MET HE1 H 1 2.176 0.030 . 1 . . . . 106 MET HE . 11337 1 1260 . 1 1 106 106 MET HE2 H 1 2.176 0.030 . 1 . . . . 106 MET HE . 11337 1 1261 . 1 1 106 106 MET HE3 H 1 2.176 0.030 . 1 . . . . 106 MET HE . 11337 1 1262 . 1 1 106 106 MET HG2 H 1 3.059 0.030 . 2 . . . . 106 MET HG2 . 11337 1 1263 . 1 1 106 106 MET HG3 H 1 2.427 0.030 . 2 . . . . 106 MET HG3 . 11337 1 1264 . 1 1 106 106 MET C C 13 176.419 0.300 . 1 . . . . 106 MET C . 11337 1 1265 . 1 1 106 106 MET CA C 13 56.626 0.300 . 1 . . . . 106 MET CA . 11337 1 1266 . 1 1 106 106 MET CB C 13 37.600 0.300 . 1 . . . . 106 MET CB . 11337 1 1267 . 1 1 106 106 MET CE C 13 16.998 0.300 . 1 . . . . 106 MET CE . 11337 1 1268 . 1 1 106 106 MET CG C 13 31.086 0.300 . 1 . . . . 106 MET CG . 11337 1 1269 . 1 1 106 106 MET N N 15 122.028 0.300 . 1 . . . . 106 MET N . 11337 1 1270 . 1 1 107 107 VAL H H 1 9.205 0.030 . 1 . . . . 107 VAL H . 11337 1 1271 . 1 1 107 107 VAL HA H 1 3.192 0.030 . 1 . . . . 107 VAL HA . 11337 1 1272 . 1 1 107 107 VAL HB H 1 2.107 0.030 . 1 . . . . 107 VAL HB . 11337 1 1273 . 1 1 107 107 VAL HG11 H 1 0.316 0.030 . 1 . . . . 107 VAL HG1 . 11337 1 1274 . 1 1 107 107 VAL HG12 H 1 0.316 0.030 . 1 . . . . 107 VAL HG1 . 11337 1 1275 . 1 1 107 107 VAL HG13 H 1 0.316 0.030 . 1 . . . . 107 VAL HG1 . 11337 1 1276 . 1 1 107 107 VAL HG21 H 1 0.839 0.030 . 1 . . . . 107 VAL HG2 . 11337 1 1277 . 1 1 107 107 VAL HG22 H 1 0.839 0.030 . 1 . . . . 107 VAL HG2 . 11337 1 1278 . 1 1 107 107 VAL HG23 H 1 0.839 0.030 . 1 . . . . 107 VAL HG2 . 11337 1 1279 . 1 1 107 107 VAL C C 13 177.511 0.300 . 1 . . . . 107 VAL C . 11337 1 1280 . 1 1 107 107 VAL CA C 13 69.022 0.300 . 1 . . . . 107 VAL CA . 11337 1 1281 . 1 1 107 107 VAL CB C 13 30.352 0.300 . 1 . . . . 107 VAL CB . 11337 1 1282 . 1 1 107 107 VAL CG1 C 13 21.391 0.300 . 2 . . . . 107 VAL CG1 . 11337 1 1283 . 1 1 107 107 VAL CG2 C 13 22.465 0.300 . 2 . . . . 107 VAL CG2 . 11337 1 1284 . 1 1 107 107 VAL N N 15 123.008 0.300 . 1 . . . . 107 VAL N . 11337 1 1285 . 1 1 108 108 HIS H H 1 9.617 0.030 . 1 . . . . 108 HIS H . 11337 1 1286 . 1 1 108 108 HIS HA H 1 4.234 0.030 . 1 . . . . 108 HIS HA . 11337 1 1287 . 1 1 108 108 HIS HB2 H 1 3.107 0.030 . 1 . . . . 108 HIS HB2 . 11337 1 1288 . 1 1 108 108 HIS HB3 H 1 3.107 0.030 . 1 . . . . 108 HIS HB3 . 11337 1 1289 . 1 1 108 108 HIS HD2 H 1 6.862 0.030 . 1 . . . . 108 HIS HD2 . 11337 1 1290 . 1 1 108 108 HIS HE1 H 1 7.724 0.030 . 1 . . . . 108 HIS HE1 . 11337 1 1291 . 1 1 108 108 HIS C C 13 177.087 0.300 . 1 . . . . 108 HIS C . 11337 1 1292 . 1 1 108 108 HIS CA C 13 59.645 0.300 . 1 . . . . 108 HIS CA . 11337 1 1293 . 1 1 108 108 HIS CB C 13 30.470 0.300 . 1 . . . . 108 HIS CB . 11337 1 1294 . 1 1 108 108 HIS CD2 C 13 118.336 0.300 . 1 . . . . 108 HIS CD2 . 11337 1 1295 . 1 1 108 108 HIS CE1 C 13 138.038 0.300 . 1 . . . . 108 HIS CE1 . 11337 1 1296 . 1 1 108 108 HIS N N 15 118.543 0.300 . 1 . . . . 108 HIS N . 11337 1 1297 . 1 1 109 109 GLU H H 1 8.296 0.030 . 1 . . . . 109 GLU H . 11337 1 1298 . 1 1 109 109 GLU HA H 1 3.856 0.030 . 1 . . . . 109 GLU HA . 11337 1 1299 . 