data_19117 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19117 _Entry.Title ; NMR solution structure ensemble of 3-4D mutant domain 11 IGF2R in complex with IGF2 (domain 11 structure only) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-03-27 _Entry.Accession_date 2013-03-27 _Entry.Last_release_date 2014-10-13 _Entry.Original_release_date 2014-10-13 _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 ; Ensemble of 20 structures of the 3-4D mutant of domain 11 IGF2R in complex with IGF2. The structure concerns the domain 11 portion only. The mutant hosts 5 mutations in the AB loop in comparison to human domain 11 IGF2R. ; _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 Madeleine Strickland . . . 19117 2 Chris Williams . . . 19117 3 Emily Richards . . . 19117 4 Leanne Minnall . . . 19117 5 Matthew Crump . P. . 19117 6 Susana Frago . . . 19117 7 Jennifer Hughes . . . 19117 8 Lee Garner . . . 19117 9 Hans-Jurgen Hoppe . . . 19117 10 Dellel Rezgui . . . 19117 11 Oliver Zaccheo . J. . 19117 12 Stuart Prince . N. . 19117 13 Andrew Hassan . B. . 19117 14 Sara Whittaker . . . 19117 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' . 19117 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 3-4D . 19117 Complex . 19117 'Domain 11' . 19117 IGF2 . 19117 IGF2R . 19117 Mutant . 19117 NMR . 19117 Solution . 19117 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19117 heteronucl_NOEs 2 19117 heteronucl_T1_relaxation 2 19117 heteronucl_T2_relaxation 2 19117 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 558 19117 '15N chemical shifts' 150 19117 '1H chemical shifts' 932 19117 'heteronuclear NOE values' 238 19117 'T1 relaxation values' 238 19117 'T2 relaxation values' 237 19117 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 . . 2014-10-13 2013-03-27 original author . 19117 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2CNJ . 19117 PDB 2L29 . 19117 PDB 2L2A . 19117 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19117 _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 'Directed evolution of structurally selected IGF2R domain 11 binding loop residues generates an IGF2 super-antagonist' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'EMBO J.' _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 Susana Frago . . . 19117 1 2 Madeleine Strickland . . . 19117 1 3 Jennifer Hughes . . . 19117 1 4 Christopher Williams . . . 19117 1 5 Lee Garner . . . 19117 1 6 Hans-Jurgen Hoppe . . . 19117 1 7 Dellel Rezgui . . . 19117 1 8 Oliver Zaccheo . J. . 19117 1 9 Stuart Prince . N. . 19117 1 10 Matthew Crump . P. . 19117 1 11 Andrew Hassan . B. . 19117 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19117 _Assembly.ID 1 _Assembly.Name 'Domain 11:IGF2 complex' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _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 '1:1 complex of domain 11 IGF2R with IGF2.' _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 Domain_11 1 $Domain_11 A . yes native no no . . . 19117 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 Domain_11 1 CYS 9 9 SG . 1 Domain_11 1 CYS 46 46 SG . Domain_11 1516 CYS SG . Domain_11 1553 CYS SG 19117 1 2 disulfide single . 1 Domain_11 1 CYS 52 52 SG . 1 Domain_11 1 CYS 59 59 SG . Domain_11 1559 CYS SG . Domain_11 1566 CYS SG 19117 1 3 disulfide single . 1 Domain_11 1 CYS 91 91 SG . 1 Domain_11 1 CYS 127 127 SG . Domain_11 1598 CYS SG . Domain_11 1634 CYS SG 19117 1 4 disulfide single . 1 Domain_11 1 CYS 107 107 SG . 1 Domain_11 1 CYS 139 139 SG . Domain_11 1614 CYS SG . Domain_11 1646 CYS SG 19117 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Domain_11 _Entity.Sf_category entity _Entity.Sf_framecode Domain_11 _Entity.Entry_ID 19117 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Domain_11 _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 ; MKSNEHDDCQVTNPSTGHLF DLSSLSGRAGFTAAYAKGWG VYMSICGENENCPPGVGACF GQTRISVGKANKRLRYVDQV LQLVYKDGSPCPSKSGLSYK SVISFVCRPEAGPTNRPMLI SLDKQTCTLFFSWHTPLACE LA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 142 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'Domain 11' _Entity.Mutation 'S1543A, E1544K, K1545G, G1546W, L1547G (affinity mutations), R1619G natural polymorphism, Q1648L restriction site' _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15433.671 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes EMBL P11717 . IGF2R . . . . . . . . . . . . . . 19117 1 2 yes EMBL P01344 . "IGF2 Human" . . . . . . . . . . . . . . 19117 1 3 no BMRB 17127 . HD11 . . . . . 98.59 142 97.14 97.86 2.40e-95 . . . . 19117 1 4 no BMRB 17128 . domain_11 . . . . . 98.59 142 97.14 97.86 2.40e-95 . . . . 19117 1 5 no BMRB 19153 . IGF2R . . . . . 100.00 142 100.00 100.00 6.18e-101 . . . . 19117 1 6 no PDB 2L29 . "Complex Structure Of E4 Mutant Human Igf2r Domain 11 Bound To Igf-Ii" . . . . . 98.59 142 97.14 97.86 2.40e-95 . . . . 19117 1 7 no PDB 2L2A . "Mutated Domain 11 Of The Cytoplasmic Region Of The Cation-Independent Mannose-6-Phosphate Receptor" . . . . . 98.59 142 97.14 97.86 2.40e-95 . . . . 19117 1 8 no PDB 2M68 . "Nmr Solution Structure Ensemble Of 3-4d Mutant Domain 11 Igf2r In Complex With Igf2 (domain 11 Structure Only)" . . . . . 100.00 142 100.00 100.00 6.18e-101 . . . . 19117 1 9 no PDB 2M6T . "Nmr Solution Structure Ensemble Of 3-4d Mutant Domain 11 Igf2r" . . . . . 100.00 142 100.00 100.00 6.18e-101 . . . . 19117 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 1508 MET . 19117 1 2 1509 LYS . 19117 1 3 1510 SER . 19117 1 4 1511 ASN . 19117 1 5 1512 GLU . 19117 1 6 1513 HIS . 19117 1 7 1514 ASP . 19117 1 8 1515 ASP . 19117 1 9 1516 CYS . 19117 1 10 1517 GLN . 19117 1 11 1518 VAL . 19117 1 12 1519 THR . 19117 1 13 1520 ASN . 19117 1 14 1521 PRO . 19117 1 15 1522 SER . 19117 1 16 1523 THR . 19117 1 17 1524 GLY . 19117 1 18 1525 HIS . 19117 1 19 1526 LEU . 19117 1 20 1527 PHE . 19117 1 21 1528 ASP . 19117 1 22 1529 LEU . 19117 1 23 1530 SER . 19117 1 24 1531 SER . 19117 1 25 1532 LEU . 19117 1 26 1533 SER . 19117 1 27 1534 GLY . 19117 1 28 1535 ARG . 19117 1 29 1536 ALA . 19117 1 30 1537 GLY . 19117 1 31 1538 PHE . 19117 1 32 1539 THR . 19117 1 33 1540 ALA . 19117 1 34 1541 ALA . 19117 1 35 1542 TYR . 19117 1 36 1543 ALA . 19117 1 37 1544 LYS . 19117 1 38 1545 GLY . 19117 1 39 1546 TRP . 19117 1 40 1547 GLY . 19117 1 41 1548 VAL . 19117 1 42 1549 TYR . 19117 1 43 1550 MET . 19117 1 44 1551 SER . 19117 1 45 1552 ILE . 19117 1 46 1553 CYS . 19117 1 47 1554 GLY . 19117 1 48 1555 GLU . 19117 1 49 1556 ASN . 19117 1 50 1557 GLU . 19117 1 51 1558 ASN . 19117 1 52 1559 CYS . 19117 1 53 1560 PRO . 19117 1 54 1561 PRO . 19117 1 55 1562 GLY . 19117 1 56 1563 VAL . 19117 1 57 1564 GLY . 19117 1 58 1565 ALA . 19117 1 59 1566 CYS . 19117 1 60 1567 PHE . 19117 1 61 1568 GLY . 19117 1 62 1569 GLN . 19117 1 63 1570 THR . 19117 1 64 1571 ARG . 19117 1 65 1572 ILE . 19117 1 66 1573 SER . 19117 1 67 1574 VAL . 19117 1 68 1575 GLY . 19117 1 69 1576 LYS . 19117 1 70 1577 ALA . 19117 1 71 1578 ASN . 19117 1 72 1579 LYS . 19117 1 73 1580 ARG . 19117 1 74 1581 LEU . 19117 1 75 1582 ARG . 19117 1 76 1583 TYR . 19117 1 77 1584 VAL . 19117 1 78 1585 ASP . 19117 1 79 1586 GLN . 19117 1 80 1587 VAL . 19117 1 81 1588 LEU . 19117 1 82 1589 GLN . 19117 1 83 1590 LEU . 19117 1 84 1591 VAL . 19117 1 85 1592 TYR . 19117 1 86 1593 LYS . 19117 1 87 1594 ASP . 19117 1 88 1595 GLY . 19117 1 89 1596 SER . 19117 1 90 1597 PRO . 19117 1 91 1598 CYS . 19117 1 92 1599 PRO . 19117 1 93 1600 SER . 19117 1 94 1601 LYS . 19117 1 95 1602 SER . 19117 1 96 1603 GLY . 19117 1 97 1604 LEU . 19117 1 98 1605 SER . 19117 1 99 1606 TYR . 19117 1 100 1607 LYS . 19117 1 101 1608 SER . 19117 1 102 1609 VAL . 19117 1 103 1610 ILE . 19117 1 104 1611 SER . 19117 1 105 1612 PHE . 19117 1 106 1613 VAL . 19117 1 107 1614 CYS . 19117 1 108 1615 ARG . 19117 1 109 1616 PRO . 19117 1 110 1617 GLU . 19117 1 111 1618 ALA . 19117 1 112 1619 GLY . 19117 1 113 1620 PRO . 19117 1 114 1621 THR . 19117 1 115 1622 ASN . 19117 1 116 1623 ARG . 19117 1 117 1624 PRO . 19117 1 118 1625 MET . 19117 1 119 1626 LEU . 19117 1 120 1627 ILE . 19117 1 121 1628 SER . 19117 1 122 1629 LEU . 19117 1 123 1630 ASP . 19117 1 124 1631 LYS . 19117 1 125 1632 GLN . 19117 1 126 1633 THR . 19117 1 127 1634 CYS . 19117 1 128 1635 THR . 19117 1 129 1636 LEU . 19117 1 130 1637 PHE . 19117 1 131 1638 PHE . 19117 1 132 1639 SER . 19117 1 133 1640 TRP . 19117 1 134 1641 HIS . 19117 1 135 1642 THR . 19117 1 136 1643 PRO . 19117 1 137 1644 LEU . 19117 1 138 1645 ALA . 19117 1 139 1646 CYS . 19117 1 140 1647 GLU . 19117 1 141 1648 LEU . 19117 1 142 1649 ALA . 