data_18534 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18534 _Entry.Title ; RDC REFINED SOLUTION STRUCTURE OF DOUBLE-STRANDED RNA BINDING DOMAIN OF S. CEREVISIAE RNASE III (RNT1P) IN COMPLEX WITH THE TERMINAL RNA HAIRPIN OF SNR47 PRECURSOR ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-06-19 _Entry.Accession_date 2012-06-19 _Entry.Last_release_date 2013-02-20 _Entry.Original_release_date 2013-02-20 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Zhonghua Wang . . . 18534 2 Juli Feigon . . . 18534 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 18534 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'double strand rna binding' . 18534 DSRBD . 18534 RNT1P . 18534 SNR47 . 18534 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18534 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 487 18534 '15N chemical shifts' 90 18534 '1H chemical shifts' 740 18534 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 . . 2013-02-20 2012-06-19 original author . 18534 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 18535 'Double Stranded RNA binding domain of Ribonuclease III (Rnt1p) apo form' 18534 PDB 2LUP 'BMRB Entry Tracking System' 18534 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18534 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21742266 _Citation.Full_citation . _Citation.Title 'Structure of a yeast RNase III dsRBD complex with a noncanonical RNA substrate provides new insights into binding specificity of dsRBDs.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full 'Structure (London, England : 1993)' _Citation.Journal_volume 19 _Citation.Journal_issue 7 _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 999 _Citation.Page_last 1010 _Citation.Year 2011 _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 Zhonghua Wang . . . 18534 1 2 Elon Hartman . . . 18534 1 3 Kevin Roy . . . 18534 1 4 Guillaume Chanfreau . . . 18534 1 5 Juli Feigon . . . 18534 1 stop_ save_ save_reference _Citation.Sf_category citations _Citation.Sf_framecode reference _Citation.Entry_ID 18534 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'STRUCTURE OF A YEAST RNASE III DSRBD COMPLEX WITH A NONCANONICAL RNA SUBSTRATE PROVIDES NEW INSIGHTS INTO BINDING SPECIFICITY OF DSRBDS.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full . _Citation.Journal_volume 19 _Citation.Journal_issue 7 _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 999 _Citation.Page_last 1010 _Citation.Year 2011 _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 Zhonghua Wang . . . 18534 2 2 Elon Hartman . . . 18534 2 3 Kevin Roy . . . 18534 2 4 Guillaume Chanfreau . . . 18534 2 5 Juli Feigon . . . 18534 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18534 _Assembly.ID 1 _Assembly.Name 'Ribonuclease III in complex with RNA (32-MER)' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Ribonuclease III' 1 $Ribonuc_III A . yes native no no . . . 18534 1 2 'RNA (32-MER)' 2 $RNA B . yes native no no . . . 18534 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Ribonuc_III _Entity.Sf_category entity _Entity.Sf_framecode Ribonuc_III _Entity.Entry_ID 18534 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Ribonuclease III' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSLDMNAKRQLYSLIGYASL RLHYVTVKKPTAVDPNSIVE CRVGDGTVLGTGVGRNIKIA GIRAAENALRDKKMLDFYAK QRAAIPRSES ; _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 90 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 9822.442 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes PDB 1T4L . . . . . . . . . . . . . . . . 18534 1 2 no BMRB 17574 . "yeast RNase III dsRBD" . . . . . 100.00 90 100.00 100.00 1.54e-57 . . . . 18534 1 3 no BMRB 18535 . "Ribonuclease III" . . . . . 100.00 90 100.00 100.00 1.54e-57 . . . . 18534 1 4 no PDB 1T4L . "Solution Structure Of Double-Stranded Rna Binding Domain Of S. Cerevisiae Rnase Iii (Rnt1p) In Complex With The 5' Terminal Rna" . . . . . 100.00 90 100.00 100.00 1.54e-57 . . . . 18534 1 5 no PDB 1T4N . "Solution Structure Of Rnt1p Dsrbd" . . . . . 91.11 94 100.00 100.00 1.76e-51 . . . . 18534 1 6 no PDB 1T4O . "Crystal Structure Of Rnt1p Dsrbd" . . . . . 97.78 117 100.00 100.00 1.72e-56 . . . . 18534 1 7 no PDB 2LBS . "Solution Structure Of Double-Stranded Rna Binding Domain Of S. Cerevisiae Rnase Iii (Rnt1p) In Complex With Aagu Tetraloop Hair" . . . . . 100.00 90 100.00 100.00 1.54e-57 . . . . 18534 1 8 no PDB 2LUP . "Rdc Refined Solution Structure Of Double-Stranded Rna Binding Domain Of S. Cerevisiae Rnase Iii (Rnt1p) In Complex With The Ter" . . . . . 100.00 90 100.00 100.00 1.54e-57 . . . . 18534 1 9 no PDB 2LUQ . "Solution Structure Of Double-stranded Rna Binding Domain Of S.cerevisiae Rnase Iii (rnt1p)" . . . . . 100.00 90 100.00 100.00 1.54e-57 . . . . 18534 1 10 no PDB 4OOG . "Crystal Structure Of Yeast Rnase Iii (rnt1p) Complexed With The Product Of Dsrna Processing" . . . . . 97.78 261 100.00 100.00 1.34e-54 . . . . 18534 1 11 no DBJ GAA25690 . "K7_Rnt1p [Saccharomyces cerevisiae Kyokai no. 7]" . . . . . 97.78 471 100.00 100.00 8.02e-51 . . . . 18534 1 12 no EMBL CAA90210 . "unknown [Saccharomyces cerevisiae]" . . . . . 97.78 362 100.00 100.00 5.24e-52 . . . . 18534 1 13 no EMBL CAY82070 . "Rnt1p [Saccharomyces cerevisiae EC1118]" . . . . . 97.78 471 98.86 98.86 3.86e-50 . . . . 18534 1 14 no GB AAB04172 . "Rnt1p [Saccharomyces cerevisiae]" . . . . . 97.78 471 100.00 100.00 8.02e-51 . . . . 18534 1 15 no GB AHY76694 . "Rnt1p [Saccharomyces cerevisiae YJM993]" . . . . . 97.78 471 100.00 100.00 8.02e-51 . . . . 18534 1 16 no GB AJP40933 . "Rnt1p [Saccharomyces cerevisiae YJM1078]" . . . . . 97.78 471 100.00 100.00 9.79e-51 . . . . 18534 1 17 no GB AJS62105 . "Rnt1p [Saccharomyces cerevisiae YJM189]" . . . . . 97.78 471 100.00 100.00 8.02e-51 . . . . 18534 1 18 no GB AJS62540 . "Rnt1p [Saccharomyces cerevisiae YJM193]" . . . . . 97.78 471 100.00 100.00 8.02e-51 . . . . 18534 1 19 no REF NP_013966 . "Rnt1p [Saccharomyces cerevisiae S288c]" . . . . . 97.78 471 100.00 100.00 8.02e-51 . . . . 18534 1 20 no SP Q02555 . "RecName: Full=Ribonuclease 3; AltName: Full=Ribonuclease III; Short=RNase III" . . . . . 97.78 471 100.00 100.00 8.02e-51 . . . . 18534 1 21 no TPG DAA10139 . "TPA: Rnt1p [Saccharomyces cerevisiae S288c]" . . . . . 97.78 471 100.00 100.00 8.02e-51 . . . . 18534 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 1 364 GLY . 18534 1 2 365 SER . 18534 1 3 366 LEU . 18534 1 4 367 ASP . 18534 1 5 368 MET . 18534 1 6 369 ASN . 18534 1 7 370 ALA . 18534 1 8 371 LYS . 18534 1 9 372 ARG . 18534 1 10 373 GLN . 18534 1 11 374 LEU . 18534 1 12 375 TYR . 18534 1 13 376 SER . 18534 1 14 377 LEU . 18534 1 15 378 ILE . 18534 1 16 379 GLY . 18534 1 17 380 TYR . 18534 1 18 381 ALA . 18534 1 19 382 SER . 18534 1 20 383 LEU . 18534 1 21 384 ARG . 18534 1 22 385 LEU . 18534 1 23 386 HIS . 18534 1 24 387 TYR . 18534 1 25 388 VAL . 18534 1 26 389 THR . 18534 1 27 390 VAL . 18534 1 28 391 LYS . 18534 1 29 392 LYS . 18534 1 30 393 PRO . 18534 1 31 394 THR . 18534 1 32 395 ALA . 18534 1 33 396 VAL . 18534 1 34 397 ASP . 18534 1 35 398 PRO . 18534 1 36 399 ASN . 18534 1 37 400 SER . 18534 1 38 401 ILE . 18534 1 39 402 VAL . 18534 1 40 403 GLU . 18534 1 41 404 CYS . 18534 1 42 405 ARG . 18534 1 43 406 VAL . 18534 1 44 407 GLY . 18534 1 45 408 ASP . 18534 1 46 409 GLY . 18534 1 47 410 THR . 18534 1 48 411 VAL . 18534 1 49 412 LEU . 18534 1 50 413 GLY . 18534 1 51 414 THR . 18534 1 52 415 GLY . 18534 1 53 416 VAL . 18534 1 54 417 GLY . 18534 1 55 418 ARG . 18534 1 56 419 ASN . 18534 1 57 420 ILE . 18534 1 58 421 LYS . 18534 1 59 422 ILE . 18534 1 60 423 ALA . 18534 1 61 424 GLY . 18534 1 62 425 ILE . 18534 1 63 426 ARG . 18534 1 64 427 ALA . 18534 1 65 428 ALA . 18534 1 66 429 GLU . 18534 1 67 430 ASN . 18534 1 68 431 ALA . 18534 1 69 432 LEU . 18534 1 70 433 ARG . 18534 1 71 434 ASP . 18534 1 72 435 LYS . 18534 1 73 436 LYS . 18534 1 74 437 MET . 18534 1 75 438 LEU . 18534 1 76 439 ASP . 18534 1 77 440 PHE . 18534 1 78 441 TYR . 18534 1 79 442 ALA . 18534 1 80 443 LYS . 18534 1 81 444 GLN . 18534 1 82 445 ARG . 18534 1 83 446 ALA . 18534 1 84 447 ALA . 18534 1 85 448 ILE . 18534 1 86 449 PRO . 18534 1 87 450 ARG . 18534 1 88 451 SER . 18534 1 89 452 GLU . 18534 1 90 453 SER . 18534 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 18534 1 . SER 2 2 18534 1 . LEU 3 3 18534 1 . ASP 4 4 18534 1 . MET 5 5 18534 1 . ASN 6 6 18534 1 . ALA 7 7 18534 1 . LYS 8 8 18534 1 . ARG 9 9 18534 1 . GLN 10 10 18534 1 . LEU 11 11 18534 1 . TYR 12 12 18534 1 . SER 13 13 18534 1 . LEU 14 14 18534 1 . ILE 15 15 18534 1 . GLY 16 16 18534 1 . TYR 17 17 18534 1 . ALA 18 18 18534 1 . SER 19 19 18534 1 . LEU 20 20 18534 1 . ARG 21 21 18534 1 . LEU 22 22 18534 1 . HIS 23 23 18534 1 . TYR 24 24 18534 1 . VAL 25 25 18534 1 . THR 26 26 18534 1 . VAL 27 27 18534 1 . LYS 28 28 18534 1 . LYS 29 29 18534 1 . PRO 30 30 18534 1 . THR 31 31 18534 1 . ALA 32 32 18534 1 . VAL 33 33 18534 1 . ASP 34 34 18534 1 . PRO 35 35 18534 1 . ASN 36 36 18534 1 . SER 37 37 18534 1 . ILE 38 38 18534 1 . VAL 39 39 18534 1 . GLU 40 40 18534 1 . CYS 41 41 18534 1 . ARG 42 42 18534 1 . VAL 43 43 18534 1 . GLY 44 44 18534 1 . ASP 45 45 18534 1 . GLY 46 46 18534 1 . THR 47 47 18534 1 . VAL 48 48 18534 1 . LEU 49 49 18534 1 . GLY 50 50 18534 1 . THR 51 51 18534 1 . GLY 52 52 18534 1 . VAL 53 53 18534 1 . GLY 54 54 18534 1 . ARG 55 55 18534 1 . ASN 56 56 18534 1 . ILE 57 57 18534 1 . LYS 58 58 18534 1 . ILE 59 59 18534 1 . ALA 60 60 18534 1 . GLY 61 61 18534 1 . ILE 62 62 18534 1 . ARG 63 63 18534 1 . ALA 64 64 18534 1 . ALA 65 65 18534 1 . GLU 66 66 18534 1 . ASN 67 67 18534 1 . ALA 68 68 18534 1 . LEU 69 69 18534 1 . ARG 70 70 18534 1 . ASP 71 71 18534 1 . LYS 72 72 18534 1 . LYS 73 73 18534 1 . MET 74 74 18534 1 . LEU 75 75 18534 1 . ASP 76 76 18534 1 . PHE 77 77 18534 1 . TYR 78 78 18534 1 . ALA 79 79 18534 1 . LYS 80 80 18534 1 . GLN 81 81 18534 1 . ARG 82 82 18534 1 . ALA 83 83 18534 1 . ALA 84 84 18534 1 . ILE 85 85 18534 1 . PRO 86 86 18534 1 . ARG 87 87 18534 1 . SER 88 88 18534 1 . GLU 89 89 18534 1 . SER 90 90 18534 1 stop_ save_ save_RNA _Entity.Sf_category entity _Entity.Sf_framecode RNA _Entity.Entry_ID 18534 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name 'RNA (32-MER)' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GGGAUACCAUGUUCAGAAGA ACGUGGUAUCUC ; _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 32 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 9822.442 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . G . 18534 2 2 . G . 18534 2 3 . G . 18534 2 4 . A . 18534 2 5 . U . 18534 2 6 . A . 18534 2 7 . C . 18534 2 8 . C . 18534 2 9 . A . 18534 2 10 . U . 18534 2 11 . G . 18534 2 12 . U . 18534 2 13 . U . 18534 2 14 . C . 18534 2 15 . A . 18534 2 16 . G . 18534 2 17 . A . 18534 2 18 . A . 18534 2 19 . G . 18534 2 20 . A . 18534 2 21 . A . 18534 2 22 . C . 18534 2 23 . G . 18534 2 24 . U . 18534 2 25 . G . 18534 2 26 . G . 18534 2 27 . U . 18534 2 28 . A . 18534 2 29 . U . 18534 2 30 . C . 18534 2 31 . U . 18534 2 32 . C . 18534 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . G 1 1 18534 2 . G 2 2 18534 2 . G 3 3 18534 2 . A 4 4 18534 2 . U 5 5 18534 2 . A 6 6 18534 2 . C 7 7 18534 2 . C 8 8 18534 2 . A 9 9 18534 2 . U 10 10 18534 2 . G 11 11 18534 2 . U 12 12 18534 2 . U 13 13 18534 2 . C 14 14 18534 2 . A 15 15 18534 2 . G 16 16 18534 2 . A 17 17 18534 2 . A 18 18 18534 2 . G 19 19 18534 2 . A 20 20 18534 2 . A 21 21 18534 2 . C 22 22 18534 2 . G 23 23 18534 2 . U 24 24 18534 2 . G 25 25 18534 2 . G 26 26 18534 2 . U 27 27 18534 2 . A 28 28 18534 2 . U 29 29 18534 2 . C 30 30 18534 2 . U 31 31 18534 2 . C 32 32 18534 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 18534 _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 $Ribonuc_III . 4932 organism . 'Saccharomyces cerevisiae' 'baker's yeast' . . Eukaryota Fungi Saccharomyces cerevisiae YM9408.01C,YM9959.21 YMR239C . . . . . . . . . . . . . . RNT1 . . . . 18534 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 18534 _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 $Ribonuc_III . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 . . . . . . . . . . . . . . . PGEX-2T . . . . . . 18534 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18534 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '20 mM phosphate, Ph6.5, 150mM NaCl' _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 'Ribonuclease III' '[U-100% 13C; U-100% 15N]' . . 1 $Ribonuc_III . . 1 . . mM . . . . 18534 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18534 1 3 D2O '[U-100% 2H]' . . . . . . 10 . . % . . . . 18534 1 4 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 18534 1 5 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 18534 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 18534 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '20 mM phosphate, Ph6.5, 150mM NaCl' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Ribonuclease III' '[U-100% 13C; U-100% 15N]' . . 1 $Ribonuc_III . . 1 . . mM . . . . 18534 2 2 D2O '[U-100% 2H]' . . . . . . 100 . . % . . . . 18534 2 3 'sodium chloride' 'natural abundance' . . . . . . 10 . . mM . . . . 18534 2 4 'sodium phosphate' 'natural abundance' . . . . . . 150 . . mM . . . . 