1 1 109 109 GLU HB2 H 1 2.107 0.030 . 2 . . . . 109 GLU HB2 . 11337 1 1300 . 1 1 109 109 GLU HB3 H 1 2.004 0.030 . 2 . . . . 109 GLU HB3 . 11337 1 1301 . 1 1 109 109 GLU HG2 H 1 2.393 0.030 . 2 . . . . 109 GLU HG2 . 11337 1 1302 . 1 1 109 109 GLU HG3 H 1 2.355 0.030 . 2 . . . . 109 GLU HG3 . 11337 1 1303 . 1 1 109 109 GLU C C 13 180.011 0.300 . 1 . . . . 109 GLU C . 11337 1 1304 . 1 1 109 109 GLU CA C 13 59.897 0.300 . 1 . . . . 109 GLU CA . 11337 1 1305 . 1 1 109 109 GLU CB C 13 28.934 0.300 . 1 . . . . 109 GLU CB . 11337 1 1306 . 1 1 109 109 GLU CG C 13 36.329 0.300 . 1 . . . . 109 GLU CG . 11337 1 1307 . 1 1 109 109 GLU N N 15 116.430 0.300 . 1 . . . . 109 GLU N . 11337 1 1308 . 1 1 110 110 LEU H H 1 8.343 0.030 . 1 . . . . 110 LEU H . 11337 1 1309 . 1 1 110 110 LEU HA H 1 4.213 0.030 . 1 . . . . 110 LEU HA . 11337 1 1310 . 1 1 110 110 LEU HB2 H 1 2.382 0.030 . 2 . . . . 110 LEU HB2 . 11337 1 1311 . 1 1 110 110 LEU HB3 H 1 1.457 0.030 . 2 . . . . 110 LEU HB3 . 11337 1 1312 . 1 1 110 110 LEU HD11 H 1 0.949 0.030 . 1 . . . . 110 LEU HD1 . 11337 1 1313 . 1 1 110 110 LEU HD12 H 1 0.949 0.030 . 1 . . . . 110 LEU HD1 . 11337 1 1314 . 1 1 110 110 LEU HD13 H 1 0.949 0.030 . 1 . . . . 110 LEU HD1 . 11337 1 1315 . 1 1 110 110 LEU HD21 H 1 0.708 0.030 . 1 . . . . 110 LEU HD2 . 11337 1 1316 . 1 1 110 110 LEU HD22 H 1 0.708 0.030 . 1 . . . . 110 LEU HD2 . 11337 1 1317 . 1 1 110 110 LEU HD23 H 1 0.708 0.030 . 1 . . . . 110 LEU HD2 . 11337 1 1318 . 1 1 110 110 LEU HG H 1 2.122 0.030 . 1 . . . . 110 LEU HG . 11337 1 1319 . 1 1 110 110 LEU C C 13 178.761 0.300 . 1 . . . . 110 LEU C . 11337 1 1320 . 1 1 110 110 LEU CA C 13 58.138 0.300 . 1 . . . . 110 LEU CA . 11337 1 1321 . 1 1 110 110 LEU CB C 13 41.753 0.300 . 1 . . . . 110 LEU CB . 11337 1 1322 . 1 1 110 110 LEU CD1 C 13 26.570 0.300 . 2 . . . . 110 LEU CD1 . 11337 1 1323 . 1 1 110 110 LEU CD2 C 13 22.121 0.300 . 2 . . . . 110 LEU CD2 . 11337 1 1324 . 1 1 110 110 LEU CG C 13 26.010 0.300 . 1 . . . . 110 LEU CG . 11337 1 1325 . 1 1 110 110 LEU N N 15 119.892 0.300 . 1 . . . . 110 LEU N . 11337 1 1326 . 1 1 111 111 VAL H H 1 8.570 0.030 . 1 . . . . 111 VAL H . 11337 1 1327 . 1 1 111 111 VAL HA H 1 3.679 0.030 . 1 . . . . 111 VAL HA . 11337 1 1328 . 1 1 111 111 VAL HB H 1 2.479 0.030 . 1 . . . . 111 VAL HB . 11337 1 1329 . 1 1 111 111 VAL HG11 H 1 1.134 0.030 . 1 . . . . 111 VAL HG1 . 11337 1 1330 . 1 1 111 111 VAL HG12 H 1 1.134 0.030 . 1 . . . . 111 VAL HG1 . 11337 1 1331 . 1 1 111 111 VAL HG13 H 1 1.134 0.030 . 1 . . . . 111 VAL HG1 . 11337 1 1332 . 1 1 111 111 VAL HG21 H 1 1.211 0.030 . 1 . . . . 111 VAL HG2 . 11337 1 1333 . 1 1 111 111 VAL HG22 H 1 1.211 0.030 . 1 . . . . 111 VAL HG2 . 11337 1 1334 . 1 1 111 111 VAL HG23 H 1 1.211 0.030 . 1 . . . . 111 VAL HG2 . 11337 1 1335 . 1 1 111 111 VAL C C 13 178.058 0.300 . 1 . . . . 111 VAL C . 11337 1 1336 . 1 1 111 111 VAL CA C 13 67.270 0.300 . 1 . . . . 111 VAL CA . 11337 1 1337 . 1 1 111 111 VAL CB C 13 31.505 0.300 . 1 . . . . 111 VAL CB . 11337 1 1338 . 1 1 111 111 VAL CG1 C 13 21.907 0.300 . 2 . . . . 111 VAL CG1 . 11337 1 1339 . 