19117 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 . MET 1 1 19117 1 . LYS 2 2 19117 1 . SER 3 3 19117 1 . ASN 4 4 19117 1 . GLU 5 5 19117 1 . HIS 6 6 19117 1 . ASP 7 7 19117 1 . ASP 8 8 19117 1 . CYS 9 9 19117 1 . GLN 10 10 19117 1 . VAL 11 11 19117 1 . THR 12 12 19117 1 . ASN 13 13 19117 1 . PRO 14 14 19117 1 . SER 15 15 19117 1 . THR 16 16 19117 1 . GLY 17 17 19117 1 . HIS 18 18 19117 1 . LEU 19 19 19117 1 . PHE 20 20 19117 1 . ASP 21 21 19117 1 . LEU 22 22 19117 1 . SER 23 23 19117 1 . SER 24 24 19117 1 . LEU 25 25 19117 1 . SER 26 26 19117 1 . GLY 27 27 19117 1 . ARG 28 28 19117 1 . ALA 29 29 19117 1 . GLY 30 30 19117 1 . PHE 31 31 19117 1 . THR 32 32 19117 1 . ALA 33 33 19117 1 . ALA 34 34 19117 1 . TYR 35 35 19117 1 . ALA 36 36 19117 1 . LYS 37 37 19117 1 . GLY 38 38 19117 1 . TRP 39 39 19117 1 . GLY 40 40 19117 1 . VAL 41 41 19117 1 . TYR 42 42 19117 1 . MET 43 43 19117 1 . SER 44 44 19117 1 . ILE 45 45 19117 1 . CYS 46 46 19117 1 . GLY 47 47 19117 1 . GLU 48 48 19117 1 . ASN 49 49 19117 1 . GLU 50 50 19117 1 . ASN 51 51 19117 1 . CYS 52 52 19117 1 . PRO 53 53 19117 1 . PRO 54 54 19117 1 . GLY 55 55 19117 1 . VAL 56 56 19117 1 . GLY 57 57 19117 1 . ALA 58 58 19117 1 . CYS 59 59 19117 1 . PHE 60 60 19117 1 . GLY 61 61 19117 1 . GLN 62 62 19117 1 . THR 63 63 19117 1 . ARG 64 64 19117 1 . ILE 65 65 19117 1 . SER 66 66 19117 1 . VAL 67 67 19117 1 . GLY 68 68 19117 1 . LYS 69 69 19117 1 . ALA 70 70 19117 1 . ASN 71 71 19117 1 . LYS 72 72 19117 1 . ARG 73 73 19117 1 . LEU 74 74 19117 1 . ARG 75 75 19117 1 . TYR 76 76 19117 1 . VAL 77 77 19117 1 . ASP 78 78 19117 1 . GLN 79 79 19117 1 . VAL 80 80 19117 1 . LEU 81 81 19117 1 . GLN 82 82 19117 1 . LEU 83 83 19117 1 . VAL 84 84 19117 1 . TYR 85 85 19117 1 . LYS 86 86 19117 1 . ASP 87 87 19117 1 . GLY 88 88 19117 1 . SER 89 89 19117 1 . PRO 90 90 19117 1 . CYS 91 91 19117 1 . PRO 92 92 19117 1 . SER 93 93 19117 1 . LYS 94 94 19117 1 . SER 95 95 19117 1 . GLY 96 96 19117 1 . LEU 97 97 19117 1 . SER 98 98 19117 1 . TYR 99 99 19117 1 . LYS 100 100 19117 1 . SER 101 101 19117 1 . VAL 102 102 19117 1 . ILE 103 103 19117 1 . SER 104 104 19117 1 . PHE 105 105 19117 1 . VAL 106 106 19117 1 . CYS 107 107 19117 1 . ARG 108 108 19117 1 . PRO 109 109 19117 1 . GLU 110 110 19117 1 . ALA 111 111 19117 1 . GLY 112 112 19117 1 . PRO 113 113 19117 1 . THR 114 114 19117 1 . ASN 115 115 19117 1 . ARG 116 116 19117 1 . PRO 117 117 19117 1 . MET 118 118 19117 1 . LEU 119 119 19117 1 . ILE 120 120 19117 1 . SER 121 121 19117 1 . LEU 122 122 19117 1 . ASP 123 123 19117 1 . LYS 124 124 19117 1 . GLN 125 125 19117 1 . THR 126 126 19117 1 . CYS 127 127 19117 1 . THR 128 128 19117 1 . LEU 129 129 19117 1 . PHE 130 130 19117 1 . PHE 131 131 19117 1 . SER 132 132 19117 1 . TRP 133 133 19117 1 . HIS 134 134 19117 1 . THR 135 135 19117 1 . PRO 136 136 19117 1 . LEU 137 137 19117 1 . ALA 138 138 19117 1 . CYS 139 139 19117 1 . GLU 140 140 19117 1 . LEU 141 141 19117 1 . ALA 142 142 19117 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 19117 _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 $Domain_11 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . 'Domain 11 IGF2R' . 'Five mutations in AB loop in comparison to human domain 11 IGF2R. Mutated using directed evolution.' . . 19117 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 19117 _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 $Domain_11 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET26a . . . . . . 19117 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19117 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'STRUCTURAL STUDIES: Lyophilised IGF2 was added to solution state domain 11 at pH 4 in a 1:1 ratio.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 Domain_11 'natural abundance' . . 1 $Domain_11 . . 1 . . mM . . . . 19117 1 2 H2O 'natural abundance' . . . . . . 93 . . % . . . . 19117 1 3 D2O 'natural abundance' . . . . . . 7 . . % . . . . 19117 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 19117 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'STRUCTURAL STUDIES: Lyophilised IGF2 was added to solution state domain 11 at pH 4 in a 1:1 ratio.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 Domain_11 'natural abundance' . . 1 $Domain_11 . . 1 . . mM . . . . 19117 2 2 H2O 'natural abundance' . . . . . . 93 . . % . . . . 19117 2 3 D2O 'natural abundance' . . . . . . 7 . . % . . . . 19117 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 19117 _Sample_condition_list.ID 1 _Sample_condition_list.Details 'Conditions for sample 1.' 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 pH 4 . pH 19117 1 temperature 310.15 . K 19117 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 19117 _Sample_condition_list.ID 2 _Sample_condition_list.Details 'Conditions for sample 2.' 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 pH 4 . pH 19117 2 temperature 298.15 . K 19117 2 stop_ save_ ############################ # Computer software used # ############################ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 19117 _Software.ID 1 _Software.Name ARIA _Software.Version 2.2 _Software.Details . 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 19117 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'Fitted with a cryogenically cooled probehead. Bristol University.' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VNMRS _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 19117 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'Fitted with a cryogenically cooled probehead. HWB-NMR/Welcome Trust.' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VNMRS _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 19117 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian VNMRS . 600 'Fitted with a cryogenically cooled probehead. Bristol University.' . . 19117 1 2 spectrometer_2 Varian VNMRS . 900 'Fitted with a cryogenically cooled probehead. HWB-NMR/Welcome Trust.' . . 19117 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 19117 _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 . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 4 '3D C(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 5 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 6 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 7 '3D HN(CO)CA' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 8 '3D H(CCO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 10 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 11 '3D 1H-15N TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 12 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 13 'Heteronuclear NOE ratio' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 14 'Heteronuclear NOE ratio' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19117 1 15 'T1 experiments' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 16 'T1 experiments' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19117 1 17 'T2 experiments' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19117 1 18 'T2 experiments' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19117 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 19117 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 19117 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 19117 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 19117 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 19117 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 19117 1 2 '2D 1H-13C HSQC' . . . 19117 1 3 '3D CBCA(CO)NH' . . . 19117 1 4 '3D C(CO)NH' . . . 19117 1 5 '3D HNCO' . . . 19117 1 6 '3D HNCA' . . . 19117 1 7 '3D HN(CO)CA' . . . 19117 1 8 '3D H(CCO)NH' . . . 19117 1 10 '3D 1H-15N NOESY' . . . 19117 1 11 '3D 1H-15N TOCSY' . . . 19117 1 12 '3D 1H-13C NOESY aliphatic' . . . 19117 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 3.836 0.000 . 1 . . . A 1508 MET HA . 19117 1 2 . 1 1 1 1 MET HB2 H 1 1.435 0.000 . 2 . . . A 1508 MET HB2 . 19117 1 3 . 1 1 1 1 MET HB3 H 1 1.509 0.000 . 2 . . . A 1508 MET HB3 . 19117 1 4 . 1 1 1 1 MET HE1 H 1 1.124 0.000 . 1 . . . A 1508 MET HE1 . 19117 1 5 . 1 1 1 1 MET HE2 H 1 1.124 0.000 . 1 . . . A 1508 MET HE2 . 19117 1 6 . 1 1 1 1 MET HE3 H 1 1.124 0.000 . 1 . . . A 1508 MET HE3 . 19117 1 7 . 1 1 1 1 MET C C 13 173.143 0.000 . 1 . . . A 1508 MET C . 19117 1 8 . 1 1 1 1 MET CA C 13 55.765 0.000 . 1 . . . A 1508 MET CA . 19117 1 9 . 1 1 1 1 MET CB C 13 33.518 0.000 . 1 . . . A 1508 MET CB . 19117 1 10 . 1 1 1 1 MET CG C 13 31.364 0.000 . 1 . . . A 1508 MET CG . 19117 1 11 . 1 1 1 1 MET CE C 13 17.830 0.000 . 1 . . . A 1508 MET CE . 19117 1 12 . 1 1 2 2 LYS H H 1 8.415 0.000 . 1 . . . A 1509 LYS H . 19117 1 13 . 1 1 2 2 LYS HA H 1 4.103 0.000 . 1 . . . A 1509 LYS HA . 19117 1 14 . 1 1 2 2 LYS HB2 H 1 1.456 0.000 . 2 . . . A 1509 LYS HB2 . 19117 1 15 . 1 1 2 2 LYS HB3 H 1 1.512 0.000 . 2 . . . A 1509 LYS HB3 . 19117 1 16 . 1 1 2 2 LYS HG2 H 1 1.136 0.000 . 2 . . . A 1509 LYS HG2 . 19117 1 17 . 1 1 2 2 LYS HG3 H 1 1.119 0.000 . 2 . . . A 1509 LYS HG3 . 19117 1 18 . 1 1 2 2 LYS HD2 H 1 1.362 0.000 . 1 . . . A 1509 LYS HD2 . 19117 1 19 . 1 1 2 2 LYS HD3 H 1 1.314 0.000 . 1 . . . A 1509 LYS HD3 . 19117 1 20 . 1 1 2 2 LYS HE2 H 1 2.666 0.000 . 1 . . . A 1509 LYS HE2 . 19117 1 21 . 1 1 2 2 LYS HE3 H 1 2.670 0.000 . 1 . . . A 1509 LYS HE3 . 19117 1 22 . 1 1 2 2 LYS C C 13 177.256 0.000 . 1 . . . A 1509 LYS C . 19117 1 23 . 1 1 2 2 LYS CA C 13 57.126 0.000 . 1 . . . A 1509 LYS CA . 19117 1 24 . 1 1 2 2 LYS CB C 13 33.686 0.000 . 1 . . . A 1509 LYS CB . 19117 1 25 . 1 1 2 2 LYS CG C 13 25.395 0.000 . 1 . . . A 1509 LYS CG . 19117 1 26 . 1 1 2 2 LYS CD C 13 29.590 0.000 . 1 . . . A 1509 LYS CD . 19117 1 27 . 1 1 2 2 LYS CE C 13 42.819 0.000 . 1 . . . A 1509 LYS CE . 19117 1 28 . 1 1 2 2 LYS N N 15 124.720 0.000 . 1 . . . A 1509 LYS N . 19117 1 29 . 1 1 3 3 SER H H 1 8.107 0.000 . 1 . . . A 1510 SER H . 19117 1 30 . 1 1 3 3 SER HA H 1 4.278 0.000 . 1 . . . A 1510 SER HA . 19117 1 31 . 1 1 3 3 SER HB2 H 1 3.575 0.000 . 2 . . . A 1510 SER HB2 . 19117 1 32 . 1 1 3 3 SER HB3 H 1 3.518 0.000 . 2 . . . A 1510 SER HB3 . 19117 1 33 . 1 1 3 3 SER C C 13 174.983 0.000 . 1 . . . A 1510 SER C . 19117 1 34 . 1 1 3 3 SER CA C 13 58.696 0.000 . 1 . . . A 1510 SER CA . 19117 1 35 . 1 1 3 3 SER CB C 13 64.861 0.000 . 1 . . . A 1510 SER CB . 19117 1 36 . 1 1 3 3 SER N N 15 117.754 0.000 . 1 . . . A 1510 SER N . 19117 1 37 . 1 1 4 4 ASN H H 1 8.241 0.000 . 1 . . . A 1511 ASN H . 19117 1 38 . 1 1 4 4 ASN HA H 1 4.484 0.000 . 1 . . . A 1511 ASN HA . 19117 1 39 . 1 1 4 4 ASN HB2 H 1 2.466 0.000 . 2 . . . A 1511 ASN HB2 . 19117 1 40 . 1 1 4 4 ASN HB3 H 1 2.509 0.000 . 2 . . . A 1511 ASN HB3 . 19117 1 41 . 1 1 4 4 ASN HD21 H 1 6.531 0.000 . 2 . . . A 1511 ASN HD21 . 19117 1 42 . 1 1 4 4 ASN HD22 H 1 7.242 0.000 . 2 . . . A 1511 ASN HD22 . 19117 1 43 . 1 1 4 4 ASN C C 13 175.570 0.000 . 1 . . . A 1511 ASN C . 19117 1 44 . 1 1 4 4 ASN CA C 13 53.535 0.000 . 1 . . . A 1511 ASN CA . 19117 1 45 . 1 1 4 4 ASN CB C 13 39.888 0.000 . 1 . . . A 1511 ASN CB . 19117 1 46 . 1 1 4 4 ASN N N 15 120.405 0.000 . 1 . . . A 1511 ASN N . 19117 1 47 . 1 1 4 4 ASN ND2 N 15 112.557 0.000 . 