data_11405 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11405 _Entry.Title ; Assigned chemical shifts of RNA binding domain 3 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-09-09 _Entry.Accession_date 2010-09-09 _Entry.Last_release_date 2011-06-24 _Entry.Original_release_date 2011-06-24 _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 K. Tsuda . . . 11405 2 K. Kuwasako . . . 11405 3 M. Takahashi . . . 11405 4 T. Someya . . . 11405 5 M. Inoue . . . 11405 6 T. Terada . . . 11405 7 N. Kobayashi . . . 11405 8 M. Shirouzu . . . 11405 9 T. Kigawa . . . 11405 10 P. Guntert . . . 11405 11 Y. Muto . . . 11405 12 S. Yokoyama . . . 11405 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)' . 11405 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11405 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 474 11405 '15N chemical shifts' 114 11405 '1H chemical shifts' 749 11405 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 . . 2011-06-24 2010-09-09 original author . 11405 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 11406 'Assigned chemical shifts of RNA binding domain 3 in RNA (CUGCUG)' 11405 BMRB 11407 'Assigned chemical shifts of RNA binding domain 3 in RNA (UAUAUA)' 11405 BMRB 11408 'Assigned chemical shifts of RNA-binding domain 3 of CUGBP1 in complex with RNA (UG)3' 11405 PDB 2rq4 'Refinement of RNA binding domain 3 in CUG triplet repeat RNA-binding protein 1' 11405 PDB 2rqc 'Solution Structure of RNA-binding domain 3 of CUGBP1 in complex with RNA (UG)3' 11405 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11405 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19553194 _Citation.Full_citation . _Citation.Title 'Structural basis for the sequence-specific RNA-recognition mechanism of human CUG-BP1 RRM3.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nucleic Acids Res.' _Citation.Journal_name_full 'Nucleic acids research' _Citation.Journal_volume 37 _Citation.Journal_issue 15 _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 5151 _Citation.Page_last 5166 _Citation.Year 2009 _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 K. Tsuda . . . 11405 1 2 K. Kuwasako . . . 11405 1 3 M. Takahashi . . . 11405 1 4 T. Someya . . . 11405 1 5 M. Inoue . . . 11405 1 6 T. Terada . . . 11405 1 7 N. Kobayashi . . . 11405 1 8 M. Shirouzu . . . 11405 1 9 T. Kigawa . . . 11405 1 10 A. Tanaka . . . 11405 1 11 S. Sugano . . . 11405 1 12 P. Guntert . . . 11405 1 13 Y. Muto . . . 11405 1 14 S. Yokoyama . . . 11405 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11405 _Assembly.ID 1 _Assembly.Name 'CUG-BP- and ETR-3-like factor 1' _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 'RNA recognition motif' 1 $entity_1 A . yes native no no . . . 11405 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 2rq4 . . . . . . 11405 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11405 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'RNA recognition motif' _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 ; GSSGSSGLTQQSIGAAGSQK EGPEGANLFIYHLPQEFGDQ DLLQMFMPFGNVVSAKVFID KQTNLSKCFGFVSYDNPVSA QAAIQSMNGFQIGMKRLKVQ LKRSKNDSKSGPSSG ; _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 115 _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 BMRB 11406 . "RNA recognition motif" . . . . . 100.00 115 100.00 100.00 1.55e-75 . . . . 11405 1 2 no BMRB 11407 . "RNA recognition motif" . . . . . 100.00 115 100.00 100.00 1.55e-75 . . . . 11405 1 3 no BMRB 11408 . "RNA RECOGNITION MOTIF, RESIDUES 383-484" . . . . . 100.00 115 100.00 100.00 1.55e-75 . . . . 11405 1 4 no PDB 2CPZ . "Solution Structure Of Rna Binding Domain 3 In Cug Triplet Repeat Rna-Binding Protein 1" . . . . . 100.00 115 100.00 100.00 1.55e-75 . . . . 11405 1 5 no PDB 2RQ4 . "Refinement Of Rna Binding Domain 3 In Cug Triplet Repeat Rna-Binding Protein 1" . . . . . 100.00 115 100.00 100.00 1.55e-75 . . . . 11405 1 6 no PDB 2RQC . "Solution Structure Of Rna-Binding Domain 3 Of Cugbp1 In Complex With Rna (Ug)3" . . . . . 100.00 115 100.00 100.00 1.55e-75 . . . . 11405 1 7 no DBJ BAB29392 . "unnamed protein product [Mus musculus]" . . . . . 88.70 487 100.00 100.00 5.53e-64 . . . . 11405 1 8 no DBJ BAE06101 . "CUGBP1 variant protein [Homo sapiens]" . . . . . 88.70 512 100.00 100.00 1.06e-63 . . . . 11405 1 9 no DBJ BAE22391 . "unnamed protein product [Mus musculus]" . . . . . 74.78 88 100.00 100.00 5.58e-55 . . . . 11405 1 10 no DBJ BAE25504 . "unnamed protein product [Mus musculus]" . . . . . 88.70 486 99.02 100.00 2.29e-63 . . . . 11405 1 11 no DBJ BAE33820 . "unnamed protein product [Mus musculus]" . . . . . 88.70 486 99.02 99.02 9.21e-63 . . . . 11405 1 12 no EMBL CAC20566 . "deadenylation factor CUG-BP [Homo sapiens]" . . . . . 88.70 486 100.00 100.00 5.41e-64 . . . . 11405 1 13 no EMBL CAC20707 . "deadenylation factor EDEN-BP [Mus musculus]" . . . . . 88.70 486 100.00 100.00 6.15e-64 . . . . 11405 1 14 no EMBL CAH65197 . "hypothetical protein RCJMB04_7f23 [Gallus gallus]" . . . . . 88.70 485 100.00 100.00 7.13e-64 . . . . 11405 1 15 no EMBL CAH91665 . "hypothetical protein [Pongo abelii]" . . . . . 88.70 513 100.00 100.00 9.79e-64 . . . . 11405 1 16 no EMBL CAJ82289 . "CUG triplet repeat, RNA binding protein 1 [Xenopus (Silurana) tropicalis]" . . . . . 88.70 490 97.06 99.02 3.46e-62 . . . . 11405 1 17 no GB AAC50895 . "CUG-BP/hNab50 [Homo sapiens]" . . . . . 88.70 482 100.00 100.00 5.41e-64 . . . . 11405 1 18 no GB AAF78955 . "CUG-binding protein LYLQ isoform [Homo sapiens]" . . . . . 88.70 486 100.00 100.00 5.41e-64 . . . . 11405 1 19 no GB AAF78956 . "CUG-binding protein A isoform [Homo sapiens]" . . . . . 88.70 483 100.00 100.00 5.53e-64 . . . . 11405 1 20 no GB AAF78957 . "CUG-binding protein LYLQ isoform [Mus musculus]" . . . . . 88.70 486 100.00 100.00 4.67e-64 . . . . 11405 1 21 no GB AAF86230 . "RNA-binding protein BRUNOL2 [Homo sapiens]" . . . . . 88.70 486 100.00 100.00 5.41e-64 . . . . 11405 1 22 no REF NP_001012539 . "CUGBP Elav-like family member 1 [Gallus gallus]" . . . . . 88.70 485 100.00 100.00 7.13e-64 . . . . 11405 1 23 no REF NP_001017152 . "CUGBP Elav-like family member 1 [Xenopus (Silurana) tropicalis]" . . . . . 88.70 490 97.06 99.02 3.46e-62 . . . . 11405 1 24 no REF NP_001020592 . "CUGBP Elav-like family member 1 [Rattus norvegicus]" . . . . . 88.70 487 100.00 100.00 5.36e-64 . . . . 11405 1 25 no REF NP_001020767 . "CUGBP Elav-like family member 1 isoform 3 [Homo sapiens]" . . . . . 88.70 486 100.00 100.00 5.41e-64 . . . . 11405 1 26 no REF NP_001094682 . "CUGBP Elav-like family member 1 [Bos taurus]" . . . . . 88.70 486 99.02 99.02 2.63e-63 . . . . 11405 1 27 no SP P28659 . "RecName: Full=CUGBP Elav-like family member 1; Short=CELF-1; AltName: Full=50 kDa nuclear polyadenylated RNA-binding protein; A" . . . . . 88.70 486 100.00 100.00 6.15e-64 . . . . 11405 1 28 no SP Q28HE9 . "RecName: Full=CUGBP Elav-like family member 1; Short=CELF-1; AltName: Full=Bruno-like protein 2; AltName: Full=CUG triplet repe" . . . . . 88.70 490 97.06 99.02 3.46e-62 . . . . 11405 1 29 no SP Q4QQT3 . "RecName: Full=CUGBP Elav-like family member 1; Short=CELF-1; AltName: Full=Bruno-like protein 2; AltName: Full=CUG triplet repe" . . . . . 88.70 487 100.00 100.00 5.36e-64 . . . . 11405 1 30 no SP Q5F3T7 . "RecName: Full=CUGBP Elav-like family member 1; Short=CELF-1; AltName: Full=Bruno-like protein 2; AltName: Full=CUG triplet repe" . . . . . 88.70 489 100.00 100.00 7.37e-64 . . . . 11405 1 31 no SP Q5R995 . "RecName: Full=CUGBP Elav-like family member 1; Short=CELF-1; AltName: Full=Bruno-like protein 2; AltName: Full=CUG triplet repe" . . . . . 88.70 513 100.00 100.00 9.79e-64 . . . . 11405 1 32 no TPG DAA21780 . "TPA: CUG triplet repeat, RNA-binding protein 1 [Bos taurus]" . . . . . 88.70 486 99.02 99.02 2.63e-63 . . . . 11405 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'RNA recognition motif' . 11405 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 . 11405 1 2 . SER . 11405 1 3 . SER . 11405 1 4 . GLY . 11405 1 5 . SER . 11405 1 6 . SER . 11405 1 7 . GLY . 11405 1 8 . LEU . 11405 1 9 . THR . 11405 1 10 . GLN . 11405 1 11 . GLN . 11405 1 12 . SER . 11405 1 13 . ILE . 11405 1 14 . GLY . 11405 1 15 . ALA . 11405 1 16 . ALA . 11405 1 17 . GLY . 11405 1 18 . SER . 11405 1 19 . GLN . 11405 1 20 . LYS . 11405 1 21 . GLU . 11405 1 22 . GLY . 11405 1 23 . PRO . 11405 1 24 . GLU . 11405 1 25 . GLY . 11405 1 26 . ALA . 11405 1 27 . ASN . 11405 1 28 . LEU . 11405 1 29 . PHE . 11405 1 30 . ILE . 11405 1 31 . TYR . 11405 1 32 . HIS . 11405 1 33 . LEU . 11405 1 34 . PRO . 11405 1 35 . GLN . 11405 1 36 . GLU . 11405 1 37 . PHE . 11405 1 38 . GLY . 11405 1 39 . ASP . 11405 1 40 . GLN . 11405 1 41 . ASP . 11405 1 42 . LEU . 11405 1 43 . LEU . 11405 1 44 . GLN . 11405 1 45 . MET . 11405 1 46 . PHE . 11405 1 47 . MET . 11405 1 48 . PRO . 11405 1 49 . PHE . 11405 1 50 . GLY . 11405 1 51 . ASN . 11405 1 52 . VAL . 11405 1 53 . VAL . 11405 1 54 . SER . 11405 1 55 . ALA . 11405 1 56 . LYS . 11405 1 57 . VAL . 11405 1 58 . PHE . 11405 1 59 . ILE . 11405 1 60 . ASP . 11405 1 61 . LYS . 11405 1 62 . GLN . 11405 1 63 . THR . 11405 1 64 . ASN . 11405 1 65 . LEU . 11405 1 66 . SER . 11405 1 67 . LYS . 11405 1 68 . CYS . 11405 1 69 . PHE . 11405 1 70 . GLY . 11405 1 71 . PHE . 11405 1 72 . VAL . 11405 1 73 . SER . 11405 1 74 . TYR . 11405 1 75 . ASP . 11405 1 76 . ASN . 11405 1 77 . PRO . 11405 1 78 . VAL . 11405 1 79 . SER . 11405 1 80 . ALA . 11405 1 81 . GLN . 11405 1 82 . ALA . 11405 1 83 . ALA . 11405 1 84 . ILE . 11405 1 85 . GLN . 11405 1 86 . SER . 11405 1 87 . MET . 11405 1 88 . ASN . 11405 1 89 . GLY . 11405 1 90 . PHE . 11405 1 91 . GLN . 11405 1 92 . ILE . 11405 1 93 . GLY . 11405 1 94 . MET . 11405 1 95 . LYS . 11405 1 96 . ARG . 11405 1 97 . LEU . 11405 1 98 . LYS . 11405 1 99 . VAL . 11405 1 100 . GLN . 11405 1 101 . LEU . 11405 1 102 . LYS . 11405 1 103 . ARG . 11405 1 104 . SER . 11405 1 105 . LYS . 11405 1 106 . ASN . 11405 1 107 . ASP . 11405 1 108 . SER . 11405 1 109 . LYS . 11405 1 110 . SER . 11405 1 111 . GLY . 11405 1 112 . PRO . 11405 1 113 . SER . 11405 1 114 . SER . 11405 1 115 . GLY . 11405 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 11405 1 . SER 2 2 11405 1 . SER 3 3 11405 1 . GLY 4 4 11405 1 . SER 5 5 11405 1 . SER 6 6 11405 1 . GLY 7 7 11405 1 . LEU 8 8 11405 1 . THR 9 9 11405 1 . GLN 10 10 11405 1 . GLN 11 11 11405 1 . SER 12 12 11405 1 . ILE 13 13 11405 1 . GLY 14 14 11405 1 . ALA 15 15 11405 1 . ALA 16 16 11405 1 . GLY 17 17 11405 1 . SER 18 18 11405 1 . GLN 19 19 11405 1 . LYS 20 20 11405 1 . GLU 21 21 11405 1 . GLY 22 22 11405 1 . PRO 23 23 11405 1 . GLU 24 24 11405 1 . GLY 25 25 11405 1 . ALA 26 26 11405 1 . ASN 27 27 11405 1 . LEU 28 28 11405 1 . PHE 29 29 11405 1 . ILE 30 30 11405 1 . TYR 31 31 11405 1 . HIS 32 32 11405 1 . LEU 33 33 11405 1 . PRO 34 34 11405 1 . GLN 35 35 11405 1 . GLU 36 36 11405 1 . PHE 37 37 11405 1 . GLY 38 38 11405 1 . ASP 39 39 11405 1 . GLN 40 40 11405 1 . ASP 41 41 11405 1 . LEU 42 42 11405 1 . LEU 43 43 11405 1 . GLN 44 44 11405 1 . MET 45 45 11405 1 . PHE 46 46 11405 1 . MET 47 47 11405 1 . PRO 48 48 11405 1 . PHE 49 49 11405 1 . GLY 50 50 11405 1 . ASN 51 51 11405 1 . VAL 52 52 11405 1 . VAL 53 53 11405 1 . SER 54 54 11405 1 . ALA 55 55 11405 1 . LYS 56 56 11405 1 . VAL 57 57 11405 1 . PHE 58 58 11405 1 . ILE 59 59 11405 1 . ASP 60 60 11405 1 . LYS 61 61 11405 1 . GLN 62 62 11405 1 . THR 63 63 11405 1 . ASN 64 64 11405 1 . LEU 65 65 11405 1 . SER 66 66 11405 1 . LYS 67 67 11405 1 . CYS 68 68 11405 1 . PHE 69 69 11405 1 . GLY 70 70 11405 1 . PHE 71 71 11405 1 . VAL 72 72 11405 1 . SER 73 73 11405 1 . TYR 74 74 11405 1 . ASP 75 75 11405 1 . ASN 76 76 11405 1 . PRO 77 77 11405 1 . VAL 78 78 11405 1 . SER 79 79 11405 1 . ALA 80 80 11405 1 . GLN 81 81 11405 1 . ALA 82 82 11405 1 . ALA 83 83 11405 1 . ILE 84 84 11405 1 . GLN 85 85 11405 1 . SER 86 86 11405 1 . MET 87 87 11405 1 . ASN 88 88 11405 1 . GLY 89 89 11405 1 . PHE 90 90 11405 1 . GLN 91 91 11405 1 . ILE 92 92 11405 1 . GLY 93 93 11405 1 . MET 94 94 11405 1 . LYS 95 95 11405 1 . ARG 96 96 11405 1 . LEU 97 97 11405 1 . LYS 98 98 11405 1 . VAL 99 99 11405 1 . GLN 100 100 11405 1 . LEU 101 101 11405 1 . LYS 102 102 11405 1 . ARG 103 103 11405 1 . SER 104 104 11405 1 . LYS 105 105 11405 1 . ASN 106 106 11405 1 . ASP 107 107 11405 1 . SER 108 108 11405 1 . LYS 109 109 11405 1 . SER 110 110 11405 1 . GLY 111 111 11405 1 . PRO 112 112 11405 1 . SER 113 113 11405 1 . SER 114 114 11405 1 . GLY 115 115 11405 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 11405 _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 . . . . . . . . . . . . . . . . . . . . . 11405 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 11405 _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 . . . . . . . . . . . . . . . . P040329-21 . . . . . . 11405 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11405 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.37mM {[U-100%} {13C;} U-100% 15N\] protein, 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 'RNA recognition motif' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.37 . . mM . . . . 11405 1 2 salt . . . . . . salt 100 . . mM . . . . 11405 1 3 H2O . . . . . . solvent 90 . . % . . . . 11405 1 4 D2O . . . . . . solvent 10 . . % . . . . 11405 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 11405 _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 11405 1 pH 7.0 0.05 pH 11405 1 pressure 1 0.001 atm 11405 1 temperature 298 0.1 K 11405 1 stop_ save_ ############################ # Computer software used # ############################ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 11405 _Software.ID 1 _Software.Name AMBER _Software.Version 9.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollm' . . 11405 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11405 1 stop_ save_ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 11405 _Software.ID 2 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker, Biospin' . . 11405 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11405 2 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11405 _Software.ID 3 _Software.Name NMRPipe _Software.Version 20030801 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer, and, Bax' . . 