1 1 111 111 VAL CG2 C 13 23.618 0.300 . 2 . . . . 111 VAL CG2 . 11337 1 1340 . 1 1 111 111 VAL N N 15 120.269 0.300 . 1 . . . . 111 VAL N . 11337 1 1341 . 1 1 112 112 LEU H H 1 8.643 0.030 . 1 . . . . 112 LEU H . 11337 1 1342 . 1 1 112 112 LEU HA H 1 4.181 0.030 . 1 . . . . 112 LEU HA . 11337 1 1343 . 1 1 112 112 LEU HB2 H 1 1.775 0.030 . 2 . . . . 112 LEU HB2 . 11337 1 1344 . 1 1 112 112 LEU HB3 H 1 1.391 0.030 . 2 . . . . 112 LEU HB3 . 11337 1 1345 . 1 1 112 112 LEU HD11 H 1 0.521 0.030 . 1 . . . . 112 LEU HD1 . 11337 1 1346 . 1 1 112 112 LEU HD12 H 1 0.521 0.030 . 1 . . . . 112 LEU HD1 . 11337 1 1347 . 1 1 112 112 LEU HD13 H 1 0.521 0.030 . 1 . . . . 112 LEU HD1 . 11337 1 1348 . 1 1 112 112 LEU HD21 H 1 0.851 0.030 . 1 . . . . 112 LEU HD2 . 11337 1 1349 . 1 1 112 112 LEU HD22 H 1 0.851 0.030 . 1 . . . . 112 LEU HD2 . 11337 1 1350 . 1 1 112 112 LEU HD23 H 1 0.851 0.030 . 1 . . . . 112 LEU HD2 . 11337 1 1351 . 1 1 112 112 LEU HG H 1 1.468 0.030 . 1 . . . . 112 LEU HG . 11337 1 1352 . 1 1 112 112 LEU C C 13 180.011 0.300 . 1 . . . . 112 LEU C . 11337 1 1353 . 1 1 112 112 LEU CA C 13 57.989 0.300 . 1 . . . . 112 LEU CA . 11337 1 1354 . 1 1 112 112 LEU CB C 13 41.725 0.300 . 1 . . . . 112 LEU CB . 11337 1 1355 . 1 1 112 112 LEU CD1 C 13 24.965 0.300 . 2 . . . . 112 LEU CD1 . 11337 1 1356 . 1 1 112 112 LEU CD2 C 13 22.680 0.300 . 2 . . . . 112 LEU CD2 . 11337 1 1357 . 1 1 112 112 LEU CG C 13 26.767 0.300 . 1 . . . . 112 LEU CG . 11337 1 1358 . 1 1 112 112 LEU N N 15 119.908 0.300 . 1 . . . . 112 LEU N . 11337 1 1359 . 1 1 113 113 TRP H H 1 8.520 0.030 . 1 . . . . 113 TRP H . 11337 1 1360 . 1 1 113 113 TRP HA H 1 4.063 0.030 . 1 . . . . 113 TRP HA . 11337 1 1361 . 1 1 113 113 TRP HB2 H 1 3.592 0.030 . 2 . . . . 113 TRP HB2 . 11337 1 1362 . 1 1 113 113 TRP HB3 H 1 3.457 0.030 . 2 . . . . 113 TRP HB3 . 11337 1 1363 . 1 1 113 113 TRP HD1 H 1 7.307 0.030 . 1 . . . . 113 TRP HD1 . 11337 1 1364 . 1 1 113 113 TRP HE1 H 1 10.252 0.030 . 1 . . . . 113 TRP HE1 . 11337 1 1365 . 1 1 113 113 TRP HE3 H 1 7.273 0.030 . 1 . . . . 113 TRP HE3 . 11337 1 1366 . 1 1 113 113 TRP HH2 H 1 6.975 0.030 . 1 . . . . 113 TRP HH2 . 11337 1 1367 . 1 1 113 113 TRP HZ2 H 1 7.381 0.030 . 1 . . . . 113 TRP HZ2 . 11337 1 1368 . 1 1 113 113 TRP HZ3 H 1 6.647 0.030 . 1 . . . . 113 TRP HZ3 . 11337 1 1369 . 1 1 113 113 TRP C C 13 180.982 0.300 . 1 . . . . 113 TRP C . 11337 1 1370 . 1 1 113 113 TRP CA C 13 63.273 0.300 . 1 . . . . 113 TRP CA . 11337 1 1371 . 1 1 113 113 TRP CB C 13 28.581 0.300 . 1 . . . . 113 TRP CB . 11337 1 1372 . 1 1 113 113 TRP CD1 C 13 127.835 0.300 . 1 . . . . 113 TRP CD1 . 11337 1 1373 . 1 1 113 113 TRP CE3 C 13 119.419 0.300 . 1 . . . . 113 TRP CE3 . 11337 1 1374 . 1 1 113 113 TRP CH2 C 13 124.116 0.300 . 1 . . . . 113 TRP CH2 . 11337 1 1375 . 1 1 113 113 TRP CZ2 C 13 115.066 0.300 . 1 . . . . 113 TRP CZ2 . 11337 1 1376 . 1 1 113 113 TRP CZ3 C 13 120.030 0.300 . 1 . . . . 113 TRP CZ3 . 11337 1 1377 . 1 1 113 113 TRP N N 15 118.837 0.300 . 1 . . . . 113 TRP N . 11337 1 1378 . 1 1 113 113 TRP NE1 N 15 132.277 0.300 . 1 . . . . 