1 . . . A 1511 ASN ND2 . 19117 1 48 . 1 1 5 5 GLU H H 1 7.856 0.000 . 1 . . . A 1512 GLU H . 19117 1 49 . 1 1 5 5 GLU HA H 1 4.170 0.000 . 1 . . . A 1512 GLU HA . 19117 1 50 . 1 1 5 5 GLU HB2 H 1 1.561 0.000 . 2 . . . A 1512 GLU HB2 . 19117 1 51 . 1 1 5 5 GLU HB3 H 1 1.638 0.000 . 2 . . . A 1512 GLU HB3 . 19117 1 52 . 1 1 5 5 GLU HG2 H 1 1.877 0.000 . 2 . . . A 1512 GLU HG2 . 19117 1 53 . 1 1 5 5 GLU HG3 H 1 1.861 0.000 . 2 . . . A 1512 GLU HG3 . 19117 1 54 . 1 1 5 5 GLU C C 13 176.526 0.000 . 1 . . . A 1512 GLU C . 19117 1 55 . 1 1 5 5 GLU CA C 13 56.917 0.000 . 1 . . . A 1512 GLU CA . 19117 1 56 . 1 1 5 5 GLU CB C 13 31.015 0.000 . 1 . . . A 1512 GLU CB . 19117 1 57 . 1 1 5 5 GLU CG C 13 35.726 0.000 . 1 . . . A 1512 GLU CG . 19117 1 58 . 1 1 5 5 GLU N N 15 120.819 0.000 . 1 . . . A 1512 GLU N . 19117 1 59 . 1 1 6 6 HIS H H 1 8.237 0.000 . 1 . . . A 1513 HIS H . 19117 1 60 . 1 1 6 6 HIS HA H 1 4.354 0.000 . 1 . . . A 1513 HIS HA . 19117 1 61 . 1 1 6 6 HIS HB2 H 1 3.207 0.000 . 2 . . . A 1513 HIS HB2 . 19117 1 62 . 1 1 6 6 HIS HB3 H 1 2.882 0.000 . 2 . . . A 1513 HIS HB3 . 19117 1 63 . 1 1 6 6 HIS C C 13 174.132 0.000 . 1 . . . A 1513 HIS C . 19117 1 64 . 1 1 6 6 HIS CA C 13 55.972 0.000 . 1 . . . A 1513 HIS CA . 19117 1 65 . 1 1 6 6 HIS CB C 13 30.044 0.000 . 1 . . . A 1513 HIS CB . 19117 1 66 . 1 1 6 6 HIS N N 15 119.969 0.000 . 1 . . . A 1513 HIS N . 19117 1 67 . 1 1 7 7 ASP H H 1 7.962 0.000 . 1 . . . A 1514 ASP H . 19117 1 68 . 1 1 7 7 ASP HA H 1 4.501 0.000 . 1 . . . A 1514 ASP HA . 19117 1 69 . 1 1 7 7 ASP HB2 H 1 2.410 0.000 . 2 . . . A 1514 ASP HB2 . 19117 1 70 . 1 1 7 7 ASP HB3 H 1 2.249 0.000 . 2 . . . A 1514 ASP HB3 . 19117 1 71 . 1 1 7 7 ASP C C 13 176.929 0.000 . 1 . . . A 1514 ASP C . 19117 1 72 . 1 1 7 7 ASP CA C 13 54.243 0.000 . 1 . . . A 1514 ASP CA . 19117 1 73 . 1 1 7 7 ASP CB C 13 41.442 0.000 . 1 . . . A 1514 ASP CB . 19117 1 74 . 1 1 7 7 ASP N N 15 121.432 0.000 . 1 . . . A 1514 ASP N . 19117 1 75 . 1 1 8 8 ASP H H 1 8.210 0.000 . 1 . . . A 1515 ASP H . 19117 1 76 . 1 1 8 8 ASP HA H 1 4.242 0.000 . 1 . . . A 1515 ASP HA . 19117 1 77 . 1 1 8 8 ASP HB2 H 1 2.399 0.000 . 2 . . . A 1515 ASP HB2 . 19117 1 78 . 1 1 8 8 ASP HB3 H 1 2.409 0.000 . 2 . . . A 1515 ASP HB3 . 19117 1 79 . 1 1 8 8 ASP C C 13 175.844 0.000 . 1 . . . A 1515 ASP C . 19117 1 80 . 1 1 8 8 ASP CA C 13 54.785 0.000 . 1 . . . A 1515 ASP CA . 19117 1 81 . 1 1 8 8 ASP CB C 13 40.515 0.000 . 1 . . . A 1515 ASP CB . 19117 1 82 . 1 1 8 8 ASP N N 15 118.065 0.000 . 1 . . . A 1515 ASP N . 19117 1 83 . 1 1 9 9 CYS H H 1 9.140 0.000 . 1 . . . A 1516 CYS H . 19117 1 84 . 1 1 9 9 CYS HA H 1 3.754 0.000 . 1 . . . A 1516 CYS HA . 19117 1 85 . 1 1 9 9 CYS HB2 H 1 2.336 0.000 . 2 . . . A 1516 CYS HB2 . 19117 1 86 . 1 1 9 9 CYS HB3 H 1 3.169 0.000 . 2 . . . A 1516 CYS HB3 . 19117 1 87 . 1 1 9 9 CYS C C 13 172.714 0.000 . 1 . . . A 1516 CYS C . 19117 1 88 . 1 1 9 9 CYS CA C 13 58.543 0.000 . 1 . . . A 1516 CYS CA . 19117 1 89 . 1 1 9 9 CYS CB C 13 41.645 0.000 . 1 . . . A 1516 CYS CB . 19117 1 90 . 1 1 9 9 CYS N N 15 123.294 0.000 . 1 . . . A 1516 CYS N . 19117 1 91 . 1 1 10 10 GLN H H 1 7.406 0.000 . 1 . . . A 1517 GLN H . 19117 1 92 . 1 1 10 10 GLN HA H 1 5.044 0.000 . 1 . . . A 1517 GLN HA . 19117 1 93 . 1 1 10 10 GLN HB2 H 1 1.713 0.000 . 2 . . . A 1517 GLN HB2 . 19117 1 94 . 1 1 10 10 GLN HB3 H 1 1.558 0.000 . 2 . . . A 1517 GLN HB3 . 19117 1 95 . 1 1 10 10 GLN HG2 H 1 1.818 0.000 . 2 . . . A 1517 GLN HG2 . 19117 1 96 . 1 1 10 10 GLN HG3 H 1 1.920 0.000 . 2 . . . A 1517 GLN HG3 . 19117 1 97 . 1 1 10 10 GLN HE21 H 1 6.794 0.000 . 1 . . . A 1517 GLN HE21 . 19117 1 98 . 1 1 10 10 GLN HE22 H 1 6.285 0.000 . 1 . . . A 1517 GLN HE22 . 19117 1 99 . 1 1 10 10 GLN C C 13 174.927 0.000 . 1 . . . A 1517 GLN C . 19117 1 100 . 1 1 10 10 GLN CA C 13 54.822 0.000 . 1 . . . A 1517 GLN CA . 19117 1 101 . 1 1 10 10 GLN CB C 13 33.490 0.000 . 1 . . . A 1517 GLN CB . 19117 1 102 . 1 1 10 10 GLN CG C 13 33.672 0.000 . 1 . . . A 1517 GLN CG . 19117 1 103 . 1 1 10 10 GLN N N 15 113.988 0.000 . 1 . . . A 1517 GLN N . 19117 1 104 . 1 1 10 10 GLN NE2 N 15 109.782 0.000 . 1 . . . A 1517 GLN NE2 . 19117 1 105 . 1 1 11 11 VAL H H 1 8.354 0.000 . 1 . . . A 1518 VAL H . 19117 1 106 . 1 1 11 11 VAL HA H 1 4.148 0.000 . 1 . . . A 1518 VAL HA . 19117 1 107 . 1 1 11 11 VAL HB H 1 1.862 0.000 . 1 . . . A 1518 VAL HB . 19117 1 108 . 1 1 11 11 VAL HG11 H 1 0.958 0.000 . 2 . . . A 1518 VAL HG11 . 19117 1 109 . 1 1 11 11 VAL HG12 H 1 0.958 0.000 . 2 . . . A 1518 VAL HG12 . 19117 1 110 . 1 1 11 11 VAL HG13 H 1 0.958 0.000 . 2 . . . A 1518 VAL HG13 . 19117 1 111 . 1 1 11 11 VAL HG21 H 1 0.383 0.000 . 2 . . . A 1518 VAL HG21 . 19117 1 112 . 1 1 11 11 VAL HG22 H 1 0.383 0.000 . 2 . . . A 1518 VAL HG22 . 19117 1 113 . 1 1 11 11 VAL HG23 H 1 0.383 0.000 . 2 . . . A 1518 VAL HG23 . 19117 1 114 . 1 1 11 11 VAL C C 13 172.839 0.000 . 1 . . . A 1518 VAL C . 19117 1 115 . 1 1 11 11 VAL CA C 13 61.819 0.000 . 1 . . . A 1518 VAL CA . 19117 1 116 . 1 1 11 11 VAL CB C 13 34.646 0.000 . 1 . . . A 1518 VAL CB . 19117 1 117 . 1 1 11 11 VAL CG1 C 13 23.441 0.000 . 1 . . . A 1518 VAL CG1 . 19117 1 118 . 1 1 11 11 VAL CG2 C 13 20.867 0.000 . 1 . . . A 1518 VAL CG2 . 19117 1 119 . 1 1 11 11 VAL N N 15 118.642 0.000 . 1 . . . A 1518 VAL N . 19117 1 120 . 1 1 12 12 THR H H 1 7.454 0.000 . 1 . . . A 1519 THR H . 19117 1 121 . 1 1 12 12 THR HA H 1 5.184 0.000 . 1 . . . A 1519 THR HA . 19117 1 122 . 1 1 12 12 THR HB H 1 3.331 0.000 . 1 . . . A 1519 THR HB . 19117 1 123 . 1 1 12 12 THR HG21 H 1 0.535 0.000 . 1 . . . A 1519 THR HG21 . 19117 1 124 . 1 1 12 12 THR HG22 H 1 0.535 0.000 . 1 . . . A 1519 THR HG22 . 19117 1 125 . 1 1 12 12 THR HG23 H 1 0.535 0.000 . 1 . . . A 1519 THR HG23 . 19117 1 126 . 1 1 12 12 THR C C 13 175.949 0.000 . 1 . . . A 1519 THR C . 19117 1 127 . 1 1 12 12 THR CA C 13 60.458 0.000 . 1 . . . A 1519 THR CA . 19117 1 128 . 1 1 12 12 THR CB C 13 71.541 0.000 . 1 . . . A 1519 THR CB . 19117 1 129 . 1 1 12 12 THR CG2 C 13 22.339 0.000 . 1 . . . A 1519 THR CG2 . 19117 1 130 . 1 1 12 12 THR N N 15 118.244 0.000 . 1 . . . A 1519 THR N . 19117 1 131 . 1 1 13 13 ASN H H 1 7.860 0.000 . 1 . . . A 1520 ASN H . 19117 1 132 . 1 1 13 13 ASN HA H 1 3.851 0.000 . 1 . . . A 1520 ASN HA . 19117 1 133 . 1 1 13 13 ASN HB2 H 1 2.082 0.000 . 2 . . . A 1520 ASN HB2 . 19117 1 134 . 1 1 13 13 ASN HB3 H 1 2.842 0.000 . 2 . . . A 1520 ASN HB3 . 19117 1 135 . 1 1 13 13 ASN HD21 H 1 9.050 0.000 . 2 . . . A 1520 ASN HD21 . 19117 1 136 . 1 1 13 13 ASN HD22 H 1 6.810 0.000 . 2 . . . A 1520 ASN HD22 . 19117 1 137 . 1 1 13 13 ASN CA C 13 50.473 0.000 . 1 . . . A 1520 ASN CA . 19117 1 138 . 1 1 13 13 ASN CB C 13 39.388 0.000 . 1 . . . A 1520 ASN CB . 19117 1 139 . 1 1 13 13 ASN N N 15 120.528 0.000 . 1 . . . A 1520 ASN N . 19117 1 140 . 1 1 13 13 ASN ND2 N 15 118.183 0.000 . 1 . . . A 1520 ASN ND2 . 19117 1 141 . 1 1 14 14 PRO HA H 1 3.970 0.000 . 1 . . . A 1521 PRO HA . 19117 1 142 . 1 1 14 14 PRO HB2 H 1 2.019 0.000 . 2 . . . A 1521 PRO HB2 . 19117 1 143 . 1 1 14 14 PRO HB3 H 1 1.706 0.000 . 2 . . . A 1521 PRO HB3 . 19117 1 144 . 1 1 14 14 PRO HG2 H 1 1.699 0.000 . 2 . . . A 1521 PRO HG2 . 19117 1 145 . 1 1 14 14 PRO HG3 H 1 1.775 0.000 . 2 . . . A 1521 PRO HG3 . 19117 1 146 . 1 1 14 14 PRO HD2 H 1 3.423 0.000 . 1 . . . A 1521 PRO HD2 . 19117 1 147 . 1 1 14 14 PRO HD3 H 1 3.736 0.000 . 1 . . . A 1521 PRO HD3 . 19117 1 148 . 1 1 14 14 PRO C C 13 179.009 0.000 . 1 . . . A 1521 PRO C . 19117 1 149 . 1 1 14 14 PRO CA C 13 64.968 0.000 . 1 . . . A 1521 PRO CA . 19117 1 150 . 1 1 14 14 PRO CB C 13 32.858 0.000 . 1 . . . A 1521 PRO CB . 19117 1 151 . 1 1 14 14 PRO CG C 13 27.865 0.000 . 1 . . . A 1521 PRO CG . 19117 1 152 . 1 1 14 14 PRO CD C 13 51.797 0.000 . 1 . . . A 1521 PRO CD . 19117 1 153 . 1 1 15 15 SER H H 1 7.653 0.000 . 1 . . . A 1522 SER H . 19117 1 154 . 1 1 15 15 SER HA H 1 4.094 0.000 . 1 . . . A 1522 SER HA . 19117 1 155 . 1 1 15 15 SER HB2 H 1 3.610 0.000 . 2 . . . A 1522 SER HB2 . 19117 1 156 . 1 1 15 15 SER HB3 H 1 3.606 0.000 . 2 . . . A 1522 SER HB3 . 19117 1 157 . 1 1 15 15 SER C C 13 176.067 0.000 . 1 . . . A 1522 SER C . 19117 1 158 . 1 1 15 15 SER CA C 13 61.319 0.000 . 1 . . . A 1522 SER CA . 19117 1 159 . 1 1 15 15 SER CB C 13 64.034 0.000 . 1 . . . A 1522 SER CB . 19117 1 160 . 1 1 15 15 SER N N 15 111.821 0.000 . 1 . . . A 1522 SER N . 19117 1 161 . 1 1 16 16 THR H H 1 6.417 0.000 . 1 . . . A 1523 THR H . 19117 1 162 . 1 1 16 16 THR HA H 1 4.174 0.000 . 1 . . . A 1523 THR HA . 19117 1 163 . 1 1 16 16 THR HB H 1 3.985 0.000 . 1 . . . A 1523 THR HB . 19117 1 164 . 1 1 16 16 THR HG21 H 1 0.760 0.000 . 1 . . . A 1523 THR HG21 . 19117 1 165 . 1 1 16 16 THR HG22 H 1 0.760 0.000 . 1 . . . A 1523 THR HG22 . 19117 1 166 . 1 1 16 16 THR HG23 H 1 0.760 0.000 . 1 . . . A 1523 THR HG23 . 19117 1 167 . 1 1 16 16 THR C C 13 177.140 0.000 . 1 . . . A 1523 THR C . 19117 1 168 . 1 1 16 16 THR CA C 13 61.702 0.000 . 1 . . . A 1523 THR CA . 19117 1 169 . 1 1 16 16 THR CB C 13 71.828 0.000 . 1 . . . A 1523 THR CB . 19117 1 170 . 1 1 16 16 THR CG2 C 13 21.816 0.000 . 1 . . . A 1523 THR CG2 . 19117 1 171 . 1 1 16 16 THR N N 15 106.845 0.000 . 1 . . . A 1523 THR N . 19117 1 172 . 1 1 17 17 GLY H H 1 8.291 0.000 . 1 . . . A 1524 GLY H . 19117 1 173 . 1 1 17 17 GLY HA2 H 1 3.186 0.000 . 1 . . . A 1524 GLY HA2 . 19117 1 174 . 1 1 17 17 GLY HA3 H 1 3.838 0.000 . 1 . . . A 1524 GLY HA3 . 19117 1 175 . 1 1 17 17 GLY C C 13 174.482 0.000 . 1 . . . A 1524 GLY C . 19117 1 176 . 1 1 17 17 GLY CA C 13 45.929 0.000 . 1 . . . A 1524 GLY CA . 19117 1 177 . 1 1 17 17 GLY N N 15 111.592 0.000 . 1 . . . A 1524 GLY N . 19117 1 178 . 1 1 18 18 HIS H H 1 7.419 0.000 . 1 . . . A 1525 HIS H . 19117 1 179 . 1 1 18 18 HIS HA H 1 3.622 0.000 . 1 . . . A 1525 HIS HA . 19117 1 180 . 1 1 18 18 HIS HB2 H 1 2.183 0.000 . 2 . . . A 1525 HIS HB2 . 19117 1 181 . 1 1 18 18 HIS HB3 H 1 2.613 0.000 . 