11405 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11405 3 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11405 _Software.ID 4 _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, One, Moon, Scientific' . . 11405 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11405 4 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11405 _Software.ID 5 _Software.Name Kujira _Software.Version 0.9297 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11405 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11405 5 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11405 _Software.ID 6 _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, Mumenthaler, and, Wuthrich' . . 11405 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 11405 6 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 11405 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 11405 _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 . 700 . . . 11405 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 11405 _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 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11405 1 2 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11405 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 11405 _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 . . . . . . . . . 11405 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11405 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11405 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 11405 _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 1H-15N NOESY' 1 $sample_1 isotropic 11405 1 2 '3D 1H-13C NOESY' 1 $sample_1 isotropic 11405 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 $AMBER . . 11405 1 2 $xwinnmr . . 11405 1 3 $NMRPipe . . 11405 1 4 $NMRView . . 11405 1 5 $Kujira . . 11405 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 HA H 1 4.466 0.030 . 1 . . . . 6 SER HA . 11405 1 2 . 1 1 6 6 SER HB2 H 1 3.890 0.030 . 2 . . . . 6 SER HB2 . 11405 1 3 . 1 1 6 6 SER C C 13 175.010 0.300 . 1 . . . . 6 SER C . 11405 1 4 . 1 1 6 6 SER CA C 13 58.770 0.300 . 1 . . . . 6 SER CA . 11405 1 5 . 1 1 6 6 SER CB C 13 63.887 0.300 . 1 . . . . 6 SER CB . 11405 1 6 . 1 1 7 7 GLY H H 1 8.392 0.030 . 1 . . . . 7 GLY H . 11405 1 7 . 1 1 7 7 GLY HA2 H 1 3.956 0.030 . 1 . . . . 7 GLY HA2 . 11405 1 8 . 1 1 7 7 GLY HA3 H 1 3.956 0.030 . 1 . . . . 7 GLY HA3 . 11405 1 9 . 1 1 7 7 GLY C C 13 174.132 0.300 . 1 . . . . 7 GLY C . 11405 1 10 . 1 1 7 7 GLY CA C 13 45.380 0.300 . 1 . . . . 7 GLY CA . 11405 1 11 . 1 1 7 7 GLY N N 15 110.589 0.300 . 1 . . . . 7 GLY N . 11405 1 12 . 1 1 8 8 LEU H H 1 8.090 0.030 . 1 . . . . 8 LEU H . 11405 1 13 . 1 1 8 8 LEU HA H 1 4.398 0.030 . 1 . . . . 8 LEU HA . 11405 1 14 . 1 1 8 8 LEU HB2 H 1 1.636 0.030 . 2 . . . . 8 LEU HB2 . 11405 1 15 . 1 1 8 8 LEU HB3 H 1 1.575 0.030 . 2 . . . . 8 LEU HB3 . 11405 1 16 . 1 1 8 8 LEU HD11 H 1 0.901 0.030 . 1 . . . . 8 LEU HD1 . 11405 1 17 . 1 1 8 8 LEU HD12 H 1 0.901 0.030 . 1 . . . . 8 LEU HD1 . 11405 1 18 . 1 1 8 8 LEU HD13 H 1 0.901 0.030 . 1 . . . . 8 LEU HD1 . 11405 1 19 . 1 1 8 8 LEU HD21 H 1 0.850 0.030 . 1 . . . . 8 LEU HD2 . 11405 1 20 . 1 1 8 8 LEU HD22 H 1 0.850 0.030 . 1 . . . . 8 LEU HD2 . 11405 1 21 . 1 1 8 8 LEU HD23 H 1 0.850 0.030 . 1 . . . . 8 LEU HD2 . 11405 1 22 . 1 1 8 8 LEU HG H 1 1.593 0.030 . 1 . . . . 8 LEU HG . 11405 1 23 . 1 1 8 8 LEU C C 13 177.784 0.300 . 1 . . . . 8 LEU C . 11405 1 24 . 1 1 8 8 LEU CA C 13 55.343 0.300 . 1 . . . . 8 LEU CA . 11405 1 25 . 1 1 8 8 LEU CB C 13 42.385 0.300 . 1 . . . . 8 LEU CB . 11405 1 26 . 1 1 8 8 LEU CD1 C 13 24.606 0.300 . 2 . . . . 8 LEU CD1 . 11405 1 27 . 1 1 8 8 LEU CD2 C 13 23.420 0.300 . 2 . . . . 8 LEU CD2 . 11405 1 28 . 1 1 8 8 LEU CG C 13 26.964 0.300 . 1 . . . . 8 LEU CG . 11405 1 29 . 1 1 8 8 LEU N N 15 121.493 0.300 . 1 . . . . 8 LEU N . 11405 1 30 . 1 1 9 9 THR H H 1 8.135 0.030 . 1 . . . . 9 THR H . 11405 1 31 . 1 1 9 9 THR HA H 1 4.322 0.030 . 1 . . . . 9 THR HA . 11405 1 32 . 1 1 9 9 THR HB H 1 4.221 0.030 . 1 . . . . 9 THR HB . 11405 1 33 . 1 1 9 9 THR HG21 H 1 1.182 0.030 . 1 . . . . 9 THR HG2 . 11405 1 34 . 1 1 9 9 THR HG22 H 1 1.182 0.030 . 1 . . . . 9 THR HG2 . 11405 1 35 . 1 1 9 9 THR HG23 H 1 1.182 0.030 . 1 . . . . 9 THR HG2 . 11405 1 36 . 1 1 9 9 THR C C 13 174.557 0.300 . 1 . . . . 9 THR C . 11405 1 37 . 1 1 9 9 THR CA C 13 61.984 0.300 . 1 . . . . 9 THR CA . 11405 1 38 . 1 1 9 9 THR CB C 13 69.915 0.300 . 1 . . . . 9 THR CB . 11405 1 39 . 1 1 9 9 THR CG2 C 13 21.679 0.300 . 1 . . . . 9 THR CG2 . 11405 1 40 . 1 1 9 9 THR N N 15 114.789 0.300 . 1 . . . . 9 THR N . 11405 1 41 . 1 1 10 10 GLN H H 1 8.401 0.030 . 1 . . . . 10 GLN H . 11405 1 42 . 1 1 10 10 GLN HA H 1 4.308 0.030 . 1 . . . . 10 GLN HA . 11405 1 43 . 1 1 10 10 GLN HB2 H 1 2.082 0.030 . 2 . . . . 10 GLN HB2 . 11405 1 44 . 1 1 10 10 GLN HB3 H 1 1.983 0.030 . 2 . . . . 10 GLN HB3 . 11405 1 45 . 1 1 10 10 GLN HG2 H 1 2.342 0.030 . 1 . . . . 10 GLN HG2 . 11405 1 46 . 1 1 10 10 GLN HG3 H 1 2.342 0.030 . 1 . . . . 10 GLN HG3 . 11405 1 47 . 1 1 10 10 GLN C C 13 175.855 0.300 . 1 . . . . 10 GLN C . 11405 1 48 . 1 1 10 10 GLN CA C 13 56.023 0.300 . 1 . . . . 10 GLN CA . 11405 1 49 . 1 1 10 10 GLN CB C 13 29.509 0.300 . 1 . . . . 10 GLN CB . 11405 1 50 . 1 1 10 10 GLN CG C 13 33.851 0.300 . 1 . . . . 10 GLN CG . 11405 1 51 . 1 1 10 10 GLN N N 15 122.512 0.300 . 1 . . . . 10 GLN N . 11405 1 52 . 1 1 11 11 GLN H H 1 8.376 0.030 . 1 . . . . 11 GLN H . 11405 1 53 . 1 1 11 11 GLN HA H 1 4.312 0.030 . 1 . . . . 11 GLN HA . 11405 1 54 . 1 1 11 11 GLN HB2 H 1 2.082 0.030 . 2 . . . . 11 GLN HB2 . 11405 1 55 . 1 1 11 11 GLN HB3 H 1 1.976 0.030 . 2 . . . . 11 GLN HB3 . 11405 1 56 . 1 1 11 11 GLN HG2 H 1 2.346 0.030 . 1 . . . . 11 GLN HG2 . 11405 1 57 . 1 1 11 11 GLN HG3 H 1 2.346 0.030 . 1 . . . . 11 GLN HG3 . 11405 1 58 . 1 1 11 11 GLN C C 13 176.079 0.300 . 1 . . . . 11 GLN C . 11405 1 59 . 1 1 11 11 GLN CA C 13 56.069 0.300 . 1 . . . . 11 GLN CA . 11405 1 60 . 1 1 11 11 GLN CB C 13 29.281 0.300 . 1 . . . . 11 GLN CB . 11405 1 61 . 1 1 11 11 GLN CG C 13 33.770 0.300 . 1 . . . . 11 GLN CG . 11405 1 62 . 1 1 11 11 GLN N N 15 121.447 0.300 . 1 . . . . 11 GLN N . 11405 1 63 . 1 1 12 12 SER H H 1 8.447 0.030 . 1 . . . . 12 SER H . 11405 1 64 . 1 1 12 12 SER HA H 1 4.476 0.030 . 1 . . . . 12 SER HA . 11405 1 65 . 1 1 12 12 SER HB2 H 1 3.873 0.030 . 1 . . . . 12 SER HB2 . 11405 1 66 . 1 1 12 12 SER HB3 H 1 3.873 0.030 . 1 . . . . 12 SER HB3 . 11405 1 67 . 1 1 12 12 SER C C 13 174.875 0.300 . 1 . . . . 12 SER C . 11405 1 68 . 1 1 12 12 SER CA C 13 58.402 0.300 . 1 . . . . 12 SER CA . 11405 1 69 . 1 1 12 12 SER CB C 13 63.687 0.300 . 1 . . . . 12 SER CB . 11405 1 70 . 1 1 12 12 SER N N 15 117.898 0.300 . 1 . . . . 12 SER N . 11405 1 71 . 1 1 13 13 ILE H H 1 8.240 0.030 . 1 . . . . 13 ILE H . 11405 1 72 . 1 1 13 13 ILE HA H 1 4.164 0.030 . 1 . . . . 13 ILE HA . 11405 1 73 . 1 1 13 13 ILE HB H 1 1.880 0.030 . 1 . . . . 13 ILE HB . 11405 1 74 . 1 1 13 13 ILE HD11 H 1 0.839 0.030 . 1 . . . . 13 ILE HD1 . 11405 1 75 . 1 1 13 13 ILE HD12 H 1 0.839 0.030 . 1 . . . . 13 ILE HD1 . 11405 1 76 . 1 1 13 13 ILE HD13 H 1 0.839 0.030 . 1 . . . . 13 ILE HD1 . 11405 1 77 . 1 1 13 13 ILE HG12 H 1 1.464 0.030 . 2 . . . . 13 ILE HG12 . 11405 1 78 . 1 1 13 13 ILE HG13 H 1 1.191 0.030 . 2 . . . . 13 ILE HG13 . 11405 1 79 . 1 1 13 13 ILE HG21 H 1 0.904 0.030 . 1 . . . . 13 ILE HG2 . 11405 1 80 . 1 1 13 13 ILE HG22 H 1 0.904 0.030 . 1 . . . . 13 ILE HG2 . 11405 1 81 . 1 1 13 13 ILE HG23 H 1 0.904 0.030 . 1 . . . . 13 ILE HG2 . 11405 1 82 . 1 1 13 13 ILE C C 13 176.973 0.300 . 1 . . . . 13 ILE C . 11405 1 83 . 1 1 13 13 ILE CA C 13 61.699 0.300 . 1 . . . . 13 ILE CA . 11405 1 84 . 1 1 13 13 ILE CB C 13 38.634 0.300 . 1 . . . . 13 ILE CB . 11405 1 85 . 1 1 13 13 ILE CD1 C 13 13.139 0.300 . 1 . . . . 13 ILE CD1 . 11405 1 86 . 1 1 13 13 ILE CG1 C 13 27.449 0.300 . 1 . . . . 13 ILE CG1 . 11405 1 87 . 1 1 13 13 ILE CG2 C 13 17.535 0.300 . 1 . . . . 13 ILE CG2 . 11405 1 88 . 1 1 13 13 ILE N N 15 122.952 0.300 . 1 . . . . 13 ILE N . 11405 1 89 . 1 1 14 14 GLY H H 1 8.445 0.030 . 1 . . . . 14 GLY H . 11405 1 90 . 1 1 14 14 GLY HA2 H 1 3.957 0.030 . 2 . . . . 14 GLY HA2 . 11405 1 91 . 1 1 14 14 GLY HA3 H 1 3.920 0.030 . 2 . . . . 14 GLY HA3 . 11405 1 92 . 1 1 14 14 GLY C C 13 174.004 0.300 . 1 . . . . 14 GLY C . 11405 1 93 . 1 1 14 14 GLY CA C 13 45.420 0.300 . 1 . . . . 14 GLY CA . 11405 1 94 . 1 1 14 14 GLY N N 15 112.602 0.300 . 1 . . . . 14 GLY N . 11405 1 95 . 1 1 15 15 ALA H H 1 7.938 0.030 . 1 . . . . 15 ALA H . 11405 1 96 . 1 1 15 15 ALA HA H 1 4.291 0.030 . 1 . . . . 15 ALA HA . 11405 1 97 . 1 1 15 15 ALA HB1 H 1 1.216 0.030 . 1 . . . . 15 ALA HB . 11405 1 98 . 1 1 15 15 ALA HB2 H 1 1.216 0.030 . 1 . . . . 15 ALA HB . 11405 1 99 . 1 1 15 15 ALA HB3 H 1 1.216 0.030 . 1 . . . . 15 ALA HB . 11405 1 100 . 1 1 15 15 ALA C C 13 179.170 0.300 . 1 . . . . 15 ALA C . 11405 1 101 . 1 1 15 15 ALA CA C 13 53.454 0.300 . 1 . . . . 15 ALA CA . 11405 1 102 . 1 1 15 15 ALA CB C 13 20.025 0.300 . 1 . . . . 15 ALA CB . 11405 1 103 . 1 1 15 15 ALA N N 15 122.921 0.300 . 1 . . . . 15 ALA N . 11405 1 104 . 1 1 16 16 ALA H H 1 8.250 0.030 . 1 . . . . 16 ALA H . 11405 1 105 . 1 1 16 16 ALA HA H 1 4.428 0.030 . 1 . . . . 16 ALA HA . 11405 1 106 . 1 1 16 16 ALA HB1 H 1 1.328 0.030 . 1 . . . . 16 ALA HB . 11405 1 107 . 1 1 16 16 ALA HB2 H 1 1.328 0.030 . 1 . . . . 16 ALA HB . 11405 1 108 . 1 1 16 16 ALA HB3 H 1 1.328 0.030 . 1 . . . . 16 ALA HB . 11405 1 109 . 1 1 16 16 ALA C C 13 178.021 0.300 . 1 . . . . 16 ALA C . 11405 1 110 . 1 1 16 16 ALA CA C 13 52.923 0.300 . 1 . . . . 16 ALA CA . 11405 1 111 . 1 1 16 16 ALA CB C 13 18.044 0.300 . 1 . . . . 16 ALA CB . 11405 1 112 . 1 1 16 16 ALA N N 15 121.429 0.300 . 1 . . . . 16 ALA N . 11405 1 113 . 1 1 17 17 GLY H H 1 9.003 0.030 . 1 . . . . 17 GLY H . 11405 1 114 . 1 1 17 17 GLY HA2 H 1 4.194 0.030 . 2 . . . . 17 GLY HA2 . 11405 1 115 . 1 1 17 17 GLY HA3 H 1 3.744 0.030 . 2 . . . . 17 GLY HA3 . 11405 1 116 . 1 1 17 17 GLY C C 13 174.017 0.300 . 1 . . . . 17 GLY C . 11405 1 117 . 1 1 17 17 GLY CA C 13 45.618 0.300 . 1 . . . . 17 GLY CA . 11405 1 118 . 1 1 17 17 GLY N N 15 111.512 0.300 . 1 . . . . 17 GLY N . 11405 1 119 . 1 1 18 18 SER H H 1 7.723 0.030 . 1 . . . . 18 SER H . 11405 1 120 . 1 1 18 18 SER HA H 1 4.436 0.030 . 1 . . . . 18 SER HA . 11405 1 121 . 1 1 18 18 SER HB2 H 1 3.927 0.030 . 1 . . . . 18 SER HB2 . 11405 1 122 . 1 1 18 18 SER HB3 H 1 3.927 0.030 . 1 . . . . 18 SER HB3 . 11405 1 123 . 1 1 18 18 SER C C 13 173.013 0.300 . 1 . . . . 18 SER C . 11405 1 124 . 1 1 18 18 SER CA C 13 57.645 0.300 . 1 . . . . 18 SER CA . 11405 1 125 . 1 1 18 18 SER CB C 13 64.233 0.300 . 1 . . . . 18 SER CB . 11405 1 126 . 1 1 18 18 SER N N 15 115.696 0.300 . 1 . . . . 18 SER N . 11405 1 127 . 1 1 19 19 GLN H H 1 8.340 0.030 . 1 . . . . 19 GLN H . 11405 1 128 . 1 1 19 19 GLN HA H 1 4.401 0.030 . 1 . . . . 19 GLN HA . 11405 1 129 . 1 1 19 19 GLN HB2 H 1 1.956 0.030 . 2 . . . . 19 GLN HB2 . 11405 1 130 . 1 1 19 19 GLN HB3 H 1 1.671 0.030 . 2 . . . . 19 GLN HB3 . 11405 1 131 . 1 1 19 19 GLN HE21 H 1 7.347 0.030 . 2 . . . . 19 GLN HE21 . 11405 1 132 . 1 1 19 19 GLN HE22 H 1 6.771 0.030 . 2 . . . . 19 GLN HE22 . 11405 1 133 . 1 1 19 19 GLN HG2 H 1 2.008 0.030 . 1 . . . . 19 GLN HG2 . 11405 1 134 . 1 1 19 19 GLN HG3 H 1 2.008 0.030 . 1 . . . . 19 GLN HG3 . 11405 1 135 . 1 1 19 19 GLN C C 13 174.929 0.300 . 1 . . . . 19 GLN C . 11405 1 136 . 1 1 19 19 GLN CA C 13 54.804 0.300 . 1 . . . . 19 GLN CA . 11405 1 137 . 1 1 19 19 GLN CB C 13 29.889 0.300 . 1 . . . . 19 GLN CB . 11405 1 138 . 1 1 19 19 GLN CG C 13 34.357 0.300 . 1 . . . . 19 GLN CG . 11405 1 139 . 1 1 19 19 GLN N N 15 119.940 0.300 . 1 . . . . 19 GLN N . 11405 1 140 . 1 1 19 19 GLN NE2 N 15 111.356 0.300 . 1 . . . . 19 GLN NE2 . 11405 1 141 . 1 1 20 20 LYS H H 1 8.099 0.030 . 1 . . . . 20 LYS H . 11405 1 142 . 1 1 20 20 LYS HA H 1 4.168 0.030 . 1 . . . . 20 LYS HA . 11405 1 143 . 1 1 20 20 LYS HB2 H 1 1.610 0.030 . 1 . . . . 20 LYS HB2 . 11405 1 144 . 1 1 20 20 LYS HB3 H 1 1.610 0.030 . 1 . . . . 20 LYS HB3 . 11405 1 145 . 1 1 20 20 LYS HD2 H 1 1.608 0.030 . 1 . . . . 20 LYS HD2 . 11405 1 146 . 1 1 20 20 LYS HD3 H 1 1.608 0.030 . 1 . . . . 20 LYS HD3 . 11405 1 147 . 1 1 20 20 LYS HE2 H 1 2.933 0.030 . 1 . . . . 20 LYS HE2 . 11405 1 148 . 1 1 20 20 LYS HE3 H 1 2.933 0.030 . 1 . . . . 20 LYS HE3 . 11405 1 149 . 1 1 20 20 LYS HG2 H 1 1.380 0.030 . 2 . . . . 20 LYS HG2 . 11405 1 150 . 1 1 20 20 LYS HG3 H 1 1.335 0.030 . 2 . . . . 20 LYS HG3 . 11405 1 151 . 1 1 20 20 LYS C C 13 175.944 0.300 . 1 . . . . 20 LYS C . 11405 1 152 . 1 1 20 20 LYS CA C 13 56.481 0.300 . 1 . . . . 20 LYS CA . 11405 1 153 . 1 1 20 20 LYS CB C 13 33.098 0.300 . 1 . . . . 20 LYS CB . 11405 1 154 . 1 1 20 20 LYS CD C 13 29.104 0.300 . 1 . . . . 20 LYS CD . 11405 1 155 . 1 1 20 20 LYS CE C 13 42.126 0.300 . 1 . . . . 20 LYS CE . 11405 1 156 . 1 1 20 20 LYS CG C 13 24.758 0.300 . 1 . . . . 20 LYS CG . 11405 1 157 . 1 1 20 20 LYS N N 15 123.479 0.300 . 1 . . . . 20 LYS N . 11405 1 158 . 1 1 21 21 GLU H H 1 8.550 0.030 . 1 . . . . 21 GLU H . 11405 1 159 . 1 1 21 21 GLU HA H 1 4.418 0.030 . 1 . . . . 21 GLU HA . 11405 1 160 . 1 1 21 21 GLU HB2 H 1 2.269 0.030 . 2 . . . . 21 GLU HB2 . 11405 1 161 . 1 1 21 21 GLU HB3 H 1 1.917 0.030 . 2 . . . . 21 GLU HB3 . 11405 1 162 . 1 1 21 21 GLU HG2 H 1 2.348 0.030 . 2 . . . . 21 GLU HG2 . 11405 1 163 . 1 1 21 21 GLU HG3 H 1 2.107 0.030 . 2 . . . . 21 GLU HG3 . 11405 1 164 . 1 1 21 21 GLU C C 13 177.700 0.300 . 1 . . . . 21 GLU C . 11405 1 165 . 1 1 21 21 GLU CA C 13 56.609 0.300 . 1 . . . . 21 GLU CA . 11405 1 166 . 1 1 21 21 GLU CB C 13 31.334 0.300 . 1 . . . . 21 GLU CB . 11405 1 167 . 1 1 21 21 GLU CG C 13 37.170 0.300 . 1 . . . . 21 GLU CG . 11405 1 168 . 1 1 21 21 GLU N N 15 124.009 0.300 . 1 . . . . 21 GLU N . 11405 1 169 . 1 1 22 22 GLY H H 1 9.391 0.030 . 1 . . . . 22 GLY H . 11405 1 170 . 1 1 22 22 GLY HA2 H 1 4.408 0.030 . 2 . . . . 22 GLY HA2 . 11405 1 171 . 1 1 22 22 GLY HA3 H 1 4.214 0.030 . 2 . . . . 22 GLY HA3 . 11405 1 172 . 1 1 22 22 GLY C C 13 171.935 0.300 . 1 . . . . 22 GLY C . 11405 1 173 . 1 1 22 22 GLY CA C 13 43.493 0.300 . 1 . . . . 22 GLY CA . 11405 1 174 . 1 1 22 22 GLY N N 15 110.847 0.300 . 1 . . . . 22 GLY N . 