113 TRP NE1 . 11337 1 1379 . 1 1 114 114 ILE H H 1 8.914 0.030 . 1 . . . . 114 ILE H . 11337 1 1380 . 1 1 114 114 ILE HA H 1 4.068 0.030 . 1 . . . . 114 ILE HA . 11337 1 1381 . 1 1 114 114 ILE HB H 1 2.238 0.030 . 1 . . . . 114 ILE HB . 11337 1 1382 . 1 1 114 114 ILE HD11 H 1 1.018 0.030 . 1 . . . . 114 ILE HD1 . 11337 1 1383 . 1 1 114 114 ILE HD12 H 1 1.018 0.030 . 1 . . . . 114 ILE HD1 . 11337 1 1384 . 1 1 114 114 ILE HD13 H 1 1.018 0.030 . 1 . . . . 114 ILE HD1 . 11337 1 1385 . 1 1 114 114 ILE HG12 H 1 1.514 0.030 . 2 . . . . 114 ILE HG12 . 11337 1 1386 . 1 1 114 114 ILE HG13 H 1 1.314 0.030 . 2 . . . . 114 ILE HG13 . 11337 1 1387 . 1 1 114 114 ILE HG21 H 1 1.277 0.030 . 1 . . . . 114 ILE HG2 . 11337 1 1388 . 1 1 114 114 ILE HG22 H 1 1.277 0.030 . 1 . . . . 114 ILE HG2 . 11337 1 1389 . 1 1 114 114 ILE HG23 H 1 1.277 0.030 . 1 . . . . 114 ILE HG2 . 11337 1 1390 . 1 1 114 114 ILE C C 13 176.540 0.300 . 1 . . . . 114 ILE C . 11337 1 1391 . 1 1 114 114 ILE CA C 13 61.323 0.300 . 1 . . . . 114 ILE CA . 11337 1 1392 . 1 1 114 114 ILE CB C 13 37.937 0.300 . 1 . . . . 114 ILE CB . 11337 1 1393 . 1 1 114 114 ILE CD1 C 13 15.685 0.300 . 1 . . . . 114 ILE CD1 . 11337 1 1394 . 1 1 114 114 ILE CG1 C 13 30.158 0.300 . 1 . . . . 114 ILE CG1 . 11337 1 1395 . 1 1 114 114 ILE CG2 C 13 19.223 0.300 . 1 . . . . 114 ILE CG2 . 11337 1 1396 . 1 1 114 114 ILE N N 15 120.178 0.300 . 1 . . . . 114 ILE N . 11337 1 1397 . 1 1 115 115 GLN H H 1 8.439 0.030 . 1 . . . . 115 GLN H . 11337 1 1398 . 1 1 115 115 GLN HA H 1 3.962 0.030 . 1 . . . . 115 GLN HA . 11337 1 1399 . 1 1 115 115 GLN HB2 H 1 2.635 0.030 . 2 . . . . 115 GLN HB2 . 11337 1 1400 . 1 1 115 115 GLN HB3 H 1 2.121 0.030 . 2 . . . . 115 GLN HB3 . 11337 1 1401 . 1 1 115 115 GLN HE21 H 1 7.148 0.030 . 2 . . . . 115 GLN HE21 . 11337 1 1402 . 1 1 115 115 GLN HE22 H 1 6.673 0.030 . 2 . . . . 115 GLN HE22 . 11337 1 1403 . 1 1 115 115 GLN HG2 H 1 2.938 0.030 . 2 . . . . 115 GLN HG2 . 11337 1 1404 . 1 1 115 115 GLN HG3 H 1 2.629 0.030 . 2 . . . . 115 GLN HG3 . 11337 1 1405 . 1 1 115 115 GLN C C 13 179.344 0.300 . 1 . . . . 115 GLN C . 11337 1 1406 . 1 1 115 115 GLN CA C 13 59.794 0.300 . 1 . . . . 115 GLN CA . 11337 1 1407 . 1 1 115 115 GLN CB C 13 28.127 0.300 . 1 . . . . 115 GLN CB . 11337 1 1408 . 1 1 115 115 GLN CG C 13 34.069 0.300 . 1 . . . . 115 GLN CG . 11337 1 1409 . 1 1 115 115 GLN N N 15 121.863 0.300 . 1 . . . . 115 GLN N . 11337 1 1410 . 1 1 115 115 GLN NE2 N 15 109.014 0.300 . 1 . . . . 115 GLN NE2 . 11337 1 1411 . 1 1 116 116 GLN H H 1 7.548 0.030 . 1 . . . . 116 GLN H . 11337 1 1412 . 1 1 116 116 GLN HA H 1 4.254 0.030 . 1 . . . . 116 GLN HA . 11337 1 1413 . 1 1 116 116 GLN HB2 H 1 2.001 0.030 . 2 . . . . 116 GLN HB2 . 11337 1 1414 . 1 1 116 116 GLN HB3 H 1 1.898 0.030 . 2 . . . . 116 GLN HB3 . 11337 1 1415 . 1 1 116 116 GLN HE21 H 1 7.491 0.030 . 2 . . . . 116 GLN HE21 . 11337 1 1416 . 1 1 116 116 GLN HE22 H 1 6.893 0.030 . 2 . . . . 116 GLN HE22 . 11337 1 1417 . 1 1 116 116 GLN HG2 H 1 2.511 0.030 . 2 . . . . 116 GLN HG2 . 11337 1 1418 . 1 1 116 116 GLN HG3 H 1 2.380 0.030 . 