2 . . . A 1525 HIS HB3 . 19117 1 182 . 1 1 18 18 HIS C C 13 173.531 0.000 . 1 . . . A 1525 HIS C . 19117 1 183 . 1 1 18 18 HIS CA C 13 57.431 0.000 . 1 . . . A 1525 HIS CA . 19117 1 184 . 1 1 18 18 HIS CB C 13 29.731 0.000 . 1 . . . A 1525 HIS CB . 19117 1 185 . 1 1 18 18 HIS N N 15 119.105 0.000 . 1 . . . A 1525 HIS N . 19117 1 186 . 1 1 19 19 LEU H H 1 7.459 0.000 . 1 . . . A 1526 LEU H . 19117 1 187 . 1 1 19 19 LEU HA H 1 3.862 0.000 . 1 . . . A 1526 LEU HA . 19117 1 188 . 1 1 19 19 LEU HB2 H 1 0.793 0.000 . 2 . . . A 1526 LEU HB2 . 19117 1 189 . 1 1 19 19 LEU HB3 H 1 1.141 0.000 . 2 . . . A 1526 LEU HB3 . 19117 1 190 . 1 1 19 19 LEU HG H 1 0.350 0.000 . 1 . . . A 1526 LEU HG . 19117 1 191 . 1 1 19 19 LEU HD11 H 1 0.292 0.000 . 2 . . . A 1526 LEU HD11 . 19117 1 192 . 1 1 19 19 LEU HD12 H 1 0.292 0.000 . 2 . . . A 1526 LEU HD12 . 19117 1 193 . 1 1 19 19 LEU HD13 H 1 0.292 0.000 . 2 . . . A 1526 LEU HD13 . 19117 1 194 . 1 1 19 19 LEU HD21 H 1 0.540 0.000 . 2 . . . A 1526 LEU HD21 . 19117 1 195 . 1 1 19 19 LEU HD22 H 1 0.540 0.000 . 2 . . . A 1526 LEU HD22 . 19117 1 196 . 1 1 19 19 LEU HD23 H 1 0.540 0.000 . 2 . . . A 1526 LEU HD23 . 19117 1 197 . 1 1 19 19 LEU C C 13 175.767 0.000 . 1 . . . A 1526 LEU C . 19117 1 198 . 1 1 19 19 LEU CA C 13 55.032 0.000 . 1 . . . A 1526 LEU CA . 19117 1 199 . 1 1 19 19 LEU CB C 13 43.839 0.000 . 1 . . . A 1526 LEU CB . 19117 1 200 . 1 1 19 19 LEU CG C 13 26.136 0.000 . 1 . . . A 1526 LEU CG . 19117 1 201 . 1 1 19 19 LEU CD1 C 13 24.613 0.000 . 1 . . . A 1526 LEU CD1 . 19117 1 202 . 1 1 19 19 LEU CD2 C 13 22.713 0.000 . 1 . . . A 1526 LEU CD2 . 19117 1 203 . 1 1 19 19 LEU N N 15 129.153 0.000 . 1 . . . A 1526 LEU N . 19117 1 204 . 1 1 20 20 PHE H H 1 8.851 0.000 . 1 . . . A 1527 PHE H . 19117 1 205 . 1 1 20 20 PHE HA H 1 4.381 0.000 . 1 . . . A 1527 PHE HA . 19117 1 206 . 1 1 20 20 PHE HB2 H 1 2.314 0.000 . 2 . . . A 1527 PHE HB2 . 19117 1 207 . 1 1 20 20 PHE HB3 H 1 2.663 0.000 . 2 . . . A 1527 PHE HB3 . 19117 1 208 . 1 1 20 20 PHE HD1 H 1 7.100 0.000 . 3 . . . A 1527 PHE HD1 . 19117 1 209 . 1 1 20 20 PHE HD2 H 1 7.100 0.000 . 1 . . . A 1527 PHE HD2 . 19117 1 210 . 1 1 20 20 PHE HZ H 1 7.050 0.000 . 1 . . . A 1527 PHE HZ . 19117 1 211 . 1 1 20 20 PHE C C 13 175.159 0.000 . 1 . . . A 1527 PHE C . 19117 1 212 . 1 1 20 20 PHE CA C 13 57.609 0.000 . 1 . . . A 1527 PHE CA . 19117 1 213 . 1 1 20 20 PHE CB C 13 40.772 0.000 . 1 . . . A 1527 PHE CB . 19117 1 214 . 1 1 20 20 PHE CD1 C 13 133.652 0.000 . 3 . . . A 1527 PHE CD1 . 19117 1 215 . 1 1 20 20 PHE CD2 C 13 133.652 0.000 . 3 . . . A 1527 PHE CD2 . 19117 1 216 . 1 1 20 20 PHE N N 15 126.254 0.000 . 1 . . . A 1527 PHE N . 19117 1 217 . 1 1 21 21 ASP H H 1 8.101 0.000 . 1 . . . A 1528 ASP H . 19117 1 218 . 1 1 21 21 ASP HA H 1 4.676 0.000 . 1 . . . A 1528 ASP HA . 19117 1 219 . 1 1 21 21 ASP HB2 H 1 1.923 0.000 . 2 . . . A 1528 ASP HB2 . 19117 1 220 . 1 1 21 21 ASP HB3 H 1 2.545 0.000 . 2 . . . A 1528 ASP HB3 . 19117 1 221 . 1 1 21 21 ASP C C 13 177.329 0.000 . 1 . . . A 1528 ASP C . 19117 1 222 . 1 1 21 21 ASP CA C 13 53.407 0.000 . 1 . . . A 1528 ASP CA . 19117 1 223 . 1 1 21 21 ASP CB C 13 43.443 0.000 . 1 . . . A 1528 ASP CB . 19117 1 224 . 1 1 21 21 ASP N N 15 120.841 0.000 . 1 . . . A 1528 ASP N . 19117 1 225 . 1 1 22 22 LEU H H 1 7.962 0.000 . 1 . . . A 1529 LEU H . 19117 1 226 . 1 1 22 22 LEU HA H 1 4.007 0.000 . 1 . . . A 1529 LEU HA . 19117 1 227 . 1 1 22 22 LEU HB2 H 1 1.029 0.000 . 2 . . . A 1529 LEU HB2 . 19117 1 228 . 1 1 22 22 LEU HB3 H 1 0.888 0.000 . 2 . . . A 1529 LEU HB3 . 19117 1 229 . 1 1 22 22 LEU HG H 1 0.593 0.000 . 1 . . . A 1529 LEU HG . 19117 1 230 . 1 1 22 22 LEU HD11 H 1 -0.673 0.000 . 2 . . . A 1529 LEU HD11 . 19117 1 231 . 1 1 22 22 LEU HD12 H 1 -0.673 0.000 . 2 . . . A 1529 LEU HD12 . 19117 1 232 . 1 1 22 22 LEU HD13 H 1 -0.673 0.000 . 2 . . . A 1529 LEU HD13 . 19117 1 233 . 1 1 22 22 LEU HD21 H 1 -0.416 0.000 . 2 . . . A 1529 LEU HD21 . 19117 1 234 . 1 1 22 22 LEU HD22 H 1 -0.416 0.000 . 2 . . . A 1529 LEU HD22 . 19117 1 235 . 1 1 22 22 LEU HD23 H 1 -0.416 0.000 . 2 . . . A 1529 LEU HD23 . 19117 1 236 . 1 1 22 22 LEU C C 13 178.054 0.000 . 1 . . . A 1529 LEU C . 19117 1 237 . 1 1 22 22 LEU CA C 13 54.598 0.000 . 1 . . . A 1529 LEU CA . 19117 1 238 . 1 1 22 22 LEU CB C 13 41.471 0.000 . 1 . . . A 1529 LEU CB . 19117 1 239 . 1 1 22 22 LEU CG C 13 27.892 0.000 . 1 . . . A 1529 LEU CG . 19117 1 240 . 1 1 22 22 LEU CD1 C 13 24.934 0.000 . 1 . . . A 1529 LEU CD1 . 19117 1 241 . 1 1 22 22 LEU CD2 C 13 23.103 0.000 . 1 . . . A 1529 LEU CD2 . 19117 1 242 . 1 1 22 22 LEU N N 15 126.560 0.000 . 1 . . . A 1529 LEU N . 19117 1 243 . 1 1 23 23 SER H H 1 8.590 0.000 . 1 . . . A 1530 SER H . 19117 1 244 . 1 1 23 23 SER HA H 1 4.322 0.000 . 1 . . . A 1530 SER HA . 19117 1 245 . 1 1 23 23 SER HB2 H 1 3.570 0.000 . 2 . . . A 1530 SER HB2 . 19117 1 246 . 1 1 23 23 SER HB3 H 1 3.684 0.000 . 2 . . . A 1530 SER HB3 . 19117 1 247 . 1 1 23 23 SER C C 13 178.498 0.000 . 1 . . . A 1530 SER C . 19117 1 248 . 1 1 23 23 SER CA C 13 63.650 0.000 . 1 . . . A 1530 SER CA . 19117 1 249 . 1 1 23 23 SER CB C 13 63.491 0.000 . 1 . . . A 1530 SER CB . 19117 1 250 . 1 1 23 23 SER N N 15 117.140 0.000 . 1 . . . A 1530 SER N . 19117 1 251 . 1 1 24 24 SER H H 1 8.505 0.000 . 1 . . . A 1531 SER H . 19117 1 252 . 1 1 24 24 SER HA H 1 3.932 0.000 . 1 . . . A 1531 SER HA . 19117 1 253 . 1 1 24 24 SER HB2 H 1 3.633 0.000 . 2 . . . A 1531 SER HB2 . 19117 1 254 . 1 1 24 24 SER HB3 H 1 3.638 0.000 . 2 . . . A 1531 SER HB3 . 19117 1 255 . 1 1 24 24 SER C C 13 176.512 0.000 . 1 . . . A 1531 SER C . 19117 1 256 . 1 1 24 24 SER CA C 13 61.871 0.000 . 1 . . . A 1531 SER CA . 19117 1 257 . 1 1 24 24 SER CB C 13 62.481 0.000 . 1 . . . A 1531 SER CB . 19117 1 258 . 1 1 24 24 SER N N 15 118.867 0.000 . 1 . . . A 1531 SER N . 19117 1 259 . 1 1 25 25 LEU H H 1 7.602 0.000 . 1 . . . A 1532 LEU H . 19117 1 260 . 1 1 25 25 LEU HA H 1 4.341 0.000 . 1 . . . A 1532 LEU HA . 19117 1 261 . 1 1 25 25 LEU HB2 H 1 1.222 0.000 . 2 . . . A 1532 LEU HB2 . 19117 1 262 . 1 1 25 25 LEU HB3 H 1 1.305 0.000 . 2 . . . A 1532 LEU HB3 . 19117 1 263 . 1 1 25 25 LEU HG H 1 0.872 0.000 . 1 . . . A 1532 LEU HG . 19117 1 264 . 1 1 25 25 LEU HD11 H 1 -0.408 0.000 . 2 . . . A 1532 LEU HD11 . 19117 1 265 . 1 1 25 25 LEU HD12 H 1 -0.408 0.000 . 2 . . . A 1532 LEU HD12 . 19117 1 266 . 1 1 25 25 LEU HD13 H 1 -0.408 0.000 . 2 . . . A 1532 LEU HD13 . 19117 1 267 . 1 1 25 25 LEU HD21 H 1 0.338 0.000 . 2 . . . A 1532 LEU HD21 . 19117 1 268 . 1 1 25 25 LEU HD22 H 1 0.338 0.000 . 2 . . . A 1532 LEU HD22 . 19117 1 269 . 1 1 25 25 LEU HD23 H 1 0.338 0.000 . 2 . . . A 1532 LEU HD23 . 19117 1 270 . 1 1 25 25 LEU C C 13 178.097 0.000 . 1 . . . A 1532 LEU C . 19117 1 271 . 1 1 25 25 LEU CA C 13 55.236 0.000 . 1 . . . A 1532 LEU CA . 19117 1 272 . 1 1 25 25 LEU CB C 13 42.457 0.000 . 1 . . . A 1532 LEU CB . 19117 1 273 . 1 1 25 25 LEU CG C 13 25.223 0.000 . 1 . . . A 1532 LEU CG . 19117 1 274 . 1 1 25 25 LEU CD1 C 13 25.445 0.000 . 1 . . . A 1532 LEU CD1 . 19117 1 275 . 1 1 25 25 LEU CD2 C 13 21.829 0.000 . 1 . . . A 1532 LEU CD2 . 19117 1 276 . 1 1 25 25 LEU N N 15 120.602 0.000 . 1 . . . A 1532 LEU N . 19117 1 277 . 1 1 26 26 SER H H 1 7.311 0.000 . 1 . . . A 1533 SER H . 19117 1 278 . 1 1 26 26 SER HA H 1 4.564 0.000 . 1 . . . A 1533 SER HA . 19117 1 279 . 1 1 26 26 SER HB2 H 1 3.595 0.000 . 2 . . . A 1533 SER HB2 . 19117 1 280 . 1 1 26 26 SER HB3 H 1 3.813 0.000 . 2 . . . A 1533 SER HB3 . 19117 1 281 . 1 1 26 26 SER C C 13 174.922 0.000 . 1 . . . A 1533 SER C . 19117 1 282 . 1 1 26 26 SER CA C 13 59.570 0.000 . 1 . . . A 1533 SER CA . 19117 1 283 . 1 1 26 26 SER CB C 13 65.830 0.000 . 1 . . . A 1533 SER CB . 19117 1 284 . 1 1 26 26 SER N N 15 114.847 0.000 . 1 . . . A 1533 SER N . 19117 1 285 . 1 1 27 27 GLY H H 1 8.647 0.000 . 1 . . . A 1534 GLY H . 19117 1 286 . 1 1 27 27 GLY HA2 H 1 3.492 0.000 . 1 . . . A 1534 GLY HA2 . 19117 1 287 . 1 1 27 27 GLY HA3 H 1 4.453 0.000 . 1 . . . A 1534 GLY HA3 . 19117 1 288 . 1 1 27 27 GLY C C 13 177.139 0.000 . 1 . . . A 1534 GLY C . 19117 1 289 . 1 1 27 27 GLY CA C 13 45.365 0.000 . 1 . . . A 1534 GLY CA . 19117 1 290 . 1 1 27 27 GLY N N 15 110.717 0.000 . 1 . . . A 1534 GLY N . 19117 1 291 . 1 1 28 28 ARG H H 1 8.342 0.000 . 1 . . . A 1535 ARG H . 19117 1 292 . 1 1 28 28 ARG HA H 1 4.199 0.000 . 1 . . . A 1535 ARG HA . 19117 1 293 . 1 1 28 28 ARG HB2 H 1 1.447 0.000 . 2 . . . A 1535 ARG HB2 . 19117 1 294 . 1 1 28 28 ARG HB3 H 1 1.409 0.000 . 2 . . . A 1535 ARG HB3 . 19117 1 295 . 1 1 28 28 ARG HG2 H 1 1.483 0.000 . 2 . . . A 1535 ARG HG2 . 19117 1 296 . 1 1 28 28 ARG HG3 H 1 1.263 0.000 . 2 . . . A 1535 ARG HG3 . 19117 1 297 . 1 1 28 28 ARG HD2 H 1 2.962 0.000 . 1 . . . A 1535 ARG HD2 . 19117 1 298 . 1 1 28 28 ARG HD3 H 1 2.837 0.000 . 1 . . . A 1535 ARG HD3 . 19117 1 299 . 1 1 28 28 ARG HE H 1 7.345 0.000 . 1 . . . A 1535 ARG HE . 19117 1 300 . 1 1 28 28 ARG C C 13 178.321 0.000 . 1 . . . A 1535 ARG C . 19117 1 301 . 1 1 28 28 ARG CA C 13 58.942 0.000 . 1 . . . A 1535 ARG CA . 19117 1 302 . 1 1 28 28 ARG CB C 13 31.681 0.000 . 1 . . . A 1535 ARG CB . 19117 1 303 . 1 1 28 28 ARG CG C 13 29.219 0.000 . 1 . . . A 1535 ARG CG . 19117 1 304 . 1 1 28 28 ARG CD C 13 43.688 0.000 . 1 . . . A 1535 ARG CD . 19117 1 305 . 1 1 28 28 ARG N N 15 123.479 0.000 . 1 . . . A 1535 ARG N . 19117 1 306 . 1 1 28 28 ARG NE N 15 84.099 0.000 . 1 . . . A 1535 ARG NE . 19117 1 307 . 1 1 29 29 ALA H H 1 7.979 0.000 . 1 . . . A 1536 ALA H . 19117 1 308 . 1 1 29 29 ALA HA H 1 3.644 0.000 . 1 . . . A 1536 ALA HA . 19117 1 309 . 1 1 29 29 ALA HB1 H 1 0.968 0.000 . 1 . . . A 1536 ALA HB1 . 19117 1 310 . 1 1 29 29 ALA HB2 H 1 0.968 0.000 . 1 . . . A 1536 ALA HB2 . 19117 1 311 . 1 1 29 29 ALA HB3 H 1 0.968 0.000 . 1 . . . A 1536 ALA HB3 . 19117 1 312 . 1 1 29 29 ALA C C 13 171.908 0.000 . 1 . . . A 1536 ALA C . 19117 1 313 . 