data_19977 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19977 _Entry.Title ; Solution structure human HCN2 CNBD in the cAMP-unbound state ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-05-16 _Entry.Accession_date 2014-05-16 _Entry.Last_release_date 2014-09-02 _Entry.Original_release_date 2014-09-02 _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 Andrea Saponaro . . . 19977 2 Sofia Pauleta . R. . 19977 3 Francesca Cantini . . . 19977 4 Manolis Matzapetakis . . . 19977 5 Christian Hammann . . . 19977 6 Lucia Banci . . . 19977 7 Gerard Thiel . . . 19977 8 Bina Santoro . . . 19977 9 Anna Moroni . . . 19977 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' . 19977 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'HCN channels' . 19977 CNBD . 19977 cAMP . 19977 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19977 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 1113 19977 '13C chemical shifts' 624 19977 '15N chemical shifts' 149 19977 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 . . 2014-09-02 2014-05-16 original author . 19977 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2MPF 'BMRB Entry Tracking System' 19977 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19977 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Structural basis for the mutual antagonism of cAMP and TRIP8b in regulating HCN channel function' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Andrea Saponaro . . . 19977 1 2 Sofia Pauleta . R. . 19977 1 3 Francesca Cantini . . . 19977 1 4 Manolis Matzapetakis . . . 19977 1 5 Christian Hammann . . . 19977 1 6 Lucia Banci . . . 19977 1 7 Gerard Thiel . . . 19977 1 8 Bina Santoro . . . 19977 1 9 Anna Moroni . . . 19977 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19977 _Assembly.ID 1 _Assembly.Name 'human HCN2 CNBD in the cAMP-unbound state' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'human HCN2 CNBD' 1 $entity A . yes native no no . . . 19977 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 19977 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPSSPMELNGPLREEIVNFN CRKLVASMPLFANADPNFVT AMLTKLKFEVFQPGDYIIRE GTIGKKMYFIQHGVVSVLTK GNKEMKLSDGSYFGEICLLT RGRRTASVRADTYCRLYSLS VDNFNEVLEEYPMMRRAFET VAIDRLDRIGKKNSILLH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; G, 515 P, 516 .. ; _Entity.Polymer_author_seq_details ; Residues 515-520 represent a non-native affinity tag Residues 521-533 are unstructured and were omitted for simplicity ; _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 158 _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 15918.672 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1Q3E . "Hcn2j 443-645 In The Presence Of Cgmp" . . . . . 96.20 207 100.00 100.00 1.06e-106 . . . . 19977 1 2 no PDB 2MPF . "Solution Structure Human Hcn2 Cnbd In The Camp-unbound State" . . . . . 100.00 158 100.00 100.00 7.15e-112 . . . . 19977 1 3 no PDB 2Q0A . "Structure And Rearrangements In The Carboxy-Terminal Region Of Spih Channels" . . . . . 93.04 200 99.32 99.32 1.25e-101 . . . . 19977 1 4 no PDB 3BPZ . "Hcn2-I 443-460 E502k In The Presence Of Camp" . . . . . 93.04 202 99.32 100.00 3.48e-102 . . . . 19977 1 5 no PDB 3ETQ . "X-Ray Structure Of Cysteine-Free Fragment Of Mhcn2 C- Terminal Region From Amino Acids 443-630 Including C508n, C584s, And C601" . . . . . 93.04 204 97.96 97.96 5.89e-99 . . . . 19977 1 6 no PDB 3FFQ . "Hcn2i 443-640 Apo-State" . . . . . 93.04 202 100.00 100.00 7.16e-103 . . . . 19977 1 7 no PDB 3U10 . "Tetramerization Dynamics Of The C-terminus Underlies Isoform-specific Camp-gating In Hcn Channels" . . . . . 96.20 210 100.00 100.00 2.08e-106 . . . . 19977 1 8 no DBJ BAD32628 . "Hyperpolarization-activated, cyclic nucleotide-gated cation channel 2 [Rattus norvegicus]" . . . . . 96.20 863 100.00 100.00 2.37e-100 . . . . 19977 1 9 no DBJ BAI44633 . "hyperpolarization-activated cation channel 2 [Mus musculus]" . . . . . 96.20 863 100.00 100.00 2.78e-100 . . . . 19977 1 10 no DBJ BAI45607 . "hyperpolarization activated cyclic nucleotide-gated potassium channel 2 [synthetic construct]" . . . . . 96.20 889 100.00 100.00 3.79e-100 . . . . 19977 1 11 no EMBL CAA12406 . "hyperpolarization-activated cation channel, HAC1 [Mus musculus]" . . . . . 96.20 863 100.00 100.00 2.93e-100 . . . . 19977 1 12 no EMBL CAB42602 . "hyperpolarization-activated cation channel HCN2 [Homo sapiens]" . . . . . 96.20 889 100.00 100.00 4.13e-100 . . . . 19977 1 13 no EMBL CAB42630 . "hyperpolarization-activated cyclic nucleotide-gated channel hHCN2 [Homo sapiens]" . . . . . 96.20 889 100.00 100.00 4.13e-100 . . . . 19977 1 14 no GB AAC28444 . "hyperpolarization-activated, cyclic nucleotide-gated channel 2 [Homo sapiens]" . . . . . 96.20 889 100.00 100.00 4.53e-100 . . . . 19977 1 15 no GB AAC39760 . "ion channel BCNG-2, partial [Homo sapiens]" . . . . . 96.20 597 100.00 100.00 4.58e-102 . . . . 19977 1 16 no GB AAC40125 . "ion channel BCNG-2, partial [Mus musculus]" . . . . . 96.20 504 99.34 99.34 8.00e-103 . . . . 19977 1 17 no GB AAF62174 . "hyperpolarization-activated, cyclic nucleotide-gated potassium channel 2 [Rattus norvegicus]" . . . . . 96.20 834 100.00 100.00 3.06e-100 . . . . 19977 1 18 no GB AAI18002 . "HCN2 protein, partial [synthetic construct]" . . . . . 96.20 889 100.00 100.00 3.79e-100 . . . . 19977 1 19 no REF NP_001185 . "potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 [Homo sapiens]" . . . . . 96.20 889 100.00 100.00 3.79e-100 . . . . 19977 1 20 no REF NP_032252 . "potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 [Mus musculus]" . . . . . 96.20 863 100.00 100.00 2.93e-100 . . . . 19977 1 21 no REF NP_446136 . "potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 [Rattus norvegicus]" . . . . . 96.20 863 100.00 100.00 2.37e-100 . . . . 19977 1 22 no REF XP_002193445 . "PREDICTED: LOW QUALITY PROTEIN: potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2, partial [Taenio" . . . . . 96.20 627 98.68 99.34 7.98e-101 . . . . 19977 1 23 no REF XP_002689207 . "PREDICTED: potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 isoform X2 [Bos taurus]" . . . . . 96.20 809 100.00 100.00 2.93e-100 . . . . 19977 1 24 no SP O88703 . "RecName: Full=Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2; AltName: Full=Brain cyclic nucleo" . . . . . 96.20 863 100.00 100.00 2.93e-100 . . . . 19977 1 25 no SP Q9JKA9 . "RecName: Full=Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2" . . . . . 96.20 863 100.00 100.00 3.22e-100 . . . . 19977 1 26 no SP Q9UL51 . "RecName: Full=Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2; AltName: Full=Brain cyclic nucleo" . . . . . 96.20 889 100.00 100.00 3.79e-100 . . . . 19977 1 27 no TPG DAA27526 . "TPA: hyperpolarization activated cyclic nucleotide-gated potassium channel 2-like [Bos taurus]" . . . . . 96.20 1024 100.00 100.00 9.68e-99 . . . . 19977 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 1 515 GLY . 19977 1 2 516 PRO . 19977 1 3 517 SER . 19977 1 4 518 SER . 19977 1 5 519 PRO . 19977 1 6 520 MET . 19977 1 7 521 GLU . 19977 1 8 522 LEU . 19977 1 9 523 ASN . 19977 1 10 524 GLY . 19977 1 11 525 PRO . 19977 1 12 526 LEU . 19977 1 13 527 ARG . 19977 1 14 528 GLU . 19977 1 15 529 GLU . 19977 1 16 530 ILE . 19977 1 17 531 VAL . 19977 1 18 532 ASN . 19977 1 19 533 PHE . 19977 1 20 534 ASN . 19977 1 21 535 CYS . 19977 1 22 536 ARG . 19977 1 23 537 LYS . 19977 1 24 538 LEU . 19977 1 25 539 VAL . 19977 1 26 540 ALA . 19977 1 27 541 SER . 19977 1 28 542 MET . 19977 1 29 543 PRO . 19977 1 30 544 LEU . 19977 1 31 545 PHE . 19977 1 32 546 ALA . 19977 1 33 547 ASN . 19977 1 34 548 ALA . 19977 1 35 549 ASP . 19977 1 36 550 PRO . 19977 1 37 551 ASN . 19977 1 38 552 PHE . 19977 1 39 553 VAL . 19977 1 40 554 THR . 19977 1 41 555 ALA . 19977 1 42 556 MET . 19977 1 43 557 LEU . 19977 1 44 558 THR . 19977 1 45 559 LYS . 19977 1 46 560 LEU . 19977 1 47 561 LYS . 19977 1 48 562 PHE . 19977 1 49 563 GLU . 19977 1 50 564 VAL . 19977 1 51 565 PHE . 19977 1 52 566 GLN . 19977 1 53 567 PRO . 19977 1 54 568 GLY . 19977 1 55 569 ASP . 19977 1 56 570 TYR . 19977 1 57 571 ILE . 19977 1 58 572 ILE . 19977 1 59 573 ARG . 19977 1 60 574 GLU . 19977 1 61 575 GLY . 19977 1 62 576 THR . 19977 1 63 577 ILE . 19977 1 64 578 GLY . 19977 1 65 579 LYS . 19977 1 66 580 LYS . 19977 1 67 581 MET . 19977 1 68 582 TYR . 19977 1 69 583 PHE . 19977 1 70 584 ILE . 19977 1 71 585 GLN . 19977 1 72 586 HIS . 19977 1 73 587 GLY . 19977 1 74 588 VAL . 19977 1 75 589 VAL . 19977 1 76 590 SER . 19977 1 77 591 VAL . 19977 1 78 592 LEU . 19977 1 79 593 THR . 19977 1 80 594 LYS . 19977 1 81 595 GLY . 19977 1 82 596 ASN . 19977 1 83 597 LYS . 19977 1 84 598 GLU . 19977 1 85 599 MET . 19977 1 86 600 LYS . 19977 1 87 601 LEU . 19977 1 88 602 SER . 19977 1 89 603 ASP . 19977 1 90 604 GLY . 19977 1 91 605 SER . 19977 1 92 606 TYR . 19977 1 93 607 PHE . 19977 1 94 608 GLY . 19977 1 95 609 GLU . 19977 1 96 610 ILE . 19977 1 97 611 CYS . 19977 1 98 612 LEU . 19977 1 99 613 LEU . 19977 1 100 614 THR . 19977 1 101 615 ARG . 19977 1 102 616 GLY . 19977 1 103 617 ARG . 19977 1 104 618 ARG . 19977 1 105 619 THR . 19977 1 106 620 ALA . 19977 1 107 621 SER . 19977 1 108 622 VAL . 19977 1 109 623 ARG . 19977 1 110 624 ALA . 19977 1 111 625 ASP . 19977 1 112 626 THR . 19977 1 113 627 TYR . 19977 1 114 628 CYS . 19977 1 115 629 ARG . 19977 1 116 630 LEU . 19977 1 117 631 TYR . 19977 1 118 632 SER . 19977 1 119 633 LEU . 19977 1 120 634 SER . 19977 1 121 635 VAL . 19977 1 122 636 ASP . 19977 1 123 637 ASN . 19977 1 124 638 PHE . 19977 1 125 639 ASN . 19977 1 126 640 GLU . 19977 1 127 641 VAL . 19977 1 128 642 LEU . 19977 1 129 643 GLU . 19977 1 130 644 GLU . 19977 1 131 645 TYR . 19977 1 132 646 PRO . 19977 1 133 647 MET . 19977 1 134 648 MET . 19977 1 135 649 ARG . 19977 1 136 650 ARG . 19977 1 137 651 ALA . 19977 1 138 652 PHE . 19977 1 139 653 GLU . 19977 1 140 654 THR . 19977 1 141 655 VAL . 19977 1 142 656 ALA . 19977 1 143 657 ILE . 19977 1 144 658 ASP . 19977 1 145 659 ARG . 19977 1 146 660 LEU . 19977 1 147 661 ASP . 19977 1 148 662 ARG . 19977 1 149 663 ILE . 19977 1 150 664 GLY . 19977 1 151 665 LYS . 19977 1 152 666 LYS . 19977 1 153 667 ASN . 19977 1 154 668 SER . 19977 1 155 669 ILE . 19977 1 156 670 LEU . 19977 1 157 671 LEU . 19977 1 158 672 HIS . 19977 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 19977 1 . PRO 2 2 19977 1 . SER 3 3 19977 1 . SER 4 4 19977 1 . PRO 5 5 19977 1 . MET 6 6 19977 1 . GLU 7 7 19977 1 . LEU 8 8 19977 1 . ASN 9 9 19977 1 . GLY 10 10 19977 1 . PRO 11 11 19977 1 . LEU 12 12 19977 1 . ARG 13 13 19977 1 . GLU 14 14 19977 1 . GLU 15 15 19977 1 . ILE 16 16 19977 1 . VAL 17 17 19977 1 . ASN 18 18 19977 1 . PHE 19 19 19977 1 . ASN 20 20 19977 1 . CYS 21 21 19977 1 . ARG 22 22 19977 1 . LYS 23 23 19977 1 . LEU 24 24 19977 1 . VAL 25 25 19977 1 . ALA 26 26 19977 1 . SER 27 27 19977 1 . MET 28 28 19977 1 . PRO 29 29 19977 1 . LEU 30 30 19977 1 . PHE 31 31 19977 1 . ALA 32 32 19977 1 . ASN 33 33 19977 1 . ALA 34 34 19977 1 . ASP 35 35 19977 1 . PRO 36 36 19977 1 . ASN 37 37 19977 1 . PHE 38 38 19977 1 . VAL 39 39 19977 1 . THR 40 40 19977 1 . ALA 41 41 19977 1 . MET 42 42 19977 1 . LEU 43 43 19977 1 . THR 44 44 19977 1 . LYS 45 45 19977 1 . LEU 46 46 19977 1 . LYS 47 47 19977 1 . PHE 48 48 19977 1 . GLU 49 49 19977 1 . VAL 50 50 19977 1 . PHE 51 51 19977 1 . GLN 52 52 19977 1 . PRO 53 53 19977 1 . GLY 54 54 19977 1 . ASP 55 55 19977 1 . TYR 56 56 19977 1 . ILE 57 57 19977 1 . ILE 58 58 19977 1 . ARG 59 59 19977 1 . GLU 60 60 19977 1 . GLY 61 61 19977 1 . THR 62 62 19977 1 . ILE 63 63 19977 1 . GLY 64 64 19977 1 . LYS 65 65 19977 1 . LYS 66 66 19977 1 . MET 67 67 19977 1 . TYR 68 68 19977 1 . PHE 69 69 19977 1 . ILE 70 70 19977 1 . GLN 71 71 19977 1 . HIS 72 72 19977 1 . GLY 73 73 19977 1 . VAL 74 74 19977 1 . VAL 75 75 19977 1 . SER 76 76 19977 1 . VAL 77 77 19977 1 . LEU 78 78 19977 1 . THR 79 79 19977 1 . LYS 80 80 19977 1 . GLY 81 81 19977 1 . ASN 82 82 19977 1 . LYS 83 83 19977 1 . GLU 84 84 19977 1 . MET 85 85 19977 1 . LYS 86 86 19977 1 . LEU 87 87 19977 1 . SER 88 88 19977 1 . ASP 89 89 19977 1 . GLY 90 90 19977 1 . SER 91 91 19977 1 . TYR 92 92 19977 1 . PHE 93 93 19977 1 . GLY 94 94 19977 1 . GLU 95 95 19977 1 . ILE 96 96 19977 1 . CYS 97 97 19977 1 . LEU 98 98 19977 1 . LEU 99 99 19977 1 . THR 100 100 19977 1 . ARG 101 101 19977 1 . GLY 102 102 19977 1 . ARG 103 103 19977 1 . ARG 104 104 19977 1 . THR 105 105 19977 1 . ALA 106 106 19977 1 . SER 107 107 19977 1 . VAL 108 108 19977 1 . ARG 109 109 19977 1 . ALA 110 110 19977 1 . ASP 111 111 19977 1 . THR 112 112 19977 1 . TYR 113 113 19977 1 . CYS 114 114 19977 1 . ARG 115 115 19977 1 . LEU 116 116 19977 1 . TYR 117 117 19977 1 . SER 118 118 19977 1 . LEU 119 119 19977 1 . SER 120 120 19977 1 . VAL 121 121 19977 1 . ASP 122 122 19977 1 . ASN 123 123 19977 1 . PHE 124 124 19977 1 . ASN 125 125 19977 1 . GLU 126 126 19977 1 . VAL 127 127 19977 1 . LEU 128 128 19977 1 . GLU 129 129 19977 1 . GLU 130 130 19977 1 . TYR 131 131 19977 1 . PRO 132 132 19977 1 . MET 133 133 19977 1 . MET 134 134 19977 1 . ARG 135 135 19977 1 . ARG 136 136 19977 1 . ALA 137 137 19977 1 . PHE 138 138 19977 1 . GLU 139 139 19977 1 . THR 140 140 19977 1 . VAL 141 141 19977 1 . ALA 142 142 19977 1 . ILE 143 143 19977 1 . ASP 144 144 19977 1 . ARG 145 145 19977 1 . LEU 146 146 19977 1 . ASP 147 147 19977 1 . ARG 148 148 19977 1 . ILE 149 149 19977 1 . GLY 150 150 19977 1 . LYS 151 151 19977 1 . LYS 152 152 19977 1 . ASN 153 153 19977 1 . SER 154 154 19977 1 . ILE 155 155 19977 1 . LEU 156 156 19977 1 . LEU 157 157 19977 1 . HIS 158 158 19977 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 19977 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 19977 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 19977 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'Rosetta strain' . . . . . . . . . . . . . . . pET-24b . . . 'modified pET-24b downstream of a double His6-maltose-binding protein (MBP) tag' . . 19977 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19977 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity [U-15N] . . 1 $entity . . 1 . . mM . . . . 19977 1 2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 19977 1 3 'potassium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 19977 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 19977 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity '[U-13C; U-15N]' . . 1 $entity . . 1 . . mM . . . . 19977 2 2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 19977 2 3 'potassium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 19977 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 19977 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity 'natural abundance' . . 1 $entity . . 1 . . mM . . . . 19977 3 2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 19977 3 3 'potassium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 19977 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 19977 _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 temperature 298 . K 19977 1 pH 7.0 . pH 19977 1 pressure 1 . atm 19977 1 'ionic strength' 170 . mM 19977 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 19977 _Software.ID 1 _Software.Name TOPSPIN _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 19977 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 19977 1 processing 19977 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 19977 _Software.ID 2 _Software.Name CARA _Software.Version 1.8 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 19977 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19977 2 'data analysis' 19977 2 'peak picking' 19977 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 19977 _Software.ID 3 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 19977 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 19977 3 stop_ save_ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 19977 _Software.ID 4 _Software.Name AMBER _Software.Version 12 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollman' . 'implemented in the web portal AMPS-NMR (http://pyenmr.cerm.unifi.it/access/index/amps-nmr)' 19977 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 19977 4 stop_ save_ save_CING _Software.Sf_category software _Software.Sf_framecode CING _Software.Entry_ID 19977 _Software.ID 5 _Software.Name CING _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Geerten Vuister, Jurgen F. Doreleijers and Alan Wilter Sousa da Silva' . . 19977 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure validation' 19977 5 stop_ save_ save_PSVS _Software.Sf_category software _Software.Sf_framecode PSVS _Software.Entry_ID 19977 _Software.ID 6 _Software.Name PSVS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 19977 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure validation' 19977 6 stop_ save_ save_CANDID _Software.Sf_category software _Software.Sf_framecode CANDID _Software.Entry_ID 19977 _Software.ID 7 _Software.Name CANDID _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Herrmann, Guntert and Wuthrich' . . 19977 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 19977 7 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 19977 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'equipped with a TCI-cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 19977 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'equipped with a QXI-HCN gradient probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 19977 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details 'equipped with cryogenically cooled probe (CPTXI)' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 19977 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 'equipped with a TCI-cryoprobe' . . 19977 1 2 spectrometer_2 Bruker Avance . 800 'equipped with a QXI-HCN gradient probe' . . 19977 1 3 spectrometer_3 Bruker Avance . 900 'equipped with cryogenically cooled probe (CPTXI)' . . 19977 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 19977 _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 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19977 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19977 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19977 1 4 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19977 1 5 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19977 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19977 1 7 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19977 1 8 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19977 1 9 '2D 1H-1H NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 19977 1 10 '2D 1H-1H TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 19977 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 19977 _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 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.0 . . . . . . . . . 19977 1 C 13 dioxane 'methylene carbons' . . . . ppm 69.4 external direct 1.0 . . . . . . . . . 19977 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 19977 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 19977 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 3 '3D CBCA(CO)NH' . . . 19977 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 2 2 PRO HA H 1 4.511 0.020 . 1 . . . . 516 PRO HA . 19977 1 2 . 1 1 2 2 PRO HB2 H 1 2.303 0.020 . 2 . . . . 516 PRO HB2 . 19977 1 3 . 1 1 2 2 PRO HB3 H 1 2.103 0.020 . 2 . . . . 516 PRO HB3 . 19977 1 4 . 1 1 2 2 PRO HG2 H 1 1.879 0.020 . 2 . . . . 516 PRO HG2 . 19977 1 5 . 1 1 2 2 PRO HG3 H 1 1.771 0.020 . 2 . . . . 516 PRO HG3 . 19977 1 6 . 1 1 2 2 PRO HD2 H 1 3.484 0.020 . 2 . . . . 516 PRO HD2 . 19977 1 7 . 1 1 2 2 PRO HD3 H 1 3.440 0.020 . 2 . . . . 516 PRO HD3 . 19977 1 8 . 1 1 2 2 PRO CA C 13 62.224 0.3 . 1 . . . . 516 PRO CA . 19977 1 9 . 1 1 2 2 PRO CB C 13 34.520 0.3 . 1 . . . . 516 PRO CB . 19977 1 10 . 