11405 1 175 . 1 1 23 23 PRO HA H 1 4.481 0.030 . 1 . . . . 23 PRO HA . 11405 1 176 . 1 1 23 23 PRO HB2 H 1 2.370 0.030 . 2 . . . . 23 PRO HB2 . 11405 1 177 . 1 1 23 23 PRO HB3 H 1 1.910 0.030 . 2 . . . . 23 PRO HB3 . 11405 1 178 . 1 1 23 23 PRO HD2 H 1 3.721 0.030 . 2 . . . . 23 PRO HD2 . 11405 1 179 . 1 1 23 23 PRO HD3 H 1 3.535 0.030 . 2 . . . . 23 PRO HD3 . 11405 1 180 . 1 1 23 23 PRO HG2 H 1 2.015 0.030 . 2 . . . . 23 PRO HG2 . 11405 1 181 . 1 1 23 23 PRO HG3 H 1 1.607 0.030 . 2 . . . . 23 PRO HG3 . 11405 1 182 . 1 1 23 23 PRO C C 13 174.188 0.300 . 1 . . . . 23 PRO C . 11405 1 183 . 1 1 23 23 PRO CA C 13 62.369 0.300 . 1 . . . . 23 PRO CA . 11405 1 184 . 1 1 23 23 PRO CB C 13 32.731 0.300 . 1 . . . . 23 PRO CB . 11405 1 185 . 1 1 23 23 PRO CD C 13 48.974 0.300 . 1 . . . . 23 PRO CD . 11405 1 186 . 1 1 23 23 PRO CG C 13 27.237 0.300 . 1 . . . . 23 PRO CG . 11405 1 187 . 1 1 24 24 GLU H H 1 8.362 0.030 . 1 . . . . 24 GLU H . 11405 1 188 . 1 1 24 24 GLU HA H 1 4.060 0.030 . 1 . . . . 24 GLU HA . 11405 1 189 . 1 1 24 24 GLU HB2 H 1 2.043 0.030 . 2 . . . . 24 GLU HB2 . 11405 1 190 . 1 1 24 24 GLU HB3 H 1 1.917 0.030 . 2 . . . . 24 GLU HB3 . 11405 1 191 . 1 1 24 24 GLU HG2 H 1 2.313 0.030 . 1 . . . . 24 GLU HG2 . 11405 1 192 . 1 1 24 24 GLU HG3 H 1 2.313 0.030 . 1 . . . . 24 GLU HG3 . 11405 1 193 . 1 1 24 24 GLU C C 13 177.901 0.300 . 1 . . . . 24 GLU C . 11405 1 194 . 1 1 24 24 GLU CA C 13 58.340 0.300 . 1 . . . . 24 GLU CA . 11405 1 195 . 1 1 24 24 GLU CB C 13 29.356 0.300 . 1 . . . . 24 GLU CB . 11405 1 196 . 1 1 24 24 GLU CG C 13 35.936 0.300 . 1 . . . . 24 GLU CG . 11405 1 197 . 1 1 24 24 GLU N N 15 119.209 0.300 . 1 . . . . 24 GLU N . 11405 1 198 . 1 1 25 25 GLY H H 1 8.625 0.030 . 1 . . . . 25 GLY H . 11405 1 199 . 1 1 25 25 GLY HA2 H 1 4.353 0.030 . 2 . . . . 25 GLY HA2 . 11405 1 200 . 1 1 25 25 GLY HA3 H 1 3.810 0.030 . 2 . . . . 25 GLY HA3 . 11405 1 201 . 1 1 25 25 GLY C C 13 173.824 0.300 . 1 . . . . 25 GLY C . 11405 1 202 . 1 1 25 25 GLY CA C 13 45.402 0.300 . 1 . . . . 25 GLY CA . 11405 1 203 . 1 1 25 25 GLY N N 15 113.106 0.300 . 1 . . . . 25 GLY N . 11405 1 204 . 1 1 26 26 ALA H H 1 8.346 0.030 . 1 . . . . 26 ALA H . 11405 1 205 . 1 1 26 26 ALA HA H 1 4.626 0.030 . 1 . . . . 26 ALA HA . 11405 1 206 . 1 1 26 26 ALA HB1 H 1 1.119 0.030 . 1 . . . . 26 ALA HB . 11405 1 207 . 1 1 26 26 ALA HB2 H 1 1.119 0.030 . 1 . . . . 26 ALA HB . 11405 1 208 . 1 1 26 26 ALA HB3 H 1 1.119 0.030 . 1 . . . . 26 ALA HB . 11405 1 209 . 1 1 26 26 ALA C C 13 174.497 0.300 . 1 . . . . 26 ALA C . 11405 1 210 . 1 1 26 26 ALA CA C 13 50.795 0.300 . 1 . . . . 26 ALA CA . 11405 1 211 . 1 1 26 26 ALA CB C 13 20.855 0.300 . 1 . . . . 26 ALA CB . 11405 1 212 . 1 1 26 26 ALA N N 15 119.959 0.300 . 1 . . . . 26 ALA N . 11405 1 213 . 1 1 27 27 ASN H H 1 7.353 0.030 . 1 . . . . 27 ASN H . 11405 1 214 . 1 1 27 27 ASN HA H 1 5.075 0.030 . 1 . . . . 27 ASN HA . 11405 1 215 . 1 1 27 27 ASN HB2 H 1 2.898 0.030 . 2 . . . . 27 ASN HB2 . 11405 1 216 . 1 1 27 27 ASN HB3 H 1 2.455 0.030 . 2 . . . . 27 ASN HB3 . 11405 1 217 . 1 1 27 27 ASN HD21 H 1 7.716 0.030 . 2 . . . . 27 ASN HD21 . 11405 1 218 . 1 1 27 27 ASN HD22 H 1 6.535 0.030 . 2 . . . . 27 ASN HD22 . 11405 1 219 . 1 1 27 27 ASN C C 13 173.293 0.300 . 1 . . . . 27 ASN C . 11405 1 220 . 1 1 27 27 ASN CA C 13 53.381 0.300 . 1 . . . . 27 ASN CA . 11405 1 221 . 1 1 27 27 ASN CB C 13 41.857 0.300 . 1 . . . . 27 ASN CB . 11405 1 222 . 1 1 27 27 ASN N N 15 115.184 0.300 . 1 . . . . 27 ASN N . 11405 1 223 . 1 1 27 27 ASN ND2 N 15 117.101 0.300 . 1 . . . . 27 ASN ND2 . 11405 1 224 . 1 1 28 28 LEU H H 1 9.320 0.030 . 1 . . . . 28 LEU H . 11405 1 225 . 1 1 28 28 LEU HA H 1 5.081 0.030 . 1 . . . . 28 LEU HA . 11405 1 226 . 1 1 28 28 LEU HB2 H 1 1.556 0.030 . 2 . . . . 28 LEU HB2 . 11405 1 227 . 1 1 28 28 LEU HB3 H 1 1.049 0.030 . 2 . . . . 28 LEU HB3 . 11405 1 228 . 1 1 28 28 LEU HD11 H 1 0.730 0.030 . 1 . . . . 28 LEU HD1 . 11405 1 229 . 1 1 28 28 LEU HD12 H 1 0.730 0.030 . 1 . . . . 28 LEU HD1 . 11405 1 230 . 1 1 28 28 LEU HD13 H 1 0.730 0.030 . 1 . . . . 28 LEU HD1 . 11405 1 231 . 1 1 28 28 LEU HD21 H 1 0.710 0.030 . 1 . . . . 28 LEU HD2 . 11405 1 232 . 1 1 28 28 LEU HD22 H 1 0.710 0.030 . 1 . . . . 28 LEU HD2 . 11405 1 233 . 1 1 28 28 LEU HD23 H 1 0.710 0.030 . 1 . . . . 28 LEU HD2 . 11405 1 234 . 1 1 28 28 LEU HG H 1 1.429 0.030 . 1 . . . . 28 LEU HG . 11405 1 235 . 1 1 28 28 LEU C C 13 175.331 0.300 . 1 . . . . 28 LEU C . 11405 1 236 . 1 1 28 28 LEU CA C 13 53.761 0.300 . 1 . . . . 28 LEU CA . 11405 1 237 . 1 1 28 28 LEU CB C 13 45.993 0.300 . 1 . . . . 28 LEU CB . 11405 1 238 . 1 1 28 28 LEU CD1 C 13 26.668 0.300 . 2 . . . . 28 LEU CD1 . 11405 1 239 . 1 1 28 28 LEU CD2 C 13 25.356 0.300 . 2 . . . . 28 LEU CD2 . 11405 1 240 . 1 1 28 28 LEU CG C 13 26.629 0.300 . 1 . . . . 28 LEU CG . 11405 1 241 . 1 1 28 28 LEU N N 15 123.770 0.300 . 1 . . . . 28 LEU N . 11405 1 242 . 1 1 29 29 PHE H H 1 9.047 0.030 . 1 . . . . 29 PHE H . 11405 1 243 . 1 1 29 29 PHE HA H 1 5.479 0.030 . 1 . . . . 29 PHE HA . 11405 1 244 . 1 1 29 29 PHE HB2 H 1 2.860 0.030 . 1 . . . . 29 PHE HB2 . 11405 1 245 . 1 1 29 29 PHE HB3 H 1 2.860 0.030 . 1 . . . . 29 PHE HB3 . 11405 1 246 . 1 1 29 29 PHE HD1 H 1 7.452 0.030 . 1 . . . . 29 PHE HD1 . 11405 1 247 . 1 1 29 29 PHE HD2 H 1 7.452 0.030 . 1 . . . . 29 PHE HD2 . 11405 1 248 . 1 1 29 29 PHE HE1 H 1 7.364 0.030 . 1 . . . . 29 PHE HE1 . 11405 1 249 . 1 1 29 29 PHE HE2 H 1 7.364 0.030 . 1 . . . . 29 PHE HE2 . 11405 1 250 . 1 1 29 29 PHE HZ H 1 7.227 0.030 . 1 . . . . 29 PHE HZ . 11405 1 251 . 1 1 29 29 PHE C C 13 174.594 0.300 . 1 . . . . 29 PHE C . 11405 1 252 . 1 1 29 29 PHE CA C 13 56.511 0.300 . 1 . . . . 29 PHE CA . 11405 1 253 . 1 1 29 29 PHE CB C 13 43.320 0.300 . 1 . . . . 29 PHE CB . 11405 1 254 . 1 1 29 29 PHE CD1 C 13 131.415 0.300 . 1 . . . . 29 PHE CD1 . 11405 1 255 . 1 1 29 29 PHE CD2 C 13 131.415 0.300 . 1 . . . . 29 PHE CD2 . 11405 1 256 . 1 1 29 29 PHE CE1 C 13 131.130 0.300 . 1 . . . . 29 PHE CE1 . 11405 1 257 . 1 1 29 29 PHE CE2 C 13 131.130 0.300 . 1 . . . . 29 PHE CE2 . 11405 1 258 . 1 1 29 29 PHE CZ C 13 129.481 0.300 . 1 . . . . 29 PHE CZ . 11405 1 259 . 1 1 29 29 PHE N N 15 117.954 0.300 . 1 . . . . 29 PHE N . 11405 1 260 . 1 1 30 30 ILE H H 1 8.524 0.030 . 1 . . . . 30 ILE H . 11405 1 261 . 1 1 30 30 ILE HA H 1 5.015 0.030 . 1 . . . . 30 ILE HA . 11405 1 262 . 1 1 30 30 ILE HB H 1 1.395 0.030 . 1 . . . . 30 ILE HB . 11405 1 263 . 1 1 30 30 ILE HD11 H 1 0.228 0.030 . 1 . . . . 30 ILE HD1 . 11405 1 264 . 1 1 30 30 ILE HD12 H 1 0.228 0.030 . 1 . . . . 30 ILE HD1 . 11405 1 265 . 1 1 30 30 ILE HD13 H 1 0.228 0.030 . 1 . . . . 30 ILE HD1 . 11405 1 266 . 1 1 30 30 ILE HG12 H 1 1.071 0.030 . 2 . . . . 30 ILE HG12 . 11405 1 267 . 1 1 30 30 ILE HG13 H 1 1.052 0.030 . 2 . . . . 30 ILE HG13 . 11405 1 268 . 1 1 30 30 ILE HG21 H 1 0.905 0.030 . 1 . . . . 30 ILE HG2 . 11405 1 269 . 1 1 30 30 ILE HG22 H 1 0.905 0.030 . 1 . . . . 30 ILE HG2 . 11405 1 270 . 1 1 30 30 ILE HG23 H 1 0.905 0.030 . 1 . . . . 30 ILE HG2 . 11405 1 271 . 1 1 30 30 ILE C C 13 174.442 0.300 . 1 . . . . 30 ILE C . 11405 1 272 . 1 1 30 30 ILE CA C 13 59.670 0.300 . 1 . . . . 30 ILE CA . 11405 1 273 . 1 1 30 30 ILE CB C 13 40.857 0.300 . 1 . . . . 30 ILE CB . 11405 1 274 . 1 1 30 30 ILE CD1 C 13 16.226 0.300 . 1 . . . . 30 ILE CD1 . 11405 1 275 . 1 1 30 30 ILE CG1 C 13 29.934 0.300 . 1 . . . . 30 ILE CG1 . 11405 1 276 . 1 1 30 30 ILE CG2 C 13 21.363 0.300 . 1 . . . . 30 ILE CG2 . 11405 1 277 . 1 1 30 30 ILE N N 15 121.200 0.300 . 1 . . . . 30 ILE N . 11405 1 278 . 1 1 31 31 TYR H H 1 9.457 0.030 . 1 . . . . 31 TYR H . 11405 1 279 . 1 1 31 31 TYR HA H 1 4.967 0.030 . 1 . . . . 31 TYR HA . 11405 1 280 . 1 1 31 31 TYR HB2 H 1 2.660 0.030 . 2 . . . . 31 TYR HB2 . 11405 1 281 . 1 1 31 31 TYR HB3 H 1 2.437 0.030 . 2 . . . . 31 TYR HB3 . 11405 1 282 . 1 1 31 31 TYR HD1 H 1 6.859 0.030 . 1 . . . . 31 TYR HD1 . 11405 1 283 . 1 1 31 31 TYR HD2 H 1 6.859 0.030 . 1 . . . . 31 TYR HD2 . 11405 1 284 . 1 1 31 31 TYR HE1 H 1 6.324 0.030 . 1 . . . . 31 TYR HE1 . 11405 1 285 . 1 1 31 31 TYR HE2 H 1 6.324 0.030 . 1 . . . . 31 TYR HE2 . 11405 1 286 . 1 1 31 31 TYR C C 13 174.527 0.300 . 1 . . . . 31 TYR C . 11405 1 287 . 1 1 31 31 TYR CA C 13 56.733 0.300 . 1 . . . . 31 TYR CA . 11405 1 288 . 1 1 31 31 TYR CB C 13 40.893 0.300 . 1 . . . . 31 TYR CB . 11405 1 289 . 1 1 31 31 TYR CD1 C 13 133.251 0.300 . 1 . . . . 31 TYR CD1 . 11405 1 290 . 1 1 31 31 TYR CD2 C 13 133.251 0.300 . 1 . . . . 31 TYR CD2 . 11405 1 291 . 1 1 31 31 TYR CE1 C 13 117.862 0.300 . 1 . . . . 31 TYR CE1 . 11405 1 292 . 1 1 31 31 TYR CE2 C 13 117.862 0.300 . 1 . . . . 31 TYR CE2 . 11405 1 293 . 1 1 31 31 TYR N N 15 123.296 0.300 . 1 . . . . 31 TYR N . 11405 1 294 . 1 1 32 32 HIS H H 1 8.544 0.030 . 1 . . . . 32 HIS H . 11405 1 295 . 1 1 32 32 HIS HA H 1 4.457 0.030 . 1 . . . . 32 HIS HA . 11405 1 296 . 1 1 32 32 HIS HB2 H 1 3.995 0.030 . 2 . . . . 32 HIS HB2 . 11405 1 297 . 1 1 32 32 HIS HB3 H 1 3.036 0.030 . 2 . . . . 32 HIS HB3 . 11405 1 298 . 1 1 32 32 HIS HD2 H 1 7.062 0.030 . 1 . . . . 32 HIS HD2 . 11405 1 299 . 1 1 32 32 HIS HE1 H 1 7.884 0.030 . 1 . . . . 32 HIS HE1 . 11405 1 300 . 1 1 32 32 HIS C C 13 174.011 0.300 . 1 . . . . 32 HIS C . 11405 1 301 . 1 1 32 32 HIS CA C 13 55.909 0.300 . 1 . . . . 32 HIS CA . 11405 1 302 . 1 1 32 32 HIS CB C 13 26.578 0.300 . 1 . . . . 32 HIS CB . 11405 1 303 . 1 1 32 32 HIS CD2 C 13 122.362 0.300 . 1 . . . . 32 HIS CD2 . 11405 1 304 . 1 1 32 32 HIS CE1 C 13 138.363 0.300 . 1 . . . . 32 HIS CE1 . 11405 1 305 . 1 1 32 32 HIS N N 15 112.360 0.300 . 1 . . . . 32 HIS N . 11405 1 306 . 1 1 33 33 LEU H H 1 7.510 0.030 . 1 . . . . 33 LEU H . 11405 1 307 . 1 1 33 33 LEU HA H 1 3.983 0.030 . 1 . . . . 33 LEU HA . 11405 1 308 . 1 1 33 33 LEU HB2 H 1 1.077 0.030 . 1 . . . . 33 LEU HB2 . 11405 1 309 . 1 1 33 33 LEU HB3 H 1 1.077 0.030 . 1 . . . . 33 LEU HB3 . 11405 1 310 . 1 1 33 33 LEU HD11 H 1 0.618 0.030 . 1 . . . . 33 LEU HD1 . 11405 1 311 . 1 1 33 33 LEU HD12 H 1 0.618 0.030 . 1 . . . . 33 LEU HD1 . 11405 1 312 . 1 1 33 33 LEU HD13 H 1 0.618 0.030 . 1 . . . . 33 LEU HD1 . 11405 1 313 . 1 1 33 33 LEU HD21 H 1 0.661 0.030 . 1 . . . . 33 LEU HD2 . 11405 1 314 . 1 1 33 33 LEU HD22 H 1 0.661 0.030 . 1 . . . . 33 LEU HD2 . 11405 1 315 . 1 1 33 33 LEU HD23 H 1 0.661 0.030 . 1 . . . . 33 LEU HD2 . 11405 1 316 . 1 1 33 33 LEU HG H 1 1.410 0.030 . 1 . . . . 33 LEU HG . 11405 1 317 . 1 1 33 33 LEU C C 13 175.358 0.300 . 1 . . . . 33 LEU C . 11405 1 318 . 1 1 33 33 LEU CA C 13 52.857 0.300 . 1 . . . . 33 LEU CA . 11405 1 319 . 1 1 33 33 LEU CB C 13 42.384 0.300 . 1 . . . . 33 LEU CB . 11405 1 320 . 1 1 33 33 LEU CD1 C 13 23.578 0.300 . 2 . . . . 33 LEU CD1 . 11405 1 321 . 1 1 33 33 LEU CD2 C 13 26.758 0.300 . 2 . . . . 33 LEU CD2 . 11405 1 322 . 1 1 33 33 LEU CG C 13 27.090 0.300 . 1 . . . . 33 LEU CG . 11405 1 323 . 1 1 33 33 LEU N N 15 114.419 0.300 . 1 . . . . 33 LEU N . 11405 1 324 . 1 1 34 34 PRO HA H 1 4.353 0.030 . 1 . . . . 34 PRO HA . 11405 1 325 . 1 1 34 34 PRO HB2 H 1 2.432 0.030 . 2 . . . . 34 PRO HB2 . 11405 1 326 . 1 1 34 34 PRO HB3 H 1 1.558 0.030 . 2 . . . . 34 PRO HB3 . 11405 1 327 . 1 1 34 34 PRO HD2 H 1 3.337 0.030 . 2 . . . . 34 PRO HD2 . 11405 1 328 . 1 1 34 34 PRO HD3 H 1 2.360 0.030 . 2 . . . . 34 PRO HD3 . 11405 1 329 . 1 1 34 34 PRO HG2 H 1 1.735 0.030 . 2 . . . . 34 PRO HG2 . 11405 1 330 . 1 1 34 34 PRO HG3 H 1 1.487 0.030 . 2 . . . . 34 PRO HG3 . 11405 1 331 . 1 1 34 34 PRO C C 13 177.818 0.300 . 1 . . . . 34 PRO C . 11405 1 332 . 1 1 34 34 PRO CA C 13 62.778 0.300 . 1 . . . . 34 PRO CA . 11405 1 333 . 1 1 34 34 PRO CB C 13 32.401 0.300 . 1 . . . . 34 PRO CB . 11405 1 334 . 1 1 34 34 PRO CD C 13 49.562 0.300 . 1 . . . . 34 PRO CD . 11405 1 335 . 1 1 34 34 PRO CG C 13 28.346 0.300 . 1 . . . . 34 PRO CG . 11405 1 336 . 1 1 35 35 GLN H H 1 9.058 0.030 . 1 . . . . 35 GLN H . 11405 1 337 . 1 1 35 35 GLN HA H 1 4.148 0.030 . 1 . . . . 35 GLN HA . 11405 1 338 . 1 1 35 35 GLN HB2 H 1 2.158 0.030 . 2 . . . . 35 GLN HB2 . 11405 1 339 . 1 1 35 35 GLN HB3 H 1 2.048 0.030 . 2 . . . . 35 GLN HB3 . 11405 1 340 . 1 1 35 35 GLN HE21 H 1 7.637 0.030 . 2 . . . . 35 GLN HE21 . 11405 1 341 . 1 1 35 35 GLN HE22 H 1 7.020 0.030 . 2 . . . . 35 GLN HE22 . 11405 1 342 . 1 1 35 35 GLN HG2 H 1 2.487 0.030 . 2 . . . . 35 GLN HG2 . 11405 1 343 . 1 1 35 35 GLN HG3 H 1 2.378 0.030 . 2 . . . . 35 GLN HG3 . 11405 1 344 . 1 1 35 35 GLN C C 13 175.909 0.300 . 1 . . . . 35 GLN C . 11405 1 345 . 1 1 35 35 GLN CA C 13 59.036 0.300 . 1 . . . . 35 GLN CA . 11405 1 346 . 1 1 35 35 GLN CB C 13 28.990 0.300 . 1 . . . . 35 GLN CB . 11405 1 347 . 1 1 35 35 GLN CG C 13 34.129 0.300 . 1 . . . . 35 GLN CG . 11405 1 348 . 1 1 35 35 GLN N N 15 125.575 0.300 . 1 . . . . 35 GLN N . 11405 1 349 . 1 1 35 35 GLN NE2 N 15 113.049 0.300 . 1 . . . . 35 GLN NE2 . 11405 1 350 . 1 1 36 36 GLU H H 1 9.076 0.030 . 1 . . . . 36 GLU H . 11405 1 351 . 1 1 36 36 GLU HA H 1 4.340 0.030 . 1 . . . . 36 GLU HA . 11405 1 352 . 1 1 36 36 GLU HB2 H 1 2.161 0.030 . 2 . . . . 36 GLU HB2 . 11405 1 353 . 1 1 36 36 GLU HB3 H 1 2.092 0.030 . 2 . . . . 36 GLU HB3 . 11405 1 354 . 1 1 36 36 GLU HG2 H 1 2.357 0.030 . 1 . . . . 36 GLU HG2 . 11405 1 355 . 1 1 36 36 GLU HG3 H 1 2.357 0.030 . 1 . . . . 36 GLU HG3 . 11405 1 356 . 1 1 36 36 GLU C C 13 176.865 0.300 . 1 . . . . 36 GLU C . 11405 1 357 . 1 1 36 36 GLU CA C 13 57.054 0.300 . 1 . . . . 36 GLU CA . 11405 1 358 . 1 1 36 36 GLU CB C 13 28.620 0.300 . 1 . . . . 36 GLU CB . 11405 1 359 . 1 1 36 36 GLU CG C 13 36.349 0.300 . 1 . . . . 36 GLU CG . 11405 1 360 . 1 1 36 36 GLU N N 15 114.528 0.300 . 1 . . . . 36 GLU N . 11405 1 361 . 1 1 37 37 PHE H H 1 7.594 0.030 . 1 . . . . 37 PHE H . 11405 1 362 . 1 1 37 37 PHE HA H 1 4.585 0.030 . 1 . . . . 37 PHE HA . 11405 1 363 . 1 1 37 37 PHE HB2 H 1 3.374 0.030 . 2 . . . . 37 PHE HB2 . 11405 1 364 . 1 1 37 37 PHE HB3 H 1 2.866 0.030 . 2 . . . . 37 PHE HB3 . 11405 1 365 . 1 1 37 37 PHE HD1 H 1 7.025 0.030 . 1 . . . . 37 PHE HD1 . 11405 1 366 . 1 1 37 37 PHE HD2 H 1 7.025 0.030 . 1 . . . . 37 PHE HD2 . 11405 1 367 . 1 1 37 37 PHE HE1 H 1 7.351 0.030 . 1 . . . . 37 PHE HE1 . 11405 1 368 . 1 1 37 37 PHE HE2 H 1 7.351 0.030 . 1 . . . . 37 PHE HE2 . 11405 1 369 . 1 1 37 37 PHE HZ H 1 7.353 0.030 . 1 . . . . 37 PHE HZ . 11405 1 370 . 1 1 37 37 PHE C C 13 176.837 0.300 . 