1 1 29 29 ALA CA C 13 55.407 0.000 . 1 . . . A 1536 ALA CA . 19117 1 314 . 1 1 29 29 ALA CB C 13 18.524 0.000 . 1 . . . A 1536 ALA CB . 19117 1 315 . 1 1 29 29 ALA N N 15 122.890 0.000 . 1 . . . A 1536 ALA N . 19117 1 316 . 1 1 30 30 GLY H H 1 6.940 0.000 . 1 . . . A 1537 GLY H . 19117 1 317 . 1 1 30 30 GLY HA2 H 1 3.557 0.000 . 1 . . . A 1537 GLY HA2 . 19117 1 318 . 1 1 30 30 GLY HA3 H 1 3.476 0.000 . 1 . . . A 1537 GLY HA3 . 19117 1 319 . 1 1 30 30 GLY C C 13 173.677 0.000 . 1 . . . A 1537 GLY C . 19117 1 320 . 1 1 30 30 GLY CA C 13 47.073 0.000 . 1 . . . A 1537 GLY CA . 19117 1 321 . 1 1 30 30 GLY N N 15 102.524 0.000 . 1 . . . A 1537 GLY N . 19117 1 322 . 1 1 31 31 PHE H H 1 8.912 0.000 . 1 . . . A 1538 PHE H . 19117 1 323 . 1 1 31 31 PHE HA H 1 4.613 0.000 . 1 . . . A 1538 PHE HA . 19117 1 324 . 1 1 31 31 PHE HB2 H 1 2.852 0.000 . 2 . . . A 1538 PHE HB2 . 19117 1 325 . 1 1 31 31 PHE HB3 H 1 2.065 0.000 . 2 . . . A 1538 PHE HB3 . 19117 1 326 . 1 1 31 31 PHE HD1 H 1 7.057 0.000 . 3 . . . A 1538 PHE HD1 . 19117 1 327 . 1 1 31 31 PHE HD2 H 1 7.057 0.000 . 1 . . . A 1538 PHE HD2 . 19117 1 328 . 1 1 31 31 PHE HE1 H 1 7.179 0.000 . 3 . . . A 1538 PHE HE1 . 19117 1 329 . 1 1 31 31 PHE HE2 H 1 7.179 0.000 . 3 . . . A 1538 PHE HE2 . 19117 1 330 . 1 1 31 31 PHE C C 13 176.506 0.000 . 1 . . . A 1538 PHE C . 19117 1 331 . 1 1 31 31 PHE CA C 13 57.552 0.000 . 1 . . . A 1538 PHE CA . 19117 1 332 . 1 1 31 31 PHE CB C 13 45.369 0.000 . 1 . . . A 1538 PHE CB . 19117 1 333 . 1 1 31 31 PHE CD1 C 13 132.859 0.000 . 3 . . . A 1538 PHE CD1 . 19117 1 334 . 1 1 31 31 PHE CD2 C 13 132.859 0.000 . 3 . . . A 1538 PHE CD2 . 19117 1 335 . 1 1 31 31 PHE N N 15 120.443 0.000 . 1 . . . A 1538 PHE N . 19117 1 336 . 1 1 32 32 THR H H 1 8.209 0.000 . 1 . . . A 1539 THR H . 19117 1 337 . 1 1 32 32 THR HA H 1 5.260 0.000 . 1 . . . A 1539 THR HA . 19117 1 338 . 1 1 32 32 THR HB H 1 3.342 0.000 . 1 . . . A 1539 THR HB . 19117 1 339 . 1 1 32 32 THR HG21 H 1 0.618 0.000 . 1 . . . A 1539 THR HG21 . 19117 1 340 . 1 1 32 32 THR HG22 H 1 0.618 0.000 . 1 . . . A 1539 THR HG22 . 19117 1 341 . 1 1 32 32 THR HG23 H 1 0.618 0.000 . 1 . . . A 1539 THR HG23 . 19117 1 342 . 1 1 32 32 THR C C 13 174.430 0.000 . 1 . . . A 1539 THR C . 19117 1 343 . 1 1 32 32 THR CA C 13 60.475 0.000 . 1 . . . A 1539 THR CA . 19117 1 344 . 1 1 32 32 THR CB C 13 72.569 0.000 . 1 . . . A 1539 THR CB . 19117 1 345 . 1 1 32 32 THR CG2 C 13 22.772 0.000 . 1 . . . A 1539 THR CG2 . 19117 1 346 . 1 1 32 32 THR N N 15 113.275 0.000 . 1 . . . A 1539 THR N . 19117 1 347 . 1 1 33 33 ALA H H 1 8.266 0.000 . 1 . . . A 1540 ALA H . 19117 1 348 . 1 1 33 33 ALA HA H 1 4.536 0.000 . 1 . . . A 1540 ALA HA . 19117 1 349 . 1 1 33 33 ALA HB1 H 1 0.987 0.000 . 1 . . . A 1540 ALA HB1 . 19117 1 350 . 1 1 33 33 ALA HB2 H 1 0.987 0.000 . 1 . . . A 1540 ALA HB2 . 19117 1 351 . 1 1 33 33 ALA HB3 H 1 0.987 0.000 . 1 . . . A 1540 ALA HB3 . 19117 1 352 . 1 1 33 33 ALA C C 13 177.044 0.000 . 1 . . . A 1540 ALA C . 19117 1 353 . 1 1 33 33 ALA CA C 13 50.570 0.000 . 1 . . . A 1540 ALA CA . 19117 1 354 . 1 1 33 33 ALA CB C 13 21.667 0.000 . 1 . . . A 1540 ALA CB . 19117 1 355 . 1 1 33 33 ALA N N 15 125.988 0.000 . 1 . . . A 1540 ALA N . 19117 1 356 . 1 1 34 34 ALA H H 1 8.155 0.000 . 1 . . . A 1541 ALA H . 19117 1 357 . 1 1 34 34 ALA HA H 1 4.149 0.000 . 1 . . . A 1541 ALA HA . 19117 1 358 . 1 1 34 34 ALA HB1 H 1 1.073 0.000 . 1 . . . A 1541 ALA HB1 . 19117 1 359 . 1 1 34 34 ALA HB2 H 1 1.073 0.000 . 1 . . . A 1541 ALA HB2 . 19117 1 360 . 1 1 34 34 ALA HB3 H 1 1.073 0.000 . 1 . . . A 1541 ALA HB3 . 19117 1 361 . 1 1 34 34 ALA C C 13 178.982 0.000 . 1 . . . A 1541 ALA C . 19117 1 362 . 1 1 34 34 ALA CA C 13 54.430 0.000 . 1 . . . A 1541 ALA CA . 19117 1 363 . 1 1 34 34 ALA CB C 13 20.901 0.000 . 1 . . . A 1541 ALA CB . 19117 1 364 . 1 1 34 34 ALA N N 15 127.782 0.000 . 1 . . . A 1541 ALA N . 19117 1 365 . 1 1 35 35 TYR H H 1 7.810 0.000 . 1 . . . A 1542 TYR H . 19117 1 366 . 1 1 35 35 TYR HA H 1 4.643 0.000 . 1 . . . A 1542 TYR HA . 19117 1 367 . 1 1 35 35 TYR HB2 H 1 2.306 0.000 . 2 . . . A 1542 TYR HB2 . 19117 1 368 . 1 1 35 35 TYR HB3 H 1 2.943 0.000 . 2 . . . A 1542 TYR HB3 . 19117 1 369 . 1 1 35 35 TYR HD1 H 1 6.645 0.000 . 3 . . . A 1542 TYR HD1 . 19117 1 370 . 1 1 35 35 TYR HD2 H 1 6.645 0.000 . 1 . . . A 1542 TYR HD2 . 19117 1 371 . 1 1 35 35 TYR HE1 H 1 6.758 0.000 . 3 . . . A 1542 TYR HE1 . 19117 1 372 . 1 1 35 35 TYR HE2 H 1 6.758 0.000 . 3 . . . A 1542 TYR HE2 . 19117 1 373 . 1 1 35 35 TYR C C 13 174.376 0.000 . 1 . . . A 1542 TYR C . 19117 1 374 . 1 1 35 35 TYR CA C 13 57.093 0.000 . 1 . . . A 1542 TYR CA . 19117 1 375 . 1 1 35 35 TYR CB C 13 40.233 0.000 . 1 . . . A 1542 TYR CB . 19117 1 376 . 1 1 35 35 TYR N N 15 114.114 0.000 . 1 . . . A 1542 TYR N . 19117 1 377 . 1 1 36 36 ALA H H 1 7.768 0.000 . 1 . . . A 1543 ALA H . 19117 1 378 . 1 1 36 36 ALA HA H 1 4.174 0.000 . 1 . . . A 1543 ALA HA . 19117 1 379 . 1 1 36 36 ALA HB1 H 1 1.071 0.000 . 1 . . . A 1543 ALA HB1 . 19117 1 380 . 1 1 36 36 ALA HB2 H 1 1.071 0.000 . 1 . . . A 1543 ALA HB2 . 19117 1 381 . 1 1 36 36 ALA HB3 H 1 1.071 0.000 . 1 . . . A 1543 ALA HB3 . 19117 1 382 . 1 1 36 36 ALA CA C 13 51.848 0.000 . 1 . . . A 1543 ALA CA . 19117 1 383 . 1 1 36 36 ALA CB C 13 22.729 0.000 . 1 . . . A 1543 ALA CB . 19117 1 384 . 1 1 36 36 ALA N N 15 124.638 0.000 . 1 . . . A 1543 ALA N . 19117 1 385 . 1 1 37 37 LYS H H 1 10.021 0.000 . 1 . . . A 1544 LYS H . 19117 1 386 . 1 1 37 37 LYS HA H 1 3.693 0.000 . 1 . . . A 1544 LYS HA . 19117 1 387 . 1 1 37 37 LYS HB2 H 1 1.479 0.000 . 2 . . . A 1544 LYS HB2 . 19117 1 388 . 1 1 37 37 LYS HB3 H 1 1.445 0.000 . 2 . . . A 1544 LYS HB3 . 19117 1 389 . 1 1 37 37 LYS HG2 H 1 1.013 0.000 . 2 . . . A 1544 LYS HG2 . 19117 1 390 . 1 1 37 37 LYS HG3 H 1 1.184 0.000 . 2 . . . A 1544 LYS HG3 . 19117 1 391 . 1 1 37 37 LYS HD2 H 1 1.326 0.000 . 1 . . . A 1544 LYS HD2 . 19117 1 392 . 1 1 37 37 LYS HD3 H 1 1.318 0.000 . 1 . . . A 1544 LYS HD3 . 19117 1 393 . 1 1 37 37 LYS HE2 H 1 2.626 0.000 . 1 . . . A 1544 LYS HE2 . 19117 1 394 . 1 1 37 37 LYS HE3 H 1 2.644 0.000 . 1 . . . A 1544 LYS HE3 . 19117 1 395 . 1 1 37 37 LYS C C 13 178.502 0.000 . 1 . . . A 1544 LYS C . 19117 1 396 . 1 1 37 37 LYS CA C 13 59.916 0.000 . 1 . . . A 1544 LYS CA . 19117 1 397 . 1 1 37 37 LYS CB C 13 31.962 0.000 . 1 . . . A 1544 LYS CB . 19117 1 398 . 1 1 37 37 LYS CG C 13 25.419 0.000 . 1 . . . A 1544 LYS CG . 19117 1 399 . 1 1 37 37 LYS CD C 13 29.617 0.000 . 1 . . . A 1544 LYS CD . 19117 1 400 . 1 1 37 37 LYS CE C 13 42.213 0.000 . 1 . . . A 1544 LYS CE . 19117 1 401 . 1 1 37 37 LYS N N 15 125.040 0.000 . 1 . . . A 1544 LYS N . 19117 1 402 . 1 1 38 38 GLY H H 1 8.092 0.000 . 1 . . . A 1545 GLY H . 19117 1 403 . 1 1 38 38 GLY HA2 H 1 3.171 0.000 . 1 . . . A 1545 GLY HA2 . 19117 1 404 . 1 1 38 38 GLY HA3 H 1 3.377 0.000 . 1 . . . A 1545 GLY HA3 . 19117 1 405 . 1 1 38 38 GLY C C 13 174.280 0.000 . 1 . . . A 1545 GLY C . 19117 1 406 . 1 1 38 38 GLY CA C 13 45.667 0.000 . 1 . . . A 1545 GLY CA . 19117 1 407 . 1 1 38 38 GLY N N 15 113.409 0.000 . 1 . . . A 1545 GLY N . 19117 1 408 . 1 1 39 39 TRP H H 1 7.336 0.000 . 1 . . . A 1546 TRP H . 19117 1 409 . 1 1 39 39 TRP HA H 1 4.411 0.000 . 1 . . . A 1546 TRP HA . 19117 1 410 . 1 1 39 39 TRP HB2 H 1 2.567 0.000 . 2 . . . A 1546 TRP HB2 . 19117 1 411 . 1 1 39 39 TRP HB3 H 1 1.742 0.000 . 2 . . . A 1546 TRP HB3 . 19117 1 412 . 1 1 39 39 TRP HD1 H 1 6.822 0.000 . 1 . . . A 1546 TRP HD1 . 19117 1 413 . 1 1 39 39 TRP HE1 H 1 9.655 0.000 . 1 . . . A 1546 TRP HE1 . 19117 1 414 . 1 1 39 39 TRP HE3 H 1 6.095 0.000 . 1 . . . A 1546 TRP HE3 . 19117 1 415 . 1 1 39 39 TRP HZ2 H 1 6.963 0.000 . 1 . . . A 1546 TRP HZ2 . 19117 1 416 . 1 1 39 39 TRP HZ3 H 1 6.275 0.000 . 1 . . . A 1546 TRP HZ3 . 19117 1 417 . 1 1 39 39 TRP HH2 H 1 7.124 0.000 . 1 . . . A 1546 TRP HH2 . 19117 1 418 . 1 1 39 39 TRP C C 13 175.014 0.000 . 1 . . . A 1546 TRP C . 19117 1 419 . 1 1 39 39 TRP CA C 13 57.029 0.000 . 1 . . . A 1546 TRP CA . 19117 1 420 . 1 1 39 39 TRP CB C 13 33.477 0.000 . 1 . . . A 1546 TRP CB . 19117 1 421 . 1 1 39 39 TRP N N 15 119.119 0.000 . 1 . . . A 1546 TRP N . 19117 1 422 . 1 1 39 39 TRP NE1 N 15 129.183 0.000 . 1 . . . A 1546 TRP NE1 . 19117 1 423 . 1 1 40 40 GLY H H 1 7.769 0.000 . 1 . . . A 1547 GLY H . 19117 1 424 . 1 1 40 40 GLY HA2 H 1 2.869 0.000 . 1 . . . A 1547 GLY HA2 . 19117 1 425 . 1 1 40 40 GLY HA3 H 1 4.427 0.000 . 1 . . . A 1547 GLY HA3 . 19117 1 426 . 1 1 40 40 GLY C C 13 173.737 0.000 . 1 . . . A 1547 GLY C . 19117 1 427 . 1 1 40 40 GLY CA C 13 45.722 0.000 . 1 . . . A 1547 GLY CA . 19117 1 428 . 1 1 40 40 GLY N N 15 109.204 0.000 . 1 . . . A 1547 GLY N . 19117 1 429 . 1 1 41 41 VAL H H 1 8.905 0.000 . 1 . . . A 1548 VAL H . 19117 1 430 . 1 1 41 41 VAL HA H 1 4.051 0.000 . 1 . . . A 1548 VAL HA . 19117 1 431 . 1 1 41 41 VAL HB H 1 1.940 0.000 . 1 . . . A 1548 VAL HB . 19117 1 432 . 1 1 41 41 VAL HG11 H 1 0.907 0.000 . 2 . . . A 1548 VAL HG11 . 19117 1 433 . 1 1 41 41 VAL HG12 H 1 0.907 0.000 . 2 . . . A 1548 VAL HG12 . 19117 1 434 . 1 1 41 41 VAL HG13 H 1 0.907 0.000 . 2 . . . A 1548 VAL HG13 . 19117 1 435 . 1 1 41 41 VAL HG21 H 1 0.664 0.000 . 2 . . . A 1548 VAL HG21 . 19117 1 436 . 1 1 41 41 VAL HG22 H 1 0.664 0.000 . 2 . . . A 1548 VAL HG22 . 19117 1 437 . 1 1 41 41 VAL HG23 H 1 0.664 0.000 . 2 . . . A 1548 VAL HG23 . 19117 1 438 . 1 1 41 41 VAL C C 13 176.972 0.000 . 1 . . . A 1548 VAL C . 19117 1 439 . 1 1 41 41 VAL CA C 13 62.726 0.000 . 1 . . . A 1548 VAL CA . 19117 1 440 . 1 1 41 41 VAL CB C 13 34.200 0.000 . 1 . . . A 1548 VAL CB . 19117 1 441 . 1 1 41 41 VAL CG1 C 13 22.536 0.000 . 1 . . . A 1548 VAL CG1 . 19117 1 442 . 1 1 41 41 VAL CG2 C 13 22.437 0.000 . 1 . . . A 1548 VAL CG2 . 19117 1 443 . 1 1 41 41 VAL N N 15 122.090 0.000 . 1 . . . A 1548 VAL N . 19117 1 444 . 1 1 42 42 TYR H H 1 8.533 0.000 . 1 . . . A 1549 TYR H . 19117 1 445 . 