1 1 2 2 PRO CG C 13 24.622 0.3 . 1 . . . . 516 PRO CG . 19977 1 11 . 1 1 2 2 PRO CD C 13 50.251 0.3 . 1 . . . . 516 PRO CD . 19977 1 12 . 1 1 3 3 SER HA H 1 4.416 0.020 . 1 . . . . 517 SER HA . 19977 1 13 . 1 1 3 3 SER HB2 H 1 3.800 0.020 . 1 . . . . 517 SER HB2 . 19977 1 14 . 1 1 3 3 SER HB3 H 1 3.800 0.020 . 1 . . . . 517 SER HB3 . 19977 1 15 . 1 1 3 3 SER C C 13 174.078 0.3 . 1 . . . . 517 SER C . 19977 1 16 . 1 1 3 3 SER CA C 13 58.273 0.3 . 1 . . . . 517 SER CA . 19977 1 17 . 1 1 3 3 SER CB C 13 63.721 0.3 . 1 . . . . 517 SER CB . 19977 1 18 . 1 1 4 4 SER H H 1 8.221 0.020 . 1 . . . . 518 SER H . 19977 1 19 . 1 1 4 4 SER HA H 1 3.796 0.020 . 1 . . . . 518 SER HA . 19977 1 20 . 1 1 4 4 SER HB2 H 1 3.798 0.020 . 1 . . . . 518 SER HB2 . 19977 1 21 . 1 1 4 4 SER HB3 H 1 3.798 0.020 . 1 . . . . 518 SER HB3 . 19977 1 22 . 1 1 4 4 SER CA C 13 56.265 0.3 . 1 . . . . 518 SER CA . 19977 1 23 . 1 1 4 4 SER CB C 13 63.262 0.3 . 1 . . . . 518 SER CB . 19977 1 24 . 1 1 4 4 SER N N 15 118.569 0.3 . 1 . . . . 518 SER N . 19977 1 25 . 1 1 5 5 PRO HA H 1 4.335 0.020 . 1 . . . . 519 PRO HA . 19977 1 26 . 1 1 5 5 PRO HB2 H 1 2.240 0.020 . 2 . . . . 519 PRO HB2 . 19977 1 27 . 1 1 5 5 PRO HB3 H 1 1.858 0.020 . 2 . . . . 519 PRO HB3 . 19977 1 28 . 1 1 5 5 PRO HG2 H 1 1.947 0.020 . 1 . . . . 519 PRO HG2 . 19977 1 29 . 1 1 5 5 PRO HG3 H 1 1.947 0.020 . 1 . . . . 519 PRO HG3 . 19977 1 30 . 1 1 5 5 PRO HD2 H 1 3.747 0.020 . 2 . . . . 519 PRO HD2 . 19977 1 31 . 1 1 5 5 PRO HD3 H 1 3.656 0.020 . 2 . . . . 519 PRO HD3 . 19977 1 32 . 1 1 5 5 PRO C C 13 177.009 0.3 . 1 . . . . 519 PRO C . 19977 1 33 . 1 1 5 5 PRO CA C 13 63.448 0.3 . 1 . . . . 519 PRO CA . 19977 1 34 . 1 1 5 5 PRO CB C 13 31.854 0.3 . 1 . . . . 519 PRO CB . 19977 1 35 . 1 1 5 5 PRO CG C 13 27.245 0.3 . 1 . . . . 519 PRO CG . 19977 1 36 . 1 1 5 5 PRO CD C 13 50.595 0.3 . 1 . . . . 519 PRO CD . 19977 1 37 . 1 1 6 6 MET H H 1 8.258 0.020 . 1 . . . . 520 MET H . 19977 1 38 . 1 1 6 6 MET HA H 1 4.321 0.020 . 1 . . . . 520 MET HA . 19977 1 39 . 1 1 6 6 MET HB2 H 1 1.985 0.020 . 2 . . . . 520 MET HB2 . 19977 1 40 . 1 1 6 6 MET HB3 H 1 1.912 0.020 . 2 . . . . 520 MET HB3 . 19977 1 41 . 1 1 6 6 MET HG2 H 1 2.513 0.020 . 2 . . . . 520 MET HG2 . 19977 1 42 . 1 1 6 6 MET HG3 H 1 2.466 0.020 . 2 . . . . 520 MET HG3 . 19977 1 43 . 1 1 6 6 MET C C 13 176.293 0.3 . 1 . . . . 520 MET C . 19977 1 44 . 1 1 6 6 MET CA C 13 55.805 0.3 . 1 . . . . 520 MET CA . 19977 1 45 . 1 1 6 6 MET CB C 13 32.709 0.3 . 1 . . . . 520 MET CB . 19977 1 46 . 1 1 6 6 MET CG C 13 31.878 0.3 . 1 . . . . 520 MET CG . 19977 1 47 . 1 1 6 6 MET N N 15 119.429 0.3 . 1 . . . . 520 MET N . 19977 1 48 . 1 1 7 7 GLU H H 1 8.210 0.020 . 1 . . . . 521 GLU H . 19977 1 49 . 1 1 7 7 GLU HA H 1 4.198 0.020 . 1 . . . . 521 GLU HA . 19977 1 50 . 1 1 7 7 GLU HB2 H 1 1.944 0.020 . 2 . . . . 521 GLU HB2 . 19977 1 51 . 1 1 7 7 GLU HB3 H 1 1.858 0.020 . 2 . . . . 521 GLU HB3 . 19977 1 52 . 1 1 7 7 GLU HG2 H 1 2.152 0.020 . 1 . . . . 521 GLU HG2 . 19977 1 53 . 1 1 7 7 GLU HG3 H 1 2.152 0.020 . 1 . . . . 521 GLU HG3 . 19977 1 54 . 1 1 7 7 GLU C C 13 176.319 0.3 . 1 . . . . 521 GLU C . 19977 1 55 . 1 1 7 7 GLU CA C 13 56.479 0.3 . 1 . . . . 521 GLU CA . 19977 1 56 . 1 1 7 7 GLU CB C 13 30.100 0.3 . 1 . . . . 521 GLU CB . 19977 1 57 . 1 1 7 7 GLU CG C 13 36.130 0.3 . 1 . . . . 521 GLU CG . 19977 1 58 . 1 1 7 7 GLU N N 15 121.524 0.3 . 1 . . . . 521 GLU N . 19977 1 59 . 1 1 8 8 LEU H H 1 8.112 0.020 . 1 . . . . 522 LEU H . 19977 1 60 . 1 1 8 8 LEU HA H 1 4.253 0.020 . 1 . . . . 522 LEU HA . 19977 1 61 . 1 1 8 8 LEU HB2 H 1 1.502 0.020 . 1 . . . . 522 LEU HB2 . 19977 1 62 . 1 1 8 8 LEU HB3 H 1 1.502 0.020 . 1 . . . . 522 LEU HB3 . 19977 1 63 . 1 1 8 8 LEU HG H 1 1.528 0.020 . 1 . . . . 522 LEU HG . 19977 1 64 . 1 1 8 8 LEU HD11 H 1 0.832 0.020 . 1 . . . . 522 LEU HD1 . 19977 1 65 . 1 1 8 8 LEU HD12 H 1 0.832 0.020 . 1 . . . . 522 LEU HD1 . 19977 1 66 . 1 1 8 8 LEU HD13 H 1 0.832 0.020 . 1 . . . . 522 LEU HD1 . 19977 1 67 . 1 1 8 8 LEU HD21 H 1 0.772 0.020 . 1 . . . . 522 LEU HD2 . 19977 1 68 . 1 1 8 8 LEU HD22 H 1 0.772 0.020 . 1 . . . . 522 LEU HD2 . 19977 1 69 . 1 1 8 8 LEU HD23 H 1 0.772 0.020 . 1 . . . . 522 LEU HD2 . 19977 1 70 . 1 1 8 8 LEU C C 13 176.887 0.3 . 1 . . . . 522 LEU C . 19977 1 71 . 1 1 8 8 LEU CA C 13 55.161 0.3 . 1 . . . . 522 LEU CA . 19977 1 72 . 1 1 8 8 LEU CB C 13 42.160 0.3 . 1 . . . . 522 LEU CB . 19977 1 73 . 1 1 8 8 LEU CG C 13 26.779 0.3 . 1 . . . . 522 LEU CG . 19977 1 74 . 1 1 8 8 LEU CD1 C 13 24.692 0.3 . 1 . . . . 522 LEU CD1 . 19977 1 75 . 1 1 8 8 LEU CD2 C 13 23.423 0.3 . 1 . . . . 522 LEU CD2 . 19977 1 76 . 1 1 8 8 LEU N N 15 122.766 0.3 . 1 . . . . 522 LEU N . 19977 1 77 . 1 1 9 9 ASN H H 1 8.286 0.020 . 1 . . . . 523 ASN H . 19977 1 78 . 1 1 9 9 ASN HA H 1 4.691 0.020 . 1 . . . . 523 ASN HA . 19977 1 79 . 1 1 9 9 ASN HB2 H 1 2.768 0.020 . 2 . . . . 523 ASN HB2 . 19977 1 80 . 1 1 9 9 ASN HB3 H 1 2.664 0.020 . 2 . . . . 523 ASN HB3 . 19977 1 81 . 1 1 9 9 ASN HD21 H 1 7.514 0.020 . 1 . . . . 523 ASN HD21 . 19977 1 82 . 1 1 9 9 ASN HD22 H 1 6.845 0.020 . 1 . . . . 523 ASN HD22 . 19977 1 83 . 1 1 9 9 ASN C C 13 175.081 0.3 . 1 . . . . 523 ASN C . 19977 1 84 . 1 1 9 9 ASN CA C 13 53.023 0.3 . 1 . . . . 523 ASN CA . 19977 1 85 . 1 1 9 9 ASN CB C 13 39.104 0.3 . 1 . . . . 523 ASN CB . 19977 1 86 . 1 1 9 9 ASN CG C 13 176.659 0.3 . 1 . . . . 523 ASN CG . 19977 1 87 . 1 1 9 9 ASN N N 15 118.606 0.3 . 1 . . . . 523 ASN N . 19977 1 88 . 1 1 9 9 ASN ND2 N 15 112.953 0.3 . 1 . . . . 523 ASN ND2 . 19977 1 89 . 1 1 10 10 GLY H H 1 8.061 0.020 . 1 . . . . 524 GLY H . 19977 1 90 . 1 1 10 10 GLY HA2 H 1 3.987 0.020 . 1 . . . . 524 GLY HA2 . 19977 1 91 . 1 1 10 10 GLY HA3 H 1 3.987 0.020 . 1 . . . . 524 GLY HA3 . 19977 1 92 . 1 1 10 10 GLY CA C 13 44.931 0.3 . 1 . . . . 524 GLY CA . 19977 1 93 . 1 1 10 10 GLY N N 15 108.964 0.3 . 1 . . . . 524 GLY N . 19977 1 94 . 1 1 11 11 PRO HA H 1 4.443 0.020 . 1 . . . . 525 PRO HA . 19977 1 95 . 1 1 11 11 PRO HB2 H 1 2.243 0.020 . 2 . . . . 525 PRO HB2 . 19977 1 96 . 1 1 11 11 PRO HB3 H 1 2.183 0.020 . 2 . . . . 525 PRO HB3 . 19977 1 97 . 1 1 11 11 PRO HG2 H 1 1.948 0.020 . 2 . . . . 525 PRO HG2 . 19977 1 98 . 1 1 11 11 PRO HG3 H 1 1.899 0.020 . 2 . . . . 525 PRO HG3 . 19977 1 99 . 1 1 11 11 PRO HD2 H 1 3.514 0.020 . 1 . . . . 525 PRO HD2 . 19977 1 100 . 1 1 11 11 PRO HD3 H 1 3.514 0.020 . 1 . . . . 525 PRO HD3 . 19977 1 101 . 1 1 11 11 PRO C C 13 177.141 0.3 . 1 . . . . 525 PRO C . 19977 1 102 . 1 1 11 11 PRO CA C 13 63.096 0.3 . 1 . . . . 525 PRO CA . 19977 1 103 . 1 1 11 11 PRO CB C 13 32.160 0.3 . 1 . . . . 525 PRO CB . 19977 1 104 . 1 1 11 11 PRO CG C 13 26.909 0.3 . 1 . . . . 525 PRO CG . 19977 1 105 . 1 1 11 11 PRO CD C 13 49.638 0.3 . 1 . . . . 525 PRO CD . 19977 1 106 . 1 1 12 12 LEU H H 1 8.203 0.020 . 1 . . . . 526 LEU H . 19977 1 107 . 1 1 12 12 LEU HA H 1 4.247 0.020 . 1 . . . . 526 LEU HA . 19977 1 108 . 1 1 12 12 LEU HB2 H 1 1.557 0.020 . 2 . . . . 526 LEU HB2 . 19977 1 109 . 1 1 12 12 LEU HB3 H 1 1.498 0.020 . 2 . . . . 526 LEU HB3 . 19977 1 110 . 1 1 12 12 LEU HG H 1 1.531 0.020 . 1 . . . . 526 LEU HG . 19977 1 111 . 1 1 12 12 LEU HD11 H 1 0.832 0.020 . 1 . . . . 526 LEU HD1 . 19977 1 112 . 1 1 12 12 LEU HD12 H 1 0.832 0.020 . 1 . . . . 526 LEU HD1 . 19977 1 113 . 1 1 12 12 LEU HD13 H 1 0.832 0.020 . 1 . . . . 526 LEU HD1 . 19977 1 114 . 1 1 12 12 LEU HD21 H 1 0.775 0.020 . 1 . . . . 526 LEU HD2 . 19977 1 115 . 1 1 12 12 LEU HD22 H 1 0.775 0.020 . 1 . . . . 526 LEU HD2 . 19977 1 116 . 1 1 12 12 LEU HD23 H 1 0.775 0.020 . 1 . . . . 526 LEU HD2 . 19977 1 117 . 1 1 12 12 LEU C C 13 177.423 0.3 . 1 . . . . 526 LEU C . 19977 1 118 . 1 1 12 12 LEU CA C 13 55.254 0.3 . 1 . . . . 526 LEU CA . 19977 1 119 . 1 1 12 12 LEU CB C 13 42.118 0.3 . 1 . . . . 526 LEU CB . 19977 1 120 . 1 1 12 12 LEU CG C 13 26.818 0.3 . 1 . . . . 526 LEU CG . 19977 1 121 . 1 1 12 12 LEU CD1 C 13 24.733 0.3 . 1 . . . . 526 LEU CD1 . 19977 1 122 . 1 1 12 12 LEU CD2 C 13 23.518 0.3 . 1 . . . . 526 LEU CD2 . 19977 1 123 . 1 1 12 12 LEU N N 15 121.258 0.3 . 1 . . . . 526 LEU N . 19977 1 124 . 1 1 13 13 ARG H H 1 8.116 0.020 . 1 . . . . 527 ARG H . 19977 1 125 . 1 1 13 13 ARG HA H 1 4.165 0.020 . 1 . . . . 527 ARG HA . 19977 1 126 . 1 1 13 13 ARG HB2 H 1 1.753 0.020 . 2 . . . . 527 ARG HB2 . 19977 1 127 . 1 1 13 13 ARG HB3 H 1 1.713 0.020 . 2 . . . . 527 ARG HB3 . 19977 1 128 . 1 1 13 13 ARG HG2 H 1 1.556 0.020 . 1 . . . . 527 ARG HG2 . 19977 1 129 . 1 1 13 13 ARG HG3 H 1 1.556 0.020 . 1 . . . . 527 ARG HG3 . 19977 1 130 . 1 1 13 13 ARG HD2 H 1 3.116 0.020 . 1 . . . . 527 ARG HD2 . 19977 1 131 . 1 1 13 13 ARG HD3 H 1 3.116 0.020 . 1 . . . . 527 ARG HD3 . 19977 1 132 . 1 1 13 13 ARG C C 13 176.456 0.3 . 1 . . . . 527 ARG C . 19977 1 133 . 1 1 13 13 ARG CA C 13 56.555 0.3 . 1 . . . . 527 ARG CA . 19977 1 134 . 1 1 13 13 ARG CB C 13 30.478 0.3 . 1 . . . . 527 ARG CB . 19977 1 135 . 1 1 13 13 ARG CG C 13 26.943 0.3 . 1 . . . . 527 ARG CG . 19977 1 136 . 1 1 13 13 ARG CD C 13 43.109 0.3 . 1 . . . . 527 ARG CD . 19977 1 137 . 1 1 13 13 ARG N N 15 121.455 0.3 . 1 . . . . 527 ARG N . 19977 1 138 . 1 1 14 14 GLU H H 1 8.338 0.020 . 1 . . . . 528 GLU H . 19977 1 139 . 1 1 14 14 GLU HA H 1 4.092 0.020 . 1 . . . . 528 GLU HA . 19977 1 140 . 1 1 14 14 GLU HB2 H 1 1.943 0.020 . 2 . . . . 528 GLU HB2 . 19977 1 141 . 1 1 14 14 GLU HB3 H 1 1.859 0.020 . 2 . . . . 528 GLU HB3 . 19977 1 142 . 1 1 14 14 GLU HG2 H 1 2.154 0.020 . 1 . . . . 528 GLU HG2 . 19977 1 143 . 1 1 14 14 GLU HG3 H 1 2.154 0.020 . 1 . . . . 528 GLU HG3 . 19977 1 144 . 1 1 14 14 GLU C C 13 176.574 0.3 . 1 . . . . 528 GLU C . 19977 1 145 . 1 1 14 14 GLU CA C 13 57.209 0.3 . 1 . . . . 528 GLU CA . 19977 1 146 . 1 1 14 14 GLU CB C 13 29.972 0.3 . 1 . . . . 528 GLU CB . 19977 1 147 . 1 1 14 14 GLU CG C 13 36.194 0.3 . 1 . . . . 528 GLU CG . 19977 1 148 . 1 1 14 14 GLU N N 15 121.280 0.3 . 1 . . . . 528 GLU N . 19977 1 149 . 1 1 15 15 GLU H H 1 8.366 0.020 . 1 . . . . 529 GLU H . 19977 1 150 . 1 1 15 15 GLU HA H 1 4.097 0.020 . 1 . . . . 529 GLU HA . 19977 1 151 . 1 1 15 15 GLU HB2 H 1 1.941 0.020 . 2 . . . . 529 GLU HB2 . 19977 1 152 . 1 1 15 15 GLU HB3 H 1 1.866 0.020 . 2 . . . . 529 GLU HB3 . 19977 1 153 . 1 1 15 15 GLU HG2 H 1 2.154 0.020 . 1 . . . . 529 GLU HG2 . 19977 1 154 . 1 1 15 15 GLU HG3 H 1 2.154 0.020 . 1 . . . . 529 GLU HG3 . 19977 1 155 . 1 1 15 15 GLU C C 13 176.850 0.3 . 1 . . . . 529 GLU C . 19977 1 156 . 1 1 15 15 GLU CA C 13 57.056 0.3 . 1 . . . . 529 GLU CA . 19977 1 157 . 1 1 15 15 GLU CB C 13 29.838 0.3 . 1 . . . . 529 GLU CB . 19977 1 158 . 1 1 15 15 GLU CG C 13 36.171 0.3 . 1 . . . . 529 GLU CG . 19977 1 159 . 1 1 15 15 GLU N N 15 120.988 0.3 . 1 . . . . 529 GLU N . 19977 1 160 . 1 1 16 16 ILE H H 1 7.941 0.020 . 1 . . . . 530 ILE H . 19977 1 161 . 1 1 16 16 ILE HA H 1 4.004 0.020 . 1 . . . . 530 ILE HA . 19977 1 162 . 1 1 16 16 ILE HB H 1 1.803 0.020 . 1 . . . . 530 ILE HB . 19977 1 163 . 1 1 16 16 ILE HG12 H 1 1.375 0.020 . 2 . . . . 530 ILE HG12 . 19977 1 164 . 1 1 16 16 ILE HG13 H 1 1.093 0.020 . 2 . . . . 530 ILE HG13 . 19977 1 165 . 1 1 16 16 ILE HG21 H 1 0.789 0.020 . 1 . . . . 530 ILE HG2 . 19977 1 166 . 1 1 16 16 ILE HG22 H 1 0.789 0.020 . 1 . . . . 530 ILE HG2 . 19977 1 167 . 1 1 16 16 ILE HG23 H 1 0.789 0.020 . 1 . . . . 530 ILE HG2 . 19977 1 168 . 1 1 16 16 ILE HD11 H 1 0.719 0.020 . 1 . . . . 530 ILE HD1 . 19977 1 169 . 1 1 16 16 ILE HD12 H 1 0.719 0.020 . 1 . . . . 530 ILE HD1 . 19977 1 170 . 1 1 16 16 ILE HD13 H 1 0.719 0.020 . 1 . . . . 530 ILE HD1 . 19977 1 171 . 1 1 16 16 ILE C C 13 176.611 0.3 . 1 . . . . 530 ILE C . 19977 1 172 . 1 1 16 16 ILE CA C 13 61.653 0.3 . 1 . . . . 530 ILE CA . 19977 1 173 . 1 1 16 16 ILE CB C 13 38.119 0.3 . 1 . . . . 530 ILE CB . 19977 1 174 . 1 1 16 16 ILE CG1 C 13 27.436 0.3 . 1 . . . . 530 ILE CG1 . 19977 1 175 . 1 1 16 16 ILE CG2 C 13 17.405 0.3 . 1 . . . . 530 ILE CG2 . 19977 1 176 . 1 1 16 16 ILE CD1 C 13 12.603 0.3 . 1 . . . . 530 ILE CD1 . 19977 1 177 . 1 1 16 16 ILE N N 15 121.269 0.3 . 1 . . . . 530 ILE N . 19977 1 178 . 1 1 17 17 VAL H H 1 7.952 0.020 . 1 . . . . 531 VAL H . 19977 1 179 . 1 1 17 17 VAL HA H 1 3.862 0.020 . 1 . . . . 531 VAL HA . 19977 1 180 . 1 1 17 17 VAL HB H 1 1.920 0.020 . 1 . . . . 531 VAL HB . 19977 1 181 . 1 1 17 17 VAL HG11 H 1 0.767 0.020 . 1 . . . . 531 VAL HG1 . 19977 1 182 . 1 1 17 17 VAL HG12 H 1 0.767 0.020 . 1 . . . . 531 VAL HG1 . 19977 1 183 . 1 1 17 17 VAL HG13 H 1 0.767 0.020 . 1 . . . . 531 VAL HG1 . 19977 1 184 . 1 1 17 17 VAL HG21 H 1 0.767 0.020 . 1 . . . . 531 VAL HG2 . 19977 1 185 . 1 1 17 17 VAL HG22 H 1 0.767 0.020 . 1 . . . . 531 VAL HG2 . 19977 1 186 . 1 1 17 17 VAL HG23 H 1 0.767 0.020 . 1 . . . . 531 VAL HG2 . 19977 1 187 . 1 1 17 17 VAL C C 13 176.308 0.3 . 1 . . . . 531 VAL C . 19977 1 188 . 1 1 17 17 VAL CA C 13 63.257 0.3 . 1 . . . . 531 VAL CA . 19977 1 189 . 1 1 17 17 VAL CB C 13 32.110 0.3 . 1 . . . . 531 VAL CB . 19977 1 190 . 1 1 17 17 VAL CG1 C 13 20.932 0.3 . 1 . . . . 531 VAL CG1 . 19977 1 191 . 1 1 17 17 VAL N N 15 122.870 0.3 . 1 . . . . 531 VAL N . 19977 1 192 . 1 1 18 18 ASN H H 1 8.267 0.020 . 1 . . . . 532 ASN H . 19977 1 193 . 1 1 18 18 ASN HA H 1 4.502 0.020 . 1 . . . . 532 ASN HA . 19977 1 194 . 1 1 18 18 ASN HB2 H 1 2.682 0.020 . 1 . . . . 532 ASN HB2 . 19977 1 195 . 1 1 18 18 ASN HB3 H 1 2.682 0.020 . 1 . . . . 532 ASN HB3 . 19977 1 196 . 1 1 18 18 ASN HD21 H 1 7.516 0.020 . 1 . . . . 532 ASN HD21 . 19977 1 197 . 1 1 18 18 ASN HD22 H 1 6.786 0.020 . 1 . . . . 532 ASN HD22 . 19977 1 198 . 1 1 18 18 ASN C C 13 175.260 0.3 . 1 . . . . 532 ASN C . 19977 1 199 . 1 1 18 18 ASN CA C 13 53.718 0.3 . 1 . . . . 532 ASN CA . 19977 1 200 . 1 1 18 18 ASN CB C 13 38.469 0.3 . 1 . . . . 532 ASN CB . 19977 1 201 . 1 1 18 18 ASN N N 15 120.311 0.3 . 1 . . . . 532 ASN N . 19977 1 202 . 1 1 18 18 ASN ND2 N 15 112.632 0.3 . 1 . . . . 532 ASN ND2 . 19977 1 203 . 1 1 19 19 PHE H H 1 8.055 0.020 . 1 . . . . 533 PHE H . 19977 1 204 . 1 1 19 19 PHE HA H 1 4.289 0.020 . 1 . . . . 533 PHE HA . 19977 1 205 . 1 1 19 19 PHE HB2 H 1 3.105 0.020 . 2 . . . . 533 PHE HB2 . 19977 1 206 . 1 1 19 19 PHE HB3 H 1 2.973 0.020 . 2 . . . . 533 PHE HB3 . 19977 1 207 . 1 1 19 19 PHE HD1 H 1 7.247 0.020 . 1 . . . . 533 PHE HD1 . 19977 1 208 . 1 1 19 19 PHE HD2 H 1 7.247 0.020 . 1 . . . . 533 PHE HD2 . 19977 1 209 . 1 1 19 19 PHE HE1 H 1 7.181 0.020 . 1 . . . . 533 PHE HE1 . 19977 1 210 . 1 1 19 19 PHE HE2 H 1 7.181 0.020 . 1 . . . . 533 PHE HE2 . 19977 1 211 . 1 1 19 19 PHE CA C 13 59.097 0.3 . 1 . . . . 533 PHE CA . 19977 1 212 . 1 1 19 19 PHE CB C 13 39.050 0.3 . 1 . . . . 533 PHE CB . 19977 1 213 . 1 1 19 19 PHE N N 15 120.952 0.3 . 1 . . . . 533 PHE N . 19977 1 214 . 1 1 22 22 ARG H H 1 8.007 0.020 . 1 . . . A 536 ARG H . 19977 1 215 . 1 1 22 22 ARG HA H 1 3.408 0.020 . 1 . . . A 536 ARG HA . 19977 1 216 . 1 1 22 22 ARG HB2 H 1 1.633 0.020 . 1 . . . A 536 ARG HB2 . 19977 1 217 . 1 1 22 22 ARG HB3 H 1 1.633 0.020 . 1 . . . A 536 ARG HB3 . 19977 1 218 . 1 1 22 22 ARG HG2 H 1 1.241 0.020 . 1 . . . A 536 ARG HG2 . 19977 1 219 . 1 1 22 22 ARG HG3 H 1 1.241 0.020 . 1 . . . A 536 ARG HG3 . 19977 1 220 . 1 1 22 22 ARG HD2 H 1 2.938 0.020 . 1 . . . A 536 ARG HD2 . 19977 1 221 . 1 1 22 22 ARG HD3 H 1 2.938 0.020 . 1 . . . A 536 ARG HD3 . 19977 1 222 . 1 1 22 22 ARG C C 13 177.139 0.3 . 1 . . . A 536 ARG C . 19977 1 223 . 1 1 22 22 ARG CA C 13 60.287 0.3 . 1 . . . A 536 ARG CA . 19977 1 224 . 1 1 22 22 ARG CB C 13 29.225 0.3 . 1 . . . A 536 ARG CB . 19977 1 225 . 1 1 22 22 ARG CG C 13 28.166 0.3 . 1 . . . A 536 ARG CG . 19977 1 226 . 1 1 22 22 ARG CD C 13 42.667 0.3 . 1 . . . A 536 ARG CD . 19977 1 227 . 1 1 22 22 ARG N N 15 120.697 0.3 . 1 . . . A 536 ARG N . 19977 1 228 . 1 1 23 23 LYS H H 1 7.576 0.020 . 1 . . . A 537 LYS H . 19977 1 229 . 1 1 23 23 LYS HA H 1 3.839 0.020 . 1 . . . A 537 LYS HA . 19977 1 230 . 1 1 23 23 LYS HB2 H 1 1.668 0.020 . 1 . . . A 537 LYS HB2 . 19977 1 231 . 1 1 23 23 LYS HB3 H 1 1.668 0.020 . 1 . . . A 537 LYS HB3 . 19977 1 232 . 1 1 23 23 LYS HG2 H 1 1.285 0.020 . 1 . . . A 537 LYS HG2 . 19977 1 233 . 1 1 23 23 LYS HG3 H 1 1.285 0.020 . 1 . . . A 537 LYS HG3 . 19977 1 234 . 1 1 23 23 LYS HD2 H 1 1.571 0.020 . 1 . . . A 537 LYS HD2 . 19977 1 235 . 1 1 23 23 LYS HD3 H 1 1.571 0.020 . 1 . . . A 537 LYS HD3 . 19977 1 236 . 1 1 23 23 LYS HE2 H 1 2.875 0.020 . 1 . . . A 537 LYS HE2 . 19977 1 237 . 1 1 23 23 LYS HE3 H 1 2.875 0.020 . 1 . . . A 537 LYS HE3 . 19977 1 238 . 1 1 23 23 LYS C C 13 178.618 0.3 . 1 . . . A 537 LYS C . 19977 1 239 . 1 1 23 23 LYS CA C 13 58.770 0.3 . 1 . . . A 537 LYS CA . 19977 1 240 . 1 1 23 23 LYS CB C 13 32.053 0.3 . 1 . . . A 537 LYS CB . 19977 1 241 . 1 1 23 23 LYS CG C 13 24.727 0.3 . 1 . . . A 537 LYS CG . 19977 1 242 . 1 1 23 23 LYS CD C 13 29.091 0.3 . 1 . . . A 537 LYS CD . 19977 1 243 . 1 1 23 23 LYS CE C 13 42.083 0.3 . 1 . . . A 537 LYS CE . 19977 1 244 . 1 1 23 23 LYS N N 15 116.910 0.3 . 1 . . . A 537 LYS N . 19977 1 245 . 1 1 24 24 LEU H H 1 7.213 0.020 . 1 . . . A 538 LEU H . 19977 1 246 . 1 1 24 24 LEU HA H 1 4.086 0.020 . 1 . . . A 538 LEU HA . 19977 1 247 . 1 1 24 24 LEU HB2 H 1 1.598 0.020 . 2 . . . A 538 LEU HB2 . 19977 1 248 . 1 1 24 24 LEU HB3 H 1 1.499 0.020 . 2 . . . A 538 LEU HB3 . 19977 1 249 . 1 1 24 24 LEU HG H 1 1.227 0.020 . 1 . . . A 538 LEU HG . 19977 1 250 . 1 1 24 24 LEU HD11 H 1 0.935 0.020 . 1 . . . A 538 LEU HD11 . 19977 1 251 . 1 1 24 24 LEU HD12 H 1 0.935 0.020 . 1 . . . A 538 LEU HD12 . 19977 1 252 . 1 1 24 24 LEU HD13 H 1 0.935 0.020 . 1 . . . A 538 LEU HD13 . 19977 1 253 . 1 1 24 24 LEU HD21 H 1 0.920 0.020 . 1 . . . A 538 LEU HD21 . 19977 1 254 . 1 1 24 24 LEU HD22 H 1 0.920 0.020 . 1 . . . A 538 LEU HD22 . 19977 1 255 . 1 1 24 24 LEU HD23 H 1 0.920 0.020 . 1 . . . A 538 LEU HD23 . 19977 1 256 . 1 1 24 24 LEU C C 13 178.449 0.3 . 1 . . . A 538 LEU C . 19977 1 257 . 1 1 24 24 LEU CA C 13 57.570 0.3 . 1 . . . A 538 LEU CA . 19977 1 258 . 1 1 24 24 LEU CB C 13 41.739 0.3 . 1 . . . A 538 LEU CB . 19977 1 259 . 1 1 24 24 LEU CG C 13 26.737 0.3 . 1 . . . A 538 LEU CG . 19977 1 260 . 1 1 24 24 LEU CD1 C 13 24.418 0.3 . 1 . . . A 538 LEU CD1 . 19977 1 261 . 1 1 24 24 LEU CD2 C 13 24.528 0.3 . 1 . . . A 538 LEU CD2 . 19977 1 262 . 1 1 24 24 LEU N N 15 118.834 0.3 . 1 . . . A 538 LEU N . 19977 1 263 . 1 1 25 25 VAL H H 1 7.328 0.020 . 1 . . . A 539 VAL H . 19977 1 264 . 1 1 25 25 VAL HA H 1 3.388 0.020 . 1 . . . A 539 VAL HA . 19977 1 265 . 1 1 25 25 VAL HB H 1 1.475 0.020 . 1 . . . A 539 VAL HB . 19977 1 266 . 1 1 25 25 VAL HG11 H 1 0.152 0.020 . 1 . . . A 539 VAL HG11 . 19977 1 267 . 1 1 25 25 VAL HG12 H 1 0.152 0.020 . 1 . . . A 539 VAL HG12 . 19977 1 268 . 1 1 25 25 VAL HG13 H 1 0.152 0.020 . 1 . . . A 539 VAL HG13 . 19977 1 269 . 1 1 25 25 VAL HG21 H 1 0.127 0.020 . 1 . . . A 539 VAL HG21 . 19977 1 270 . 1 1 25 25 VAL HG22 H 1 0.127 0.020 . 1 . . . A 539 VAL HG22 . 19977 1 271 . 1 1 25 25 VAL HG23 H 1 0.127 0.020 . 1 . . . A 539 VAL HG23 . 19977 1 272 . 1 1 25 25 VAL C C 13 177.033 0.3 . 1 . . . A 539 VAL C . 19977 1 273 . 1 1 25 25 VAL CA C 13 64.867 0.3 . 1 . . . A 539 VAL CA . 19977 1 274 . 1 1 25 25 VAL CB C 13 31.308 0.3 . 1 . . . A 539 VAL CB . 19977 1 275 . 1 1 25 25 VAL CG1 C 13 21.462 0.3 . 1 . . . A 539 VAL CG1 . 19977 1 276 . 1 1 25 25 VAL CG2 C 13 20.765 0.3 . 1 . . . A 539 VAL CG2 . 19977 1 277 . 1 1 25 25 VAL N N 15 116.066 0.3 . 1 . . . A 539 VAL N . 19977 1 278 . 1 1 26 26 ALA H H 1 7.920 0.020 . 1 . . . A 540 ALA H . 19977 1 279 . 1 1 26 26 ALA HA H 1 3.916 0.020 . 1 . . . A 540 ALA HA . 19977 1 280 . 1 1 26 26 ALA HB1 H 1 1.349 0.020 . 1 . . . A 540 ALA HB1 . 19977 1 281 . 1 1 26 26 ALA HB2 H 1 1.349 0.020 . 1 . . . A 540 ALA HB2 . 19977 1 282 . 1 1 26 26 ALA HB3 H 1 1.349 0.020 . 1 . . . A 540 ALA HB3 . 19977 1 283 . 1 1 26 26 ALA C C 13 177.555 0.3 . 1 . . . A 540 ALA C . 19977 1 284 . 1 1 26 26 ALA CA C 13 53.656 0.3 . 1 . . . A 540 ALA CA . 19977 1 285 . 1 1 26 26 ALA CB C 13 18.164 0.3 . 