18534 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 18534 _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' 150 . mM 18534 1 pH 6.5 . pH 18534 1 pressure 1 . atm 18534 1 temperature 298 . K 18534 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 18534 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 18534 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 18534 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 18534 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 18534 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 18534 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 18534 _Software.ID 3 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 18534 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18534 3 'data analysis' 18534 3 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 18534 _Software.ID 4 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 18534 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 18534 4 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 18534 _Software.ID 5 _Software.Name 'X-PLOR NIH' _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 18534 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 18534 5 'structure solution' 18534 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 18534 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18534 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 18534 _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 DRX . 500 . . . 18534 1 2 spectrometer_2 Bruker DRX . 600 . . . 18534 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 18534 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18534 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18534 1 3 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18534 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18534 1 5 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18534 1 6 '3D HCCH-COSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18534 1 7 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18534 1 8 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18534 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 18534 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 18534 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18534 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18534 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 18534 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.3 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 18534 1 2 '3D HNCACB' . . . 18534 1 3 '3D HBHA(CO)NH' . . . 18534 1 5 '3D HCCH-TOCSY' . . . 18534 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.817 0.02 . 2 . . . B 364 GLY HA2 . 18534 1 2 . 1 1 1 1 GLY HA3 H 1 3.661 0.02 . 2 . . . B 364 GLY HA3 . 18534 1 3 . 1 1 2 2 SER HA H 1 4.000 0.02 . 1 . . . B 365 SER HA . 18534 1 4 . 1 1 2 2 SER HB2 H 1 4.160 0.02 . 2 . . . B 365 SER HB2 . 18534 1 5 . 1 1 2 2 SER CA C 13 56.260 0.3 . 1 . . . B 365 SER CA . 18534 1 6 . 1 1 2 2 SER CB C 13 61.470 0.3 . 1 . . . B 365 SER CB . 18534 1 7 . 1 1 3 3 LEU H H 1 8.263 0.02 . 1 . . . B 366 LEU H . 18534 1 8 . 1 1 3 3 LEU HA H 1 4.332 0.02 . 1 . . . B 366 LEU HA . 18534 1 9 . 1 1 3 3 LEU HB2 H 1 1.499 0.02 . 2 . . . B 366 LEU HB2 . 18534 1 10 . 1 1 3 3 LEU HG H 1 1.474 0.02 . 1 . . . B 366 LEU HG . 18534 1 11 . 1 1 3 3 LEU HD11 H 1 .782 0.02 . 2 . . . B 366 LEU HD11 . 18534 1 12 . 1 1 3 3 LEU HD12 H 1 .782 0.02 . 2 . . . B 366 LEU HD12 . 18534 1 13 . 1 1 3 3 LEU HD13 H 1 .782 0.02 . 2 . . . B 366 LEU HD13 . 18534 1 14 . 1 1 3 3 LEU HD21 H 1 .810 0.02 . 2 . . . B 366 LEU HD21 . 18534 1 15 . 1 1 3 3 LEU HD22 H 1 .810 0.02 . 2 . . . B 366 LEU HD22 . 18534 1 16 . 1 1 3 3 LEU HD23 H 1 .810 0.02 . 2 . . . B 366 LEU HD23 . 18534 1 17 . 1 1 3 3 LEU CA C 13 52.800 0.3 . 1 . . . B 366 LEU CA . 18534 1 18 . 1 1 3 3 LEU CB C 13 40.360 0.3 . 1 . . . B 366 LEU CB . 18534 1 19 . 1 1 3 3 LEU CG C 13 24.630 0.3 . 1 . . . B 366 LEU CG . 18534 1 20 . 1 1 3 3 LEU CD1 C 13 22.040 0.3 . 1 . . . B 366 LEU CD1 . 18534 1 21 . 1 1 3 3 LEU CD2 C 13 22.500 0.3 . 1 . . . B 366 LEU CD2 . 18534 1 22 . 1 1 3 3 LEU N N 15 123.510 0.3 . 1 . . . B 366 LEU N . 18534 1 23 . 1 1 4 4 ASP H H 1 8.366 0.02 . 1 . . . B 367 ASP H . 18534 1 24 . 1 1 4 4 ASP HA H 1 4.503 0.02 . 1 . . . B 367 ASP HA . 18534 1 25 . 1 1 4 4 ASP HB2 H 1 2.507 0.02 . 2 . . . B 367 ASP HB2 . 18534 1 26 . 1 1 4 4 ASP HB3 H 1 2.762 0.02 . 2 . . . B 367 ASP HB3 . 18534 1 27 . 1 1 4 4 ASP CA C 13 51.100 0.3 . 1 . . . B 367 ASP CA . 18534 1 28 . 1 1 4 4 ASP CB C 13 38.100 0.3 . 1 . . . B 367 ASP CB . 18534 1 29 . 1 1 4 4 ASP N N 15 121.910 0.3 . 1 . . . B 367 ASP N . 18534 1 30 . 1 1 5 5 MET H H 1 8.165 0.02 . 1 . . . B 368 MET H . 18534 1 31 . 1 1 5 5 MET HA H 1 4.390 0.02 . 1 . . . B 368 MET HA . 18534 1 32 . 1 1 5 5 MET HB2 H 1 2.438 0.02 . 2 . . . B 368 MET HB2 . 18534 1 33 . 1 1 5 5 MET HB3 H 1 2.595 0.02 . 2 . . . B 368 MET HB3 . 18534 1 34 . 1 1 5 5 MET HG2 H 1 1.997 0.02 . 2 . . . B 368 MET HG2 . 18534 1 35 . 1 1 5 5 MET HG3 H 1 1.894 0.02 . 2 . . . B 368 MET HG3 . 18534 1 36 . 1 1 5 5 MET HE1 H 1 1.949 0.02 . 1 . . . B 368 MET HE1 . 18534 1 37 . 1 1 5 5 MET HE2 H 1 1.949 0.02 . 1 . . . B 368 MET HE2 . 18534 1 38 . 1 1 5 5 MET HE3 H 1 1.949 0.02 . 1 . . . B 368 MET HE3 . 18534 1 39 . 1 1 5 5 MET CA C 13 52.810 0.3 . 1 . . . B 368 MET CA . 18534 1 40 . 1 1 5 5 MET CB C 13 29.600 0.3 . 1 . . . B 368 MET CB . 18534 1 41 . 1 1 5 5 MET CG C 13 29.300 0.3 . 1 . . . B 368 MET CG . 18534 1 42 . 1 1 5 5 MET CE C 13 14.070 0.3 . 1 . . . B 368 MET CE . 18534 1 43 . 1 1 5 5 MET N N 15 120.640 0.3 . 1 . . . B 368 MET N . 18534 1 44 . 1 1 6 6 ASN H H 1 8.252 0.02 . 1 . . . B 369 ASN H . 18534 1 45 . 1 1 6 6 ASN HA H 1 4.768 0.02 . 1 . . . B 369 ASN HA . 18534 1 46 . 1 1 6 6 ASN HB2 H 1 2.760 0.02 . 2 . . . B 369 ASN HB2 . 18534 1 47 . 1 1 6 6 ASN HB3 H 1 2.902 0.02 . 2 . . . B 369 ASN HB3 . 18534 1 48 . 1 1 6 6 ASN HD21 H 1 6.925 0.02 . 2 . . . B 369 ASN HD21 . 18534 1 49 . 1 1 6 6 ASN HD22 H 1 7.776 0.02 . 2 . . . B 369 ASN HD22 . 18534 1 50 . 1 1 6 6 ASN CA C 13 50.400 0.3 . 1 . . . B 369 ASN CA . 18534 1 51 . 1 1 6 6 ASN CB C 13 36.880 0.3 . 1 . . . B 369 ASN CB . 18534 1 52 . 1 1 6 6 ASN N N 15 118.460 0.3 . 1 . . . B 369 ASN N . 18534 1 53 . 1 1 6 6 ASN ND2 N 15 114.020 0.3 . 1 . . . B 369 ASN ND2 . 18534 1 54 . 1 1 7 7 ALA H H 1 8.245 0.02 . 1 . . . B 370 ALA H . 18534 1 55 . 1 1 7 7 ALA HA H 1 3.915 0.02 . 1 . . . B 370 ALA HA . 18534 1 56 . 1 1 7 7 ALA HB1 H 1 1.425 0.02 . 1 . . . B 370 ALA HB1 . 18534 1 57 . 1 1 7 7 ALA HB2 H 1 1.425 0.02 . 1 . . . B 370 ALA HB2 . 18534 1 58 . 1 1 7 7 ALA HB3 H 1 1.425 0.02 . 1 . . . B 370 ALA HB3 . 18534 1 59 . 1 1 7 7 ALA CA C 13 53.750 0.3 . 1 . . . B 370 ALA CA . 18534 1 60 . 1 1 7 7 ALA CB C 13 17.660 0.3 . 1 . . . B 370 ALA CB . 18534 1 61 . 1 1 7 7 ALA N N 15 122.570 0.3 . 1 . . . B 370 ALA N . 18534 1 62 . 1 1 8 8 LYS H H 1 7.908 0.02 . 1 . . . B 371 LYS H . 18534 1 63 . 1 1 8 8 LYS HA H 1 4.660 0.02 . 1 . . . B 371 LYS HA . 18534 1 64 . 1 1 8 8 LYS HB2 H 1 1.718 0.02 . 2 . . . B 371 LYS HB2 . 18534 1 65 . 1 1 8 8 LYS HG2 H 1 1.894 0.02 . 2 . . . B 371 LYS HG2 . 18534 1 66 . 1 1 8 8 LYS HD2 H 1 1.635 0.02 . 2 . . . B 371 LYS HD2 . 18534 1 67 . 1 1 8 8 LYS HE2 H 1 3.196 0.02 . 2 . . . B 371 LYS HE2 . 18534 1 68 . 1 1 8 8 LYS CA C 13 57.740 0.3 . 1 . . . B 371 LYS CA . 18534 1 69 . 1 1 8 8 LYS CB C 13 29.410 0.3 . 1 . . . B 371 LYS CB . 18534 1 70 . 1 1 8 8 LYS N N 15 113.590 0.3 . 1 . . . B 371 LYS N . 18534 1 71 . 1 1 9 9 ARG H H 1 7.797 0.02 . 1 . . . B 372 ARG H . 18534 1 72 . 1 1 9 9 ARG HA H 1 4.092 0.02 . 1 . . . B 372 ARG HA . 18534 1 73 . 1 1 9 9 ARG HB2 H 1 1.905 0.02 . 2 . . . B 372 ARG HB2 . 18534 1 74 . 1 1 9 9 ARG HB3 H 1 1.667 0.02 . 2 . . . B 372 ARG HB3 . 18534 1 75 . 1 1 9 9 ARG HG2 H 1 1.525 0.02 . 2 . . . B 372 ARG HG2 . 18534 1 76 . 1 1 9 9 ARG HD2 H 1 3.036 0.02 . 2 . . . B 372 ARG HD2 . 18534 1 77 . 1 1 9 9 ARG CA C 13 56.410 0.3 . 1 . . . B 372 ARG CA . 18534 1 78 . 1 1 9 9 ARG CB C 13 27.350 0.3 . 1 . . . B 372 ARG CB . 18534 1 79 . 1 1 9 9 ARG CG C 13 24.630 0.3 . 1 . . . B 372 ARG CG . 18534 1 80 . 1 1 9 9 ARG CD C 13 41.080 0.3 . 1 . . . B 372 ARG CD . 18534 1 81 . 1 1 9 9 ARG N N 15 120.930 0.3 . 1 . . . B 372 ARG N . 18534 1 82 . 1 1 10 10 GLN H H 1 8.479 0.02 . 1 . . . B 373 GLN H . 18534 1 83 . 1 1 10 10 GLN HA H 1 4.007 0.02 . 1 . . . B 373 GLN HA . 18534 1 84 . 1 1 10 10 GLN HB2 H 1 1.960 0.02 . 2 . . . B 373 GLN HB2 . 18534 1 85 . 1 1 10 10 GLN HB3 H 1 2.061 0.02 . 2 . . . B 373 GLN HB3 . 18534 1 86 . 1 1 10 10 GLN HG2 H 1 2.257 0.02 . 2 . . . B 373 GLN HG2 . 18534 1 87 . 1 1 10 10 GLN HE21 H 1 6.783 0.02 . 2 . . . B 373 GLN HE21 . 18534 1 88 . 1 1 10 10 GLN HE22 H 1 7.051 0.02 . 2 . . . B 373 GLN HE22 . 18534 1 89 . 1 1 10 10 GLN CA C 13 56.280 0.3 . 1 . . . B 373 GLN CA . 18534 1 90 . 1 1 10 10 GLN CB C 13 25.930 0.3 . 1 . . . B 373 GLN CB . 18534 1 91 . 1 1 10 10 GLN CG C 13 30.930 0.3 . 1 . . . B 373 GLN CG . 18534 1 92 . 1 1 10 10 GLN N N 15 120.690 0.3 . 1 . . . B 373 GLN N . 18534 1 93 . 1 1 10 10 GLN NE2 N 15 109.820 0.3 . 1 . . . B 373 GLN NE2 . 18534 1 94 . 1 1 11 11 LEU H H 1 8.310 0.02 . 1 . . . B 374 LEU H . 18534 1 95 . 1 1 11 11 LEU HA H 1 4.002 0.02 . 1 . . . B 374 LEU HA . 18534 1 96 . 1 1 11 11 LEU HB2 H 1 1.393 0.02 . 2 . . . B 374 LEU HB2 . 18534 1 97 . 1 1 11 11 LEU HB3 H 1 1.913 0.02 . 2 . . . B 374 LEU HB3 . 18534 1 98 . 1 1 11 11 LEU HG H 1 1.936 0.02 . 1 . . . B 374 LEU HG . 18534 1 99 . 1 1 11 11 LEU HD11 H 1 .727 0.02 . 2 . . . B 374 LEU HD11 . 18534 1 100 . 1 1 11 11 LEU HD12 H 1 .727 0.02 . 2 . . . B 374 LEU HD12 . 18534 1 101 . 1 1 11 11 LEU HD13 H 1 .727 0.02 . 2 . . . B 374 LEU HD13 . 18534 1 102 . 1 1 11 11 LEU HD21 H 1 .862 0.02 . 2 . . . B 374 LEU HD21 . 18534 1 103 . 1 1 11 11 LEU HD22 H 1 .862 0.02 . 2 . . . B 374 LEU HD22 . 18534 1 104 . 1 1 11 11 LEU HD23 H 1 .862 0.02 . 2 . . . B 374 LEU HD23 . 18534 1 105 . 1 1 11 11 LEU CA C 13 55.900 0.3 . 1 . . . B 374 LEU CA . 18534 1 106 . 1 1 11 11 LEU CB C 13 39.480 0.3 . 1 . . . B 374 LEU CB . 18534 1 107 . 1 1 11 11 LEU CG C 13 23.610 0.3 . 1 . . . B 374 LEU CG . 18534 1 108 . 1 1 11 11 LEU CD1 C 13 21.480 0.3 . 1 . . . B 374 LEU CD1 . 18534 1 109 . 1 1 11 11 LEU CD2 C 13 25.500 0.3 . 1 . . . B 374 LEU CD2 . 18534 1 110 . 1 1 11 11 LEU N N 15 119.270 0.3 . 1 . . . B 374 LEU N . 18534 1 111 . 1 1 12 12 TYR H H 1 7.801 0.02 . 1 . . . B 375 TYR H . 18534 1 112 . 1 1 12 12 TYR HA H 1 3.436 0.02 . 1 . . . B 375 TYR HA . 18534 1 113 . 1 1 12 12 TYR HB2 H 1 2.950 0.02 . 2 . . . B 375 TYR HB2 . 18534 1 114 . 1 1 12 12 TYR HB3 H 1 3.070 0.02 . 2 . . . B 375 TYR HB3 . 18534 1 115 . 1 1 12 12 TYR CA C 13 60.250 0.3 . 1 . . . B 375 TYR CA . 18534 1 116 . 1 1 12 12 TYR CB C 13 35.630 0.3 . 1 . . . B 375 TYR CB . 18534 1 117 . 1 1 12 12 TYR N N 15 117.830 0.3 . 1 . . . B 375 TYR N . 18534 1 118 . 1 1 13 13 SER H H 1 8.420 0.02 . 1 . . . B 376 SER H . 18534 1 119 . 1 1 13 13 SER HA H 1 3.992 0.02 . 1 . . . B 376 SER HA . 18534 1 120 . 1 1 13 13 SER HB2 H 1 4.170 0.02 . 2 . . . B 376 SER HB2 . 18534 1 121 . 1 1 13 13 SER CA C 13 60.320 0.3 . 1 . . . B 376 SER CA . 18534 1 122 . 1 1 13 13 SER CB C 13 60.300 0.3 . 1 . . . B 376 SER CB . 18534 1 123 . 1 1 13 13 SER N N 15 114.370 0.3 . 1 . . . B 376 SER N . 18534 1 124 . 1 1 14 14 LEU H H 1 7.476 0.02 . 1 . . . B 377 LEU H . 18534 1 125 . 1 1 14 14 LEU HA H 1 4.234 0.02 . 1 . . . B 377 LEU HA . 18534 1 126 . 1 1 14 14 LEU HB2 H 1 1.836 0.02 . 2 . . . B 377 LEU HB2 . 18534 1 127 . 1 1 14 14 LEU HB3 H 1 1.425 0.02 . 2 . . . B 377 LEU HB3 . 18534 1 128 . 1 1 14 14 LEU HG H 1 1.740 0.02 . 1 . . . B 377 LEU HG . 18534 1 129 . 1 1 14 14 LEU HD11 H 1 .802 0.02 . 2 . . . B 377 LEU HD11 . 18534 1 130 . 1 1 14 14 LEU HD12 H 1 .802 0.02 . 2 . . . B 377 LEU HD12 . 18534 1 131 . 1 1 14 14 LEU HD13 H 1 .802 0.02 . 2 . . . B 377 LEU HD13 . 18534 1 132 . 1 1 14 14 LEU HD21 H 1 .822 0.02 . 2 . . . B 377 LEU HD21 . 18534 1 133 . 1 1 14 14 LEU HD22 H 1 .822 0.02 . 2 . . . B 377 LEU HD22 . 18534 1 134 . 1 1 14 14 LEU HD23 H 1 .822 0.02 . 2 . . . B 377 LEU HD23 . 18534 1 135 . 1 1 14 14 LEU CA C 13 54.860 0.3 . 1 . . . B 377 LEU CA . 18534 1 136 . 1 1 14 14 LEU CB C 13 41.510 0.3 . 1 . . . B 377 LEU CB . 18534 1 137 . 1 1 14 14 LEU CG C 13 25.280 0.3 . 1 . . . B 377 LEU CG . 18534 1 138 . 1 1 14 14 LEU CD1 C 13 20.590 0.3 . 1 . . . B 377 LEU CD1 . 18534 1 139 . 1 1 14 14 LEU CD2 C 13 23.040 0.3 . 1 . . . B 377 LEU CD2 . 18534 1 140 . 1 1 14 14 LEU N N 15 120.230 0.3 . 1 . . . B 377 LEU N . 18534 1 141 . 1 1 15 15 ILE H H 1 7.346 0.02 . 1 . . . B 378 ILE H . 18534 1 142 . 1 1 15 15 ILE HA H 1 4.484 0.02 . 1 . . . B 378 ILE HA . 18534 1 143 . 1 1 15 15 ILE HB H 1 1.972 0.02 . 1 . . . B 378 ILE HB . 18534 1 144 . 1 1 15 15 ILE HD11 H 1 .363 0.02 . 1 . . . B 378 ILE HD11 . 18534 1 145 . 1 1 15 15 ILE HD12 H 1 .363 0.02 . 1 . . . B 378 ILE HD12 . 18534 1 146 . 1 1 15 15 ILE HD13 H 1 .363 0.02 . 1 . . . B 378 ILE HD13 . 18534 1 147 . 1 1 15 15 ILE CA C 13 58.270 0.3 . 1 . . . B 378 ILE CA . 18534 1 148 . 1 1 15 15 ILE CB C 13 38.750 0.3 . 1 . . . B 378 ILE CB . 18534 1 149 . 1 1 15 15 ILE CD1 C 13 12.160 0.3 . 1 . . . B 378 ILE CD1 . 18534 1 150 . 1 1 15 15 ILE N N 15 105.660 0.3 . 1 . . . B 378 ILE N . 18534 1 151 . 1 1 16 16 GLY H H 1 8.180 0.02 . 1 . . . B 379 GLY H . 18534 1 152 . 1 1 16 16 GLY HA2 H 1 3.103 0.02 . 2 . . . B 379 GLY HA2 . 18534 1 153 . 1 1 16 16 GLY CA C 13 43.300 0.3 . 1 . . . B 379 GLY CA . 18534 1 154 . 1 1 16 16 GLY N N 15 108.090 0.3 . 1 . . . B 379 GLY N . 18534 1 155 . 1 1 17 17 TYR H H 1 6.551 0.02 . 1 . . . B 380 TYR H . 18534 1 156 . 1 1 17 17 TYR HA H 1 4.611 0.02 . 1 . . . B 380 TYR HA . 18534 1 157 . 1 1 17 17 TYR HB2 H 1 3.194 0.02 . 2 . . . B 380 TYR HB2 . 18534 1 158 . 1 1 17 17 TYR CA C 13 53.800 0.3 . 1 . . . B 380 TYR CA . 18534 1 159 . 