1 1 42 42 TYR HA H 1 4.406 0.000 . 1 . . . A 1549 TYR HA . 19117 1 446 . 1 1 42 42 TYR HB2 H 1 2.606 0.000 . 2 . . . A 1549 TYR HB2 . 19117 1 447 . 1 1 42 42 TYR HB3 H 1 2.780 0.000 . 2 . . . A 1549 TYR HB3 . 19117 1 448 . 1 1 42 42 TYR HD1 H 1 6.769 0.000 . 3 . . . A 1549 TYR HD1 . 19117 1 449 . 1 1 42 42 TYR HD2 H 1 6.769 0.000 . 1 . . . A 1549 TYR HD2 . 19117 1 450 . 1 1 42 42 TYR HE1 H 1 6.427 0.000 . 3 . . . A 1549 TYR HE1 . 19117 1 451 . 1 1 42 42 TYR HE2 H 1 6.427 0.000 . 3 . . . A 1549 TYR HE2 . 19117 1 452 . 1 1 42 42 TYR C C 13 176.603 0.000 . 1 . . . A 1549 TYR C . 19117 1 453 . 1 1 42 42 TYR CA C 13 58.572 0.000 . 1 . . . A 1549 TYR CA . 19117 1 454 . 1 1 42 42 TYR CB C 13 38.937 0.000 . 1 . . . A 1549 TYR CB . 19117 1 455 . 1 1 42 42 TYR CD1 C 13 133.765 0.000 . 3 . . . A 1549 TYR CD1 . 19117 1 456 . 1 1 42 42 TYR CD2 C 13 133.765 0.000 . 3 . . . A 1549 TYR CD2 . 19117 1 457 . 1 1 42 42 TYR CE1 C 13 118.404 0.000 . 3 . . . A 1549 TYR CE1 . 19117 1 458 . 1 1 42 42 TYR CE2 C 13 118.404 0.000 . 3 . . . A 1549 TYR CE2 . 19117 1 459 . 1 1 42 42 TYR N N 15 129.751 0.000 . 1 . . . A 1549 TYR N . 19117 1 460 . 1 1 43 43 MET H H 1 8.431 0.000 . 1 . . . A 1550 MET H . 19117 1 461 . 1 1 43 43 MET HA H 1 5.449 0.000 . 1 . . . A 1550 MET HA . 19117 1 462 . 1 1 43 43 MET HB2 H 1 1.518 0.000 . 2 . . . A 1550 MET HB2 . 19117 1 463 . 1 1 43 43 MET HB3 H 1 1.498 0.000 . 2 . . . A 1550 MET HB3 . 19117 1 464 . 1 1 43 43 MET HG2 H 1 1.878 0.000 . 2 . . . A 1550 MET HG2 . 19117 1 465 . 1 1 43 43 MET HG3 H 1 1.838 0.000 . 2 . . . A 1550 MET HG3 . 19117 1 466 . 1 1 43 43 MET HE1 H 1 0.467 0.000 . 1 . . . A 1550 MET HE1 . 19117 1 467 . 1 1 43 43 MET HE2 H 1 0.467 0.000 . 1 . . . A 1550 MET HE2 . 19117 1 468 . 1 1 43 43 MET HE3 H 1 0.467 0.000 . 1 . . . A 1550 MET HE3 . 19117 1 469 . 1 1 43 43 MET C C 13 176.053 0.000 . 1 . . . A 1550 MET C . 19117 1 470 . 1 1 43 43 MET CA C 13 55.508 0.000 . 1 . . . A 1550 MET CA . 19117 1 471 . 1 1 43 43 MET CB C 13 38.312 0.000 . 1 . . . A 1550 MET CB . 19117 1 472 . 1 1 43 43 MET CG C 13 30.722 0.000 . 1 . . . A 1550 MET CG . 19117 1 473 . 1 1 43 43 MET CE C 13 15.470 0.000 . 1 . . . A 1550 MET CE . 19117 1 474 . 1 1 43 43 MET N N 15 119.078 0.000 . 1 . . . A 1550 MET N . 19117 1 475 . 1 1 44 44 SER H H 1 8.932 0.000 . 1 . . . A 1551 SER H . 19117 1 476 . 1 1 44 44 SER HA H 1 5.221 0.000 . 1 . . . A 1551 SER HA . 19117 1 477 . 1 1 44 44 SER HB2 H 1 3.273 0.000 . 2 . . . A 1551 SER HB2 . 19117 1 478 . 1 1 44 44 SER HB3 H 1 3.408 0.000 . 2 . . . A 1551 SER HB3 . 19117 1 479 . 1 1 44 44 SER C C 13 173.905 0.000 . 1 . . . A 1551 SER C . 19117 1 480 . 1 1 44 44 SER CA C 13 58.953 0.000 . 1 . . . A 1551 SER CA . 19117 1 481 . 1 1 44 44 SER CB C 13 68.393 0.000 . 1 . . . A 1551 SER CB . 19117 1 482 . 1 1 44 44 SER N N 15 120.815 0.000 . 1 . . . A 1551 SER N . 19117 1 483 . 1 1 45 45 ILE H H 1 9.547 0.000 . 1 . . . A 1552 ILE H . 19117 1 484 . 1 1 45 45 ILE HA H 1 3.806 0.000 . 1 . . . A 1552 ILE HA . 19117 1 485 . 1 1 45 45 ILE HB H 1 1.732 0.000 . 1 . . . A 1552 ILE HB . 19117 1 486 . 1 1 45 45 ILE HG12 H 1 1.533 0.000 . 2 . . . A 1552 ILE HG12 . 19117 1 487 . 1 1 45 45 ILE HG13 H 1 0.931 0.000 . 2 . . . A 1552 ILE HG13 . 19117 1 488 . 1 1 45 45 ILE HG21 H 1 0.431 0.000 . 1 . . . A 1552 ILE HG21 . 19117 1 489 . 1 1 45 45 ILE HG22 H 1 0.431 0.000 . 1 . . . A 1552 ILE HG22 . 19117 1 490 . 1 1 45 45 ILE HG23 H 1 0.431 0.000 . 1 . . . A 1552 ILE HG23 . 19117 1 491 . 1 1 45 45 ILE HD11 H 1 0.493 0.000 . 1 . . . A 1552 ILE HD11 . 19117 1 492 . 1 1 45 45 ILE HD12 H 1 0.493 0.000 . 1 . . . A 1552 ILE HD12 . 19117 1 493 . 1 1 45 45 ILE HD13 H 1 0.493 0.000 . 1 . . . A 1552 ILE HD13 . 19117 1 494 . 1 1 45 45 ILE C C 13 177.053 0.000 . 1 . . . A 1552 ILE C . 19117 1 495 . 1 1 45 45 ILE CA C 13 58.763 0.000 . 1 . . . A 1552 ILE CA . 19117 1 496 . 1 1 45 45 ILE CB C 13 33.228 0.000 . 1 . . . A 1552 ILE CB . 19117 1 497 . 1 1 45 45 ILE CG1 C 13 28.092 0.000 . 1 . . . A 1552 ILE CG1 . 19117 1 498 . 1 1 45 45 ILE CG2 C 13 18.091 0.000 . 1 . . . A 1552 ILE CG2 . 19117 1 499 . 1 1 45 45 ILE CD1 C 13 9.840 0.000 . 1 . . . A 1552 ILE CD1 . 19117 1 500 . 1 1 45 45 ILE N N 15 124.078 0.000 . 1 . . . A 1552 ILE N . 19117 1 501 . 1 1 46 46 CYS H H 1 7.781 0.000 . 1 . . . A 1553 CYS H . 19117 1 502 . 1 1 46 46 CYS HA H 1 4.148 0.000 . 1 . . . A 1553 CYS HA . 19117 1 503 . 1 1 46 46 CYS HB2 H 1 2.854 0.000 . 2 . . . A 1553 CYS HB2 . 19117 1 504 . 1 1 46 46 CYS HB3 H 1 3.739 0.000 . 2 . . . A 1553 CYS HB3 . 19117 1 505 . 1 1 46 46 CYS C C 13 172.921 0.000 . 1 . . . A 1553 CYS C . 19117 1 506 . 1 1 46 46 CYS CA C 13 57.157 0.000 . 1 . . . A 1553 CYS CA . 19117 1 507 . 1 1 46 46 CYS CB C 13 41.785 0.000 . 1 . . . A 1553 CYS CB . 19117 1 508 . 1 1 46 46 CYS N N 15 118.205 0.000 . 1 . . . A 1553 CYS N . 19117 1 509 . 1 1 47 47 GLY H H 1 6.598 0.000 . 1 . . . A 1554 GLY H . 19117 1 510 . 1 1 47 47 GLY HA2 H 1 3.688 0.000 . 1 . . . A 1554 GLY HA2 . 19117 1 511 . 1 1 47 47 GLY HA3 H 1 3.327 0.000 . 1 . . . A 1554 GLY HA3 . 19117 1 512 . 1 1 47 47 GLY C C 13 170.687 0.000 . 1 . . . A 1554 GLY C . 19117 1 513 . 1 1 47 47 GLY CA C 13 45.989 0.000 . 1 . . . A 1554 GLY CA . 19117 1 514 . 1 1 47 47 GLY N N 15 100.721 0.000 . 1 . . . A 1554 GLY N . 19117 1 515 . 1 1 48 48 GLU H H 1 7.472 0.000 . 1 . . . A 1555 GLU H . 19117 1 516 . 1 1 48 48 GLU HA H 1 3.407 0.000 . 1 . . . A 1555 GLU HA . 19117 1 517 . 1 1 48 48 GLU HB2 H 1 1.205 0.000 . 2 . . . A 1555 GLU HB2 . 19117 1 518 . 1 1 48 48 GLU HB3 H 1 1.781 0.000 . 2 . . . A 1555 GLU HB3 . 19117 1 519 . 1 1 48 48 GLU HG2 H 1 1.858 0.000 . 2 . . . A 1555 GLU HG2 . 19117 1 520 . 1 1 48 48 GLU HG3 H 1 1.465 0.000 . 2 . . . A 1555 GLU HG3 . 19117 1 521 . 1 1 48 48 GLU C C 13 176.574 0.000 . 1 . . . A 1555 GLU C . 19117 1 522 . 1 1 48 48 GLU CA C 13 55.783 0.000 . 1 . . . A 1555 GLU CA . 19117 1 523 . 1 1 48 48 GLU CB C 13 29.181 0.000 . 1 . . . A 1555 GLU CB . 19117 1 524 . 1 1 48 48 GLU CG C 13 35.051 0.000 . 1 . . . A 1555 GLU CG . 19117 1 525 . 1 1 48 48 GLU N N 15 115.294 0.000 . 1 . . . A 1555 GLU N . 19117 1 526 . 1 1 49 49 ASN H H 1 7.690 0.000 . 1 . . . A 1556 ASN H . 19117 1 527 . 1 1 49 49 ASN HA H 1 5.125 0.000 . 1 . . . A 1556 ASN HA . 19117 1 528 . 1 1 49 49 ASN HB2 H 1 2.279 0.000 . 2 . . . A 1556 ASN HB2 . 19117 1 529 . 1 1 49 49 ASN HB3 H 1 1.781 0.000 . 2 . . . A 1556 ASN HB3 . 19117 1 530 . 1 1 49 49 ASN HD21 H 1 7.540 0.000 . 2 . . . A 1556 ASN HD21 . 19117 1 531 . 1 1 49 49 ASN HD22 H 1 6.712 0.000 . 2 . . . A 1556 ASN HD22 . 19117 1 532 . 1 1 49 49 ASN C C 13 178.664 0.000 . 1 . . . A 1556 ASN C . 19117 1 533 . 1 1 49 49 ASN CA C 13 53.061 0.000 . 1 . . . A 1556 ASN CA . 19117 1 534 . 1 1 49 49 ASN CB C 13 44.179 0.000 . 1 . . . A 1556 ASN CB . 19117 1 535 . 1 1 49 49 ASN N N 15 117.736 0.000 . 1 . . . A 1556 ASN N . 19117 1 536 . 1 1 49 49 ASN ND2 N 15 117.133 0.000 . 1 . . . A 1556 ASN ND2 . 19117 1 537 . 1 1 50 50 GLU H H 1 8.905 0.000 . 1 . . . A 1557 GLU H . 19117 1 538 . 1 1 50 50 GLU HA H 1 3.800 0.000 . 1 . . . A 1557 GLU HA . 19117 1 539 . 1 1 50 50 GLU HB2 H 1 1.502 0.000 . 2 . . . A 1557 GLU HB2 . 19117 1 540 . 1 1 50 50 GLU HB3 H 1 1.355 0.000 . 2 . . . A 1557 GLU HB3 . 19117 1 541 . 1 1 50 50 GLU HG2 H 1 1.978 0.000 . 2 . . . A 1557 GLU HG2 . 19117 1 542 . 1 1 50 50 GLU HG3 H 1 1.964 0.000 . 2 . . . A 1557 GLU HG3 . 19117 1 543 . 1 1 50 50 GLU C C 13 175.839 0.000 . 1 . . . A 1557 GLU C . 19117 1 544 . 1 1 50 50 GLU CA C 13 58.225 0.000 . 1 . . . A 1557 GLU CA . 19117 1 545 . 1 1 50 50 GLU CB C 13 29.292 0.000 . 1 . . . A 1557 GLU CB . 19117 1 546 . 1 1 50 50 GLU CG C 13 33.790 0.000 . 1 . . . A 1557 GLU CG . 19117 1 547 . 1 1 50 50 GLU N N 15 125.648 0.000 . 1 . . . A 1557 GLU N . 19117 1 548 . 1 1 51 51 ASN H H 1 8.146 0.000 . 1 . . . A 1558 ASN H . 19117 1 549 . 1 1 51 51 ASN HA H 1 4.082 0.000 . 1 . . . A 1558 ASN HA . 19117 1 550 . 1 1 51 51 ASN HB2 H 1 1.243 0.000 . 2 . . . A 1558 ASN HB2 . 19117 1 551 . 1 1 51 51 ASN HB3 H 1 1.856 0.000 . 2 . . . A 1558 ASN HB3 . 19117 1 552 . 1 1 51 51 ASN C C 13 174.418 0.000 . 1 . . . A 1558 ASN C . 19117 1 553 . 1 1 51 51 ASN CA C 13 54.469 0.000 . 1 . . . A 1558 ASN CA . 19117 1 554 . 1 1 51 51 ASN CB C 13 39.486 0.000 . 1 . . . A 1558 ASN CB . 19117 1 555 . 1 1 51 51 ASN N N 15 117.522 0.000 . 1 . . . A 1558 ASN N . 19117 1 556 . 1 1 52 52 CYS H H 1 7.235 0.000 . 1 . . . A 1559 CYS H . 19117 1 557 . 1 1 52 52 CYS HA H 1 4.815 0.000 . 1 . . . A 1559 CYS HA . 19117 1 558 . 1 1 52 52 CYS HB2 H 1 2.776 0.000 . 2 . . . A 1559 CYS HB2 . 19117 1 559 . 1 1 52 52 CYS HB3 H 1 3.468 0.000 . 2 . . . A 1559 CYS HB3 . 19117 1 560 . 1 1 52 52 CYS CA C 13 51.191 0.000 . 1 . . . A 1559 CYS CA . 19117 1 561 . 1 1 52 52 CYS N N 15 117.217 0.000 . 1 . . . A 1559 CYS N . 19117 1 562 . 1 1 54 54 PRO HA H 1 3.808 0.000 . 1 . . . A 1561 PRO HA . 19117 1 563 . 1 1 54 54 PRO HB2 H 1 1.479 0.000 . 2 . . . A 1561 PRO HB2 . 19117 1 564 . 1 1 54 54 PRO HB3 H 1 2.004 0.000 . 2 . . . A 1561 PRO HB3 . 19117 1 565 . 1 1 54 54 PRO HG2 H 1 1.684 0.000 . 2 . . . A 1561 PRO HG2 . 19117 1 566 . 1 1 54 54 PRO HG3 H 1 1.799 0.000 . 2 . . . A 1561 PRO HG3 . 19117 1 567 . 1 1 54 54 PRO C C 13 178.775 0.000 . 1 . . . A 1561 PRO C . 19117 1 568 . 1 1 54 54 PRO CA C 13 65.227 0.000 . 1 . . . A 1561 PRO CA . 19117 1 569 . 1 1 54 54 PRO CB C 13 32.300 0.000 . 1 . . . A 1561 PRO CB . 19117 1 570 . 1 1 54 54 PRO CG C 13 28.221 0.000 . 1 . . . A 1561 PRO CG . 19117 1 571 . 1 1 55 55 GLY H H 1 8.828 0.000 . 1 . . . A 1562 GLY H . 19117 1 572 . 1 1 55 55 GLY HA2 H 1 3.329 0.000 . 1 . . . A 1562 GLY HA2 . 19117 1 573 . 1 1 55 55 GLY HA3 H 1 3.863 0.000 . 1 . . . A 1562 GLY HA3 . 19117 1 574 . 1 1 55 55 GLY C C 13 175.199 0.000 . 1 . . . A 1562 GLY C . 19117 1 575 . 1 1 55 55 GLY CA C 13 46.138 0.000 . 1 . . . A 1562 GLY CA . 19117 1 576 . 1 1 55 55 GLY N N 15 112.320 0.000 . 1 . . . A 1562 GLY N . 19117 1 577 . 1 1 56 56 VAL H H 1 7.861 0.000 . 