1 . . . A 540 ALA CB . 19977 1 286 . 1 1 26 26 ALA N N 15 117.862 0.3 . 1 . . . A 540 ALA N . 19977 1 287 . 1 1 27 27 SER H H 1 7.326 0.020 . 1 . . . A 541 SER H . 19977 1 288 . 1 1 27 27 SER HA H 1 4.363 0.020 . 1 . . . A 541 SER HA . 19977 1 289 . 1 1 27 27 SER HB2 H 1 4.142 0.020 . 2 . . . A 541 SER HB2 . 19977 1 290 . 1 1 27 27 SER HB3 H 1 4.100 0.020 . 2 . . . A 541 SER HB3 . 19977 1 291 . 1 1 27 27 SER C C 13 174.152 0.3 . 1 . . . A 541 SER C . 19977 1 292 . 1 1 27 27 SER CA C 13 59.232 0.3 . 1 . . . A 541 SER CA . 19977 1 293 . 1 1 27 27 SER CB C 13 63.865 0.3 . 1 . . . A 541 SER CB . 19977 1 294 . 1 1 27 27 SER N N 15 110.460 0.3 . 1 . . . A 541 SER N . 19977 1 295 . 1 1 28 28 MET H H 1 7.693 0.020 . 1 . . . A 542 MET H . 19977 1 296 . 1 1 28 28 MET HA H 1 4.509 0.020 . 1 . . . A 542 MET HA . 19977 1 297 . 1 1 28 28 MET HB2 H 1 2.182 0.020 . 2 . . . A 542 MET HB2 . 19977 1 298 . 1 1 28 28 MET HB3 H 1 1.827 0.020 . 2 . . . A 542 MET HB3 . 19977 1 299 . 1 1 28 28 MET HG2 H 1 2.065 0.020 . 2 . . . A 542 MET HG2 . 19977 1 300 . 1 1 28 28 MET HG3 H 1 1.537 0.020 . 2 . . . A 542 MET HG3 . 19977 1 301 . 1 1 28 28 MET HE1 H 1 1.393 0.020 . 1 . . . A 542 MET HE1 . 19977 1 302 . 1 1 28 28 MET HE2 H 1 1.393 0.020 . 1 . . . A 542 MET HE2 . 19977 1 303 . 1 1 28 28 MET HE3 H 1 1.393 0.020 . 1 . . . A 542 MET HE3 . 19977 1 304 . 1 1 28 28 MET CA C 13 53.997 0.3 . 1 . . . A 542 MET CA . 19977 1 305 . 1 1 28 28 MET CB C 13 33.361 0.3 . 1 . . . A 542 MET CB . 19977 1 306 . 1 1 28 28 MET CG C 13 32.345 0.3 . 1 . . . A 542 MET CG . 19977 1 307 . 1 1 28 28 MET CE C 13 17.919 0.3 . 1 . . . A 542 MET CE . 19977 1 308 . 1 1 28 28 MET N N 15 126.210 0.3 . 1 . . . A 542 MET N . 19977 1 309 . 1 1 29 29 PRO HA H 1 4.142 0.020 . 1 . . . A 543 PRO HA . 19977 1 310 . 1 1 29 29 PRO HB2 H 1 2.329 0.020 . 1 . . . A 543 PRO HB2 . 19977 1 311 . 1 1 29 29 PRO HB3 H 1 2.329 0.020 . 1 . . . A 543 PRO HB3 . 19977 1 312 . 1 1 29 29 PRO HG2 H 1 2.050 0.020 . 1 . . . A 543 PRO HG2 . 19977 1 313 . 1 1 29 29 PRO HG3 H 1 2.050 0.020 . 1 . . . A 543 PRO HG3 . 19977 1 314 . 1 1 29 29 PRO HD2 H 1 4.203 0.020 . 2 . . . A 543 PRO HD2 . 19977 1 315 . 1 1 29 29 PRO HD3 H 1 3.619 0.020 . 2 . . . A 543 PRO HD3 . 19977 1 316 . 1 1 29 29 PRO C C 13 177.828 0.3 . 1 . . . A 543 PRO C . 19977 1 317 . 1 1 29 29 PRO CA C 13 65.846 0.3 . 1 . . . A 543 PRO CA . 19977 1 318 . 1 1 29 29 PRO CB C 13 31.981 0.3 . 1 . . . A 543 PRO CB . 19977 1 319 . 1 1 29 29 PRO CG C 13 27.531 0.3 . 1 . . . A 543 PRO CG . 19977 1 320 . 1 1 29 29 PRO CD C 13 51.577 0.3 . 1 . . . A 543 PRO CD . 19977 1 321 . 1 1 30 30 LEU H H 1 7.358 0.020 . 1 . . . A 544 LEU H . 19977 1 322 . 1 1 30 30 LEU HA H 1 3.845 0.020 . 1 . . . A 544 LEU HA . 19977 1 323 . 1 1 30 30 LEU HB2 H 1 1.016 0.020 . 2 . . . A 544 LEU HB2 . 19977 1 324 . 1 1 30 30 LEU HB3 H 1 0.841 0.020 . 2 . . . A 544 LEU HB3 . 19977 1 325 . 1 1 30 30 LEU HG H 1 1.075 0.020 . 1 . . . A 544 LEU HG . 19977 1 326 . 1 1 30 30 LEU HD11 H 1 0.484 0.020 . 1 . . . A 544 LEU HD11 . 19977 1 327 . 1 1 30 30 LEU HD12 H 1 0.484 0.020 . 1 . . . A 544 LEU HD12 . 19977 1 328 . 1 1 30 30 LEU HD13 H 1 0.484 0.020 . 1 . . . A 544 LEU HD13 . 19977 1 329 . 1 1 30 30 LEU HD21 H 1 0.345 0.020 . 1 . . . A 544 LEU HD21 . 19977 1 330 . 1 1 30 30 LEU HD22 H 1 0.345 0.020 . 1 . . . A 544 LEU HD22 . 19977 1 331 . 1 1 30 30 LEU HD23 H 1 0.345 0.020 . 1 . . . A 544 LEU HD23 . 19977 1 332 . 1 1 30 30 LEU C C 13 176.824 0.3 . 1 . . . A 544 LEU C . 19977 1 333 . 1 1 30 30 LEU CA C 13 56.955 0.3 . 1 . . . A 544 LEU CA . 19977 1 334 . 1 1 30 30 LEU CB C 13 41.999 0.3 . 1 . . . A 544 LEU CB . 19977 1 335 . 1 1 30 30 LEU CG C 13 26.610 0.3 . 1 . . . A 544 LEU CG . 19977 1 336 . 1 1 30 30 LEU CD1 C 13 24.227 0.3 . 1 . . . A 544 LEU CD1 . 19977 1 337 . 1 1 30 30 LEU CD2 C 13 23.782 0.3 . 1 . . . A 544 LEU CD2 . 19977 1 338 . 1 1 30 30 LEU N N 15 115.020 0.3 . 1 . . . A 544 LEU N . 19977 1 339 . 1 1 31 31 PHE H H 1 7.423 0.020 . 1 . . . A 545 PHE H . 19977 1 340 . 1 1 31 31 PHE HA H 1 4.734 0.020 . 1 . . . A 545 PHE HA . 19977 1 341 . 1 1 31 31 PHE HB2 H 1 3.110 0.020 . 1 . . . A 545 PHE HB2 . 19977 1 342 . 1 1 31 31 PHE HB3 H 1 3.110 0.020 . 1 . . . A 545 PHE HB3 . 19977 1 343 . 1 1 31 31 PHE HD1 H 1 7.249 0.020 . 1 . . . A 545 PHE HD1 . 19977 1 344 . 1 1 31 31 PHE HD2 H 1 7.249 0.020 . 1 . . . A 545 PHE HD2 . 19977 1 345 . 1 1 31 31 PHE HE1 H 1 6.995 0.020 . 1 . . . A 545 PHE HE1 . 19977 1 346 . 1 1 31 31 PHE HE2 H 1 6.995 0.020 . 1 . . . A 545 PHE HE2 . 19977 1 347 . 1 1 31 31 PHE HZ H 1 6.930 0.020 . 1 . . . A 545 PHE HZ . 19977 1 348 . 1 1 31 31 PHE C C 13 176.702 0.3 . 1 . . . A 545 PHE C . 19977 1 349 . 1 1 31 31 PHE CA C 13 56.116 0.3 . 1 . . . A 545 PHE CA . 19977 1 350 . 1 1 31 31 PHE CB C 13 38.715 0.3 . 1 . . . A 545 PHE CB . 19977 1 351 . 1 1 31 31 PHE CZ C 13 128.990 0.3 . 1 . . . A 545 PHE CZ . 19977 1 352 . 1 1 31 31 PHE N N 15 112.051 0.3 . 1 . . . A 545 PHE N . 19977 1 353 . 1 1 32 32 ALA H H 1 7.646 0.020 . 1 . . . A 546 ALA H . 19977 1 354 . 1 1 32 32 ALA HA H 1 4.150 0.020 . 1 . . . A 546 ALA HA . 19977 1 355 . 1 1 32 32 ALA HB1 H 1 1.378 0.020 . 1 . . . A 546 ALA HB1 . 19977 1 356 . 1 1 32 32 ALA HB2 H 1 1.378 0.020 . 1 . . . A 546 ALA HB2 . 19977 1 357 . 1 1 32 32 ALA HB3 H 1 1.378 0.020 . 1 . . . A 546 ALA HB3 . 19977 1 358 . 1 1 32 32 ALA C C 13 178.328 0.3 . 1 . . . A 546 ALA C . 19977 1 359 . 1 1 32 32 ALA CA C 13 54.984 0.3 . 1 . . . A 546 ALA CA . 19977 1 360 . 1 1 32 32 ALA CB C 13 18.815 0.3 . 1 . . . A 546 ALA CB . 19977 1 361 . 1 1 32 32 ALA N N 15 124.307 0.3 . 1 . . . A 546 ALA N . 19977 1 362 . 1 1 33 33 ASN H H 1 8.323 0.020 . 1 . . . A 547 ASN H . 19977 1 363 . 1 1 33 33 ASN HA H 1 4.744 0.020 . 1 . . . A 547 ASN HA . 19977 1 364 . 1 1 33 33 ASN HB2 H 1 2.862 0.020 . 2 . . . A 547 ASN HB2 . 19977 1 365 . 1 1 33 33 ASN HB3 H 1 2.588 0.020 . 2 . . . A 547 ASN HB3 . 19977 1 366 . 1 1 33 33 ASN HD21 H 1 7.499 0.020 . 1 . . . A 547 ASN HD21 . 19977 1 367 . 1 1 33 33 ASN HD22 H 1 6.852 0.020 . 1 . . . A 547 ASN HD22 . 19977 1 368 . 1 1 33 33 ASN C C 13 174.451 0.3 . 1 . . . A 547 ASN C . 19977 1 369 . 1 1 33 33 ASN CA C 13 52.506 0.3 . 1 . . . A 547 ASN CA . 19977 1 370 . 1 1 33 33 ASN CB C 13 38.627 0.3 . 1 . . . A 547 ASN CB . 19977 1 371 . 1 1 33 33 ASN CG C 13 176.970 0.3 . 1 . . . A 547 ASN CG . 19977 1 372 . 1 1 33 33 ASN N N 15 113.594 0.3 . 1 . . . A 547 ASN N . 19977 1 373 . 1 1 33 33 ASN ND2 N 15 113.419 0.3 . 1 . . . A 547 ASN ND2 . 19977 1 374 . 1 1 34 34 ALA H H 1 7.190 0.020 . 1 . . . A 548 ALA H . 19977 1 375 . 1 1 34 34 ALA HA H 1 4.136 0.020 . 1 . . . A 548 ALA HA . 19977 1 376 . 1 1 34 34 ALA HB1 H 1 1.513 0.020 . 1 . . . A 548 ALA HB1 . 19977 1 377 . 1 1 34 34 ALA HB2 H 1 1.513 0.020 . 1 . . . A 548 ALA HB2 . 19977 1 378 . 1 1 34 34 ALA HB3 H 1 1.513 0.020 . 1 . . . A 548 ALA HB3 . 19977 1 379 . 1 1 34 34 ALA C C 13 176.320 0.3 . 1 . . . A 548 ALA C . 19977 1 380 . 1 1 34 34 ALA CA C 13 51.343 0.3 . 1 . . . A 548 ALA CA . 19977 1 381 . 1 1 34 34 ALA CB C 13 20.447 0.3 . 1 . . . A 548 ALA CB . 19977 1 382 . 1 1 34 34 ALA N N 15 120.857 0.3 . 1 . . . A 548 ALA N . 19977 1 383 . 1 1 35 35 ASP H H 1 7.475 0.020 . 1 . . . A 549 ASP H . 19977 1 384 . 1 1 35 35 ASP HA H 1 4.641 0.020 . 1 . . . A 549 ASP HA . 19977 1 385 . 1 1 35 35 ASP HB2 H 1 2.714 0.020 . 2 . . . A 549 ASP HB2 . 19977 1 386 . 1 1 35 35 ASP HB3 H 1 2.532 0.020 . 2 . . . A 549 ASP HB3 . 19977 1 387 . 1 1 35 35 ASP CA C 13 52.432 0.3 . 1 . . . A 549 ASP CA . 19977 1 388 . 1 1 35 35 ASP CB C 13 42.002 0.3 . 1 . . . A 549 ASP CB . 19977 1 389 . 1 1 35 35 ASP N N 15 122.061 0.3 . 1 . . . A 549 ASP N . 19977 1 390 . 1 1 36 36 PRO HA H 1 4.130 0.020 . 1 . . . A 550 PRO HA . 19977 1 391 . 1 1 36 36 PRO HB2 H 1 1.883 0.020 . 2 . . . A 550 PRO HB2 . 19977 1 392 . 1 1 36 36 PRO HB3 H 1 2.296 0.020 . 2 . . . A 550 PRO HB3 . 19977 1 393 . 1 1 36 36 PRO HG2 H 1 2.005 0.020 . 1 . . . A 550 PRO HG2 . 19977 1 394 . 1 1 36 36 PRO HG3 H 1 2.005 0.020 . 1 . . . A 550 PRO HG3 . 19977 1 395 . 1 1 36 36 PRO HD2 H 1 3.875 0.020 . 2 . . . A 550 PRO HD2 . 19977 1 396 . 1 1 36 36 PRO HD3 H 1 3.846 0.020 . 2 . . . A 550 PRO HD3 . 19977 1 397 . 1 1 36 36 PRO C C 13 179.076 0.3 . 1 . . . A 550 PRO C . 19977 1 398 . 1 1 36 36 PRO CA C 13 65.253 0.3 . 1 . . . A 550 PRO CA . 19977 1 399 . 1 1 36 36 PRO CB C 13 32.113 0.3 . 1 . . . A 550 PRO CB . 19977 1 400 . 1 1 36 36 PRO CG C 13 27.523 0.3 . 1 . . . A 550 PRO CG . 19977 1 401 . 1 1 36 36 PRO CD C 13 51.083 0.3 . 1 . . . A 550 PRO CD . 19977 1 402 . 1 1 37 37 ASN H H 1 8.747 0.020 . 1 . . . A 551 ASN H . 19977 1 403 . 1 1 37 37 ASN HA H 1 4.369 0.020 . 1 . . . A 551 ASN HA . 19977 1 404 . 1 1 37 37 ASN HB2 H 1 3.000 0.020 . 2 . . . A 551 ASN HB2 . 19977 1 405 . 1 1 37 37 ASN HB3 H 1 2.906 0.020 . 2 . . . A 551 ASN HB3 . 19977 1 406 . 1 1 37 37 ASN HD21 H 1 8.157 0.020 . 1 . . . A 551 ASN HD21 . 19977 1 407 . 1 1 37 37 ASN HD22 H 1 7.070 0.020 . 1 . . . A 551 ASN HD22 . 19977 1 408 . 1 1 37 37 ASN C C 13 177.571 0.3 . 1 . . . A 551 ASN C . 19977 1 409 . 1 1 37 37 ASN CA C 13 55.997 0.3 . 1 . . . A 551 ASN CA . 19977 1 410 . 1 1 37 37 ASN CB C 13 37.579 0.3 . 1 . . . A 551 ASN CB . 19977 1 411 . 1 1 37 37 ASN CG C 13 176.844 0.3 . 1 . . . A 551 ASN CG . 19977 1 412 . 1 1 37 37 ASN N N 15 116.671 0.3 . 1 . . . A 551 ASN N . 19977 1 413 . 1 1 37 37 ASN ND2 N 15 115.486 0.3 . 1 . . . A 551 ASN ND2 . 19977 1 414 . 1 1 38 38 PHE H H 1 7.346 0.020 . 1 . . . A 552 PHE H . 19977 1 415 . 1 1 38 38 PHE HA H 1 3.208 0.020 . 1 . . . A 552 PHE HA . 19977 1 416 . 1 1 38 38 PHE HB2 H 1 2.169 0.020 . 1 . . . A 552 PHE HB2 . 19977 1 417 . 1 1 38 38 PHE HB3 H 1 2.169 0.020 . 1 . . . A 552 PHE HB3 . 19977 1 418 . 1 1 38 38 PHE HD1 H 1 6.794 0.020 . 1 . . . A 552 PHE HD1 . 19977 1 419 . 1 1 38 38 PHE HD2 H 1 6.794 0.020 . 1 . . . A 552 PHE HD2 . 19977 1 420 . 1 1 38 38 PHE HE1 H 1 6.851 0.020 . 1 . . . A 552 PHE HE1 . 19977 1 421 . 1 1 38 38 PHE HE2 H 1 6.851 0.020 . 1 . . . A 552 PHE HE2 . 19977 1 422 . 1 1 38 38 PHE HZ H 1 6.990 0.020 . 1 . . . A 552 PHE HZ . 19977 1 423 . 1 1 38 38 PHE C C 13 175.692 0.3 . 1 . . . A 552 PHE C . 19977 1 424 . 1 1 38 38 PHE CA C 13 59.874 0.3 . 1 . . . A 552 PHE CA . 19977 1 425 . 1 1 38 38 PHE CB C 13 38.367 0.3 . 1 . . . A 552 PHE CB . 19977 1 426 . 1 1 38 38 PHE N N 15 123.291 0.3 . 1 . . . A 552 PHE N . 19977 1 427 . 1 1 39 39 VAL H H 1 7.433 0.020 . 1 . . . A 553 VAL H . 19977 1 428 . 1 1 39 39 VAL HA H 1 2.843 0.020 . 1 . . . A 553 VAL HA . 19977 1 429 . 1 1 39 39 VAL HB H 1 1.995 0.020 . 1 . . . A 553 VAL HB . 19977 1 430 . 1 1 39 39 VAL HG11 H 1 0.977 0.020 . 1 . . . A 553 VAL HG11 . 19977 1 431 . 1 1 39 39 VAL HG12 H 1 0.977 0.020 . 1 . . . A 553 VAL HG12 . 19977 1 432 . 1 1 39 39 VAL HG13 H 1 0.977 0.020 . 1 . . . A 553 VAL HG13 . 19977 1 433 . 1 1 39 39 VAL HG21 H 1 0.606 0.020 . 1 . . . A 553 VAL HG21 . 19977 1 434 . 1 1 39 39 VAL HG22 H 1 0.606 0.020 . 1 . . . A 553 VAL HG22 . 19977 1 435 . 1 1 39 39 VAL HG23 H 1 0.606 0.020 . 1 . . . A 553 VAL HG23 . 19977 1 436 . 1 1 39 39 VAL C C 13 177.041 0.3 . 1 . . . A 553 VAL C . 19977 1 437 . 1 1 39 39 VAL CA C 13 67.207 0.3 . 1 . . . A 553 VAL CA . 19977 1 438 . 1 1 39 39 VAL CB C 13 31.019 0.3 . 1 . . . A 553 VAL CB . 19977 1 439 . 1 1 39 39 VAL CG1 C 13 23.468 0.3 . 1 . . . A 553 VAL CG1 . 19977 1 440 . 1 1 39 39 VAL CG2 C 13 20.721 0.3 . 1 . . . A 553 VAL CG2 . 19977 1 441 . 1 1 39 39 VAL N N 15 118.950 0.3 . 1 . . . A 553 VAL N . 19977 1 442 . 1 1 40 40 THR H H 1 8.137 0.020 . 1 . . . A 554 THR H . 19977 1 443 . 1 1 40 40 THR HA H 1 3.487 0.020 . 1 . . . A 554 THR HA . 19977 1 444 . 1 1 40 40 THR HB H 1 4.140 0.020 . 1 . . . A 554 THR HB . 19977 1 445 . 1 1 40 40 THR HG21 H 1 1.092 0.020 . 1 . . . A 554 THR HG21 . 19977 1 446 . 1 1 40 40 THR HG22 H 1 1.092 0.020 . 1 . . . A 554 THR HG22 . 19977 1 447 . 1 1 40 40 THR HG23 H 1 1.092 0.020 . 1 . . . A 554 THR HG23 . 19977 1 448 . 1 1 40 40 THR C C 13 175.829 0.3 . 1 . . . A 554 THR C . 19977 1 449 . 1 1 40 40 THR CA C 13 66.659 0.3 . 1 . . . A 554 THR CA . 19977 1 450 . 1 1 40 40 THR CB C 13 68.553 0.3 . 1 . . . A 554 THR CB . 19977 1 451 . 1 1 40 40 THR CG2 C 13 22.282 0.3 . 1 . . . A 554 THR CG2 . 19977 1 452 . 1 1 40 40 THR N N 15 115.607 0.3 . 1 . . . A 554 THR N . 19977 1 453 . 1 1 41 41 ALA H H 1 7.461 0.020 . 1 . . . A 555 ALA H . 19977 1 454 . 1 1 41 41 ALA HA H 1 4.056 0.020 . 1 . . . A 555 ALA HA . 19977 1 455 . 1 1 41 41 ALA HB1 H 1 1.401 0.020 . 1 . . . A 555 ALA HB1 . 19977 1 456 . 1 1 41 41 ALA HB2 H 1 1.401 0.020 . 1 . . . A 555 ALA HB2 . 19977 1 457 . 1 1 41 41 ALA HB3 H 1 1.401 0.020 . 1 . . . A 555 ALA HB3 . 19977 1 458 . 1 1 41 41 ALA C C 13 180.438 0.3 . 1 . . . A 555 ALA C . 19977 1 459 . 1 1 41 41 ALA CA C 13 54.825 0.3 . 1 . . . A 555 ALA CA . 19977 1 460 . 1 1 41 41 ALA CB C 13 18.488 0.3 . 1 . . . A 555 ALA CB . 19977 1 461 . 1 1 41 41 ALA N N 15 122.747 0.3 . 1 . . . A 555 ALA N . 19977 1 462 . 1 1 42 42 MET H H 1 7.994 0.020 . 1 . . . A 556 MET H . 19977 1 463 . 1 1 42 42 MET HA H 1 3.754 0.020 . 1 . . . A 556 MET HA . 19977 1 464 . 1 1 42 42 MET HB2 H 1 1.559 0.020 . 2 . . . A 556 MET HB2 . 19977 1 465 . 1 1 42 42 MET HB3 H 1 1.484 0.020 . 2 . . . A 556 MET HB3 . 19977 1 466 . 1 1 42 42 MET HG2 H 1 1.946 0.020 . 1 . . . A 556 MET HG2 . 19977 1 467 . 1 1 42 42 MET HG3 H 1 1.946 0.020 . 1 . . . A 556 MET HG3 . 19977 1 468 . 1 1 42 42 MET HE1 H 1 1.156 0.020 . 1 . . . A 556 MET HE1 . 19977 1 469 . 1 1 42 42 MET HE2 H 1 1.156 0.020 . 1 . . . A 556 MET HE2 . 19977 1 470 . 1 1 42 42 MET HE3 H 1 1.156 0.020 . 1 . . . A 556 MET HE3 . 19977 1 471 . 1 1 42 42 MET C C 13 178.618 0.3 . 1 . . . A 556 MET C . 19977 1 472 . 1 1 42 42 MET CA C 13 57.628 0.3 . 1 . . . A 556 MET CA . 19977 1 473 . 1 1 42 42 MET CB C 13 30.910 0.3 . 1 . . . A 556 MET CB . 19977 1 474 . 1 1 42 42 MET CG C 13 31.637 0.3 . 1 . . . A 556 MET CG . 19977 1 475 . 1 1 42 42 MET CE C 13 17.460 0.3 . 1 . . . A 556 MET CE . 19977 1 476 . 1 1 42 42 MET N N 15 119.583 0.3 . 1 . . . A 556 MET N . 19977 1 477 . 1 1 43 43 LEU H H 1 7.939 0.020 . 1 . . . A 557 LEU H . 19977 1 478 . 1 1 43 43 LEU HA H 1 3.600 0.020 . 1 . . . A 557 LEU HA . 19977 1 479 . 1 1 43 43 LEU HB2 H 1 1.799 0.020 . 2 . . . A 557 LEU HB2 . 19977 1 480 . 1 1 43 43 LEU HB3 H 1 1.278 0.020 . 2 . . . A 557 LEU HB3 . 19977 1 481 . 1 1 43 43 LEU HG H 1 1.809 0.020 . 1 . . . A 557 LEU HG . 19977 1 482 . 1 1 43 43 LEU HD11 H 1 0.578 0.020 . 1 . . . A 557 LEU HD11 . 19977 1 483 . 1 1 43 43 LEU HD12 H 1 0.578 0.020 . 1 . . . A 557 LEU HD12 . 19977 1 484 . 1 1 43 43 LEU HD13 H 1 0.578 0.020 . 1 . . . A 557 LEU HD13 . 19977 1 485 . 1 1 43 43 LEU HD21 H 1 0.353 0.020 . 1 . . . A 557 LEU HD21 . 19977 1 486 . 1 1 43 43 LEU HD22 H 1 0.353 0.020 . 1 . . . A 557 LEU HD22 . 19977 1 487 . 1 1 43 43 LEU HD23 H 1 0.353 0.020 . 1 . . . A 557 LEU HD23 . 19977 1 488 . 1 1 43 43 LEU C C 13 179.742 0.3 . 1 . . . A 557 LEU C . 19977 1 489 . 1 1 43 43 LEU CA C 13 57.563 0.3 . 1 . . . A 557 LEU CA . 19977 1 490 . 1 1 43 43 LEU CB C 13 40.590 0.3 . 1 . . . A 557 LEU CB . 19977 1 491 . 1 1 43 43 LEU CG C 13 25.331 0.3 . 1 . . . A 557 LEU CG . 19977 1 492 . 1 1 43 43 LEU CD1 C 13 25.018 0.3 . 1 . . . A 557 LEU CD1 . 19977 1 493 . 1 1 43 43 LEU CD2 C 13 22.912 0.3 . 1 . . . A 557 LEU CD2 . 19977 1 494 . 1 1 43 43 LEU N N 15 116.280 0.3 . 1 . . . A 557 LEU N . 19977 1 495 . 1 1 44 44 THR H H 1 7.240 0.020 . 1 . . . A 558 THR H . 19977 1 496 . 1 1 44 44 THR HA H 1 4.110 0.020 . 1 . . . A 558 THR HA . 19977 1 497 . 1 1 44 44 THR HB H 1 4.262 0.020 . 1 . . . A 558 THR HB . 19977 1 498 . 1 1 44 44 THR HG21 H 1 1.313 0.020 . 1 . . . A 558 THR HG21 . 19977 1 499 . 1 1 44 44 THR HG22 H 1 1.313 0.020 . 1 . . . A 558 THR HG22 . 19977 1 500 . 1 1 44 44 THR HG23 H 1 1.313 0.020 . 1 . . . A 558 THR HG23 . 19977 1 501 . 1 1 44 44 THR C C 13 175.387 0.3 . 1 . . . A 558 THR C . 19977 1 502 . 1 1 44 44 THR CA C 13 63.972 0.3 . 1 . . . A 558 THR CA . 19977 1 503 . 1 1 44 44 THR CB C 13 69.240 0.3 . 1 . . . A 558 THR CB . 19977 1 504 . 1 1 44 44 THR CG2 C 13 21.408 0.3 . 1 . . . A 558 THR CG2 . 19977 1 505 . 1 1 44 44 THR N N 15 107.255 0.3 . 1 . . . A 558 THR N . 19977 1 506 . 1 1 45 45 LYS H H 1 7.568 0.020 . 1 . . . A 559 LYS H . 19977 1 507 . 1 1 45 45 LYS HA H 1 4.297 0.020 . 1 . . . A 559 LYS HA . 19977 1 508 . 1 1 45 45 LYS HB2 H 1 1.790 0.020 . 1 . . . A 559 LYS HB2 . 19977 1 509 . 1 1 45 45 LYS HB3 H 1 1.790 0.020 . 1 . . . A 559 LYS HB3 . 19977 1 510 . 1 1 45 45 LYS HG2 H 1 1.482 0.020 . 1 . . . A 559 LYS HG2 . 19977 1 511 . 1 1 45 45 LYS HG3 H 1 1.482 0.020 . 1 . . . A 559 LYS HG3 . 19977 1 512 . 1 1 45 45 LYS HD2 H 1 1.352 0.020 . 1 . . . A 559 LYS HD2 . 19977 1 513 . 1 1 45 45 LYS HD3 H 1 1.352 0.020 . 1 . . . A 559 LYS HD3 . 19977 1 514 . 1 1 45 45 LYS HE2 H 1 2.714 0.020 . 2 . . . A 559 LYS HE2 . 19977 1 515 . 1 1 45 45 LYS HE3 H 1 2.636 0.020 . 2 . . . A 559 LYS HE3 . 19977 1 516 . 1 1 45 45 LYS C C 13 176.898 0.3 . 1 . . . A 559 LYS C . 19977 1 517 . 1 1 45 45 LYS CA C 13 53.429 0.3 . 1 . . . A 559 LYS CA . 19977 1 518 . 1 1 45 45 LYS CB C 13 32.207 0.3 . 1 . . . A 559 LYS CB . 19977 1 519 . 1 1 45 45 LYS CG C 13 23.483 0.3 . 1 . . . A 559 LYS CG . 19977 1 520 . 1 1 45 45 LYS CD C 13 26.861 0.3 . 1 . . . A 559 LYS CD . 19977 1 521 . 1 1 45 45 LYS CE C 13 42.359 0.3 . 1 . . . A 559 LYS CE . 19977 1 522 . 1 1 45 45 LYS N N 15 117.202 0.3 . 1 . . . A 559 LYS N . 19977 1 523 . 1 1 46 46 LEU H H 1 6.952 0.020 . 1 . . . A 560 LEU H . 19977 1 524 . 1 1 46 46 LEU HA H 1 4.696 0.020 . 1 . . . A 560 LEU HA . 19977 1 525 . 1 1 46 46 LEU HB2 H 1 1.371 0.020 . 1 . . . A 560 LEU HB2 . 19977 1 526 . 1 1 46 46 LEU HB3 H 1 1.371 0.020 . 1 . . . A 560 LEU HB3 . 19977 1 527 . 1 1 46 46 LEU HG H 1 1.771 0.020 . 1 . . . A 560 LEU HG . 19977 1 528 . 1 1 46 46 LEU HD11 H 1 0.420 0.020 . 1 . . . A 560 LEU HD11 . 19977 1 529 . 1 1 46 46 LEU HD12 H 1 0.420 0.020 . 1 . . . A 560 LEU HD12 . 19977 1 530 . 1 1 46 46 LEU HD13 H 1 0.420 0.020 . 1 . . . A 560 LEU HD13 . 19977 1 531 . 1 1 46 46 LEU HD21 H 1 0.531 0.020 . 1 . . . A 560 LEU HD21 . 19977 1 532 . 1 1 46 46 LEU HD22 H 1 0.531 0.020 . 1 . . . A 560 LEU HD22 . 19977 1 533 . 1 1 46 46 LEU HD23 H 1 0.531 0.020 . 1 . . . A 560 LEU HD23 . 19977 1 534 . 1 1 46 46 LEU C C 13 177.447 0.3 . 1 . . . A 560 LEU C . 19977 1 535 . 1 1 46 46 LEU CA C 13 55.381 0.3 . 1 . . . A 560 LEU CA . 19977 1 536 . 1 1 46 46 LEU CB C 13 42.509 0.3 . 1 . . . A 560 LEU CB . 19977 1 537 . 1 1 46 46 LEU CG C 13 26.253 0.3 . 1 . . . A 560 LEU CG . 19977 1 538 . 1 1 46 46 LEU CD1 C 13 25.791 0.3 . 1 . . . A 560 LEU CD1 . 19977 1 539 . 1 1 46 46 LEU CD2 C 13 23.582 0.3 . 1 . . . A 560 LEU CD2 . 19977 1 540 . 1 1 46 46 LEU N N 15 119.508 0.3 . 1 . . . A 560 LEU N . 19977 1 541 . 1 1 47 47 LYS H H 1 9.078 0.020 . 1 . . . A 561 LYS H . 19977 1 542 . 1 1 47 47 LYS HA H 1 4.810 0.020 . 1 . . . A 561 LYS HA . 19977 1 543 . 1 1 47 47 LYS HB2 H 1 1.968 0.020 . 2 . . . A 561 LYS HB2 . 19977 1 544 . 1 1 47 47 LYS HB3 H 1 1.846 0.020 . 2 . . . A 561 LYS HB3 . 19977 1 545 . 1 1 47 47 LYS HG2 H 1 1.487 0.020 . 2 . . . A 561 LYS HG2 . 19977 1 546 . 1 1 47 47 LYS HG3 H 1 1.347 0.020 . 2 . . . A 561 LYS HG3 . 19977 1 547 . 1 1 47 47 LYS HD2 H 1 1.657 0.020 . 1 . . . A 561 LYS HD2 . 19977 1 548 . 1 1 47 47 LYS HD3 H 1 1.657 0.020 . 1 . . . A 561 LYS HD3 . 19977 1 549 . 1 1 47 47 LYS HE2 H 1 2.974 0.020 . 1 . . . A 561 LYS HE2 . 19977 1 550 . 1 1 47 47 LYS HE3 H 1 2.974 0.020 . 1 . . . A 561 LYS HE3 . 19977 1 551 . 1 1 47 47 LYS C C 13 175.073 0.3 . 1 . . . A 561 LYS C . 19977 1 552 . 1 1 47 47 LYS CA C 13 54.214 0.3 . 1 . . . A 561 LYS CA . 19977 1 553 . 1 1 47 47 LYS CB C 13 34.239 0.3 . 1 . . . A 561 LYS CB . 19977 1 554 . 1 1 47 47 LYS CG C 13 24.727 0.3 . 1 . . . A 561 LYS CG . 19977 1 555 . 1 1 47 47 LYS CD C 13 28.732 0.3 . 1 . . . A 561 LYS CD . 19977 1 556 . 1 1 47 47 LYS CE C 13 42.255 0.3 . 1 . . . A 561 LYS CE . 19977 1 557 . 1 1 47 47 LYS N N 15 123.514 0.3 . 1 . . . A 561 LYS N . 