1 1 17 17 TYR CB C 13 36.100 0.3 . 1 . . . B 380 TYR CB . 18534 1 160 . 1 1 17 17 TYR N N 15 114.680 0.3 . 1 . . . B 380 TYR N . 18534 1 161 . 1 1 18 18 ALA HA H 1 4.114 0.02 . 1 . . . B 381 ALA HA . 18534 1 162 . 1 1 18 18 ALA HB1 H 1 1.502 0.02 . 1 . . . B 381 ALA HB1 . 18534 1 163 . 1 1 18 18 ALA HB2 H 1 1.502 0.02 . 1 . . . B 381 ALA HB2 . 18534 1 164 . 1 1 18 18 ALA HB3 H 1 1.502 0.02 . 1 . . . B 381 ALA HB3 . 18534 1 165 . 1 1 18 18 ALA CA C 13 54.430 0.3 . 1 . . . B 381 ALA CA . 18534 1 166 . 1 1 18 18 ALA CB C 13 16.000 0.3 . 1 . . . B 381 ALA CB . 18534 1 167 . 1 1 19 19 SER H H 1 8.498 0.02 . 1 . . . B 382 SER H . 18534 1 168 . 1 1 19 19 SER HA H 1 4.187 0.02 . 1 . . . B 382 SER HA . 18534 1 169 . 1 1 19 19 SER HB2 H 1 3.941 0.02 . 2 . . . B 382 SER HB2 . 18534 1 170 . 1 1 19 19 SER HB3 H 1 4.030 0.02 . 2 . . . B 382 SER HB3 . 18534 1 171 . 1 1 19 19 SER CA C 13 57.460 0.3 . 1 . . . B 382 SER CA . 18534 1 172 . 1 1 19 19 SER CB C 13 60.450 0.3 . 1 . . . B 382 SER CB . 18534 1 173 . 1 1 19 19 SER N N 15 109.840 0.3 . 1 . . . B 382 SER N . 18534 1 174 . 1 1 20 20 LEU H H 1 6.804 0.02 . 1 . . . B 383 LEU H . 18534 1 175 . 1 1 20 20 LEU HA H 1 3.704 0.02 . 1 . . . B 383 LEU HA . 18534 1 176 . 1 1 20 20 LEU HB2 H 1 1.280 0.02 . 2 . . . B 383 LEU HB2 . 18534 1 177 . 1 1 20 20 LEU HB3 H 1 1.330 0.02 . 2 . . . B 383 LEU HB3 . 18534 1 178 . 1 1 20 20 LEU HG H 1 1.260 0.02 . 1 . . . B 383 LEU HG . 18534 1 179 . 1 1 20 20 LEU HD11 H 1 .584 0.02 . 2 . . . B 383 LEU HD11 . 18534 1 180 . 1 1 20 20 LEU HD12 H 1 .584 0.02 . 2 . . . B 383 LEU HD12 . 18534 1 181 . 1 1 20 20 LEU HD13 H 1 .584 0.02 . 2 . . . B 383 LEU HD13 . 18534 1 182 . 1 1 20 20 LEU HD21 H 1 .792 0.02 . 2 . . . B 383 LEU HD21 . 18534 1 183 . 1 1 20 20 LEU HD22 H 1 .792 0.02 . 2 . . . B 383 LEU HD22 . 18534 1 184 . 1 1 20 20 LEU HD23 H 1 .792 0.02 . 2 . . . B 383 LEU HD23 . 18534 1 185 . 1 1 20 20 LEU CA C 13 53.420 0.3 . 1 . . . B 383 LEU CA . 18534 1 186 . 1 1 20 20 LEU CB C 13 38.600 0.3 . 1 . . . B 383 LEU CB . 18534 1 187 . 1 1 20 20 LEU CD1 C 13 24.150 0.3 . 1 . . . B 383 LEU CD1 . 18534 1 188 . 1 1 20 20 LEU CD2 C 13 20.020 0.3 . 1 . . . B 383 LEU CD2 . 18534 1 189 . 1 1 20 20 LEU N N 15 123.760 0.3 . 1 . . . B 383 LEU N . 18534 1 190 . 1 1 21 21 ARG H H 1 7.451 0.02 . 1 . . . B 384 ARG H . 18534 1 191 . 1 1 21 21 ARG HA H 1 3.762 0.02 . 1 . . . B 384 ARG HA . 18534 1 192 . 1 1 21 21 ARG HB2 H 1 1.460 0.02 . 2 . . . B 384 ARG HB2 . 18534 1 193 . 1 1 21 21 ARG HB3 H 1 1.386 0.02 . 2 . . . B 384 ARG HB3 . 18534 1 194 . 1 1 21 21 ARG HG2 H 1 1.590 0.02 . 2 . . . B 384 ARG HG2 . 18534 1 195 . 1 1 21 21 ARG HG3 H 1 1.780 0.02 . 2 . . . B 384 ARG HG3 . 18534 1 196 . 1 1 21 21 ARG HD2 H 1 3.020 0.02 . 2 . . . B 384 ARG HD2 . 18534 1 197 . 1 1 21 21 ARG CA C 13 53.760 0.3 . 1 . . . B 384 ARG CA . 18534 1 198 . 1 1 21 21 ARG CB C 13 24.980 0.3 . 1 . . . B 384 ARG CB . 18534 1 199 . 1 1 21 21 ARG CD C 13 40.880 0.3 . 1 . . . B 384 ARG CD . 18534 1 200 . 1 1 21 21 ARG N N 15 113.050 0.3 . 1 . . . B 384 ARG N . 18534 1 201 . 1 1 22 22 LEU H H 1 8.360 0.02 . 1 . . . B 385 LEU H . 18534 1 202 . 1 1 22 22 LEU HA H 1 4.640 0.02 . 1 . . . B 385 LEU HA . 18534 1 203 . 1 1 22 22 LEU HB2 H 1 1.662 0.02 . 2 . . . B 385 LEU HB2 . 18534 1 204 . 1 1 22 22 LEU HB3 H 1 1.164 0.02 . 2 . . . B 385 LEU HB3 . 18534 1 205 . 1 1 22 22 LEU HG H 1 1.220 0.02 . 1 . . . B 385 LEU HG . 18534 1 206 . 1 1 22 22 LEU HD11 H 1 .455 0.02 . 2 . . . B 385 LEU HD11 . 18534 1 207 . 1 1 22 22 LEU HD12 H 1 .455 0.02 . 2 . . . B 385 LEU HD12 . 18534 1 208 . 1 1 22 22 LEU HD13 H 1 .455 0.02 . 2 . . . B 385 LEU HD13 . 18534 1 209 . 1 1 22 22 LEU HD21 H 1 .588 0.02 . 2 . . . B 385 LEU HD21 . 18534 1 210 . 1 1 22 22 LEU HD22 H 1 .588 0.02 . 2 . . . B 385 LEU HD22 . 18534 1 211 . 1 1 22 22 LEU HD23 H 1 .588 0.02 . 2 . . . B 385 LEU HD23 . 18534 1 212 . 1 1 22 22 LEU CA C 13 53.240 0.3 . 1 . . . B 385 LEU CA . 18534 1 213 . 1 1 22 22 LEU CB C 13 40.400 0.3 . 1 . . . B 385 LEU CB . 18534 1 214 . 1 1 22 22 LEU CG C 13 25.030 0.3 . 1 . . . B 385 LEU CG . 18534 1 215 . 1 1 22 22 LEU CD1 C 13 23.300 0.3 . 1 . . . B 385 LEU CD1 . 18534 1 216 . 1 1 22 22 LEU CD2 C 13 23.330 0.3 . 1 . . . B 385 LEU CD2 . 18534 1 217 . 1 1 22 22 LEU N N 15 124.080 0.3 . 1 . . . B 385 LEU N . 18534 1 218 . 1 1 23 23 HIS H H 1 9.341 0.02 . 1 . . . B 386 HIS H . 18534 1 219 . 1 1 23 23 HIS HA H 1 4.825 0.02 . 1 . . . B 386 HIS HA . 18534 1 220 . 1 1 23 23 HIS HB2 H 1 3.057 0.02 . 2 . . . B 386 HIS HB2 . 18534 1 221 . 1 1 23 23 HIS HB3 H 1 2.943 0.02 . 2 . . . B 386 HIS HB3 . 18534 1 222 . 1 1 23 23 HIS HD1 H 1 6.650 0.02 . 1 . . . B 386 HIS HD1 . 18534 1 223 . 1 1 23 23 HIS HE1 H 1 7.564 0.02 . 1 . . . B 386 HIS HE1 . 18534 1 224 . 1 1 23 23 HIS CA C 13 52.520 0.3 . 1 . . . B 386 HIS CA . 18534 1 225 . 1 1 23 23 HIS CB C 13 27.960 0.3 . 1 . . . B 386 HIS CB . 18534 1 226 . 1 1 23 23 HIS N N 15 124.430 0.3 . 1 . . . B 386 HIS N . 18534 1 227 . 1 1 24 24 TYR H H 1 8.583 0.02 . 1 . . . B 387 TYR H . 18534 1 228 . 1 1 24 24 TYR HA H 1 4.980 0.02 . 1 . . . B 387 TYR HA . 18534 1 229 . 1 1 24 24 TYR HB2 H 1 2.490 0.02 . 2 . . . B 387 TYR HB2 . 18534 1 230 . 1 1 24 24 TYR HB3 H 1 2.680 0.02 . 2 . . . B 387 TYR HB3 . 18534 1 231 . 1 1 24 24 TYR HE1 H 1 6.847 0.02 . 3 . . . B 387 TYR HE1 . 18534 1 232 . 1 1 24 24 TYR CA C 13 54.910 0.3 . 1 . . . B 387 TYR CA . 18534 1 233 . 1 1 24 24 TYR CB C 13 36.780 0.3 . 1 . . . B 387 TYR CB . 18534 1 234 . 1 1 24 24 TYR N N 15 118.930 0.3 . 1 . . . B 387 TYR N . 18534 1 235 . 1 1 25 25 VAL H H 1 9.177 0.02 . 1 . . . B 388 VAL H . 18534 1 236 . 1 1 25 25 VAL HA H 1 4.256 0.02 . 1 . . . B 388 VAL HA . 18534 1 237 . 1 1 25 25 VAL HB H 1 1.691 0.02 . 1 . . . B 388 VAL HB . 18534 1 238 . 1 1 25 25 VAL CA C 13 58.430 0.3 . 1 . . . B 388 VAL CA . 18534 1 239 . 1 1 25 25 VAL CB C 13 33.200 0.3 . 1 . . . B 388 VAL CB . 18534 1 240 . 1 1 25 25 VAL CG1 C 13 18.360 0.3 . 1 . . . B 388 VAL CG1 . 18534 1 241 . 1 1 25 25 VAL CG2 C 13 19.760 0.3 . 1 . . . B 388 VAL CG2 . 18534 1 242 . 1 1 25 25 VAL N N 15 123.980 0.3 . 1 . . . B 388 VAL N . 18534 1 243 . 1 1 26 26 THR H H 1 9.153 0.02 . 1 . . . B 389 THR H . 18534 1 244 . 1 1 26 26 THR HA H 1 4.350 0.02 . 1 . . . B 389 THR HA . 18534 1 245 . 1 1 26 26 THR HB H 1 4.080 0.02 . 1 . . . B 389 THR HB . 18534 1 246 . 1 1 26 26 THR CA C 13 60.810 0.3 . 1 . . . B 389 THR CA . 18534 1 247 . 1 1 26 26 THR CB C 13 65.130 0.3 . 1 . . . B 389 THR CB . 18534 1 248 . 1 1 26 26 THR CG2 C 13 20.810 0.3 . 1 . . . B 389 THR CG2 . 18534 1 249 . 1 1 26 26 THR N N 15 126.070 0.3 . 1 . . . B 389 THR N . 18534 1 250 . 1 1 27 27 VAL H H 1 8.612 0.02 . 1 . . . B 390 VAL H . 18534 1 251 . 1 1 27 27 VAL HA H 1 4.090 0.02 . 1 . . . B 390 VAL HA . 18534 1 252 . 1 1 27 27 VAL HB H 1 1.879 0.02 . 1 . . . B 390 VAL HB . 18534 1 253 . 1 1 27 27 VAL CA C 13 60.230 0.3 . 1 . . . B 390 VAL CA . 18534 1 254 . 1 1 27 27 VAL CB C 13 29.630 0.3 . 1 . . . B 390 VAL CB . 18534 1 255 . 1 1 27 27 VAL CG1 C 13 17.860 0.3 . 1 . . . B 390 VAL CG1 . 18534 1 256 . 1 1 27 27 VAL CG2 C 13 18.500 0.3 . 1 . . . B 390 VAL CG2 . 18534 1 257 . 1 1 27 27 VAL N N 15 127.010 0.3 . 1 . . . B 390 VAL N . 18534 1 258 . 1 1 28 28 LYS H H 1 7.774 0.02 . 1 . . . B 391 LYS H . 18534 1 259 . 1 1 28 28 LYS HA H 1 4.489 0.02 . 1 . . . B 391 LYS HA . 18534 1 260 . 1 1 28 28 LYS HB2 H 1 1.427 0.02 . 2 . . . B 391 LYS HB2 . 18534 1 261 . 1 1 28 28 LYS HG2 H 1 1.790 0.02 . 2 . . . B 391 LYS HG2 . 18534 1 262 . 1 1 28 28 LYS HD2 H 1 1.390 0.02 . 2 . . . B 391 LYS HD2 . 18534 1 263 . 1 1 28 28 LYS HD3 H 1 1.700 0.02 . 2 . . . B 391 LYS HD3 . 18534 1 264 . 1 1 28 28 LYS HE2 H 1 2.948 0.02 . 2 . . . B 391 LYS HE2 . 18534 1 265 . 1 1 28 28 LYS CA C 13 53.810 0.3 . 1 . . . B 391 LYS CA . 18534 1 266 . 1 1 28 28 LYS CB C 13 33.380 0.3 . 1 . . . B 391 LYS CB . 18534 1 267 . 1 1 28 28 LYS CG C 13 33.400 0.3 . 1 . . . B 391 LYS CG . 18534 1 268 . 1 1 28 28 LYS CD C 13 26.450 0.3 . 1 . . . B 391 LYS CD . 18534 1 269 . 1 1 28 28 LYS CE C 13 39.500 0.3 . 1 . . . B 391 LYS CE . 18534 1 270 . 1 1 28 28 LYS N N 15 121.300 0.3 . 1 . . . B 391 LYS N . 18534 1 271 . 1 1 29 29 LYS H H 1 8.630 0.02 . 1 . . . B 392 LYS H . 18534 1 272 . 1 1 29 29 LYS HA H 1 4.509 0.02 . 1 . . . B 392 LYS HA . 18534 1 273 . 1 1 29 29 LYS HB2 H 1 1.813 0.02 . 2 . . . B 392 LYS HB2 . 18534 1 274 . 1 1 29 29 LYS HG2 H 1 1.658 0.02 . 2 . . . B 392 LYS HG2 . 18534 1 275 . 1 1 29 29 LYS HD2 H 1 1.448 0.02 . 2 . . . B 392 LYS HD2 . 18534 1 276 . 1 1 29 29 LYS HE2 H 1 2.957 0.02 . 2 . . . B 392 LYS HE2 . 18534 1 277 . 1 1 29 29 LYS CA C 13 51.820 0.3 . 1 . . . B 392 LYS CA . 18534 1 278 . 1 1 29 29 LYS CB C 13 29.810 0.3 . 1 . . . B 392 LYS CB . 18534 1 279 . 1 1 29 29 LYS CG C 13 26.590 0.3 . 1 . . . B 392 LYS CG . 18534 1 280 . 1 1 29 29 LYS CD C 13 22.500 0.3 . 1 . . . B 392 LYS CD . 18534 1 281 . 1 1 29 29 LYS CE C 13 39.630 0.3 . 1 . . . B 392 LYS CE . 18534 1 282 . 1 1 29 29 LYS N N 15 127.350 0.3 . 1 . . . B 392 LYS N . 18534 1 283 . 1 1 30 30 PRO HA H 1 4.368 0.02 . 1 . . . B 393 PRO HA . 18534 1 284 . 1 1 30 30 PRO HB2 H 1 2.073 0.02 . 2 . . . B 393 PRO HB2 . 18534 1 285 . 1 1 30 30 PRO HG2 H 1 1.971 0.02 . 2 . . . B 393 PRO HG2 . 18534 1 286 . 1 1 30 30 PRO HG3 H 1 1.879 0.02 . 2 . . . B 393 PRO HG3 . 18534 1 287 . 1 1 30 30 PRO HD2 H 1 3.620 0.02 . 2 . . . B 393 PRO HD2 . 18534 1 288 . 1 1 30 30 PRO HD3 H 1 3.386 0.02 . 2 . . . B 393 PRO HD3 . 18534 1 289 . 1 1 30 30 PRO CA C 13 61.200 0.3 . 1 . . . B 393 PRO CA . 18534 1 290 . 1 1 30 30 PRO CB C 13 29.960 0.3 . 1 . . . B 393 PRO CB . 18534 1 291 . 1 1 30 30 PRO CG C 13 24.920 0.3 . 1 . . . B 393 PRO CG . 18534 1 292 . 1 1 30 30 PRO CD C 13 48.640 0.3 . 1 . . . B 393 PRO CD . 18534 1 293 . 1 1 31 31 THR H H 1 8.185 0.02 . 1 . . . B 394 THR H . 18534 1 294 . 1 1 31 31 THR HA H 1 4.619 0.02 . 1 . . . B 394 THR HA . 18534 1 295 . 1 1 31 31 THR HB H 1 4.528 0.02 . 1 . . . B 394 THR HB . 18534 1 296 . 1 1 31 31 THR CA C 13 56.930 0.3 . 1 . . . B 394 THR CA . 18534 1 297 . 1 1 31 31 THR CB C 13 70.300 0.3 . 1 . . . B 394 THR CB . 18534 1 298 . 1 1 31 31 THR CG2 C 13 19.170 0.3 . 1 . . . B 394 THR CG2 . 18534 1 299 . 1 1 31 31 THR N N 15 112.670 0.3 . 1 . . . B 394 THR N . 18534 1 300 . 1 1 32 32 ALA H H 1 8.523 0.02 . 1 . . . B 395 ALA H . 18534 1 301 . 1 1 32 32 ALA HA H 1 3.990 0.02 . 1 . . . B 395 ALA HA . 18534 1 302 . 1 1 32 32 ALA HB1 H 1 1.367 0.02 . 1 . . . B 395 ALA HB1 . 18534 1 303 . 1 1 32 32 ALA HB2 H 1 1.367 0.02 . 1 . . . B 395 ALA HB2 . 18534 1 304 . 1 1 32 32 ALA HB3 H 1 1.367 0.02 . 1 . . . B 395 ALA HB3 . 18534 1 305 . 1 1 32 32 ALA CA C 13 52.480 0.3 . 1 . . . B 395 ALA CA . 18534 1 306 . 1 1 32 32 ALA CB C 13 15.800 0.3 . 1 . . . B 395 ALA CB . 18534 1 307 . 1 1 32 32 ALA N N 15 120.590 0.3 . 1 . . . B 395 ALA N . 18534 1 308 . 1 1 33 33 VAL H H 1 7.247 0.02 . 1 . . . B 396 VAL H . 18534 1 309 . 1 1 33 33 VAL HA H 1 4.034 0.02 . 1 . . . B 396 VAL HA . 18534 1 310 . 1 1 33 33 VAL HB H 1 2.026 0.02 . 1 . . . B 396 VAL HB . 18534 1 311 . 1 1 33 33 VAL CA C 13 59.880 0.3 . 1 . . . B 396 VAL CA . 18534 1 312 . 1 1 33 33 VAL CB C 13 30.050 0.3 . 1 . . . B 396 VAL CB . 18534 1 313 . 1 1 33 33 VAL CG1 C 13 18.320 0.3 . 1 . . . B 396 VAL CG1 . 18534 1 314 . 1 1 33 33 VAL CG2 C 13 18.200 0.3 . 1 . . . B 396 VAL CG2 . 18534 1 315 . 1 1 33 33 VAL N N 15 109.190 0.3 . 1 . . . B 396 VAL N . 18534 1 316 . 1 1 34 34 ASP H H 1 7.206 0.02 . 1 . . . B 397 ASP H . 18534 1 317 . 1 1 34 34 ASP HA H 1 4.953 0.02 . 1 . . . B 397 ASP HA . 18534 1 318 . 1 1 34 34 ASP HB2 H 1 2.634 0.02 . 2 . . . B 397 ASP HB2 . 18534 1 319 . 1 1 34 34 ASP HB3 H 1 2.406 0.02 . 2 . . . B 397 ASP HB3 . 18534 1 320 . 1 1 34 34 ASP CA C 13 48.470 0.3 . 1 . . . B 397 ASP CA . 18534 1 321 . 1 1 34 34 ASP CB C 13 39.110 0.3 . 1 . . . B 397 ASP CB . 18534 1 322 . 1 1 34 34 ASP N N 15 118.600 0.3 . 1 . . . B 397 ASP N . 18534 1 323 . 1 1 35 35 PRO HA H 1 4.657 0.02 . 1 . . . B 398 PRO HA . 18534 1 324 . 1 1 35 35 PRO HB2 H 1 2.123 0.02 . 2 . . . B 398 PRO HB2 . 18534 1 325 . 1 1 35 35 PRO HB3 H 1 1.791 0.02 . 2 . . . B 398 PRO HB3 . 18534 1 326 . 1 1 35 35 PRO HG2 H 1 1.957 0.02 . 2 . . . B 398 PRO HG2 . 18534 1 327 . 1 1 35 35 PRO HG3 H 1 1.765 0.02 . 2 . . . B 398 PRO HG3 . 18534 1 328 . 1 1 35 35 PRO HD2 H 1 3.695 0.02 . 2 . . . B 398 PRO HD2 . 18534 1 329 . 1 1 35 35 PRO HD3 H 1 3.406 0.02 . 2 . . . B 398 PRO HD3 . 18534 1 330 . 1 1 35 35 PRO CA C 13 60.760 0.3 . 1 . . . B 398 PRO CA . 18534 1 331 . 1 1 35 35 PRO CB C 13 28.510 0.3 . 1 . . . B 398 PRO CB . 18534 1 332 . 1 1 35 35 PRO CG C 13 24.020 0.3 . 1 . . . B 398 PRO CG . 18534 1 333 . 1 1 35 35 PRO CD C 13 48.260 0.3 . 1 . . . B 398 PRO CD . 18534 1 334 . 1 1 36 36 ASN H H 1 8.001 0.02 . 1 . . . B 399 ASN H . 18534 1 335 . 1 1 36 36 ASN HA H 1 4.588 0.02 . 1 . . . B 399 ASN HA . 18534 1 336 . 1 1 36 36 ASN HB2 H 1 2.213 0.02 . 2 . . . B 399 ASN HB2 . 18534 1 337 . 1 1 36 36 ASN HB3 H 1 2.583 0.02 . 2 . . . B 399 ASN HB3 . 18534 1 338 . 1 1 36 36 ASN HD21 H 1 6.647 0.02 . 2 . . . B 399 ASN HD21 . 18534 1 339 . 1 1 36 36 ASN HD22 H 1 7.724 0.02 . 2 . . . B 399 ASN HD22 . 18534 1 340 . 1 1 36 36 ASN CA C 13 51.560 0.3 . 1 . . . B 399 ASN CA . 18534 1 341 . 1 1 36 36 ASN CB C 13 38.040 0.3 . 1 . . . B 399 ASN CB . 18534 1 342 . 1 1 36 36 ASN N N 15 117.630 0.3 . 1 . . . B 399 ASN N . 18534 1 343 . 1 1 36 36 ASN ND2 N 15 113.610 0.3 . 1 . . . B 399 ASN ND2 . 18534 1 344 . 1 1 37 37 SER H H 1 8.742 0.02 . 1 . . . B 400 SER H . 18534 1 345 . 1 1 37 37 SER HA H 1 4.640 0.02 . 1 . . . B 400 SER HA . 18534 1 346 . 1 1 37 37 SER HB2 H 1 3.324 0.02 . 