1 . . . . 37 PHE C . 11405 1 371 . 1 1 37 37 PHE CA C 13 58.598 0.300 . 1 . . . . 37 PHE CA . 11405 1 372 . 1 1 37 37 PHE CB C 13 39.981 0.300 . 1 . . . . 37 PHE CB . 11405 1 373 . 1 1 37 37 PHE CD1 C 13 130.112 0.300 . 1 . . . . 37 PHE CD1 . 11405 1 374 . 1 1 37 37 PHE CD2 C 13 130.112 0.300 . 1 . . . . 37 PHE CD2 . 11405 1 375 . 1 1 37 37 PHE CE1 C 13 132.005 0.300 . 1 . . . . 37 PHE CE1 . 11405 1 376 . 1 1 37 37 PHE CE2 C 13 132.005 0.300 . 1 . . . . 37 PHE CE2 . 11405 1 377 . 1 1 37 37 PHE CZ C 13 130.237 0.300 . 1 . . . . 37 PHE CZ . 11405 1 378 . 1 1 37 37 PHE N N 15 122.530 0.300 . 1 . . . . 37 PHE N . 11405 1 379 . 1 1 38 38 GLY H H 1 9.552 0.030 . 1 . . . . 38 GLY H . 11405 1 380 . 1 1 38 38 GLY HA2 H 1 4.632 0.030 . 2 . . . . 38 GLY HA2 . 11405 1 381 . 1 1 38 38 GLY HA3 H 1 3.869 0.030 . 2 . . . . 38 GLY HA3 . 11405 1 382 . 1 1 38 38 GLY C C 13 174.638 0.300 . 1 . . . . 38 GLY C . 11405 1 383 . 1 1 38 38 GLY CA C 13 43.428 0.300 . 1 . . . . 38 GLY CA . 11405 1 384 . 1 1 38 38 GLY N N 15 114.091 0.300 . 1 . . . . 38 GLY N . 11405 1 385 . 1 1 39 39 ASP H H 1 8.559 0.030 . 1 . . . . 39 ASP H . 11405 1 386 . 1 1 39 39 ASP HA H 1 3.956 0.030 . 1 . . . . 39 ASP HA . 11405 1 387 . 1 1 39 39 ASP HB2 H 1 2.709 0.030 . 2 . . . . 39 ASP HB2 . 11405 1 388 . 1 1 39 39 ASP HB3 H 1 2.544 0.030 . 2 . . . . 39 ASP HB3 . 11405 1 389 . 1 1 39 39 ASP C C 13 178.175 0.300 . 1 . . . . 39 ASP C . 11405 1 390 . 1 1 39 39 ASP CA C 13 58.616 0.300 . 1 . . . . 39 ASP CA . 11405 1 391 . 1 1 39 39 ASP CB C 13 40.937 0.300 . 1 . . . . 39 ASP CB . 11405 1 392 . 1 1 39 39 ASP N N 15 120.342 0.300 . 1 . . . . 39 ASP N . 11405 1 393 . 1 1 40 40 GLN H H 1 8.678 0.030 . 1 . . . . 40 GLN H . 11405 1 394 . 1 1 40 40 GLN HA H 1 3.894 0.030 . 1 . . . . 40 GLN HA . 11405 1 395 . 1 1 40 40 GLN HB2 H 1 2.003 0.030 . 2 . . . . 40 GLN HB2 . 11405 1 396 . 1 1 40 40 GLN HB3 H 1 1.976 0.030 . 2 . . . . 40 GLN HB3 . 11405 1 397 . 1 1 40 40 GLN HE21 H 1 7.516 0.030 . 2 . . . . 40 GLN HE21 . 11405 1 398 . 1 1 40 40 GLN HE22 H 1 6.771 0.030 . 2 . . . . 40 GLN HE22 . 11405 1 399 . 1 1 40 40 GLN HG2 H 1 2.348 0.030 . 1 . . . . 40 GLN HG2 . 11405 1 400 . 1 1 40 40 GLN HG3 H 1 2.348 0.030 . 1 . . . . 40 GLN HG3 . 11405 1 401 . 1 1 40 40 GLN C C 13 178.136 0.300 . 1 . . . . 40 GLN C . 11405 1 402 . 1 1 40 40 GLN CA C 13 58.617 0.300 . 1 . . . . 40 GLN CA . 11405 1 403 . 1 1 40 40 GLN CB C 13 27.758 0.300 . 1 . . . . 40 GLN CB . 11405 1 404 . 1 1 40 40 GLN CG C 13 33.614 0.300 . 1 . . . . 40 GLN CG . 11405 1 405 . 1 1 40 40 GLN N N 15 115.731 0.300 . 1 . . . . 40 GLN N . 11405 1 406 . 1 1 40 40 GLN NE2 N 15 111.553 0.300 . 1 . . . . 40 GLN NE2 . 11405 1 407 . 1 1 41 41 ASP H H 1 7.058 0.030 . 1 . . . . 41 ASP H . 11405 1 408 . 1 1 41 41 ASP HA H 1 3.971 0.030 . 1 . . . . 41 ASP HA . 11405 1 409 . 1 1 41 41 ASP HB2 H 1 1.868 0.030 . 2 . . . . 41 ASP HB2 . 11405 1 410 . 1 1 41 41 ASP HB3 H 1 1.106 0.030 . 2 . . . . 41 ASP HB3 . 11405 1 411 . 1 1 41 41 ASP C C 13 178.215 0.300 . 1 . . . . 41 ASP C . 11405 1 412 . 1 1 41 41 ASP CA C 13 56.788 0.300 . 1 . . . . 41 ASP CA . 11405 1 413 . 1 1 41 41 ASP CB C 13 39.643 0.300 . 1 . . . . 41 ASP CB . 11405 1 414 . 1 1 41 41 ASP N N 15 118.318 0.300 . 1 . . . . 41 ASP N . 11405 1 415 . 1 1 42 42 LEU H H 1 7.727 0.030 . 1 . . . . 42 LEU H . 11405 1 416 . 1 1 42 42 LEU HA H 1 4.155 0.030 . 1 . . . . 42 LEU HA . 11405 1 417 . 1 1 42 42 LEU HB2 H 1 1.873 0.030 . 2 . . . . 42 LEU HB2 . 11405 1 418 . 1 1 42 42 LEU HB3 H 1 1.252 0.030 . 2 . . . . 42 LEU HB3 . 11405 1 419 . 1 1 42 42 LEU HD11 H 1 0.949 0.030 . 1 . . . . 42 LEU HD1 . 11405 1 420 . 1 1 42 42 LEU HD12 H 1 0.949 0.030 . 1 . . . . 42 LEU HD1 . 11405 1 421 . 1 1 42 42 LEU HD13 H 1 0.949 0.030 . 1 . . . . 42 LEU HD1 . 11405 1 422 . 1 1 42 42 LEU HD21 H 1 0.605 0.030 . 1 . . . . 42 LEU HD2 . 11405 1 423 . 1 1 42 42 LEU HD22 H 1 0.605 0.030 . 1 . . . . 42 LEU HD2 . 11405 1 424 . 1 1 42 42 LEU HD23 H 1 0.605 0.030 . 1 . . . . 42 LEU HD2 . 11405 1 425 . 1 1 42 42 LEU HG H 1 1.361 0.030 . 1 . . . . 42 LEU HG . 11405 1 426 . 1 1 42 42 LEU C C 13 177.755 0.300 . 1 . . . . 42 LEU C . 11405 1 427 . 1 1 42 42 LEU CA C 13 57.787 0.300 . 1 . . . . 42 LEU CA . 11405 1 428 . 1 1 42 42 LEU CB C 13 42.616 0.300 . 1 . . . . 42 LEU CB . 11405 1 429 . 1 1 42 42 LEU CD1 C 13 24.997 0.300 . 2 . . . . 42 LEU CD1 . 11405 1 430 . 1 1 42 42 LEU CD2 C 13 27.194 0.300 . 2 . . . . 42 LEU CD2 . 11405 1 431 . 1 1 42 42 LEU CG C 13 26.466 0.300 . 1 . . . . 42 LEU CG . 11405 1 432 . 1 1 42 42 LEU N N 15 120.653 0.300 . 1 . . . . 42 LEU N . 11405 1 433 . 1 1 43 43 LEU H H 1 8.229 0.030 . 1 . . . . 43 LEU H . 11405 1 434 . 1 1 43 43 LEU HA H 1 3.741 0.030 . 1 . . . . 43 LEU HA . 11405 1 435 . 1 1 43 43 LEU HB2 H 1 1.959 0.030 . 2 . . . . 43 LEU HB2 . 11405 1 436 . 1 1 43 43 LEU HB3 H 1 1.454 0.030 . 2 . . . . 43 LEU HB3 . 11405 1 437 . 1 1 43 43 LEU HD11 H 1 0.936 0.030 . 1 . . . . 43 LEU HD1 . 11405 1 438 . 1 1 43 43 LEU HD12 H 1 0.936 0.030 . 1 . . . . 43 LEU HD1 . 11405 1 439 . 1 1 43 43 LEU HD13 H 1 0.936 0.030 . 1 . . . . 43 LEU HD1 . 11405 1 440 . 1 1 43 43 LEU HD21 H 1 0.834 0.030 . 1 . . . . 43 LEU HD2 . 11405 1 441 . 1 1 43 43 LEU HD22 H 1 0.834 0.030 . 1 . . . . 43 LEU HD2 . 11405 1 442 . 1 1 43 43 LEU HD23 H 1 0.834 0.030 . 1 . . . . 43 LEU HD2 . 11405 1 443 . 1 1 43 43 LEU HG H 1 1.509 0.030 . 1 . . . . 43 LEU HG . 11405 1 444 . 1 1 43 43 LEU C C 13 178.404 0.300 . 1 . . . . 43 LEU C . 11405 1 445 . 1 1 43 43 LEU CA C 13 58.855 0.300 . 1 . . . . 43 LEU CA . 11405 1 446 . 1 1 43 43 LEU CB C 13 42.135 0.300 . 1 . . . . 43 LEU CB . 11405 1 447 . 1 1 43 43 LEU CD1 C 13 26.242 0.300 . 2 . . . . 43 LEU CD1 . 11405 1 448 . 1 1 43 43 LEU CD2 C 13 24.168 0.300 . 2 . . . . 43 LEU CD2 . 11405 1 449 . 1 1 43 43 LEU CG C 13 27.134 0.300 . 1 . . . . 43 LEU CG . 11405 1 450 . 1 1 43 43 LEU N N 15 118.739 0.300 . 1 . . . . 43 LEU N . 11405 1 451 . 1 1 44 44 GLN H H 1 8.014 0.030 . 1 . . . . 44 GLN H . 11405 1 452 . 1 1 44 44 GLN HA H 1 3.954 0.030 . 1 . . . . 44 GLN HA . 11405 1 453 . 1 1 44 44 GLN HB2 H 1 2.112 0.030 . 1 . . . . 44 GLN HB2 . 11405 1 454 . 1 1 44 44 GLN HB3 H 1 2.112 0.030 . 1 . . . . 44 GLN HB3 . 11405 1 455 . 1 1 44 44 GLN HE21 H 1 7.340 0.030 . 2 . . . . 44 GLN HE21 . 11405 1 456 . 1 1 44 44 GLN HE22 H 1 6.812 0.030 . 2 . . . . 44 GLN HE22 . 11405 1 457 . 1 1 44 44 GLN HG2 H 1 2.484 0.030 . 2 . . . . 44 GLN HG2 . 11405 1 458 . 1 1 44 44 GLN HG3 H 1 2.410 0.030 . 2 . . . . 44 GLN HG3 . 11405 1 459 . 1 1 44 44 GLN C C 13 178.290 0.300 . 1 . . . . 44 GLN C . 11405 1 460 . 1 1 44 44 GLN CA C 13 58.992 0.300 . 1 . . . . 44 GLN CA . 11405 1 461 . 1 1 44 44 GLN CB C 13 28.410 0.300 . 1 . . . . 44 GLN CB . 11405 1 462 . 1 1 44 44 GLN CG C 13 34.115 0.300 . 1 . . . . 44 GLN CG . 11405 1 463 . 1 1 44 44 GLN N N 15 115.530 0.300 . 1 . . . . 44 GLN N . 11405 1 464 . 1 1 44 44 GLN NE2 N 15 111.520 0.300 . 1 . . . . 44 GLN NE2 . 11405 1 465 . 1 1 45 45 MET H H 1 7.563 0.030 . 1 . . . . 45 MET H . 11405 1 466 . 1 1 45 45 MET HA H 1 3.972 0.030 . 1 . . . . 45 MET HA . 11405 1 467 . 1 1 45 45 MET HB2 H 1 2.320 0.030 . 2 . . . . 45 MET HB2 . 11405 1 468 . 1 1 45 45 MET HB3 H 1 2.143 0.030 . 2 . . . . 45 MET HB3 . 11405 1 469 . 1 1 45 45 MET HE1 H 1 2.055 0.030 . 1 . . . . 45 MET HE . 11405 1 470 . 1 1 45 45 MET HE2 H 1 2.055 0.030 . 1 . . . . 45 MET HE . 11405 1 471 . 1 1 45 45 MET HE3 H 1 2.055 0.030 . 1 . . . . 45 MET HE . 11405 1 472 . 1 1 45 45 MET HG2 H 1 2.226 0.030 . 2 . . . . 45 MET HG2 . 11405 1 473 . 1 1 45 45 MET HG3 H 1 1.885 0.030 . 2 . . . . 45 MET HG3 . 11405 1 474 . 1 1 45 45 MET C C 13 175.828 0.300 . 1 . . . . 45 MET C . 11405 1 475 . 1 1 45 45 MET CA C 13 58.214 0.300 . 1 . . . . 45 MET CA . 11405 1 476 . 1 1 45 45 MET CB C 13 34.392 0.300 . 1 . . . . 45 MET CB . 11405 1 477 . 1 1 45 45 MET CE C 13 18.221 0.300 . 1 . . . . 45 MET CE . 11405 1 478 . 1 1 45 45 MET CG C 13 32.213 0.300 . 1 . . . . 45 MET CG . 11405 1 479 . 1 1 45 45 MET N N 15 116.239 0.300 . 1 . . . . 45 MET N . 11405 1 480 . 1 1 46 46 PHE H H 1 7.588 0.030 . 1 . . . . 46 PHE H . 11405 1 481 . 1 1 46 46 PHE HA H 1 4.739 0.030 . 1 . . . . 46 PHE HA . 11405 1 482 . 1 1 46 46 PHE HB2 H 1 3.580 0.030 . 2 . . . . 46 PHE HB2 . 11405 1 483 . 1 1 46 46 PHE HB3 H 1 2.609 0.030 . 2 . . . . 46 PHE HB3 . 11405 1 484 . 1 1 46 46 PHE HD1 H 1 7.882 0.030 . 1 . . . . 46 PHE HD1 . 11405 1 485 . 1 1 46 46 PHE HD2 H 1 7.882 0.030 . 1 . . . . 46 PHE HD2 . 11405 1 486 . 1 1 46 46 PHE HE1 H 1 6.959 0.030 . 1 . . . . 46 PHE HE1 . 11405 1 487 . 1 1 46 46 PHE HE2 H 1 6.959 0.030 . 1 . . . . 46 PHE HE2 . 11405 1 488 . 1 1 46 46 PHE HZ H 1 6.883 0.030 . 1 . . . . 46 PHE HZ . 11405 1 489 . 1 1 46 46 PHE C C 13 177.609 0.300 . 1 . . . . 46 PHE C . 11405 1 490 . 1 1 46 46 PHE CA C 13 60.287 0.300 . 1 . . . . 46 PHE CA . 11405 1 491 . 1 1 46 46 PHE CB C 13 38.856 0.300 . 1 . . . . 46 PHE CB . 11405 1 492 . 1 1 46 46 PHE CD1 C 13 132.124 0.300 . 1 . . . . 46 PHE CD1 . 11405 1 493 . 1 1 46 46 PHE CD2 C 13 132.124 0.300 . 1 . . . . 46 PHE CD2 . 11405 1 494 . 1 1 46 46 PHE CE1 C 13 130.374 0.300 . 1 . . . . 46 PHE CE1 . 11405 1 495 . 1 1 46 46 PHE CE2 C 13 130.374 0.300 . 1 . . . . 46 PHE CE2 . 11405 1 496 . 1 1 46 46 PHE CZ C 13 128.391 0.300 . 1 . . . . 46 PHE CZ . 11405 1 497 . 1 1 46 46 PHE N N 15 112.888 0.300 . 1 . . . . 46 PHE N . 11405 1 498 . 1 1 47 47 MET H H 1 8.441 0.030 . 1 . . . . 47 MET H . 11405 1 499 . 1 1 47 47 MET HA H 1 4.663 0.030 . 1 . . . . 47 MET HA . 11405 1 500 . 1 1 47 47 MET HB2 H 1 2.244 0.030 . 2 . . . . 47 MET HB2 . 11405 1 501 . 1 1 47 47 MET HB3 H 1 2.185 0.030 . 2 . . . . 47 MET HB3 . 11405 1 502 . 1 1 47 47 MET HE1 H 1 2.088 0.030 . 1 . . . . 47 MET HE . 11405 1 503 . 1 1 47 47 MET HE2 H 1 2.088 0.030 . 1 . . . . 47 MET HE . 11405 1 504 . 1 1 47 47 MET HE3 H 1 2.088 0.030 . 1 . . . . 47 MET HE . 11405 1 505 . 1 1 47 47 MET HG2 H 1 2.758 0.030 . 1 . . . . 47 MET HG2 . 11405 1 506 . 1 1 47 47 MET HG3 H 1 2.758 0.030 . 1 . . . . 47 MET HG3 . 11405 1 507 . 1 1 47 47 MET C C 13 174.166 0.300 . 1 . . . . 47 MET C . 11405 1 508 . 1 1 47 47 MET CA C 13 59.580 0.300 . 1 . . . . 47 MET CA . 11405 1 509 . 1 1 47 47 MET CB C 13 32.180 0.300 . 1 . . . . 47 MET CB . 11405 1 510 . 1 1 47 47 MET CE C 13 16.400 0.300 . 1 . . . . 47 MET CE . 11405 1 511 . 1 1 47 47 MET CG C 13 32.105 0.300 . 1 . . . . 47 MET CG . 11405 1 512 . 1 1 47 47 MET N N 15 127.705 0.300 . 1 . . . . 47 MET N . 11405 1 513 . 1 1 48 48 PRO HA H 1 4.066 0.030 . 1 . . . . 48 PRO HA . 11405 1 514 . 1 1 48 48 PRO HB2 H 1 1.884 0.030 . 2 . . . . 48 PRO HB2 . 11405 1 515 . 1 1 48 48 PRO HB3 H 1 0.139 0.030 . 2 . . . . 48 PRO HB3 . 11405 1 516 . 1 1 48 48 PRO HD2 H 1 3.594 0.030 . 2 . . . . 48 PRO HD2 . 11405 1 517 . 1 1 48 48 PRO HD3 H 1 2.866 0.030 . 2 . . . . 48 PRO HD3 . 11405 1 518 . 1 1 48 48 PRO HG2 H 1 1.635 0.030 . 2 . . . . 48 PRO HG2 . 11405 1 519 . 1 1 48 48 PRO HG3 H 1 1.593 0.030 . 2 . . . . 48 PRO HG3 . 11405 1 520 . 1 1 48 48 PRO C C 13 177.191 0.300 . 1 . . . . 48 PRO C . 11405 1 521 . 1 1 48 48 PRO CA C 13 65.645 0.300 . 1 . . . . 48 PRO CA . 11405 1 522 . 1 1 48 48 PRO CB C 13 31.103 0.300 . 1 . . . . 48 PRO CB . 11405 1 523 . 1 1 48 48 PRO CD C 13 51.644 0.300 . 1 . . . . 48 PRO CD . 11405 1 524 . 1 1 48 48 PRO CG C 13 27.927 0.300 . 1 . . . . 48 PRO CG . 11405 1 525 . 1 1 49 49 PHE H H 1 6.568 0.030 . 1 . . . . 49 PHE H . 11405 1 526 . 1 1 49 49 PHE HA H 1 4.322 0.030 . 1 . . . . 49 PHE HA . 11405 1 527 . 1 1 49 49 PHE HB2 H 1 3.381 0.030 . 2 . . . . 49 PHE HB2 . 11405 1 528 . 1 1 49 49 PHE HB3 H 1 2.791 0.030 . 2 . . . . 49 PHE HB3 . 11405 1 529 . 1 1 49 49 PHE HD1 H 1 7.267 0.030 . 1 . . . . 49 PHE HD1 . 11405 1 530 . 1 1 49 49 PHE HD2 H 1 7.267 0.030 . 1 . . . . 49 PHE HD2 . 11405 1 531 . 1 1 49 49 PHE HE1 H 1 7.198 0.030 . 1 . . . . 49 PHE HE1 . 11405 1 532 . 1 1 49 49 PHE HE2 H 1 7.198 0.030 . 1 . . . . 49 PHE HE2 . 11405 1 533 . 1 1 49 49 PHE HZ H 1 7.142 0.030 . 1 . . . . 49 PHE HZ . 11405 1 534 . 1 1 49 49 PHE C C 13 174.994 0.300 . 1 . . . . 49 PHE C . 11405 1 535 . 1 1 49 49 PHE CA C 13 58.230 0.300 . 1 . . . . 49 PHE CA . 11405 1 536 . 1 1 49 49 PHE CB C 13 38.445 0.300 . 1 . . . . 49 PHE CB . 11405 1 537 . 1 1 49 49 PHE CD1 C 13 131.101 0.300 . 1 . . . . 49 PHE CD1 . 11405 1 538 . 1 1 49 49 PHE CD2 C 13 131.101 0.300 . 1 . . . . 49 PHE CD2 . 11405 1 539 . 1 1 49 49 PHE CE1 C 13 131.862 0.300 . 1 . . . . 49 PHE CE1 . 11405 1 540 . 1 1 49 49 PHE CE2 C 13 131.862 0.300 . 1 . . . . 49 PHE CE2 . 11405 1 541 . 1 1 49 49 PHE CZ C 13 129.671 0.300 . 1 . . . . 49 PHE CZ . 11405 1 542 . 1 1 49 49 PHE N N 15 110.079 0.300 . 1 . . . . 49 PHE N . 11405 1 543 . 1 1 50 50 GLY H H 1 7.657 0.030 . 1 . . . . 50 GLY H . 11405 1 544 . 1 1 50 50 GLY HA2 H 1 4.195 0.030 . 2 . . . . 50 GLY HA2 . 11405 1 545 . 1 1 50 50 GLY HA3 H 1 3.884 0.030 . 2 . . . . 50 GLY HA3 . 11405 1 546 . 1 1 50 50 GLY C C 13 170.405 0.300 . 1 . . . . 50 GLY C . 11405 1 547 . 1 1 50 50 GLY CA C 13 44.877 0.300 . 1 . . . . 50 GLY CA . 11405 1 548 . 1 1 50 50 GLY N N 15 105.870 0.300 . 1 . . . . 50 GLY N . 11405 1 549 . 1 1 51 51 ASN H H 1 9.000 0.030 . 1 . . . . 51 ASN H . 11405 1 550 . 1 1 51 51 ASN HA H 1 4.681 0.030 . 1 . . . . 51 ASN HA . 11405 1 551 . 1 1 51 51 ASN HB2 H 1 2.785 0.030 . 1 . . . . 51 ASN HB2 . 11405 1 552 . 1 1 51 51 ASN HB3 H 1 2.785 0.030 . 1 . . . . 51 ASN HB3 . 11405 1 553 . 1 1 51 51 ASN HD21 H 1 7.858 0.030 . 2 . . . . 51 ASN HD21 . 11405 1 554 . 1 1 51 51 ASN HD22 H 1 6.825 0.030 . 2 . . . . 51 ASN HD22 . 11405 1 555 . 1 1 51 51 ASN C C 13 173.618 0.300 . 1 . . . . 51 ASN C . 11405 1 556 . 1 1 51 51 ASN CA C 13 53.098 0.300 . 1 . . . . 51 ASN CA . 11405 1 557 . 1 1 51 51 ASN CB C 13 37.600 0.300 . 1 . . . . 51 ASN CB . 11405 1 558 . 1 1 51 51 ASN N N 15 117.372 0.300 . 1 . . . . 51 ASN N . 11405 1 559 . 1 1 51 51 ASN ND2 N 15 113.579 0.300 . 1 . . . . 51 ASN ND2 . 11405 1 560 . 1 1 52 52 VAL H H 1 8.310 0.030 . 1 . . . . 52 VAL H . 11405 1 561 . 1 1 52 52 VAL HA H 1 3.723 0.030 . 1 . . . . 52 VAL HA . 11405 1 562 . 1 1 52 52 VAL HB H 1 1.764 0.030 . 1 . . . . 52 VAL HB . 11405 1 563 . 1 1 52 52 VAL HG11 H 1 0.710 0.030 . 1 . . . . 52 VAL HG1 . 11405 1 564 . 1 1 52 52 VAL HG12 H 1 0.710 0.030 . 1 . . . . 52 VAL HG1 . 11405 1 565 . 1 1 52 52 VAL HG13 H 1 0.710 0.030 . 1 . . . . 52 VAL HG1 . 11405 1 566 . 