2 . . . . 116 GLN HG3 . 11337 1 1419 . 1 1 116 116 GLN C C 13 177.305 0.300 . 1 . . . . 116 GLN C . 11337 1 1420 . 1 1 116 116 GLN CA C 13 56.998 0.300 . 1 . . . . 116 GLN CA . 11337 1 1421 . 1 1 116 116 GLN CB C 13 30.023 0.300 . 1 . . . . 116 GLN CB . 11337 1 1422 . 1 1 116 116 GLN CG C 13 34.025 0.300 . 1 . . . . 116 GLN CG . 11337 1 1423 . 1 1 116 116 GLN N N 15 114.572 0.300 . 1 . . . . 116 GLN N . 11337 1 1424 . 1 1 116 116 GLN NE2 N 15 112.159 0.300 . 1 . . . . 116 GLN NE2 . 11337 1 1425 . 1 1 117 117 ASN H H 1 7.791 0.030 . 1 . . . . 117 ASN H . 11337 1 1426 . 1 1 117 117 ASN HA H 1 4.692 0.030 . 1 . . . . 117 ASN HA . 11337 1 1427 . 1 1 117 117 ASN HB2 H 1 1.865 0.030 . 2 . . . . 117 ASN HB2 . 11337 1 1428 . 1 1 117 117 ASN HB3 H 1 0.871 0.030 . 2 . . . . 117 ASN HB3 . 11337 1 1429 . 1 1 117 117 ASN HD21 H 1 6.882 0.030 . 2 . . . . 117 ASN HD21 . 11337 1 1430 . 1 1 117 117 ASN HD22 H 1 6.164 0.030 . 2 . . . . 117 ASN HD22 . 11337 1 1431 . 1 1 117 117 ASN C C 13 175.776 0.300 . 1 . . . . 117 ASN C . 11337 1 1432 . 1 1 117 117 ASN CA C 13 54.687 0.300 . 1 . . . . 117 ASN CA . 11337 1 1433 . 1 1 117 117 ASN CB C 13 39.703 0.300 . 1 . . . . 117 ASN CB . 11337 1 1434 . 1 1 117 117 ASN N N 15 112.739 0.300 . 1 . . . . 117 ASN N . 11337 1 1435 . 1 1 117 117 ASN ND2 N 15 116.118 0.300 . 1 . . . . 117 ASN ND2 . 11337 1 1436 . 1 1 118 118 LEU H H 1 8.234 0.030 . 1 . . . . 118 LEU H . 11337 1 1437 . 1 1 118 118 LEU HA H 1 3.787 0.030 . 1 . . . . 118 LEU HA . 11337 1 1438 . 1 1 118 118 LEU HB2 H 1 1.912 0.030 . 2 . . . . 118 LEU HB2 . 11337 1 1439 . 1 1 118 118 LEU HB3 H 1 1.663 0.030 . 2 . . . . 118 LEU HB3 . 11337 1 1440 . 1 1 118 118 LEU HD11 H 1 0.771 0.030 . 1 . . . . 118 LEU HD1 . 11337 1 1441 . 1 1 118 118 LEU HD12 H 1 0.771 0.030 . 1 . . . . 118 LEU HD1 . 11337 1 1442 . 1 1 118 118 LEU HD13 H 1 0.771 0.030 . 1 . . . . 118 LEU HD1 . 11337 1 1443 . 1 1 118 118 LEU HD21 H 1 0.841 0.030 . 1 . . . . 118 LEU HD2 . 11337 1 1444 . 1 1 118 118 LEU HD22 H 1 0.841 0.030 . 1 . . . . 118 LEU HD2 . 11337 1 1445 . 1 1 118 118 LEU HD23 H 1 0.841 0.030 . 1 . . . . 118 LEU HD2 . 11337 1 1446 . 1 1 118 118 LEU HG H 1 1.485 0.030 . 1 . . . . 118 LEU HG . 11337 1 1447 . 1 1 118 118 LEU C C 13 177.718 0.300 . 1 . . . . 118 LEU C . 11337 1 1448 . 1 1 118 118 LEU CA C 13 59.955 0.300 . 1 . . . . 118 LEU CA . 11337 1 1449 . 1 1 118 118 LEU CB C 13 40.219 0.300 . 1 . . . . 118 LEU CB . 11337 1 1450 . 1 1 118 118 LEU CD1 C 13 27.303 0.300 . 2 . . . . 118 LEU CD1 . 11337 1 1451 . 1 1 118 118 LEU CD2 C 13 25.625 0.300 . 2 . . . . 118 LEU CD2 . 11337 1 1452 . 1 1 118 118 LEU CG C 13 26.653 0.300 . 1 . . . . 118 LEU CG . 11337 1 1453 . 1 1 118 118 LEU N N 15 125.267 0.300 . 1 . . . . 118 LEU N . 11337 1 1454 . 1 1 119 119 ARG H H 1 8.616 0.030 . 1 . . . . 119 ARG H . 11337 1 1455 . 1 1 119 119 ARG HA H 1 3.741 0.030 . 1 . . . . 119 ARG HA . 11337 1 1456 . 1 1 119 119 ARG HB2 H 1 1.480 0.030 . 2 . . . . 119 ARG HB2 . 11337 1 1457 . 1 1 119 119 ARG HB3 H 1 1.441 0.030 . 2 . . . . 119 ARG HB3 . 11337 1 1458 . 1 1 119 119 ARG HD2 H 1 2.747 0.030 . 