2 . . . B 400 SER HB2 . 18534 1 347 . 1 1 37 37 SER CA C 13 53.200 0.3 . 1 . . . B 400 SER CA . 18534 1 348 . 1 1 37 37 SER CB C 13 63.170 0.3 . 1 . . . B 400 SER CB . 18534 1 349 . 1 1 37 37 SER N N 15 115.030 0.3 . 1 . . . B 400 SER N . 18534 1 350 . 1 1 38 38 ILE H H 1 8.174 0.02 . 1 . . . B 401 ILE H . 18534 1 351 . 1 1 38 38 ILE HA H 1 5.057 0.02 . 1 . . . B 401 ILE HA . 18534 1 352 . 1 1 38 38 ILE HB H 1 1.400 0.02 . 1 . . . B 401 ILE HB . 18534 1 353 . 1 1 38 38 ILE HD11 H 1 .698 0.02 . 1 . . . B 401 ILE HD11 . 18534 1 354 . 1 1 38 38 ILE HD12 H 1 .698 0.02 . 1 . . . B 401 ILE HD12 . 18534 1 355 . 1 1 38 38 ILE HD13 H 1 .698 0.02 . 1 . . . B 401 ILE HD13 . 18534 1 356 . 1 1 38 38 ILE CA C 13 58.080 0.3 . 1 . . . B 401 ILE CA . 18534 1 357 . 1 1 38 38 ILE CB C 13 38.360 0.3 . 1 . . . B 401 ILE CB . 18534 1 358 . 1 1 38 38 ILE CG1 C 13 24.510 0.3 . 1 . . . B 401 ILE CG1 . 18534 1 359 . 1 1 38 38 ILE CG2 C 13 10.800 0.3 . 1 . . . B 401 ILE CG2 . 18534 1 360 . 1 1 38 38 ILE CD1 C 13 14.560 0.3 . 1 . . . B 401 ILE CD1 . 18534 1 361 . 1 1 38 38 ILE N N 15 120.560 0.3 . 1 . . . B 401 ILE N . 18534 1 362 . 1 1 39 39 VAL H H 1 8.980 0.02 . 1 . . . B 402 VAL H . 18534 1 363 . 1 1 39 39 VAL HA H 1 4.926 0.02 . 1 . . . B 402 VAL HA . 18534 1 364 . 1 1 39 39 VAL HB H 1 1.374 0.02 . 1 . . . B 402 VAL HB . 18534 1 365 . 1 1 39 39 VAL CA C 13 57.300 0.3 . 1 . . . B 402 VAL CA . 18534 1 366 . 1 1 39 39 VAL CB C 13 33.090 0.3 . 1 . . . B 402 VAL CB . 18534 1 367 . 1 1 39 39 VAL CG1 C 13 20.740 0.3 . 1 . . . B 402 VAL CG1 . 18534 1 368 . 1 1 39 39 VAL CG2 C 13 20.390 0.3 . 1 . . . B 402 VAL CG2 . 18534 1 369 . 1 1 39 39 VAL N N 15 127.820 0.3 . 1 . . . B 402 VAL N . 18534 1 370 . 1 1 40 40 GLU H H 1 9.061 0.02 . 1 . . . B 403 GLU H . 18534 1 371 . 1 1 40 40 GLU HA H 1 4.970 0.02 . 1 . . . B 403 GLU HA . 18534 1 372 . 1 1 40 40 GLU HB2 H 1 2.340 0.02 . 2 . . . B 403 GLU HB2 . 18534 1 373 . 1 1 40 40 GLU HG2 H 1 2.140 0.02 . 2 . . . B 403 GLU HG2 . 18534 1 374 . 1 1 40 40 GLU CA C 13 51.580 0.3 . 1 . . . B 403 GLU CA . 18534 1 375 . 1 1 40 40 GLU CB C 13 33.830 0.3 . 1 . . . B 403 GLU CB . 18534 1 376 . 1 1 40 40 GLU CG C 13 33.970 0.3 . 1 . . . B 403 GLU CG . 18534 1 377 . 1 1 40 40 GLU N N 15 122.770 0.3 . 1 . . . B 403 GLU N . 18534 1 378 . 1 1 41 41 CYS H H 1 8.831 0.02 . 1 . . . B 404 CYS H . 18534 1 379 . 1 1 41 41 CYS HA H 1 4.035 0.02 . 1 . . . B 404 CYS HA . 18534 1 380 . 1 1 41 41 CYS HB2 H 1 2.282 0.02 . 2 . . . B 404 CYS HB2 . 18534 1 381 . 1 1 41 41 CYS CA C 13 55.230 0.3 . 1 . . . B 404 CYS CA . 18534 1 382 . 1 1 41 41 CYS CB C 13 24.350 0.3 . 1 . . . B 404 CYS CB . 18534 1 383 . 1 1 41 41 CYS N N 15 123.280 0.3 . 1 . . . B 404 CYS N . 18534 1 384 . 1 1 42 42 ARG H H 1 8.768 0.02 . 1 . . . B 405 ARG H . 18534 1 385 . 1 1 42 42 ARG HA H 1 5.355 0.02 . 1 . . . B 405 ARG HA . 18534 1 386 . 1 1 42 42 ARG HB2 H 1 1.478 0.02 . 2 . . . B 405 ARG HB2 . 18534 1 387 . 1 1 42 42 ARG HB3 H 1 1.700 0.02 . 2 . . . B 405 ARG HB3 . 18534 1 388 . 1 1 42 42 ARG HG2 H 1 1.309 0.02 . 2 . . . B 405 ARG HG2 . 18534 1 389 . 1 1 42 42 ARG HG3 H 1 1.140 0.02 . 2 . . . B 405 ARG HG3 . 18534 1 390 . 1 1 42 42 ARG HD2 H 1 2.759 0.02 . 2 . . . B 405 ARG HD2 . 18534 1 391 . 1 1 42 42 ARG CA C 13 51.500 0.3 . 1 . . . B 405 ARG CA . 18534 1 392 . 1 1 42 42 ARG CB C 13 32.980 0.3 . 1 . . . B 405 ARG CB . 18534 1 393 . 1 1 42 42 ARG CG C 13 24.890 0.3 . 1 . . . B 405 ARG CG . 18534 1 394 . 1 1 42 42 ARG CD C 13 41.620 0.3 . 1 . . . B 405 ARG CD . 18534 1 395 . 1 1 42 42 ARG N N 15 127.500 0.3 . 1 . . . B 405 ARG N . 18534 1 396 . 1 1 43 43 VAL H H 1 7.598 0.02 . 1 . . . B 406 VAL H . 18534 1 397 . 1 1 43 43 VAL HA H 1 4.732 0.02 . 1 . . . B 406 VAL HA . 18534 1 398 . 1 1 43 43 VAL HB H 1 2.112 0.02 . 1 . . . B 406 VAL HB . 18534 1 399 . 1 1 43 43 VAL CA C 13 57.280 0.3 . 1 . . . B 406 VAL CA . 18534 1 400 . 1 1 43 43 VAL CB C 13 30.700 0.3 . 1 . . . B 406 VAL CB . 18534 1 401 . 1 1 43 43 VAL CG1 C 13 17.040 0.3 . 1 . . . B 406 VAL CG1 . 18534 1 402 . 1 1 43 43 VAL CG2 C 13 20.770 0.3 . 1 . . . B 406 VAL CG2 . 18534 1 403 . 1 1 43 43 VAL N N 15 108.720 0.3 . 1 . . . B 406 VAL N . 18534 1 404 . 1 1 44 44 GLY H H 1 8.400 0.02 . 1 . . . B 407 GLY H . 18534 1 405 . 1 1 44 44 GLY HA2 H 1 3.920 0.02 . 2 . . . B 407 GLY HA2 . 18534 1 406 . 1 1 44 44 GLY HA3 H 1 3.724 0.02 . 2 . . . B 407 GLY HA3 . 18534 1 407 . 1 1 44 44 GLY CA C 13 45.470 0.3 . 1 . . . B 407 GLY CA . 18534 1 408 . 1 1 44 44 GLY N N 15 108.200 0.3 . 1 . . . B 407 GLY N . 18534 1 409 . 1 1 45 45 ASP H H 1 7.850 0.02 . 1 . . . B 408 ASP H . 18534 1 410 . 1 1 45 45 ASP HA H 1 4.513 0.02 . 1 . . . B 408 ASP HA . 18534 1 411 . 1 1 45 45 ASP HB2 H 1 2.577 0.02 . 2 . . . B 408 ASP HB2 . 18534 1 412 . 1 1 45 45 ASP HB3 H 1 3.034 0.02 . 2 . . . B 408 ASP HB3 . 18534 1 413 . 1 1 45 45 ASP CA C 13 51.350 0.3 . 1 . . . B 408 ASP CA . 18534 1 414 . 1 1 45 45 ASP CB C 13 37.430 0.3 . 1 . . . B 408 ASP CB . 18534 1 415 . 1 1 45 45 ASP N N 15 118.160 0.3 . 1 . . . B 408 ASP N . 18534 1 416 . 1 1 46 46 GLY H H 1 8.275 0.02 . 1 . . . B 409 GLY H . 18534 1 417 . 1 1 46 46 GLY HA2 H 1 4.327 0.02 . 2 . . . B 409 GLY HA2 . 18534 1 418 . 1 1 46 46 GLY HA3 H 1 3.533 0.02 . 2 . . . B 409 GLY HA3 . 18534 1 419 . 1 1 46 46 GLY CA C 13 42.280 0.3 . 1 . . . B 409 GLY CA . 18534 1 420 . 1 1 46 46 GLY N N 15 107.740 0.3 . 1 . . . B 409 GLY N . 18534 1 421 . 1 1 47 47 THR H H 1 8.044 0.02 . 1 . . . B 410 THR H . 18534 1 422 . 1 1 47 47 THR HA H 1 3.945 0.02 . 1 . . . B 410 THR HA . 18534 1 423 . 1 1 47 47 THR HB H 1 3.742 0.02 . 1 . . . B 410 THR HB . 18534 1 424 . 1 1 47 47 THR CA C 13 65.850 0.3 . 1 . . . B 410 THR CA . 18534 1 425 . 1 1 47 47 THR CB C 13 62.900 0.3 . 1 . . . B 410 THR CB . 18534 1 426 . 1 1 47 47 THR CG2 C 13 18.610 0.3 . 1 . . . B 410 THR CG2 . 18534 1 427 . 1 1 47 47 THR N N 15 119.210 0.3 . 1 . . . B 410 THR N . 18534 1 428 . 1 1 48 48 VAL H H 1 8.386 0.02 . 1 . . . B 411 VAL H . 18534 1 429 . 1 1 48 48 VAL HA H 1 4.010 0.02 . 1 . . . B 411 VAL HA . 18534 1 430 . 1 1 48 48 VAL HB H 1 1.894 0.02 . 1 . . . B 411 VAL HB . 18534 1 431 . 1 1 48 48 VAL CA C 13 59.950 0.3 . 1 . . . B 411 VAL CA . 18534 1 432 . 1 1 48 48 VAL CB C 13 29.470 0.3 . 1 . . . B 411 VAL CB . 18534 1 433 . 1 1 48 48 VAL CG1 C 13 19.550 0.3 . 1 . . . B 411 VAL CG1 . 18534 1 434 . 1 1 48 48 VAL CG2 C 13 19.170 0.3 . 1 . . . B 411 VAL CG2 . 18534 1 435 . 1 1 48 48 VAL N N 15 126.460 0.3 . 1 . . . B 411 VAL N . 18534 1 436 . 1 1 49 49 LEU H H 1 9.185 0.02 . 1 . . . B 412 LEU H . 18534 1 437 . 1 1 49 49 LEU HA H 1 4.290 0.02 . 1 . . . B 412 LEU HA . 18534 1 438 . 1 1 49 49 LEU HB2 H 1 1.306 0.02 . 2 . . . B 412 LEU HB2 . 18534 1 439 . 1 1 49 49 LEU HB3 H 1 1.405 0.02 . 2 . . . B 412 LEU HB3 . 18534 1 440 . 1 1 49 49 LEU HG H 1 1.386 0.02 . 1 . . . B 412 LEU HG . 18534 1 441 . 1 1 49 49 LEU HD11 H 1 .536 0.02 . 2 . . . B 412 LEU HD11 . 18534 1 442 . 1 1 49 49 LEU HD12 H 1 .536 0.02 . 2 . . . B 412 LEU HD12 . 18534 1 443 . 1 1 49 49 LEU HD13 H 1 .536 0.02 . 2 . . . B 412 LEU HD13 . 18534 1 444 . 1 1 49 49 LEU HD21 H 1 .463 0.02 . 2 . . . B 412 LEU HD21 . 18534 1 445 . 1 1 49 49 LEU HD22 H 1 .463 0.02 . 2 . . . B 412 LEU HD22 . 18534 1 446 . 1 1 49 49 LEU HD23 H 1 .463 0.02 . 2 . . . B 412 LEU HD23 . 18534 1 447 . 1 1 49 49 LEU CA C 13 53.100 0.3 . 1 . . . B 412 LEU CA . 18534 1 448 . 1 1 49 49 LEU CB C 13 40.660 0.3 . 1 . . . B 412 LEU CB . 18534 1 449 . 1 1 49 49 LEU CG C 13 25.240 0.3 . 1 . . . B 412 LEU CG . 18534 1 450 . 1 1 49 49 LEU CD1 C 13 19.940 0.3 . 1 . . . B 412 LEU CD1 . 18534 1 451 . 1 1 49 49 LEU CD2 C 13 23.320 0.3 . 1 . . . B 412 LEU CD2 . 18534 1 452 . 1 1 49 49 LEU N N 15 127.930 0.3 . 1 . . . B 412 LEU N . 18534 1 453 . 1 1 50 50 GLY H H 1 7.183 0.02 . 1 . . . B 413 GLY H . 18534 1 454 . 1 1 50 50 GLY HA2 H 1 4.186 0.02 . 2 . . . B 413 GLY HA2 . 18534 1 455 . 1 1 50 50 GLY HA3 H 1 3.892 0.02 . 2 . . . B 413 GLY HA3 . 18534 1 456 . 1 1 50 50 GLY CA C 13 42.900 0.3 . 1 . . . B 413 GLY CA . 18534 1 457 . 1 1 50 50 GLY N N 15 101.990 0.3 . 1 . . . B 413 GLY N . 18534 1 458 . 1 1 51 51 THR H H 1 8.543 0.02 . 1 . . . B 414 THR H . 18534 1 459 . 1 1 51 51 THR HA H 1 5.048 0.02 . 1 . . . B 414 THR HA . 18534 1 460 . 1 1 51 51 THR HB H 1 3.704 0.02 . 1 . . . B 414 THR HB . 18534 1 461 . 1 1 51 51 THR CA C 13 59.660 0.3 . 1 . . . B 414 THR CA . 18534 1 462 . 1 1 51 51 THR CB C 13 68.180 0.3 . 1 . . . B 414 THR CB . 18534 1 463 . 1 1 51 51 THR CG2 C 13 19.130 0.3 . 1 . . . B 414 THR CG2 . 18534 1 464 . 1 1 51 51 THR N N 15 118.130 0.3 . 1 . . . B 414 THR N . 18534 1 465 . 1 1 52 52 GLY H H 1 9.457 0.02 . 1 . . . B 415 GLY H . 18534 1 466 . 1 1 52 52 GLY HA2 H 1 4.078 0.02 . 2 . . . B 415 GLY HA2 . 18534 1 467 . 1 1 52 52 GLY CA C 13 41.470 0.3 . 1 . . . B 415 GLY CA . 18534 1 468 . 1 1 52 52 GLY N N 15 115.100 0.3 . 1 . . . B 415 GLY N . 18534 1 469 . 1 1 53 53 VAL H H 1 7.895 0.02 . 1 . . . B 416 VAL H . 18534 1 470 . 1 1 53 53 VAL HA H 1 5.280 0.02 . 1 . . . B 416 VAL HA . 18534 1 471 . 1 1 53 53 VAL HB H 1 1.860 0.02 . 1 . . . B 416 VAL HB . 18534 1 472 . 1 1 53 53 VAL CA C 13 56.920 0.3 . 1 . . . B 416 VAL CA . 18534 1 473 . 1 1 53 53 VAL CB C 13 32.040 0.3 . 1 . . . B 416 VAL CB . 18534 1 474 . 1 1 53 53 VAL CG1 C 13 18.280 0.3 . 1 . . . B 416 VAL CG1 . 18534 1 475 . 1 1 53 53 VAL CG2 C 13 18.280 0.3 . 1 . . . B 416 VAL CG2 . 18534 1 476 . 1 1 53 53 VAL N N 15 119.290 0.3 . 1 . . . B 416 VAL N . 18534 1 477 . 1 1 54 54 GLY H H 1 8.313 0.02 . 1 . . . B 417 GLY H . 18534 1 478 . 1 1 54 54 GLY HA2 H 1 4.306 0.02 . 2 . . . B 417 GLY HA2 . 18534 1 479 . 1 1 54 54 GLY HA3 H 1 3.717 0.02 . 2 . . . B 417 GLY HA3 . 18534 1 480 . 1 1 54 54 GLY CA C 13 42.690 0.3 . 1 . . . B 417 GLY CA . 18534 1 481 . 1 1 54 54 GLY N N 15 108.950 0.3 . 1 . . . B 417 GLY N . 18534 1 482 . 1 1 55 55 ARG H H 1 8.695 0.02 . 1 . . . B 418 ARG H . 18534 1 483 . 1 1 55 55 ARG HA H 1 4.332 0.02 . 1 . . . B 418 ARG HA . 18534 1 484 . 1 1 55 55 ARG HB2 H 1 1.792 0.02 . 2 . . . B 418 ARG HB2 . 18534 1 485 . 1 1 55 55 ARG HG2 H 1 1.611 0.02 . 2 . . . B 418 ARG HG2 . 18534 1 486 . 1 1 55 55 ARG HD2 H 1 3.175 0.02 . 2 . . . B 418 ARG HD2 . 18534 1 487 . 1 1 55 55 ARG CA C 13 55.260 0.3 . 1 . . . B 418 ARG CA . 18534 1 488 . 1 1 55 55 ARG CB C 13 27.700 0.3 . 1 . . . B 418 ARG CB . 18534 1 489 . 1 1 55 55 ARG CG C 13 24.690 0.3 . 1 . . . B 418 ARG CG . 18534 1 490 . 1 1 55 55 ARG CD C 13 40.870 0.3 . 1 . . . B 418 ARG CD . 18534 1 491 . 1 1 55 55 ARG N N 15 117.770 0.3 . 1 . . . B 418 ARG N . 18534 1 492 . 1 1 56 56 ASN H H 1 7.246 0.02 . 1 . . . B 419 ASN H . 18534 1 493 . 1 1 56 56 ASN HA H 1 4.672 0.02 . 1 . . . B 419 ASN HA . 18534 1 494 . 1 1 56 56 ASN HB2 H 1 3.320 0.02 . 2 . . . B 419 ASN HB2 . 18534 1 495 . 1 1 56 56 ASN HB3 H 1 2.910 0.02 . 2 . . . B 419 ASN HB3 . 18534 1 496 . 1 1 56 56 ASN HD21 H 1 6.728 0.02 . 2 . . . B 419 ASN HD21 . 18534 1 497 . 1 1 56 56 ASN CA C 13 49.240 0.3 . 1 . . . B 419 ASN CA . 18534 1 498 . 1 1 56 56 ASN CB C 13 37.970 0.3 . 1 . . . B 419 ASN CB . 18534 1 499 . 1 1 56 56 ASN N N 15 110.280 0.3 . 1 . . . B 419 ASN N . 18534 1 500 . 1 1 56 56 ASN ND2 N 15 113.780 0.3 . 1 . . . B 419 ASN ND2 . 18534 1 501 . 1 1 57 57 ILE H H 1 8.879 0.02 . 1 . . . B 420 ILE H . 18534 1 502 . 1 1 57 57 ILE HA H 1 3.603 0.02 . 1 . . . B 420 ILE HA . 18534 1 503 . 1 1 57 57 ILE HB H 1 1.714 0.02 . 1 . . . B 420 ILE HB . 18534 1 504 . 1 1 57 57 ILE HD11 H 1 .890 0.02 . 1 . . . B 420 ILE HD11 . 18534 1 505 . 1 1 57 57 ILE HD12 H 1 .890 0.02 . 1 . . . B 420 ILE HD12 . 18534 1 506 . 1 1 57 57 ILE HD13 H 1 .890 0.02 . 1 . . . B 420 ILE HD13 . 18534 1 507 . 1 1 57 57 ILE CA C 13 62.320 0.3 . 1 . . . B 420 ILE CA . 18534 1 508 . 1 1 57 57 ILE CB C 13 36.220 0.3 . 1 . . . B 420 ILE CB . 18534 1 509 . 1 1 57 57 ILE CG1 C 13 25.810 0.3 . 1 . . . B 420 ILE CG1 . 18534 1 510 . 1 1 57 57 ILE CG2 C 13 20.970 0.3 . 1 . . . B 420 ILE CG2 . 18534 1 511 . 1 1 57 57 ILE CD1 C 13 22.460 0.3 . 1 . . . B 420 ILE CD1 . 18534 1 512 . 1 1 57 57 ILE N N 15 118.750 0.3 . 1 . . . B 420 ILE N . 18534 1 513 . 1 1 58 58 LYS H H 1 8.077 0.02 . 1 . . . B 421 LYS H . 18534 1 514 . 1 1 58 58 LYS HA H 1 3.870 0.02 . 1 . . . B 421 LYS HA . 18534 1 515 . 1 1 58 58 LYS HB2 H 1 1.730 0.02 . 2 . . . B 421 LYS HB2 . 18534 1 516 . 1 1 58 58 LYS HB3 H 1 1.680 0.02 . 2 . . . B 421 LYS HB3 . 18534 1 517 . 1 1 58 58 LYS HG2 H 1 1.560 0.02 . 2 . . . B 421 LYS HG2 . 18534 1 518 . 1 1 58 58 LYS HD2 H 1 1.393 0.02 . 2 . . . B 421 LYS HD2 . 18534 1 519 . 1 1 58 58 LYS HD3 H 1 1.151 0.02 . 2 . . . B 421 LYS HD3 . 18534 1 520 . 1 1 58 58 LYS HE2 H 1 2.843 0.02 . 2 . . . B 421 LYS HE2 . 18534 1 521 . 1 1 58 58 LYS CA C 13 57.250 0.3 . 1 . . . B 421 LYS CA . 18534 1 522 . 1 1 58 58 LYS CB C 13 29.440 0.3 . 1 . . . B 421 LYS CB . 18534 1 523 . 1 1 58 58 LYS CG C 13 26.740 0.3 . 1 . . . B 421 LYS CG . 18534 1 524 . 1 1 58 58 LYS CD C 13 22.420 0.3 . 1 . . . B 421 LYS CD . 18534 1 525 . 1 1 58 58 LYS CE C 13 39.670 0.3 . 1 . . . B 421 LYS CE . 18534 1 526 . 1 1 58 58 LYS N N 15 123.970 0.3 . 1 . . . B 421 LYS N . 18534 1 527 . 1 1 59 59 ILE H H 1 8.545 0.02 . 1 . . . B 422 ILE H . 18534 1 528 . 1 1 59 59 ILE HA H 1 3.652 0.02 . 1 . . . B 422 ILE HA . 18534 1 529 . 1 1 59 59 ILE HB H 1 1.571 0.02 . 1 . . . B 422 ILE HB . 18534 1 530 . 1 1 59 59 ILE HD11 H 1 .793 0.02 . 1 . . . B 422 ILE HD11 . 18534 1 531 . 1 1 59 59 ILE HD12 H 1 .793 0.02 . 1 . . . B 422 ILE HD12 . 18534 1 532 . 1 1 59 59 ILE HD13 H 1 .793 0.02 . 1 . . . B 422 ILE HD13 . 18534 1 533 . 1 1 59 59 ILE CA C 13 60.900 0.3 . 1 . . . B 422 ILE CA . 18534 1 534 . 