1 1 52 52 VAL HG21 H 1 0.556 0.030 . 1 . . . . 52 VAL HG2 . 11405 1 567 . 1 1 52 52 VAL HG22 H 1 0.556 0.030 . 1 . . . . 52 VAL HG2 . 11405 1 568 . 1 1 52 52 VAL HG23 H 1 0.556 0.030 . 1 . . . . 52 VAL HG2 . 11405 1 569 . 1 1 52 52 VAL C C 13 176.273 0.300 . 1 . . . . 52 VAL C . 11405 1 570 . 1 1 52 52 VAL CA C 13 62.599 0.300 . 1 . . . . 52 VAL CA . 11405 1 571 . 1 1 52 52 VAL CB C 13 32.251 0.300 . 1 . . . . 52 VAL CB . 11405 1 572 . 1 1 52 52 VAL CG1 C 13 22.534 0.300 . 2 . . . . 52 VAL CG1 . 11405 1 573 . 1 1 52 52 VAL CG2 C 13 23.159 0.300 . 2 . . . . 52 VAL CG2 . 11405 1 574 . 1 1 52 52 VAL N N 15 128.261 0.300 . 1 . . . . 52 VAL N . 11405 1 575 . 1 1 53 53 VAL H H 1 8.932 0.030 . 1 . . . . 53 VAL H . 11405 1 576 . 1 1 53 53 VAL HA H 1 3.713 0.030 . 1 . . . . 53 VAL HA . 11405 1 577 . 1 1 53 53 VAL HB H 1 1.862 0.030 . 1 . . . . 53 VAL HB . 11405 1 578 . 1 1 53 53 VAL HG11 H 1 0.700 0.030 . 1 . . . . 53 VAL HG1 . 11405 1 579 . 1 1 53 53 VAL HG12 H 1 0.700 0.030 . 1 . . . . 53 VAL HG1 . 11405 1 580 . 1 1 53 53 VAL HG13 H 1 0.700 0.030 . 1 . . . . 53 VAL HG1 . 11405 1 581 . 1 1 53 53 VAL HG21 H 1 0.675 0.030 . 1 . . . . 53 VAL HG2 . 11405 1 582 . 1 1 53 53 VAL HG22 H 1 0.675 0.030 . 1 . . . . 53 VAL HG2 . 11405 1 583 . 1 1 53 53 VAL HG23 H 1 0.675 0.030 . 1 . . . . 53 VAL HG2 . 11405 1 584 . 1 1 53 53 VAL C C 13 176.405 0.300 . 1 . . . . 53 VAL C . 11405 1 585 . 1 1 53 53 VAL CA C 13 64.162 0.300 . 1 . . . . 53 VAL CA . 11405 1 586 . 1 1 53 53 VAL CB C 13 31.853 0.300 . 1 . . . . 53 VAL CB . 11405 1 587 . 1 1 53 53 VAL CG1 C 13 21.065 0.300 . 2 . . . . 53 VAL CG1 . 11405 1 588 . 1 1 53 53 VAL CG2 C 13 20.890 0.300 . 2 . . . . 53 VAL CG2 . 11405 1 589 . 1 1 53 53 VAL N N 15 130.896 0.300 . 1 . . . . 53 VAL N . 11405 1 590 . 1 1 54 54 SER H H 1 7.180 0.030 . 1 . . . . 54 SER H . 11405 1 591 . 1 1 54 54 SER HA H 1 4.743 0.030 . 1 . . . . 54 SER HA . 11405 1 592 . 1 1 54 54 SER HB2 H 1 3.797 0.030 . 2 . . . . 54 SER HB2 . 11405 1 593 . 1 1 54 54 SER HB3 H 1 3.705 0.030 . 2 . . . . 54 SER HB3 . 11405 1 594 . 1 1 54 54 SER C C 13 171.143 0.300 . 1 . . . . 54 SER C . 11405 1 595 . 1 1 54 54 SER CA C 13 57.735 0.300 . 1 . . . . 54 SER CA . 11405 1 596 . 1 1 54 54 SER CB C 13 66.486 0.300 . 1 . . . . 54 SER CB . 11405 1 597 . 1 1 54 54 SER N N 15 113.745 0.300 . 1 . . . . 54 SER N . 11405 1 598 . 1 1 55 55 ALA H H 1 7.808 0.030 . 1 . . . . 55 ALA H . 11405 1 599 . 1 1 55 55 ALA HA H 1 5.089 0.030 . 1 . . . . 55 ALA HA . 11405 1 600 . 1 1 55 55 ALA HB1 H 1 1.061 0.030 . 1 . . . . 55 ALA HB . 11405 1 601 . 1 1 55 55 ALA HB2 H 1 1.061 0.030 . 1 . . . . 55 ALA HB . 11405 1 602 . 1 1 55 55 ALA HB3 H 1 1.061 0.030 . 1 . . . . 55 ALA HB . 11405 1 603 . 1 1 55 55 ALA C C 13 174.579 0.300 . 1 . . . . 55 ALA C . 11405 1 604 . 1 1 55 55 ALA CA C 13 51.360 0.300 . 1 . . . . 55 ALA CA . 11405 1 605 . 1 1 55 55 ALA CB C 13 21.211 0.300 . 1 . . . . 55 ALA CB . 11405 1 606 . 1 1 55 55 ALA N N 15 123.497 0.300 . 1 . . . . 55 ALA N . 11405 1 607 . 1 1 56 56 LYS H H 1 8.835 0.030 . 1 . . . . 56 LYS H . 11405 1 608 . 1 1 56 56 LYS HA H 1 4.531 0.030 . 1 . . . . 56 LYS HA . 11405 1 609 . 1 1 56 56 LYS HB2 H 1 1.577 0.030 . 2 . . . . 56 LYS HB2 . 11405 1 610 . 1 1 56 56 LYS HB3 H 1 1.325 0.030 . 2 . . . . 56 LYS HB3 . 11405 1 611 . 1 1 56 56 LYS HD2 H 1 1.502 0.030 . 2 . . . . 56 LYS HD2 . 11405 1 612 . 1 1 56 56 LYS HD3 H 1 1.284 0.030 . 2 . . . . 56 LYS HD3 . 11405 1 613 . 1 1 56 56 LYS HE2 H 1 2.773 0.030 . 1 . . . . 56 LYS HE2 . 11405 1 614 . 1 1 56 56 LYS HE3 H 1 2.773 0.030 . 1 . . . . 56 LYS HE3 . 11405 1 615 . 1 1 56 56 LYS HG2 H 1 0.809 0.030 . 2 . . . . 56 LYS HG2 . 11405 1 616 . 1 1 56 56 LYS HG3 H 1 0.754 0.030 . 2 . . . . 56 LYS HG3 . 11405 1 617 . 1 1 56 56 LYS C C 13 173.638 0.300 . 1 . . . . 56 LYS C . 11405 1 618 . 1 1 56 56 LYS CA C 13 54.178 0.300 . 1 . . . . 56 LYS CA . 11405 1 619 . 1 1 56 56 LYS CB C 13 36.615 0.300 . 1 . . . . 56 LYS CB . 11405 1 620 . 1 1 56 56 LYS CD C 13 28.865 0.300 . 1 . . . . 56 LYS CD . 11405 1 621 . 1 1 56 56 LYS CE C 13 42.268 0.300 . 1 . . . . 56 LYS CE . 11405 1 622 . 1 1 56 56 LYS CG C 13 24.461 0.300 . 1 . . . . 56 LYS CG . 11405 1 623 . 1 1 56 56 LYS N N 15 123.934 0.300 . 1 . . . . 56 LYS N . 11405 1 624 . 1 1 57 57 VAL H H 1 8.746 0.030 . 1 . . . . 57 VAL H . 11405 1 625 . 1 1 57 57 VAL HA H 1 3.899 0.030 . 1 . . . . 57 VAL HA . 11405 1 626 . 1 1 57 57 VAL HB H 1 1.845 0.030 . 1 . . . . 57 VAL HB . 11405 1 627 . 1 1 57 57 VAL HG11 H 1 0.721 0.030 . 1 . . . . 57 VAL HG1 . 11405 1 628 . 1 1 57 57 VAL HG12 H 1 0.721 0.030 . 1 . . . . 57 VAL HG1 . 11405 1 629 . 1 1 57 57 VAL HG13 H 1 0.721 0.030 . 1 . . . . 57 VAL HG1 . 11405 1 630 . 1 1 57 57 VAL HG21 H 1 0.904 0.030 . 1 . . . . 57 VAL HG2 . 11405 1 631 . 1 1 57 57 VAL HG22 H 1 0.904 0.030 . 1 . . . . 57 VAL HG2 . 11405 1 632 . 1 1 57 57 VAL HG23 H 1 0.904 0.030 . 1 . . . . 57 VAL HG2 . 11405 1 633 . 1 1 57 57 VAL C C 13 175.863 0.300 . 1 . . . . 57 VAL C . 11405 1 634 . 1 1 57 57 VAL CA C 13 62.321 0.300 . 1 . . . . 57 VAL CA . 11405 1 635 . 1 1 57 57 VAL CB C 13 33.217 0.300 . 1 . . . . 57 VAL CB . 11405 1 636 . 1 1 57 57 VAL CG1 C 13 23.365 0.300 . 2 . . . . 57 VAL CG1 . 11405 1 637 . 1 1 57 57 VAL CG2 C 13 21.364 0.300 . 2 . . . . 57 VAL CG2 . 11405 1 638 . 1 1 57 57 VAL N N 15 125.630 0.300 . 1 . . . . 57 VAL N . 11405 1 639 . 1 1 58 58 PHE H H 1 8.226 0.030 . 1 . . . . 58 PHE H . 11405 1 640 . 1 1 58 58 PHE HA H 1 4.427 0.030 . 1 . . . . 58 PHE HA . 11405 1 641 . 1 1 58 58 PHE HB2 H 1 2.769 0.030 . 2 . . . . 58 PHE HB2 . 11405 1 642 . 1 1 58 58 PHE HB3 H 1 2.080 0.030 . 2 . . . . 58 PHE HB3 . 11405 1 643 . 1 1 58 58 PHE HD1 H 1 6.650 0.030 . 1 . . . . 58 PHE HD1 . 11405 1 644 . 1 1 58 58 PHE HD2 H 1 6.650 0.030 . 1 . . . . 58 PHE HD2 . 11405 1 645 . 1 1 58 58 PHE HE1 H 1 7.081 0.030 . 1 . . . . 58 PHE HE1 . 11405 1 646 . 1 1 58 58 PHE HE2 H 1 7.081 0.030 . 1 . . . . 58 PHE HE2 . 11405 1 647 . 1 1 58 58 PHE HZ H 1 7.085 0.030 . 1 . . . . 58 PHE HZ . 11405 1 648 . 1 1 58 58 PHE C C 13 174.029 0.300 . 1 . . . . 58 PHE C . 11405 1 649 . 1 1 58 58 PHE CA C 13 59.099 0.300 . 1 . . . . 58 PHE CA . 11405 1 650 . 1 1 58 58 PHE CB C 13 39.035 0.300 . 1 . . . . 58 PHE CB . 11405 1 651 . 1 1 58 58 PHE CD1 C 13 132.067 0.300 . 1 . . . . 58 PHE CD1 . 11405 1 652 . 1 1 58 58 PHE CD2 C 13 132.067 0.300 . 1 . . . . 58 PHE CD2 . 11405 1 653 . 1 1 58 58 PHE CE1 C 13 130.619 0.300 . 1 . . . . 58 PHE CE1 . 11405 1 654 . 1 1 58 58 PHE CE2 C 13 130.619 0.300 . 1 . . . . 58 PHE CE2 . 11405 1 655 . 1 1 58 58 PHE CZ C 13 129.041 0.300 . 1 . . . . 58 PHE CZ . 11405 1 656 . 1 1 58 58 PHE N N 15 126.997 0.300 . 1 . . . . 58 PHE N . 11405 1 657 . 1 1 59 59 ILE H H 1 8.311 0.030 . 1 . . . . 59 ILE H . 11405 1 658 . 1 1 59 59 ILE HA H 1 4.507 0.030 . 1 . . . . 59 ILE HA . 11405 1 659 . 1 1 59 59 ILE HB H 1 1.730 0.030 . 1 . . . . 59 ILE HB . 11405 1 660 . 1 1 59 59 ILE HD11 H 1 0.763 0.030 . 1 . . . . 59 ILE HD1 . 11405 1 661 . 1 1 59 59 ILE HD12 H 1 0.763 0.030 . 1 . . . . 59 ILE HD1 . 11405 1 662 . 1 1 59 59 ILE HD13 H 1 0.763 0.030 . 1 . . . . 59 ILE HD1 . 11405 1 663 . 1 1 59 59 ILE HG12 H 1 1.334 0.030 . 1 . . . . 59 ILE HG12 . 11405 1 664 . 1 1 59 59 ILE HG13 H 1 1.334 0.030 . 1 . . . . 59 ILE HG13 . 11405 1 665 . 1 1 59 59 ILE HG21 H 1 0.712 0.030 . 1 . . . . 59 ILE HG2 . 11405 1 666 . 1 1 59 59 ILE HG22 H 1 0.712 0.030 . 1 . . . . 59 ILE HG2 . 11405 1 667 . 1 1 59 59 ILE HG23 H 1 0.712 0.030 . 1 . . . . 59 ILE HG2 . 11405 1 668 . 1 1 59 59 ILE C C 13 176.176 0.300 . 1 . . . . 59 ILE C . 11405 1 669 . 1 1 59 59 ILE CA C 13 58.724 0.300 . 1 . . . . 59 ILE CA . 11405 1 670 . 1 1 59 59 ILE CB C 13 40.311 0.300 . 1 . . . . 59 ILE CB . 11405 1 671 . 1 1 59 59 ILE CD1 C 13 11.576 0.300 . 1 . . . . 59 ILE CD1 . 11405 1 672 . 1 1 59 59 ILE CG1 C 13 26.856 0.300 . 1 . . . . 59 ILE CG1 . 11405 1 673 . 1 1 59 59 ILE CG2 C 13 17.026 0.300 . 1 . . . . 59 ILE CG2 . 11405 1 674 . 1 1 59 59 ILE N N 15 121.292 0.300 . 1 . . . . 59 ILE N . 11405 1 675 . 1 1 60 60 ASP H H 1 8.701 0.030 . 1 . . . . 60 ASP H . 11405 1 676 . 1 1 60 60 ASP HA H 1 4.644 0.030 . 1 . . . . 60 ASP HA . 11405 1 677 . 1 1 60 60 ASP HB2 H 1 3.293 0.030 . 2 . . . . 60 ASP HB2 . 11405 1 678 . 1 1 60 60 ASP HB3 H 1 2.458 0.030 . 2 . . . . 60 ASP HB3 . 11405 1 679 . 1 1 60 60 ASP C C 13 176.776 0.300 . 1 . . . . 60 ASP C . 11405 1 680 . 1 1 60 60 ASP CA C 13 54.011 0.300 . 1 . . . . 60 ASP CA . 11405 1 681 . 1 1 60 60 ASP CB C 13 42.618 0.300 . 1 . . . . 60 ASP CB . 11405 1 682 . 1 1 60 60 ASP N N 15 126.266 0.300 . 1 . . . . 60 ASP N . 11405 1 683 . 1 1 61 61 LYS H H 1 8.872 0.030 . 1 . . . . 61 LYS H . 11405 1 684 . 1 1 61 61 LYS HA H 1 4.110 0.030 . 1 . . . . 61 LYS HA . 11405 1 685 . 1 1 61 61 LYS HB2 H 1 1.910 0.030 . 1 . . . . 61 LYS HB2 . 11405 1 686 . 1 1 61 61 LYS HB3 H 1 1.910 0.030 . 1 . . . . 61 LYS HB3 . 11405 1 687 . 1 1 61 61 LYS HD2 H 1 1.730 0.030 . 1 . . . . 61 LYS HD2 . 11405 1 688 . 1 1 61 61 LYS HD3 H 1 1.730 0.030 . 1 . . . . 61 LYS HD3 . 11405 1 689 . 1 1 61 61 LYS HE2 H 1 3.037 0.030 . 1 . . . . 61 LYS HE2 . 11405 1 690 . 1 1 61 61 LYS HE3 H 1 3.037 0.030 . 1 . . . . 61 LYS HE3 . 11405 1 691 . 1 1 61 61 LYS HG2 H 1 1.529 0.030 . 1 . . . . 61 LYS HG2 . 11405 1 692 . 1 1 61 61 LYS HG3 H 1 1.529 0.030 . 1 . . . . 61 LYS HG3 . 11405 1 693 . 1 1 61 61 LYS C C 13 177.516 0.300 . 1 . . . . 61 LYS C . 11405 1 694 . 1 1 61 61 LYS CA C 13 58.244 0.300 . 1 . . . . 61 LYS CA . 11405 1 695 . 1 1 61 61 LYS CB C 13 32.344 0.300 . 1 . . . . 61 LYS CB . 11405 1 696 . 1 1 61 61 LYS CD C 13 28.981 0.300 . 1 . . . . 61 LYS CD . 11405 1 697 . 1 1 61 61 LYS CE C 13 42.152 0.300 . 1 . . . . 61 LYS CE . 11405 1 698 . 1 1 61 61 LYS CG C 13 24.998 0.300 . 1 . . . . 61 LYS CG . 11405 1 699 . 1 1 61 61 LYS N N 15 127.452 0.300 . 1 . . . . 61 LYS N . 11405 1 700 . 1 1 62 62 GLN H H 1 8.675 0.030 . 1 . . . . 62 GLN H . 11405 1 701 . 1 1 62 62 GLN HA H 1 4.279 0.030 . 1 . . . . 62 GLN HA . 11405 1 702 . 1 1 62 62 GLN HB2 H 1 2.257 0.030 . 2 . . . . 62 GLN HB2 . 11405 1 703 . 1 1 62 62 GLN HB3 H 1 2.193 0.030 . 2 . . . . 62 GLN HB3 . 11405 1 704 . 1 1 62 62 GLN HG2 H 1 2.436 0.030 . 2 . . . . 62 GLN HG2 . 11405 1 705 . 1 1 62 62 GLN HG3 H 1 2.378 0.030 . 2 . . . . 62 GLN HG3 . 11405 1 706 . 1 1 62 62 GLN C C 13 177.753 0.300 . 1 . . . . 62 GLN C . 11405 1 707 . 1 1 62 62 GLN CA C 13 58.096 0.300 . 1 . . . . 62 GLN CA . 11405 1 708 . 1 1 62 62 GLN CB C 13 29.293 0.300 . 1 . . . . 62 GLN CB . 11405 1 709 . 1 1 62 62 GLN CG C 13 34.481 0.300 . 1 . . . . 62 GLN CG . 11405 1 710 . 1 1 62 62 GLN N N 15 117.096 0.300 . 1 . . . . 62 GLN N . 11405 1 711 . 1 1 63 63 THR H H 1 7.778 0.030 . 1 . . . . 63 THR H . 11405 1 712 . 1 1 63 63 THR HA H 1 4.320 0.030 . 1 . . . . 63 THR HA . 11405 1 713 . 1 1 63 63 THR HB H 1 4.320 0.030 . 1 . . . . 63 THR HB . 11405 1 714 . 1 1 63 63 THR HG21 H 1 1.186 0.030 . 1 . . . . 63 THR HG2 . 11405 1 715 . 1 1 63 63 THR HG22 H 1 1.186 0.030 . 1 . . . . 63 THR HG2 . 11405 1 716 . 1 1 63 63 THR HG23 H 1 1.186 0.030 . 1 . . . . 63 THR HG2 . 11405 1 717 . 1 1 63 63 THR C C 13 175.614 0.300 . 1 . . . . 63 THR C . 11405 1 718 . 1 1 63 63 THR CA C 13 61.613 0.300 . 1 . . . . 63 THR CA . 11405 1 719 . 1 1 63 63 THR CB C 13 70.762 0.300 . 1 . . . . 63 THR CB . 11405 1 720 . 1 1 63 63 THR CG2 C 13 21.409 0.300 . 1 . . . . 63 THR CG2 . 11405 1 721 . 1 1 63 63 THR N N 15 107.073 0.300 . 1 . . . . 63 THR N . 11405 1 722 . 1 1 64 64 ASN H H 1 8.486 0.030 . 1 . . . . 64 ASN H . 11405 1 723 . 1 1 64 64 ASN HA H 1 4.307 0.030 . 1 . . . . 64 ASN HA . 11405 1 724 . 1 1 64 64 ASN HB2 H 1 3.106 0.030 . 2 . . . . 64 ASN HB2 . 11405 1 725 . 1 1 64 64 ASN HB3 H 1 2.843 0.030 . 2 . . . . 64 ASN HB3 . 11405 1 726 . 1 1 64 64 ASN HD21 H 1 7.461 0.030 . 2 . . . . 64 ASN HD21 . 11405 1 727 . 1 1 64 64 ASN HD22 H 1 6.744 0.030 . 2 . . . . 64 ASN HD22 . 11405 1 728 . 1 1 64 64 ASN C C 13 173.800 0.300 . 1 . . . . 64 ASN C . 11405 1 729 . 1 1 64 64 ASN CA C 13 55.011 0.300 . 1 . . . . 64 ASN CA . 11405 1 730 . 1 1 64 64 ASN CB C 13 38.095 0.300 . 1 . . . . 64 ASN CB . 11405 1 731 . 1 1 64 64 ASN N N 15 116.987 0.300 . 1 . . . . 64 ASN N . 11405 1 732 . 1 1 64 64 ASN ND2 N 15 112.288 0.300 . 1 . . . . 64 ASN ND2 . 11405 1 733 . 1 1 65 65 LEU H H 1 7.638 0.030 . 1 . . . . 65 LEU H . 11405 1 734 . 1 1 65 65 LEU HA H 1 4.628 0.030 . 1 . . . . 65 LEU HA . 11405 1 735 . 1 1 65 65 LEU HB2 H 1 1.698 0.030 . 2 . . . . 65 LEU HB2 . 11405 1 736 . 1 1 65 65 LEU HB3 H 1 1.428 0.030 . 2 . . . . 65 LEU HB3 . 11405 1 737 . 1 1 65 65 LEU HD11 H 1 0.903 0.030 . 1 . . . . 65 LEU HD1 . 11405 1 738 . 1 1 65 65 LEU HD12 H 1 0.903 0.030 . 1 . . . . 65 LEU HD1 . 11405 1 739 . 1 1 65 65 LEU HD13 H 1 0.903 0.030 . 1 . . . . 65 LEU HD1 . 11405 1 740 . 1 1 65 65 LEU HD21 H 1 0.882 0.030 . 1 . . . . 65 LEU HD2 . 11405 1 741 . 1 1 65 65 LEU HD22 H 1 0.882 0.030 . 1 . . . . 65 LEU HD2 . 11405 1 742 . 1 1 65 65 LEU HD23 H 1 0.882 0.030 . 1 . . . . 65 LEU HD2 . 11405 1 743 . 1 1 65 65 LEU HG H 1 1.586 0.030 . 1 . . . . 65 LEU HG . 11405 1 744 . 1 1 65 65 LEU C C 13 177.121 0.300 . 1 . . . . 65 LEU C . 11405 1 745 . 1 1 65 65 LEU CA C 13 53.653 0.300 . 1 . . . . 65 LEU CA . 11405 1 746 . 1 1 65 65 LEU CB C 13 44.044 0.300 . 1 . . . . 65 LEU CB . 11405 1 747 . 1 1 65 65 LEU CD1 C 13 25.009 0.300 . 2 . . . . 65 LEU CD1 . 11405 1 748 . 1 1 65 65 LEU CD2 C 13 22.980 0.300 . 2 . . . . 65 LEU CD2 . 11405 1 749 . 1 1 65 65 LEU CG C 13 26.356 0.300 . 1 . . . . 65 LEU CG . 11405 1 750 . 1 1 65 65 LEU N N 15 117.884 0.300 . 1 . . . . 65 LEU N . 11405 1 751 . 1 1 66 66 SER H H 1 8.741 0.030 . 1 . . . . 66 SER H . 11405 1 752 . 1 1 66 66 SER HA H 1 4.508 0.030 . 1 . . . . 66 SER HA . 11405 1 753 . 1 1 66 66 SER HB2 H 1 4.150 0.030 . 2 . . . . 66 SER HB2 . 11405 1 754 . 1 1 66 66 SER HB3 H 1 3.998 0.030 . 2 . . . . 66 SER HB3 . 11405 1 755 . 1 1 66 66 SER C C 13 177.086 0.300 . 1 . . . . 66 SER C . 11405 1 756 . 1 1 66 66 SER CA C 13 58.608 0.300 . 1 . . . . 66 SER CA . 11405 1 757 . 1 1 66 66 SER CB C 13 63.733 0.300 . 1 . . . . 66 SER CB . 11405 1 758 . 1 1 66 66 SER N N 15 115.145 0.300 . 1 . . . . 66 SER N . 11405 1 759 . 1 1 67 67 LYS H H 1 9.279 0.030 . 1 . . . . 67 LYS H . 11405 1 760 . 1 1 67 67 LYS HA H 1 4.547 0.030 . 1 . . . . 67 LYS HA . 11405 1 761 . 1 1 67 67 LYS HB2 H 1 2.319 0.030 . 2 . . . . 