2 . . . . 119 ARG HD2 . 11337 1 1459 . 1 1 119 119 ARG HD3 H 1 2.663 0.030 . 2 . . . . 119 ARG HD3 . 11337 1 1460 . 1 1 119 119 ARG HG2 H 1 1.058 0.030 . 2 . . . . 119 ARG HG2 . 11337 1 1461 . 1 1 119 119 ARG HG3 H 1 0.592 0.030 . 2 . . . . 119 ARG HG3 . 11337 1 1462 . 1 1 119 119 ARG C C 13 176.820 0.300 . 1 . . . . 119 ARG C . 11337 1 1463 . 1 1 119 119 ARG CA C 13 58.514 0.300 . 1 . . . . 119 ARG CA . 11337 1 1464 . 1 1 119 119 ARG CB C 13 28.169 0.300 . 1 . . . . 119 ARG CB . 11337 1 1465 . 1 1 119 119 ARG CD C 13 43.381 0.300 . 1 . . . . 119 ARG CD . 11337 1 1466 . 1 1 119 119 ARG CG C 13 25.356 0.300 . 1 . . . . 119 ARG CG . 11337 1 1467 . 1 1 119 119 ARG N N 15 113.981 0.300 . 1 . . . . 119 ARG N . 11337 1 1468 . 1 1 120 120 HIS H H 1 7.132 0.030 . 1 . . . . 120 HIS H . 11337 1 1469 . 1 1 120 120 HIS HA H 1 4.608 0.030 . 1 . . . . 120 HIS HA . 11337 1 1470 . 1 1 120 120 HIS HB2 H 1 3.184 0.030 . 2 . . . . 120 HIS HB2 . 11337 1 1471 . 1 1 120 120 HIS HB3 H 1 3.125 0.030 . 2 . . . . 120 HIS HB3 . 11337 1 1472 . 1 1 120 120 HIS HD2 H 1 7.137 0.030 . 1 . . . . 120 HIS HD2 . 11337 1 1473 . 1 1 120 120 HIS HE1 H 1 7.927 0.030 . 1 . . . . 120 HIS HE1 . 11337 1 1474 . 1 1 120 120 HIS C C 13 178.361 0.300 . 1 . . . . 120 HIS C . 11337 1 1475 . 1 1 120 120 HIS CA C 13 57.664 0.300 . 1 . . . . 120 HIS CA . 11337 1 1476 . 1 1 120 120 HIS CB C 13 30.723 0.300 . 1 . . . . 120 HIS CB . 11337 1 1477 . 1 1 120 120 HIS CD2 C 13 119.584 0.300 . 1 . . . . 120 HIS CD2 . 11337 1 1478 . 1 1 120 120 HIS CE1 C 13 137.392 0.300 . 1 . . . . 120 HIS CE1 . 11337 1 1479 . 1 1 120 120 HIS N N 15 118.652 0.300 . 1 . . . . 120 HIS N . 11337 1 1480 . 1 1 121 121 ILE H H 1 7.884 0.030 . 1 . . . . 121 ILE H . 11337 1 1481 . 1 1 121 121 ILE HA H 1 3.939 0.030 . 1 . . . . 121 ILE HA . 11337 1 1482 . 1 1 121 121 ILE HB H 1 1.969 0.030 . 1 . . . . 121 ILE HB . 11337 1 1483 . 1 1 121 121 ILE HD11 H 1 0.897 0.030 . 1 . . . . 121 ILE HD1 . 11337 1 1484 . 1 1 121 121 ILE HD12 H 1 0.897 0.030 . 1 . . . . 121 ILE HD1 . 11337 1 1485 . 1 1 121 121 ILE HD13 H 1 0.897 0.030 . 1 . . . . 121 ILE HD1 . 11337 1 1486 . 1 1 121 121 ILE HG12 H 1 1.752 0.030 . 2 . . . . 121 ILE HG12 . 11337 1 1487 . 1 1 121 121 ILE HG13 H 1 1.239 0.030 . 2 . . . . 121 ILE HG13 . 11337 1 1488 . 1 1 121 121 ILE HG21 H 1 0.933 0.030 . 1 . . . . 121 ILE HG2 . 11337 1 1489 . 1 1 121 121 ILE HG22 H 1 0.933 0.030 . 1 . . . . 121 ILE HG2 . 11337 1 1490 . 1 1 121 121 ILE HG23 H 1 0.933 0.030 . 1 . . . . 121 ILE HG2 . 11337 1 1491 . 1 1 121 121 ILE C C 13 177.972 0.300 . 1 . . . . 121 ILE C . 11337 1 1492 . 1 1 121 121 ILE CA C 13 64.103 0.300 . 1 . . . . 121 ILE CA . 11337 1 1493 . 1 1 121 121 ILE CB C 13 38.885 0.300 . 1 . . . . 121 ILE CB . 11337 1 1494 . 1 1 121 121 ILE CD1 C 13 14.991 0.300 . 1 . . . . 121 ILE CD1 . 11337 1 1495 . 1 1 121 121 ILE CG1 C 13 27.880 0.300 . 1 . . . . 121 ILE CG1 . 11337 1 1496 . 1 1 121 121 ILE CG2 C 13 17.720 0.300 . 1 . . . . 121 ILE CG2 . 11337 1 1497 . 1 1 121 121 ILE N N 15 119.164 0.300 . 1 . . . . 121 ILE N . 11337 1 1498 . 