1 1 59 59 ILE CB C 13 35.750 0.3 . 1 . . . B 422 ILE CB . 18534 1 535 . 1 1 59 59 ILE CG1 C 13 26.550 0.3 . 1 . . . B 422 ILE CG1 . 18534 1 536 . 1 1 59 59 ILE CG2 C 13 15.590 0.3 . 1 . . . B 422 ILE CG2 . 18534 1 537 . 1 1 59 59 ILE CD1 C 13 10.520 0.3 . 1 . . . B 422 ILE CD1 . 18534 1 538 . 1 1 59 59 ILE N N 15 118.740 0.3 . 1 . . . B 422 ILE N . 18534 1 539 . 1 1 60 60 ALA H H 1 8.106 0.02 . 1 . . . B 423 ALA H . 18534 1 540 . 1 1 60 60 ALA HA H 1 3.544 0.02 . 1 . . . B 423 ALA HA . 18534 1 541 . 1 1 60 60 ALA HB1 H 1 1.169 0.02 . 1 . . . B 423 ALA HB1 . 18534 1 542 . 1 1 60 60 ALA HB2 H 1 1.169 0.02 . 1 . . . B 423 ALA HB2 . 18534 1 543 . 1 1 60 60 ALA HB3 H 1 1.169 0.02 . 1 . . . B 423 ALA HB3 . 18534 1 544 . 1 1 60 60 ALA CA C 13 53.310 0.3 . 1 . . . B 423 ALA CA . 18534 1 545 . 1 1 60 60 ALA CB C 13 15.860 0.3 . 1 . . . B 423 ALA CB . 18534 1 546 . 1 1 60 60 ALA N N 15 121.700 0.3 . 1 . . . B 423 ALA N . 18534 1 547 . 1 1 61 61 GLY H H 1 8.069 0.02 . 1 . . . B 424 GLY H . 18534 1 548 . 1 1 61 61 GLY HA2 H 1 3.817 0.02 . 2 . . . B 424 GLY HA2 . 18534 1 549 . 1 1 61 61 GLY HA3 H 1 3.817 0.02 . 2 . . . B 424 GLY HA3 . 18534 1 550 . 1 1 61 61 GLY CA C 13 44.780 0.3 . 1 . . . B 424 GLY CA . 18534 1 551 . 1 1 61 61 GLY N N 15 103.980 0.3 . 1 . . . B 424 GLY N . 18534 1 552 . 1 1 62 62 ILE H H 1 7.602 0.02 . 1 . . . B 425 ILE H . 18534 1 553 . 1 1 62 62 ILE HA H 1 3.470 0.02 . 1 . . . B 425 ILE HA . 18534 1 554 . 1 1 62 62 ILE HB H 1 1.970 0.02 . 1 . . . B 425 ILE HB . 18534 1 555 . 1 1 62 62 ILE HD11 H 1 .872 0.02 . 1 . . . B 425 ILE HD11 . 18534 1 556 . 1 1 62 62 ILE HD12 H 1 .872 0.02 . 1 . . . B 425 ILE HD12 . 18534 1 557 . 1 1 62 62 ILE HD13 H 1 .872 0.02 . 1 . . . B 425 ILE HD13 . 18534 1 558 . 1 1 62 62 ILE CA C 13 63.100 0.3 . 1 . . . B 425 ILE CA . 18534 1 559 . 1 1 62 62 ILE CB C 13 35.080 0.3 . 1 . . . B 425 ILE CB . 18534 1 560 . 1 1 62 62 ILE CG2 C 13 15.860 0.3 . 1 . . . B 425 ILE CG2 . 18534 1 561 . 1 1 62 62 ILE N N 15 122.230 0.3 . 1 . . . B 425 ILE N . 18534 1 562 . 1 1 63 63 ARG H H 1 8.329 0.02 . 1 . . . B 426 ARG H . 18534 1 563 . 1 1 63 63 ARG HA H 1 4.074 0.02 . 1 . . . B 426 ARG HA . 18534 1 564 . 1 1 63 63 ARG HB2 H 1 1.894 0.02 . 2 . . . B 426 ARG HB2 . 18534 1 565 . 1 1 63 63 ARG HG2 H 1 1.706 0.02 . 2 . . . B 426 ARG HG2 . 18534 1 566 . 1 1 63 63 ARG HD2 H 1 3.196 0.02 . 2 . . . B 426 ARG HD2 . 18534 1 567 . 1 1 63 63 ARG CA C 13 56.420 0.3 . 1 . . . B 426 ARG CA . 18534 1 568 . 1 1 63 63 ARG CB C 13 27.550 0.3 . 1 . . . B 426 ARG CB . 18534 1 569 . 1 1 63 63 ARG CG C 13 24.920 0.3 . 1 . . . B 426 ARG CG . 18534 1 570 . 1 1 63 63 ARG CD C 13 41.080 0.3 . 1 . . . B 426 ARG CD . 18534 1 571 . 1 1 63 63 ARG N N 15 117.800 0.3 . 1 . . . B 426 ARG N . 18534 1 572 . 1 1 64 64 ALA H H 1 8.232 0.02 . 1 . . . B 427 ALA H . 18534 1 573 . 1 1 64 64 ALA HA H 1 3.672 0.02 . 1 . . . B 427 ALA HA . 18534 1 574 . 1 1 64 64 ALA HB1 H 1 1.490 0.02 . 1 . . . B 427 ALA HB1 . 18534 1 575 . 1 1 64 64 ALA HB2 H 1 1.490 0.02 . 1 . . . B 427 ALA HB2 . 18534 1 576 . 1 1 64 64 ALA HB3 H 1 1.490 0.02 . 1 . . . B 427 ALA HB3 . 18534 1 577 . 1 1 64 64 ALA CA C 13 53.150 0.3 . 1 . . . B 427 ALA CA . 18534 1 578 . 1 1 64 64 ALA CB C 13 15.700 0.3 . 1 . . . B 427 ALA CB . 18534 1 579 . 1 1 64 64 ALA N N 15 123.950 0.3 . 1 . . . B 427 ALA N . 18534 1 580 . 1 1 65 65 ALA H H 1 7.764 0.02 . 1 . . . B 428 ALA H . 18534 1 581 . 1 1 65 65 ALA HA H 1 4.072 0.02 . 1 . . . B 428 ALA HA . 18534 1 582 . 1 1 65 65 ALA HB1 H 1 1.511 0.02 . 1 . . . B 428 ALA HB1 . 18534 1 583 . 1 1 65 65 ALA HB2 H 1 1.511 0.02 . 1 . . . B 428 ALA HB2 . 18534 1 584 . 1 1 65 65 ALA HB3 H 1 1.511 0.02 . 1 . . . B 428 ALA HB3 . 18534 1 585 . 1 1 65 65 ALA CA C 13 52.580 0.3 . 1 . . . B 428 ALA CA . 18534 1 586 . 1 1 65 65 ALA CB C 13 15.650 0.3 . 1 . . . B 428 ALA CB . 18534 1 587 . 1 1 65 65 ALA N N 15 119.950 0.3 . 1 . . . B 428 ALA N . 18534 1 588 . 1 1 66 66 GLU H H 1 8.703 0.02 . 1 . . . B 429 GLU H . 18534 1 589 . 1 1 66 66 GLU HA H 1 3.763 0.02 . 1 . . . B 429 GLU HA . 18534 1 590 . 1 1 66 66 GLU HB2 H 1 2.212 0.02 . 2 . . . B 429 GLU HB2 . 18534 1 591 . 1 1 66 66 GLU HB3 H 1 1.878 0.02 . 2 . . . B 429 GLU HB3 . 18534 1 592 . 1 1 66 66 GLU HG2 H 1 2.092 0.02 . 2 . . . B 429 GLU HG2 . 18534 1 593 . 1 1 66 66 GLU HG3 H 1 2.483 0.02 . 2 . . . B 429 GLU HG3 . 18534 1 594 . 1 1 66 66 GLU CA C 13 57.230 0.3 . 1 . . . B 429 GLU CA . 18534 1 595 . 1 1 66 66 GLU CB C 13 27.380 0.3 . 1 . . . B 429 GLU CB . 18534 1 596 . 1 1 66 66 GLU CG C 13 34.760 0.3 . 1 . . . B 429 GLU CG . 18534 1 597 . 1 1 66 66 GLU N N 15 116.970 0.3 . 1 . . . B 429 GLU N . 18534 1 598 . 1 1 67 67 ASN H H 1 8.191 0.02 . 1 . . . B 430 ASN H . 18534 1 599 . 1 1 67 67 ASN HA H 1 4.486 0.02 . 1 . . . B 430 ASN HA . 18534 1 600 . 1 1 67 67 ASN HB2 H 1 2.890 0.02 . 2 . . . B 430 ASN HB2 . 18534 1 601 . 1 1 67 67 ASN HD21 H 1 6.890 0.02 . 2 . . . B 430 ASN HD21 . 18534 1 602 . 1 1 67 67 ASN HD22 H 1 7.663 0.02 . 2 . . . B 430 ASN HD22 . 18534 1 603 . 1 1 67 67 ASN CA C 13 53.600 0.3 . 1 . . . B 430 ASN CA . 18534 1 604 . 1 1 67 67 ASN CB C 13 35.880 0.3 . 1 . . . B 430 ASN CB . 18534 1 605 . 1 1 67 67 ASN N N 15 116.780 0.3 . 1 . . . B 430 ASN N . 18534 1 606 . 1 1 67 67 ASN ND2 N 15 111.920 0.3 . 1 . . . B 430 ASN ND2 . 18534 1 607 . 1 1 68 68 ALA H H 1 8.136 0.02 . 1 . . . B 431 ALA H . 18534 1 608 . 1 1 68 68 ALA HA H 1 4.151 0.02 . 1 . . . B 431 ALA HA . 18534 1 609 . 1 1 68 68 ALA HB1 H 1 1.293 0.02 . 1 . . . B 431 ALA HB1 . 18534 1 610 . 1 1 68 68 ALA HB2 H 1 1.293 0.02 . 1 . . . B 431 ALA HB2 . 18534 1 611 . 1 1 68 68 ALA HB3 H 1 1.293 0.02 . 1 . . . B 431 ALA HB3 . 18534 1 612 . 1 1 68 68 ALA CA C 13 53.080 0.3 . 1 . . . B 431 ALA CA . 18534 1 613 . 1 1 68 68 ALA CB C 13 17.300 0.3 . 1 . . . B 431 ALA CB . 18534 1 614 . 1 1 68 68 ALA N N 15 125.780 0.3 . 1 . . . B 431 ALA N . 18534 1 615 . 1 1 69 69 LEU H H 1 7.961 0.02 . 1 . . . B 432 LEU H . 18534 1 616 . 1 1 69 69 LEU HA H 1 3.910 0.02 . 1 . . . B 432 LEU HA . 18534 1 617 . 1 1 69 69 LEU HB2 H 1 1.913 0.02 . 2 . . . B 432 LEU HB2 . 18534 1 618 . 1 1 69 69 LEU HD11 H 1 .851 0.02 . 2 . . . B 432 LEU HD11 . 18534 1 619 . 1 1 69 69 LEU HD12 H 1 .851 0.02 . 2 . . . B 432 LEU HD12 . 18534 1 620 . 1 1 69 69 LEU HD13 H 1 .851 0.02 . 2 . . . B 432 LEU HD13 . 18534 1 621 . 1 1 69 69 LEU HD21 H 1 .719 0.02 . 2 . . . B 432 LEU HD21 . 18534 1 622 . 1 1 69 69 LEU HD22 H 1 .719 0.02 . 2 . . . B 432 LEU HD22 . 18534 1 623 . 1 1 69 69 LEU HD23 H 1 .719 0.02 . 2 . . . B 432 LEU HD23 . 18534 1 624 . 1 1 69 69 LEU CA C 13 54.360 0.3 . 1 . . . B 432 LEU CA . 18534 1 625 . 1 1 69 69 LEU CB C 13 39.300 0.3 . 1 . . . B 432 LEU CB . 18534 1 626 . 1 1 69 69 LEU CD2 C 13 21.660 0.3 . 1 . . . B 432 LEU CD2 . 18534 1 627 . 1 1 69 69 LEU N N 15 113.890 0.3 . 1 . . . B 432 LEU N . 18534 1 628 . 1 1 70 70 ARG H H 1 7.203 0.02 . 1 . . . B 433 ARG H . 18534 1 629 . 1 1 70 70 ARG HA H 1 4.141 0.02 . 1 . . . B 433 ARG HA . 18534 1 630 . 1 1 70 70 ARG HB2 H 1 1.975 0.02 . 2 . . . B 433 ARG HB2 . 18534 1 631 . 1 1 70 70 ARG HG2 H 1 1.689 0.02 . 2 . . . B 433 ARG HG2 . 18534 1 632 . 1 1 70 70 ARG HG3 H 1 1.942 0.02 . 2 . . . B 433 ARG HG3 . 18534 1 633 . 1 1 70 70 ARG HD2 H 1 3.209 0.02 . 2 . . . B 433 ARG HD2 . 18534 1 634 . 1 1 70 70 ARG CA C 13 54.440 0.3 . 1 . . . B 433 ARG CA . 18534 1 635 . 1 1 70 70 ARG CB C 13 28.520 0.3 . 1 . . . B 433 ARG CB . 18534 1 636 . 1 1 70 70 ARG CG C 13 25.570 0.3 . 1 . . . B 433 ARG CG . 18534 1 637 . 1 1 70 70 ARG CD C 13 40.940 0.3 . 1 . . . B 433 ARG CD . 18534 1 638 . 1 1 70 70 ARG N N 15 114.460 0.3 . 1 . . . B 433 ARG N . 18534 1 639 . 1 1 71 71 ASP H H 1 7.651 0.02 . 1 . . . B 434 ASP H . 18534 1 640 . 1 1 71 71 ASP HA H 1 4.751 0.02 . 1 . . . B 434 ASP HA . 18534 1 641 . 1 1 71 71 ASP HB2 H 1 2.462 0.02 . 2 . . . B 434 ASP HB2 . 18534 1 642 . 1 1 71 71 ASP HB3 H 1 3.410 0.02 . 2 . . . B 434 ASP HB3 . 18534 1 643 . 1 1 71 71 ASP CA C 13 49.920 0.3 . 1 . . . B 434 ASP CA . 18534 1 644 . 1 1 71 71 ASP CB C 13 36.900 0.3 . 1 . . . B 434 ASP CB . 18534 1 645 . 1 1 71 71 ASP N N 15 120.200 0.3 . 1 . . . B 434 ASP N . 18534 1 646 . 1 1 72 72 LYS H H 1 7.783 0.02 . 1 . . . B 435 LYS H . 18534 1 647 . 1 1 72 72 LYS HA H 1 3.852 0.02 . 1 . . . B 435 LYS HA . 18534 1 648 . 1 1 72 72 LYS HB2 H 1 1.849 0.02 . 2 . . . B 435 LYS HB2 . 18534 1 649 . 1 1 72 72 LYS HG2 H 1 1.498 0.02 . 2 . . . B 435 LYS HG2 . 18534 1 650 . 1 1 72 72 LYS HD2 H 1 1.631 0.02 . 2 . . . B 435 LYS HD2 . 18534 1 651 . 1 1 72 72 LYS HE2 H 1 2.962 0.02 . 2 . . . B 435 LYS HE2 . 18534 1 652 . 1 1 72 72 LYS CA C 13 56.670 0.3 . 1 . . . B 435 LYS CA . 18534 1 653 . 1 1 72 72 LYS CB C 13 29.560 0.3 . 1 . . . B 435 LYS CB . 18534 1 654 . 1 1 72 72 LYS CG C 13 22.500 0.3 . 1 . . . B 435 LYS CG . 18534 1 655 . 1 1 72 72 LYS CD C 13 25.990 0.3 . 1 . . . B 435 LYS CD . 18534 1 656 . 1 1 72 72 LYS CE C 13 39.670 0.3 . 1 . . . B 435 LYS CE . 18534 1 657 . 1 1 72 72 LYS N N 15 122.200 0.3 . 1 . . . B 435 LYS N . 18534 1 658 . 1 1 73 73 LYS H H 1 8.134 0.02 . 1 . . . B 436 LYS H . 18534 1 659 . 1 1 73 73 LYS HA H 1 4.094 0.02 . 1 . . . B 436 LYS HA . 18534 1 660 . 1 1 73 73 LYS HB2 H 1 1.834 0.02 . 2 . . . B 436 LYS HB2 . 18534 1 661 . 1 1 73 73 LYS HG2 H 1 1.371 0.02 . 2 . . . B 436 LYS HG2 . 18534 1 662 . 1 1 73 73 LYS HD2 H 1 1.667 0.02 . 2 . . . B 436 LYS HD2 . 18534 1 663 . 1 1 73 73 LYS HE2 H 1 2.930 0.02 . 2 . . . B 436 LYS HE2 . 18534 1 664 . 1 1 73 73 LYS CA C 13 56.880 0.3 . 1 . . . B 436 LYS CA . 18534 1 665 . 1 1 73 73 LYS CB C 13 29.360 0.3 . 1 . . . B 436 LYS CB . 18534 1 666 . 1 1 73 73 LYS CG C 13 22.600 0.3 . 1 . . . B 436 LYS CG . 18534 1 667 . 1 1 73 73 LYS CD C 13 26.500 0.3 . 1 . . . B 436 LYS CD . 18534 1 668 . 1 1 73 73 LYS CE C 13 39.350 0.3 . 1 . . . B 436 LYS CE . 18534 1 669 . 1 1 73 73 LYS N N 15 117.900 0.3 . 1 . . . B 436 LYS N . 18534 1 670 . 1 1 74 74 MET H H 1 7.507 0.02 . 1 . . . B 437 MET H . 18534 1 671 . 1 1 74 74 MET HA H 1 4.240 0.02 . 1 . . . B 437 MET HA . 18534 1 672 . 1 1 74 74 MET HB2 H 1 2.212 0.02 . 2 . . . B 437 MET HB2 . 18534 1 673 . 1 1 74 74 MET HB3 H 1 2.072 0.02 . 2 . . . B 437 MET HB3 . 18534 1 674 . 1 1 74 74 MET HG2 H 1 2.818 0.02 . 2 . . . B 437 MET HG2 . 18534 1 675 . 1 1 74 74 MET HG3 H 1 2.612 0.02 . 2 . . . B 437 MET HG3 . 18534 1 676 . 1 1 74 74 MET HE1 H 1 2.064 0.02 . 1 . . . B 437 MET HE1 . 18534 1 677 . 1 1 74 74 MET HE2 H 1 2.064 0.02 . 1 . . . B 437 MET HE2 . 18534 1 678 . 1 1 74 74 MET HE3 H 1 2.064 0.02 . 1 . . . B 437 MET HE3 . 18534 1 679 . 1 1 74 74 MET CA C 13 55.750 0.3 . 1 . . . B 437 MET CA . 18534 1 680 . 1 1 74 74 MET CB C 13 28.720 0.3 . 1 . . . B 437 MET CB . 18534 1 681 . 1 1 74 74 MET CG C 13 29.750 0.3 . 1 . . . B 437 MET CG . 18534 1 682 . 1 1 74 74 MET CE C 13 15.400 0.3 . 1 . . . B 437 MET CE . 18534 1 683 . 1 1 74 74 MET N N 15 121.260 0.3 . 1 . . . B 437 MET N . 18534 1 684 . 1 1 75 75 LEU H H 1 8.176 0.02 . 1 . . . B 438 LEU H . 18534 1 685 . 1 1 75 75 LEU HA H 1 4.023 0.02 . 1 . . . B 438 LEU HA . 18534 1 686 . 1 1 75 75 LEU HB2 H 1 1.846 0.02 . 2 . . . B 438 LEU HB2 . 18534 1 687 . 1 1 75 75 LEU HB3 H 1 1.410 0.02 . 2 . . . B 438 LEU HB3 . 18534 1 688 . 1 1 75 75 LEU HG H 1 1.929 0.02 . 1 . . . B 438 LEU HG . 18534 1 689 . 1 1 75 75 LEU HD11 H 1 .734 0.02 . 2 . . . B 438 LEU HD11 . 18534 1 690 . 1 1 75 75 LEU HD12 H 1 .734 0.02 . 2 . . . B 438 LEU HD12 . 18534 1 691 . 1 1 75 75 LEU HD13 H 1 .734 0.02 . 2 . . . B 438 LEU HD13 . 18534 1 692 . 1 1 75 75 LEU HD21 H 1 .848 0.02 . 2 . . . B 438 LEU HD21 . 18534 1 693 . 1 1 75 75 LEU HD22 H 1 .848 0.02 . 2 . . . B 438 LEU HD22 . 18534 1 694 . 1 1 75 75 LEU HD23 H 1 .848 0.02 . 2 . . . B 438 LEU HD23 . 18534 1 695 . 1 1 75 75 LEU CA C 13 55.550 0.3 . 1 . . . B 438 LEU CA . 18534 1 696 . 1 1 75 75 LEU CB C 13 39.310 0.3 . 1 . . . B 438 LEU CB . 18534 1 697 . 1 1 75 75 LEU CG C 13 23.700 0.3 . 1 . . . B 438 LEU CG . 18534 1 698 . 1 1 75 75 LEU CD1 C 13 20.960 0.3 . 1 . . . B 438 LEU CD1 . 18534 1 699 . 1 1 75 75 LEU CD2 C 13 23.440 0.3 . 1 . . . B 438 LEU CD2 . 18534 1 700 . 1 1 75 75 LEU N N 15 118.750 0.3 . 1 . . . B 438 LEU N . 18534 1 701 . 1 1 76 76 ASP H H 1 8.109 0.02 . 1 . . . B 439 ASP H . 18534 1 702 . 1 1 76 76 ASP HA H 1 4.310 0.02 . 1 . . . B 439 ASP HA . 18534 1 703 . 1 1 76 76 ASP HB2 H 1 2.760 0.02 . 2 . . . B 439 ASP HB2 . 18534 1 704 . 1 1 76 76 ASP HB3 H 1 2.579 0.02 . 2 . . . B 439 ASP HB3 . 18534 1 705 . 1 1 76 76 ASP CA C 13 54.860 0.3 . 1 . . . B 439 ASP CA . 18534 1 706 . 1 1 76 76 ASP CB C 13 38.710 0.3 . 1 . . . B 439 ASP CB . 18534 1 707 . 1 1 76 76 ASP N N 15 117.400 0.3 . 1 . . . B 439 ASP N . 18534 1 708 . 1 1 77 77 PHE H H 1 7.644 0.02 . 1 . . . B 440 PHE H . 18534 1 709 . 1 1 77 77 PHE HA H 1 4.014 0.02 . 1 . . . B 440 PHE HA . 18534 1 710 . 1 1 77 77 PHE HB2 H 1 3.072 0.02 . 2 . . . B 440 PHE HB2 . 18534 1 711 . 1 1 77 77 PHE HD2 H 1 6.950 0.02 . 3 . . . B 440 PHE HD2 . 18534 1 712 . 1 1 77 77 PHE HE2 H 1 7.065 0.02 . 3 . . . B 440 PHE HE2 . 18534 1 713 . 1 1 77 77 PHE HZ H 1 6.379 0.02 . 1 . . . B 440 PHE HZ . 18534 1 714 . 1 1 77 77 PHE CA C 13 59.220 0.3 . 1 . . . B 440 PHE CA . 18534 1 715 . 1 1 77 77 PHE CB C 13 36.540 0.3 . 1 . . . B 440 PHE CB . 18534 1 716 . 1 1 77 77 PHE N N 15 119.030 0.3 . 1 . . . B 440 PHE N . 18534 1 717 . 1 1 78 78 TYR H H 1 8.211 0.02 . 1 . . . B 441 TYR H . 18534 1 718 . 1 1 78 78 TYR HA H 1 4.036 0.02 . 1 . . . B 441 TYR HA . 18534 1 719 . 1 1 78 78 TYR HB2 H 1 3.266 0.02 . 2 . . . B 441 TYR HB2 . 18534 1 720 . 1 1 78 78 TYR HB3 H 1 2.795 0.02 . 2 . . . B 441 TYR HB3 . 18534 1 721 . 1 1 78 78 TYR HD1 H 1 7.298 0.02 . 3 . . . B 441 TYR HD1 . 