19977 1 558 . 1 1 48 48 PHE H H 1 8.765 0.020 . 1 . . . A 562 PHE H . 19977 1 559 . 1 1 48 48 PHE HA H 1 4.602 0.020 . 1 . . . A 562 PHE HA . 19977 1 560 . 1 1 48 48 PHE HB2 H 1 2.911 0.020 . 2 . . . A 562 PHE HB2 . 19977 1 561 . 1 1 48 48 PHE HB3 H 1 2.814 0.020 . 2 . . . A 562 PHE HB3 . 19977 1 562 . 1 1 48 48 PHE HD1 H 1 6.625 0.020 . 1 . . . A 562 PHE HD1 . 19977 1 563 . 1 1 48 48 PHE HD2 H 1 6.625 0.020 . 1 . . . A 562 PHE HD2 . 19977 1 564 . 1 1 48 48 PHE HE1 H 1 6.951 0.020 . 1 . . . A 562 PHE HE1 . 19977 1 565 . 1 1 48 48 PHE HE2 H 1 6.951 0.020 . 1 . . . A 562 PHE HE2 . 19977 1 566 . 1 1 48 48 PHE HZ H 1 6.912 0.020 . 1 . . . A 562 PHE HZ . 19977 1 567 . 1 1 48 48 PHE C C 13 175.010 0.3 . 1 . . . A 562 PHE C . 19977 1 568 . 1 1 48 48 PHE CA C 13 57.512 0.3 . 1 . . . A 562 PHE CA . 19977 1 569 . 1 1 48 48 PHE CB C 13 39.876 0.3 . 1 . . . A 562 PHE CB . 19977 1 570 . 1 1 48 48 PHE N N 15 126.517 0.3 . 1 . . . A 562 PHE N . 19977 1 571 . 1 1 49 49 GLU H H 1 8.753 0.020 . 1 . . . A 563 GLU H . 19977 1 572 . 1 1 49 49 GLU HA H 1 4.275 0.020 . 1 . . . A 563 GLU HA . 19977 1 573 . 1 1 49 49 GLU HB2 H 1 2.108 0.020 . 1 . . . A 563 GLU HB2 . 19977 1 574 . 1 1 49 49 GLU HB3 H 1 2.108 0.020 . 1 . . . A 563 GLU HB3 . 19977 1 575 . 1 1 49 49 GLU HG2 H 1 2.015 0.020 . 1 . . . A 563 GLU HG2 . 19977 1 576 . 1 1 49 49 GLU HG3 H 1 2.015 0.020 . 1 . . . A 563 GLU HG3 . 19977 1 577 . 1 1 49 49 GLU C C 13 172.696 0.3 . 1 . . . A 563 GLU C . 19977 1 578 . 1 1 49 49 GLU CA C 13 55.753 0.3 . 1 . . . A 563 GLU CA . 19977 1 579 . 1 1 49 49 GLU CB C 13 35.056 0.3 . 1 . . . A 563 GLU CB . 19977 1 580 . 1 1 49 49 GLU CG C 13 36.302 0.3 . 1 . . . A 563 GLU CG . 19977 1 581 . 1 1 49 49 GLU N N 15 128.845 0.3 . 1 . . . A 563 GLU N . 19977 1 582 . 1 1 50 50 VAL H H 1 7.595 0.020 . 1 . . . A 564 VAL H . 19977 1 583 . 1 1 50 50 VAL HA H 1 4.903 0.020 . 1 . . . A 564 VAL HA . 19977 1 584 . 1 1 50 50 VAL HB H 1 1.628 0.020 . 1 . . . A 564 VAL HB . 19977 1 585 . 1 1 50 50 VAL HG11 H 1 0.634 0.020 . 1 . . . A 564 VAL HG11 . 19977 1 586 . 1 1 50 50 VAL HG12 H 1 0.634 0.020 . 1 . . . A 564 VAL HG12 . 19977 1 587 . 1 1 50 50 VAL HG13 H 1 0.634 0.020 . 1 . . . A 564 VAL HG13 . 19977 1 588 . 1 1 50 50 VAL HG21 H 1 0.610 0.020 . 1 . . . A 564 VAL HG21 . 19977 1 589 . 1 1 50 50 VAL HG22 H 1 0.610 0.020 . 1 . . . A 564 VAL HG22 . 19977 1 590 . 1 1 50 50 VAL HG23 H 1 0.610 0.020 . 1 . . . A 564 VAL HG23 . 19977 1 591 . 1 1 50 50 VAL C C 13 175.313 0.3 . 1 . . . A 564 VAL C . 19977 1 592 . 1 1 50 50 VAL CA C 13 58.767 0.3 . 1 . . . A 564 VAL CA . 19977 1 593 . 1 1 50 50 VAL CB C 13 34.456 0.3 . 1 . . . A 564 VAL CB . 19977 1 594 . 1 1 50 50 VAL CG1 C 13 22.114 0.3 . 1 . . . A 564 VAL CG1 . 19977 1 595 . 1 1 50 50 VAL CG2 C 13 20.376 0.3 . 1 . . . A 564 VAL CG2 . 19977 1 596 . 1 1 50 50 VAL N N 15 116.264 0.3 . 1 . . . A 564 VAL N . 19977 1 597 . 1 1 51 51 PHE H H 1 8.165 0.020 . 1 . . . A 565 PHE H . 19977 1 598 . 1 1 51 51 PHE HA H 1 4.517 0.020 . 1 . . . A 565 PHE HA . 19977 1 599 . 1 1 51 51 PHE HB2 H 1 3.028 0.020 . 2 . . . A 565 PHE HB2 . 19977 1 600 . 1 1 51 51 PHE HB3 H 1 2.932 0.020 . 2 . . . A 565 PHE HB3 . 19977 1 601 . 1 1 51 51 PHE HD1 H 1 6.940 0.020 . 1 . . . A 565 PHE HD1 . 19977 1 602 . 1 1 51 51 PHE HD2 H 1 6.940 0.020 . 1 . . . A 565 PHE HD2 . 19977 1 603 . 1 1 51 51 PHE HE1 H 1 7.390 0.020 . 1 . . . A 565 PHE HE1 . 19977 1 604 . 1 1 51 51 PHE HE2 H 1 7.390 0.020 . 1 . . . A 565 PHE HE2 . 19977 1 605 . 1 1 51 51 PHE HZ H 1 7.154 0.020 . 1 . . . A 565 PHE HZ . 19977 1 606 . 1 1 51 51 PHE C C 13 173.194 0.3 . 1 . . . A 565 PHE C . 19977 1 607 . 1 1 51 51 PHE CA C 13 56.982 0.3 . 1 . . . A 565 PHE CA . 19977 1 608 . 1 1 51 51 PHE CB C 13 43.427 0.3 . 1 . . . A 565 PHE CB . 19977 1 609 . 1 1 51 51 PHE N N 15 121.156 0.3 . 1 . . . A 565 PHE N . 19977 1 610 . 1 1 52 52 GLN H H 1 8.831 0.020 . 1 . . . A 566 GLN H . 19977 1 611 . 1 1 52 52 GLN HA H 1 4.466 0.020 . 1 . . . A 566 GLN HA . 19977 1 612 . 1 1 52 52 GLN HB2 H 1 2.078 0.020 . 2 . . . A 566 GLN HB2 . 19977 1 613 . 1 1 52 52 GLN HB3 H 1 1.737 0.020 . 2 . . . A 566 GLN HB3 . 19977 1 614 . 1 1 52 52 GLN HG2 H 1 2.405 0.020 . 1 . . . A 566 GLN HG2 . 19977 1 615 . 1 1 52 52 GLN HG3 H 1 2.405 0.020 . 1 . . . A 566 GLN HG3 . 19977 1 616 . 1 1 52 52 GLN HE21 H 1 7.633 0.020 . 1 . . . A 566 GLN HE21 . 19977 1 617 . 1 1 52 52 GLN HE22 H 1 6.719 0.020 . 1 . . . A 566 GLN HE22 . 19977 1 618 . 1 1 52 52 GLN CA C 13 52.926 0.3 . 1 . . . A 566 GLN CA . 19977 1 619 . 1 1 52 52 GLN CB C 13 27.659 0.3 . 1 . . . A 566 GLN CB . 19977 1 620 . 1 1 52 52 GLN CG C 13 32.881 0.3 . 1 . . . A 566 GLN CG . 19977 1 621 . 1 1 52 52 GLN CD C 13 180.161 0.3 . 1 . . . A 566 GLN CD . 19977 1 622 . 1 1 52 52 GLN N N 15 120.001 0.3 . 1 . . . A 566 GLN N . 19977 1 623 . 1 1 52 52 GLN NE2 N 15 111.585 0.3 . 1 . . . A 566 GLN NE2 . 19977 1 624 . 1 1 53 53 PRO HA H 1 3.438 0.020 . 1 . . . A 567 PRO HA . 19977 1 625 . 1 1 53 53 PRO HB2 H 1 1.736 0.020 . 1 . . . A 567 PRO HB2 . 19977 1 626 . 1 1 53 53 PRO HB3 H 1 1.736 0.020 . 1 . . . A 567 PRO HB3 . 19977 1 627 . 1 1 53 53 PRO HG2 H 1 2.079 0.020 . 2 . . . A 567 PRO HG2 . 19977 1 628 . 1 1 53 53 PRO HG3 H 1 1.735 0.020 . 2 . . . A 567 PRO HG3 . 19977 1 629 . 1 1 53 53 PRO HD2 H 1 3.196 0.020 . 1 . . . A 567 PRO HD2 . 19977 1 630 . 1 1 53 53 PRO HD3 H 1 3.196 0.020 . 1 . . . A 567 PRO HD3 . 19977 1 631 . 1 1 53 53 PRO C C 13 177.663 0.3 . 1 . . . A 567 PRO C . 19977 1 632 . 1 1 53 53 PRO CA C 13 63.635 0.3 . 1 . . . A 567 PRO CA . 19977 1 633 . 1 1 53 53 PRO CB C 13 30.793 0.3 . 1 . . . A 567 PRO CB . 19977 1 634 . 1 1 53 53 PRO CG C 13 27.816 0.3 . 1 . . . A 567 PRO CG . 19977 1 635 . 1 1 53 53 PRO CD C 13 49.768 0.3 . 1 . . . A 567 PRO CD . 19977 1 636 . 1 1 54 54 GLY H H 1 8.954 0.020 . 1 . . . A 568 GLY H . 19977 1 637 . 1 1 54 54 GLY HA2 H 1 4.288 0.020 . 1 . . . A 568 GLY HA2 . 19977 1 638 . 1 1 54 54 GLY HA3 H 1 4.288 0.020 . 1 . . . A 568 GLY HA3 . 19977 1 639 . 1 1 54 54 GLY C C 13 174.579 0.3 . 1 . . . A 568 GLY C . 19977 1 640 . 1 1 54 54 GLY CA C 13 44.599 0.3 . 1 . . . A 568 GLY CA . 19977 1 641 . 1 1 54 54 GLY N N 15 113.711 0.3 . 1 . . . A 568 GLY N . 19977 1 642 . 1 1 55 55 ASP H H 1 8.133 0.020 . 1 . . . A 569 ASP H . 19977 1 643 . 1 1 55 55 ASP HA H 1 4.522 0.020 . 1 . . . A 569 ASP HA . 19977 1 644 . 1 1 55 55 ASP HB2 H 1 2.927 0.020 . 1 . . . A 569 ASP HB2 . 19977 1 645 . 1 1 55 55 ASP HB3 H 1 2.927 0.020 . 1 . . . A 569 ASP HB3 . 19977 1 646 . 1 1 55 55 ASP C C 13 176.420 0.3 . 1 . . . A 569 ASP C . 19977 1 647 . 1 1 55 55 ASP CA C 13 55.039 0.3 . 1 . . . A 569 ASP CA . 19977 1 648 . 1 1 55 55 ASP CB C 13 41.718 0.3 . 1 . . . A 569 ASP CB . 19977 1 649 . 1 1 55 55 ASP N N 15 121.723 0.3 . 1 . . . A 569 ASP N . 19977 1 650 . 1 1 56 56 TYR H H 1 8.999 0.020 . 1 . . . A 570 TYR H . 19977 1 651 . 1 1 56 56 TYR HA H 1 4.313 0.020 . 1 . . . A 570 TYR HA . 19977 1 652 . 1 1 56 56 TYR HB2 H 1 2.837 0.020 . 2 . . . A 570 TYR HB2 . 19977 1 653 . 1 1 56 56 TYR HB3 H 1 2.331 0.020 . 2 . . . A 570 TYR HB3 . 19977 1 654 . 1 1 56 56 TYR HD1 H 1 7.081 0.020 . 1 . . . A 570 TYR HD1 . 19977 1 655 . 1 1 56 56 TYR HD2 H 1 7.081 0.020 . 1 . . . A 570 TYR HD2 . 19977 1 656 . 1 1 56 56 TYR HE1 H 1 6.685 0.020 . 1 . . . A 570 TYR HE1 . 19977 1 657 . 1 1 56 56 TYR HE2 H 1 6.685 0.020 . 1 . . . A 570 TYR HE2 . 19977 1 658 . 1 1 56 56 TYR C C 13 175.334 0.3 . 1 . . . A 570 TYR C . 19977 1 659 . 1 1 56 56 TYR CA C 13 59.559 0.3 . 1 . . . A 570 TYR CA . 19977 1 660 . 1 1 56 56 TYR CB C 13 37.773 0.3 . 1 . . . A 570 TYR CB . 19977 1 661 . 1 1 56 56 TYR N N 15 120.369 0.3 . 1 . . . A 570 TYR N . 19977 1 662 . 1 1 57 57 ILE H H 1 8.405 0.020 . 1 . . . A 571 ILE H . 19977 1 663 . 1 1 57 57 ILE HA H 1 3.166 0.020 . 1 . . . A 571 ILE HA . 19977 1 664 . 1 1 57 57 ILE HB H 1 0.597 0.020 . 1 . . . A 571 ILE HB . 19977 1 665 . 1 1 57 57 ILE HG12 H 1 0.508 0.020 . 2 . . . A 571 ILE HG12 . 19977 1 666 . 1 1 57 57 ILE HG13 H 1 -1.105 0.020 . 2 . . . A 571 ILE HG13 . 19977 1 667 . 1 1 57 57 ILE HG21 H 1 0.066 0.020 . 1 . . . A 571 ILE HG21 . 19977 1 668 . 1 1 57 57 ILE HG22 H 1 0.066 0.020 . 1 . . . A 571 ILE HG22 . 19977 1 669 . 1 1 57 57 ILE HG23 H 1 0.066 0.020 . 1 . . . A 571 ILE HG23 . 19977 1 670 . 1 1 57 57 ILE HD11 H 1 -0.260 0.020 . 1 . . . A 571 ILE HD11 . 19977 1 671 . 1 1 57 57 ILE HD12 H 1 -0.260 0.020 . 1 . . . A 571 ILE HD12 . 19977 1 672 . 1 1 57 57 ILE HD13 H 1 -0.260 0.020 . 1 . . . A 571 ILE HD13 . 19977 1 673 . 1 1 57 57 ILE C C 13 176.085 0.3 . 1 . . . A 571 ILE C . 19977 1 674 . 1 1 57 57 ILE CA C 13 63.056 0.3 . 1 . . . A 571 ILE CA . 19977 1 675 . 1 1 57 57 ILE CB C 13 39.303 0.3 . 1 . . . A 571 ILE CB . 19977 1 676 . 1 1 57 57 ILE CG1 C 13 26.354 0.3 . 1 . . . A 571 ILE CG1 . 19977 1 677 . 1 1 57 57 ILE CG2 C 13 15.739 0.3 . 1 . . . A 571 ILE CG2 . 19977 1 678 . 1 1 57 57 ILE CD1 C 13 16.519 0.3 . 1 . . . A 571 ILE CD1 . 19977 1 679 . 1 1 57 57 ILE N N 15 127.049 0.3 . 1 . . . A 571 ILE N . 19977 1 680 . 1 1 58 58 ILE H H 1 7.408 0.020 . 1 . . . A 572 ILE H . 19977 1 681 . 1 1 58 58 ILE HA H 1 4.385 0.020 . 1 . . . A 572 ILE HA . 19977 1 682 . 1 1 58 58 ILE HB H 1 1.453 0.020 . 1 . . . A 572 ILE HB . 19977 1 683 . 1 1 58 58 ILE HG12 H 1 1.213 0.020 . 2 . . . A 572 ILE HG12 . 19977 1 684 . 1 1 58 58 ILE HG13 H 1 1.147 0.020 . 2 . . . A 572 ILE HG13 . 19977 1 685 . 1 1 58 58 ILE HG21 H 1 0.998 0.020 . 1 . . . A 572 ILE HG21 . 19977 1 686 . 1 1 58 58 ILE HG22 H 1 0.998 0.020 . 1 . . . A 572 ILE HG22 . 19977 1 687 . 1 1 58 58 ILE HG23 H 1 0.998 0.020 . 1 . . . A 572 ILE HG23 . 19977 1 688 . 1 1 58 58 ILE HD11 H 1 1.019 0.020 . 1 . . . A 572 ILE HD11 . 19977 1 689 . 1 1 58 58 ILE HD12 H 1 1.019 0.020 . 1 . . . A 572 ILE HD12 . 19977 1 690 . 1 1 58 58 ILE HD13 H 1 1.019 0.020 . 1 . . . A 572 ILE HD13 . 19977 1 691 . 1 1 58 58 ILE C C 13 175.239 0.3 . 1 . . . A 572 ILE C . 19977 1 692 . 1 1 58 58 ILE CA C 13 59.946 0.3 . 1 . . . A 572 ILE CA . 19977 1 693 . 1 1 58 58 ILE CB C 13 42.937 0.3 . 1 . . . A 572 ILE CB . 19977 1 694 . 1 1 58 58 ILE CG1 C 13 27.909 0.3 . 1 . . . A 572 ILE CG1 . 19977 1 695 . 1 1 58 58 ILE CG2 C 13 17.859 0.3 . 1 . . . A 572 ILE CG2 . 19977 1 696 . 1 1 58 58 ILE CD1 C 13 14.122 0.3 . 1 . . . A 572 ILE CD1 . 19977 1 697 . 1 1 58 58 ILE N N 15 113.758 0.3 . 1 . . . A 572 ILE N . 19977 1 698 . 1 1 59 59 ARG H H 1 8.613 0.020 . 1 . . . A 573 ARG H . 19977 1 699 . 1 1 59 59 ARG HA H 1 4.722 0.020 . 1 . . . A 573 ARG HA . 19977 1 700 . 1 1 59 59 ARG HB2 H 1 1.652 0.020 . 2 . . . A 573 ARG HB2 . 19977 1 701 . 1 1 59 59 ARG HB3 H 1 1.551 0.020 . 2 . . . A 573 ARG HB3 . 19977 1 702 . 1 1 59 59 ARG HG2 H 1 1.356 0.020 . 1 . . . A 573 ARG HG2 . 19977 1 703 . 1 1 59 59 ARG HG3 H 1 1.356 0.020 . 1 . . . A 573 ARG HG3 . 19977 1 704 . 1 1 59 59 ARG HD2 H 1 2.903 0.020 . 1 . . . A 573 ARG HD2 . 19977 1 705 . 1 1 59 59 ARG HD3 H 1 2.903 0.020 . 1 . . . A 573 ARG HD3 . 19977 1 706 . 1 1 59 59 ARG C C 13 175.384 0.3 . 1 . . . A 573 ARG C . 19977 1 707 . 1 1 59 59 ARG CA C 13 54.088 0.3 . 1 . . . A 573 ARG CA . 19977 1 708 . 1 1 59 59 ARG CB C 13 31.905 0.3 . 1 . . . A 573 ARG CB . 19977 1 709 . 1 1 59 59 ARG CG C 13 27.447 0.3 . 1 . . . A 573 ARG CG . 19977 1 710 . 1 1 59 59 ARG CD C 13 42.814 0.3 . 1 . . . A 573 ARG CD . 19977 1 711 . 1 1 59 59 ARG N N 15 124.863 0.3 . 1 . . . A 573 ARG N . 19977 1 712 . 1 1 60 60 GLU H H 1 8.516 0.020 . 1 . . . A 574 GLU H . 19977 1 713 . 1 1 60 60 GLU HA H 1 3.437 0.020 . 1 . . . A 574 GLU HA . 19977 1 714 . 1 1 60 60 GLU HB2 H 1 1.823 0.020 . 1 . . . A 574 GLU HB2 . 19977 1 715 . 1 1 60 60 GLU HB3 H 1 1.823 0.020 . 1 . . . A 574 GLU HB3 . 19977 1 716 . 1 1 60 60 GLU HG2 H 1 1.992 0.020 . 1 . . . A 574 GLU HG2 . 19977 1 717 . 1 1 60 60 GLU HG3 H 1 1.992 0.020 . 1 . . . A 574 GLU HG3 . 19977 1 718 . 1 1 60 60 GLU C C 13 175.950 0.3 . 1 . . . A 574 GLU C . 19977 1 719 . 1 1 60 60 GLU CA C 13 57.645 0.3 . 1 . . . A 574 GLU CA . 19977 1 720 . 1 1 60 60 GLU CB C 13 29.219 0.3 . 1 . . . A 574 GLU CB . 19977 1 721 . 1 1 60 60 GLU CG C 13 35.010 0.3 . 1 . . . A 574 GLU CG . 19977 1 722 . 1 1 60 60 GLU N N 15 126.645 0.3 . 1 . . . A 574 GLU N . 19977 1 723 . 1 1 61 61 GLY H H 1 8.675 0.020 . 1 . . . A 575 GLY H . 19977 1 724 . 1 1 61 61 GLY HA2 H 1 4.293 0.020 . 1 . . . A 575 GLY HA2 . 19977 1 725 . 1 1 61 61 GLY HA3 H 1 4.293 0.020 . 1 . . . A 575 GLY HA3 . 19977 1 726 . 1 1 61 61 GLY C C 13 174.128 0.3 . 1 . . . A 575 GLY C . 19977 1 727 . 1 1 61 61 GLY CA C 13 45.382 0.3 . 1 . . . A 575 GLY CA . 19977 1 728 . 1 1 61 61 GLY N N 15 111.236 0.3 . 1 . . . A 575 GLY N . 19977 1 729 . 1 1 62 62 THR H H 1 7.283 0.020 . 1 . . . A 576 THR H . 19977 1 730 . 1 1 62 62 THR HA H 1 4.490 0.020 . 1 . . . A 576 THR HA . 19977 1 731 . 1 1 62 62 THR HB H 1 4.338 0.020 . 1 . . . A 576 THR HB . 19977 1 732 . 1 1 62 62 THR HG21 H 1 1.189 0.020 . 1 . . . A 576 THR HG21 . 19977 1 733 . 1 1 62 62 THR HG22 H 1 1.189 0.020 . 1 . . . A 576 THR HG22 . 19977 1 734 . 1 1 62 62 THR HG23 H 1 1.189 0.020 . 1 . . . A 576 THR HG23 . 19977 1 735 . 1 1 62 62 THR C C 13 173.822 0.3 . 1 . . . A 576 THR C . 19977 1 736 . 1 1 62 62 THR CA C 13 60.513 0.3 . 1 . . . A 576 THR CA . 19977 1 737 . 1 1 62 62 THR CB C 13 71.488 0.3 . 1 . . . A 576 THR CB . 19977 1 738 . 1 1 62 62 THR CG2 C 13 21.892 0.3 . 1 . . . A 576 THR CG2 . 19977 1 739 . 1 1 62 62 THR N N 15 109.861 0.3 . 1 . . . A 576 THR N . 19977 1 740 . 1 1 63 63 ILE H H 1 8.703 0.020 . 1 . . . A 577 ILE H . 19977 1 741 . 1 1 63 63 ILE HA H 1 4.111 0.020 . 1 . . . A 577 ILE HA . 19977 1 742 . 1 1 63 63 ILE HB H 1 1.809 0.020 . 1 . . . A 577 ILE HB . 19977 1 743 . 1 1 63 63 ILE HG12 H 1 1.492 0.020 . 2 . . . A 577 ILE HG12 . 19977 1 744 . 1 1 63 63 ILE HG13 H 1 1.142 0.020 . 2 . . . A 577 ILE HG13 . 19977 1 745 . 1 1 63 63 ILE HG21 H 1 0.800 0.020 . 1 . . . A 577 ILE HG21 . 19977 1 746 . 1 1 63 63 ILE HG22 H 1 0.800 0.020 . 1 . . . A 577 ILE HG22 . 19977 1 747 . 1 1 63 63 ILE HG23 H 1 0.800 0.020 . 1 . . . A 577 ILE HG23 . 19977 1 748 . 1 1 63 63 ILE HD11 H 1 0.743 0.020 . 1 . . . A 577 ILE HD11 . 19977 1 749 . 1 1 63 63 ILE HD12 H 1 0.743 0.020 . 1 . . . A 577 ILE HD12 . 19977 1 750 . 1 1 63 63 ILE HD13 H 1 0.743 0.020 . 1 . . . A 577 ILE HD13 . 19977 1 751 . 1 1 63 63 ILE C C 13 177.014 0.3 . 1 . . . A 577 ILE C . 19977 1 752 . 1 1 63 63 ILE CA C 13 60.910 0.3 . 1 . . . A 577 ILE CA . 19977 1 753 . 1 1 63 63 ILE CB C 13 37.173 0.3 . 1 . . . A 577 ILE CB . 19977 1 754 . 1 1 63 63 ILE CG1 C 13 27.131 0.3 . 1 . . . A 577 ILE CG1 . 19977 1 755 . 1 1 63 63 ILE CG2 C 13 17.287 0.3 . 1 . . . A 577 ILE CG2 . 19977 1 756 . 1 1 63 63 ILE CD1 C 13 11.640 0.3 . 1 . . . A 577 ILE CD1 . 19977 1 757 . 1 1 63 63 ILE N N 15 121.999 0.3 . 1 . . . A 577 ILE N . 19977 1 758 . 1 1 64 64 GLY H H 1 8.584 0.020 . 1 . . . A 578 GLY H . 19977 1 759 . 1 1 64 64 GLY HA2 H 1 4.275 0.020 . 2 . . . A 578 GLY HA2 . 19977 1 760 . 1 1 64 64 GLY HA3 H 1 3.493 0.020 . 2 . . . A 578 GLY HA3 . 19977 1 761 . 1 1 64 64 GLY CA C 13 46.388 0.3 . 1 . . . A 578 GLY CA . 19977 1 762 . 1 1 64 64 GLY N N 15 115.318 0.3 . 1 . . . A 578 GLY N . 19977 1 763 . 1 1 65 65 LYS HA H 1 4.494 0.020 . 1 . . . A 579 LYS HA . 19977 1 764 . 1 1 65 65 LYS HB2 H 1 2.073 0.020 . 2 . . . A 579 LYS HB2 . 19977 1 765 . 1 1 65 65 LYS HB3 H 1 1.745 0.020 . 2 . . . A 579 LYS HB3 . 19977 1 766 . 1 1 65 65 LYS HG2 H 1 1.429 0.020 . 1 . . . A 579 LYS HG2 . 19977 1 767 . 1 1 65 65 LYS HG3 H 1 1.429 0.020 . 1 . . . A 579 LYS HG3 . 19977 1 768 . 1 1 65 65 LYS HD2 H 1 1.666 0.020 . 1 . . . A 579 LYS HD2 . 19977 1 769 . 1 1 65 65 LYS HD3 H 1 1.666 0.020 . 1 . . . A 579 LYS HD3 . 19977 1 770 . 1 1 65 65 LYS HE2 H 1 2.935 0.020 . 1 . . . A 579 LYS HE2 . 19977 1 771 . 1 1 65 65 LYS HE3 H 1 2.935 0.020 . 1 . . . A 579 LYS HE3 . 19977 1 772 . 1 1 65 65 LYS C C 13 175.463 0.3 . 1 . . . A 579 LYS C . 19977 1 773 . 1 1 65 65 LYS CA C 13 55.714 0.3 . 1 . . . A 579 LYS CA . 19977 1 774 . 1 1 65 65 LYS CB C 13 34.815 0.3 . 1 . . . A 579 LYS CB . 19977 1 775 . 1 1 65 65 LYS CG C 13 24.917 0.3 . 1 . . . A 579 LYS CG . 19977 1 776 . 1 1 65 65 LYS CD C 13 28.854 0.3 . 1 . . . A 579 LYS CD . 19977 1 777 . 1 1 65 65 LYS CE C 13 42.040 0.3 . 1 . . . A 579 LYS CE . 19977 1 778 . 1 1 66 66 LYS H H 1 7.314 0.020 . 1 . . . A 580 LYS H . 19977 1 779 . 1 1 66 66 LYS HA H 1 4.884 0.020 . 1 . . . A 580 LYS HA . 19977 1 780 . 1 1 66 66 LYS HB2 H 1 1.204 0.020 . 1 . . . A 580 LYS HB2 . 19977 1 781 . 1 1 66 66 LYS HB3 H 1 1.204 0.020 . 1 . . . A 580 LYS HB3 . 19977 1 782 . 1 1 66 66 LYS HG2 H 1 1.038 0.020 . 1 . . . A 580 LYS HG2 . 19977 1 783 . 1 1 66 66 LYS HG3 H 1 1.038 0.020 . 1 . . . A 580 LYS HG3 . 19977 1 784 . 1 1 66 66 LYS HD2 H 1 1.601 0.020 . 2 . . . A 580 LYS HD2 . 19977 1 785 . 1 1 66 66 LYS HD3 H 1 1.433 0.020 . 2 . . . A 580 LYS HD3 . 19977 1 786 . 1 1 66 66 LYS HE2 H 1 2.796 0.020 . 1 . . . A 580 LYS HE2 . 19977 1 787 . 1 1 66 66 LYS HE3 H 1 2.796 0.020 . 1 . . . A 580 LYS HE3 . 19977 1 788 . 1 1 66 66 LYS C C 13 173.982 0.3 . 1 . . . A 580 LYS C . 19977 1 789 . 1 1 66 66 LYS CA C 13 55.111 0.3 . 1 . . . A 580 LYS CA . 19977 1 790 . 1 1 66 66 LYS CB C 13 37.040 0.3 . 1 . . . A 580 LYS CB . 19977 1 791 . 1 1 66 66 LYS CG C 13 24.169 0.3 . 1 . . . A 580 LYS CG . 19977 1 792 . 1 1 66 66 LYS CD C 13 30.146 0.3 . 1 . . . A 580 LYS CD . 19977 1 793 . 1 1 66 66 LYS CE C 13 41.698 0.3 . 1 . . . A 580 LYS CE . 19977 1 794 . 1 1 66 66 LYS N N 15 117.874 0.3 . 1 . . . A 580 LYS N . 19977 1 795 . 1 1 67 67 MET H H 1 8.361 0.020 . 1 . . . A 581 MET H . 19977 1 796 . 1 1 67 67 MET HA H 1 4.708 0.020 . 1 . . . A 581 MET HA . 19977 1 797 . 1 1 67 67 MET HB2 H 1 1.865 0.020 . 1 . . . A 581 MET HB2 . 19977 1 798 . 1 1 67 67 MET HB3 H 1 1.865 0.020 . 1 . . . A 581 MET HB3 . 19977 1 799 . 1 1 67 67 MET HG2 H 1 1.966 0.020 . 1 . . . A 581 MET HG2 . 19977 1 800 . 1 1 67 67 MET HG3 H 1 1.966 0.020 . 1 . . . A 581 MET HG3 . 19977 1 801 . 1 1 67 67 MET HE1 H 1 0.983 0.020 . 1 . . . A 581 MET HE1 . 19977 1 802 . 1 1 67 67 MET HE2 H 1 0.983 0.020 . 1 . . . A 581 MET HE2 . 19977 1 803 . 1 1 67 67 MET HE3 H 1 0.983 0.020 . 1 . . . A 581 MET HE3 . 19977 1 804 . 1 1 67 67 MET C C 13 172.568 0.3 . 1 . . . A 581 MET C . 19977 1 805 . 1 1 67 67 MET CA C 13 53.626 0.3 . 1 . . . A 581 MET CA . 19977 1 806 . 1 1 67 67 MET CB C 13 34.350 0.3 . 1 . . . A 581 MET CB . 19977 1 807 . 1 1 67 67 MET CG C 13 34.747 0.3 . 1 . . . A 581 MET CG . 19977 1 808 . 1 1 67 67 MET CE C 13 17.562 0.3 . 1 . . . A 581 MET CE . 19977 1 809 . 1 1 67 67 MET N N 15 118.003 0.3 . 1 . . . A 581 MET N . 19977 1 810 . 1 1 68 68 TYR H H 1 8.022 0.020 . 1 . . . A 582 TYR H . 19977 1 811 . 1 1 68 68 TYR HA H 1 4.907 0.020 . 1 . . . A 582 TYR HA . 19977 1 812 . 1 1 68 68 TYR HB2 H 1 1.878 0.020 . 2 . . . A 582 TYR HB2 . 19977 1 813 . 1 1 68 68 TYR HB3 H 1 0.615 0.020 . 2 . . . A 582 TYR HB3 . 19977 1 814 . 1 1 68 68 TYR HD1 H 1 6.954 0.020 . 1 . . . A 582 TYR HD1 . 19977 1 815 . 1 1 68 68 TYR HD2 H 1 6.954 0.020 . 1 . . . A 582 TYR HD2 . 19977 1 816 . 1 1 68 68 TYR C C 13 173.109 0.3 . 1 . . . A 582 TYR C . 19977 1 817 . 1 1 68 68 TYR CA C 13 56.927 0.3 . 1 . . . A 582 TYR CA . 19977 1 818 . 1 1 68 68 TYR CB C 13 42.988 0.3 . 1 . . . A 582 TYR CB . 19977 1 819 . 1 1 68 68 TYR N N 15 114.990 0.3 . 1 . . . A 582 TYR N . 19977 1 820 . 1 1 69 69 PHE H H 1 9.367 0.020 . 1 . . . A 583 PHE H . 19977 1 821 . 1 1 69 69 PHE HA H 1 4.823 0.020 . 1 . . . A 583 PHE HA . 19977 1 822 . 1 1 69 69 PHE HB2 H 1 2.954 0.020 . 2 . . . A 583 PHE HB2 . 19977 1 823 . 1 1 69 69 PHE HB3 H 1 2.839 0.020 . 2 . . . A 583 PHE HB3 . 19977 1 824 . 1 1 69 69 PHE HD1 H 1 7.121 0.020 . 1 . . . A 583 PHE HD1 . 19977 1 825 . 1 1 69 69 PHE HD2 H 1 7.121 0.020 . 1 . . . A 583 PHE HD2 . 19977 1 826 . 1 1 69 69 PHE HE1 H 1 6.873 0.020 . 1 . . . A 583 PHE HE1 . 19977 1 827 . 1 1 69 69 PHE HE2 H 1 6.873 0.020 . 1 . . . A 583 PHE HE2 . 19977 1 828 . 1 1 69 69 PHE HZ H 1 6.990 0.020 . 1 . . . A 583 PHE HZ . 19977 1 829 . 1 1 69 69 PHE C C 13 175.966 0.3 . 1 . . . A 583 PHE C . 