1 1 122 122 LEU H H 1 7.727 0.030 . 1 . . . . 122 LEU H . 11337 1 1499 . 1 1 122 122 LEU HA H 1 4.356 0.030 . 1 . . . . 122 LEU HA . 11337 1 1500 . 1 1 122 122 LEU HB2 H 1 1.695 0.030 . 2 . . . . 122 LEU HB2 . 11337 1 1501 . 1 1 122 122 LEU HB3 H 1 1.582 0.030 . 2 . . . . 122 LEU HB3 . 11337 1 1502 . 1 1 122 122 LEU HD11 H 1 0.761 0.030 . 1 . . . . 122 LEU HD1 . 11337 1 1503 . 1 1 122 122 LEU HD12 H 1 0.761 0.030 . 1 . . . . 122 LEU HD1 . 11337 1 1504 . 1 1 122 122 LEU HD13 H 1 0.761 0.030 . 1 . . . . 122 LEU HD1 . 11337 1 1505 . 1 1 122 122 LEU HD21 H 1 0.833 0.030 . 1 . . . . 122 LEU HD2 . 11337 1 1506 . 1 1 122 122 LEU HD22 H 1 0.833 0.030 . 1 . . . . 122 LEU HD2 . 11337 1 1507 . 1 1 122 122 LEU HD23 H 1 0.833 0.030 . 1 . . . . 122 LEU HD2 . 11337 1 1508 . 1 1 122 122 LEU HG H 1 1.780 0.030 . 1 . . . . 122 LEU HG . 11337 1 1509 . 1 1 122 122 LEU C C 13 177.026 0.300 . 1 . . . . 122 LEU C . 11337 1 1510 . 1 1 122 122 LEU CA C 13 55.169 0.300 . 1 . . . . 122 LEU CA . 11337 1 1511 . 1 1 122 122 LEU CB C 13 41.804 0.300 . 1 . . . . 122 LEU CB . 11337 1 1512 . 1 1 122 122 LEU CD1 C 13 26.481 0.300 . 2 . . . . 122 LEU CD1 . 11337 1 1513 . 1 1 122 122 LEU CD2 C 13 21.567 0.300 . 2 . . . . 122 LEU CD2 . 11337 1 1514 . 1 1 122 122 LEU CG C 13 26.404 0.300 . 1 . . . . 122 LEU CG . 11337 1 1515 . 1 1 122 122 LEU N N 15 116.467 0.300 . 1 . . . . 122 LEU N . 11337 1 1516 . 1 1 123 123 SER H H 1 7.514 0.030 . 1 . . . . 123 SER H . 11337 1 1517 . 1 1 123 123 SER HA H 1 4.358 0.030 . 1 . . . . 123 SER HA . 11337 1 1518 . 1 1 123 123 SER HB2 H 1 3.938 0.030 . 1 . . . . 123 SER HB2 . 11337 1 1519 . 1 1 123 123 SER HB3 H 1 3.938 0.030 . 1 . . . . 123 SER HB3 . 11337 1 1520 . 1 1 123 123 SER C C 13 173.882 0.300 . 1 . . . . 123 SER C . 11337 1 1521 . 1 1 123 123 SER CA C 13 58.630 0.300 . 1 . . . . 123 SER CA . 11337 1 1522 . 1 1 123 123 SER CB C 13 63.934 0.300 . 1 . . . . 123 SER CB . 11337 1 1523 . 1 1 123 123 SER N N 15 113.509 0.300 . 1 . . . . 123 SER N . 11337 1 1524 . 1 1 124 124 GLN H H 1 7.809 0.030 . 1 . . . . 124 GLN H . 11337 1 1525 . 1 1 124 124 GLN HA H 1 4.541 0.030 . 1 . . . . 124 GLN HA . 11337 1 1526 . 1 1 124 124 GLN HB2 H 1 2.108 0.030 . 2 . . . . 124 GLN HB2 . 11337 1 1527 . 1 1 124 124 GLN HB3 H 1 1.966 0.030 . 2 . . . . 124 GLN HB3 . 11337 1 1528 . 1 1 124 124 GLN HE21 H 1 7.480 0.030 . 2 . . . . 124 GLN HE21 . 11337 1 1529 . 1 1 124 124 GLN HE22 H 1 6.837 0.030 . 2 . . . . 124 GLN HE22 . 11337 1 1530 . 1 1 124 124 GLN HG2 H 1 2.409 0.030 . 1 . . . . 124 GLN HG2 . 11337 1 1531 . 1 1 124 124 GLN HG3 H 1 2.409 0.030 . 1 . . . . 124 GLN HG3 . 11337 1 1532 . 1 1 124 124 GLN C C 13 173.955 0.300 . 1 . . . . 124 GLN C . 11337 1 1533 . 1 1 124 124 GLN CA C 13 53.859 0.300 . 1 . . . . 124 GLN CA . 11337 1 1534 . 1 1 124 124 GLN CB C 13 28.704 0.300 . 1 . . . . 124 GLN CB . 11337 1 1535 . 1 1 124 124 GLN CG C 13 33.512 0.300 . 1 . . . . 124 GLN CG . 11337 1 1536 . 1 1 124 124 GLN N N 15 122.516 0.300 . 1 . . . . 124 GLN N . 11337 1 1537 . 1 1 124 124 GLN NE2 N 15 112.565 0.300 . 1 . . . . 124 GLN NE2 . 11337 1 1538 . 