18534 1 722 . 1 1 78 78 TYR HE1 H 1 6.800 0.02 . 3 . . . B 441 TYR HE1 . 18534 1 723 . 1 1 78 78 TYR CA C 13 60.900 0.3 . 1 . . . B 441 TYR CA . 18534 1 724 . 1 1 78 78 TYR CB C 13 35.700 0.3 . 1 . . . B 441 TYR CB . 18534 1 725 . 1 1 78 78 TYR N N 15 117.260 0.3 . 1 . . . B 441 TYR N . 18534 1 726 . 1 1 79 79 ALA H H 1 8.976 0.02 . 1 . . . B 442 ALA H . 18534 1 727 . 1 1 79 79 ALA HA H 1 4.100 0.02 . 1 . . . B 442 ALA HA . 18534 1 728 . 1 1 79 79 ALA HB1 H 1 1.503 0.02 . 1 . . . B 442 ALA HB1 . 18534 1 729 . 1 1 79 79 ALA HB2 H 1 1.503 0.02 . 1 . . . B 442 ALA HB2 . 18534 1 730 . 1 1 79 79 ALA HB3 H 1 1.503 0.02 . 1 . . . B 442 ALA HB3 . 18534 1 731 . 1 1 79 79 ALA CA C 13 53.170 0.3 . 1 . . . B 442 ALA CA . 18534 1 732 . 1 1 79 79 ALA CB C 13 15.800 0.3 . 1 . . . B 442 ALA CB . 18534 1 733 . 1 1 79 79 ALA N N 15 124.390 0.3 . 1 . . . B 442 ALA N . 18534 1 734 . 1 1 80 80 LYS H H 1 7.794 0.02 . 1 . . . B 443 LYS H . 18534 1 735 . 1 1 80 80 LYS HA H 1 3.919 0.02 . 1 . . . B 443 LYS HA . 18534 1 736 . 1 1 80 80 LYS HB2 H 1 1.711 0.02 . 2 . . . B 443 LYS HB2 . 18534 1 737 . 1 1 80 80 LYS HG2 H 1 1.263 0.02 . 2 . . . B 443 LYS HG2 . 18534 1 738 . 1 1 80 80 LYS HG3 H 1 1.486 0.02 . 2 . . . B 443 LYS HG3 . 18534 1 739 . 1 1 80 80 LYS HD2 H 1 1.497 0.02 . 2 . . . B 443 LYS HD2 . 18534 1 740 . 1 1 80 80 LYS HE2 H 1 2.848 0.02 . 2 . . . B 443 LYS HE2 . 18534 1 741 . 1 1 80 80 LYS CA C 13 56.710 0.3 . 1 . . . B 443 LYS CA . 18534 1 742 . 1 1 80 80 LYS CB C 13 29.390 0.3 . 1 . . . B 443 LYS CB . 18534 1 743 . 1 1 80 80 LYS CG C 13 23.270 0.3 . 1 . . . B 443 LYS CG . 18534 1 744 . 1 1 80 80 LYS CD C 13 26.360 0.3 . 1 . . . B 443 LYS CD . 18534 1 745 . 1 1 80 80 LYS CE C 13 39.600 0.3 . 1 . . . B 443 LYS CE . 18534 1 746 . 1 1 80 80 LYS N N 15 118.550 0.3 . 1 . . . B 443 LYS N . 18534 1 747 . 1 1 81 81 GLN H H 1 7.461 0.02 . 1 . . . B 444 GLN H . 18534 1 748 . 1 1 81 81 GLN HA H 1 3.785 0.02 . 1 . . . B 444 GLN HA . 18534 1 749 . 1 1 81 81 GLN HB2 H 1 2.004 0.02 . 2 . . . B 444 GLN HB2 . 18534 1 750 . 1 1 81 81 GLN HG2 H 1 1.885 0.02 . 2 . . . B 444 GLN HG2 . 18534 1 751 . 1 1 81 81 GLN HE21 H 1 6.794 0.02 . 2 . . . B 444 GLN HE21 . 18534 1 752 . 1 1 81 81 GLN HE22 H 1 6.876 0.02 . 2 . . . B 444 GLN HE22 . 18534 1 753 . 1 1 81 81 GLN CA C 13 56.110 0.3 . 1 . . . B 444 GLN CA . 18534 1 754 . 1 1 81 81 GLN CB C 13 31.600 0.3 . 1 . . . B 444 GLN CB . 18534 1 755 . 1 1 81 81 GLN CG C 13 26.400 0.3 . 1 . . . B 444 GLN CG . 18534 1 756 . 1 1 81 81 GLN N N 15 118.980 0.3 . 1 . . . B 444 GLN N . 18534 1 757 . 1 1 81 81 GLN NE2 N 15 111.220 0.3 . 1 . . . B 444 GLN NE2 . 18534 1 758 . 1 1 82 82 ARG H H 1 7.997 0.02 . 1 . . . B 445 ARG H . 18534 1 759 . 1 1 82 82 ARG HA H 1 3.293 0.02 . 1 . . . B 445 ARG HA . 18534 1 760 . 1 1 82 82 ARG HB2 H 1 1.884 0.02 . 2 . . . B 445 ARG HB2 . 18534 1 761 . 1 1 82 82 ARG HB3 H 1 1.751 0.02 . 2 . . . B 445 ARG HB3 . 18534 1 762 . 1 1 82 82 ARG HG2 H 1 1.261 0.02 . 2 . . . B 445 ARG HG2 . 18534 1 763 . 1 1 82 82 ARG HD2 H 1 2.965 0.02 . 2 . . . B 445 ARG HD2 . 18534 1 764 . 1 1 82 82 ARG HD3 H 1 2.774 0.02 . 2 . . . B 445 ARG HD3 . 18534 1 765 . 1 1 82 82 ARG CA C 13 55.930 0.3 . 1 . . . B 445 ARG CA . 18534 1 766 . 1 1 82 82 ARG CB C 13 27.580 0.3 . 1 . . . B 445 ARG CB . 18534 1 767 . 1 1 82 82 ARG CG C 13 24.030 0.3 . 1 . . . B 445 ARG CG . 18534 1 768 . 1 1 82 82 ARG CD C 13 41.800 0.3 . 1 . . . B 445 ARG CD . 18534 1 769 . 1 1 82 82 ARG N N 15 118.660 0.3 . 1 . . . B 445 ARG N . 18534 1 770 . 1 1 83 83 ALA H H 1 7.450 0.02 . 1 . . . B 446 ALA H . 18534 1 771 . 1 1 83 83 ALA HA H 1 4.100 0.02 . 1 . . . B 446 ALA HA . 18534 1 772 . 1 1 83 83 ALA HB1 H 1 1.338 0.02 . 1 . . . B 446 ALA HB1 . 18534 1 773 . 1 1 83 83 ALA HB2 H 1 1.338 0.02 . 1 . . . B 446 ALA HB2 . 18534 1 774 . 1 1 83 83 ALA HB3 H 1 1.338 0.02 . 1 . . . B 446 ALA HB3 . 18534 1 775 . 1 1 83 83 ALA CA C 13 50.720 0.3 . 1 . . . B 446 ALA CA . 18534 1 776 . 1 1 83 83 ALA CB C 13 16.070 0.3 . 1 . . . B 446 ALA CB . 18534 1 777 . 1 1 83 83 ALA N N 15 119.110 0.3 . 1 . . . B 446 ALA N . 18534 1 778 . 1 1 84 84 ALA H H 1 7.240 0.02 . 1 . . . B 447 ALA H . 18534 1 779 . 1 1 84 84 ALA HA H 1 4.182 0.02 . 1 . . . B 447 ALA HA . 18534 1 780 . 1 1 84 84 ALA HB1 H 1 1.288 0.02 . 1 . . . B 447 ALA HB1 . 18534 1 781 . 1 1 84 84 ALA HB2 H 1 1.288 0.02 . 1 . . . B 447 ALA HB2 . 18534 1 782 . 1 1 84 84 ALA HB3 H 1 1.288 0.02 . 1 . . . B 447 ALA HB3 . 18534 1 783 . 1 1 84 84 ALA CA C 13 49.720 0.3 . 1 . . . B 447 ALA CA . 18534 1 784 . 1 1 84 84 ALA CB C 13 16.550 0.3 . 1 . . . B 447 ALA CB . 18534 1 785 . 1 1 84 84 ALA N N 15 118.860 0.3 . 1 . . . B 447 ALA N . 18534 1 786 . 1 1 85 85 ILE H H 1 7.262 0.02 . 1 . . . B 448 ILE H . 18534 1 787 . 1 1 85 85 ILE HA H 1 4.170 0.02 . 1 . . . B 448 ILE HA . 18534 1 788 . 1 1 85 85 ILE HB H 1 1.688 0.02 . 1 . . . B 448 ILE HB . 18534 1 789 . 1 1 85 85 ILE HD11 H 1 .773 0.02 . 1 . . . B 448 ILE HD11 . 18534 1 790 . 1 1 85 85 ILE HD12 H 1 .773 0.02 . 1 . . . B 448 ILE HD12 . 18534 1 791 . 1 1 85 85 ILE HD13 H 1 .773 0.02 . 1 . . . B 448 ILE HD13 . 18534 1 792 . 1 1 85 85 ILE CA C 13 56.800 0.3 . 1 . . . B 448 ILE CA . 18534 1 793 . 1 1 85 85 ILE CB C 13 35.690 0.3 . 1 . . . B 448 ILE CB . 18534 1 794 . 1 1 85 85 ILE CG1 C 13 24.380 0.3 . 1 . . . B 448 ILE CG1 . 18534 1 795 . 1 1 85 85 ILE CG2 C 13 14.280 0.3 . 1 . . . B 448 ILE CG2 . 18534 1 796 . 1 1 85 85 ILE CD1 C 13 10.160 0.3 . 1 . . . B 448 ILE CD1 . 18534 1 797 . 1 1 85 85 ILE N N 15 121.050 0.3 . 1 . . . B 448 ILE N . 18534 1 798 . 1 1 86 86 PRO HA H 1 4.326 0.02 . 1 . . . B 449 PRO HA . 18534 1 799 . 1 1 86 86 PRO HB2 H 1 2.199 0.02 . 2 . . . B 449 PRO HB2 . 18534 1 800 . 1 1 86 86 PRO HB3 H 1 1.810 0.02 . 2 . . . B 449 PRO HB3 . 18534 1 801 . 1 1 86 86 PRO HG2 H 1 1.957 0.02 . 2 . . . B 449 PRO HG2 . 18534 1 802 . 1 1 86 86 PRO HD2 H 1 3.848 0.02 . 2 . . . B 449 PRO HD2 . 18534 1 803 . 1 1 86 86 PRO HD3 H 1 3.549 0.02 . 2 . . . B 449 PRO HD3 . 18534 1 804 . 1 1 86 86 PRO CA C 13 60.730 0.3 . 1 . . . B 449 PRO CA . 18534 1 805 . 1 1 86 86 PRO CB C 13 29.310 0.3 . 1 . . . B 449 PRO CB . 18534 1 806 . 1 1 86 86 PRO CG C 13 24.020 0.3 . 1 . . . B 449 PRO CG . 18534 1 807 . 1 1 86 86 PRO CD C 13 48.200 0.3 . 1 . . . B 449 PRO CD . 18534 1 808 . 1 1 87 87 ARG H H 1 8.318 0.02 . 1 . . . B 450 ARG H . 18534 1 809 . 1 1 87 87 ARG HA H 1 4.266 0.02 . 1 . . . B 450 ARG HA . 18534 1 810 . 1 1 87 87 ARG HB2 H 1 1.677 0.02 . 2 . . . B 450 ARG HB2 . 18534 1 811 . 1 1 87 87 ARG HB3 H 1 1.788 0.02 . 2 . . . B 450 ARG HB3 . 18534 1 812 . 1 1 87 87 ARG HG2 H 1 1.557 0.02 . 2 . . . B 450 ARG HG2 . 18534 1 813 . 1 1 87 87 ARG HD2 H 1 3.076 0.02 . 2 . . . B 450 ARG HD2 . 18534 1 814 . 1 1 87 87 ARG CA C 13 53.430 0.3 . 1 . . . B 450 ARG CA . 18534 1 815 . 1 1 87 87 ARG CB C 13 28.390 0.3 . 1 . . . B 450 ARG CB . 18534 1 816 . 1 1 87 87 ARG CG C 13 24.650 0.3 . 1 . . . B 450 ARG CG . 18534 1 817 . 1 1 87 87 ARG CD C 13 40.660 0.3 . 1 . . . B 450 ARG CD . 18534 1 818 . 1 1 87 87 ARG N N 15 121.240 0.3 . 1 . . . B 450 ARG N . 18534 1 819 . 1 1 88 88 SER H H 1 8.263 0.02 . 1 . . . B 451 SER H . 18534 1 820 . 1 1 88 88 SER HA H 1 3.809 0.02 . 1 . . . B 451 SER HA . 18534 1 821 . 1 1 88 88 SER HB2 H 1 4.399 0.02 . 2 . . . B 451 SER HB2 . 18534 1 822 . 1 1 88 88 SER CA C 13 61.230 0.3 . 1 . . . B 451 SER CA . 18534 1 823 . 1 1 88 88 SER CB C 13 55.960 0.3 . 1 . . . B 451 SER CB . 18534 1 824 . 1 1 88 88 SER N N 15 116.270 0.3 . 1 . . . B 451 SER N . 18534 1 825 . 1 1 89 89 GLU H H 1 8.347 0.02 . 1 . . . B 452 GLU H . 18534 1 826 . 1 1 89 89 GLU HA H 1 4.330 0.02 . 1 . . . B 452 GLU HA . 18534 1 827 . 1 1 89 89 GLU HB2 H 1 1.860 0.02 . 2 . . . B 452 GLU HB2 . 18534 1 828 . 1 1 89 89 GLU HB3 H 1 2.070 0.02 . 2 . . . B 452 GLU HB3 . 18534 1 829 . 1 1 89 89 GLU HG2 H 1 2.197 0.02 . 2 . . . B 452 GLU HG2 . 18534 1 830 . 1 1 89 89 GLU CA C 13 54.120 0.3 . 1 . . . B 452 GLU CA . 18534 1 831 . 1 1 89 89 GLU CB C 13 27.910 0.3 . 1 . . . B 452 GLU CB . 18534 1 832 . 1 1 89 89 GLU CG C 13 33.820 0.3 . 1 . . . B 452 GLU CG . 18534 1 833 . 1 1 89 89 GLU N N 15 122.600 0.3 . 1 . . . B 452 GLU N . 18534 1 834 . 1 1 90 90 SER H H 1 7.851 0.02 . 1 . . . B 453 SER H . 18534 1 835 . 1 1 90 90 SER HA H 1 4.195 0.02 . 1 . . . B 453 SER HA . 18534 1 836 . 1 1 90 90 SER HB2 H 1 3.776 0.02 . 2 . . . B 453 SER HB2 . 18534 1 837 . 1 1 90 90 SER CA C 13 62.460 0.3 . 1 . . . B 453 SER CA . 18534 1 838 . 1 1 90 90 SER CB C 13 57.590 0.3 . 1 . . . B 453 SER CB . 18534 1 839 . 1 1 90 90 SER N N 15 121.300 0.3 . 1 . . . B 453 SER N . 18534 1 840 . 2 2 1 1 G H1 H 1 12.9 0.02 . 1 . . . A 1 G H1 . 18534 1 841 . 2 2 1 1 G H1' H 1 5.816 0.02 . 1 . . . A 1 G H1' . 18534 1 842 . 2 2 1 1 G H2' H 1 5.01 0.02 . 1 . . . A 1 G H2' . 18534 1 843 . 2 2 1 1 G H3' H 1 4.766 0.02 . 1 . . . A 1 G H3' . 18534 1 844 . 2 2 1 1 G H4' H 1 4.6 0.02 . 1 . . . A 1 G H4' . 18534 1 845 . 2 2 1 1 G H5' H 1 4.33 0.02 . 1 . . . A 1 G H5' . 18534 1 846 . 2 2 1 1 G H5'' H 1 4.423 0.02 . 1 . . . A 1 G H5'' . 18534 1 847 . 2 2 1 1 G H8 H 1 8.133 0.02 . 1 . . . A 1 G H8 . 18534 1 848 . 2 2 1 1 G C1' C 13 92.1 0.2 . 1 . . . A 1 G C1' . 18534 1 849 . 2 2 1 1 G C2' C 13 74.44 0.2 . 1 . . . A 1 G C2' . 18534 1 850 . 2 2 1 1 G C3' C 13 74.2 0.2 . 1 . . . A 1 G C3' . 18534 1 851 . 2 2 1 1 G C4' C 13 83 0.2 . 1 . . . A 1 G C4' . 18534 1 852 . 2 2 1 1 G C5' C 13 67.02 0.2 . 1 . . . A 1 G C5' . 18534 1 853 . 2 2 1 1 G C8 C 13 138.6 0.2 . 1 . . . A 1 G C8 . 18534 1 854 . 2 2 2 2 G H1 H 1 11.13 0.02 . 1 . . . A 2 G H1 . 18534 1 855 . 2 2 2 2 G H1' H 1 5.867 0.02 . 1 . . . A 2 G H1' . 18534 1 856 . 2 2 2 2 G H2' H 1 4.503 0.02 . 1 . . . A 2 G H2' . 18534 1 857 . 2 2 2 2 G H3' H 1 4.554 0.02 . 1 . . . A 2 G H3' . 18534 1 858 . 2 2 2 2 G H4' H 1 4.52 0.02 . 1 . . . A 2 G H4' . 18534 1 859 . 2 2 2 2 G H5' H 1 4.32 0.02 . 1 . . . A 2 G H5' . 18534 1 860 . 2 2 2 2 G H5'' H 1 4.5 0.02 . 1 . . . A 2 G H5'' . 18534 1 861 . 2 2 2 2 G H8 H 1 7.396 0.02 . 1 . . . A 2 G H8 . 18534 1 862 . 2 2 2 2 G C1' C 13 92.22 0.2 . 1 . . . A 2 G C1' . 18534 1 863 . 2 2 2 2 G C2' C 13 75.2 0.2 . 1 . . . A 2 G C2' . 18534 1 864 . 2 2 2 2 G C3' C 13 72.08 0.2 . 1 . . . A 2 G C3' . 18534 1 865 . 2 2 2 2 G C4' C 13 82.02 0.2 . 1 . . . A 2 G C4' . 18534 1 866 . 2 2 2 2 G C5' C 13 66.2 0.2 . 1 . . . A 2 G C5' . 18534 1 867 . 2 2 2 2 G C8 C 13 137.4 0.2 . 1 . . . A 2 G C8 . 18534 1 868 . 2 2 3 3 G H1 H 1 12.53 0.02 . 1 . . . A 3 G H1 . 18534 1 869 . 2 2 3 3 G H1' H 1 5.75 0.02 . 1 . . . A 3 G H1' . 18534 1 870 . 2 2 3 3 G H2' H 1 4.34 0.02 . 1 . . . A 3 G H2' . 18534 1 871 . 2 2 3 3 G H3' H 1 4.33 0.02 . 1 . . . A 3 G H3' . 18534 1 872 . 2 2 3 3 G H4' H 1 4.573 0.02 . 1 . . . A 3 G H4' . 18534 1 873 . 2 2 3 3 G H5' H 1 4.222 0.02 . 1 . . . A 3 G H5' . 18534 1 874 . 2 2 3 3 G H5'' H 1 4.49 0.02 . 1 . . . A 3 G H5'' . 18534 1 875 . 2 2 3 3 G H8 H 1 7.196 0.02 . 1 . . . A 3 G H8 . 18534 1 876 . 2 2 3 3 G C1' C 13 92.5 0.2 . 1 . . . A 3 G C1' . 18534 1 877 . 2 2 3 3 G C2' C 13 74.1 0.2 . 1 . . . A 3 G C2' . 18534 1 878 . 2 2 3 3 G C3' C 13 72.2 0.2 . 1 . . . A 3 G C3' . 18534 1 879 . 2 2 3 3 G C4' C 13 83.6 0.2 . 1 . . . A 3 G C4' . 18534 1 880 . 2 2 3 3 G C5' C 13 65.33 0.2 . 1 . . . A 3 G C5' . 18534 1 881 . 2 2 3 3 G C8 C 13 138.2 0.2 . 1 . . . A 3 G C8 . 18534 1 882 . 2 2 4 4 A H1' H 1 5.924 0.02 . 1 . . . A 4 A H1' . 18534 1 883 . 2 2 4 4 A H2 H 1 7.623 0.02 . 1 . . . A 4 A H2 . 18534 1 884 . 2 2 4 4 A H2' H 1 4.55 0.02 . 1 . . . A 4 A H2' . 18534 1 885 . 2 2 4 4 A H3' H 1 4.65 0.02 . 1 . . . A 4 A H3' . 18534 1 886 . 2 2 4 4 A H4' H 1 4.412 0.02 . 1 . . . A 4 A H4' . 18534 1 887 . 2 2 4 4 A H5' H 1 4.239 0.02 . 1 . . . A 4 A H5' . 18534 1 888 . 2 2 4 4 A H5'' H 1 4.41 0.02 . 1 . . . A 4 A H5'' . 18534 1 889 . 2 2 4 4 A H8 H 1 7.688 0.02 . 1 . . . A 4 A H8 . 18534 1 890 . 2 2 4 4 A C1' C 13 93.3 0.2 . 1 . . . A 4 A C1' . 18534 1 891 . 2 2 4 4 A C2 C 13 153.6 0.2 . 1 . . . A 4 A C2 . 18534 1 892 . 2 2 4 4 A C2' C 13 73.9 0.2 . 1 . . . A 4 A C2' . 18534 1 893 . 2 2 4 4 A C3' C 13 73.55 0.2 . 1 . . . A 4 A C3' . 18534 1 894 . 2 2 4 4 A C4' C 13 83.77 0.2 . 1 . . . A 4 A C4' . 18534 1 895 . 2 2 4 4 A C5' C 13 65.8 0.2 . 1 . . . A 4 A C5' . 18534 1 896 . 2 2 4 4 A C8 C 13 136.9 0.2 . 1 . . . A 4 A C8 . 18534 1 897 . 2 2 5 5 U H1' H 1 5.38 0.02 . 1 . . . A 5 U H1' . 18534 1 898 . 2 2 5 5 U H2' H 1 4.323 0.02 . 1 . . . A 5 U H2' . 18534 1 899 . 2 2 5 5 U H3 H 1 13.46 0.02 . 1 . . . A 5 U H3 . 18534 1 900 . 2 2 5 5 U H3' H 1 4.244 0.02 . 1 . . . A 5 U H3' . 18534 1 901 . 2 2 5 5 U H4' H 1 4.328 0.02 . 1 . . . A 5 U H4' . 18534 1 902 . 2 2 5 5 U H5 H 1 4.997 0.02 . 1 . . . A 5 U H5 . 18534 1 903 . 2 2 5 5 U H5' H 1 4.463 0.02 . 1 . . . A 5 U H5' . 18534 1 904 . 2 2 5 5 U H5'' H 1 4.463 0.02 . 1 . . . A 5 U H5'' . 18534 1 905 . 2 2 5 5 U H6 H 1 7.537 0.02 . 1 . . . A 5 U H6 . 18534 1 906 . 2 2 5 5 U C1' C 13 93.1 0.2 . 1 . . . A 5 U C1' . 18534 1 907 . 2 2 5 5 U C2' C 13 72.01 0.2 . 1 . . . A 5 U C2' . 18534 1 908 . 2 2 5 5 U C3' C 13 71.66 0.2 . 1 . . . A 5 U C3' . 18534 1 909 . 2 2 5 5 U C4' C 13 82 0.2 . 1 . . . A 5 U C4' . 18534 1 910 . 2 2 5 5 U C5 C 13 102.9 0.2 . 1 . . . A 5 U C5 . 18534 1 911 . 2 2 5 5 U C5' C 13 64.62 0.2 . 1 . . . A 5 U C5' . 18534 1 912 . 2 2 5 5 U C6 C 13 139.6 0.2 . 1 . . . A 5 U C6 . 18534 1 913 . 2 2 6 6 A H1' H 1 5.955 0.02 . 1 . . . A 6 A H1' . 18534 1 914 . 2 2 6 6 A H2 H 1 7.081 0.02 . 1 . . . A 6 A H2 . 18534 1 915 . 2 2 6 6 A H2' H 1 4.53 0.02 . 1 . . . A 6 A H2' . 18534 1 916 . 2 2 6 6 A H3' H 1 4.333 0.02 . 1 . . . A 6 A H3' . 18534 1 917 . 2 2 6 6 A H4' H 1 4.401 0.02 . 1 . . . A 6 A H4' . 