19977 1 830 . 1 1 69 69 PHE CA C 13 56.228 0.3 . 1 . . . A 583 PHE CA . 19977 1 831 . 1 1 69 69 PHE CB C 13 41.946 0.3 . 1 . . . A 583 PHE CB . 19977 1 832 . 1 1 69 69 PHE N N 15 117.309 0.3 . 1 . . . A 583 PHE N . 19977 1 833 . 1 1 70 70 ILE H H 1 9.158 0.020 . 1 . . . A 584 ILE H . 19977 1 834 . 1 1 70 70 ILE HA H 1 4.078 0.020 . 1 . . . A 584 ILE HA . 19977 1 835 . 1 1 70 70 ILE HB H 1 1.841 0.020 . 1 . . . A 584 ILE HB . 19977 1 836 . 1 1 70 70 ILE HG12 H 1 1.453 0.020 . 1 . . . A 584 ILE HG12 . 19977 1 837 . 1 1 70 70 ILE HG13 H 1 1.453 0.020 . 1 . . . A 584 ILE HG13 . 19977 1 838 . 1 1 70 70 ILE HG21 H 1 0.490 0.020 . 1 . . . A 584 ILE HG21 . 19977 1 839 . 1 1 70 70 ILE HG22 H 1 0.490 0.020 . 1 . . . A 584 ILE HG22 . 19977 1 840 . 1 1 70 70 ILE HG23 H 1 0.490 0.020 . 1 . . . A 584 ILE HG23 . 19977 1 841 . 1 1 70 70 ILE HD11 H 1 0.601 0.020 . 1 . . . A 584 ILE HD11 . 19977 1 842 . 1 1 70 70 ILE HD12 H 1 0.601 0.020 . 1 . . . A 584 ILE HD12 . 19977 1 843 . 1 1 70 70 ILE HD13 H 1 0.601 0.020 . 1 . . . A 584 ILE HD13 . 19977 1 844 . 1 1 70 70 ILE C C 13 175.129 0.3 . 1 . . . A 584 ILE C . 19977 1 845 . 1 1 70 70 ILE CA C 13 61.921 0.3 . 1 . . . A 584 ILE CA . 19977 1 846 . 1 1 70 70 ILE CB C 13 37.931 0.3 . 1 . . . A 584 ILE CB . 19977 1 847 . 1 1 70 70 ILE CG1 C 13 27.025 0.3 . 1 . . . A 584 ILE CG1 . 19977 1 848 . 1 1 70 70 ILE CG2 C 13 17.002 0.3 . 1 . . . A 584 ILE CG2 . 19977 1 849 . 1 1 70 70 ILE CD1 C 13 14.326 0.3 . 1 . . . A 584 ILE CD1 . 19977 1 850 . 1 1 70 70 ILE N N 15 121.475 0.3 . 1 . . . A 584 ILE N . 19977 1 851 . 1 1 71 71 GLN H H 1 8.497 0.020 . 1 . . . A 585 GLN H . 19977 1 852 . 1 1 71 71 GLN HA H 1 4.333 0.020 . 1 . . . A 585 GLN HA . 19977 1 853 . 1 1 71 71 GLN HB2 H 1 2.229 0.020 . 1 . . . A 585 GLN HB2 . 19977 1 854 . 1 1 71 71 GLN HB3 H 1 2.229 0.020 . 1 . . . A 585 GLN HB3 . 19977 1 855 . 1 1 71 71 GLN HG2 H 1 2.102 0.020 . 2 . . . A 585 GLN HG2 . 19977 1 856 . 1 1 71 71 GLN HG3 H 1 1.874 0.020 . 2 . . . A 585 GLN HG3 . 19977 1 857 . 1 1 71 71 GLN HE21 H 1 6.922 0.020 . 1 . . . A 585 GLN HE21 . 19977 1 858 . 1 1 71 71 GLN HE22 H 1 6.727 0.020 . 1 . . . A 585 GLN HE22 . 19977 1 859 . 1 1 71 71 GLN C C 13 175.571 0.3 . 1 . . . A 585 GLN C . 19977 1 860 . 1 1 71 71 GLN CA C 13 58.530 0.3 . 1 . . . A 585 GLN CA . 19977 1 861 . 1 1 71 71 GLN CB C 13 28.296 0.3 . 1 . . . A 585 GLN CB . 19977 1 862 . 1 1 71 71 GLN CG C 13 33.947 0.3 . 1 . . . A 585 GLN CG . 19977 1 863 . 1 1 71 71 GLN N N 15 130.475 0.3 . 1 . . . A 585 GLN N . 19977 1 864 . 1 1 71 71 GLN NE2 N 15 110.912 0.3 . 1 . . . A 585 GLN NE2 . 19977 1 865 . 1 1 72 72 HIS H H 1 7.981 0.020 . 1 . . . A 586 HIS H . 19977 1 866 . 1 1 72 72 HIS HA H 1 4.893 0.020 . 1 . . . A 586 HIS HA . 19977 1 867 . 1 1 72 72 HIS HB2 H 1 3.103 0.020 . 2 . . . A 586 HIS HB2 . 19977 1 868 . 1 1 72 72 HIS HB3 H 1 2.864 0.020 . 2 . . . A 586 HIS HB3 . 19977 1 869 . 1 1 72 72 HIS HD2 H 1 6.911 0.020 . 1 . . . A 586 HIS HD2 . 19977 1 870 . 1 1 72 72 HIS C C 13 172.702 0.3 . 1 . . . A 586 HIS C . 19977 1 871 . 1 1 72 72 HIS CA C 13 55.018 0.3 . 1 . . . A 586 HIS CA . 19977 1 872 . 1 1 72 72 HIS CB C 13 33.188 0.3 . 1 . . . A 586 HIS CB . 19977 1 873 . 1 1 72 72 HIS N N 15 113.351 0.3 . 1 . . . A 586 HIS N . 19977 1 874 . 1 1 73 73 GLY H H 1 8.267 0.020 . 1 . . . A 587 GLY H . 19977 1 875 . 1 1 73 73 GLY HA2 H 1 4.684 0.020 . 1 . . . A 587 GLY HA2 . 19977 1 876 . 1 1 73 73 GLY HA3 H 1 4.684 0.020 . 1 . . . A 587 GLY HA3 . 19977 1 877 . 1 1 73 73 GLY C C 13 169.824 0.3 . 1 . . . A 587 GLY C . 19977 1 878 . 1 1 73 73 GLY CA C 13 44.158 0.3 . 1 . . . A 587 GLY CA . 19977 1 879 . 1 1 73 73 GLY N N 15 115.182 0.3 . 1 . . . A 587 GLY N . 19977 1 880 . 1 1 74 74 VAL H H 1 7.305 0.020 . 1 . . . A 588 VAL H . 19977 1 881 . 1 1 74 74 VAL HA H 1 4.765 0.020 . 1 . . . A 588 VAL HA . 19977 1 882 . 1 1 74 74 VAL HB H 1 1.693 0.020 . 1 . . . A 588 VAL HB . 19977 1 883 . 1 1 74 74 VAL HG11 H 1 0.809 0.020 . 1 . . . A 588 VAL HG11 . 19977 1 884 . 1 1 74 74 VAL HG12 H 1 0.809 0.020 . 1 . . . A 588 VAL HG12 . 19977 1 885 . 1 1 74 74 VAL HG13 H 1 0.809 0.020 . 1 . . . A 588 VAL HG13 . 19977 1 886 . 1 1 74 74 VAL HG21 H 1 0.809 0.020 . 1 . . . A 588 VAL HG21 . 19977 1 887 . 1 1 74 74 VAL HG22 H 1 0.809 0.020 . 1 . . . A 588 VAL HG22 . 19977 1 888 . 1 1 74 74 VAL HG23 H 1 0.809 0.020 . 1 . . . A 588 VAL HG23 . 19977 1 889 . 1 1 74 74 VAL C C 13 175.513 0.3 . 1 . . . A 588 VAL C . 19977 1 890 . 1 1 74 74 VAL CA C 13 60.879 0.3 . 1 . . . A 588 VAL CA . 19977 1 891 . 1 1 74 74 VAL CB C 13 34.668 0.3 . 1 . . . A 588 VAL CB . 19977 1 892 . 1 1 74 74 VAL CG1 C 13 21.138 0.3 . 1 . . . A 588 VAL CG1 . 19977 1 893 . 1 1 74 74 VAL N N 15 117.417 0.3 . 1 . . . A 588 VAL N . 19977 1 894 . 1 1 75 75 VAL H H 1 8.760 0.020 . 1 . . . A 589 VAL H . 19977 1 895 . 1 1 75 75 VAL HA H 1 4.841 0.020 . 1 . . . A 589 VAL HA . 19977 1 896 . 1 1 75 75 VAL HB H 1 1.364 0.020 . 1 . . . A 589 VAL HB . 19977 1 897 . 1 1 75 75 VAL HG11 H 1 0.403 0.020 . 1 . . . A 589 VAL HG11 . 19977 1 898 . 1 1 75 75 VAL HG12 H 1 0.403 0.020 . 1 . . . A 589 VAL HG12 . 19977 1 899 . 1 1 75 75 VAL HG13 H 1 0.403 0.020 . 1 . . . A 589 VAL HG13 . 19977 1 900 . 1 1 75 75 VAL HG21 H 1 0.094 0.020 . 1 . . . A 589 VAL HG21 . 19977 1 901 . 1 1 75 75 VAL HG22 H 1 0.094 0.020 . 1 . . . A 589 VAL HG22 . 19977 1 902 . 1 1 75 75 VAL HG23 H 1 0.094 0.020 . 1 . . . A 589 VAL HG23 . 19977 1 903 . 1 1 75 75 VAL C C 13 173.698 0.3 . 1 . . . A 589 VAL C . 19977 1 904 . 1 1 75 75 VAL CA C 13 57.533 0.3 . 1 . . . A 589 VAL CA . 19977 1 905 . 1 1 75 75 VAL CB C 13 33.283 0.3 . 1 . . . A 589 VAL CB . 19977 1 906 . 1 1 75 75 VAL CG1 C 13 21.315 0.3 . 1 . . . A 589 VAL CG1 . 19977 1 907 . 1 1 75 75 VAL CG2 C 13 19.680 0.3 . 1 . . . A 589 VAL CG2 . 19977 1 908 . 1 1 75 75 VAL N N 15 117.953 0.3 . 1 . . . A 589 VAL N . 19977 1 909 . 1 1 76 76 SER H H 1 8.805 0.020 . 1 . . . A 590 SER H . 19977 1 910 . 1 1 76 76 SER HA H 1 4.899 0.020 . 1 . . . A 590 SER HA . 19977 1 911 . 1 1 76 76 SER HB2 H 1 3.400 0.020 . 2 . . . A 590 SER HB2 . 19977 1 912 . 1 1 76 76 SER HB3 H 1 3.298 0.020 . 2 . . . A 590 SER HB3 . 19977 1 913 . 1 1 76 76 SER C C 13 172.955 0.3 . 1 . . . A 590 SER C . 19977 1 914 . 1 1 76 76 SER CA C 13 57.746 0.3 . 1 . . . A 590 SER CA . 19977 1 915 . 1 1 76 76 SER CB C 13 65.224 0.3 . 1 . . . A 590 SER CB . 19977 1 916 . 1 1 76 76 SER N N 15 115.641 0.3 . 1 . . . A 590 SER N . 19977 1 917 . 1 1 77 77 VAL H H 1 9.085 0.020 . 1 . . . A 591 VAL H . 19977 1 918 . 1 1 77 77 VAL HA H 1 4.239 0.020 . 1 . . . A 591 VAL HA . 19977 1 919 . 1 1 77 77 VAL HB H 1 1.887 0.020 . 1 . . . A 591 VAL HB . 19977 1 920 . 1 1 77 77 VAL HG11 H 1 0.642 0.020 . 1 . . . A 591 VAL HG11 . 19977 1 921 . 1 1 77 77 VAL HG12 H 1 0.642 0.020 . 1 . . . A 591 VAL HG12 . 19977 1 922 . 1 1 77 77 VAL HG13 H 1 0.642 0.020 . 1 . . . A 591 VAL HG13 . 19977 1 923 . 1 1 77 77 VAL HG21 H 1 0.515 0.020 . 1 . . . A 591 VAL HG21 . 19977 1 924 . 1 1 77 77 VAL HG22 H 1 0.515 0.020 . 1 . . . A 591 VAL HG22 . 19977 1 925 . 1 1 77 77 VAL HG23 H 1 0.515 0.020 . 1 . . . A 591 VAL HG23 . 19977 1 926 . 1 1 77 77 VAL C C 13 175.952 0.3 . 1 . . . A 591 VAL C . 19977 1 927 . 1 1 77 77 VAL CA C 13 61.574 0.3 . 1 . . . A 591 VAL CA . 19977 1 928 . 1 1 77 77 VAL CB C 13 31.602 0.3 . 1 . . . A 591 VAL CB . 19977 1 929 . 1 1 77 77 VAL CG1 C 13 20.952 0.3 . 1 . . . A 591 VAL CG1 . 19977 1 930 . 1 1 77 77 VAL CG2 C 13 19.957 0.3 . 1 . . . A 591 VAL CG2 . 19977 1 931 . 1 1 77 77 VAL N N 15 125.341 0.3 . 1 . . . A 591 VAL N . 19977 1 932 . 1 1 78 78 LEU H H 1 8.998 0.020 . 1 . . . A 592 LEU H . 19977 1 933 . 1 1 78 78 LEU HA H 1 4.867 0.020 . 1 . . . A 592 LEU HA . 19977 1 934 . 1 1 78 78 LEU HB2 H 1 1.505 0.020 . 1 . . . A 592 LEU HB2 . 19977 1 935 . 1 1 78 78 LEU HB3 H 1 1.505 0.020 . 1 . . . A 592 LEU HB3 . 19977 1 936 . 1 1 78 78 LEU HG H 1 1.358 0.020 . 1 . . . A 592 LEU HG . 19977 1 937 . 1 1 78 78 LEU HD11 H 1 0.711 0.020 . 1 . . . A 592 LEU HD11 . 19977 1 938 . 1 1 78 78 LEU HD12 H 1 0.711 0.020 . 1 . . . A 592 LEU HD12 . 19977 1 939 . 1 1 78 78 LEU HD13 H 1 0.711 0.020 . 1 . . . A 592 LEU HD13 . 19977 1 940 . 1 1 78 78 LEU HD21 H 1 0.711 0.020 . 1 . . . A 592 LEU HD21 . 19977 1 941 . 1 1 78 78 LEU HD22 H 1 0.711 0.020 . 1 . . . A 592 LEU HD22 . 19977 1 942 . 1 1 78 78 LEU HD23 H 1 0.711 0.020 . 1 . . . A 592 LEU HD23 . 19977 1 943 . 1 1 78 78 LEU C C 13 176.276 0.3 . 1 . . . A 592 LEU C . 19977 1 944 . 1 1 78 78 LEU CA C 13 54.281 0.3 . 1 . . . A 592 LEU CA . 19977 1 945 . 1 1 78 78 LEU CB C 13 43.031 0.3 . 1 . . . A 592 LEU CB . 19977 1 946 . 1 1 78 78 LEU CG C 13 26.681 0.3 . 1 . . . A 592 LEU CG . 19977 1 947 . 1 1 78 78 LEU CD1 C 13 24.479 0.3 . 1 . . . A 592 LEU CD1 . 19977 1 948 . 1 1 78 78 LEU N N 15 130.086 0.3 . 1 . . . A 592 LEU N . 19977 1 949 . 1 1 79 79 THR H H 1 8.383 0.020 . 1 . . . A 593 THR H . 19977 1 950 . 1 1 79 79 THR HA H 1 4.613 0.020 . 1 . . . A 593 THR HA . 19977 1 951 . 1 1 79 79 THR HB H 1 4.137 0.020 . 1 . . . A 593 THR HB . 19977 1 952 . 1 1 79 79 THR HG21 H 1 1.142 0.020 . 1 . . . A 593 THR HG21 . 19977 1 953 . 1 1 79 79 THR HG22 H 1 1.142 0.020 . 1 . . . A 593 THR HG22 . 19977 1 954 . 1 1 79 79 THR HG23 H 1 1.142 0.020 . 1 . . . A 593 THR HG23 . 19977 1 955 . 1 1 79 79 THR C C 13 174.412 0.3 . 1 . . . A 593 THR C . 19977 1 956 . 1 1 79 79 THR CA C 13 60.400 0.3 . 1 . . . A 593 THR CA . 19977 1 957 . 1 1 79 79 THR CB C 13 71.081 0.3 . 1 . . . A 593 THR CB . 19977 1 958 . 1 1 79 79 THR CG2 C 13 21.831 0.3 . 1 . . . A 593 THR CG2 . 19977 1 959 . 1 1 79 79 THR N N 15 117.229 0.3 . 1 . . . A 593 THR N . 19977 1 960 . 1 1 80 80 LYS H H 1 8.793 0.020 . 1 . . . A 594 LYS H . 19977 1 961 . 1 1 80 80 LYS HA H 1 4.031 0.020 . 1 . . . A 594 LYS HA . 19977 1 962 . 1 1 80 80 LYS HB2 H 1 1.768 0.020 . 1 . . . A 594 LYS HB2 . 19977 1 963 . 1 1 80 80 LYS HB3 H 1 1.768 0.020 . 1 . . . A 594 LYS HB3 . 19977 1 964 . 1 1 80 80 LYS HG2 H 1 1.431 0.020 . 2 . . . A 594 LYS HG2 . 19977 1 965 . 1 1 80 80 LYS HG3 H 1 1.363 0.020 . 2 . . . A 594 LYS HG3 . 19977 1 966 . 1 1 80 80 LYS HD2 H 1 1.624 0.020 . 1 . . . A 594 LYS HD2 . 19977 1 967 . 1 1 80 80 LYS HD3 H 1 1.624 0.020 . 1 . . . A 594 LYS HD3 . 19977 1 968 . 1 1 80 80 LYS HE2 H 1 2.924 0.020 . 1 . . . A 594 LYS HE2 . 19977 1 969 . 1 1 80 80 LYS HE3 H 1 2.924 0.020 . 1 . . . A 594 LYS HE3 . 19977 1 970 . 1 1 80 80 LYS CA C 13 57.781 0.3 . 1 . . . A 594 LYS CA . 19977 1 971 . 1 1 80 80 LYS CB C 13 31.873 0.3 . 1 . . . A 594 LYS CB . 19977 1 972 . 1 1 80 80 LYS CG C 13 24.532 0.3 . 1 . . . A 594 LYS CG . 19977 1 973 . 1 1 80 80 LYS CD C 13 29.247 0.3 . 1 . . . A 594 LYS CD . 19977 1 974 . 1 1 80 80 LYS CE C 13 41.993 0.3 . 1 . . . A 594 LYS CE . 19977 1 975 . 1 1 80 80 LYS N N 15 123.932 0.3 . 1 . . . A 594 LYS N . 19977 1 976 . 1 1 81 81 GLY HA2 H 1 3.731 0.020 . 1 . . . A 595 GLY HA2 . 19977 1 977 . 1 1 81 81 GLY HA3 H 1 3.731 0.020 . 1 . . . A 595 GLY HA3 . 19977 1 978 . 1 1 81 81 GLY C C 13 173.879 0.3 . 1 . . . A 595 GLY C . 19977 1 979 . 1 1 81 81 GLY CA C 13 45.364 0.3 . 1 . . . A 595 GLY CA . 19977 1 980 . 1 1 82 82 ASN H H 1 8.025 0.020 . 1 . . . A 596 ASN H . 19977 1 981 . 1 1 82 82 ASN HA H 1 4.762 0.020 . 1 . . . A 596 ASN HA . 19977 1 982 . 1 1 82 82 ASN HB2 H 1 2.804 0.020 . 2 . . . A 596 ASN HB2 . 19977 1 983 . 1 1 82 82 ASN HB3 H 1 2.676 0.020 . 2 . . . A 596 ASN HB3 . 19977 1 984 . 1 1 82 82 ASN HD21 H 1 7.400 0.020 . 1 . . . A 596 ASN HD21 . 19977 1 985 . 1 1 82 82 ASN HD22 H 1 6.825 0.020 . 1 . . . A 596 ASN HD22 . 19977 1 986 . 1 1 82 82 ASN C C 13 174.656 0.3 . 1 . . . A 596 ASN C . 19977 1 987 . 1 1 82 82 ASN CA C 13 52.420 0.3 . 1 . . . A 596 ASN CA . 19977 1 988 . 1 1 82 82 ASN CB C 13 39.721 0.3 . 1 . . . A 596 ASN CB . 19977 1 989 . 1 1 82 82 ASN CG C 13 177.459 0.3 . 1 . . . A 596 ASN CG . 19977 1 990 . 1 1 82 82 ASN N N 15 117.186 0.3 . 1 . . . A 596 ASN N . 19977 1 991 . 1 1 82 82 ASN ND2 N 15 112.843 0.3 . 1 . . . A 596 ASN ND2 . 19977 1 992 . 1 1 83 83 LYS H H 1 7.969 0.020 . 1 . . . A 597 LYS H . 19977 1 993 . 1 1 83 83 LYS HA H 1 4.254 0.020 . 1 . . . A 597 LYS HA . 19977 1 994 . 1 1 83 83 LYS HB2 H 1 1.773 0.020 . 2 . . . A 597 LYS HB2 . 19977 1 995 . 1 1 83 83 LYS HB3 H 1 1.690 0.020 . 2 . . . A 597 LYS HB3 . 19977 1 996 . 1 1 83 83 LYS HG2 H 1 1.356 0.020 . 1 . . . A 597 LYS HG2 . 19977 1 997 . 1 1 83 83 LYS HG3 H 1 1.356 0.020 . 1 . . . A 597 LYS HG3 . 19977 1 998 . 1 1 83 83 LYS HD2 H 1 1.608 0.020 . 1 . . . A 597 LYS HD2 . 19977 1 999 . 1 1 83 83 LYS HD3 H 1 1.608 0.020 . 1 . . . A 597 LYS HD3 . 19977 1 1000 . 1 1 83 83 LYS HE2 H 1 2.921 0.020 . 1 . . . A 597 LYS HE2 . 19977 1 1001 . 1 1 83 83 LYS HE3 H 1 2.921 0.020 . 1 . . . A 597 LYS HE3 . 19977 1 1002 . 1 1 83 83 LYS C C 13 176.253 0.3 . 1 . . . A 597 LYS C . 19977 1 1003 . 1 1 83 83 LYS CA C 13 56.079 0.3 . 1 . . . A 597 LYS CA . 19977 1 1004 . 1 1 83 83 LYS CB C 13 32.726 0.3 . 1 . . . A 597 LYS CB . 19977 1 1005 . 1 1 83 83 LYS CG C 13 24.623 0.3 . 1 . . . A 597 LYS CG . 19977 1 1006 . 1 1 83 83 LYS CD C 13 28.838 0.3 . 1 . . . A 597 LYS CD . 19977 1 1007 . 1 1 83 83 LYS CE C 13 42.059 0.3 . 1 . . . A 597 LYS CE . 19977 1 1008 . 1 1 83 83 LYS N N 15 120.353 0.3 . 1 . . . A 597 LYS N . 19977 1 1009 . 1 1 84 84 GLU H H 1 8.629 0.020 . 1 . . . A 598 GLU H . 19977 1 1010 . 1 1 84 84 GLU HA H 1 4.555 0.020 . 1 . . . A 598 GLU HA . 19977 1 1011 . 1 1 84 84 GLU HB2 H 1 1.788 0.020 . 1 . . . A 598 GLU HB2 . 19977 1 1012 . 1 1 84 84 GLU HB3 H 1 1.788 0.020 . 1 . . . A 598 GLU HB3 . 19977 1 1013 . 1 1 84 84 GLU HG2 H 1 2.110 0.020 . 2 . . . A 598 GLU HG2 . 19977 1 1014 . 1 1 84 84 GLU HG3 H 1 2.007 0.020 . 2 . . . A 598 GLU HG3 . 19977 1 1015 . 1 1 84 84 GLU C C 13 175.535 0.3 . 1 . . . A 598 GLU C . 19977 1 1016 . 1 1 84 84 GLU CA C 13 56.472 0.3 . 1 . . . A 598 GLU CA . 19977 1 1017 . 1 1 84 84 GLU CB C 13 31.266 0.3 . 1 . . . A 598 GLU CB . 19977 1 1018 . 1 1 84 84 GLU CG C 13 36.061 0.3 . 1 . . . A 598 GLU CG . 19977 1 1019 . 1 1 84 84 GLU N N 15 123.742 0.3 . 1 . . . A 598 GLU N . 19977 1 1020 . 1 1 85 85 MET H H 1 8.173 0.020 . 1 . . . A 599 MET H . 19977 1 1021 . 1 1 85 85 MET HA H 1 4.640 0.020 . 1 . . . A 599 MET HA . 19977 1 1022 . 1 1 85 85 MET HB2 H 1 1.868 0.020 . 1 . . . A 599 MET HB2 . 19977 1 1023 . 1 1 85 85 MET HB3 H 1 1.868 0.020 . 1 . . . A 599 MET HB3 . 19977 1 1024 . 1 1 85 85 MET HG2 H 1 1.950 0.020 . 1 . . . A 599 MET HG2 . 19977 1 1025 . 1 1 85 85 MET HG3 H 1 1.950 0.020 . 1 . . . A 599 MET HG3 . 19977 1 1026 . 1 1 85 85 MET HE1 H 1 1.961 0.020 . 1 . . . A 599 MET HE1 . 19977 1 1027 . 1 1 85 85 MET HE2 H 1 1.961 0.020 . 1 . . . A 599 MET HE2 . 19977 1 1028 . 1 1 85 85 MET HE3 H 1 1.961 0.020 . 1 . . . A 599 MET HE3 . 19977 1 1029 . 1 1 85 85 MET C C 13 174.078 0.3 . 1 . . . A 599 MET C . 19977 1 1030 . 1 1 85 85 MET CA C 13 54.530 0.3 . 1 . . . A 599 MET CA . 19977 1 1031 . 1 1 85 85 MET CB C 13 35.196 0.3 . 1 . . . A 599 MET CB . 19977 1 1032 . 1 1 85 85 MET CG C 13 35.194 0.3 . 1 . . . A 599 MET CG . 19977 1 1033 . 1 1 85 85 MET CE C 13 16.854 0.3 . 1 . . . A 599 MET CE . 19977 1 1034 . 1 1 85 85 MET N N 15 122.225 0.3 . 1 . . . A 599 MET N . 19977 1 1035 . 1 1 86 86 LYS H H 1 8.435 0.020 . 1 . . . A 600 LYS H . 19977 1 1036 . 1 1 86 86 LYS HA H 1 5.333 0.020 . 1 . . . A 600 LYS HA . 19977 1 1037 . 1 1 86 86 LYS HB2 H 1 1.610 0.020 . 2 . . . A 600 LYS HB2 . 19977 1 1038 . 1 1 86 86 LYS HB3 H 1 1.437 0.020 . 2 . . . A 600 LYS HB3 . 19977 1 1039 . 1 1 86 86 LYS HG2 H 1 1.243 0.020 . 1 . . . A 600 LYS HG2 . 19977 1 1040 . 1 1 86 86 LYS HG3 H 1 1.243 0.020 . 1 . . . A 600 LYS HG3 . 19977 1 1041 . 1 1 86 86 LYS HD2 H 1 1.417 0.020 . 2 . . . A 600 LYS HD2 . 19977 1 1042 . 1 1 86 86 LYS HD3 H 1 1.336 0.020 . 2 . . . A 600 LYS HD3 . 19977 1 1043 . 1 1 86 86 LYS HE2 H 1 2.729 0.020 . 2 . . . A 600 LYS HE2 . 19977 1 1044 . 1 1 86 86 LYS HE3 H 1 2.687 0.020 . 2 . . . A 600 LYS HE3 . 19977 1 1045 . 1 1 86 86 LYS C C 13 176.387 0.3 . 1 . . . A 600 LYS C . 19977 1 1046 . 1 1 86 86 LYS CA C 13 54.510 0.3 . 1 . . . A 600 LYS CA . 19977 1 1047 . 1 1 86 86 LYS CB C 13 34.318 0.3 . 1 . . . A 600 LYS CB . 19977 1 1048 . 1 1 86 86 LYS CG C 13 24.793 0.3 . 1 . . . A 600 LYS CG . 19977 1 1049 . 1 1 86 86 LYS CD C 13 28.635 0.3 . 1 . . . A 600 LYS CD . 19977 1 1050 . 1 1 86 86 LYS CE C 13 42.194 0.3 . 1 . . . A 600 LYS CE . 19977 1 1051 . 1 1 86 86 LYS N N 15 123.204 0.3 . 1 . . . A 600 LYS N . 19977 1 1052 . 1 1 87 87 LEU H H 1 8.549 0.020 . 1 . . . A 601 LEU H . 19977 1 1053 . 1 1 87 87 LEU HA H 1 4.598 0.020 . 1 . . . A 601 LEU HA . 19977 1 1054 . 1 1 87 87 LEU HB2 H 1 1.273 0.020 . 2 . . . A 601 LEU HB2 . 19977 1 1055 . 1 1 87 87 LEU HB3 H 1 1.237 0.020 . 2 . . . A 601 LEU HB3 . 19977 1 1056 . 1 1 87 87 LEU HG H 1 1.200 0.020 . 1 . . . A 601 LEU HG . 19977 1 1057 . 1 1 87 87 LEU HD11 H 1 0.561 0.020 . 1 . . . A 601 LEU HD11 . 19977 1 1058 . 1 1 87 87 LEU HD12 H 1 0.561 0.020 . 1 . . . A 601 LEU HD12 . 19977 1 1059 . 1 1 87 87 LEU HD13 H 1 0.561 0.020 . 1 . . . A 601 LEU HD13 . 19977 1 1060 . 1 1 87 87 LEU HD21 H 1 0.812 0.020 . 1 . . . A 601 LEU HD21 . 19977 1 1061 . 1 1 87 87 LEU HD22 H 1 0.812 0.020 . 1 . . . A 601 LEU HD22 . 19977 1 1062 . 1 1 87 87 LEU HD23 H 1 0.812 0.020 . 1 . . . A 601 LEU HD23 . 19977 1 1063 . 1 1 87 87 LEU C C 13 175.012 0.3 . 1 . . . A 601 LEU C . 19977 1 1064 . 1 1 87 87 LEU CA C 13 53.338 0.3 . 1 . . . A 601 LEU CA . 19977 1 1065 . 1 1 87 87 LEU CB C 13 45.714 0.3 . 1 . . . A 601 LEU CB . 19977 1 1066 . 1 1 87 87 LEU CG C 13 26.191 0.3 . 1 . . . A 601 LEU CG . 19977 1 1067 . 1 1 87 87 LEU CD1 C 13 25.979 0.3 . 1 . . . A 601 LEU CD1 . 19977 1 1068 . 1 1 87 87 LEU CD2 C 13 22.701 0.3 . 1 . . . A 601 LEU CD2 . 19977 1 1069 . 1 1 87 87 LEU N N 15 121.952 0.3 . 1 . . . A 601 LEU N . 19977 1 1070 . 1 1 88 88 SER H H 1 8.214 0.020 . 1 . . . A 602 SER H . 19977 1 1071 . 1 1 88 88 SER HA H 1 5.661 0.020 . 1 . . . A 602 SER HA . 19977 1 1072 . 1 1 88 88 SER HB2 H 1 3.863 0.020 . 2 . . . A 602 SER HB2 . 19977 1 1073 . 1 1 88 88 SER HB3 H 1 3.717 0.020 . 2 . . . A 602 SER HB3 . 19977 1 1074 . 1 1 88 88 SER C C 13 173.881 0.3 . 1 . . . A 602 SER C . 19977 1 1075 . 1 1 88 88 SER CA C 13 55.503 0.3 . 1 . . . A 602 SER CA . 19977 1 1076 . 1 1 88 88 SER CB C 13 65.641 0.3 . 1 . . . A 602 SER CB . 19977 1 1077 . 1 1 88 88 SER N N 15 114.028 0.3 . 1 . . . A 602 SER N . 19977 1 1078 . 1 1 89 89 ASP H H 1 9.219 0.020 . 1 . . . A 603 ASP H . 19977 1 1079 . 1 1 89 89 ASP HA H 1 3.756 0.020 . 1 . . . A 603 ASP HA . 19977 1 1080 . 1 1 89 89 ASP HB2 H 1 2.658 0.020 . 1 . . . A 603 ASP HB2 . 19977 1 1081 . 1 1 89 89 ASP HB3 H 1 2.658 0.020 . 1 . . . A 603 ASP HB3 . 19977 1 1082 . 1 1 89 89 ASP C C 13 176.396 0.3 . 1 . . . A 603 ASP C . 19977 1 1083 . 1 1 89 89 ASP CA C 13 56.007 0.3 . 1 . . . A 603 ASP CA . 19977 1 1084 . 1 1 89 89 ASP CB C 13 39.995 0.3 . 1 . . . A 603 ASP CB . 19977 1 1085 . 1 1 89 89 ASP N N 15 116.599 0.3 . 1 . . . A 603 ASP N . 19977 1 1086 . 1 1 90 90 GLY H H 1 9.045 0.020 . 1 . . . A 604 GLY H . 19977 1 1087 . 1 1 90 90 GLY HA2 H 1 4.439 0.020 . 2 . . . A 604 GLY HA2 . 19977 1 1088 . 1 1 90 90 GLY HA3 H 1 3.639 0.020 . 2 . . . A 604 GLY HA3 . 19977 1 1089 . 1 1 90 90 GLY C C 13 174.532 0.3 . 1 . . . A 604 GLY C . 19977 1 1090 . 1 1 90 90 GLY CA C 13 45.203 0.3 . 1 . . . A 604 GLY CA . 19977 1 1091 . 1 1 90 90 GLY N N 15 112.794 0.3 . 1 . . . A 604 GLY N . 19977 1 1092 . 1 1 91 91 SER H H 1 8.075 0.020 . 1 . . . A 605 SER H . 19977 1 1093 . 1 1 91 91 SER HA H 1 4.738 0.020 . 1 . . . A 605 SER HA . 19977 1 1094 . 1 1 91 91 SER HB2 H 1 4.002 0.020 . 2 . . . A 605 SER HB2 . 19977 1 1095 . 1 1 91 91 SER HB3 H 1 3.952 0.020 . 2 . . . A 605 SER HB3 . 19977 1 1096 . 1 1 91 91 SER C C 13 170.751 0.3 . 1 . . . A 605 SER C . 19977 1 1097 . 1 1 91 91 SER CA C 13 58.541 0.3 . 1 . . . A 605 SER CA . 19977 1 1098 . 1 1 91 91 SER CB C 13 64.571 0.3 . 1 . . . A 605 SER CB . 19977 1 1099 . 1 1 91 91 SER N N 15 115.612 0.3 . 1 . . . A 605 SER N . 19977 1 1100 . 1 1 92 92 TYR H H 1 7.520 0.020 . 