1 1 125 125 PRO HA H 1 4.439 0.030 . 1 . . . . 125 PRO HA . 11337 1 1539 . 1 1 125 125 PRO HB2 H 1 2.309 0.030 . 2 . . . . 125 PRO HB2 . 11337 1 1540 . 1 1 125 125 PRO HB3 H 1 1.921 0.030 . 2 . . . . 125 PRO HB3 . 11337 1 1541 . 1 1 125 125 PRO HD2 H 1 3.775 0.030 . 2 . . . . 125 PRO HD2 . 11337 1 1542 . 1 1 125 125 PRO HD3 H 1 3.636 0.030 . 2 . . . . 125 PRO HD3 . 11337 1 1543 . 1 1 125 125 PRO HG2 H 1 2.009 0.030 . 1 . . . . 125 PRO HG2 . 11337 1 1544 . 1 1 125 125 PRO HG3 H 1 2.009 0.030 . 1 . . . . 125 PRO HG3 . 11337 1 1545 . 1 1 125 125 PRO C C 13 177.087 0.300 . 1 . . . . 125 PRO C . 11337 1 1546 . 1 1 125 125 PRO CA C 13 63.235 0.300 . 1 . . . . 125 PRO CA . 11337 1 1547 . 1 1 125 125 PRO CB C 13 32.165 0.300 . 1 . . . . 125 PRO CB . 11337 1 1548 . 1 1 125 125 PRO CD C 13 50.616 0.300 . 1 . . . . 125 PRO CD . 11337 1 1549 . 1 1 125 125 PRO CG C 13 27.389 0.300 . 1 . . . . 125 PRO CG . 11337 1 1550 . 1 1 126 126 GLU H H 1 8.674 0.030 . 1 . . . . 126 GLU H . 11337 1 1551 . 1 1 126 126 GLU HA H 1 4.326 0.030 . 1 . . . . 126 GLU HA . 11337 1 1552 . 1 1 126 126 GLU HB2 H 1 2.083 0.030 . 2 . . . . 126 GLU HB2 . 11337 1 1553 . 1 1 126 126 GLU HB3 H 1 1.971 0.030 . 2 . . . . 126 GLU HB3 . 11337 1 1554 . 1 1 126 126 GLU HG2 H 1 2.296 0.030 . 1 . . . . 126 GLU HG2 . 11337 1 1555 . 1 1 126 126 GLU HG3 H 1 2.296 0.030 . 1 . . . . 126 GLU HG3 . 11337 1 1556 . 1 1 126 126 GLU C C 13 176.953 0.300 . 1 . . . . 126 GLU C . 11337 1 1557 . 1 1 126 126 GLU CA C 13 56.877 0.300 . 1 . . . . 126 GLU CA . 11337 1 1558 . 1 1 126 126 GLU CB C 13 30.146 0.300 . 1 . . . . 126 GLU CB . 11337 1 1559 . 1 1 126 126 GLU CG C 13 36.447 0.300 . 1 . . . . 126 GLU CG . 11337 1 1560 . 1 1 126 126 GLU N N 15 121.391 0.300 . 1 . . . . 126 GLU N . 11337 1 1561 . 1 1 127 127 THR H H 1 8.163 0.030 . 1 . . . . 127 THR H . 11337 1 1562 . 1 1 127 127 THR HA H 1 4.357 0.030 . 1 . . . . 127 THR HA . 11337 1 1563 . 1 1 127 127 THR HB H 1 4.293 0.030 . 1 . . . . 127 THR HB . 11337 1 1564 . 1 1 127 127 THR HG21 H 1 1.194 0.030 . 1 . . . . 127 THR HG2 . 11337 1 1565 . 1 1 127 127 THR HG22 H 1 1.194 0.030 . 1 . . . . 127 THR HG2 . 11337 1 1566 . 1 1 127 127 THR HG23 H 1 1.194 0.030 . 1 . . . . 127 THR HG2 . 11337 1 1567 . 1 1 127 127 THR C C 13 174.307 0.300 . 1 . . . . 127 THR C . 11337 1 1568 . 1 1 127 127 THR CA C 13 61.717 0.300 . 1 . . . . 127 THR CA . 11337 1 1569 . 1 1 127 127 THR CB C 13 69.994 0.300 . 1 . . . . 127 THR CB . 11337 1 1570 . 1 1 127 127 THR CG2 C 13 21.474 0.300 . 1 . . . . 127 THR CG2 . 11337 1 1571 . 1 1 127 127 THR N N 15 114.202 0.300 . 1 . . . . 127 THR N . 11337 1 1572 . 1 1 128 128 GLY H H 1 8.044 0.030 . 1 . . . . 128 GLY H . 11337 1 1573 . 1 1 128 128 GLY HA2 H 1 3.768 0.030 . 1 . . . . 128 GLY HA2 . 11337 1 1574 . 1 1 128 128 GLY HA3 H 1 3.768 0.030 . 1 . . . . 128 GLY HA3 . 11337 1 1575 . 1 1 128 128 GLY C C 13 179.053 0.300 . 1 . . . . 128 GLY C . 11337 1 1576 . 1 1 128 128 GLY CA C 13 46.209 0.300 . 1 . . . . 128 GLY CA . 11337 1 1577 . 1 1 128 128 GLY N N 15 117.308 0.300 . 1 . . . . 128 GLY N . 11337 1 stop_ save_