18534 1 918 . 2 2 6 6 A H5' H 1 4.234 0.02 . 1 . . . A 6 A H5' . 18534 1 919 . 2 2 6 6 A H5'' H 1 4.56 0.02 . 1 . . . A 6 A H5'' . 18534 1 920 . 2 2 6 6 A H8 H 1 8.063 0.02 . 1 . . . A 6 A H8 . 18534 1 921 . 2 2 6 6 A C1' C 13 92.8 0.2 . 1 . . . A 6 A C1' . 18534 1 922 . 2 2 6 6 A C2 C 13 151.9 0.2 . 1 . . . A 6 A C2 . 18534 1 923 . 2 2 6 6 A C2' C 13 74 0.2 . 1 . . . A 6 A C2' . 18534 1 924 . 2 2 6 6 A C3' C 13 74.33 0.2 . 1 . . . A 6 A C3' . 18534 1 925 . 2 2 6 6 A C4' C 13 82.33 0.2 . 1 . . . A 6 A C4' . 18534 1 926 . 2 2 6 6 A C5' C 13 64.23 0.2 . 1 . . . A 6 A C5' . 18534 1 927 . 2 2 6 6 A C8 C 13 138.2 0.2 . 1 . . . A 6 A C8 . 18534 1 928 . 2 2 7 7 C H1' H 1 5.29 0.02 . 1 . . . A 7 C H1' . 18534 1 929 . 2 2 7 7 C H2' H 1 4.4 0.02 . 1 . . . A 7 C H2' . 18534 1 930 . 2 2 7 7 C H3' H 1 4.56 0.02 . 1 . . . A 7 C H3' . 18534 1 931 . 2 2 7 7 C H4' H 1 4.347 0.02 . 1 . . . A 7 C H4' . 18534 1 932 . 2 2 7 7 C H5 H 1 5.127 0.02 . 1 . . . A 7 C H5 . 18534 1 933 . 2 2 7 7 C H5' H 1 4.334 0.02 . 1 . . . A 7 C H5' . 18534 1 934 . 2 2 7 7 C H5'' H 1 4.476 0.02 . 1 . . . A 7 C H5'' . 18534 1 935 . 2 2 7 7 C H6 H 1 7.456 0.02 . 1 . . . A 7 C H6 . 18534 1 936 . 2 2 7 7 C C1' C 13 93.7 0.2 . 1 . . . A 7 C C1' . 18534 1 937 . 2 2 7 7 C C2' C 13 75.03 0.2 . 1 . . . A 7 C C2' . 18534 1 938 . 2 2 7 7 C C3' C 13 73.8 0.2 . 1 . . . A 7 C C3' . 18534 1 939 . 2 2 7 7 C C4' C 13 84.23 0.2 . 1 . . . A 7 C C4' . 18534 1 940 . 2 2 7 7 C C5 C 13 96.3 0.2 . 1 . . . A 7 C C5 . 18534 1 941 . 2 2 7 7 C C5' C 13 65.22 0.2 . 1 . . . A 7 C C5' . 18534 1 942 . 2 2 7 7 C C6 C 13 141.3 0.2 . 1 . . . A 7 C C6 . 18534 1 943 . 2 2 8 8 C H1' H 1 5.378 0.02 . 1 . . . A 8 C H1' . 18534 1 944 . 2 2 8 8 C H2' H 1 4.35 0.02 . 1 . . . A 8 C H2' . 18534 1 945 . 2 2 8 8 C H3' H 1 4.666 0.02 . 1 . . . A 8 C H3' . 18534 1 946 . 2 2 8 8 C H4' H 1 4.467 0.02 . 1 . . . A 8 C H4' . 18534 1 947 . 2 2 8 8 C H5 H 1 5.387 0.02 . 1 . . . A 8 C H5 . 18534 1 948 . 2 2 8 8 C H5' H 1 4.29 0.02 . 1 . . . A 8 C H5' . 18534 1 949 . 2 2 8 8 C H5'' H 1 4.302 0.02 . 1 . . . A 8 C H5'' . 18534 1 950 . 2 2 8 8 C H6 H 1 7.638 0.02 . 1 . . . A 8 C H6 . 18534 1 951 . 2 2 8 8 C C1' C 13 93.8 0.2 . 1 . . . A 8 C C1' . 18534 1 952 . 2 2 8 8 C C2' C 13 73.55 0.2 . 1 . . . A 8 C C2' . 18534 1 953 . 2 2 8 8 C C3' C 13 74.3 0.2 . 1 . . . A 8 C C3' . 18534 1 954 . 2 2 8 8 C C4' C 13 83.66 0.2 . 1 . . . A 8 C C4' . 18534 1 955 . 2 2 8 8 C C5 C 13 95.44 0.2 . 1 . . . A 8 C C5 . 18534 1 956 . 2 2 8 8 C C5' C 13 64.89 0.2 . 1 . . . A 8 C C5' . 18534 1 957 . 2 2 8 8 C C6 C 13 140.2 0.2 . 1 . . . A 8 C C6 . 18534 1 958 . 2 2 9 9 A H1' H 1 5.847 0.02 . 1 . . . A 9 A H1' . 18534 1 959 . 2 2 9 9 A H2 H 1 7.276 0.02 . 1 . . . A 9 A H2 . 18534 1 960 . 2 2 9 9 A H2' H 1 4.441 0.02 . 1 . . . A 9 A H2' . 18534 1 961 . 2 2 9 9 A H3' H 1 4.572 0.02 . 1 . . . A 9 A H3' . 18534 1 962 . 2 2 9 9 A H4' H 1 4.062 0.02 . 1 . . . A 9 A H4' . 18534 1 963 . 2 2 9 9 A H5' H 1 4.375 0.02 . 1 . . . A 9 A H5' . 18534 1 964 . 2 2 9 9 A H5'' H 1 4.464 0.02 . 1 . . . A 9 A H5'' . 18534 1 965 . 2 2 9 9 A H8 H 1 7.876 0.02 . 1 . . . A 9 A H8 . 18534 1 966 . 2 2 9 9 A C1' C 13 93.3 0.2 . 1 . . . A 9 A C1' . 18534 1 967 . 2 2 9 9 A C2 C 13 152.4 0.2 . 1 . . . A 9 A C2 . 18534 1 968 . 2 2 9 9 A C2' C 13 74.22 0.2 . 1 . . . A 9 A C2' . 18534 1 969 . 2 2 9 9 A C3' C 13 72.3 0.2 . 1 . . . A 9 A C3' . 18534 1 970 . 2 2 9 9 A C4' C 13 83.56 0.2 . 1 . . . A 9 A C4' . 18534 1 971 . 2 2 9 9 A C5' C 13 65.32 0.2 . 1 . . . A 9 A C5' . 18534 1 972 . 2 2 9 9 A C8 C 13 138.5 0.2 . 1 . . . A 9 A C8 . 18534 1 973 . 2 2 10 10 U H1' H 1 5.266 0.02 . 1 . . . A 10 U H1' . 18534 1 974 . 2 2 10 10 U H2' H 1 4.146 0.02 . 1 . . . A 10 U H2' . 18534 1 975 . 2 2 10 10 U H3 H 1 11.62 0.02 . 1 . . . A 10 U H3 . 18534 1 976 . 2 2 10 10 U H3' H 1 4.448 0.02 . 1 . . . A 10 U H3' . 18534 1 977 . 2 2 10 10 U H4' H 1 4.344 0.02 . 1 . . . A 10 U H4' . 18534 1 978 . 2 2 10 10 U H5 H 1 5.31 0.02 . 1 . . . A 10 U H5 . 18534 1 979 . 2 2 10 10 U H5' H 1 4.42 0.02 . 1 . . . A 10 U H5' . 18534 1 980 . 2 2 10 10 U H5'' H 1 4.63 0.02 . 1 . . . A 10 U H5'' . 18534 1 981 . 2 2 10 10 U H6 H 1 7.424 0.02 . 1 . . . A 10 U H6 . 18534 1 982 . 2 2 10 10 U C1' C 13 92.5 0.2 . 1 . . . A 10 U C1' . 18534 1 983 . 2 2 10 10 U C2' C 13 73.9 0.2 . 1 . . . A 10 U C2' . 18534 1 984 . 2 2 10 10 U C3' C 13 71.34 0.2 . 1 . . . A 10 U C3' . 18534 1 985 . 2 2 10 10 U C4' C 13 82.43 0.2 . 1 . . . A 10 U C4' . 18534 1 986 . 2 2 10 10 U C5 C 13 104.2 0.2 . 1 . . . A 10 U C5 . 18534 1 987 . 2 2 10 10 U C5' C 13 65.9 0.2 . 1 . . . A 10 U C5' . 18534 1 988 . 2 2 10 10 U C6 C 13 139.2 0.2 . 1 . . . A 10 U C6 . 18534 1 989 . 2 2 11 11 G H1 H 1 13.09 0.02 . 1 . . . A 11 G H1 . 18534 1 990 . 2 2 11 11 G H1' H 1 5.668 0.02 . 1 . . . A 11 G H1' . 18534 1 991 . 2 2 11 11 G H2' H 1 4.475 0.02 . 1 . . . A 11 G H2' . 18534 1 992 . 2 2 11 11 G H3' H 1 4.62 0.02 . 1 . . . A 11 G H3' . 18534 1 993 . 2 2 11 11 G H4' H 1 4.592 0.02 . 1 . . . A 11 G H4' . 18534 1 994 . 2 2 11 11 G H5' H 1 4.323 0.02 . 1 . . . A 11 G H5' . 18534 1 995 . 2 2 11 11 G H5'' H 1 4.51 0.02 . 1 . . . A 11 G H5'' . 18534 1 996 . 2 2 11 11 G H8 H 1 7.863 0.02 . 1 . . . A 11 G H8 . 18534 1 997 . 2 2 11 11 G C1' C 13 92.44 0.2 . 1 . . . A 11 G C1' . 18534 1 998 . 2 2 11 11 G C2' C 13 74.3 0.2 . 1 . . . A 11 G C2' . 18534 1 999 . 2 2 11 11 G C3' C 13 75.11 0.2 . 1 . . . A 11 G C3' . 18534 1 1000 . 2 2 11 11 G C4' C 13 82.55 0.2 . 1 . . . A 11 G C4' . 18534 1 1001 . 2 2 11 11 G C5' C 13 66.22 0.2 . 1 . . . A 11 G C5' . 18534 1 1002 . 2 2 11 11 G C8 C 13 136.8 0.2 . 1 . . . A 11 G C8 . 18534 1 1003 . 2 2 12 12 U H1' H 1 5.442 0.02 . 1 . . . A 12 U H1' . 18534 1 1004 . 2 2 12 12 U H2' H 1 4.51 0.02 . 1 . . . A 12 U H2' . 18534 1 1005 . 2 2 12 12 U H3 H 1 14.46 0.02 . 1 . . . A 12 U H3 . 18534 1 1006 . 2 2 12 12 U H3' H 1 4.522 0.02 . 1 . . . A 12 U H3' . 18534 1 1007 . 2 2 12 12 U H4' H 1 4.509 0.02 . 1 . . . A 12 U H4' . 18534 1 1008 . 2 2 12 12 U H5 H 1 5.033 0.02 . 1 . . . A 12 U H5 . 18534 1 1009 . 2 2 12 12 U H5' H 1 4.17 0.02 . 1 . . . A 12 U H5' . 18534 1 1010 . 2 2 12 12 U H5'' H 1 4.633 0.02 . 1 . . . A 12 U H5'' . 18534 1 1011 . 2 2 12 12 U H6 H 1 7.715 0.02 . 1 . . . A 12 U H6 . 18534 1 1012 . 2 2 12 12 U C1' C 13 94.33 0.2 . 1 . . . A 12 U C1' . 18534 1 1013 . 2 2 12 12 U C2' C 13 74.77 0.2 . 1 . . . A 12 U C2' . 18534 1 1014 . 2 2 12 12 U C3' C 13 72.09 0.2 . 1 . . . A 12 U C3' . 18534 1 1015 . 2 2 12 12 U C4' C 13 82.33 0.2 . 1 . . . A 12 U C4' . 18534 1 1016 . 2 2 12 12 U C5 C 13 103.1 0.2 . 1 . . . A 12 U C5 . 18534 1 1017 . 2 2 12 12 U C5' C 13 64.08 0.2 . 1 . . . A 12 U C5' . 18534 1 1018 . 2 2 12 12 U C6 C 13 141.4 0.2 . 1 . . . A 12 U C6 . 18534 1 1019 . 2 2 13 13 U H1' H 1 5.545 0.02 . 1 . . . A 13 U H1' . 18534 1 1020 . 2 2 13 13 U H2' H 1 4.299 0.02 . 1 . . . A 13 U H2' . 18534 1 1021 . 2 2 13 13 U H3 H 1 14 0.02 . 1 . . . A 13 U H3 . 18534 1 1022 . 2 2 13 13 U H3' H 1 4.41 0.02 . 1 . . . A 13 U H3' . 18534 1 1023 . 2 2 13 13 U H4' H 1 4.37 0.02 . 1 . . . A 13 U H4' . 18534 1 1024 . 2 2 13 13 U H5 H 1 5.418 0.02 . 1 . . . A 13 U H5 . 18534 1 1025 . 2 2 13 13 U H5' H 1 4.038 0.02 . 1 . . . A 13 U H5' . 18534 1 1026 . 2 2 13 13 U H5'' H 1 4.476 0.02 . 1 . . . A 13 U H5'' . 18534 1 1027 . 2 2 13 13 U H6 H 1 7.904 0.02 . 1 . . . A 13 U H6 . 18534 1 1028 . 2 2 13 13 U C1' C 13 93.65 0.2 . 1 . . . A 13 U C1' . 18534 1 1029 . 2 2 13 13 U C2' C 13 74.5 0.2 . 1 . . . A 13 U C2' . 18534 1 1030 . 2 2 13 13 U C3' C 13 72.5 0.2 . 1 . . . A 13 U C3' . 18534 1 1031 . 2 2 13 13 U C4' C 13 81.6 0.2 . 1 . . . A 13 U C4' . 18534 1 1032 . 2 2 13 13 U C5 C 13 103 0.2 . 1 . . . A 13 U C5 . 18534 1 1033 . 2 2 13 13 U C5' C 13 64.5 0.2 . 1 . . . A 13 U C5' . 18534 1 1034 . 2 2 13 13 U C6 C 13 141.9 0.2 . 1 . . . A 13 U C6 . 18534 1 1035 . 2 2 14 14 C H1' H 1 5.4 0.02 . 1 . . . A 14 C H1' . 18534 1 1036 . 2 2 14 14 C H2' H 1 4.453 0.02 . 1 . . . A 14 C H2' . 18534 1 1037 . 2 2 14 14 C H3' H 1 4.28 0.02 . 1 . . . A 14 C H3' . 18534 1 1038 . 2 2 14 14 C H4' H 1 4.39 0.02 . 1 . . . A 14 C H4' . 18534 1 1039 . 2 2 14 14 C H5 H 1 5.204 0.02 . 1 . . . A 14 C H5 . 18534 1 1040 . 2 2 14 14 C H5' H 1 4.102 0.02 . 1 . . . A 14 C H5' . 18534 1 1041 . 2 2 14 14 C H5'' H 1 4.4 0.02 . 1 . . . A 14 C H5'' . 18534 1 1042 . 2 2 14 14 C H6 H 1 7.508 0.02 . 1 . . . A 14 C H6 . 18534 1 1043 . 2 2 14 14 C C1' C 13 93.2 0.2 . 1 . . . A 14 C C1' . 18534 1 1044 . 2 2 14 14 C C2' C 13 74.5 0.2 . 1 . . . A 14 C C2' . 18534 1 1045 . 2 2 14 14 C C3' C 13 72.33 0.2 . 1 . . . A 14 C C3' . 18534 1 1046 . 2 2 14 14 C C4' C 13 82.3 0.2 . 1 . . . A 14 C C4' . 18534 1 1047 . 2 2 14 14 C C5 C 13 96.9 0.2 . 1 . . . A 14 C C5 . 18534 1 1048 . 2 2 14 14 C C5' C 13 65.3 0.2 . 1 . . . A 14 C C5' . 18534 1 1049 . 2 2 14 14 C C6 C 13 140.7 0.2 . 1 . . . A 14 C C6 . 18534 1 1050 . 2 2 15 15 A H1' H 1 5.527 0.02 . 1 . . . A 15 A H1' . 18534 1 1051 . 2 2 15 15 A H2 H 1 7.304 0.02 . 1 . . . A 15 A H2 . 18534 1 1052 . 2 2 15 15 A H2' H 1 4.42 0.02 . 1 . . . A 15 A H2' . 18534 1 1053 . 2 2 15 15 A H3' H 1 4.59 0.02 . 1 . . . A 15 A H3' . 18534 1 1054 . 2 2 15 15 A H4' H 1 4.307 0.02 . 1 . . . A 15 A H4' . 18534 1 1055 . 2 2 15 15 A H5' H 1 4.203 0.02 . 1 . . . A 15 A H5' . 18534 1 1056 . 2 2 15 15 A H5'' H 1 4.5 0.02 . 1 . . . A 15 A H5'' . 18534 1 1057 . 2 2 15 15 A H8 H 1 7.977 0.02 . 1 . . . A 15 A H8 . 18534 1 1058 . 2 2 15 15 A C1' C 13 93.4 0.2 . 1 . . . A 15 A C1' . 18534 1 1059 . 2 2 15 15 A C2 C 13 153.5 0.2 . 1 . . . A 15 A C2 . 18534 1 1060 . 2 2 15 15 A C2' C 13 75.3 0.2 . 1 . . . A 15 A C2' . 18534 1 1061 . 2 2 15 15 A C3' C 13 73 0.2 . 1 . . . A 15 A C3' . 18534 1 1062 . 2 2 15 15 A C4' C 13 82.4 0.2 . 1 . . . A 15 A C4' . 18534 1 1063 . 2 2 15 15 A C5' C 13 65.8 0.2 . 1 . . . A 15 A C5' . 18534 1 1064 . 2 2 15 15 A C8 C 13 139.8 0.2 . 1 . . . A 15 A C8 . 18534 1 1065 . 2 2 16 16 G H1 H 1 10.5 0.02 . 1 . . . A 16 G H1 . 18534 1 1066 . 2 2 16 16 G H1' H 1 5.203 0.02 . 1 . . . A 16 G H1' . 18534 1 1067 . 2 2 16 16 G H2' H 1 4.58 0.02 . 1 . . . A 16 G H2' . 18534 1 1068 . 2 2 16 16 G H3' H 1 4.45 0.02 . 1 . . . A 16 G H3' . 18534 1 1069 . 2 2 16 16 G H4' H 1 3.801 0.02 . 1 . . . A 16 G H4' . 18534 1 1070 . 2 2 16 16 G H5' H 1 3.9 0.02 . 1 . . . A 16 G H5' . 18534 1 1071 . 2 2 16 16 G H5'' H 1 4.05 0.02 . 1 . . . A 16 G H5'' . 18534 1 1072 . 2 2 16 16 G H8 H 1 7.501 0.02 . 1 . . . A 16 G H8 . 18534 1 1073 . 2 2 16 16 G C1' C 13 88.9 0.2 . 1 . . . A 16 G C1' . 18534 1 1074 . 2 2 16 16 G C2' C 13 73.2 0.2 . 1 . . . A 16 G C2' . 18534 1 1075 . 2 2 16 16 G C3' C 13 77.08 0.2 . 1 . . . A 16 G C3' . 18534 1 1076 . 2 2 16 16 G C4' C 13 83.5 0.2 . 1 . . . A 16 G C4' . 18534 1 1077 . 2 2 16 16 G C5' C 13 66.2 0.2 . 1 . . . A 16 G C5' . 18534 1 1078 . 2 2 16 16 G C8 C 13 140.4 0.2 . 1 . . . A 16 G C8 . 18534 1 1079 . 2 2 17 17 A H1' H 1 5.729 0.02 . 1 . . . A 17 A H1' . 18534 1 1080 . 2 2 17 17 A H2 H 1 8.052 0.02 . 1 . . . A 17 A H2 . 18534 1 1081 . 2 2 17 17 A H2' H 1 4.66 0.02 . 1 . . . A 17 A H2' . 18534 1 1082 . 2 2 17 17 A H3' H 1 4.75 0.02 . 1 . . . A 17 A H3' . 18534 1 1083 . 2 2 17 17 A H4' H 1 4.5 0.02 . 1 . . . A 17 A H4' . 18534 1 1084 . 2 2 17 17 A H5' H 1 3.95 0.02 . 1 . . . A 17 A H5' . 18534 1 1085 . 2 2 17 17 A H5'' H 1 3.91 0.02 . 1 . . . A 17 A H5'' . 18534 1 1086 . 2 2 17 17 A H8 H 1 8.053 0.02 . 1 . . . A 17 A H8 . 18534 1 1087 . 2 2 17 17 A C1' C 13 89.7 0.2 . 1 . . . A 17 A C1' . 18534 1 1088 . 2 2 17 17 A C2 C 13 154.5 0.2 . 1 . . . A 17 A C2 . 18534 1 1089 . 2 2 17 17 A C2' C 13 76.8 0.2 . 1 . . . A 17 A C2' . 18534 1 1090 . 2 2 17 17 A C3' C 13 76.22 0.2 . 1 . . . A 17 A C3' . 18534 1 1091 . 2 2 17 17 A C4' C 13 84.66 0.2 . 1 . . . A 17 A C4' . 18534 1 1092 . 2 2 17 17 A C5' C 13 67.3 0.2 . 1 . . . A 17 A C5' . 18534 1 1093 . 2 2 17 17 A C8 C 13 141.7 0.2 . 1 . . . A 17 A C8 . 18534 1 1094 . 2 2 18 18 A H1' H 1 6.068 0.02 . 1 . . . A 18 A H1' . 18534 1 1095 . 2 2 18 18 A H2 H 1 7.933 0.02 . 1 . . . A 18 A H2 . 18534 1 1096 . 2 2 18 18 A H2' H 1 4.793 0.02 . 1 . . . A 18 A H2' . 18534 1 1097 . 2 2 18 18 A H3' H 1 4.89 0.02 . 1 . . . A 18 A H3' . 18534 1 1098 . 2 2 18 18 A H4' H 1 4.594 0.02 . 1 . . . A 18 A H4' . 18534 1 1099 . 2 2 18 18 A H5' H 1 4.42 0.02 . 1 . . . A 18 A H5' . 18534 1 1100 . 2 2 18 18 A H5'' H 1 4.41 0.02 . 1 . . . A 18 A H5'' . 18534 1 1101 . 2 2 18 18 A H8 H 1 8.341 0.02 . 1 . . . A 18 A H8 . 18534 1 1102 . 2 2 18 18 A C1' C 13 90.2 0.2 . 1 . . . A 18 A C1' . 18534 1 1103 . 2 2 18 18 A C2 C 13 154.3 0.2 . 1 . . . A 18 A C2 . 18534 1 1104 . 2 2 18 18 A C2' C 13 76.5 0.2 . 1 . . . A 18 A C2' . 18534 1 1105 . 2 2 18 18 A C3' C 13 75.6 0.2 . 1 . . . A 18 A C3' . 18534 1 1106 . 2 2 18 18 A C4' C 13 83.4 0.2 . 1 . . . A 18 A C4' . 18534 1 1107 . 2 2 18 18 A C5' C 13 66.9 0.2 . 1 . . . A 18 A C5' . 18534 1 1108 . 2 2 18 18 A C8 C 13 141.6 0.2 . 1 . . . A 18 A C8 . 18534 1 1109 . 2 2 19 19 G H1' H 1 5.225 0.02 . 1 . . . A 19 G H1' . 18534 1 1110 . 2 2 19 19 G H2' H 1 4.658 0.02 . 1 . . . A 19 G H2' . 18534 1 1111 . 2 2 19 19 G H3' H 1 4.361 0.02 . 1 . . . A 19 G H3' . 18534 1 1112 . 2 2 19 19 G H4' H 1 4.499 0.02 . 1 . . . A 19 G H4' . 18534 1 1113 . 2 2 19 19 G H5' H 1 4.19 0.02 . 1 . . . A 19 G H5' . 18534 1 1114 . 2 2 19 19 G H5'' H 1 4.26 0.02 . 1 . . . A 19 G H5'' . 18534 1 1115 . 2 2 19 19 G H8 H 1 7.656 0.02 . 1 . . . A 19 G H8 . 18534 1 1116 . 2 2 19 19 G C1' C 13 92.5 0.2 . 1 . . . A 19 G C1' . 18534 1 1117 . 2 2 19 19 G C2' C 13 74.9 0.2 . 1 . . . A 19 G C2' . 18534 1 1118 . 2 2 19 19 G C3' C 13 74.2 0.2 . 1 . . . A 19 G C3' . 18534 1 1119 . 2 2 19 19 G C4' C 13 82.1 0.2 . 1 . . . A 19 G C4' . 