1 . . . A 1563 VAL H . 19117 1 578 . 1 1 56 56 VAL HA H 1 3.499 0.000 . 1 . . . A 1563 VAL HA . 19117 1 579 . 1 1 56 56 VAL HB H 1 2.124 0.000 . 1 . . . A 1563 VAL HB . 19117 1 580 . 1 1 56 56 VAL HG11 H 1 0.530 0.000 . 2 . . . A 1563 VAL HG11 . 19117 1 581 . 1 1 56 56 VAL HG12 H 1 0.530 0.000 . 2 . . . A 1563 VAL HG12 . 19117 1 582 . 1 1 56 56 VAL HG13 H 1 0.530 0.000 . 2 . . . A 1563 VAL HG13 . 19117 1 583 . 1 1 56 56 VAL HG21 H 1 0.883 0.000 . 2 . . . A 1563 VAL HG21 . 19117 1 584 . 1 1 56 56 VAL HG22 H 1 0.883 0.000 . 2 . . . A 1563 VAL HG22 . 19117 1 585 . 1 1 56 56 VAL HG23 H 1 0.883 0.000 . 2 . . . A 1563 VAL HG23 . 19117 1 586 . 1 1 56 56 VAL C C 13 175.966 0.000 . 1 . . . A 1563 VAL C . 19117 1 587 . 1 1 56 56 VAL CA C 13 65.465 0.000 . 1 . . . A 1563 VAL CA . 19117 1 588 . 1 1 56 56 VAL CB C 13 32.051 0.000 . 1 . . . A 1563 VAL CB . 19117 1 589 . 1 1 56 56 VAL CG1 C 13 22.917 0.000 . 1 . . . A 1563 VAL CG1 . 19117 1 590 . 1 1 56 56 VAL CG2 C 13 24.771 0.000 . 1 . . . A 1563 VAL CG2 . 19117 1 591 . 1 1 56 56 VAL N N 15 124.968 0.000 . 1 . . . A 1563 VAL N . 19117 1 592 . 1 1 57 57 GLY H H 1 8.237 0.000 . 1 . . . A 1564 GLY H . 19117 1 593 . 1 1 57 57 GLY HA2 H 1 2.756 0.000 . 1 . . . A 1564 GLY HA2 . 19117 1 594 . 1 1 57 57 GLY HA3 H 1 3.879 0.000 . 1 . . . A 1564 GLY HA3 . 19117 1 595 . 1 1 57 57 GLY C C 13 171.952 0.000 . 1 . . . A 1564 GLY C . 19117 1 596 . 1 1 57 57 GLY CA C 13 47.060 0.000 . 1 . . . A 1564 GLY CA . 19117 1 597 . 1 1 57 57 GLY N N 15 114.703 0.000 . 1 . . . A 1564 GLY N . 19117 1 598 . 1 1 58 58 ALA H H 1 6.990 0.000 . 1 . . . A 1565 ALA H . 19117 1 599 . 1 1 58 58 ALA HA H 1 5.688 0.000 . 1 . . . A 1565 ALA HA . 19117 1 600 . 1 1 58 58 ALA HB1 H 1 0.896 0.000 . 1 . . . A 1565 ALA HB1 . 19117 1 601 . 1 1 58 58 ALA HB2 H 1 0.896 0.000 . 1 . . . A 1565 ALA HB2 . 19117 1 602 . 1 1 58 58 ALA HB3 H 1 0.896 0.000 . 1 . . . A 1565 ALA HB3 . 19117 1 603 . 1 1 58 58 ALA C C 13 176.502 0.000 . 1 . . . A 1565 ALA C . 19117 1 604 . 1 1 58 58 ALA CA C 13 51.795 0.000 . 1 . . . A 1565 ALA CA . 19117 1 605 . 1 1 58 58 ALA CB C 13 22.374 0.000 . 1 . . . A 1565 ALA CB . 19117 1 606 . 1 1 58 58 ALA N N 15 119.895 0.000 . 1 . . . A 1565 ALA N . 19117 1 607 . 1 1 59 59 CYS H H 1 8.930 0.000 . 1 . . . A 1566 CYS H . 19117 1 608 . 1 1 59 59 CYS HA H 1 5.363 0.000 . 1 . . . A 1566 CYS HA . 19117 1 609 . 1 1 59 59 CYS HB2 H 1 2.814 0.000 . 2 . . . A 1566 CYS HB2 . 19117 1 610 . 1 1 59 59 CYS HB3 H 1 2.837 0.000 . 2 . . . A 1566 CYS HB3 . 19117 1 611 . 1 1 59 59 CYS C C 13 172.130 0.000 . 1 . . . A 1566 CYS C . 19117 1 612 . 1 1 59 59 CYS CA C 13 56.911 0.000 . 1 . . . A 1566 CYS CA . 19117 1 613 . 1 1 59 59 CYS CB C 13 43.947 0.000 . 1 . . . A 1566 CYS CB . 19117 1 614 . 1 1 59 59 CYS N N 15 115.466 0.000 . 1 . . . A 1566 CYS N . 19117 1 615 . 1 1 60 60 PHE H H 1 8.179 0.000 . 1 . . . A 1567 PHE H . 19117 1 616 . 1 1 60 60 PHE HA H 1 5.162 0.000 . 1 . . . A 1567 PHE HA . 19117 1 617 . 1 1 60 60 PHE HB2 H 1 3.175 0.000 . 2 . . . A 1567 PHE HB2 . 19117 1 618 . 1 1 60 60 PHE HB3 H 1 2.295 0.000 . 2 . . . A 1567 PHE HB3 . 19117 1 619 . 1 1 60 60 PHE HD1 H 1 6.465 0.000 . 3 . . . A 1567 PHE HD1 . 19117 1 620 . 1 1 60 60 PHE HD2 H 1 6.465 0.000 . 1 . . . A 1567 PHE HD2 . 19117 1 621 . 1 1 60 60 PHE HE1 H 1 6.066 0.000 . 3 . . . A 1567 PHE HE1 . 19117 1 622 . 1 1 60 60 PHE HE2 H 1 6.066 0.000 . 3 . . . A 1567 PHE HE2 . 19117 1 623 . 1 1 60 60 PHE HZ H 1 6.167 0.000 . 1 . . . A 1567 PHE HZ . 19117 1 624 . 1 1 60 60 PHE C C 13 173.605 0.000 . 1 . . . A 1567 PHE C . 19117 1 625 . 1 1 60 60 PHE CA C 13 57.394 0.000 . 1 . . . A 1567 PHE CA . 19117 1 626 . 1 1 60 60 PHE CB C 13 44.020 0.000 . 1 . . . A 1567 PHE CB . 19117 1 627 . 1 1 60 60 PHE CD1 C 13 132.136 0.000 . 3 . . . A 1567 PHE CD1 . 19117 1 628 . 1 1 60 60 PHE CD2 C 13 132.136 0.000 . 3 . . . A 1567 PHE CD2 . 19117 1 629 . 1 1 60 60 PHE CE1 C 13 130.795 0.000 . 3 . . . A 1567 PHE CE1 . 19117 1 630 . 1 1 60 60 PHE CE2 C 13 130.795 0.000 . 3 . . . A 1567 PHE CE2 . 19117 1 631 . 1 1 60 60 PHE N N 15 115.123 0.000 . 1 . . . A 1567 PHE N . 19117 1 632 . 1 1 61 61 GLY H H 1 8.957 0.000 . 1 . . . A 1568 GLY H . 19117 1 633 . 1 1 61 61 GLY HA2 H 1 3.884 0.000 . 1 . . . A 1568 GLY HA2 . 19117 1 634 . 1 1 61 61 GLY HA3 H 1 3.499 0.000 . 1 . . . A 1568 GLY HA3 . 19117 1 635 . 1 1 61 61 GLY C C 13 176.703 0.000 . 1 . . . A 1568 GLY C . 19117 1 636 . 1 1 61 61 GLY CA C 13 43.954 0.000 . 1 . . . A 1568 GLY CA . 19117 1 637 . 1 1 61 61 GLY N N 15 106.067 0.000 . 1 . . . A 1568 GLY N . 19117 1 638 . 1 1 62 62 GLN H H 1 9.232 0.000 . 1 . . . A 1569 GLN H . 19117 1 639 . 1 1 62 62 GLN HA H 1 4.015 0.000 . 1 . . . A 1569 GLN HA . 19117 1 640 . 1 1 62 62 GLN HB2 H 1 1.960 0.000 . 2 . . . A 1569 GLN HB2 . 19117 1 641 . 1 1 62 62 GLN HB3 H 1 2.084 0.000 . 2 . . . A 1569 GLN HB3 . 19117 1 642 . 1 1 62 62 GLN HG2 H 1 2.288 0.000 . 2 . . . A 1569 GLN HG2 . 19117 1 643 . 1 1 62 62 GLN HG3 H 1 2.295 0.000 . 2 . . . A 1569 GLN HG3 . 19117 1 644 . 1 1 62 62 GLN HE21 H 1 6.563 0.000 . 1 . . . A 1569 GLN HE21 . 19117 1 645 . 1 1 62 62 GLN HE22 H 1 7.218 0.000 . 1 . . . A 1569 GLN HE22 . 19117 1 646 . 1 1 62 62 GLN CA C 13 60.203 0.000 . 1 . . . A 1569 GLN CA . 19117 1 647 . 1 1 62 62 GLN CB C 13 29.962 0.000 . 1 . . . A 1569 GLN CB . 19117 1 648 . 1 1 62 62 GLN CG C 13 34.916 0.000 . 1 . . . A 1569 GLN CG . 19117 1 649 . 1 1 62 62 GLN N N 15 123.869 0.000 . 1 . . . A 1569 GLN N . 19117 1 650 . 1 1 62 62 GLN NE2 N 15 111.700 0.000 . 1 . . . A 1569 GLN NE2 . 19117 1 651 . 1 1 63 63 THR H H 1 9.892 0.000 . 1 . . . A 1570 THR H . 19117 1 652 . 1 1 63 63 THR HA H 1 3.795 0.000 . 1 . . . A 1570 THR HA . 19117 1 653 . 1 1 63 63 THR HB H 1 3.915 0.000 . 1 . . . A 1570 THR HB . 19117 1 654 . 1 1 63 63 THR HG21 H 1 0.729 0.000 . 1 . . . A 1570 THR HG21 . 19117 1 655 . 1 1 63 63 THR HG22 H 1 0.729 0.000 . 1 . . . A 1570 THR HG22 . 19117 1 656 . 1 1 63 63 THR HG23 H 1 0.729 0.000 . 1 . . . A 1570 THR HG23 . 19117 1 657 . 1 1 63 63 THR C C 13 175.502 0.000 . 1 . . . A 1570 THR C . 19117 1 658 . 1 1 63 63 THR CA C 13 63.405 0.000 . 1 . . . A 1570 THR CA . 19117 1 659 . 1 1 63 63 THR CB C 13 69.776 0.000 . 1 . . . A 1570 THR CB . 19117 1 660 . 1 1 63 63 THR CG2 C 13 21.968 0.000 . 1 . . . A 1570 THR CG2 . 19117 1 661 . 1 1 63 63 THR N N 15 109.928 0.000 . 1 . . . A 1570 THR N . 19117 1 662 . 1 1 64 64 ARG H H 1 6.925 0.000 . 1 . . . A 1571 ARG H . 19117 1 663 . 1 1 64 64 ARG HA H 1 2.875 0.000 . 1 . . . A 1571 ARG HA . 19117 1 664 . 1 1 64 64 ARG HB2 H 1 1.270 0.000 . 2 . . . A 1571 ARG HB2 . 19117 1 665 . 1 1 64 64 ARG HB3 H 1 1.167 0.000 . 2 . . . A 1571 ARG HB3 . 19117 1 666 . 1 1 64 64 ARG HG2 H 1 1.167 0.000 . 2 . . . A 1571 ARG HG2 . 19117 1 667 . 1 1 64 64 ARG HG3 H 1 1.270 0.000 . 2 . . . A 1571 ARG HG3 . 19117 1 668 . 1 1 64 64 ARG HD2 H 1 3.063 0.000 . 1 . . . A 1571 ARG HD2 . 19117 1 669 . 1 1 64 64 ARG HD3 H 1 2.755 0.000 . 1 . . . A 1571 ARG HD3 . 19117 1 670 . 1 1 64 64 ARG HE H 1 6.299 0.000 . 1 . . . A 1571 ARG HE . 19117 1 671 . 1 1 64 64 ARG C C 13 175.292 0.000 . 1 . . . A 1571 ARG C . 19117 1 672 . 1 1 64 64 ARG CA C 13 55.133 0.000 . 1 . . . A 1571 ARG CA . 19117 1 673 . 1 1 64 64 ARG CB C 13 31.577 0.000 . 1 . . . A 1571 ARG CB . 19117 1 674 . 1 1 64 64 ARG CG C 13 27.065 0.000 . 1 . . . A 1571 ARG CG . 19117 1 675 . 1 1 64 64 ARG CD C 13 43.004 0.000 . 1 . . . A 1571 ARG CD . 19117 1 676 . 1 1 64 64 ARG N N 15 116.808 0.000 . 1 . . . A 1571 ARG N . 19117 1 677 . 1 1 64 64 ARG NE N 15 86.547 0.000 . 1 . . . A 1571 ARG NE . 19117 1 678 . 1 1 65 65 ILE H H 1 7.335 0.000 . 1 . . . A 1572 ILE H . 19117 1 679 . 1 1 65 65 ILE HA H 1 2.880 0.000 . 1 . . . A 1572 ILE HA . 19117 1 680 . 1 1 65 65 ILE HB H 1 -0.311 0.000 . 1 . . . A 1572 ILE HB . 19117 1 681 . 1 1 65 65 ILE HG12 H 1 1.156 0.000 . 2 . . . A 1572 ILE HG12 . 19117 1 682 . 1 1 65 65 ILE HG13 H 1 0.293 0.000 . 2 . . . A 1572 ILE HG13 . 19117 1 683 . 1 1 65 65 ILE HG21 H 1 0.116 0.000 . 1 . . . A 1572 ILE HG21 . 19117 1 684 . 1 1 65 65 ILE HG22 H 1 0.116 0.000 . 1 . . . A 1572 ILE HG22 . 19117 1 685 . 1 1 65 65 ILE HG23 H 1 0.116 0.000 . 1 . . . A 1572 ILE HG23 . 19117 1 686 . 1 1 65 65 ILE HD11 H 1 0.218 0.000 . 1 . . . A 1572 ILE HD11 . 19117 1 687 . 1 1 65 65 ILE HD12 H 1 0.218 0.000 . 1 . . . A 1572 ILE HD12 . 19117 1 688 . 1 1 65 65 ILE HD13 H 1 0.218 0.000 . 1 . . . A 1572 ILE HD13 . 19117 1 689 . 1 1 65 65 ILE C C 13 175.144 0.000 . 1 . . . A 1572 ILE C . 19117 1 690 . 1 1 65 65 ILE CA C 13 63.886 0.000 . 1 . . . A 1572 ILE CA . 19117 1 691 . 1 1 65 65 ILE CB C 13 38.421 0.000 . 1 . . . A 1572 ILE CB . 19117 1 692 . 1 1 65 65 ILE CG1 C 13 28.738 0.000 . 1 . . . A 1572 ILE CG1 . 19117 1 693 . 1 1 65 65 ILE CG2 C 13 18.277 0.000 . 1 . . . A 1572 ILE CG2 . 19117 1 694 . 1 1 65 65 ILE CD1 C 13 15.251 0.000 . 1 . . . A 1572 ILE CD1 . 19117 1 695 . 1 1 65 65 ILE N N 15 123.229 0.000 . 1 . . . A 1572 ILE N . 19117 1 696 . 1 1 66 66 SER H H 1 8.106 0.000 . 1 . . . A 1573 SER H . 19117 1 697 . 1 1 66 66 SER HA H 1 5.351 0.000 . 1 . . . A 1573 SER HA . 19117 1 698 . 1 1 66 66 SER HB2 H 1 3.502 0.000 . 2 . . . A 1573 SER HB2 . 19117 1 699 . 1 1 66 66 SER HB3 H 1 2.795 0.000 . 2 . . . A 1573 SER HB3 . 19117 1 700 . 1 1 66 66 SER HG H 1 5.664 0.000 . 1 . . . A 1573 SER HG . 19117 1 701 . 1 1 66 66 SER C C 13 177.835 0.000 . 1 . . . A 1573 SER C . 19117 1 702 . 1 1 66 66 SER CA C 13 57.597 0.000 . 1 . . . A 1573 SER CA . 19117 1 703 . 1 1 66 66 SER CB C 13 64.246 0.000 . 1 . . . A 1573 SER CB . 19117 1 704 . 1 1 66 66 SER N N 15 120.993 0.000 . 1 . . . A 1573 SER N . 19117 1 705 . 1 1 67 67 VAL H H 1 8.606 0.000 . 1 . . . A 1574 VAL H . 19117 1 706 . 1 1 67 67 VAL HA H 1 4.413 0.000 . 1 . . . A 1574 VAL HA . 19117 1 707 . 1 1 67 67 VAL HB H 1 2.032 0.000 . 1 . . . A 1574 VAL HB . 19117 1 708 . 1 1 67 67 VAL HG11 H 1 -0.025 0.000 . 2 . . . A 1574 VAL HG11 . 19117 1 709 . 