1 . . . A 606 TYR H . 19977 1 1101 . 1 1 92 92 TYR HA H 1 5.377 0.020 . 1 . . . A 606 TYR HA . 19977 1 1102 . 1 1 92 92 TYR HB2 H 1 2.800 0.020 . 2 . . . A 606 TYR HB2 . 19977 1 1103 . 1 1 92 92 TYR HB3 H 1 2.394 0.020 . 2 . . . A 606 TYR HB3 . 19977 1 1104 . 1 1 92 92 TYR HD1 H 1 6.931 0.020 . 1 . . . A 606 TYR HD1 . 19977 1 1105 . 1 1 92 92 TYR HD2 H 1 6.931 0.020 . 1 . . . A 606 TYR HD2 . 19977 1 1106 . 1 1 92 92 TYR HE1 H 1 6.764 0.020 . 1 . . . A 606 TYR HE1 . 19977 1 1107 . 1 1 92 92 TYR HE2 H 1 6.764 0.020 . 1 . . . A 606 TYR HE2 . 19977 1 1108 . 1 1 92 92 TYR C C 13 173.337 0.3 . 1 . . . A 606 TYR C . 19977 1 1109 . 1 1 92 92 TYR CA C 13 54.808 0.3 . 1 . . . A 606 TYR CA . 19977 1 1110 . 1 1 92 92 TYR CB C 13 41.371 0.3 . 1 . . . A 606 TYR CB . 19977 1 1111 . 1 1 92 92 TYR N N 15 115.230 0.3 . 1 . . . A 606 TYR N . 19977 1 1112 . 1 1 93 93 PHE H H 1 8.583 0.020 . 1 . . . A 607 PHE H . 19977 1 1113 . 1 1 93 93 PHE HA H 1 5.130 0.020 . 1 . . . A 607 PHE HA . 19977 1 1114 . 1 1 93 93 PHE HB2 H 1 3.054 0.020 . 2 . . . A 607 PHE HB2 . 19977 1 1115 . 1 1 93 93 PHE HB3 H 1 2.873 0.020 . 2 . . . A 607 PHE HB3 . 19977 1 1116 . 1 1 93 93 PHE HD1 H 1 6.613 0.020 . 1 . . . A 607 PHE HD1 . 19977 1 1117 . 1 1 93 93 PHE HD2 H 1 6.613 0.020 . 1 . . . A 607 PHE HD2 . 19977 1 1118 . 1 1 93 93 PHE HE1 H 1 6.513 0.020 . 1 . . . A 607 PHE HE1 . 19977 1 1119 . 1 1 93 93 PHE HE2 H 1 6.513 0.020 . 1 . . . A 607 PHE HE2 . 19977 1 1120 . 1 1 93 93 PHE HZ H 1 6.261 0.020 . 1 . . . A 607 PHE HZ . 19977 1 1121 . 1 1 93 93 PHE C C 13 174.390 0.3 . 1 . . . A 607 PHE C . 19977 1 1122 . 1 1 93 93 PHE CA C 13 56.891 0.3 . 1 . . . A 607 PHE CA . 19977 1 1123 . 1 1 93 93 PHE CB C 13 38.980 0.3 . 1 . . . A 607 PHE CB . 19977 1 1124 . 1 1 93 93 PHE N N 15 111.548 0.3 . 1 . . . A 607 PHE N . 19977 1 1125 . 1 1 94 94 GLY H H 1 9.063 0.020 . 1 . . . A 608 GLY H . 19977 1 1126 . 1 1 94 94 GLY HA2 H 1 4.681 0.020 . 1 . . . A 608 GLY HA2 . 19977 1 1127 . 1 1 94 94 GLY HA3 H 1 4.681 0.020 . 1 . . . A 608 GLY HA3 . 19977 1 1128 . 1 1 94 94 GLY CA C 13 45.785 0.3 . 1 . . . A 608 GLY CA . 19977 1 1129 . 1 1 94 94 GLY N N 15 107.661 0.3 . 1 . . . A 608 GLY N . 19977 1 1130 . 1 1 95 95 GLU H H 1 10.433 0.020 . 1 . . . A 609 GLU H . 19977 1 1131 . 1 1 95 95 GLU HA H 1 4.071 0.020 . 1 . . . A 609 GLU HA . 19977 1 1132 . 1 1 95 95 GLU HB2 H 1 1.860 0.020 . 1 . . . A 609 GLU HB2 . 19977 1 1133 . 1 1 95 95 GLU HB3 H 1 1.860 0.020 . 1 . . . A 609 GLU HB3 . 19977 1 1134 . 1 1 95 95 GLU HG2 H 1 2.156 0.020 . 2 . . . A 609 GLU HG2 . 19977 1 1135 . 1 1 95 95 GLU HG3 H 1 2.017 0.020 . 2 . . . A 609 GLU HG3 . 19977 1 1136 . 1 1 95 95 GLU C C 13 176.226 0.3 . 1 . . . A 609 GLU C . 19977 1 1137 . 1 1 95 95 GLU CA C 13 56.498 0.3 . 1 . . . A 609 GLU CA . 19977 1 1138 . 1 1 95 95 GLU CB C 13 30.151 0.3 . 1 . . . A 609 GLU CB . 19977 1 1139 . 1 1 95 95 GLU CG C 13 36.148 0.3 . 1 . . . A 609 GLU CG . 19977 1 1140 . 1 1 95 95 GLU N N 15 121.700 0.3 . 1 . . . A 609 GLU N . 19977 1 1141 . 1 1 96 96 ILE H H 1 8.189 0.020 . 1 . . . A 610 ILE H . 19977 1 1142 . 1 1 96 96 ILE HA H 1 4.072 0.020 . 1 . . . A 610 ILE HA . 19977 1 1143 . 1 1 96 96 ILE HB H 1 1.782 0.020 . 1 . . . A 610 ILE HB . 19977 1 1144 . 1 1 96 96 ILE HG12 H 1 1.372 0.020 . 2 . . . A 610 ILE HG12 . 19977 1 1145 . 1 1 96 96 ILE HG13 H 1 1.092 0.020 . 2 . . . A 610 ILE HG13 . 19977 1 1146 . 1 1 96 96 ILE HG21 H 1 0.784 0.020 . 1 . . . A 610 ILE HG21 . 19977 1 1147 . 1 1 96 96 ILE HG22 H 1 0.784 0.020 . 1 . . . A 610 ILE HG22 . 19977 1 1148 . 1 1 96 96 ILE HG23 H 1 0.784 0.020 . 1 . . . A 610 ILE HG23 . 19977 1 1149 . 1 1 96 96 ILE HD11 H 1 0.774 0.020 . 1 . . . A 610 ILE HD11 . 19977 1 1150 . 1 1 96 96 ILE HD12 H 1 0.774 0.020 . 1 . . . A 610 ILE HD12 . 19977 1 1151 . 1 1 96 96 ILE HD13 H 1 0.774 0.020 . 1 . . . A 610 ILE HD13 . 19977 1 1152 . 1 1 96 96 ILE CA C 13 61.036 0.3 . 1 . . . A 610 ILE CA . 19977 1 1153 . 1 1 96 96 ILE CB C 13 38.350 0.3 . 1 . . . A 610 ILE CB . 19977 1 1154 . 1 1 96 96 ILE CG1 C 13 27.360 0.3 . 1 . . . A 610 ILE CG1 . 19977 1 1155 . 1 1 96 96 ILE CG2 C 13 17.337 0.3 . 1 . . . A 610 ILE CG2 . 19977 1 1156 . 1 1 96 96 ILE CD1 C 13 12.991 0.3 . 1 . . . A 610 ILE CD1 . 19977 1 1157 . 1 1 96 96 ILE N N 15 122.537 0.3 . 1 . . . A 610 ILE N . 19977 1 1158 . 1 1 97 97 CYS H H 1 7.279 0.020 . 1 . . . A 611 CYS H . 19977 1 1159 . 1 1 97 97 CYS HA H 1 4.581 0.020 . 1 . . . A 611 CYS HA . 19977 1 1160 . 1 1 97 97 CYS HB2 H 1 2.810 0.020 . 2 . . . A 611 CYS HB2 . 19977 1 1161 . 1 1 97 97 CYS HB3 H 1 2.701 0.020 . 2 . . . A 611 CYS HB3 . 19977 1 1162 . 1 1 97 97 CYS C C 13 174.455 0.3 . 1 . . . A 611 CYS C . 19977 1 1163 . 1 1 97 97 CYS CA C 13 59.296 0.3 . 1 . . . A 611 CYS CA . 19977 1 1164 . 1 1 97 97 CYS CB C 13 26.887 0.3 . 1 . . . A 611 CYS CB . 19977 1 1165 . 1 1 97 97 CYS N N 15 116.074 0.3 . 1 . . . A 611 CYS N . 19977 1 1166 . 1 1 98 98 LEU H H 1 7.252 0.020 . 1 . . . A 612 LEU H . 19977 1 1167 . 1 1 98 98 LEU HA H 1 3.789 0.020 . 1 . . . A 612 LEU HA . 19977 1 1168 . 1 1 98 98 LEU HB2 H 1 1.248 0.020 . 2 . . . A 612 LEU HB2 . 19977 1 1169 . 1 1 98 98 LEU HB3 H 1 0.699 0.020 . 2 . . . A 612 LEU HB3 . 19977 1 1170 . 1 1 98 98 LEU HG H 1 1.236 0.020 . 1 . . . A 612 LEU HG . 19977 1 1171 . 1 1 98 98 LEU HD11 H 1 0.178 0.020 . 1 . . . A 612 LEU HD11 . 19977 1 1172 . 1 1 98 98 LEU HD12 H 1 0.178 0.020 . 1 . . . A 612 LEU HD12 . 19977 1 1173 . 1 1 98 98 LEU HD13 H 1 0.178 0.020 . 1 . . . A 612 LEU HD13 . 19977 1 1174 . 1 1 98 98 LEU HD21 H 1 0.105 0.020 . 1 . . . A 612 LEU HD21 . 19977 1 1175 . 1 1 98 98 LEU HD22 H 1 0.105 0.020 . 1 . . . A 612 LEU HD22 . 19977 1 1176 . 1 1 98 98 LEU HD23 H 1 0.105 0.020 . 1 . . . A 612 LEU HD23 . 19977 1 1177 . 1 1 98 98 LEU CA C 13 56.643 0.3 . 1 . . . A 612 LEU CA . 19977 1 1178 . 1 1 98 98 LEU CB C 13 40.581 0.3 . 1 . . . A 612 LEU CB . 19977 1 1179 . 1 1 98 98 LEU CG C 13 26.523 0.3 . 1 . . . A 612 LEU CG . 19977 1 1180 . 1 1 98 98 LEU CD1 C 13 25.086 0.3 . 1 . . . A 612 LEU CD1 . 19977 1 1181 . 1 1 98 98 LEU CD2 C 13 21.359 0.3 . 1 . . . A 612 LEU CD2 . 19977 1 1182 . 1 1 98 98 LEU N N 15 119.557 0.3 . 1 . . . A 612 LEU N . 19977 1 1183 . 1 1 99 99 LEU H H 1 7.253 0.020 . 1 . . . A 613 LEU H . 19977 1 1184 . 1 1 99 99 LEU HA H 1 4.404 0.020 . 1 . . . A 613 LEU HA . 19977 1 1185 . 1 1 99 99 LEU HB2 H 1 1.645 0.020 . 2 . . . A 613 LEU HB2 . 19977 1 1186 . 1 1 99 99 LEU HB3 H 1 1.564 0.020 . 2 . . . A 613 LEU HB3 . 19977 1 1187 . 1 1 99 99 LEU HG H 1 1.449 0.020 . 1 . . . A 613 LEU HG . 19977 1 1188 . 1 1 99 99 LEU HD11 H 1 0.730 0.020 . 1 . . . A 613 LEU HD11 . 19977 1 1189 . 1 1 99 99 LEU HD12 H 1 0.730 0.020 . 1 . . . A 613 LEU HD12 . 19977 1 1190 . 1 1 99 99 LEU HD13 H 1 0.730 0.020 . 1 . . . A 613 LEU HD13 . 19977 1 1191 . 1 1 99 99 LEU HD21 H 1 0.716 0.020 . 1 . . . A 613 LEU HD21 . 19977 1 1192 . 1 1 99 99 LEU HD22 H 1 0.716 0.020 . 1 . . . A 613 LEU HD22 . 19977 1 1193 . 1 1 99 99 LEU HD23 H 1 0.716 0.020 . 1 . . . A 613 LEU HD23 . 19977 1 1194 . 1 1 99 99 LEU C C 13 177.391 0.3 . 1 . . . A 613 LEU C . 19977 1 1195 . 1 1 99 99 LEU CA C 13 55.070 0.3 . 1 . . . A 613 LEU CA . 19977 1 1196 . 1 1 99 99 LEU CB C 13 43.610 0.3 . 1 . . . A 613 LEU CB . 19977 1 1197 . 1 1 99 99 LEU CG C 13 26.841 0.3 . 1 . . . A 613 LEU CG . 19977 1 1198 . 1 1 99 99 LEU CD1 C 13 25.448 0.3 . 1 . . . A 613 LEU CD1 . 19977 1 1199 . 1 1 99 99 LEU CD2 C 13 22.768 0.3 . 1 . . . A 613 LEU CD2 . 19977 1 1200 . 1 1 99 99 LEU N N 15 113.724 0.3 . 1 . . . A 613 LEU N . 19977 1 1201 . 1 1 100 100 THR H H 1 7.718 0.020 . 1 . . . A 614 THR H . 19977 1 1202 . 1 1 100 100 THR HA H 1 4.442 0.020 . 1 . . . A 614 THR HA . 19977 1 1203 . 1 1 100 100 THR HB H 1 4.021 0.020 . 1 . . . A 614 THR HB . 19977 1 1204 . 1 1 100 100 THR HG21 H 1 1.018 0.020 . 1 . . . A 614 THR HG21 . 19977 1 1205 . 1 1 100 100 THR HG22 H 1 1.018 0.020 . 1 . . . A 614 THR HG22 . 19977 1 1206 . 1 1 100 100 THR HG23 H 1 1.018 0.020 . 1 . . . A 614 THR HG23 . 19977 1 1207 . 1 1 100 100 THR CA C 13 60.739 0.3 . 1 . . . A 614 THR CA . 19977 1 1208 . 1 1 100 100 THR CB C 13 70.753 0.3 . 1 . . . A 614 THR CB . 19977 1 1209 . 1 1 100 100 THR CG2 C 13 20.821 0.3 . 1 . . . A 614 THR CG2 . 19977 1 1210 . 1 1 100 100 THR N N 15 111.006 0.3 . 1 . . . A 614 THR N . 19977 1 1211 . 1 1 101 101 ARG H H 1 8.343 0.020 . 1 . . . A 615 ARG H . 19977 1 1212 . 1 1 101 101 ARG HA H 1 4.432 0.020 . 1 . . . A 615 ARG HA . 19977 1 1213 . 1 1 101 101 ARG HB2 H 1 1.853 0.020 . 2 . . . A 615 ARG HB2 . 19977 1 1214 . 1 1 101 101 ARG HB3 H 1 1.739 0.020 . 2 . . . A 615 ARG HB3 . 19977 1 1215 . 1 1 101 101 ARG HG2 H 1 1.587 0.020 . 2 . . . A 615 ARG HG2 . 19977 1 1216 . 1 1 101 101 ARG HG3 H 1 1.542 0.020 . 2 . . . A 615 ARG HG3 . 19977 1 1217 . 1 1 101 101 ARG HD2 H 1 3.157 0.020 . 1 . . . A 615 ARG HD2 . 19977 1 1218 . 1 1 101 101 ARG HD3 H 1 3.157 0.020 . 1 . . . A 615 ARG HD3 . 19977 1 1219 . 1 1 101 101 ARG CA C 13 57.497 0.3 . 1 . . . A 615 ARG CA . 19977 1 1220 . 1 1 101 101 ARG CB C 13 29.667 0.3 . 1 . . . A 615 ARG CB . 19977 1 1221 . 1 1 101 101 ARG CG C 13 27.449 0.3 . 1 . . . A 615 ARG CG . 19977 1 1222 . 1 1 101 101 ARG CD C 13 43.240 0.3 . 1 . . . A 615 ARG CD . 19977 1 1223 . 1 1 101 101 ARG N N 15 122.935 0.3 . 1 . . . A 615 ARG N . 19977 1 1224 . 1 1 102 102 GLY H H 1 8.150 0.020 . 1 . . . A 616 GLY H . 19977 1 1225 . 1 1 102 102 GLY HA2 H 1 4.057 0.020 . 2 . . . A 616 GLY HA2 . 19977 1 1226 . 1 1 102 102 GLY HA3 H 1 3.844 0.020 . 2 . . . A 616 GLY HA3 . 19977 1 1227 . 1 1 102 102 GLY C C 13 173.138 0.3 . 1 . . . A 616 GLY C . 19977 1 1228 . 1 1 102 102 GLY CA C 13 44.849 0.3 . 1 . . . A 616 GLY CA . 19977 1 1229 . 1 1 102 102 GLY N N 15 109.300 0.3 . 1 . . . A 616 GLY N . 19977 1 1230 . 1 1 103 103 ARG H H 1 8.325 0.020 . 1 . . . A 617 ARG H . 19977 1 1231 . 1 1 103 103 ARG HA H 1 4.676 0.020 . 1 . . . A 617 ARG HA . 19977 1 1232 . 1 1 103 103 ARG HB2 H 1 1.351 0.020 . 1 . . . A 617 ARG HB2 . 19977 1 1233 . 1 1 103 103 ARG HB3 H 1 1.351 0.020 . 1 . . . A 617 ARG HB3 . 19977 1 1234 . 1 1 103 103 ARG HG2 H 1 1.557 0.020 . 2 . . . A 617 ARG HG2 . 19977 1 1235 . 1 1 103 103 ARG HG3 H 1 1.369 0.020 . 2 . . . A 617 ARG HG3 . 19977 1 1236 . 1 1 103 103 ARG HD2 H 1 3.045 0.020 . 1 . . . A 617 ARG HD2 . 19977 1 1237 . 1 1 103 103 ARG HD3 H 1 3.045 0.020 . 1 . . . A 617 ARG HD3 . 19977 1 1238 . 1 1 103 103 ARG C C 13 177.471 0.3 . 1 . . . A 617 ARG C . 19977 1 1239 . 1 1 103 103 ARG CA C 13 55.205 0.3 . 1 . . . A 617 ARG CA . 19977 1 1240 . 1 1 103 103 ARG CB C 13 31.595 0.3 . 1 . . . A 617 ARG CB . 19977 1 1241 . 1 1 103 103 ARG CG C 13 27.819 0.3 . 1 . . . A 617 ARG CG . 19977 1 1242 . 1 1 103 103 ARG CD C 13 42.708 0.3 . 1 . . . A 617 ARG CD . 19977 1 1243 . 1 1 103 103 ARG N N 15 119.232 0.3 . 1 . . . A 617 ARG N . 19977 1 1244 . 1 1 104 104 ARG H H 1 9.094 0.020 . 1 . . . A 618 ARG H . 19977 1 1245 . 1 1 104 104 ARG HA H 1 3.802 0.020 . 1 . . . A 618 ARG HA . 19977 1 1246 . 1 1 104 104 ARG HB2 H 1 1.545 0.020 . 1 . . . A 618 ARG HB2 . 19977 1 1247 . 1 1 104 104 ARG HB3 H 1 1.545 0.020 . 1 . . . A 618 ARG HB3 . 19977 1 1248 . 1 1 104 104 ARG HG2 H 1 1.536 0.020 . 1 . . . A 618 ARG HG2 . 19977 1 1249 . 1 1 104 104 ARG HG3 H 1 1.536 0.020 . 1 . . . A 618 ARG HG3 . 19977 1 1250 . 1 1 104 104 ARG HD2 H 1 3.126 0.020 . 1 . . . A 618 ARG HD2 . 19977 1 1251 . 1 1 104 104 ARG HD3 H 1 3.126 0.020 . 1 . . . A 618 ARG HD3 . 19977 1 1252 . 1 1 104 104 ARG CA C 13 55.112 0.3 . 1 . . . A 618 ARG CA . 19977 1 1253 . 1 1 104 104 ARG CB C 13 31.459 0.3 . 1 . . . A 618 ARG CB . 19977 1 1254 . 1 1 104 104 ARG CG C 13 26.242 0.3 . 1 . . . A 618 ARG CG . 19977 1 1255 . 1 1 104 104 ARG CD C 13 43.112 0.3 . 1 . . . A 618 ARG CD . 19977 1 1256 . 1 1 104 104 ARG N N 15 120.595 0.3 . 1 . . . A 618 ARG N . 19977 1 1257 . 1 1 106 106 ALA H H 1 7.419 0.020 . 1 . . . A 620 ALA H . 19977 1 1258 . 1 1 106 106 ALA HA H 1 4.669 0.020 . 1 . . . A 620 ALA HA . 19977 1 1259 . 1 1 106 106 ALA HB1 H 1 1.137 0.020 . 1 . . . A 620 ALA HB1 . 19977 1 1260 . 1 1 106 106 ALA HB2 H 1 1.137 0.020 . 1 . . . A 620 ALA HB2 . 19977 1 1261 . 1 1 106 106 ALA HB3 H 1 1.137 0.020 . 1 . . . A 620 ALA HB3 . 19977 1 1262 . 1 1 106 106 ALA C C 13 176.539 0.3 . 1 . . . A 620 ALA C . 19977 1 1263 . 1 1 106 106 ALA CA C 13 51.194 0.3 . 1 . . . A 620 ALA CA . 19977 1 1264 . 1 1 106 106 ALA CB C 13 22.191 0.3 . 1 . . . A 620 ALA CB . 19977 1 1265 . 1 1 106 106 ALA N N 15 122.075 0.3 . 1 . . . A 620 ALA N . 19977 1 1266 . 1 1 107 107 SER H H 1 8.365 0.020 . 1 . . . A 621 SER H . 19977 1 1267 . 1 1 107 107 SER HA H 1 4.772 0.020 . 1 . . . A 621 SER HA . 19977 1 1268 . 1 1 107 107 SER HB2 H 1 4.085 0.020 . 1 . . . A 621 SER HB2 . 19977 1 1269 . 1 1 107 107 SER HB3 H 1 4.085 0.020 . 1 . . . A 621 SER HB3 . 19977 1 1270 . 1 1 107 107 SER C C 13 172.428 0.3 . 1 . . . A 621 SER C . 19977 1 1271 . 1 1 107 107 SER CA C 13 57.138 0.3 . 1 . . . A 621 SER CA . 19977 1 1272 . 1 1 107 107 SER CB C 13 65.091 0.3 . 1 . . . A 621 SER CB . 19977 1 1273 . 1 1 107 107 SER N N 15 113.580 0.3 . 1 . . . A 621 SER N . 19977 1 1274 . 1 1 108 108 VAL H H 1 8.985 0.020 . 1 . . . A 622 VAL H . 19977 1 1275 . 1 1 108 108 VAL HA H 1 4.850 0.020 . 1 . . . A 622 VAL HA . 19977 1 1276 . 1 1 108 108 VAL HB H 1 1.185 0.020 . 1 . . . A 622 VAL HB . 19977 1 1277 . 1 1 108 108 VAL HG11 H 1 0.429 0.020 . 1 . . . A 622 VAL HG11 . 19977 1 1278 . 1 1 108 108 VAL HG12 H 1 0.429 0.020 . 1 . . . A 622 VAL HG12 . 19977 1 1279 . 1 1 108 108 VAL HG13 H 1 0.429 0.020 . 1 . . . A 622 VAL HG13 . 19977 1 1280 . 1 1 108 108 VAL HG21 H 1 -0.348 0.020 . 1 . . . A 622 VAL HG21 . 19977 1 1281 . 1 1 108 108 VAL HG22 H 1 -0.348 0.020 . 1 . . . A 622 VAL HG22 . 19977 1 1282 . 1 1 108 108 VAL HG23 H 1 -0.348 0.020 . 1 . . . A 622 VAL HG23 . 19977 1 1283 . 1 1 108 108 VAL C C 13 173.759 0.3 . 1 . . . A 622 VAL C . 19977 1 1284 . 1 1 108 108 VAL CA C 13 61.161 0.3 . 1 . . . A 622 VAL CA . 19977 1 1285 . 1 1 108 108 VAL CB C 13 34.208 0.3 . 1 . . . A 622 VAL CB . 19977 1 1286 . 1 1 108 108 VAL CG1 C 13 21.011 0.3 . 1 . . . A 622 VAL CG1 . 19977 1 1287 . 1 1 108 108 VAL CG2 C 13 20.289 0.3 . 1 . . . A 622 VAL CG2 . 19977 1 1288 . 1 1 108 108 VAL N N 15 121.492 0.3 . 1 . . . A 622 VAL N . 19977 1 1289 . 1 1 109 109 ARG H H 1 8.751 0.020 . 1 . . . A 623 ARG H . 19977 1 1290 . 1 1 109 109 ARG HA H 1 4.518 0.020 . 1 . . . A 623 ARG HA . 19977 1 1291 . 1 1 109 109 ARG HB2 H 1 1.217 0.020 . 2 . . . A 623 ARG HB2 . 19977 1 1292 . 1 1 109 109 ARG HB3 H 1 0.660 0.020 . 2 . . . A 623 ARG HB3 . 19977 1 1293 . 1 1 109 109 ARG HG2 H 1 0.873 0.020 . 2 . . . A 623 ARG HG2 . 19977 1 1294 . 1 1 109 109 ARG HG3 H 1 0.521 0.020 . 2 . . . A 623 ARG HG3 . 19977 1 1295 . 1 1 109 109 ARG HD2 H 1 2.697 0.020 . 2 . . . A 623 ARG HD2 . 19977 1 1296 . 1 1 109 109 ARG HD3 H 1 2.536 0.020 . 2 . . . A 623 ARG HD3 . 19977 1 1297 . 1 1 109 109 ARG HE H 1 6.623 0.020 . 1 . . . A 623 ARG HE . 19977 1 1298 . 1 1 109 109 ARG C C 13 174.065 0.3 . 1 . . . A 623 ARG C . 19977 1 1299 . 1 1 109 109 ARG CA C 13 52.797 0.3 . 1 . . . A 623 ARG CA . 19977 1 1300 . 1 1 109 109 ARG CB C 13 34.783 0.3 . 1 . . . A 623 ARG CB . 19977 1 1301 . 1 1 109 109 ARG CG C 13 25.812 0.3 . 1 . . . A 623 ARG CG . 19977 1 1302 . 1 1 109 109 ARG CD C 13 43.130 0.3 . 1 . . . A 623 ARG CD . 19977 1 1303 . 1 1 109 109 ARG N N 15 129.873 0.3 . 1 . . . A 623 ARG N . 19977 1 1304 . 1 1 109 109 ARG NE N 15 83.706 0.3 . 1 . . . A 623 ARG NE . 19977 1 1305 . 1 1 110 110 ALA H H 1 8.745 0.020 . 1 . . . A 624 ALA H . 19977 1 1306 . 1 1 110 110 ALA HA H 1 4.084 0.020 . 1 . . . A 624 ALA HA . 19977 1 1307 . 1 1 110 110 ALA HB1 H 1 1.386 0.020 . 1 . . . A 624 ALA HB1 . 19977 1 1308 . 1 1 110 110 ALA HB2 H 1 1.386 0.020 . 1 . . . A 624 ALA HB2 . 19977 1 1309 . 1 1 110 110 ALA HB3 H 1 1.386 0.020 . 1 . . . A 624 ALA HB3 . 19977 1 1310 . 1 1 110 110 ALA C C 13 177.133 0.3 . 1 . . . A 624 ALA C . 19977 1 1311 . 1 1 110 110 ALA CA C 13 52.739 0.3 . 1 . . . A 624 ALA CA . 19977 1 1312 . 1 1 110 110 ALA CB C 13 18.751 0.3 . 1 . . . A 624 ALA CB . 19977 1 1313 . 1 1 110 110 ALA N N 15 127.858 0.3 . 1 . . . A 624 ALA N . 19977 1 1314 . 1 1 111 111 ASP H H 1 9.208 0.020 . 1 . . . A 625 ASP H . 19977 1 1315 . 1 1 111 111 ASP HA H 1 4.630 0.020 . 1 . . . A 625 ASP HA . 19977 1 1316 . 1 1 111 111 ASP HB2 H 1 2.445 0.020 . 2 . . . A 625 ASP HB2 . 19977 1 1317 . 1 1 111 111 ASP HB3 H 1 2.262 0.020 . 2 . . . A 625 ASP HB3 . 19977 1 1318 . 1 1 111 111 ASP C C 13 176.513 0.3 . 1 . . . A 625 ASP C . 19977 1 1319 . 1 1 111 111 ASP CA C 13 55.247 0.3 . 1 . . . A 625 ASP CA . 19977 1 1320 . 1 1 111 111 ASP CB C 13 41.305 0.3 . 1 . . . A 625 ASP CB . 19977 1 1321 . 1 1 111 111 ASP N N 15 126.771 0.3 . 1 . . . A 625 ASP N . 19977 1 1322 . 1 1 112 112 THR H H 1 7.256 0.020 . 1 . . . A 626 THR H . 19977 1 1323 . 1 1 112 112 THR HA H 1 4.545 0.020 . 1 . . . A 626 THR HA . 19977 1 1324 . 1 1 112 112 THR HB H 1 4.606 0.020 . 1 . . . A 626 THR HB . 19977 1 1325 . 1 1 112 112 THR HG21 H 1 1.051 0.020 . 1 . . . A 626 THR HG21 . 19977 1 1326 . 1 1 112 112 THR HG22 H 1 1.051 0.020 . 1 . . . A 626 THR HG22 . 19977 1 1327 . 1 1 112 112 THR HG23 H 1 1.051 0.020 . 1 . . . A 626 THR HG23 . 19977 1 1328 . 1 1 112 112 THR C C 13 173.759 0.3 . 1 . . . A 626 THR C . 19977 1 1329 . 1 1 112 112 THR CA C 13 59.333 0.3 . 1 . . . A 626 THR CA . 19977 1 1330 . 1 1 112 112 THR CB C 13 73.340 0.3 . 1 . . . A 626 THR CB . 19977 1 1331 . 1 1 112 112 THR CG2 C 13 20.178 0.3 . 1 . . . A 626 THR CG2 . 19977 1 1332 . 1 1 112 112 THR N N 15 108.771 0.3 . 1 . . . A 626 THR N . 19977 1 1333 . 1 1 113 113 TYR H H 1 8.443 0.020 . 1 . . . A 627 TYR H . 19977 1 1334 . 1 1 113 113 TYR HA H 1 4.422 0.020 . 1 . . . A 627 TYR HA . 19977 1 1335 . 1 1 113 113 TYR HB2 H 1 3.082 0.020 . 2 . . . A 627 TYR HB2 . 19977 1 1336 . 1 1 113 113 TYR HB3 H 1 2.849 0.020 . 2 . . . A 627 TYR HB3 . 19977 1 1337 . 1 1 113 113 TYR HD1 H 1 7.064 0.020 . 1 . . . A 627 TYR HD1 . 19977 1 1338 . 1 1 113 113 TYR HD2 H 1 7.064 0.020 . 1 . . . A 627 TYR HD2 . 19977 1 1339 . 1 1 113 113 TYR HE1 H 1 6.668 0.020 . 1 . . . A 627 TYR HE1 . 19977 1 1340 . 1 1 113 113 TYR HE2 H 1 6.668 0.020 . 1 . . . A 627 TYR HE2 . 19977 1 1341 . 1 1 113 113 TYR C C 13 177.824 0.3 . 1 . . . A 627 TYR C . 19977 1 1342 . 1 1 113 113 TYR CA C 13 59.882 0.3 . 1 . . . A 627 TYR CA . 19977 1 1343 . 1 1 113 113 TYR CB C 13 38.284 0.3 . 1 . . . A 627 TYR CB . 19977 1 1344 . 1 1 113 113 TYR N N 15 119.597 0.3 . 1 . . . A 627 TYR N . 19977 1 1345 . 1 1 114 114 CYS H H 1 8.741 0.020 . 1 . . . A 628 CYS H . 19977 1 1346 . 1 1 114 114 CYS HA H 1 5.328 0.020 . 1 . . . A 628 CYS HA . 19977 1 1347 . 1 1 114 114 CYS HB2 H 1 2.573 0.020 . 2 . . . A 628 CYS HB2 . 19977 1 1348 . 1 1 114 114 CYS HB3 H 1 2.264 0.020 . 2 . . . A 628 CYS HB3 . 19977 1 1349 . 1 1 114 114 CYS C C 13 172.313 0.3 . 1 . . . A 628 CYS C . 19977 1 1350 . 1 1 114 114 CYS CA C 13 58.449 0.3 . 1 . . . A 628 CYS CA . 19977 1 1351 . 1 1 114 114 CYS CB C 13 31.451 0.3 . 1 . . . A 628 CYS CB . 19977 1 1352 . 1 1 114 114 CYS N N 15 127.921 0.3 . 1 . . . A 628 CYS N . 19977 1 1353 . 1 1 115 115 ARG H H 1 9.005 0.020 . 1 . . . A 629 ARG H . 19977 1 1354 . 1 1 115 115 ARG HA H 1 4.410 0.020 . 1 . . . A 629 ARG HA . 19977 1 1355 . 1 1 115 115 ARG HB2 H 1 1.976 0.020 . 2 . . . A 629 ARG HB2 . 19977 1 1356 . 1 1 115 115 ARG HB3 H 1 1.907 0.020 . 2 . . . A 629 ARG HB3 . 19977 1 1357 . 1 1 115 115 ARG HG2 H 1 1.641 0.020 . 1 . . . A 629 ARG HG2 . 19977 1 1358 . 1 1 115 115 ARG HG3 H 1 1.641 0.020 . 1 . . . A 629 ARG HG3 . 19977 1 1359 . 1 1 115 115 ARG HD2 H 1 3.492 0.020 . 2 . . . A 629 ARG HD2 . 19977 1 1360 . 1 1 115 115 ARG HD3 H 1 3.334 0.020 . 2 . . . A 629 ARG HD3 . 19977 1 1361 . 1 1 115 115 ARG C C 13 173.982 0.3 . 1 . . . A 629 ARG C . 19977 1 1362 . 1 1 115 115 ARG CA C 13 55.314 0.3 . 1 . . . A 629 ARG CA . 19977 1 1363 . 1 1 115 115 ARG CB C 13 32.784 0.3 . 1 . . . A 629 ARG CB . 19977 1 1364 . 1 1 115 115 ARG CG C 13 27.431 0.3 . 1 . . . A 629 ARG CG . 