18534 1 1120 . 2 2 19 19 G C5' C 13 68.6 0.2 . 1 . . . A 19 G C5' . 18534 1 1121 . 2 2 19 19 G C8 C 13 137.2 0.2 . 1 . . . A 19 G C8 . 18534 1 1122 . 2 2 20 20 A H1' H 1 5.756 0.02 . 1 . . . A 20 A H1' . 18534 1 1123 . 2 2 20 20 A H2 H 1 6.97 0.02 . 1 . . . A 20 A H2 . 18534 1 1124 . 2 2 20 20 A H2' H 1 4.64 0.02 . 1 . . . A 20 A H2' . 18534 1 1125 . 2 2 20 20 A H3' H 1 4.304 0.02 . 1 . . . A 20 A H3' . 18534 1 1126 . 2 2 20 20 A H4' H 1 4.352 0.02 . 1 . . . A 20 A H4' . 18534 1 1127 . 2 2 20 20 A H5' H 1 4.256 0.02 . 1 . . . A 20 A H5' . 18534 1 1128 . 2 2 20 20 A H5'' H 1 4.3 0.02 . 1 . . . A 20 A H5'' . 18534 1 1129 . 2 2 20 20 A H8 H 1 7.721 0.02 . 1 . . . A 20 A H8 . 18534 1 1130 . 2 2 20 20 A C1' C 13 93.1 0.2 . 1 . . . A 20 A C1' . 18534 1 1131 . 2 2 20 20 A C2 C 13 152.7 0.2 . 1 . . . A 20 A C2 . 18534 1 1132 . 2 2 20 20 A C2' C 13 72.1 0.2 . 1 . . . A 20 A C2' . 18534 1 1133 . 2 2 20 20 A C3' C 13 75 0.2 . 1 . . . A 20 A C3' . 18534 1 1134 . 2 2 20 20 A C4' C 13 82 0.2 . 1 . . . A 20 A C4' . 18534 1 1135 . 2 2 20 20 A C5' C 13 65.2 0.2 . 1 . . . A 20 A C5' . 18534 1 1136 . 2 2 20 20 A C8 C 13 139.4 0.2 . 1 . . . A 20 A C8 . 18534 1 1137 . 2 2 21 21 A H1' H 1 5.766 0.02 . 1 . . . A 21 A H1' . 18534 1 1138 . 2 2 21 21 A H2 H 1 7.637 0.02 . 1 . . . A 21 A H2 . 18534 1 1139 . 2 2 21 21 A H2' H 1 4.477 0.02 . 1 . . . A 21 A H2' . 18534 1 1140 . 2 2 21 21 A H3' H 1 4.6 0.02 . 1 . . . A 21 A H3' . 18534 1 1141 . 2 2 21 21 A H4' H 1 4.53 0.02 . 1 . . . A 21 A H4' . 18534 1 1142 . 2 2 21 21 A H5' H 1 4.205 0.02 . 1 . . . A 21 A H5' . 18534 1 1143 . 2 2 21 21 A H5'' H 1 4.65 0.02 . 1 . . . A 21 A H5'' . 18534 1 1144 . 2 2 21 21 A H8 H 1 7.728 0.02 . 1 . . . A 21 A H8 . 18534 1 1145 . 2 2 21 21 A C1' C 13 93.3 0.2 . 1 . . . A 21 A C1' . 18534 1 1146 . 2 2 21 21 A C2 C 13 153.4 0.2 . 1 . . . A 21 A C2 . 18534 1 1147 . 2 2 21 21 A C2' C 13 75.33 0.2 . 1 . . . A 21 A C2' . 18534 1 1148 . 2 2 21 21 A C3' C 13 72.45 0.2 . 1 . . . A 21 A C3' . 18534 1 1149 . 2 2 21 21 A C4' C 13 81.38 0.2 . 1 . . . A 21 A C4' . 18534 1 1150 . 2 2 21 21 A C5' C 13 64.2 0.2 . 1 . . . A 21 A C5' . 18534 1 1151 . 2 2 21 21 A C8 C 13 138.7 0.2 . 1 . . . A 21 A C8 . 18534 1 1152 . 2 2 22 22 C H1' H 1 5.398 0.02 . 1 . . . A 22 C H1' . 18534 1 1153 . 2 2 22 22 C H2' H 1 4.58 0.02 . 1 . . . A 22 C H2' . 18534 1 1154 . 2 2 22 22 C H3' H 1 4.559 0.02 . 1 . . . A 22 C H3' . 18534 1 1155 . 2 2 22 22 C H4' H 1 4.376 0.02 . 1 . . . A 22 C H4' . 18534 1 1156 . 2 2 22 22 C H5 H 1 5.053 0.02 . 1 . . . A 22 C H5 . 18534 1 1157 . 2 2 22 22 C H5' H 1 4.411 0.02 . 1 . . . A 22 C H5' . 18534 1 1158 . 2 2 22 22 C H5'' H 1 4.58 0.02 . 1 . . . A 22 C H5'' . 18534 1 1159 . 2 2 22 22 C H6 H 1 7.304 0.02 . 1 . . . A 22 C H6 . 18534 1 1160 . 2 2 22 22 C C1' C 13 93 0.2 . 1 . . . A 22 C C1' . 18534 1 1161 . 2 2 22 22 C C2' C 13 75.02 0.2 . 1 . . . A 22 C C2' . 18534 1 1162 . 2 2 22 22 C C3' C 13 74.2 0.2 . 1 . . . A 22 C C3' . 18534 1 1163 . 2 2 22 22 C C4' C 13 82.3 0.2 . 1 . . . A 22 C C4' . 18534 1 1164 . 2 2 22 22 C C5 C 13 96.7 0.2 . 1 . . . A 22 C C5 . 18534 1 1165 . 2 2 22 22 C C5' C 13 64.3 0.2 . 1 . . . A 22 C C5' . 18534 1 1166 . 2 2 22 22 C C6 C 13 140.2 0.2 . 1 . . . A 22 C C6 . 18534 1 1167 . 2 2 23 23 G H1 H 1 11.32 0.02 . 1 . . . A 23 G H1 . 18534 1 1168 . 2 2 23 23 G H1' H 1 5.615 0.02 . 1 . . . A 23 G H1' . 18534 1 1169 . 2 2 23 23 G H2' H 1 4.443 0.02 . 1 . . . A 23 G H2' . 18534 1 1170 . 2 2 23 23 G H3' H 1 4.2 0.02 . 1 . . . A 23 G H3' . 18534 1 1171 . 2 2 23 23 G H4' H 1 4.498 0.02 . 1 . . . A 23 G H4' . 18534 1 1172 . 2 2 23 23 G H5' H 1 4.222 0.02 . 1 . . . A 23 G H5' . 18534 1 1173 . 2 2 23 23 G H5'' H 1 4.466 0.02 . 1 . . . A 23 G H5'' . 18534 1 1174 . 2 2 23 23 G H8 H 1 7.354 0.02 . 1 . . . A 23 G H8 . 18534 1 1175 . 2 2 23 23 G C1' C 13 93.7 0.2 . 1 . . . A 23 G C1' . 18534 1 1176 . 2 2 23 23 G C2' C 13 74.2 0.2 . 1 . . . A 23 G C2' . 18534 1 1177 . 2 2 23 23 G C3' C 13 71.22 0.2 . 1 . . . A 23 G C3' . 18534 1 1178 . 2 2 23 23 G C4' C 13 83.68 0.2 . 1 . . . A 23 G C4' . 18534 1 1179 . 2 2 23 23 G C5' C 13 64.88 0.2 . 1 . . . A 23 G C5' . 18534 1 1180 . 2 2 23 23 G C8 C 13 137.9 0.2 . 1 . . . A 23 G C8 . 18534 1 1181 . 2 2 24 24 U H1' H 1 5.383 0.02 . 1 . . . A 24 U H1' . 18534 1 1182 . 2 2 24 24 U H2' H 1 4.38 0.02 . 1 . . . A 24 U H2' . 18534 1 1183 . 2 2 24 24 U H3 H 1 13.76 0.02 . 1 . . . A 24 U H3 . 18534 1 1184 . 2 2 24 24 U H3' H 1 4.633 0.02 . 1 . . . A 24 U H3' . 18534 1 1185 . 2 2 24 24 U H4' H 1 4.28 0.02 . 1 . . . A 24 U H4' . 18534 1 1186 . 2 2 24 24 U H5 H 1 5.05 0.02 . 1 . . . A 24 U H5 . 18534 1 1187 . 2 2 24 24 U H5' H 1 4.16 0.02 . 1 . . . A 24 U H5' . 18534 1 1188 . 2 2 24 24 U H5'' H 1 4.65 0.02 . 1 . . . A 24 U H5'' . 18534 1 1189 . 2 2 24 24 U H6 H 1 7.546 0.02 . 1 . . . A 24 U H6 . 18534 1 1190 . 2 2 24 24 U C1' C 13 93.23 0.2 . 1 . . . A 24 U C1' . 18534 1 1191 . 2 2 24 24 U C2' C 13 73.88 0.2 . 1 . . . A 24 U C2' . 18534 1 1192 . 2 2 24 24 U C3' C 13 74.77 0.2 . 1 . . . A 24 U C3' . 18534 1 1193 . 2 2 24 24 U C4' C 13 82.63 0.2 . 1 . . . A 24 U C4' . 18534 1 1194 . 2 2 24 24 U C5 C 13 103.4 0.2 . 1 . . . A 24 U C5 . 18534 1 1195 . 2 2 24 24 U C5' C 13 65 0.2 . 1 . . . A 24 U C5' . 18534 1 1196 . 2 2 24 24 U C6 C 13 139.4 0.2 . 1 . . . A 24 U C6 . 18534 1 1197 . 2 2 25 25 G H1 H 1 12.2 0.02 . 1 . . . A 25 G H1 . 18534 1 1198 . 2 2 25 25 G H1' H 1 5.738 0.02 . 1 . . . A 25 G H1' . 18534 1 1199 . 2 2 25 25 G H2' H 1 4.61 0.02 . 1 . . . A 25 G H2' . 18534 1 1200 . 2 2 25 25 G H3' H 1 4.406 0.02 . 1 . . . A 25 G H3' . 18534 1 1201 . 2 2 25 25 G H4' H 1 4.478 0.02 . 1 . . . A 25 G H4' . 18534 1 1202 . 2 2 25 25 G H5' H 1 4.102 0.02 . 1 . . . A 25 G H5' . 18534 1 1203 . 2 2 25 25 G H5'' H 1 4.539 0.02 . 1 . . . A 25 G H5'' . 18534 1 1204 . 2 2 25 25 G H8 H 1 7.572 0.02 . 1 . . . A 25 G H8 . 18534 1 1205 . 2 2 25 25 G C1' C 13 92.44 0.2 . 1 . . . A 25 G C1' . 18534 1 1206 . 2 2 25 25 G C2' C 13 75.39 0.2 . 1 . . . A 25 G C2' . 18534 1 1207 . 2 2 25 25 G C3' C 13 73.4 0.2 . 1 . . . A 25 G C3' . 18534 1 1208 . 2 2 25 25 G C4' C 13 83 0.2 . 1 . . . A 25 G C4' . 18534 1 1209 . 2 2 25 25 G C5' C 13 64.34 0.2 . 1 . . . A 25 G C5' . 18534 1 1210 . 2 2 25 25 G C8 C 13 138 0.2 . 1 . . . A 25 G C8 . 18534 1 1211 . 2 2 26 26 G H1 H 1 13.2 0.02 . 1 . . . A 26 G H1 . 18534 1 1212 . 2 2 26 26 G H1' H 1 5.598 0.02 . 1 . . . A 26 G H1' . 18534 1 1213 . 2 2 26 26 G H2' H 1 4.555 0.02 . 1 . . . A 26 G H2' . 18534 1 1214 . 2 2 26 26 G H3' H 1 4.388 0.02 . 1 . . . A 26 G H3' . 18534 1 1215 . 2 2 26 26 G H4' H 1 4.377 0.02 . 1 . . . A 26 G H4' . 18534 1 1216 . 2 2 26 26 G H5' H 1 4.214 0.02 . 1 . . . A 26 G H5' . 18534 1 1217 . 2 2 26 26 G H5'' H 1 4.444 0.02 . 1 . . . A 26 G H5'' . 18534 1 1218 . 2 2 26 26 G H8 H 1 7.152 0.02 . 1 . . . A 26 G H8 . 18534 1 1219 . 2 2 26 26 G C1' C 13 93.2 0.2 . 1 . . . A 26 G C1' . 18534 1 1220 . 2 2 26 26 G C2' C 13 73.99 0.2 . 1 . . . A 26 G C2' . 18534 1 1221 . 2 2 26 26 G C3' C 13 75.2 0.2 . 1 . . . A 26 G C3' . 18534 1 1222 . 2 2 26 26 G C4' C 13 82.47 0.2 . 1 . . . A 26 G C4' . 18534 1 1223 . 2 2 26 26 G C5' C 13 65.3 0.2 . 1 . . . A 26 G C5' . 18534 1 1224 . 2 2 26 26 G C8 C 13 137.4 0.2 . 1 . . . A 26 G C8 . 18534 1 1225 . 2 2 27 27 U H1' H 1 5.39 0.02 . 1 . . . A 27 U H1' . 18534 1 1226 . 2 2 27 27 U H2' H 1 4.477 0.02 . 1 . . . A 27 U H2' . 18534 1 1227 . 2 2 27 27 U H3 H 1 13.67 0.02 . 1 . . . A 27 U H3 . 18534 1 1228 . 2 2 27 27 U H3' H 1 4.433 0.02 . 1 . . . A 27 U H3' . 18534 1 1229 . 2 2 27 27 U H4' H 1 4.45 0.02 . 1 . . . A 27 U H4' . 18534 1 1230 . 2 2 27 27 U H5 H 1 5.019 0.02 . 1 . . . A 27 U H5 . 18534 1 1231 . 2 2 27 27 U H5' H 1 4.301 0.02 . 1 . . . A 27 U H5' . 18534 1 1232 . 2 2 27 27 U H5'' H 1 4.564 0.02 . 1 . . . A 27 U H5'' . 18534 1 1233 . 2 2 27 27 U H6 H 1 7.661 0.02 . 1 . . . A 27 U H6 . 18534 1 1234 . 2 2 27 27 U C1' C 13 93.2 0.2 . 1 . . . A 27 U C1' . 18534 1 1235 . 2 2 27 27 U C2' C 13 75 0.2 . 1 . . . A 27 U C2' . 18534 1 1236 . 2 2 27 27 U C3' C 13 76.3 0.2 . 1 . . . A 27 U C3' . 18534 1 1237 . 2 2 27 27 U C4' C 13 83.22 0.2 . 1 . . . A 27 U C4' . 18534 1 1238 . 2 2 27 27 U C5 C 13 102.1 0.2 . 1 . . . A 27 U C5 . 18534 1 1239 . 2 2 27 27 U C5' C 13 66.03 0.2 . 1 . . . A 27 U C5' . 18534 1 1240 . 2 2 27 27 U C6 C 13 141.2 0.2 . 1 . . . A 27 U C6 . 18534 1 1241 . 2 2 28 28 A H1' H 1 5.929 0.02 . 1 . . . A 28 A H1' . 18534 1 1242 . 2 2 28 28 A H2 H 1 7.029 0.02 . 1 . . . A 28 A H2 . 18534 1 1243 . 2 2 28 28 A H2' H 1 4.2 0.02 . 1 . . . A 28 A H2' . 18534 1 1244 . 2 2 28 28 A H3' H 1 4.404 0.02 . 1 . . . A 28 A H3' . 18534 1 1245 . 2 2 28 28 A H4' H 1 4.38 0.02 . 1 . . . A 28 A H4' . 18534 1 1246 . 2 2 28 28 A H5' H 1 4.142 0.02 . 1 . . . A 28 A H5' . 18534 1 1247 . 2 2 28 28 A H5'' H 1 4.49 0.02 . 1 . . . A 28 A H5'' . 18534 1 1248 . 2 2 28 28 A H8 H 1 8.075 0.02 . 1 . . . A 28 A H8 . 18534 1 1249 . 2 2 28 28 A C1' C 13 92.7 0.2 . 1 . . . A 28 A C1' . 18534 1 1250 . 2 2 28 28 A C2 C 13 152.6 0.2 . 1 . . . A 28 A C2 . 18534 1 1251 . 2 2 28 28 A C2' C 13 74.66 0.2 . 1 . . . A 28 A C2' . 18534 1 1252 . 2 2 28 28 A C3' C 13 73.2 0.2 . 1 . . . A 28 A C3' . 18534 1 1253 . 2 2 28 28 A C4' C 13 81.33 0.2 . 1 . . . A 28 A C4' . 18534 1 1254 . 2 2 28 28 A C5' C 13 63.9 0.2 . 1 . . . A 28 A C5' . 18534 1 1255 . 2 2 28 28 A C8 C 13 139.2 0.2 . 1 . . . A 28 A C8 . 18534 1 1256 . 2 2 29 29 U H1' H 1 5.372 0.02 . 1 . . . A 29 U H1' . 18534 1 1257 . 2 2 29 29 U H2' H 1 4.475 0.02 . 1 . . . A 29 U H2' . 18534 1 1258 . 2 2 29 29 U H3 H 1 14.09 0.02 . 1 . . . A 29 U H3 . 18534 1 1259 . 2 2 29 29 U H3' H 1 4.43 0.02 . 1 . . . A 29 U H3' . 18534 1 1260 . 2 2 29 29 U H4' H 1 3.694 0.02 . 1 . . . A 29 U H4' . 18534 1 1261 . 2 2 29 29 U H5 H 1 4.944 0.02 . 1 . . . A 29 U H5 . 18534 1 1262 . 2 2 29 29 U H5' H 1 4.19 0.02 . 1 . . . A 29 U H5' . 18534 1 1263 . 2 2 29 29 U H5'' H 1 4.61 0.02 . 1 . . . A 29 U H5'' . 18534 1 1264 . 2 2 29 29 U H6 H 1 7.571 0.02 . 1 . . . A 29 U H6 . 18534 1 1265 . 2 2 29 29 U C1' C 13 93.66 0.2 . 1 . . . A 29 U C1' . 18534 1 1266 . 2 2 29 29 U C2' C 13 74.9 0.2 . 1 . . . A 29 U C2' . 18534 1 1267 . 2 2 29 29 U C3' C 13 75.2 0.2 . 1 . . . A 29 U C3' . 18534 1 1268 . 2 2 29 29 U C4' C 13 81.3 0.2 . 1 . . . A 29 U C4' . 18534 1 1269 . 2 2 29 29 U C5 C 13 102.6 0.2 . 1 . . . A 29 U C5 . 18534 1 1270 . 2 2 29 29 U C5' C 13 66.56 0.2 . 1 . . . A 29 U C5' . 18534 1 1271 . 2 2 29 29 U C6 C 13 138.9 0.2 . 1 . . . A 29 U C6 . 18534 1 1272 . 2 2 30 30 C H1' H 1 5.458 0.02 . 1 . . . A 30 C H1' . 18534 1 1273 . 2 2 30 30 C H2' H 1 4.26 0.02 . 1 . . . A 30 C H2' . 18534 1 1274 . 2 2 30 30 C H3' H 1 4.43 0.02 . 1 . . . A 30 C H3' . 18534 1 1275 . 2 2 30 30 C H4' H 1 4.2 0.02 . 1 . . . A 30 C H4' . 18534 1 1276 . 2 2 30 30 C H5 H 1 5.47 0.02 . 1 . . . A 30 C H5 . 18534 1 1277 . 2 2 30 30 C H5' H 1 4.36 0.02 . 1 . . . A 30 C H5' . 18534 1 1278 . 2 2 30 30 C H5'' H 1 4.71 0.02 . 1 . . . A 30 C H5'' . 18534 1 1279 . 2 2 30 30 C H6 H 1 7.645 0.02 . 1 . . . A 30 C H6 . 18534 1 1280 . 2 2 30 30 C C1' C 13 94.1 0.2 . 1 . . . A 30 C C1' . 18534 1 1281 . 2 2 30 30 C C2' C 13 74.77 0.2 . 1 . . . A 30 C C2' . 18534 1 1282 . 2 2 30 30 C C3' C 13 73.48 0.2 . 1 . . . A 30 C C3' . 18534 1 1283 . 2 2 30 30 C C4' C 13 82.43 0.2 . 1 . . . A 30 C C4' . 18534 1 1284 . 2 2 30 30 C C5 C 13 95.2 0.2 . 1 . . . A 30 C C5 . 18534 1 1285 . 2 2 30 30 C C5' C 13 65.23 0.2 . 1 . . . A 30 C C5' . 18534 1 1286 . 2 2 30 30 C C6 C 13 140.7 0.2 . 1 . . . A 30 C C6 . 18534 1 1287 . 2 2 31 31 U H1' H 1 5.554 0.02 . 1 . . . A 31 U H1' . 18534 1 1288 . 2 2 31 31 U H2' H 1 4.188 0.02 . 1 . . . A 31 U H2' . 18534 1 1289 . 2 2 31 31 U H3 H 1 12 0.02 . 1 . . . A 31 U H3 . 18534 1 1290 . 2 2 31 31 U H3' H 1 4.332 0.02 . 1 . . . A 31 U H3' . 18534 1 1291 . 2 2 31 31 U H4' H 1 4.337 0.02 . 1 . . . A 31 U H4' . 18534 1 1292 . 2 2 31 31 U H5 H 1 5.541 0.02 . 1 . . . A 31 U H5 . 18534 1 1293 . 2 2 31 31 U H5' H 1 4.233 0.02 . 1 . . . A 31 U H5' . 18534 1 1294 . 2 2 31 31 U H5'' H 1 4.56 0.02 . 1 . . . A 31 U H5'' . 18534 1 1295 . 2 2 31 31 U H6 H 1 7.797 0.02 . 1 . . . A 31 U H6 . 18534 1 1296 . 2 2 31 31 U C1' C 13 94.45 0.2 . 1 . . . A 31 U C1' . 18534 1 1297 . 2 2 31 31 U C2' C 13 75.33 0.2 . 1 . . . A 31 U C2' . 18534 1 1298 . 2 2 31 31 U C3' C 13 71.88 0.2 . 1 . . . A 31 U C3' . 18534 1 1299 . 2 2 31 31 U C4' C 13 81.22 0.2 . 1 . . . A 31 U C4' . 18534 1 1300 . 2 2 31 31 U C5 C 13 104.4 0.2 . 1 . . . A 31 U C5 . 18534 1 1301 . 2 2 31 31 U C5' C 13 64.66 0.2 . 1 . . . A 31 U C5' . 18534 1 1302 . 2 2 31 31 U C6 C 13 140.2 0.2 . 1 . . . A 31 U C6 . 18534 1 1303 . 2 2 32 32 C H1' H 1 5.728 0.02 . 1 . . . A 32 C H1' . 18534 1 1304 . 2 2 32 32 C H2' H 1 4.02 0.02 . 1 . . . A 32 C H2' . 18534 1 1305 . 2 2 32 32 C H3' H 1 4.18 0.02 . 1 . . . A 32 C H3' . 18534 1 1306 . 2 2 32 32 C H4' H 1 4.17 0.02 . 1 . . . A 32 C H4' . 18534 1 1307 . 2 2 32 32 C H5 H 1 5.589 0.02 . 1 . . . A 32 C H5 . 18534 1 1308 . 2 2 32 32 C H5' H 1 4.04 0.02 . 1 . . . A 32 C H5' . 18534 1 1309 . 2 2 32 32 C H5'' H 1 4.48 0.02 . 1 . . . A 32 C H5'' . 18534 1 1310 . 2 2 32 32 C H6 H 1 7.757 0.02 . 1 . . . A 32 C H6 . 18534 1 1311 . 2 2 32 32 C C1' C 13 92.9 0.2 . 1 . . . A 32 C C1' . 18534 1 1312 . 2 2 32 32 C C2' C 13 77.4 0.2 . 1 . . . A 32 C C2' . 18534 1 1313 . 2 2 32 32 C C3' C 13 69.3 0.2 . 1 . . . A 32 C C3' . 18534 1 1314 . 2 2 32 32 C C4' C 13 83.2 0.2 . 1 . . . A 32 C C4' . 18534 1 1315 . 2 2 32 32 C C5 C 13 95.93 0.2 . 1 . . . A 32 C C5 . 18534 1 1316 . 2 2 32 32 C C5' C 13 64.71 0.2 . 1 . . . A 32 C C5' . 18534 1 1317 . 2 2 32 32 C C6 C 13 141.5 0.2 . 1 . . . A 32 C C6 . 18534 1 stop_ save_