67 LYS HB2 . 11405 1 762 . 1 1 67 67 LYS HB3 H 1 1.676 0.030 . 2 . . . . 67 LYS HB3 . 11405 1 763 . 1 1 67 67 LYS HD2 H 1 1.831 0.030 . 2 . . . . 67 LYS HD2 . 11405 1 764 . 1 1 67 67 LYS HD3 H 1 1.715 0.030 . 2 . . . . 67 LYS HD3 . 11405 1 765 . 1 1 67 67 LYS HE2 H 1 3.024 0.030 . 1 . . . . 67 LYS HE2 . 11405 1 766 . 1 1 67 67 LYS HE3 H 1 3.024 0.030 . 1 . . . . 67 LYS HE3 . 11405 1 767 . 1 1 67 67 LYS HG2 H 1 1.542 0.030 . 1 . . . . 67 LYS HG2 . 11405 1 768 . 1 1 67 67 LYS HG3 H 1 1.542 0.030 . 1 . . . . 67 LYS HG3 . 11405 1 769 . 1 1 67 67 LYS CA C 13 56.875 0.300 . 1 . . . . 67 LYS CA . 11405 1 770 . 1 1 67 67 LYS CB C 13 33.027 0.300 . 1 . . . . 67 LYS CB . 11405 1 771 . 1 1 67 67 LYS CD C 13 29.560 0.300 . 1 . . . . 67 LYS CD . 11405 1 772 . 1 1 67 67 LYS CE C 13 42.044 0.300 . 1 . . . . 67 LYS CE . 11405 1 773 . 1 1 67 67 LYS CG C 13 26.185 0.300 . 1 . . . . 67 LYS CG . 11405 1 774 . 1 1 67 67 LYS N N 15 125.409 0.300 . 1 . . . . 67 LYS N . 11405 1 775 . 1 1 68 68 CYS H H 1 10.208 0.030 . 1 . . . . 68 CYS H . 11405 1 776 . 1 1 68 68 CYS HA H 1 3.632 0.030 . 1 . . . . 68 CYS HA . 11405 1 777 . 1 1 68 68 CYS HB2 H 1 3.568 0.030 . 2 . . . . 68 CYS HB2 . 11405 1 778 . 1 1 68 68 CYS HB3 H 1 3.511 0.030 . 2 . . . . 68 CYS HB3 . 11405 1 779 . 1 1 68 68 CYS C C 13 176.546 0.300 . 1 . . . . 68 CYS C . 11405 1 780 . 1 1 68 68 CYS CA C 13 60.903 0.300 . 1 . . . . 68 CYS CA . 11405 1 781 . 1 1 68 68 CYS CB C 13 25.009 0.300 . 1 . . . . 68 CYS CB . 11405 1 782 . 1 1 68 68 CYS N N 15 112.992 0.300 . 1 . . . . 68 CYS N . 11405 1 783 . 1 1 69 69 PHE H H 1 7.676 0.030 . 1 . . . . 69 PHE H . 11405 1 784 . 1 1 69 69 PHE HA H 1 5.456 0.030 . 1 . . . . 69 PHE HA . 11405 1 785 . 1 1 69 69 PHE HB2 H 1 3.199 0.030 . 1 . . . . 69 PHE HB2 . 11405 1 786 . 1 1 69 69 PHE HB3 H 1 3.199 0.030 . 1 . . . . 69 PHE HB3 . 11405 1 787 . 1 1 69 69 PHE HD1 H 1 6.968 0.030 . 1 . . . . 69 PHE HD1 . 11405 1 788 . 1 1 69 69 PHE HD2 H 1 6.968 0.030 . 1 . . . . 69 PHE HD2 . 11405 1 789 . 1 1 69 69 PHE HE1 H 1 6.891 0.030 . 1 . . . . 69 PHE HE1 . 11405 1 790 . 1 1 69 69 PHE HE2 H 1 6.891 0.030 . 1 . . . . 69 PHE HE2 . 11405 1 791 . 1 1 69 69 PHE HZ H 1 6.761 0.030 . 1 . . . . 69 PHE HZ . 11405 1 792 . 1 1 69 69 PHE C C 13 172.714 0.300 . 1 . . . . 69 PHE C . 11405 1 793 . 1 1 69 69 PHE CA C 13 55.119 0.300 . 1 . . . . 69 PHE CA . 11405 1 794 . 1 1 69 69 PHE CB C 13 42.732 0.300 . 1 . . . . 69 PHE CB . 11405 1 795 . 1 1 69 69 PHE CD1 C 13 132.490 0.300 . 1 . . . . 69 PHE CD1 . 11405 1 796 . 1 1 69 69 PHE CD2 C 13 132.490 0.300 . 1 . . . . 69 PHE CD2 . 11405 1 797 . 1 1 69 69 PHE CE1 C 13 131.281 0.300 . 1 . . . . 69 PHE CE1 . 11405 1 798 . 1 1 69 69 PHE CE2 C 13 131.281 0.300 . 1 . . . . 69 PHE CE2 . 11405 1 799 . 1 1 69 69 PHE CZ C 13 129.615 0.300 . 1 . . . . 69 PHE CZ . 11405 1 800 . 1 1 69 69 PHE N N 15 115.132 0.300 . 1 . . . . 69 PHE N . 11405 1 801 . 1 1 70 70 GLY H H 1 9.326 0.030 . 1 . . . . 70 GLY H . 11405 1 802 . 1 1 70 70 GLY HA2 H 1 4.671 0.030 . 2 . . . . 70 GLY HA2 . 11405 1 803 . 1 1 70 70 GLY HA3 H 1 3.538 0.030 . 2 . . . . 70 GLY HA3 . 11405 1 804 . 1 1 70 70 GLY C C 13 170.110 0.300 . 1 . . . . 70 GLY C . 11405 1 805 . 1 1 70 70 GLY CA C 13 45.618 0.300 . 1 . . . . 70 GLY CA . 11405 1 806 . 1 1 70 70 GLY N N 15 108.035 0.300 . 1 . . . . 70 GLY N . 11405 1 807 . 1 1 71 71 PHE H H 1 8.884 0.030 . 1 . . . . 71 PHE H . 11405 1 808 . 1 1 71 71 PHE HA H 1 5.480 0.030 . 1 . . . . 71 PHE HA . 11405 1 809 . 1 1 71 71 PHE HB2 H 1 3.051 0.030 . 2 . . . . 71 PHE HB2 . 11405 1 810 . 1 1 71 71 PHE HB3 H 1 2.580 0.030 . 2 . . . . 71 PHE HB3 . 11405 1 811 . 1 1 71 71 PHE HD1 H 1 6.730 0.030 . 1 . . . . 71 PHE HD1 . 11405 1 812 . 1 1 71 71 PHE HD2 H 1 6.730 0.030 . 1 . . . . 71 PHE HD2 . 11405 1 813 . 1 1 71 71 PHE HE1 H 1 6.890 0.030 . 1 . . . . 71 PHE HE1 . 11405 1 814 . 1 1 71 71 PHE HE2 H 1 6.890 0.030 . 1 . . . . 71 PHE HE2 . 11405 1 815 . 1 1 71 71 PHE HZ H 1 7.133 0.030 . 1 . . . . 71 PHE HZ . 11405 1 816 . 1 1 71 71 PHE C C 13 173.185 0.300 . 1 . . . . 71 PHE C . 11405 1 817 . 1 1 71 71 PHE CA C 13 55.329 0.300 . 1 . . . . 71 PHE CA . 11405 1 818 . 1 1 71 71 PHE CB C 13 44.220 0.300 . 1 . . . . 71 PHE CB . 11405 1 819 . 1 1 71 71 PHE CD1 C 13 131.916 0.300 . 1 . . . . 71 PHE CD1 . 11405 1 820 . 1 1 71 71 PHE CD2 C 13 131.916 0.300 . 1 . . . . 71 PHE CD2 . 11405 1 821 . 1 1 71 71 PHE CE1 C 13 130.513 0.300 . 1 . . . . 71 PHE CE1 . 11405 1 822 . 1 1 71 71 PHE CE2 C 13 130.513 0.300 . 1 . . . . 71 PHE CE2 . 11405 1 823 . 1 1 71 71 PHE CZ C 13 129.692 0.300 . 1 . . . . 71 PHE CZ . 11405 1 824 . 1 1 71 71 PHE N N 15 120.762 0.300 . 1 . . . . 71 PHE N . 11405 1 825 . 1 1 72 72 VAL H H 1 7.812 0.030 . 1 . . . . 72 VAL H . 11405 1 826 . 1 1 72 72 VAL HA H 1 4.333 0.030 . 1 . . . . 72 VAL HA . 11405 1 827 . 1 1 72 72 VAL HB H 1 0.904 0.030 . 1 . . . . 72 VAL HB . 11405 1 828 . 1 1 72 72 VAL HG11 H 1 0.176 0.030 . 1 . . . . 72 VAL HG1 . 11405 1 829 . 1 1 72 72 VAL HG12 H 1 0.176 0.030 . 1 . . . . 72 VAL HG1 . 11405 1 830 . 1 1 72 72 VAL HG13 H 1 0.176 0.030 . 1 . . . . 72 VAL HG1 . 11405 1 831 . 1 1 72 72 VAL HG21 H 1 0.172 0.030 . 1 . . . . 72 VAL HG2 . 11405 1 832 . 1 1 72 72 VAL HG22 H 1 0.172 0.030 . 1 . . . . 72 VAL HG2 . 11405 1 833 . 1 1 72 72 VAL HG23 H 1 0.172 0.030 . 1 . . . . 72 VAL HG2 . 11405 1 834 . 1 1 72 72 VAL C C 13 172.608 0.300 . 1 . . . . 72 VAL C . 11405 1 835 . 1 1 72 72 VAL CA C 13 59.886 0.300 . 1 . . . . 72 VAL CA . 11405 1 836 . 1 1 72 72 VAL CB C 13 36.777 0.300 . 1 . . . . 72 VAL CB . 11405 1 837 . 1 1 72 72 VAL CG1 C 13 22.168 0.300 . 2 . . . . 72 VAL CG1 . 11405 1 838 . 1 1 72 72 VAL CG2 C 13 21.060 0.300 . 2 . . . . 72 VAL CG2 . 11405 1 839 . 1 1 72 72 VAL N N 15 124.971 0.300 . 1 . . . . 72 VAL N . 11405 1 840 . 1 1 73 73 SER H H 1 8.440 0.030 . 1 . . . . 73 SER H . 11405 1 841 . 1 1 73 73 SER HA H 1 5.259 0.030 . 1 . . . . 73 SER HA . 11405 1 842 . 1 1 73 73 SER HB2 H 1 4.013 0.030 . 2 . . . . 73 SER HB2 . 11405 1 843 . 1 1 73 73 SER HB3 H 1 3.747 0.030 . 2 . . . . 73 SER HB3 . 11405 1 844 . 1 1 73 73 SER C C 13 174.014 0.300 . 1 . . . . 73 SER C . 11405 1 845 . 1 1 73 73 SER CA C 13 55.062 0.300 . 1 . . . . 73 SER CA . 11405 1 846 . 1 1 73 73 SER CB C 13 67.421 0.300 . 1 . . . . 73 SER CB . 11405 1 847 . 1 1 73 73 SER N N 15 118.474 0.300 . 1 . . . . 73 SER N . 11405 1 848 . 1 1 74 74 TYR H H 1 8.334 0.030 . 1 . . . . 74 TYR H . 11405 1 849 . 1 1 74 74 TYR HA H 1 5.394 0.030 . 1 . . . . 74 TYR HA . 11405 1 850 . 1 1 74 74 TYR HB2 H 1 3.410 0.030 . 2 . . . . 74 TYR HB2 . 11405 1 851 . 1 1 74 74 TYR HB3 H 1 2.765 0.030 . 2 . . . . 74 TYR HB3 . 11405 1 852 . 1 1 74 74 TYR HD1 H 1 6.731 0.030 . 1 . . . . 74 TYR HD1 . 11405 1 853 . 1 1 74 74 TYR HD2 H 1 6.731 0.030 . 1 . . . . 74 TYR HD2 . 11405 1 854 . 1 1 74 74 TYR HE1 H 1 6.501 0.030 . 1 . . . . 74 TYR HE1 . 11405 1 855 . 1 1 74 74 TYR HE2 H 1 6.501 0.030 . 1 . . . . 74 TYR HE2 . 11405 1 856 . 1 1 74 74 TYR C C 13 174.073 0.300 . 1 . . . . 74 TYR C . 11405 1 857 . 1 1 74 74 TYR CA C 13 56.920 0.300 . 1 . . . . 74 TYR CA . 11405 1 858 . 1 1 74 74 TYR CB C 13 43.410 0.300 . 1 . . . . 74 TYR CB . 11405 1 859 . 1 1 74 74 TYR CD1 C 13 132.085 0.300 . 1 . . . . 74 TYR CD1 . 11405 1 860 . 1 1 74 74 TYR CD2 C 13 132.085 0.300 . 1 . . . . 74 TYR CD2 . 11405 1 861 . 1 1 74 74 TYR CE1 C 13 118.131 0.300 . 1 . . . . 74 TYR CE1 . 11405 1 862 . 1 1 74 74 TYR CE2 C 13 118.131 0.300 . 1 . . . . 74 TYR CE2 . 11405 1 863 . 1 1 74 74 TYR N N 15 119.866 0.300 . 1 . . . . 74 TYR N . 11405 1 864 . 1 1 75 75 ASP H H 1 7.856 0.030 . 1 . . . . 75 ASP H . 11405 1 865 . 1 1 75 75 ASP HA H 1 4.532 0.030 . 1 . . . . 75 ASP HA . 11405 1 866 . 1 1 75 75 ASP HB2 H 1 3.171 0.030 . 2 . . . . 75 ASP HB2 . 11405 1 867 . 1 1 75 75 ASP HB3 H 1 2.432 0.030 . 2 . . . . 75 ASP HB3 . 11405 1 868 . 1 1 75 75 ASP C C 13 176.688 0.300 . 1 . . . . 75 ASP C . 11405 1 869 . 1 1 75 75 ASP CA C 13 53.187 0.300 . 1 . . . . 75 ASP CA . 11405 1 870 . 1 1 75 75 ASP CB C 13 40.618 0.300 . 1 . . . . 75 ASP CB . 11405 1 871 . 1 1 75 75 ASP N N 15 113.552 0.300 . 1 . . . . 75 ASP N . 11405 1 872 . 1 1 76 76 ASN H H 1 7.210 0.030 . 1 . . . . 76 ASN H . 11405 1 873 . 1 1 76 76 ASN HA H 1 5.097 0.030 . 1 . . . . 76 ASN HA . 11405 1 874 . 1 1 76 76 ASN HB2 H 1 2.927 0.030 . 2 . . . . 76 ASN HB2 . 11405 1 875 . 1 1 76 76 ASN HB3 H 1 2.879 0.030 . 2 . . . . 76 ASN HB3 . 11405 1 876 . 1 1 76 76 ASN HD21 H 1 7.997 0.030 . 2 . . . . 76 ASN HD21 . 11405 1 877 . 1 1 76 76 ASN HD22 H 1 7.264 0.030 . 2 . . . . 76 ASN HD22 . 11405 1 878 . 1 1 76 76 ASN C C 13 173.406 0.300 . 1 . . . . 76 ASN C . 11405 1 879 . 1 1 76 76 ASN CA C 13 51.238 0.300 . 1 . . . . 76 ASN CA . 11405 1 880 . 1 1 76 76 ASN CB C 13 41.544 0.300 . 1 . . . . 76 ASN CB . 11405 1 881 . 1 1 76 76 ASN N N 15 113.990 0.300 . 1 . . . . 76 ASN N . 11405 1 882 . 1 1 76 76 ASN ND2 N 15 114.813 0.300 . 1 . . . . 76 ASN ND2 . 11405 1 883 . 1 1 77 77 PRO HA H 1 4.206 0.030 . 1 . . . . 77 PRO HA . 11405 1 884 . 1 1 77 77 PRO HB2 H 1 2.257 0.030 . 2 . . . . 77 PRO HB2 . 11405 1 885 . 1 1 77 77 PRO HB3 H 1 2.115 0.030 . 2 . . . . 77 PRO HB3 . 11405 1 886 . 1 1 77 77 PRO HD2 H 1 4.070 0.030 . 2 . . . . 77 PRO HD2 . 11405 1 887 . 1 1 77 77 PRO HD3 H 1 3.570 0.030 . 2 . . . . 77 PRO HD3 . 11405 1 888 . 1 1 77 77 PRO HG2 H 1 2.164 0.030 . 2 . . . . 77 PRO HG2 . 11405 1 889 . 1 1 77 77 PRO HG3 H 1 2.047 0.030 . 2 . . . . 77 PRO HG3 . 11405 1 890 . 1 1 77 77 PRO C C 13 177.637 0.300 . 1 . . . . 77 PRO C . 11405 1 891 . 1 1 77 77 PRO CA C 13 64.662 0.300 . 1 . . . . 77 PRO CA . 11405 1 892 . 1 1 77 77 PRO CB C 13 32.802 0.300 . 1 . . . . 77 PRO CB . 11405 1 893 . 1 1 77 77 PRO CD C 13 51.598 0.300 . 1 . . . . 77 PRO CD . 11405 1 894 . 1 1 77 77 PRO CG C 13 27.487 0.300 . 1 . . . . 77 PRO CG . 11405 1 895 . 1 1 78 78 VAL H H 1 8.056 0.030 . 1 . . . . 78 VAL H . 11405 1 896 . 1 1 78 78 VAL HA H 1 3.680 0.030 . 1 . . . . 78 VAL HA . 11405 1 897 . 1 1 78 78 VAL HB H 1 2.089 0.030 . 1 . . . . 78 VAL HB . 11405 1 898 . 1 1 78 78 VAL HG11 H 1 1.025 0.030 . 1 . . . . 78 VAL HG1 . 11405 1 899 . 1 1 78 78 VAL HG12 H 1 1.025 0.030 . 1 . . . . 78 VAL HG1 . 11405 1 900 . 1 1 78 78 VAL HG13 H 1 1.025 0.030 . 1 . . . . 78 VAL HG1 . 11405 1 901 . 1 1 78 78 VAL HG21 H 1 0.940 0.030 . 1 . . . . 78 VAL HG2 . 11405 1 902 . 1 1 78 78 VAL HG22 H 1 0.940 0.030 . 1 . . . . 78 VAL HG2 . 11405 1 903 . 1 1 78 78 VAL HG23 H 1 0.940 0.030 . 1 . . . . 78 VAL HG2 . 11405 1 904 . 1 1 78 78 VAL C C 13 179.536 0.300 . 1 . . . . 78 VAL C . 11405 1 905 . 1 1 78 78 VAL CA C 13 66.457 0.300 . 1 . . . . 78 VAL CA . 11405 1 906 . 1 1 78 78 VAL CB C 13 31.336 0.300 . 1 . . . . 78 VAL CB . 11405 1 907 . 1 1 78 78 VAL CG1 C 13 22.393 0.300 . 2 . . . . 78 VAL CG1 . 11405 1 908 . 1 1 78 78 VAL CG2 C 13 21.097 0.300 . 2 . . . . 78 VAL CG2 . 11405 1 909 . 1 1 78 78 VAL N N 15 121.099 0.300 . 1 . . . . 78 VAL N . 11405 1 910 . 1 1 79 79 SER H H 1 7.848 0.030 . 1 . . . . 79 SER H . 11405 1 911 . 1 1 79 79 SER HA H 1 3.988 0.030 . 1 . . . . 79 SER HA . 11405 1 912 . 1 1 79 79 SER HB2 H 1 3.207 0.030 . 2 . . . . 79 SER HB2 . 11405 1 913 . 1 1 79 79 SER HB3 H 1 2.839 0.030 . 2 . . . . 79 SER HB3 . 11405 1 914 . 1 1 79 79 SER C C 13 174.024 0.300 . 1 . . . . 79 SER C . 11405 1 915 . 1 1 79 79 SER CA C 13 61.554 0.300 . 1 . . . . 79 SER CA . 11405 1 916 . 1 1 79 79 SER CB C 13 62.912 0.300 . 1 . . . . 79 SER CB . 11405 1 917 . 1 1 79 79 SER N N 15 117.910 0.300 . 1 . . . . 79 SER N . 11405 1 918 . 1 1 80 80 ALA H H 1 6.349 0.030 . 1 . . . . 80 ALA H . 11405 1 919 . 1 1 80 80 ALA HA H 1 3.795 0.030 . 1 . . . . 80 ALA HA . 11405 1 920 . 1 1 80 80 ALA HB1 H 1 1.533 0.030 . 1 . . . . 80 ALA HB . 11405 1 921 . 1 1 80 80 ALA HB2 H 1 1.533 0.030 . 1 . . . . 80 ALA HB . 11405 1 922 . 1 1 80 80 ALA HB3 H 1 1.533 0.030 . 1 . . . . 80 ALA HB . 11405 1 923 . 1 1 80 80 ALA C C 13 178.524 0.300 . 1 . . . . 80 ALA C . 11405 1 924 . 1 1 80 80 ALA CA C 13 54.945 0.300 . 1 . . . . 80 ALA CA . 11405 1 925 . 1 1 80 80 ALA CB C 13 18.376 0.300 . 1 . . . . 80 ALA CB . 11405 1 926 . 1 1 80 80 ALA N N 15 120.098 0.300 . 1 . . . . 80 ALA N . 11405 1 927 . 1 1 81 81 GLN H H 1 7.730 0.030 . 1 . . . . 81 GLN H . 11405 1 928 . 1 1 81 81 GLN HA H 1 3.885 0.030 . 1 . . . . 81 GLN HA . 11405 1 929 . 1 1 81 81 GLN HB2 H 1 2.150 0.030 . 1 . . . . 81 GLN HB2 . 11405 1 930 . 1 1 81 81 GLN HB3 H 1 2.150 0.030 . 1 . . . . 81 GLN HB3 . 11405 1 931 . 1 1 81 81 GLN HE21 H 1 7.800 0.030 . 2 . . . . 81 GLN HE21 . 11405 1 932 . 1 1 81 81 GLN HE22 H 1 6.810 0.030 . 2 . . . . 81 GLN HE22 . 11405 1 933 . 1 1 81 81 GLN HG2 H 1 2.492 0.030 . 1 . . . . 81 GLN HG2 . 11405 1 934 . 1 1 81 81 GLN HG3 H 1 2.492 0.030 . 1 . . . . 81 GLN HG3 . 11405 1 935 . 1 1 81 81 GLN C C 13 178.459 0.300 . 1 . . . . 81 GLN C . 11405 1 936 . 1 1 81 81 GLN CA C 13 58.634 0.300 . 1 . . . . 81 GLN CA . 11405 1 937 . 1 1 81 81 GLN CB C 13 27.835 0.300 . 1 . . . . 81 GLN CB . 11405 1 938 . 1 1 81 81 GLN CG C 13 33.543 0.300 . 1 . . . . 81 GLN CG . 11405 1 939 . 1 1 81 81 GLN N N 15 116.011 0.300 . 1 . . . . 81 GLN N . 11405 1 940 . 1 1 81 81 GLN NE2 N 15 112.165 0.300 . 1 . . . . 81 GLN NE2 . 11405 1 941 . 1 1 82 82 ALA H H 1 7.800 0.030 . 1 . . . . 82 ALA H . 11405 1 942 . 1 1 82 82 ALA HA H 1 4.050 0.030 . 1 . . . . 82 ALA HA . 11405 1 943 . 1 1 82 82 ALA HB1 H 1 1.587 0.030 . 1 . . . . 82 ALA HB . 11405 1 944 . 1 1 82 82 ALA HB2 H 1 1.587 0.030 . 1 . . . . 82 ALA HB . 11405 1 945 . 1 1 82 82 ALA HB3 H 1 1.587 0.030 . 1 . . . . 82 ALA HB . 11405 1 946 . 1 1 82 82 ALA C C 13 179.859 0.300 . 1 . . . . 82 ALA C . 11405 1 947 . 1 1 82 82 ALA CA C 13 54.962 0.300 . 1 . . . . 82 ALA CA . 11405 1 948 . 1 1 82 82 ALA CB C 13 17.960 0.300 . 1 . . . . 82 ALA CB . 11405 1 949 . 1 1 82 82 ALA N N 15 123.033 0.300 . 1 . . . . 82 ALA N . 11405 1 950 . 1 1 83 83 ALA H H 1 7.845 0.030 . 1 . . . . 83 ALA H . 11405 1 951 . 1 1 83 83 ALA HA H 1 2.347 0.030 . 1 . . . . 83 ALA HA . 11405 1 952 . 1 1 83 83 ALA HB1 H 1 1.424 0.030 . 1 . . . . 83 ALA HB . 11405 1 953 . 1 1 83 83 ALA HB2 H 1 1.424 0.030 . 1 . . . . 83 ALA HB . 11405 1 954 . 1 1 83 83 ALA HB3 H 1 1.424 0.030 . 1 . . . . 83 ALA HB . 11405 1 955 . 1 1 83 83 ALA C C 13 179.900 0.300 . 1 . . . . 83 ALA C . 11405 1 956 . 1 1 83 83 ALA CA C 13 54.678 0.300 . 1 . . . . 83 ALA CA . 11405 1 957 . 1 1 83 83 ALA CB C 13 18.876 0.300 . 