19977 1 1365 . 1 1 115 115 ARG CD C 13 43.989 0.3 . 1 . . . A 629 ARG CD . 19977 1 1366 . 1 1 115 115 ARG N N 15 121.281 0.3 . 1 . . . A 629 ARG N . 19977 1 1367 . 1 1 116 116 LEU H H 1 8.949 0.020 . 1 . . . A 630 LEU H . 19977 1 1368 . 1 1 116 116 LEU HA H 1 5.312 0.020 . 1 . . . A 630 LEU HA . 19977 1 1369 . 1 1 116 116 LEU HB2 H 1 1.717 0.020 . 2 . . . A 630 LEU HB2 . 19977 1 1370 . 1 1 116 116 LEU HB3 H 1 1.662 0.020 . 2 . . . A 630 LEU HB3 . 19977 1 1371 . 1 1 116 116 LEU HG H 1 1.556 0.020 . 1 . . . A 630 LEU HG . 19977 1 1372 . 1 1 116 116 LEU HD11 H 1 0.638 0.020 . 1 . . . A 630 LEU HD11 . 19977 1 1373 . 1 1 116 116 LEU HD12 H 1 0.638 0.020 . 1 . . . A 630 LEU HD12 . 19977 1 1374 . 1 1 116 116 LEU HD13 H 1 0.638 0.020 . 1 . . . A 630 LEU HD13 . 19977 1 1375 . 1 1 116 116 LEU HD21 H 1 0.764 0.020 . 1 . . . A 630 LEU HD21 . 19977 1 1376 . 1 1 116 116 LEU HD22 H 1 0.764 0.020 . 1 . . . A 630 LEU HD22 . 19977 1 1377 . 1 1 116 116 LEU HD23 H 1 0.764 0.020 . 1 . . . A 630 LEU HD23 . 19977 1 1378 . 1 1 116 116 LEU C C 13 174.324 0.3 . 1 . . . A 630 LEU C . 19977 1 1379 . 1 1 116 116 LEU CA C 13 52.542 0.3 . 1 . . . A 630 LEU CA . 19977 1 1380 . 1 1 116 116 LEU CB C 13 46.060 0.3 . 1 . . . A 630 LEU CB . 19977 1 1381 . 1 1 116 116 LEU CG C 13 27.681 0.3 . 1 . . . A 630 LEU CG . 19977 1 1382 . 1 1 116 116 LEU CD1 C 13 28.284 0.3 . 1 . . . A 630 LEU CD1 . 19977 1 1383 . 1 1 116 116 LEU CD2 C 13 26.761 0.3 . 1 . . . A 630 LEU CD2 . 19977 1 1384 . 1 1 116 116 LEU N N 15 123.294 0.3 . 1 . . . A 630 LEU N . 19977 1 1385 . 1 1 117 117 TYR H H 1 8.967 0.020 . 1 . . . A 631 TYR H . 19977 1 1386 . 1 1 117 117 TYR HA H 1 5.670 0.020 . 1 . . . A 631 TYR HA . 19977 1 1387 . 1 1 117 117 TYR HB2 H 1 2.854 0.020 . 2 . . . A 631 TYR HB2 . 19977 1 1388 . 1 1 117 117 TYR HB3 H 1 2.625 0.020 . 2 . . . A 631 TYR HB3 . 19977 1 1389 . 1 1 117 117 TYR HD1 H 1 6.778 0.020 . 1 . . . A 631 TYR HD1 . 19977 1 1390 . 1 1 117 117 TYR HD2 H 1 6.778 0.020 . 1 . . . A 631 TYR HD2 . 19977 1 1391 . 1 1 117 117 TYR HE1 H 1 6.647 0.020 . 1 . . . A 631 TYR HE1 . 19977 1 1392 . 1 1 117 117 TYR HE2 H 1 6.647 0.020 . 1 . . . A 631 TYR HE2 . 19977 1 1393 . 1 1 117 117 TYR CA C 13 56.777 0.3 . 1 . . . A 631 TYR CA . 19977 1 1394 . 1 1 117 117 TYR CB C 13 42.523 0.3 . 1 . . . A 631 TYR CB . 19977 1 1395 . 1 1 117 117 TYR N N 15 115.674 0.3 . 1 . . . A 631 TYR N . 19977 1 1396 . 1 1 118 118 SER H H 1 10.324 0.020 . 1 . . . A 632 SER H . 19977 1 1397 . 1 1 118 118 SER HA H 1 5.349 0.020 . 1 . . . A 632 SER HA . 19977 1 1398 . 1 1 118 118 SER HB2 H 1 3.318 0.020 . 2 . . . A 632 SER HB2 . 19977 1 1399 . 1 1 118 118 SER HB3 H 1 3.152 0.020 . 2 . . . A 632 SER HB3 . 19977 1 1400 . 1 1 118 118 SER CA C 13 54.510 0.3 . 1 . . . A 632 SER CA . 19977 1 1401 . 1 1 118 118 SER CB C 13 67.641 0.3 . 1 . . . A 632 SER CB . 19977 1 1402 . 1 1 118 118 SER N N 15 118.613 0.3 . 1 . . . A 632 SER N . 19977 1 1403 . 1 1 119 119 LEU H H 1 8.001 0.020 . 1 . . . A 633 LEU H . 19977 1 1404 . 1 1 119 119 LEU HA H 1 4.891 0.020 . 1 . . . A 633 LEU HA . 19977 1 1405 . 1 1 119 119 LEU HB2 H 1 1.553 0.020 . 2 . . . A 633 LEU HB2 . 19977 1 1406 . 1 1 119 119 LEU HB3 H 1 1.194 0.020 . 2 . . . A 633 LEU HB3 . 19977 1 1407 . 1 1 119 119 LEU HG H 1 0.891 0.020 . 1 . . . A 633 LEU HG . 19977 1 1408 . 1 1 119 119 LEU HD11 H 1 0.862 0.020 . 1 . . . A 633 LEU HD11 . 19977 1 1409 . 1 1 119 119 LEU HD12 H 1 0.862 0.020 . 1 . . . A 633 LEU HD12 . 19977 1 1410 . 1 1 119 119 LEU HD13 H 1 0.862 0.020 . 1 . . . A 633 LEU HD13 . 19977 1 1411 . 1 1 119 119 LEU HD21 H 1 0.862 0.020 . 1 . . . A 633 LEU HD21 . 19977 1 1412 . 1 1 119 119 LEU HD22 H 1 0.862 0.020 . 1 . . . A 633 LEU HD22 . 19977 1 1413 . 1 1 119 119 LEU HD23 H 1 0.862 0.020 . 1 . . . A 633 LEU HD23 . 19977 1 1414 . 1 1 119 119 LEU C C 13 174.738 0.3 . 1 . . . A 633 LEU C . 19977 1 1415 . 1 1 119 119 LEU CA C 13 52.559 0.3 . 1 . . . A 633 LEU CA . 19977 1 1416 . 1 1 119 119 LEU CB C 13 46.184 0.3 . 1 . . . A 633 LEU CB . 19977 1 1417 . 1 1 119 119 LEU CG C 13 26.177 0.3 . 1 . . . A 633 LEU CG . 19977 1 1418 . 1 1 119 119 LEU CD1 C 13 22.489 0.3 . 1 . . . A 633 LEU CD1 . 19977 1 1419 . 1 1 120 120 SER H H 1 8.929 0.020 . 1 . . . A 634 SER H . 19977 1 1420 . 1 1 120 120 SER HA H 1 5.036 0.020 . 1 . . . A 634 SER HA . 19977 1 1421 . 1 1 120 120 SER HB2 H 1 4.348 0.020 . 2 . . . A 634 SER HB2 . 19977 1 1422 . 1 1 120 120 SER HB3 H 1 3.925 0.020 . 2 . . . A 634 SER HB3 . 19977 1 1423 . 1 1 120 120 SER C C 13 175.072 0.3 . 1 . . . A 634 SER C . 19977 1 1424 . 1 1 120 120 SER CA C 13 55.712 0.3 . 1 . . . A 634 SER CA . 19977 1 1425 . 1 1 120 120 SER CB C 13 65.297 0.3 . 1 . . . A 634 SER CB . 19977 1 1426 . 1 1 120 120 SER N N 15 122.508 0.3 . 1 . . . A 634 SER N . 19977 1 1427 . 1 1 121 121 VAL H H 1 8.548 0.020 . 1 . . . A 635 VAL H . 19977 1 1428 . 1 1 121 121 VAL HA H 1 3.604 0.020 . 1 . . . A 635 VAL HA . 19977 1 1429 . 1 1 121 121 VAL HB H 1 1.955 0.020 . 1 . . . A 635 VAL HB . 19977 1 1430 . 1 1 121 121 VAL HG11 H 1 0.927 0.020 . 1 . . . A 635 VAL HG11 . 19977 1 1431 . 1 1 121 121 VAL HG12 H 1 0.927 0.020 . 1 . . . A 635 VAL HG12 . 19977 1 1432 . 1 1 121 121 VAL HG13 H 1 0.927 0.020 . 1 . . . A 635 VAL HG13 . 19977 1 1433 . 1 1 121 121 VAL HG21 H 1 0.997 0.020 . 1 . . . A 635 VAL HG21 . 19977 1 1434 . 1 1 121 121 VAL HG22 H 1 0.997 0.020 . 1 . . . A 635 VAL HG22 . 19977 1 1435 . 1 1 121 121 VAL HG23 H 1 0.997 0.020 . 1 . . . A 635 VAL HG23 . 19977 1 1436 . 1 1 121 121 VAL C C 13 177.576 0.3 . 1 . . . A 635 VAL C . 19977 1 1437 . 1 1 121 121 VAL CA C 13 65.875 0.3 . 1 . . . A 635 VAL CA . 19977 1 1438 . 1 1 121 121 VAL CB C 13 32.005 0.3 . 1 . . . A 635 VAL CB . 19977 1 1439 . 1 1 121 121 VAL CG1 C 13 23.047 0.3 . 1 . . . A 635 VAL CG1 . 19977 1 1440 . 1 1 121 121 VAL CG2 C 13 20.709 0.3 . 1 . . . A 635 VAL CG2 . 19977 1 1441 . 1 1 121 121 VAL N N 15 122.663 0.3 . 1 . . . A 635 VAL N . 19977 1 1442 . 1 1 122 122 ASP H H 1 8.251 0.020 . 1 . . . A 636 ASP H . 19977 1 1443 . 1 1 122 122 ASP HA H 1 4.464 0.020 . 1 . . . A 636 ASP HA . 19977 1 1444 . 1 1 122 122 ASP HB2 H 1 2.691 0.020 . 2 . . . A 636 ASP HB2 . 19977 1 1445 . 1 1 122 122 ASP HB3 H 1 2.411 0.020 . 2 . . . A 636 ASP HB3 . 19977 1 1446 . 1 1 122 122 ASP C C 13 178.949 0.3 . 1 . . . A 636 ASP C . 19977 1 1447 . 1 1 122 122 ASP CA C 13 57.436 0.3 . 1 . . . A 636 ASP CA . 19977 1 1448 . 1 1 122 122 ASP CB C 13 39.886 0.3 . 1 . . . A 636 ASP CB . 19977 1 1449 . 1 1 122 122 ASP N N 15 118.531 0.3 . 1 . . . A 636 ASP N . 19977 1 1450 . 1 1 123 123 ASN H H 1 7.908 0.020 . 1 . . . A 637 ASN H . 19977 1 1451 . 1 1 123 123 ASN HA H 1 4.649 0.020 . 1 . . . A 637 ASN HA . 19977 1 1452 . 1 1 123 123 ASN HB2 H 1 2.909 0.020 . 2 . . . A 637 ASN HB2 . 19977 1 1453 . 1 1 123 123 ASN HB3 H 1 2.387 0.020 . 2 . . . A 637 ASN HB3 . 19977 1 1454 . 1 1 123 123 ASN HD21 H 1 8.314 0.020 . 1 . . . A 637 ASN HD21 . 19977 1 1455 . 1 1 123 123 ASN HD22 H 1 7.179 0.020 . 1 . . . A 637 ASN HD22 . 19977 1 1456 . 1 1 123 123 ASN C C 13 176.441 0.3 . 1 . . . A 637 ASN C . 19977 1 1457 . 1 1 123 123 ASN CA C 13 55.956 0.3 . 1 . . . A 637 ASN CA . 19977 1 1458 . 1 1 123 123 ASN CB C 13 38.348 0.3 . 1 . . . A 637 ASN CB . 19977 1 1459 . 1 1 123 123 ASN CG C 13 175.552 0.3 . 1 . . . A 637 ASN CG . 19977 1 1460 . 1 1 123 123 ASN N N 15 117.993 0.3 . 1 . . . A 637 ASN N . 19977 1 1461 . 1 1 123 123 ASN ND2 N 15 112.650 0.3 . 1 . . . A 637 ASN ND2 . 19977 1 1462 . 1 1 124 124 PHE H H 1 8.707 0.020 . 1 . . . A 638 PHE H . 19977 1 1463 . 1 1 124 124 PHE HA H 1 4.111 0.020 . 1 . . . A 638 PHE HA . 19977 1 1464 . 1 1 124 124 PHE HB2 H 1 3.236 0.020 . 2 . . . A 638 PHE HB2 . 19977 1 1465 . 1 1 124 124 PHE HB3 H 1 2.933 0.020 . 2 . . . A 638 PHE HB3 . 19977 1 1466 . 1 1 124 124 PHE HD1 H 1 7.168 0.020 . 1 . . . A 638 PHE HD1 . 19977 1 1467 . 1 1 124 124 PHE HD2 H 1 7.168 0.020 . 1 . . . A 638 PHE HD2 . 19977 1 1468 . 1 1 124 124 PHE HE1 H 1 7.059 0.020 . 1 . . . A 638 PHE HE1 . 19977 1 1469 . 1 1 124 124 PHE HE2 H 1 7.059 0.020 . 1 . . . A 638 PHE HE2 . 19977 1 1470 . 1 1 124 124 PHE HZ H 1 6.420 0.020 . 1 . . . A 638 PHE HZ . 19977 1 1471 . 1 1 124 124 PHE C C 13 176.565 0.3 . 1 . . . A 638 PHE C . 19977 1 1472 . 1 1 124 124 PHE CA C 13 61.189 0.3 . 1 . . . A 638 PHE CA . 19977 1 1473 . 1 1 124 124 PHE CB C 13 39.541 0.3 . 1 . . . A 638 PHE CB . 19977 1 1474 . 1 1 124 124 PHE N N 15 121.615 0.3 . 1 . . . A 638 PHE N . 19977 1 1475 . 1 1 125 125 ASN H H 1 8.628 0.020 . 1 . . . A 639 ASN H . 19977 1 1476 . 1 1 125 125 ASN HA H 1 4.227 0.020 . 1 . . . A 639 ASN HA . 19977 1 1477 . 1 1 125 125 ASN HB2 H 1 2.912 0.020 . 2 . . . A 639 ASN HB2 . 19977 1 1478 . 1 1 125 125 ASN HB3 H 1 2.735 0.020 . 2 . . . A 639 ASN HB3 . 19977 1 1479 . 1 1 125 125 ASN HD21 H 1 7.608 0.020 . 1 . . . A 639 ASN HD21 . 19977 1 1480 . 1 1 125 125 ASN HD22 H 1 6.912 0.020 . 1 . . . A 639 ASN HD22 . 19977 1 1481 . 1 1 125 125 ASN C C 13 177.854 0.3 . 1 . . . A 639 ASN C . 19977 1 1482 . 1 1 125 125 ASN CA C 13 56.222 0.3 . 1 . . . A 639 ASN CA . 19977 1 1483 . 1 1 125 125 ASN CB C 13 38.064 0.3 . 1 . . . A 639 ASN CB . 19977 1 1484 . 1 1 125 125 ASN CG C 13 175.907 0.3 . 1 . . . A 639 ASN CG . 19977 1 1485 . 1 1 125 125 ASN N N 15 116.590 0.3 . 1 . . . A 639 ASN N . 19977 1 1486 . 1 1 125 125 ASN ND2 N 15 111.667 0.3 . 1 . . . A 639 ASN ND2 . 19977 1 1487 . 1 1 126 126 GLU H H 1 7.758 0.020 . 1 . . . A 640 GLU H . 19977 1 1488 . 1 1 126 126 GLU HA H 1 3.983 0.020 . 1 . . . A 640 GLU HA . 19977 1 1489 . 1 1 126 126 GLU HB2 H 1 2.324 0.020 . 2 . . . A 640 GLU HB2 . 19977 1 1490 . 1 1 126 126 GLU HB3 H 1 2.054 0.020 . 2 . . . A 640 GLU HB3 . 19977 1 1491 . 1 1 126 126 GLU HG2 H 1 2.446 0.020 . 2 . . . A 640 GLU HG2 . 19977 1 1492 . 1 1 126 126 GLU HG3 H 1 2.162 0.020 . 2 . . . A 640 GLU HG3 . 19977 1 1493 . 1 1 126 126 GLU C C 13 179.506 0.3 . 1 . . . A 640 GLU C . 19977 1 1494 . 1 1 126 126 GLU CA C 13 59.377 0.3 . 1 . . . A 640 GLU CA . 19977 1 1495 . 1 1 126 126 GLU CB C 13 29.573 0.3 . 1 . . . A 640 GLU CB . 19977 1 1496 . 1 1 126 126 GLU CG C 13 36.192 0.3 . 1 . . . A 640 GLU CG . 19977 1 1497 . 1 1 126 126 GLU N N 15 120.264 0.3 . 1 . . . A 640 GLU N . 19977 1 1498 . 1 1 127 127 VAL H H 1 7.542 0.020 . 1 . . . A 641 VAL H . 19977 1 1499 . 1 1 127 127 VAL HA H 1 3.821 0.020 . 1 . . . A 641 VAL HA . 19977 1 1500 . 1 1 127 127 VAL HB H 1 1.864 0.020 . 1 . . . A 641 VAL HB . 19977 1 1501 . 1 1 127 127 VAL HG11 H 1 0.873 0.020 . 1 . . . A 641 VAL HG11 . 19977 1 1502 . 1 1 127 127 VAL HG12 H 1 0.873 0.020 . 1 . . . A 641 VAL HG12 . 19977 1 1503 . 1 1 127 127 VAL HG13 H 1 0.873 0.020 . 1 . . . A 641 VAL HG13 . 19977 1 1504 . 1 1 127 127 VAL HG21 H 1 0.745 0.020 . 1 . . . A 641 VAL HG21 . 19977 1 1505 . 1 1 127 127 VAL HG22 H 1 0.745 0.020 . 1 . . . A 641 VAL HG22 . 19977 1 1506 . 1 1 127 127 VAL HG23 H 1 0.745 0.020 . 1 . . . A 641 VAL HG23 . 19977 1 1507 . 1 1 127 127 VAL C C 13 178.762 0.3 . 1 . . . A 641 VAL C . 19977 1 1508 . 1 1 127 127 VAL CA C 13 65.945 0.3 . 1 . . . A 641 VAL CA . 19977 1 1509 . 1 1 127 127 VAL CB C 13 31.436 0.3 . 1 . . . A 641 VAL CB . 19977 1 1510 . 1 1 127 127 VAL CG1 C 13 23.139 0.3 . 1 . . . A 641 VAL CG1 . 19977 1 1511 . 1 1 127 127 VAL CG2 C 13 23.139 0.3 . 1 . . . A 641 VAL CG2 . 19977 1 1512 . 1 1 127 127 VAL N N 15 119.307 0.3 . 1 . . . A 641 VAL N . 19977 1 1513 . 1 1 128 128 LEU H H 1 8.089 0.020 . 1 . . . A 642 LEU H . 19977 1 1514 . 1 1 128 128 LEU HA H 1 3.933 0.020 . 1 . . . A 642 LEU HA . 19977 1 1515 . 1 1 128 128 LEU HB2 H 1 1.485 0.020 . 2 . . . A 642 LEU HB2 . 19977 1 1516 . 1 1 128 128 LEU HB3 H 1 1.308 0.020 . 2 . . . A 642 LEU HB3 . 19977 1 1517 . 1 1 128 128 LEU HG H 1 1.239 0.020 . 1 . . . A 642 LEU HG . 19977 1 1518 . 1 1 128 128 LEU HD11 H 1 0.449 0.020 . 1 . . . A 642 LEU HD11 . 19977 1 1519 . 1 1 128 128 LEU HD12 H 1 0.449 0.020 . 1 . . . A 642 LEU HD12 . 19977 1 1520 . 1 1 128 128 LEU HD13 H 1 0.449 0.020 . 1 . . . A 642 LEU HD13 . 19977 1 1521 . 1 1 128 128 LEU HD21 H 1 0.552 0.020 . 1 . . . A 642 LEU HD21 . 19977 1 1522 . 1 1 128 128 LEU HD22 H 1 0.552 0.020 . 1 . . . A 642 LEU HD22 . 19977 1 1523 . 1 1 128 128 LEU HD23 H 1 0.552 0.020 . 1 . . . A 642 LEU HD23 . 19977 1 1524 . 1 1 128 128 LEU C C 13 178.898 0.3 . 1 . . . A 642 LEU C . 19977 1 1525 . 1 1 128 128 LEU CA C 13 57.836 0.3 . 1 . . . A 642 LEU CA . 19977 1 1526 . 1 1 128 128 LEU CB C 13 41.982 0.3 . 1 . . . A 642 LEU CB . 19977 1 1527 . 1 1 128 128 LEU CG C 13 26.059 0.3 . 1 . . . A 642 LEU CG . 19977 1 1528 . 1 1 128 128 LEU CD1 C 13 25.177 0.3 . 1 . . . A 642 LEU CD1 . 19977 1 1529 . 1 1 128 128 LEU CD2 C 13 24.437 0.3 . 1 . . . A 642 LEU CD2 . 19977 1 1530 . 1 1 128 128 LEU N N 15 119.704 0.3 . 1 . . . A 642 LEU N . 19977 1 1531 . 1 1 129 129 GLU H H 1 7.538 0.020 . 1 . . . A 643 GLU H . 19977 1 1532 . 1 1 129 129 GLU HA H 1 3.898 0.020 . 1 . . . A 643 GLU HA . 19977 1 1533 . 1 1 129 129 GLU HB2 H 1 2.055 0.020 . 2 . . . A 643 GLU HB2 . 19977 1 1534 . 1 1 129 129 GLU HB3 H 1 1.989 0.020 . 2 . . . A 643 GLU HB3 . 19977 1 1535 . 1 1 129 129 GLU HG2 H 1 2.357 0.020 . 2 . . . A 643 GLU HG2 . 19977 1 1536 . 1 1 129 129 GLU HG3 H 1 2.273 0.020 . 2 . . . A 643 GLU HG3 . 19977 1 1537 . 1 1 129 129 GLU C C 13 178.021 0.3 . 1 . . . A 643 GLU C . 19977 1 1538 . 1 1 129 129 GLU CA C 13 58.669 0.3 . 1 . . . A 643 GLU CA . 19977 1 1539 . 1 1 129 129 GLU CB C 13 29.481 0.3 . 1 . . . A 643 GLU CB . 19977 1 1540 . 1 1 129 129 GLU CG C 13 36.062 0.3 . 1 . . . A 643 GLU CG . 19977 1 1541 . 1 1 129 129 GLU N N 15 116.825 0.3 . 1 . . . A 643 GLU N . 19977 1 1542 . 1 1 130 130 GLU H H 1 7.373 0.020 . 1 . . . A 644 GLU H . 19977 1 1543 . 1 1 130 130 GLU HA H 1 4.042 0.020 . 1 . . . A 644 GLU HA . 19977 1 1544 . 1 1 130 130 GLU HB2 H 1 2.053 0.020 . 2 . . . A 644 GLU HB2 . 19977 1 1545 . 1 1 130 130 GLU HB3 H 1 1.909 0.020 . 2 . . . A 644 GLU HB3 . 19977 1 1546 . 1 1 130 130 GLU HG2 H 1 2.246 0.020 . 2 . . . A 644 GLU HG2 . 19977 1 1547 . 1 1 130 130 GLU HG3 H 1 2.014 0.020 . 2 . . . A 644 GLU HG3 . 19977 1 1548 . 1 1 130 130 GLU C C 13 175.267 0.3 . 1 . . . A 644 GLU C . 19977 1 1549 . 1 1 130 130 GLU CA C 13 56.607 0.3 . 1 . . . A 644 GLU CA . 19977 1 1550 . 1 1 130 130 GLU CB C 13 30.317 0.3 . 1 . . . A 644 GLU CB . 19977 1 1551 . 1 1 130 130 GLU CG C 13 36.321 0.3 . 1 . . . A 644 GLU CG . 19977 1 1552 . 1 1 130 130 GLU N N 15 115.630 0.3 . 1 . . . A 644 GLU N . 19977 1 1553 . 1 1 131 131 TYR H H 1 7.510 0.020 . 1 . . . A 645 TYR H . 19977 1 1554 . 1 1 131 131 TYR HA H 1 4.797 0.020 . 1 . . . A 645 TYR HA . 19977 1 1555 . 1 1 131 131 TYR HB2 H 1 2.928 0.020 . 2 . . . A 645 TYR HB2 . 19977 1 1556 . 1 1 131 131 TYR HB3 H 1 2.640 0.020 . 2 . . . A 645 TYR HB3 . 19977 1 1557 . 1 1 131 131 TYR HD1 H 1 7.342 0.020 . 1 . . . A 645 TYR HD1 . 19977 1 1558 . 1 1 131 131 TYR HD2 H 1 7.342 0.020 . 1 . . . A 645 TYR HD2 . 19977 1 1559 . 1 1 131 131 TYR HE1 H 1 6.669 0.020 . 1 . . . A 645 TYR HE1 . 19977 1 1560 . 1 1 131 131 TYR HE2 H 1 6.669 0.020 . 1 . . . A 645 TYR HE2 . 19977 1 1561 . 1 1 131 131 TYR CA C 13 56.126 0.3 . 1 . . . A 645 TYR CA . 19977 1 1562 . 1 1 131 131 TYR CB C 13 39.351 0.3 . 1 . . . A 645 TYR CB . 19977 1 1563 . 1 1 131 131 TYR N N 15 116.930 0.3 . 1 . . . A 645 TYR N . 19977 1 1564 . 1 1 132 132 PRO HA H 1 4.334 0.020 . 1 . . . A 646 PRO HA . 19977 1 1565 . 1 1 132 132 PRO HB2 H 1 2.309 0.020 . 1 . . . A 646 PRO HB2 . 19977 1 1566 . 1 1 132 132 PRO HB3 H 1 2.309 0.020 . 1 . . . A 646 PRO HB3 . 19977 1 1567 . 1 1 132 132 PRO HG2 H 1 1.930 0.020 . 2 . . . A 646 PRO HG2 . 19977 1 1568 . 1 1 132 132 PRO HG3 H 1 1.872 0.020 . 2 . . . A 646 PRO HG3 . 19977 1 1569 . 1 1 132 132 PRO HD2 H 1 3.563 0.020 . 2 . . . A 646 PRO HD2 . 19977 1 1570 . 1 1 132 132 PRO HD3 H 1 3.230 0.020 . 2 . . . A 646 PRO HD3 . 19977 1 1571 . 1 1 132 132 PRO C C 13 179.701 0.3 . 1 . . . A 646 PRO C . 19977 1 1572 . 1 1 132 132 PRO CA C 13 64.969 0.3 . 1 . . . A 646 PRO CA . 19977 1 1573 . 1 1 132 132 PRO CB C 13 31.698 0.3 . 1 . . . A 646 PRO CB . 19977 1 1574 . 1 1 132 132 PRO CG C 13 27.376 0.3 . 1 . . . A 646 PRO CG . 19977 1 1575 . 1 1 132 132 PRO CD C 13 50.298 0.3 . 1 . . . A 646 PRO CD . 19977 1 1576 . 1 1 133 133 MET H H 1 8.926 0.020 . 1 . . . A 647 MET H . 19977 1 1577 . 1 1 133 133 MET HA H 1 4.320 0.020 . 1 . . . A 647 MET HA . 19977 1 1578 . 1 1 133 133 MET HB2 H 1 2.139 0.020 . 2 . . . A 647 MET HB2 . 19977 1 1579 . 1 1 133 133 MET HB3 H 1 2.035 0.020 . 2 . . . A 647 MET HB3 . 19977 1 1580 . 1 1 133 133 MET HG2 H 1 2.703 0.020 . 2 . . . A 647 MET HG2 . 19977 1 1581 . 1 1 133 133 MET HG3 H 1 2.486 0.020 . 2 . . . A 647 MET HG3 . 19977 1 1582 . 1 1 133 133 MET HE1 H 1 2.062 0.020 . 1 . . . A 647 MET HE1 . 19977 1 1583 . 1 1 133 133 MET HE2 H 1 2.062 0.020 . 1 . . . A 647 MET HE2 . 19977 1 1584 . 1 1 133 133 MET HE3 H 1 2.062 0.020 . 1 . . . A 647 MET HE3 . 19977 1 1585 . 1 1 133 133 MET C C 13 179.718 0.3 . 1 . . . A 647 MET C . 19977 1 1586 . 1 1 133 133 MET CA C 13 57.895 0.3 . 1 . . . A 647 MET CA . 19977 1 1587 . 1 1 133 133 MET CB C 13 30.672 0.3 . 1 . . . A 647 MET CB . 19977 1 1588 . 1 1 133 133 MET CG C 13 32.525 0.3 . 1 . . . A 647 MET CG . 19977 1 1589 . 1 1 133 133 MET CE C 13 16.973 0.3 . 1 . . . A 647 MET CE . 19977 1 1590 . 1 1 133 133 MET N N 15 117.052 0.3 . 1 . . . A 647 MET N . 19977 1 1591 . 1 1 134 134 MET H H 1 7.760 0.020 . 1 . . . A 648 MET H . 19977 1 1592 . 1 1 134 134 MET HA H 1 4.295 0.020 . 1 . . . A 648 MET HA . 19977 1 1593 . 1 1 134 134 MET HB2 H 1 1.580 0.020 . 1 . . . A 648 MET HB2 . 19977 1 1594 . 1 1 134 134 MET HB3 H 1 1.580 0.020 . 1 . . . A 648 MET HB3 . 19977 1 1595 . 1 1 134 134 MET HG2 H 1 1.882 0.020 . 1 . . . A 648 MET HG2 . 19977 1 1596 . 1 1 134 134 MET HG3 H 1 1.882 0.020 . 1 . . . A 648 MET HG3 . 19977 1 1597 . 1 1 134 134 MET HE1 H 1 1.561 0.020 . 1 . . . A 648 MET HE1 . 19977 1 1598 . 1 1 134 134 MET HE2 H 1 1.561 0.020 . 1 . . . A 648 MET HE2 . 19977 1 1599 . 1 1 134 134 MET HE3 H 1 1.561 0.020 . 1 . . . A 648 MET HE3 . 19977 1 1600 . 1 1 134 134 MET C C 13 177.256 0.3 . 1 . . . A 648 MET C . 19977 1 1601 . 1 1 134 134 MET CA C 13 54.913 0.3 . 1 . . . A 648 MET CA . 19977 1 1602 . 1 1 134 134 MET CB C 13 30.562 0.3 . 1 . . . A 648 MET CB . 19977 1 1603 . 1 1 134 134 MET CG C 13 30.578 0.3 . 1 . . . A 648 MET CG . 19977 1 1604 . 1 1 134 134 MET CE C 13 16.072 0.3 . 1 . . . A 648 MET CE . 19977 1 1605 . 1 1 134 134 MET N N 15 118.613 0.3 . 1 . . . A 648 MET N . 19977 1 1606 . 1 1 135 135 ARG H H 1 7.677 0.020 . 1 . . . A 649 ARG H . 19977 1 1607 . 1 1 135 135 ARG HA H 1 3.763 0.020 . 1 . . . A 649 ARG HA . 19977 1 1608 . 1 1 135 135 ARG HB2 H 1 1.909 0.020 . 2 . . . A 649 ARG HB2 . 19977 1 1609 . 1 1 135 135 ARG HB3 H 1 1.772 0.020 . 2 . . . A 649 ARG HB3 . 19977 1 1610 . 1 1 135 135 ARG HG2 H 1 1.600 0.020 . 2 . . . A 649 ARG HG2 . 19977 1 1611 . 1 1 135 135 ARG HG3 H 1 1.531 0.020 . 2 . . . A 649 ARG HG3 . 19977 1 1612 . 1 1 135 135 ARG HD2 H 1 3.160 0.020 . 2 . . . A 649 ARG HD2 . 19977 1 1613 . 1 1 135 135 ARG HD3 H 1 3.097 0.020 . 2 . . . A 649 ARG HD3 . 19977 1 1614 . 1 1 135 135 ARG C C 13 178.188 0.3 . 1 . . . A 649 ARG C . 19977 1 1615 . 1 1 135 135 ARG CA C 13 60.261 0.3 . 1 . . . A 649 ARG CA . 19977 1 1616 . 1 1 135 135 ARG CB C 13 29.504 0.3 . 1 . . . A 649 ARG CB . 19977 1 1617 . 1 1 135 135 ARG CG C 13 27.382 0.3 . 1 . . . A 649 ARG CG . 19977 1 1618 . 1 1 135 135 ARG CD C 13 43.155 0.3 . 1 . . . A 649 ARG CD . 19977 1 1619 . 1 1 135 135 ARG N N 15 120.147 0.3 . 1 . . . A 649 ARG N . 19977 1 1620 . 1 1 136 136 ARG H H 1 7.682 0.020 . 1 . . . A 650 ARG H . 19977 1 1621 . 1 1 136 136 ARG HA H 1 4.069 0.020 . 1 . . . A 650 ARG HA . 19977 1 1622 . 1 1 136 136 ARG HB2 H 1 1.812 0.020 . 1 . . . A 650 ARG HB2 . 19977 1 1623 . 1 1 136 136 ARG HB3 H 1 1.812 0.020 . 1 . . . A 650 ARG HB3 . 19977 1 1624 . 1 1 136 136 ARG HG2 H 1 1.634 0.020 . 1 . . . A 650 ARG HG2 . 19977 1 1625 . 1 1 136 136 ARG HG3 H 1 1.634 0.020 . 1 . . . A 650 ARG HG3 . 19977 1 1626 . 