1 . . . . 83 ALA CB . 11405 1 958 . 1 1 83 83 ALA N N 15 121.773 0.300 . 1 . . . . 83 ALA N . 11405 1 959 . 1 1 84 84 ILE H H 1 8.071 0.030 . 1 . . . . 84 ILE H . 11405 1 960 . 1 1 84 84 ILE HA H 1 3.280 0.030 . 1 . . . . 84 ILE HA . 11405 1 961 . 1 1 84 84 ILE HB H 1 1.795 0.030 . 1 . . . . 84 ILE HB . 11405 1 962 . 1 1 84 84 ILE HD11 H 1 0.787 0.030 . 1 . . . . 84 ILE HD1 . 11405 1 963 . 1 1 84 84 ILE HD12 H 1 0.787 0.030 . 1 . . . . 84 ILE HD1 . 11405 1 964 . 1 1 84 84 ILE HD13 H 1 0.787 0.030 . 1 . . . . 84 ILE HD1 . 11405 1 965 . 1 1 84 84 ILE HG12 H 1 1.776 0.030 . 2 . . . . 84 ILE HG12 . 11405 1 966 . 1 1 84 84 ILE HG13 H 1 0.681 0.030 . 2 . . . . 84 ILE HG13 . 11405 1 967 . 1 1 84 84 ILE HG21 H 1 0.934 0.030 . 1 . . . . 84 ILE HG2 . 11405 1 968 . 1 1 84 84 ILE HG22 H 1 0.934 0.030 . 1 . . . . 84 ILE HG2 . 11405 1 969 . 1 1 84 84 ILE HG23 H 1 0.934 0.030 . 1 . . . . 84 ILE HG2 . 11405 1 970 . 1 1 84 84 ILE C C 13 177.995 0.300 . 1 . . . . 84 ILE C . 11405 1 971 . 1 1 84 84 ILE CA C 13 66.474 0.300 . 1 . . . . 84 ILE CA . 11405 1 972 . 1 1 84 84 ILE CB C 13 38.644 0.300 . 1 . . . . 84 ILE CB . 11405 1 973 . 1 1 84 84 ILE CD1 C 13 14.221 0.300 . 1 . . . . 84 ILE CD1 . 11405 1 974 . 1 1 84 84 ILE CG1 C 13 30.336 0.300 . 1 . . . . 84 ILE CG1 . 11405 1 975 . 1 1 84 84 ILE CG2 C 13 17.551 0.300 . 1 . . . . 84 ILE CG2 . 11405 1 976 . 1 1 84 84 ILE N N 15 118.566 0.300 . 1 . . . . 84 ILE N . 11405 1 977 . 1 1 85 85 GLN H H 1 7.841 0.030 . 1 . . . . 85 GLN H . 11405 1 978 . 1 1 85 85 GLN HA H 1 3.965 0.030 . 1 . . . . 85 GLN HA . 11405 1 979 . 1 1 85 85 GLN HB2 H 1 2.125 0.030 . 1 . . . . 85 GLN HB2 . 11405 1 980 . 1 1 85 85 GLN HB3 H 1 2.125 0.030 . 1 . . . . 85 GLN HB3 . 11405 1 981 . 1 1 85 85 GLN HE21 H 1 7.478 0.030 . 2 . . . . 85 GLN HE21 . 11405 1 982 . 1 1 85 85 GLN HE22 H 1 6.863 0.030 . 2 . . . . 85 GLN HE22 . 11405 1 983 . 1 1 85 85 GLN HG2 H 1 2.464 0.030 . 1 . . . . 85 GLN HG2 . 11405 1 984 . 1 1 85 85 GLN HG3 H 1 2.464 0.030 . 1 . . . . 85 GLN HG3 . 11405 1 985 . 1 1 85 85 GLN C C 13 178.613 0.300 . 1 . . . . 85 GLN C . 11405 1 986 . 1 1 85 85 GLN CA C 13 58.724 0.300 . 1 . . . . 85 GLN CA . 11405 1 987 . 1 1 85 85 GLN CB C 13 28.410 0.300 . 1 . . . . 85 GLN CB . 11405 1 988 . 1 1 85 85 GLN CG C 13 33.848 0.300 . 1 . . . . 85 GLN CG . 11405 1 989 . 1 1 85 85 GLN N N 15 116.799 0.300 . 1 . . . . 85 GLN N . 11405 1 990 . 1 1 85 85 GLN NE2 N 15 112.021 0.300 . 1 . . . . 85 GLN NE2 . 11405 1 991 . 1 1 86 86 SER H H 1 7.536 0.030 . 1 . . . . 86 SER H . 11405 1 992 . 1 1 86 86 SER HA H 1 4.448 0.030 . 1 . . . . 86 SER HA . 11405 1 993 . 1 1 86 86 SER HB2 H 1 3.681 0.030 . 2 . . . . 86 SER HB2 . 11405 1 994 . 1 1 86 86 SER HB3 H 1 3.490 0.030 . 2 . . . . 86 SER HB3 . 11405 1 995 . 1 1 86 86 SER C C 13 175.615 0.300 . 1 . . . . 86 SER C . 11405 1 996 . 1 1 86 86 SER CA C 13 61.587 0.300 . 1 . . . . 86 SER CA . 11405 1 997 . 1 1 86 86 SER CB C 13 64.849 0.300 . 1 . . . . 86 SER CB . 11405 1 998 . 1 1 86 86 SER N N 15 110.691 0.300 . 1 . . . . 86 SER N . 11405 1 999 . 1 1 87 87 MET H H 1 8.318 0.030 . 1 . . . . 87 MET H . 11405 1 1000 . 1 1 87 87 MET HA H 1 4.915 0.030 . 1 . . . . 87 MET HA . 11405 1 1001 . 1 1 87 87 MET HB2 H 1 2.064 0.030 . 2 . . . . 87 MET HB2 . 11405 1 1002 . 1 1 87 87 MET HB3 H 1 1.853 0.030 . 2 . . . . 87 MET HB3 . 11405 1 1003 . 1 1 87 87 MET HE1 H 1 1.147 0.030 . 1 . . . . 87 MET HE . 11405 1 1004 . 1 1 87 87 MET HE2 H 1 1.147 0.030 . 1 . . . . 87 MET HE . 11405 1 1005 . 1 1 87 87 MET HE3 H 1 1.147 0.030 . 1 . . . . 87 MET HE . 11405 1 1006 . 1 1 87 87 MET HG2 H 1 1.964 0.030 . 2 . . . . 87 MET HG2 . 11405 1 1007 . 1 1 87 87 MET HG3 H 1 1.881 0.030 . 2 . . . . 87 MET HG3 . 11405 1 1008 . 1 1 87 87 MET C C 13 177.859 0.300 . 1 . . . . 87 MET C . 11405 1 1009 . 1 1 87 87 MET CA C 13 53.837 0.300 . 1 . . . . 87 MET CA . 11405 1 1010 . 1 1 87 87 MET CB C 13 31.472 0.300 . 1 . . . . 87 MET CB . 11405 1 1011 . 1 1 87 87 MET CE C 13 15.730 0.300 . 1 . . . . 87 MET CE . 11405 1 1012 . 1 1 87 87 MET CG C 13 32.352 0.300 . 1 . . . . 87 MET CG . 11405 1 1013 . 1 1 87 87 MET N N 15 114.353 0.300 . 1 . . . . 87 MET N . 11405 1 1014 . 1 1 88 88 ASN H H 1 8.367 0.030 . 1 . . . . 88 ASN H . 11405 1 1015 . 1 1 88 88 ASN HA H 1 4.537 0.030 . 1 . . . . 88 ASN HA . 11405 1 1016 . 1 1 88 88 ASN HB2 H 1 3.117 0.030 . 2 . . . . 88 ASN HB2 . 11405 1 1017 . 1 1 88 88 ASN HB3 H 1 2.984 0.030 . 2 . . . . 88 ASN HB3 . 11405 1 1018 . 1 1 88 88 ASN HD21 H 1 7.891 0.030 . 2 . . . . 88 ASN HD21 . 11405 1 1019 . 1 1 88 88 ASN HD22 H 1 7.057 0.030 . 2 . . . . 88 ASN HD22 . 11405 1 1020 . 1 1 88 88 ASN C C 13 176.678 0.300 . 1 . . . . 88 ASN C . 11405 1 1021 . 1 1 88 88 ASN CA C 13 56.519 0.300 . 1 . . . . 88 ASN CA . 11405 1 1022 . 1 1 88 88 ASN CB C 13 38.751 0.300 . 1 . . . . 88 ASN CB . 11405 1 1023 . 1 1 88 88 ASN N N 15 118.768 0.300 . 1 . . . . 88 ASN N . 11405 1 1024 . 1 1 88 88 ASN ND2 N 15 114.646 0.300 . 1 . . . . 88 ASN ND2 . 11405 1 1025 . 1 1 89 89 GLY H H 1 8.998 0.030 . 1 . . . . 89 GLY H . 11405 1 1026 . 1 1 89 89 GLY HA2 H 1 4.394 0.030 . 2 . . . . 89 GLY HA2 . 11405 1 1027 . 1 1 89 89 GLY HA3 H 1 3.673 0.030 . 2 . . . . 89 GLY HA3 . 11405 1 1028 . 1 1 89 89 GLY C C 13 173.173 0.300 . 1 . . . . 89 GLY C . 11405 1 1029 . 1 1 89 89 GLY CA C 13 45.695 0.300 . 1 . . . . 89 GLY CA . 11405 1 1030 . 1 1 89 89 GLY N N 15 118.146 0.300 . 1 . . . . 89 GLY N . 11405 1 1031 . 1 1 90 90 PHE H H 1 7.935 0.030 . 1 . . . . 90 PHE H . 11405 1 1032 . 1 1 90 90 PHE HA H 1 4.265 0.030 . 1 . . . . 90 PHE HA . 11405 1 1033 . 1 1 90 90 PHE HB2 H 1 3.348 0.030 . 2 . . . . 90 PHE HB2 . 11405 1 1034 . 1 1 90 90 PHE HB3 H 1 3.000 0.030 . 2 . . . . 90 PHE HB3 . 11405 1 1035 . 1 1 90 90 PHE HD1 H 1 7.122 0.030 . 1 . . . . 90 PHE HD1 . 11405 1 1036 . 1 1 90 90 PHE HD2 H 1 7.122 0.030 . 1 . . . . 90 PHE HD2 . 11405 1 1037 . 1 1 90 90 PHE HE1 H 1 7.312 0.030 . 1 . . . . 90 PHE HE1 . 11405 1 1038 . 1 1 90 90 PHE HE2 H 1 7.312 0.030 . 1 . . . . 90 PHE HE2 . 11405 1 1039 . 1 1 90 90 PHE HZ H 1 7.316 0.030 . 1 . . . . 90 PHE HZ . 11405 1 1040 . 1 1 90 90 PHE C C 13 174.811 0.300 . 1 . . . . 90 PHE C . 11405 1 1041 . 1 1 90 90 PHE CA C 13 59.321 0.300 . 1 . . . . 90 PHE CA . 11405 1 1042 . 1 1 90 90 PHE CB C 13 41.098 0.300 . 1 . . . . 90 PHE CB . 11405 1 1043 . 1 1 90 90 PHE CD1 C 13 131.990 0.300 . 1 . . . . 90 PHE CD1 . 11405 1 1044 . 1 1 90 90 PHE CD2 C 13 131.990 0.300 . 1 . . . . 90 PHE CD2 . 11405 1 1045 . 1 1 90 90 PHE CE1 C 13 131.257 0.300 . 1 . . . . 90 PHE CE1 . 11405 1 1046 . 1 1 90 90 PHE CE2 C 13 131.257 0.300 . 1 . . . . 90 PHE CE2 . 11405 1 1047 . 1 1 90 90 PHE CZ C 13 129.728 0.300 . 1 . . . . 90 PHE CZ . 11405 1 1048 . 1 1 90 90 PHE N N 15 123.339 0.300 . 1 . . . . 90 PHE N . 11405 1 1049 . 1 1 91 91 GLN H H 1 8.032 0.030 . 1 . . . . 91 GLN H . 11405 1 1050 . 1 1 91 91 GLN HA H 1 4.655 0.030 . 1 . . . . 91 GLN HA . 11405 1 1051 . 1 1 91 91 GLN HB2 H 1 1.825 0.030 . 2 . . . . 91 GLN HB2 . 11405 1 1052 . 1 1 91 91 GLN HB3 H 1 1.717 0.030 . 2 . . . . 91 GLN HB3 . 11405 1 1053 . 1 1 91 91 GLN HE21 H 1 7.394 0.030 . 2 . . . . 91 GLN HE21 . 11405 1 1054 . 1 1 91 91 GLN HE22 H 1 6.657 0.030 . 2 . . . . 91 GLN HE22 . 11405 1 1055 . 1 1 91 91 GLN HG2 H 1 2.091 0.030 . 1 . . . . 91 GLN HG2 . 11405 1 1056 . 1 1 91 91 GLN HG3 H 1 2.091 0.030 . 1 . . . . 91 GLN HG3 . 11405 1 1057 . 1 1 91 91 GLN C C 13 174.346 0.300 . 1 . . . . 91 GLN C . 11405 1 1058 . 1 1 91 91 GLN CA C 13 55.804 0.300 . 1 . . . . 91 GLN CA . 11405 1 1059 . 1 1 91 91 GLN CB C 13 29.126 0.300 . 1 . . . . 91 GLN CB . 11405 1 1060 . 1 1 91 91 GLN CG C 13 33.552 0.300 . 1 . . . . 91 GLN CG . 11405 1 1061 . 1 1 91 91 GLN N N 15 128.571 0.300 . 1 . . . . 91 GLN N . 11405 1 1062 . 1 1 91 91 GLN NE2 N 15 110.801 0.300 . 1 . . . . 91 GLN NE2 . 11405 1 1063 . 1 1 92 92 ILE H H 1 8.486 0.030 . 1 . . . . 92 ILE H . 11405 1 1064 . 1 1 92 92 ILE HA H 1 4.225 0.030 . 1 . . . . 92 ILE HA . 11405 1 1065 . 1 1 92 92 ILE HB H 1 1.757 0.030 . 1 . . . . 92 ILE HB . 11405 1 1066 . 1 1 92 92 ILE HD11 H 1 0.945 0.030 . 1 . . . . 92 ILE HD1 . 11405 1 1067 . 1 1 92 92 ILE HD12 H 1 0.945 0.030 . 1 . . . . 92 ILE HD1 . 11405 1 1068 . 1 1 92 92 ILE HD13 H 1 0.945 0.030 . 1 . . . . 92 ILE HD1 . 11405 1 1069 . 1 1 92 92 ILE HG12 H 1 1.581 0.030 . 2 . . . . 92 ILE HG12 . 11405 1 1070 . 1 1 92 92 ILE HG13 H 1 1.098 0.030 . 2 . . . . 92 ILE HG13 . 11405 1 1071 . 1 1 92 92 ILE HG21 H 1 0.899 0.030 . 1 . . . . 92 ILE HG2 . 11405 1 1072 . 1 1 92 92 ILE HG22 H 1 0.899 0.030 . 1 . . . . 92 ILE HG2 . 11405 1 1073 . 1 1 92 92 ILE HG23 H 1 0.899 0.030 . 1 . . . . 92 ILE HG2 . 11405 1 1074 . 1 1 92 92 ILE C C 13 175.579 0.300 . 1 . . . . 92 ILE C . 11405 1 1075 . 1 1 92 92 ILE CA C 13 60.088 0.300 . 1 . . . . 92 ILE CA . 11405 1 1076 . 1 1 92 92 ILE CB C 13 39.723 0.300 . 1 . . . . 92 ILE CB . 11405 1 1077 . 1 1 92 92 ILE CD1 C 13 14.797 0.300 . 1 . . . . 92 ILE CD1 . 11405 1 1078 . 1 1 92 92 ILE CG1 C 13 27.853 0.300 . 1 . . . . 92 ILE CG1 . 11405 1 1079 . 1 1 92 92 ILE CG2 C 13 16.727 0.300 . 1 . . . . 92 ILE CG2 . 11405 1 1080 . 1 1 92 92 ILE N N 15 126.294 0.300 . 1 . . . . 92 ILE N . 11405 1 1081 . 1 1 93 93 GLY H H 1 8.960 0.030 . 1 . . . . 93 GLY H . 11405 1 1082 . 1 1 93 93 GLY HA2 H 1 3.922 0.030 . 2 . . . . 93 GLY HA2 . 11405 1 1083 . 1 1 93 93 GLY HA3 H 1 3.668 0.030 . 2 . . . . 93 GLY HA3 . 11405 1 1084 . 1 1 93 93 GLY C C 13 175.206 0.300 . 1 . . . . 93 GLY C . 11405 1 1085 . 1 1 93 93 GLY CA C 13 46.975 0.300 . 1 . . . . 93 GLY CA . 11405 1 1086 . 1 1 93 93 GLY N N 15 117.743 0.300 . 1 . . . . 93 GLY N . 11405 1 1087 . 1 1 94 94 MET H H 1 8.953 0.030 . 1 . . . . 94 MET H . 11405 1 1088 . 1 1 94 94 MET HA H 1 4.438 0.030 . 1 . . . . 94 MET HA . 11405 1 1089 . 1 1 94 94 MET HB2 H 1 2.269 0.030 . 2 . . . . 94 MET HB2 . 11405 1 1090 . 1 1 94 94 MET HB3 H 1 2.004 0.030 . 2 . . . . 94 MET HB3 . 11405 1 1091 . 1 1 94 94 MET HE1 H 1 2.078 0.030 . 1 . . . . 94 MET HE . 11405 1 1092 . 1 1 94 94 MET HE2 H 1 2.078 0.030 . 1 . . . . 94 MET HE . 11405 1 1093 . 1 1 94 94 MET HE3 H 1 2.078 0.030 . 1 . . . . 94 MET HE . 11405 1 1094 . 1 1 94 94 MET HG2 H 1 2.655 0.030 . 2 . . . . 94 MET HG2 . 11405 1 1095 . 1 1 94 94 MET HG3 H 1 2.521 0.030 . 2 . . . . 94 MET HG3 . 11405 1 1096 . 1 1 94 94 MET C C 13 176.056 0.300 . 1 . . . . 94 MET C . 11405 1 1097 . 1 1 94 94 MET CA C 13 55.454 0.300 . 1 . . . . 94 MET CA . 11405 1 1098 . 1 1 94 94 MET CB C 13 32.226 0.300 . 1 . . . . 94 MET CB . 11405 1 1099 . 1 1 94 94 MET CE C 13 16.868 0.300 . 1 . . . . 94 MET CE . 11405 1 1100 . 1 1 94 94 MET CG C 13 32.334 0.300 . 1 . . . . 94 MET CG . 11405 1 1101 . 1 1 94 94 MET N N 15 123.051 0.300 . 1 . . . . 94 MET N . 11405 1 1102 . 1 1 95 95 LYS H H 1 7.860 0.030 . 1 . . . . 95 LYS H . 11405 1 1103 . 1 1 95 95 LYS HA H 1 4.560 0.030 . 1 . . . . 95 LYS HA . 11405 1 1104 . 1 1 95 95 LYS HB2 H 1 1.898 0.030 . 1 . . . . 95 LYS HB2 . 11405 1 1105 . 1 1 95 95 LYS HB3 H 1 1.898 0.030 . 1 . . . . 95 LYS HB3 . 11405 1 1106 . 1 1 95 95 LYS HD2 H 1 1.453 0.030 . 1 . . . . 95 LYS HD2 . 11405 1 1107 . 1 1 95 95 LYS HD3 H 1 1.453 0.030 . 1 . . . . 95 LYS HD3 . 11405 1 1108 . 1 1 95 95 LYS HE2 H 1 2.930 0.030 . 2 . . . . 95 LYS HE2 . 11405 1 1109 . 1 1 95 95 LYS HE3 H 1 2.864 0.030 . 2 . . . . 95 LYS HE3 . 11405 1 1110 . 1 1 95 95 LYS HG2 H 1 1.359 0.030 . 2 . . . . 95 LYS HG2 . 11405 1 1111 . 1 1 95 95 LYS HG3 H 1 1.286 0.030 . 2 . . . . 95 LYS HG3 . 11405 1 1112 . 1 1 95 95 LYS C C 13 174.668 0.300 . 1 . . . . 95 LYS C . 11405 1 1113 . 1 1 95 95 LYS CA C 13 55.102 0.300 . 1 . . . . 95 LYS CA . 11405 1 1114 . 1 1 95 95 LYS CB C 13 35.328 0.300 . 1 . . . . 95 LYS CB . 11405 1 1115 . 1 1 95 95 LYS CD C 13 28.992 0.300 . 1 . . . . 95 LYS CD . 11405 1 1116 . 1 1 95 95 LYS CE C 13 42.339 0.300 . 1 . . . . 95 LYS CE . 11405 1 1117 . 1 1 95 95 LYS CG C 13 25.384 0.300 . 1 . . . . 95 LYS CG . 11405 1 1118 . 1 1 95 95 LYS N N 15 119.608 0.300 . 1 . . . . 95 LYS N . 11405 1 1119 . 1 1 96 96 ARG H H 1 8.107 0.030 . 1 . . . . 96 ARG H . 11405 1 1120 . 1 1 96 96 ARG HA H 1 4.870 0.030 . 1 . . . . 96 ARG HA . 11405 1 1121 . 1 1 96 96 ARG HB2 H 1 1.585 0.030 . 2 . . . . 96 ARG HB2 . 11405 1 1122 . 1 1 96 96 ARG HB3 H 1 1.398 0.030 . 2 . . . . 96 ARG HB3 . 11405 1 1123 . 1 1 96 96 ARG HD2 H 1 3.169 0.030 . 2 . . . . 96 ARG HD2 . 11405 1 1124 . 1 1 96 96 ARG HD3 H 1 3.117 0.030 . 2 . . . . 96 ARG HD3 . 11405 1 1125 . 1 1 96 96 ARG HG2 H 1 1.524 0.030 . 2 . . . . 96 ARG HG2 . 11405 1 1126 . 1 1 96 96 ARG HG3 H 1 1.283 0.030 . 2 . . . . 96 ARG HG3 . 11405 1 1127 . 1 1 96 96 ARG C C 13 176.092 0.300 . 1 . . . . 96 ARG C . 11405 1 1128 . 1 1 96 96 ARG CA C 13 54.420 0.300 . 1 . . . . 96 ARG CA . 11405 1 1129 . 1 1 96 96 ARG CB C 13 31.935 0.300 . 1 . . . . 96 ARG CB . 11405 1 1130 . 1 1 96 96 ARG CD C 13 43.464 0.300 . 1 . . . . 96 ARG CD . 11405 1 1131 . 1 1 96 96 ARG CG C 13 28.117 0.300 . 1 . . . . 96 ARG CG . 11405 1 1132 . 1 1 96 96 ARG N N 15 119.439 0.300 . 1 . . . . 96 ARG N . 11405 1 1133 . 1 1 97 97 LEU H H 1 9.079 0.030 . 1 . . . . 97 LEU H . 11405 1 1134 . 1 1 97 97 LEU HA H 1 4.552 0.030 . 1 . . . . 97 LEU HA . 11405 1 1135 . 1 1 97 97 LEU HB2 H 1 2.289 0.030 . 2 . . . . 97 LEU HB2 . 11405 1 1136 . 1 1 97 97 LEU HB3 H 1 1.427 0.030 . 2 . . . . 97 LEU HB3 . 11405 1 1137 . 1 1 97 97 LEU HD11 H 1 0.793 0.030 . 1 . . . . 97 LEU HD1 . 11405 1 1138 . 1 1 97 97 LEU HD12 H 1 0.793 0.030 . 1 . . . . 97 LEU HD1 . 11405 1 1139 . 1 1 97 97 LEU HD13 H 1 0.793 0.030 . 1 . . . . 97 LEU HD1 . 11405 1 1140 . 1 1 97 97 LEU HD21 H 1 0.973 0.030 . 1 . . . . 97 LEU HD2 . 11405 1 1141 . 1 1 97 97 LEU HD22 H 1 0.973 0.030 . 1 . . . . 97 LEU HD2 . 11405 1 1142 . 1 1 97 97 LEU HD23 H 1 0.973 0.030 . 1 . . . . 97 LEU HD2 . 11405 1 1143 . 1 1 97 97 LEU HG H 1 2.099 0.030 . 1 . . . . 97 LEU HG . 11405 1 1144 . 1 1 97 97 LEU C C 13 178.274 0.300 . 1 . . . . 97 LEU C . 11405 1 1145 . 1 1 97 97 LEU CA C 13 55.869 0.300 . 1 . . . . 97 LEU CA . 11405 1 1146 . 1 1 97 97 LEU CB C 13 43.368 0.300 . 1 . . . . 97 LEU CB . 11405 1 1147 . 1 1 97 97 LEU CD1 C 13 23.856 0.300 . 2 . . . . 97 LEU CD1 . 11405 1 1148 . 1 1 97 97 LEU CD2 C 13 26.117 0.300 . 2 . . . . 97 LEU CD2 . 11405 1 1149 . 1 1 97 97 LEU CG C 13 26.935 0.300 . 1 . . . . 97 LEU CG . 11405 1 1150 . 1 1 97 97 LEU N N 15 122.504 0.300 . 1 . . . . 97 LEU N . 11405 1 1151 . 