1 1 136 136 ARG HD2 H 1 3.151 0.020 . 1 . . . A 650 ARG HD2 . 19977 1 1627 . 1 1 136 136 ARG HD3 H 1 3.151 0.020 . 1 . . . A 650 ARG HD3 . 19977 1 1628 . 1 1 136 136 ARG C C 13 178.427 0.3 . 1 . . . A 650 ARG C . 19977 1 1629 . 1 1 136 136 ARG CA C 13 58.537 0.3 . 1 . . . A 650 ARG CA . 19977 1 1630 . 1 1 136 136 ARG CB C 13 29.727 0.3 . 1 . . . A 650 ARG CB . 19977 1 1631 . 1 1 136 136 ARG CG C 13 26.690 0.3 . 1 . . . A 650 ARG CG . 19977 1 1632 . 1 1 136 136 ARG CD C 13 43.224 0.3 . 1 . . . A 650 ARG CD . 19977 1 1633 . 1 1 136 136 ARG N N 15 116.559 0.3 . 1 . . . A 650 ARG N . 19977 1 1634 . 1 1 137 137 ALA H H 1 7.366 0.020 . 1 . . . A 651 ALA H . 19977 1 1635 . 1 1 137 137 ALA HA H 1 4.032 0.020 . 1 . . . A 651 ALA HA . 19977 1 1636 . 1 1 137 137 ALA HB1 H 1 1.250 0.020 . 1 . . . A 651 ALA HB1 . 19977 1 1637 . 1 1 137 137 ALA HB2 H 1 1.250 0.020 . 1 . . . A 651 ALA HB2 . 19977 1 1638 . 1 1 137 137 ALA HB3 H 1 1.250 0.020 . 1 . . . A 651 ALA HB3 . 19977 1 1639 . 1 1 137 137 ALA C C 13 179.793 0.3 . 1 . . . A 651 ALA C . 19977 1 1640 . 1 1 137 137 ALA CA C 13 54.631 0.3 . 1 . . . A 651 ALA CA . 19977 1 1641 . 1 1 137 137 ALA CB C 13 17.674 0.3 . 1 . . . A 651 ALA CB . 19977 1 1642 . 1 1 137 137 ALA N N 15 121.688 0.3 . 1 . . . A 651 ALA N . 19977 1 1643 . 1 1 138 138 PHE H H 1 7.950 0.020 . 1 . . . A 652 PHE H . 19977 1 1644 . 1 1 138 138 PHE HA H 1 4.439 0.020 . 1 . . . A 652 PHE HA . 19977 1 1645 . 1 1 138 138 PHE HB2 H 1 3.292 0.020 . 2 . . . A 652 PHE HB2 . 19977 1 1646 . 1 1 138 138 PHE HB3 H 1 3.063 0.020 . 2 . . . A 652 PHE HB3 . 19977 1 1647 . 1 1 138 138 PHE HD1 H 1 7.151 0.020 . 1 . . . A 652 PHE HD1 . 19977 1 1648 . 1 1 138 138 PHE HD2 H 1 7.151 0.020 . 1 . . . A 652 PHE HD2 . 19977 1 1649 . 1 1 138 138 PHE HE1 H 1 7.111 0.020 . 1 . . . A 652 PHE HE1 . 19977 1 1650 . 1 1 138 138 PHE HE2 H 1 7.111 0.020 . 1 . . . A 652 PHE HE2 . 19977 1 1651 . 1 1 138 138 PHE HZ H 1 6.880 0.020 . 1 . . . A 652 PHE HZ . 19977 1 1652 . 1 1 138 138 PHE C C 13 176.871 0.3 . 1 . . . A 652 PHE C . 19977 1 1653 . 1 1 138 138 PHE CA C 13 58.783 0.3 . 1 . . . A 652 PHE CA . 19977 1 1654 . 1 1 138 138 PHE CB C 13 38.377 0.3 . 1 . . . A 652 PHE CB . 19977 1 1655 . 1 1 138 138 PHE N N 15 116.636 0.3 . 1 . . . A 652 PHE N . 19977 1 1656 . 1 1 139 139 GLU H H 1 8.002 0.020 . 1 . . . A 653 GLU H . 19977 1 1657 . 1 1 139 139 GLU HA H 1 4.090 0.020 . 1 . . . A 653 GLU HA . 19977 1 1658 . 1 1 139 139 GLU HB2 H 1 2.142 0.020 . 2 . . . A 653 GLU HB2 . 19977 1 1659 . 1 1 139 139 GLU HB3 H 1 2.049 0.020 . 2 . . . A 653 GLU HB3 . 19977 1 1660 . 1 1 139 139 GLU HG2 H 1 2.496 0.020 . 2 . . . A 653 GLU HG2 . 19977 1 1661 . 1 1 139 139 GLU HG3 H 1 2.251 0.020 . 2 . . . A 653 GLU HG3 . 19977 1 1662 . 1 1 139 139 GLU C C 13 177.831 0.3 . 1 . . . A 653 GLU C . 19977 1 1663 . 1 1 139 139 GLU CA C 13 58.484 0.3 . 1 . . . A 653 GLU CA . 19977 1 1664 . 1 1 139 139 GLU CB C 13 29.888 0.3 . 1 . . . A 653 GLU CB . 19977 1 1665 . 1 1 139 139 GLU CG C 13 36.575 0.3 . 1 . . . A 653 GLU CG . 19977 1 1666 . 1 1 139 139 GLU N N 15 118.990 0.3 . 1 . . . A 653 GLU N . 19977 1 1667 . 1 1 140 140 THR H H 1 7.676 0.020 . 1 . . . A 654 THR H . 19977 1 1668 . 1 1 140 140 THR HA H 1 4.190 0.020 . 1 . . . A 654 THR HA . 19977 1 1669 . 1 1 140 140 THR HB H 1 4.279 0.020 . 1 . . . A 654 THR HB . 19977 1 1670 . 1 1 140 140 THR HG21 H 1 1.177 0.020 . 1 . . . A 654 THR HG21 . 19977 1 1671 . 1 1 140 140 THR HG22 H 1 1.177 0.020 . 1 . . . A 654 THR HG22 . 19977 1 1672 . 1 1 140 140 THR HG23 H 1 1.177 0.020 . 1 . . . A 654 THR HG23 . 19977 1 1673 . 1 1 140 140 THR C C 13 175.074 0.3 . 1 . . . A 654 THR C . 19977 1 1674 . 1 1 140 140 THR CA C 13 63.239 0.3 . 1 . . . A 654 THR CA . 19977 1 1675 . 1 1 140 140 THR CB C 13 69.318 0.3 . 1 . . . A 654 THR CB . 19977 1 1676 . 1 1 140 140 THR CG2 C 13 21.459 0.3 . 1 . . . A 654 THR CG2 . 19977 1 1677 . 1 1 140 140 THR N N 15 111.018 0.3 . 1 . . . A 654 THR N . 19977 1 1678 . 1 1 141 141 VAL H H 1 7.477 0.020 . 1 . . . A 655 VAL H . 19977 1 1679 . 1 1 141 141 VAL HA H 1 3.904 0.020 . 1 . . . A 655 VAL HA . 19977 1 1680 . 1 1 141 141 VAL HB H 1 2.057 0.020 . 1 . . . A 655 VAL HB . 19977 1 1681 . 1 1 141 141 VAL HG11 H 1 0.927 0.020 . 1 . . . A 655 VAL HG11 . 19977 1 1682 . 1 1 141 141 VAL HG12 H 1 0.927 0.020 . 1 . . . A 655 VAL HG12 . 19977 1 1683 . 1 1 141 141 VAL HG13 H 1 0.927 0.020 . 1 . . . A 655 VAL HG13 . 19977 1 1684 . 1 1 141 141 VAL HG21 H 1 0.825 0.020 . 1 . . . A 655 VAL HG21 . 19977 1 1685 . 1 1 141 141 VAL HG22 H 1 0.825 0.020 . 1 . . . A 655 VAL HG22 . 19977 1 1686 . 1 1 141 141 VAL HG23 H 1 0.825 0.020 . 1 . . . A 655 VAL HG23 . 19977 1 1687 . 1 1 141 141 VAL C C 13 176.006 0.3 . 1 . . . A 655 VAL C . 19977 1 1688 . 1 1 141 141 VAL CA C 13 63.397 0.3 . 1 . . . A 655 VAL CA . 19977 1 1689 . 1 1 141 141 VAL CB C 13 32.064 0.3 . 1 . . . A 655 VAL CB . 19977 1 1690 . 1 1 141 141 VAL CG1 C 13 21.432 0.3 . 1 . . . A 655 VAL CG1 . 19977 1 1691 . 1 1 141 141 VAL CG2 C 13 20.977 0.3 . 1 . . . A 655 VAL CG2 . 19977 1 1692 . 1 1 141 141 VAL N N 15 121.307 0.3 . 1 . . . A 655 VAL N . 19977 1 1693 . 1 1 142 142 ALA H H 1 8.129 0.020 . 1 . . . A 656 ALA H . 19977 1 1694 . 1 1 142 142 ALA HA H 1 4.187 0.020 . 1 . . . A 656 ALA HA . 19977 1 1695 . 1 1 142 142 ALA HB1 H 1 1.309 0.020 . 1 . . . A 656 ALA HB1 . 19977 1 1696 . 1 1 142 142 ALA HB2 H 1 1.309 0.020 . 1 . . . A 656 ALA HB2 . 19977 1 1697 . 1 1 142 142 ALA HB3 H 1 1.309 0.020 . 1 . . . A 656 ALA HB3 . 19977 1 1698 . 1 1 142 142 ALA CA C 13 52.881 0.3 . 1 . . . A 656 ALA CA . 19977 1 1699 . 1 1 142 142 ALA CB C 13 18.858 0.3 . 1 . . . A 656 ALA CB . 19977 1 1700 . 1 1 142 142 ALA N N 15 125.867 0.3 . 1 . . . A 656 ALA N . 19977 1 1701 . 1 1 143 143 ILE H H 1 7.951 0.020 . 1 . . . A 657 ILE H . 19977 1 1702 . 1 1 143 143 ILE HA H 1 4.023 0.020 . 1 . . . A 657 ILE HA . 19977 1 1703 . 1 1 143 143 ILE HB H 1 1.816 0.020 . 1 . . . A 657 ILE HB . 19977 1 1704 . 1 1 143 143 ILE HG12 H 1 1.142 0.020 . 1 . . . A 657 ILE HG12 . 19977 1 1705 . 1 1 143 143 ILE HG13 H 1 1.142 0.020 . 1 . . . A 657 ILE HG13 . 19977 1 1706 . 1 1 143 143 ILE HG21 H 1 0.844 0.020 . 1 . . . A 657 ILE HG21 . 19977 1 1707 . 1 1 143 143 ILE HG22 H 1 0.844 0.020 . 1 . . . A 657 ILE HG22 . 19977 1 1708 . 1 1 143 143 ILE HG23 H 1 0.844 0.020 . 1 . . . A 657 ILE HG23 . 19977 1 1709 . 1 1 143 143 ILE HD11 H 1 0.776 0.020 . 1 . . . A 657 ILE HD11 . 19977 1 1710 . 1 1 143 143 ILE HD12 H 1 0.776 0.020 . 1 . . . A 657 ILE HD12 . 19977 1 1711 . 1 1 143 143 ILE HD13 H 1 0.776 0.020 . 1 . . . A 657 ILE HD13 . 19977 1 1712 . 1 1 143 143 ILE C C 13 172.703 0.3 . 1 . . . A 657 ILE C . 19977 1 1713 . 1 1 143 143 ILE CA C 13 61.566 0.3 . 1 . . . A 657 ILE CA . 19977 1 1714 . 1 1 143 143 ILE CB C 13 38.203 0.3 . 1 . . . A 657 ILE CB . 19977 1 1715 . 1 1 143 143 ILE CG1 C 13 27.377 0.3 . 1 . . . A 657 ILE CG1 . 19977 1 1716 . 1 1 143 143 ILE CG2 C 13 17.381 0.3 . 1 . . . A 657 ILE CG2 . 19977 1 1717 . 1 1 143 143 ILE CD1 C 13 12.771 0.3 . 1 . . . A 657 ILE CD1 . 19977 1 1718 . 1 1 143 143 ILE N N 15 119.617 0.3 . 1 . . . A 657 ILE N . 19977 1 1719 . 1 1 144 144 ASP HA H 1 4.474 0.020 . 1 . . . A 658 ASP HA . 19977 1 1720 . 1 1 144 144 ASP HB2 H 1 2.626 0.020 . 1 . . . A 658 ASP HB2 . 19977 1 1721 . 1 1 144 144 ASP HB3 H 1 2.626 0.020 . 1 . . . A 658 ASP HB3 . 19977 1 1722 . 1 1 144 144 ASP C C 13 177.121 0.3 . 1 . . . A 658 ASP C . 19977 1 1723 . 1 1 144 144 ASP CA C 13 55.130 0.3 . 1 . . . A 658 ASP CA . 19977 1 1724 . 1 1 144 144 ASP CB C 13 40.889 0.3 . 1 . . . A 658 ASP CB . 19977 1 1725 . 1 1 145 145 ARG H H 1 7.992 0.020 . 1 . . . A 659 ARG H . 19977 1 1726 . 1 1 145 145 ARG HA H 1 4.177 0.020 . 1 . . . A 659 ARG HA . 19977 1 1727 . 1 1 145 145 ARG HB2 H 1 1.838 0.020 . 2 . . . A 659 ARG HB2 . 19977 1 1728 . 1 1 145 145 ARG HB3 H 1 1.700 0.020 . 2 . . . A 659 ARG HB3 . 19977 1 1729 . 1 1 145 145 ARG HG2 H 1 1.600 0.020 . 2 . . . A 659 ARG HG2 . 19977 1 1730 . 1 1 145 145 ARG HG3 H 1 1.546 0.020 . 2 . . . A 659 ARG HG3 . 19977 1 1731 . 1 1 145 145 ARG HD2 H 1 3.113 0.020 . 1 . . . A 659 ARG HD2 . 19977 1 1732 . 1 1 145 145 ARG HD3 H 1 3.113 0.020 . 1 . . . A 659 ARG HD3 . 19977 1 1733 . 1 1 145 145 ARG C C 13 174.226 0.3 . 1 . . . A 659 ARG C . 19977 1 1734 . 1 1 145 145 ARG CA C 13 56.585 0.3 . 1 . . . A 659 ARG CA . 19977 1 1735 . 1 1 145 145 ARG CB C 13 30.236 0.3 . 1 . . . A 659 ARG CB . 19977 1 1736 . 1 1 145 145 ARG CG C 13 26.989 0.3 . 1 . . . A 659 ARG CG . 19977 1 1737 . 1 1 145 145 ARG CD C 13 43.143 0.3 . 1 . . . A 659 ARG CD . 19977 1 1738 . 1 1 145 145 ARG N N 15 119.156 0.3 . 1 . . . A 659 ARG N . 19977 1 1739 . 1 1 146 146 LEU H H 1 8.011 0.020 . 1 . . . A 660 LEU H . 19977 1 1740 . 1 1 146 146 LEU HA H 1 4.141 0.020 . 1 . . . A 660 LEU HA . 19977 1 1741 . 1 1 146 146 LEU HB2 H 1 1.684 0.020 . 1 . . . A 660 LEU HB2 . 19977 1 1742 . 1 1 146 146 LEU HB3 H 1 1.684 0.020 . 1 . . . A 660 LEU HB3 . 19977 1 1743 . 1 1 146 146 LEU HG H 1 1.612 0.020 . 1 . . . A 660 LEU HG . 19977 1 1744 . 1 1 146 146 LEU HD11 H 1 0.831 0.020 . 1 . . . A 660 LEU HD11 . 19977 1 1745 . 1 1 146 146 LEU HD12 H 1 0.831 0.020 . 1 . . . A 660 LEU HD12 . 19977 1 1746 . 1 1 146 146 LEU HD13 H 1 0.831 0.020 . 1 . . . A 660 LEU HD13 . 19977 1 1747 . 1 1 146 146 LEU HD21 H 1 0.774 0.020 . 1 . . . A 660 LEU HD21 . 19977 1 1748 . 1 1 146 146 LEU HD22 H 1 0.774 0.020 . 1 . . . A 660 LEU HD22 . 19977 1 1749 . 1 1 146 146 LEU HD23 H 1 0.774 0.020 . 1 . . . A 660 LEU HD23 . 19977 1 1750 . 1 1 146 146 LEU C C 13 177.573 0.3 . 1 . . . A 660 LEU C . 19977 1 1751 . 1 1 146 146 LEU CA C 13 56.273 0.3 . 1 . . . A 660 LEU CA . 19977 1 1752 . 1 1 146 146 LEU CB C 13 41.940 0.3 . 1 . . . A 660 LEU CB . 19977 1 1753 . 1 1 146 146 LEU CG C 13 26.914 0.3 . 1 . . . A 660 LEU CG . 19977 1 1754 . 1 1 146 146 LEU CD1 C 13 24.767 0.3 . 1 . . . A 660 LEU CD1 . 19977 1 1755 . 1 1 146 146 LEU CD2 C 13 23.276 0.3 . 1 . . . A 660 LEU CD2 . 19977 1 1756 . 1 1 146 146 LEU N N 15 120.572 0.3 . 1 . . . A 660 LEU N . 19977 1 1757 . 1 1 147 147 ASP H H 1 8.132 0.020 . 1 . . . A 661 ASP H . 19977 1 1758 . 1 1 147 147 ASP HA H 1 4.439 0.020 . 1 . . . A 661 ASP HA . 19977 1 1759 . 1 1 147 147 ASP HB2 H 1 2.639 0.020 . 1 . . . A 661 ASP HB2 . 19977 1 1760 . 1 1 147 147 ASP HB3 H 1 2.639 0.020 . 1 . . . A 661 ASP HB3 . 19977 1 1761 . 1 1 147 147 ASP C C 13 176.570 0.3 . 1 . . . A 661 ASP C . 19977 1 1762 . 1 1 147 147 ASP CA C 13 54.823 0.3 . 1 . . . A 661 ASP CA . 19977 1 1763 . 1 1 147 147 ASP CB C 13 40.779 0.3 . 1 . . . A 661 ASP CB . 19977 1 1764 . 1 1 147 147 ASP N N 15 119.293 0.3 . 1 . . . A 661 ASP N . 19977 1 1765 . 1 1 148 148 ARG H H 1 7.951 0.020 . 1 . . . A 662 ARG H . 19977 1 1766 . 1 1 148 148 ARG HA H 1 4.200 0.020 . 1 . . . A 662 ARG HA . 19977 1 1767 . 1 1 148 148 ARG HB2 H 1 1.753 0.020 . 2 . . . A 662 ARG HB2 . 19977 1 1768 . 1 1 148 148 ARG HB3 H 1 1.710 0.020 . 2 . . . A 662 ARG HB3 . 19977 1 1769 . 1 1 148 148 ARG HG2 H 1 1.545 0.020 . 1 . . . A 662 ARG HG2 . 19977 1 1770 . 1 1 148 148 ARG HG3 H 1 1.545 0.020 . 1 . . . A 662 ARG HG3 . 19977 1 1771 . 1 1 148 148 ARG HD2 H 1 3.113 0.020 . 1 . . . A 662 ARG HD2 . 19977 1 1772 . 1 1 148 148 ARG HD3 H 1 3.113 0.020 . 1 . . . A 662 ARG HD3 . 19977 1 1773 . 1 1 148 148 ARG C C 13 176.942 0.3 . 1 . . . A 662 ARG C . 19977 1 1774 . 1 1 148 148 ARG CA C 13 56.609 0.3 . 1 . . . A 662 ARG CA . 19977 1 1775 . 1 1 148 148 ARG CB C 13 30.592 0.3 . 1 . . . A 662 ARG CB . 19977 1 1776 . 1 1 148 148 ARG CG C 13 27.013 0.3 . 1 . . . A 662 ARG CG . 19977 1 1777 . 1 1 148 148 ARG CD C 13 43.153 0.3 . 1 . . . A 662 ARG CD . 19977 1 1778 . 1 1 148 148 ARG N N 15 119.494 0.3 . 1 . . . A 662 ARG N . 19977 1 1779 . 1 1 149 149 ILE H H 1 7.923 0.020 . 1 . . . A 663 ILE H . 19977 1 1780 . 1 1 149 149 ILE HA H 1 3.890 0.020 . 1 . . . A 663 ILE HA . 19977 1 1781 . 1 1 149 149 ILE HB H 1 1.854 0.020 . 1 . . . A 663 ILE HB . 19977 1 1782 . 1 1 149 149 ILE HG12 H 1 1.468 0.020 . 2 . . . A 663 ILE HG12 . 19977 1 1783 . 1 1 149 149 ILE HG13 H 1 1.149 0.020 . 2 . . . A 663 ILE HG13 . 19977 1 1784 . 1 1 149 149 ILE HG21 H 1 0.841 0.020 . 1 . . . A 663 ILE HG21 . 19977 1 1785 . 1 1 149 149 ILE HG22 H 1 0.841 0.020 . 1 . . . A 663 ILE HG22 . 19977 1 1786 . 1 1 149 149 ILE HG23 H 1 0.841 0.020 . 1 . . . A 663 ILE HG23 . 19977 1 1787 . 1 1 149 149 ILE HD11 H 1 0.778 0.020 . 1 . . . A 663 ILE HD11 . 19977 1 1788 . 1 1 149 149 ILE HD12 H 1 0.778 0.020 . 1 . . . A 663 ILE HD12 . 19977 1 1789 . 1 1 149 149 ILE HD13 H 1 0.778 0.020 . 1 . . . A 663 ILE HD13 . 19977 1 1790 . 1 1 149 149 ILE C C 13 176.969 0.3 . 1 . . . A 663 ILE C . 19977 1 1791 . 1 1 149 149 ILE CA C 13 62.364 0.3 . 1 . . . A 663 ILE CA . 19977 1 1792 . 1 1 149 149 ILE CB C 13 38.204 0.3 . 1 . . . A 663 ILE CB . 19977 1 1793 . 1 1 149 149 ILE CG1 C 13 27.700 0.3 . 1 . . . A 663 ILE CG1 . 19977 1 1794 . 1 1 149 149 ILE CG2 C 13 17.275 0.3 . 1 . . . A 663 ILE CG2 . 19977 1 1795 . 1 1 149 149 ILE CD1 C 13 12.974 0.3 . 1 . . . A 663 ILE CD1 . 19977 1 1796 . 1 1 149 149 ILE N N 15 119.880 0.3 . 1 . . . A 663 ILE N . 19977 1 1797 . 1 1 150 150 GLY H H 1 8.321 0.020 . 1 . . . A 664 GLY H . 19977 1 1798 . 1 1 150 150 GLY HA2 H 1 3.880 0.020 . 2 . . . A 664 GLY HA2 . 19977 1 1799 . 1 1 150 150 GLY HA3 H 1 4.018 0.020 . 2 . . . A 664 GLY HA3 . 19977 1 1800 . 1 1 150 150 GLY C C 13 177.070 0.3 . 1 . . . A 664 GLY C . 19977 1 1801 . 1 1 150 150 GLY CA C 13 45.382 0.3 . 1 . . . A 664 GLY CA . 19977 1 1802 . 1 1 150 150 GLY N N 15 111.580 0.3 . 1 . . . A 664 GLY N . 19977 1 1803 . 1 1 151 151 LYS H H 1 8.018 0.020 . 1 . . . A 665 LYS H . 19977 1 1804 . 1 1 151 151 LYS HA H 1 4.213 0.020 . 1 . . . A 665 LYS HA . 19977 1 1805 . 1 1 151 151 LYS HB2 H 1 1.773 0.020 . 2 . . . A 665 LYS HB2 . 19977 1 1806 . 1 1 151 151 LYS HB3 H 1 1.690 0.020 . 2 . . . A 665 LYS HB3 . 19977 1 1807 . 1 1 151 151 LYS HG2 H 1 1.355 0.020 . 1 . . . A 665 LYS HG2 . 19977 1 1808 . 1 1 151 151 LYS HG3 H 1 1.355 0.020 . 1 . . . A 665 LYS HG3 . 19977 1 1809 . 1 1 151 151 LYS HD2 H 1 1.605 0.020 . 1 . . . A 665 LYS HD2 . 19977 1 1810 . 1 1 151 151 LYS HD3 H 1 1.605 0.020 . 1 . . . A 665 LYS HD3 . 19977 1 1811 . 1 1 151 151 LYS HE2 H 1 2.923 0.020 . 1 . . . A 665 LYS HE2 . 19977 1 1812 . 1 1 151 151 LYS HE3 H 1 2.923 0.020 . 1 . . . A 665 LYS HE3 . 19977 1 1813 . 1 1 151 151 LYS CA C 13 56.225 0.3 . 1 . . . A 665 LYS CA . 19977 1 1814 . 1 1 151 151 LYS CB C 13 32.872 0.3 . 1 . . . A 665 LYS CB . 19977 1 1815 . 1 1 151 151 LYS CG C 13 24.533 0.3 . 1 . . . A 665 LYS CG . 19977 1 1816 . 1 1 151 151 LYS CD C 13 28.924 0.3 . 1 . . . A 665 LYS CD . 19977 1 1817 . 1 1 151 151 LYS CE C 13 42.096 0.3 . 1 . . . A 665 LYS CE . 19977 1 1818 . 1 1 151 151 LYS N N 15 120.619 0.3 . 1 . . . A 665 LYS N . 19977 1 1819 . 1 1 154 154 SER HA H 1 4.379 0.020 . 1 . . . A 668 SER HA . 19977 1 1820 . 1 1 154 154 SER HB2 H 1 3.780 0.020 . 1 . . . A 668 SER HB2 . 19977 1 1821 . 1 1 154 154 SER HB3 H 1 3.780 0.020 . 1 . . . A 668 SER HB3 . 19977 1 1822 . 1 1 154 154 SER C C 13 174.381 0.3 . 1 . . . A 668 SER C . 19977 1 1823 . 1 1 154 154 SER CA C 13 58.484 0.3 . 1 . . . A 668 SER CA . 19977 1 1824 . 1 1 154 154 SER CB C 13 63.729 0.3 . 1 . . . A 668 SER CB . 19977 1 1825 . 1 1 155 155 ILE H H 1 8.006 0.020 . 1 . . . A 669 ILE H . 19977 1 1826 . 1 1 155 155 ILE HA H 1 4.036 0.020 . 1 . . . A 669 ILE HA . 19977 1 1827 . 1 1 155 155 ILE HB H 1 1.786 0.020 . 1 . . . A 669 ILE HB . 19977 1 1828 . 1 1 155 155 ILE HG12 H 1 1.374 0.020 . 2 . . . A 669 ILE HG12 . 19977 1 1829 . 1 1 155 155 ILE HG13 H 1 1.095 0.020 . 2 . . . A 669 ILE HG13 . 19977 1 1830 . 1 1 155 155 ILE HG21 H 1 0.791 0.020 . 1 . . . A 669 ILE HG21 . 19977 1 1831 . 1 1 155 155 ILE HG22 H 1 0.791 0.020 . 1 . . . A 669 ILE HG22 . 19977 1 1832 . 1 1 155 155 ILE HG23 H 1 0.791 0.020 . 1 . . . A 669 ILE HG23 . 19977 1 1833 . 1 1 155 155 ILE HD11 H 1 0.775 0.020 . 1 . . . A 669 ILE HD11 . 19977 1 1834 . 1 1 155 155 ILE HD12 H 1 0.775 0.020 . 1 . . . A 669 ILE HD12 . 19977 1 1835 . 1 1 155 155 ILE HD13 H 1 0.775 0.020 . 1 . . . A 669 ILE HD13 . 19977 1 1836 . 1 1 155 155 ILE C C 13 175.697 0.3 . 1 . . . A 669 ILE C . 19977 1 1837 . 1 1 155 155 ILE CA C 13 61.267 0.3 . 1 . . . A 669 ILE CA . 19977 1 1838 . 1 1 155 155 ILE CB C 13 38.546 0.3 . 1 . . . A 669 ILE CB . 19977 1 1839 . 1 1 155 155 ILE CG1 C 13 27.362 0.3 . 1 . . . A 669 ILE CG1 . 19977 1 1840 . 1 1 155 155 ILE CG2 C 13 17.335 0.3 . 1 . . . A 669 ILE CG2 . 19977 1 1841 . 1 1 155 155 ILE CD1 C 13 12.899 0.3 . 1 . . . A 669 ILE CD1 . 19977 1 1842 . 1 1 155 155 ILE N N 15 121.819 0.3 . 1 . . . A 669 ILE N . 19977 1 1843 . 1 1 156 156 LEU H H 1 8.080 0.020 . 1 . . . A 670 LEU H . 19977 1 1844 . 1 1 156 156 LEU HA H 1 4.279 0.020 . 1 . . . A 670 LEU HA . 19977 1 1845 . 1 1 156 156 LEU HB2 H 1 1.508 0.020 . 1 . . . A 670 LEU HB2 . 19977 1 1846 . 1 1 156 156 LEU HB3 H 1 1.508 0.020 . 1 . . . A 670 LEU HB3 . 19977 1 1847 . 1 1 156 156 LEU HG H 1 1.494 0.020 . 1 . . . A 670 LEU HG . 19977 1 1848 . 1 1 156 156 LEU HD11 H 1 0.832 0.020 . 1 . . . A 670 LEU HD11 . 19977 1 1849 . 1 1 156 156 LEU HD12 H 1 0.832 0.020 . 1 . . . A 670 LEU HD12 . 19977 1 1850 . 1 1 156 156 LEU HD13 H 1 0.832 0.020 . 1 . . . A 670 LEU HD13 . 19977 1 1851 . 1 1 156 156 LEU HD21 H 1 0.772 0.020 . 1 . . . A 670 LEU HD21 . 19977 1 1852 . 1 1 156 156 LEU HD22 H 1 0.772 0.020 . 1 . . . A 670 LEU HD22 . 19977 1 1853 . 1 1 156 156 LEU HD23 H 1 0.772 0.020 . 1 . . . A 670 LEU HD23 . 19977 1 1854 . 1 1 156 156 LEU C C 13 176.637 0.3 . 1 . . . A 670 LEU C . 19977 1 1855 . 1 1 156 156 LEU CA C 13 54.796 0.3 . 1 . . . A 670 LEU CA . 19977 1 1856 . 1 1 156 156 LEU CB C 13 42.171 0.3 . 1 . . . A 670 LEU CB . 19977 1 1857 . 1 1 156 156 LEU CG C 13 26.741 0.3 . 1 . . . A 670 LEU CG . 19977 1 1858 . 1 1 156 156 LEU CD1 C 13 24.699 0.3 . 1 . . . A 670 LEU CD1 . 19977 1 1859 . 1 1 156 156 LEU CD2 C 13 23.369 0.3 . 1 . . . A 670 LEU CD2 . 19977 1 1860 . 1 1 156 156 LEU N N 15 125.009 0.3 . 1 . . . A 670 LEU N . 19977 1 1861 . 1 1 157 157 LEU H H 1 8.056 0.020 . 1 . . . A 671 LEU H . 19977 1 1862 . 1 1 157 157 LEU HA H 1 4.240 0.020 . 1 . . . A 671 LEU HA . 19977 1 1863 . 1 1 157 157 LEU HB2 H 1 1.506 0.020 . 1 . . . A 671 LEU HB2 . 19977 1 1864 . 1 1 157 157 LEU HB3 H 1 1.506 0.020 . 1 . . . A 671 LEU HB3 . 19977 1 1865 . 1 1 157 157 LEU HG H 1 1.522 0.020 . 1 . . . A 671 LEU HG . 19977 1 1866 . 1 1 157 157 LEU HD11 H 1 0.833 0.020 . 1 . . . A 671 LEU HD11 . 19977 1 1867 . 1 1 157 157 LEU HD12 H 1 0.833 0.020 . 1 . . . A 671 LEU HD12 . 19977 1 1868 . 1 1 157 157 LEU HD13 H 1 0.833 0.020 . 1 . . . A 671 LEU HD13 . 19977 1 1869 . 1 1 157 157 LEU HD21 H 1 0.775 0.020 . 1 . . . A 671 LEU HD21 . 19977 1 1870 . 1 1 157 157 LEU HD22 H 1 0.775 0.020 . 1 . . . A 671 LEU HD22 . 19977 1 1871 . 1 1 157 157 LEU HD23 H 1 0.775 0.020 . 1 . . . A 671 LEU HD23 . 19977 1 1872 . 1 1 157 157 LEU C C 13 175.956 0.3 . 1 . . . A 671 LEU C . 19977 1 1873 . 1 1 157 157 LEU CA C 13 54.915 0.3 . 1 . . . A 671 LEU CA . 19977 1 1874 . 1 1 157 157 LEU CB C 13 42.323 0.3 . 1 . . . A 671 LEU CB . 19977 1 1875 . 1 1 157 157 LEU CG C 13 26.783 0.3 . 1 . . . A 671 LEU CG . 19977 1 1876 . 1 1 157 157 LEU CD1 C 13 24.794 0.3 . 1 . . . A 671 LEU CD1 . 19977 1 1877 . 1 1 157 157 LEU CD2 C 13 23.360 0.3 . 1 . . . A 671 LEU CD2 . 19977 1 1878 . 1 1 157 157 LEU N N 15 123.187 0.3 . 1 . . . A 671 LEU N . 19977 1 1879 . 1 1 158 158 HIS H H 1 7.710 0.020 . 1 . . . A 672 HIS H . 19977 1 1880 . 1 1 158 158 HIS HA H 1 4.335 0.020 . 1 . . . A 672 HIS HA . 19977 1 1881 . 1 1 158 158 HIS HB2 H 1 3.121 0.020 . 2 . . . A 672 HIS HB2 . 19977 1 1882 . 1 1 158 158 HIS HB3 H 1 2.969 0.020 . 2 . . . A 672 HIS HB3 . 19977 1 1883 . 1 1 158 158 HIS HD2 H 1 7.021 0.020 . 1 . . . A 672 HIS HD2 . 19977 1 1884 . 1 1 158 158 HIS CA C 13 57.059 0.3 . 1 . . . A 672 HIS CA . 19977 1 1885 . 1 1 158 158 HIS CB C 13 30.671 0.3 . 1 . . . A 672 HIS CB . 19977 1 1886 . 1 1 158 158 HIS N N 15 123.950 0.3 . 1 . . . A 672 HIS N . 19977 1 stop_ save_