1 1 98 98 LYS H H 1 8.093 0.030 . 1 . . . . 98 LYS H . 11405 1 1152 . 1 1 98 98 LYS HA H 1 5.208 0.030 . 1 . . . . 98 LYS HA . 11405 1 1153 . 1 1 98 98 LYS HB2 H 1 1.763 0.030 . 1 . . . . 98 LYS HB2 . 11405 1 1154 . 1 1 98 98 LYS HB3 H 1 1.763 0.030 . 1 . . . . 98 LYS HB3 . 11405 1 1155 . 1 1 98 98 LYS HD2 H 1 1.693 0.030 . 2 . . . . 98 LYS HD2 . 11405 1 1156 . 1 1 98 98 LYS HD3 H 1 1.587 0.030 . 2 . . . . 98 LYS HD3 . 11405 1 1157 . 1 1 98 98 LYS HE2 H 1 2.830 0.030 . 1 . . . . 98 LYS HE2 . 11405 1 1158 . 1 1 98 98 LYS HE3 H 1 2.830 0.030 . 1 . . . . 98 LYS HE3 . 11405 1 1159 . 1 1 98 98 LYS HG2 H 1 1.555 0.030 . 2 . . . . 98 LYS HG2 . 11405 1 1160 . 1 1 98 98 LYS HG3 H 1 1.289 0.030 . 2 . . . . 98 LYS HG3 . 11405 1 1161 . 1 1 98 98 LYS C C 13 174.480 0.300 . 1 . . . . 98 LYS C . 11405 1 1162 . 1 1 98 98 LYS CA C 13 54.929 0.300 . 1 . . . . 98 LYS CA . 11405 1 1163 . 1 1 98 98 LYS CB C 13 35.115 0.300 . 1 . . . . 98 LYS CB . 11405 1 1164 . 1 1 98 98 LYS CD C 13 29.216 0.300 . 1 . . . . 98 LYS CD . 11405 1 1165 . 1 1 98 98 LYS CE C 13 41.945 0.300 . 1 . . . . 98 LYS CE . 11405 1 1166 . 1 1 98 98 LYS CG C 13 24.990 0.300 . 1 . . . . 98 LYS CG . 11405 1 1167 . 1 1 98 98 LYS N N 15 123.488 0.300 . 1 . . . . 98 LYS N . 11405 1 1168 . 1 1 99 99 VAL H H 1 8.770 0.030 . 1 . . . . 99 VAL H . 11405 1 1169 . 1 1 99 99 VAL HA H 1 4.946 0.030 . 1 . . . . 99 VAL HA . 11405 1 1170 . 1 1 99 99 VAL HB H 1 1.873 0.030 . 1 . . . . 99 VAL HB . 11405 1 1171 . 1 1 99 99 VAL HG11 H 1 0.887 0.030 . 1 . . . . 99 VAL HG1 . 11405 1 1172 . 1 1 99 99 VAL HG12 H 1 0.887 0.030 . 1 . . . . 99 VAL HG1 . 11405 1 1173 . 1 1 99 99 VAL HG13 H 1 0.887 0.030 . 1 . . . . 99 VAL HG1 . 11405 1 1174 . 1 1 99 99 VAL HG21 H 1 1.028 0.030 . 1 . . . . 99 VAL HG2 . 11405 1 1175 . 1 1 99 99 VAL HG22 H 1 1.028 0.030 . 1 . . . . 99 VAL HG2 . 11405 1 1176 . 1 1 99 99 VAL HG23 H 1 1.028 0.030 . 1 . . . . 99 VAL HG2 . 11405 1 1177 . 1 1 99 99 VAL C C 13 174.013 0.300 . 1 . . . . 99 VAL C . 11405 1 1178 . 1 1 99 99 VAL CA C 13 61.338 0.300 . 1 . . . . 99 VAL CA . 11405 1 1179 . 1 1 99 99 VAL CB C 13 34.126 0.300 . 1 . . . . 99 VAL CB . 11405 1 1180 . 1 1 99 99 VAL CG1 C 13 23.561 0.300 . 2 . . . . 99 VAL CG1 . 11405 1 1181 . 1 1 99 99 VAL CG2 C 13 21.750 0.300 . 2 . . . . 99 VAL CG2 . 11405 1 1182 . 1 1 99 99 VAL N N 15 126.988 0.300 . 1 . . . . 99 VAL N . 11405 1 1183 . 1 1 100 100 GLN H H 1 9.146 0.030 . 1 . . . . 100 GLN H . 11405 1 1184 . 1 1 100 100 GLN HA H 1 4.854 0.030 . 1 . . . . 100 GLN HA . 11405 1 1185 . 1 1 100 100 GLN HB2 H 1 2.236 0.030 . 2 . . . . 100 GLN HB2 . 11405 1 1186 . 1 1 100 100 GLN HB3 H 1 2.099 0.030 . 2 . . . . 100 GLN HB3 . 11405 1 1187 . 1 1 100 100 GLN HE21 H 1 7.663 0.030 . 2 . . . . 100 GLN HE21 . 11405 1 1188 . 1 1 100 100 GLN HE22 H 1 6.860 0.030 . 2 . . . . 100 GLN HE22 . 11405 1 1189 . 1 1 100 100 GLN HG2 H 1 2.422 0.030 . 2 . . . . 100 GLN HG2 . 11405 1 1190 . 1 1 100 100 GLN HG3 H 1 2.382 0.030 . 2 . . . . 100 GLN HG3 . 11405 1 1191 . 1 1 100 100 GLN C C 13 173.981 0.300 . 1 . . . . 100 GLN C . 11405 1 1192 . 1 1 100 100 GLN CA C 13 53.627 0.300 . 1 . . . . 100 GLN CA . 11405 1 1193 . 1 1 100 100 GLN CB C 13 33.972 0.300 . 1 . . . . 100 GLN CB . 11405 1 1194 . 1 1 100 100 GLN CG C 13 33.717 0.300 . 1 . . . . 100 GLN CG . 11405 1 1195 . 1 1 100 100 GLN N N 15 123.707 0.300 . 1 . . . . 100 GLN N . 11405 1 1196 . 1 1 100 100 GLN NE2 N 15 111.747 0.300 . 1 . . . . 100 GLN NE2 . 11405 1 1197 . 1 1 101 101 LEU H H 1 8.735 0.030 . 1 . . . . 101 LEU H . 11405 1 1198 . 1 1 101 101 LEU HA H 1 4.523 0.030 . 1 . . . . 101 LEU HA . 11405 1 1199 . 1 1 101 101 LEU HB2 H 1 1.594 0.030 . 1 . . . . 101 LEU HB2 . 11405 1 1200 . 1 1 101 101 LEU HB3 H 1 1.594 0.030 . 1 . . . . 101 LEU HB3 . 11405 1 1201 . 1 1 101 101 LEU HD11 H 1 0.929 0.030 . 1 . . . . 101 LEU HD1 . 11405 1 1202 . 1 1 101 101 LEU HD12 H 1 0.929 0.030 . 1 . . . . 101 LEU HD1 . 11405 1 1203 . 1 1 101 101 LEU HD13 H 1 0.929 0.030 . 1 . . . . 101 LEU HD1 . 11405 1 1204 . 1 1 101 101 LEU HD21 H 1 0.834 0.030 . 1 . . . . 101 LEU HD2 . 11405 1 1205 . 1 1 101 101 LEU HD22 H 1 0.834 0.030 . 1 . . . . 101 LEU HD2 . 11405 1 1206 . 1 1 101 101 LEU HD23 H 1 0.834 0.030 . 1 . . . . 101 LEU HD2 . 11405 1 1207 . 1 1 101 101 LEU HG H 1 1.659 0.030 . 1 . . . . 101 LEU HG . 11405 1 1208 . 1 1 101 101 LEU C C 13 177.664 0.300 . 1 . . . . 101 LEU C . 11405 1 1209 . 1 1 101 101 LEU CA C 13 55.610 0.300 . 1 . . . . 101 LEU CA . 11405 1 1210 . 1 1 101 101 LEU CB C 13 42.820 0.300 . 1 . . . . 101 LEU CB . 11405 1 1211 . 1 1 101 101 LEU CD1 C 13 25.330 0.300 . 2 . . . . 101 LEU CD1 . 11405 1 1212 . 1 1 101 101 LEU CD2 C 13 24.142 0.300 . 2 . . . . 101 LEU CD2 . 11405 1 1213 . 1 1 101 101 LEU CG C 13 26.802 0.300 . 1 . . . . 101 LEU CG . 11405 1 1214 . 1 1 101 101 LEU N N 15 123.051 0.300 . 1 . . . . 101 LEU N . 11405 1 1215 . 1 1 102 102 LYS H H 1 8.442 0.030 . 1 . . . . 102 LYS H . 11405 1 1216 . 1 1 102 102 LYS HA H 1 4.304 0.030 . 1 . . . . 102 LYS HA . 11405 1 1217 . 1 1 102 102 LYS HB2 H 1 1.598 0.030 . 2 . . . . 102 LYS HB2 . 11405 1 1218 . 1 1 102 102 LYS HB3 H 1 1.267 0.030 . 2 . . . . 102 LYS HB3 . 11405 1 1219 . 1 1 102 102 LYS HD2 H 1 1.454 0.030 . 2 . . . . 102 LYS HD2 . 11405 1 1220 . 1 1 102 102 LYS HD3 H 1 1.378 0.030 . 2 . . . . 102 LYS HD3 . 11405 1 1221 . 1 1 102 102 LYS HE2 H 1 2.868 0.030 . 1 . . . . 102 LYS HE2 . 11405 1 1222 . 1 1 102 102 LYS HE3 H 1 2.868 0.030 . 1 . . . . 102 LYS HE3 . 11405 1 1223 . 1 1 102 102 LYS HG2 H 1 1.323 0.030 . 1 . . . . 102 LYS HG2 . 11405 1 1224 . 1 1 102 102 LYS HG3 H 1 1.323 0.030 . 1 . . . . 102 LYS HG3 . 11405 1 1225 . 1 1 102 102 LYS C C 13 175.657 0.300 . 1 . . . . 102 LYS C . 11405 1 1226 . 1 1 102 102 LYS CA C 13 56.644 0.300 . 1 . . . . 102 LYS CA . 11405 1 1227 . 1 1 102 102 LYS CB C 13 33.626 0.300 . 1 . . . . 102 LYS CB . 11405 1 1228 . 1 1 102 102 LYS CD C 13 30.001 0.300 . 1 . . . . 102 LYS CD . 11405 1 1229 . 1 1 102 102 LYS CE C 13 41.985 0.300 . 1 . . . . 102 LYS CE . 11405 1 1230 . 1 1 102 102 LYS CG C 13 25.017 0.300 . 1 . . . . 102 LYS CG . 11405 1 1231 . 1 1 102 102 LYS N N 15 124.766 0.300 . 1 . . . . 102 LYS N . 11405 1 1232 . 1 1 103 103 ARG H H 1 8.583 0.030 . 1 . . . . 103 ARG H . 11405 1 1233 . 1 1 103 103 ARG HA H 1 4.453 0.030 . 1 . . . . 103 ARG HA . 11405 1 1234 . 1 1 103 103 ARG HB2 H 1 1.863 0.030 . 2 . . . . 103 ARG HB2 . 11405 1 1235 . 1 1 103 103 ARG HB3 H 1 1.751 0.030 . 2 . . . . 103 ARG HB3 . 11405 1 1236 . 1 1 103 103 ARG HD2 H 1 3.202 0.030 . 1 . . . . 103 ARG HD2 . 11405 1 1237 . 1 1 103 103 ARG HD3 H 1 3.202 0.030 . 1 . . . . 103 ARG HD3 . 11405 1 1238 . 1 1 103 103 ARG HG2 H 1 1.640 0.030 . 1 . . . . 103 ARG HG2 . 11405 1 1239 . 1 1 103 103 ARG HG3 H 1 1.640 0.030 . 1 . . . . 103 ARG HG3 . 11405 1 1240 . 1 1 103 103 ARG C C 13 176.188 0.300 . 1 . . . . 103 ARG C . 11405 1 1241 . 1 1 103 103 ARG CA C 13 55.983 0.300 . 1 . . . . 103 ARG CA . 11405 1 1242 . 1 1 103 103 ARG CB C 13 31.356 0.300 . 1 . . . . 103 ARG CB . 11405 1 1243 . 1 1 103 103 ARG CD C 13 43.468 0.300 . 1 . . . . 103 ARG CD . 11405 1 1244 . 1 1 103 103 ARG CG C 13 27.344 0.300 . 1 . . . . 103 ARG CG . 11405 1 1245 . 1 1 103 103 ARG N N 15 126.315 0.300 . 1 . . . . 103 ARG N . 11405 1 1246 . 1 1 104 104 SER H H 1 8.642 0.030 . 1 . . . . 104 SER H . 11405 1 1247 . 1 1 104 104 SER HA H 1 4.445 0.030 . 1 . . . . 104 SER HA . 11405 1 1248 . 1 1 104 104 SER HB2 H 1 3.877 0.030 . 1 . . . . 104 SER HB2 . 11405 1 1249 . 1 1 104 104 SER HB3 H 1 3.877 0.030 . 1 . . . . 104 SER HB3 . 11405 1 1250 . 1 1 104 104 SER C C 13 176.196 0.300 . 1 . . . . 104 SER C . 11405 1 1251 . 1 1 104 104 SER CA C 13 58.353 0.300 . 1 . . . . 104 SER CA . 11405 1 1252 . 1 1 104 104 SER CB C 13 64.040 0.300 . 1 . . . . 104 SER CB . 11405 1 1253 . 1 1 104 104 SER N N 15 118.571 0.300 . 1 . . . . 104 SER N . 11405 1 1254 . 1 1 105 105 LYS H H 1 9.284 0.030 . 1 . . . . 105 LYS H . 11405 1 1255 . 1 1 105 105 LYS HA H 1 4.285 0.030 . 1 . . . . 105 LYS HA . 11405 1 1256 . 1 1 105 105 LYS HB2 H 1 1.817 0.030 . 2 . . . . 105 LYS HB2 . 11405 1 1257 . 1 1 105 105 LYS HB3 H 1 1.757 0.030 . 2 . . . . 105 LYS HB3 . 11405 1 1258 . 1 1 105 105 LYS HD2 H 1 1.663 0.030 . 1 . . . . 105 LYS HD2 . 11405 1 1259 . 1 1 105 105 LYS HD3 H 1 1.663 0.030 . 1 . . . . 105 LYS HD3 . 11405 1 1260 . 1 1 105 105 LYS HE2 H 1 2.981 0.030 . 1 . . . . 105 LYS HE2 . 11405 1 1261 . 1 1 105 105 LYS HE3 H 1 2.981 0.030 . 1 . . . . 105 LYS HE3 . 11405 1 1262 . 1 1 105 105 LYS HG2 H 1 1.406 0.030 . 1 . . . . 105 LYS HG2 . 11405 1 1263 . 1 1 105 105 LYS HG3 H 1 1.406 0.030 . 1 . . . . 105 LYS HG3 . 11405 1 1264 . 1 1 105 105 LYS C C 13 176.537 0.300 . 1 . . . . 105 LYS C . 11405 1 1265 . 1 1 105 105 LYS CA C 13 56.795 0.300 . 1 . . . . 105 LYS CA . 11405 1 1266 . 1 1 105 105 LYS CB C 13 32.993 0.300 . 1 . . . . 105 LYS CB . 11405 1 1267 . 1 1 105 105 LYS CD C 13 29.172 0.300 . 1 . . . . 105 LYS CD . 11405 1 1268 . 1 1 105 105 LYS CE C 13 42.150 0.300 . 1 . . . . 105 LYS CE . 11405 1 1269 . 1 1 105 105 LYS CG C 13 24.609 0.300 . 1 . . . . 105 LYS CG . 11405 1 1270 . 1 1 105 105 LYS N N 15 125.383 0.300 . 1 . . . . 105 LYS N . 11405 1 1271 . 1 1 106 106 ASN HA H 1 4.690 0.030 . 1 . . . . 106 ASN HA . 11405 1 1272 . 1 1 106 106 ASN HB2 H 1 2.821 0.030 . 2 . . . . 106 ASN HB2 . 11405 1 1273 . 1 1 106 106 ASN HB3 H 1 2.698 0.030 . 2 . . . . 106 ASN HB3 . 11405 1 1274 . 1 1 106 106 ASN HD21 H 1 7.592 0.030 . 2 . . . . 106 ASN HD21 . 11405 1 1275 . 1 1 106 106 ASN HD22 H 1 6.918 0.030 . 2 . . . . 106 ASN HD22 . 11405 1 1276 . 1 1 106 106 ASN C C 13 174.916 0.300 . 1 . . . . 106 ASN C . 11405 1 1277 . 1 1 106 106 ASN CA C 13 53.348 0.300 . 1 . . . . 106 ASN CA . 11405 1 1278 . 1 1 106 106 ASN CB C 13 38.885 0.300 . 1 . . . . 106 ASN CB . 11405 1 1279 . 1 1 106 106 ASN ND2 N 15 113.023 0.300 . 1 . . . . 106 ASN ND2 . 11405 1 1280 . 1 1 107 107 ASP H H 1 8.222 0.030 . 1 . . . . 107 ASP H . 11405 1 1281 . 1 1 107 107 ASP HA H 1 4.609 0.030 . 1 . . . . 107 ASP HA . 11405 1 1282 . 1 1 107 107 ASP HB2 H 1 2.678 0.030 . 1 . . . . 107 ASP HB2 . 11405 1 1283 . 1 1 107 107 ASP HB3 H 1 2.678 0.030 . 1 . . . . 107 ASP HB3 . 11405 1 1284 . 1 1 107 107 ASP C C 13 176.395 0.300 . 1 . . . . 107 ASP C . 11405 1 1285 . 1 1 107 107 ASP CA C 13 54.381 0.300 . 1 . . . . 107 ASP CA . 11405 1 1286 . 1 1 107 107 ASP CB C 13 41.302 0.300 . 1 . . . . 107 ASP CB . 11405 1 1287 . 1 1 107 107 ASP N N 15 121.148 0.300 . 1 . . . . 107 ASP N . 11405 1 1288 . 1 1 108 108 SER H H 1 8.264 0.030 . 1 . . . . 108 SER H . 11405 1 1289 . 1 1 108 108 SER HA H 1 4.381 0.030 . 1 . . . . 108 SER HA . 11405 1 1290 . 1 1 108 108 SER HB2 H 1 3.877 0.030 . 1 . . . . 108 SER HB2 . 11405 1 1291 . 1 1 108 108 SER HB3 H 1 3.877 0.030 . 1 . . . . 108 SER HB3 . 11405 1 1292 . 1 1 108 108 SER C C 13 174.810 0.300 . 1 . . . . 108 SER C . 11405 1 1293 . 1 1 108 108 SER CA C 13 58.807 0.300 . 1 . . . . 108 SER CA . 11405 1 1294 . 1 1 108 108 SER CB C 13 63.674 0.300 . 1 . . . . 108 SER CB . 11405 1 1295 . 1 1 108 108 SER N N 15 116.293 0.300 . 1 . . . . 108 SER N . 11405 1 1296 . 1 1 109 109 LYS H H 1 8.347 0.030 . 1 . . . . 109 LYS H . 11405 1 1297 . 1 1 109 109 LYS HA H 1 4.360 0.030 . 1 . . . . 109 LYS HA . 11405 1 1298 . 1 1 109 109 LYS HB2 H 1 1.874 0.030 . 2 . . . . 109 LYS HB2 . 11405 1 1299 . 1 1 109 109 LYS HB3 H 1 1.773 0.030 . 2 . . . . 109 LYS HB3 . 11405 1 1300 . 1 1 109 109 LYS HD2 H 1 1.663 0.030 . 1 . . . . 109 LYS HD2 . 11405 1 1301 . 1 1 109 109 LYS HD3 H 1 1.663 0.030 . 1 . . . . 109 LYS HD3 . 11405 1 1302 . 1 1 109 109 LYS HE2 H 1 2.980 0.030 . 1 . . . . 109 LYS HE2 . 11405 1 1303 . 1 1 109 109 LYS HE3 H 1 2.980 0.030 . 1 . . . . 109 LYS HE3 . 11405 1 1304 . 1 1 109 109 LYS HG2 H 1 1.442 0.030 . 2 . . . . 109 LYS HG2 . 11405 1 1305 . 1 1 109 109 LYS HG3 H 1 1.402 0.030 . 2 . . . . 109 LYS HG3 . 11405 1 1306 . 1 1 109 109 LYS C C 13 176.699 0.300 . 1 . . . . 109 LYS C . 11405 1 1307 . 1 1 109 109 LYS CA C 13 56.483 0.300 . 1 . . . . 109 LYS CA . 11405 1 1308 . 1 1 109 109 LYS CB C 13 32.736 0.300 . 1 . . . . 109 LYS CB . 11405 1 1309 . 1 1 109 109 LYS CD C 13 29.074 0.300 . 1 . . . . 109 LYS CD . 11405 1 1310 . 1 1 109 109 LYS CE C 13 42.041 0.300 . 1 . . . . 109 LYS CE . 11405 1 1311 . 1 1 109 109 LYS CG C 13 24.731 0.300 . 1 . . . . 109 LYS CG . 11405 1 1312 . 1 1 109 109 LYS N N 15 122.789 0.300 . 1 . . . . 109 LYS N . 11405 1 1313 . 1 1 110 110 SER H H 1 8.222 0.030 . 1 . . . . 110 SER H . 11405 1 1314 . 1 1 110 110 SER HA H 1 4.454 0.030 . 1 . . . . 110 SER HA . 11405 1 1315 . 1 1 110 110 SER HB2 H 1 3.757 0.030 . 1 . . . . 110 SER HB2 . 11405 1 1316 . 1 1 110 110 SER HB3 H 1 3.757 0.030 . 1 . . . . 110 SER HB3 . 11405 1 1317 . 1 1 110 110 SER C C 13 174.477 0.300 . 1 . . . . 110 SER C . 11405 1 1318 . 1 1 110 110 SER CA C 13 58.392 0.300 . 1 . . . . 110 SER CA . 11405 1 1319 . 1 1 110 110 SER CB C 13 64.250 0.300 . 1 . . . . 110 SER CB . 11405 1 1320 . 1 1 110 110 SER N N 15 116.352 0.300 . 1 . . . . 110 SER N . 11405 1 1321 . 1 1 111 111 GLY H H 1 8.179 0.030 . 1 . . . . 111 GLY H . 11405 1 1322 . 1 1 111 111 GLY HA2 H 1 4.097 0.030 . 1 . . . . 111 GLY HA2 . 11405 1 1323 . 1 1 111 111 GLY HA3 H 1 4.097 0.030 . 1 . . . . 111 GLY HA3 . 11405 1 1324 . 1 1 111 111 GLY C C 13 171.783 0.300 . 1 . . . . 111 GLY C . 11405 1 1325 . 1 1 111 111 GLY CA C 13 44.686 0.300 . 1 . . . . 111 GLY CA . 11405 1 1326 . 1 1 111 111 GLY N N 15 110.596 0.300 . 1 . . . . 111 GLY N . 11405 1 1327 . 1 1 112 112 PRO HA H 1 4.447 0.030 . 1 . . . . 112 PRO HA . 11405 1 1328 . 1 1 112 112 PRO HB2 H 1 2.253 0.030 . 2 . . . . 112 PRO HB2 . 11405 1 1329 . 1 1 112 112 PRO HB3 H 1 1.951 0.030 . 2 . . . . 112 PRO HB3 . 11405 1 1330 . 1 1 112 112 PRO HD2 H 1 3.606 0.030 . 2 . . . . 112 PRO HD2 . 11405 1 1331 . 1 1 112 112 PRO HD3 H 1 3.574 0.030 . 2 . . . . 112 PRO HD3 . 11405 1 1332 . 1 1 112 112 PRO HG2 H 1 1.978 0.030 . 1 . . . . 112 PRO HG2 . 11405 1 1333 . 1 1 112 112 PRO HG3 H 1 1.978 0.030 . 1 . . . . 112 PRO HG3 . 11405 1 1334 . 1 1 112 112 PRO CA C 13 63.297 0.300 . 1 . . . . 112 PRO CA . 11405 1 1335 . 1 1 112 112 PRO CB C 13 32.197 0.300 . 1 . . . . 112 PRO CB . 11405 1 1336 . 1 1 112 112 PRO CD C 13 49.778 0.300 . 1 . . . . 112 PRO CD . 11405 1 1337 . 1 1 112 112 PRO CG C 13 27.106 0.300 . 1 . . . . 112 PRO CG . 11405 1 stop_ save_