1 1 67 67 VAL HG12 H 1 -0.025 0.000 . 2 . . . A 1574 VAL HG12 . 19117 1 710 . 1 1 67 67 VAL HG13 H 1 -0.025 0.000 . 2 . . . A 1574 VAL HG13 . 19117 1 711 . 1 1 67 67 VAL HG21 H 1 0.302 0.000 . 2 . . . A 1574 VAL HG21 . 19117 1 712 . 1 1 67 67 VAL HG22 H 1 0.302 0.000 . 2 . . . A 1574 VAL HG22 . 19117 1 713 . 1 1 67 67 VAL HG23 H 1 0.302 0.000 . 2 . . . A 1574 VAL HG23 . 19117 1 714 . 1 1 67 67 VAL C C 13 175.242 0.000 . 1 . . . A 1574 VAL C . 19117 1 715 . 1 1 67 67 VAL CA C 13 60.073 0.000 . 1 . . . A 1574 VAL CA . 19117 1 716 . 1 1 67 67 VAL CB C 13 29.446 0.000 . 1 . . . A 1574 VAL CB . 19117 1 717 . 1 1 67 67 VAL CG1 C 13 22.935 0.000 . 1 . . . A 1574 VAL CG1 . 19117 1 718 . 1 1 67 67 VAL CG2 C 13 20.367 0.000 . 1 . . . A 1574 VAL CG2 . 19117 1 719 . 1 1 67 67 VAL N N 15 120.478 0.000 . 1 . . . A 1574 VAL N . 19117 1 720 . 1 1 68 68 GLY H H 1 7.479 0.000 . 1 . . . A 1575 GLY H . 19117 1 721 . 1 1 68 68 GLY HA2 H 1 4.339 0.000 . 1 . . . A 1575 GLY HA2 . 19117 1 722 . 1 1 68 68 GLY HA3 H 1 2.669 0.000 . 1 . . . A 1575 GLY HA3 . 19117 1 723 . 1 1 68 68 GLY C C 13 174.237 0.000 . 1 . . . A 1575 GLY C . 19117 1 724 . 1 1 68 68 GLY CA C 13 45.935 0.000 . 1 . . . A 1575 GLY CA . 19117 1 725 . 1 1 68 68 GLY N N 15 106.589 0.000 . 1 . . . A 1575 GLY N . 19117 1 726 . 1 1 69 69 LYS H H 1 8.614 0.000 . 1 . . . A 1576 LYS H . 19117 1 727 . 1 1 69 69 LYS HA H 1 3.930 0.000 . 1 . . . A 1576 LYS HA . 19117 1 728 . 1 1 69 69 LYS HB2 H 1 1.439 0.000 . 2 . . . A 1576 LYS HB2 . 19117 1 729 . 1 1 69 69 LYS HB3 H 1 1.547 0.000 . 2 . . . A 1576 LYS HB3 . 19117 1 730 . 1 1 69 69 LYS HG2 H 1 1.438 0.000 . 2 . . . A 1576 LYS HG2 . 19117 1 731 . 1 1 69 69 LYS HG3 H 1 1.015 0.000 . 2 . . . A 1576 LYS HG3 . 19117 1 732 . 1 1 69 69 LYS HD2 H 1 1.432 0.000 . 1 . . . A 1576 LYS HD2 . 19117 1 733 . 1 1 69 69 LYS HD3 H 1 1.395 0.000 . 1 . . . A 1576 LYS HD3 . 19117 1 734 . 1 1 69 69 LYS HE2 H 1 2.682 0.000 . 1 . . . A 1576 LYS HE2 . 19117 1 735 . 1 1 69 69 LYS HE3 H 1 2.791 0.000 . 1 . . . A 1576 LYS HE3 . 19117 1 736 . 1 1 69 69 LYS C C 13 177.436 0.000 . 1 . . . A 1576 LYS C . 19117 1 737 . 1 1 69 69 LYS CA C 13 57.726 0.000 . 1 . . . A 1576 LYS CA . 19117 1 738 . 1 1 69 69 LYS CB C 13 33.431 0.000 . 1 . . . A 1576 LYS CB . 19117 1 739 . 1 1 69 69 LYS CG C 13 26.419 0.000 . 1 . . . A 1576 LYS CG . 19117 1 740 . 1 1 69 69 LYS CD C 13 30.375 0.000 . 1 . . . A 1576 LYS CD . 19117 1 741 . 1 1 69 69 LYS CE C 13 42.855 0.000 . 1 . . . A 1576 LYS CE . 19117 1 742 . 1 1 69 69 LYS N N 15 126.527 0.000 . 1 . . . A 1576 LYS N . 19117 1 743 . 1 1 70 70 ALA H H 1 7.524 0.000 . 1 . . . A 1577 ALA H . 19117 1 744 . 1 1 70 70 ALA HA H 1 2.143 0.000 . 1 . . . A 1577 ALA HA . 19117 1 745 . 1 1 70 70 ALA HB1 H 1 0.268 0.000 . 1 . . . A 1577 ALA HB1 . 19117 1 746 . 1 1 70 70 ALA HB2 H 1 0.268 0.000 . 1 . . . A 1577 ALA HB2 . 19117 1 747 . 1 1 70 70 ALA HB3 H 1 0.268 0.000 . 1 . . . A 1577 ALA HB3 . 19117 1 748 . 1 1 70 70 ALA C C 13 177.126 0.000 . 1 . . . A 1577 ALA C . 19117 1 749 . 1 1 70 70 ALA CA C 13 52.625 0.000 . 1 . . . A 1577 ALA CA . 19117 1 750 . 1 1 70 70 ALA CB C 13 19.147 0.000 . 1 . . . A 1577 ALA CB . 19117 1 751 . 1 1 70 70 ALA N N 15 123.880 0.000 . 1 . . . A 1577 ALA N . 19117 1 752 . 1 1 71 71 ASN H H 1 6.587 0.000 . 1 . . . A 1578 ASN H . 19117 1 753 . 1 1 71 71 ASN HA H 1 4.274 0.000 . 1 . . . A 1578 ASN HA . 19117 1 754 . 1 1 71 71 ASN HB2 H 1 0.922 0.000 . 2 . . . A 1578 ASN HB2 . 19117 1 755 . 1 1 71 71 ASN HB3 H 1 2.622 0.000 . 2 . . . A 1578 ASN HB3 . 19117 1 756 . 1 1 71 71 ASN HD21 H 1 7.584 0.000 . 2 . . . A 1578 ASN HD21 . 19117 1 757 . 1 1 71 71 ASN HD22 H 1 7.707 0.000 . 2 . . . A 1578 ASN HD22 . 19117 1 758 . 1 1 71 71 ASN C C 13 173.141 0.000 . 1 . . . A 1578 ASN C . 19117 1 759 . 1 1 71 71 ASN CA C 13 53.812 0.000 . 1 . . . A 1578 ASN CA . 19117 1 760 . 1 1 71 71 ASN CB C 13 41.645 0.000 . 1 . . . A 1578 ASN CB . 19117 1 761 . 1 1 71 71 ASN N N 15 113.604 0.000 . 1 . . . A 1578 ASN N . 19117 1 762 . 1 1 71 71 ASN ND2 N 15 119.186 0.000 . 1 . . . A 1578 ASN ND2 . 19117 1 763 . 1 1 72 72 LYS H H 1 8.286 0.000 . 1 . . . A 1579 LYS H . 19117 1 764 . 1 1 72 72 LYS HA H 1 4.498 0.000 . 1 . . . A 1579 LYS HA . 19117 1 765 . 1 1 72 72 LYS HB2 H 1 1.554 0.000 . 2 . . . A 1579 LYS HB2 . 19117 1 766 . 1 1 72 72 LYS HB3 H 1 1.693 0.000 . 2 . . . A 1579 LYS HB3 . 19117 1 767 . 1 1 72 72 LYS HG2 H 1 0.934 0.000 . 2 . . . A 1579 LYS HG2 . 19117 1 768 . 1 1 72 72 LYS HG3 H 1 0.915 0.000 . 2 . . . A 1579 LYS HG3 . 19117 1 769 . 1 1 72 72 LYS HD2 H 1 1.551 0.000 . 1 . . . A 1579 LYS HD2 . 19117 1 770 . 1 1 72 72 LYS HD3 H 1 1.413 0.000 . 1 . . . A 1579 LYS HD3 . 19117 1 771 . 1 1 72 72 LYS HE2 H 1 2.710 0.000 . 1 . . . A 1579 LYS HE2 . 19117 1 772 . 1 1 72 72 LYS HE3 H 1 2.732 0.000 . 1 . . . A 1579 LYS HE3 . 19117 1 773 . 1 1 72 72 LYS C C 13 177.079 0.000 . 1 . . . A 1579 LYS C . 19117 1 774 . 1 1 72 72 LYS CA C 13 55.396 0.000 . 1 . . . A 1579 LYS CA . 19117 1 775 . 1 1 72 72 LYS CB C 13 33.444 0.000 . 1 . . . A 1579 LYS CB . 19117 1 776 . 1 1 72 72 LYS CG C 13 25.220 0.000 . 1 . . . A 1579 LYS CG . 19117 1 777 . 1 1 72 72 LYS CD C 13 30.473 0.000 . 1 . . . A 1579 LYS CD . 19117 1 778 . 1 1 72 72 LYS CE C 13 43.536 0.000 . 1 . . . A 1579 LYS CE . 19117 1 779 . 1 1 72 72 LYS N N 15 115.826 0.000 . 1 . . . A 1579 LYS N . 19117 1 780 . 1 1 73 73 ARG H H 1 8.144 0.000 . 1 . . . A 1580 ARG H . 19117 1 781 . 1 1 73 73 ARG HA H 1 4.308 0.000 . 1 . . . A 1580 ARG HA . 19117 1 782 . 1 1 73 73 ARG HB2 H 1 1.271 0.000 . 2 . . . A 1580 ARG HB2 . 19117 1 783 . 1 1 73 73 ARG HB3 H 1 1.544 0.000 . 2 . . . A 1580 ARG HB3 . 19117 1 784 . 1 1 73 73 ARG HG2 H 1 1.439 0.000 . 2 . . . A 1580 ARG HG2 . 19117 1 785 . 1 1 73 73 ARG HG3 H 1 1.297 0.000 . 2 . . . A 1580 ARG HG3 . 19117 1 786 . 1 1 73 73 ARG HD2 H 1 2.915 0.000 . 1 . . . A 1580 ARG HD2 . 19117 1 787 . 1 1 73 73 ARG HD3 H 1 2.874 0.000 . 1 . . . A 1580 ARG HD3 . 19117 1 788 . 1 1 73 73 ARG HE H 1 7.067 0.000 . 1 . . . A 1580 ARG HE . 19117 1 789 . 1 1 73 73 ARG C C 13 175.319 0.000 . 1 . . . A 1580 ARG C . 19117 1 790 . 1 1 73 73 ARG CA C 13 55.835 0.000 . 1 . . . A 1580 ARG CA . 19117 1 791 . 1 1 73 73 ARG CB C 13 29.460 0.000 . 1 . . . A 1580 ARG CB . 19117 1 792 . 1 1 73 73 ARG CG C 13 27.927 0.000 . 1 . . . A 1580 ARG CG . 19117 1 793 . 1 1 73 73 ARG CD C 13 44.190 0.000 . 1 . . . A 1580 ARG CD . 19117 1 794 . 1 1 73 73 ARG N N 15 123.081 0.000 . 1 . . . A 1580 ARG N . 19117 1 795 . 1 1 73 73 ARG NE N 15 85.230 0.000 . 1 . . . A 1580 ARG NE . 19117 1 796 . 1 1 74 74 LEU H H 1 7.970 0.000 . 1 . . . A 1581 LEU H . 19117 1 797 . 1 1 74 74 LEU HA H 1 4.214 0.000 . 1 . . . A 1581 LEU HA . 19117 1 798 . 1 1 74 74 LEU HB2 H 1 0.675 0.000 . 2 . . . A 1581 LEU HB2 . 19117 1 799 . 1 1 74 74 LEU HB3 H 1 1.250 0.000 . 2 . . . A 1581 LEU HB3 . 19117 1 800 . 1 1 74 74 LEU HG H 1 0.646 0.000 . 1 . . . A 1581 LEU HG . 19117 1 801 . 1 1 74 74 LEU HD11 H 1 0.289 0.000 . 2 . . . A 1581 LEU HD11 . 19117 1 802 . 1 1 74 74 LEU HD12 H 1 0.289 0.000 . 2 . . . A 1581 LEU HD12 . 19117 1 803 . 1 1 74 74 LEU HD13 H 1 0.289 0.000 . 2 . . . A 1581 LEU HD13 . 19117 1 804 . 1 1 74 74 LEU HD21 H 1 0.212 0.000 . 2 . . . A 1581 LEU HD21 . 19117 1 805 . 1 1 74 74 LEU HD22 H 1 0.212 0.000 . 2 . . . A 1581 LEU HD22 . 19117 1 806 . 1 1 74 74 LEU HD23 H 1 0.212 0.000 . 2 . . . A 1581 LEU HD23 . 19117 1 807 . 1 1 74 74 LEU C C 13 176.583 0.000 . 1 . . . A 1581 LEU C . 19117 1 808 . 1 1 74 74 LEU CA C 13 55.337 0.000 . 1 . . . A 1581 LEU CA . 19117 1 809 . 1 1 74 74 LEU CB C 13 45.247 0.000 . 1 . . . A 1581 LEU CB . 19117 1 810 . 1 1 74 74 LEU CG C 13 25.040 0.000 . 1 . . . A 1581 LEU CG . 19117 1 811 . 1 1 74 74 LEU CD1 C 13 25.407 0.000 . 1 . . . A 1581 LEU CD1 . 19117 1 812 . 1 1 74 74 LEU CD2 C 13 26.629 0.000 . 1 . . . A 1581 LEU CD2 . 19117 1 813 . 1 1 74 74 LEU N N 15 129.466 0.000 . 1 . . . A 1581 LEU N . 19117 1 814 . 1 1 75 75 ARG H H 1 8.526 0.000 . 1 . . . A 1582 ARG H . 19117 1 815 . 1 1 75 75 ARG HA H 1 4.639 0.000 . 1 . . . A 1582 ARG HA . 19117 1 816 . 1 1 75 75 ARG HB2 H 1 1.480 0.000 . 2 . . . A 1582 ARG HB2 . 19117 1 817 . 1 1 75 75 ARG HB3 H 1 1.412 0.000 . 2 . . . A 1582 ARG HB3 . 19117 1 818 . 1 1 75 75 ARG HG2 H 1 1.422 0.000 . 2 . . . A 1582 ARG HG2 . 19117 1 819 . 1 1 75 75 ARG HG3 H 1 1.289 0.000 . 2 . . . A 1582 ARG HG3 . 19117 1 820 . 1 1 75 75 ARG HD2 H 1 2.839 0.000 . 1 . . . A 1582 ARG HD2 . 19117 1 821 . 1 1 75 75 ARG HD3 H 1 2.878 0.000 . 1 . . . A 1582 ARG HD3 . 19117 1 822 . 1 1 75 75 ARG HE H 1 6.855 0.000 . 1 . . . A 1582 ARG HE . 19117 1 823 . 1 1 75 75 ARG C C 13 175.376 0.000 . 1 . . . A 1582 ARG C . 19117 1 824 . 1 1 75 75 ARG CA C 13 55.246 0.000 . 1 . . . A 1582 ARG CA . 19117 1 825 . 1 1 75 75 ARG CB C 13 34.556 0.000 . 1 . . . A 1582 ARG CB . 19117 1 826 . 1 1 75 75 ARG CG C 13 27.941 0.000 . 1 . . . A 1582 ARG CG . 19117 1 827 . 1 1 75 75 ARG CD C 13 44.256 0.000 . 1 . . . A 1582 ARG CD . 19117 1 828 . 1 1 75 75 ARG N N 15 123.453 0.000 . 1 . . . A 1582 ARG N . 19117 1 829 . 1 1 75 75 ARG NE N 15 84.784 0.000 . 1 . . . A 1582 ARG NE . 19117 1 830 . 1 1 76 76 TYR H H 1 8.550 0.000 . 1 . . . A 1583 TYR H . 19117 1 831 . 1 1 76 76 TYR HA H 1 4.506 0.000 . 1 . . . A 1583 TYR HA . 19117 1 832 . 1 1 76 76 TYR HB2 H 1 2.765 0.000 . 2 . . . A 1583 TYR HB2 . 19117 1 833 . 1 1 76 76 TYR HB3 H 1 2.253 0.000 . 2 . . . A 1583 TYR HB3 . 19117 1 834 . 1 1 76 76 TYR HD1 H 1 6.475 0.000 . 3 . . . A 1583 TYR HD1 . 19117 1 835 . 1 1 76 76 TYR HD2 H 1 6.475 0.000 . 1 . . . A 1583 TYR HD2 . 19117 1 836 . 1 1 76 76 TYR HE1 H 1 6.520 0.000 . 3 . . . A 1583 TYR HE1 . 19117 1 837 . 1 1 76 76 TYR HE2 H 1 6.520 0.000 . 3 . . . A 1583 TYR HE2 . 19117 1 838 . 1 1 76 76 TYR C C 13 175.453 0.000 . 1 . . . A 1583 TYR C . 19117 1 839 . 1 1 76 76 TYR CA C 13 58.286 0.000 . 1 . . . A 1583 TYR CA . 19117 1 840 . 1 1 76 76 TYR CB C 13 40.793 0.000 . 1 . . . A 1583 TYR CB . 19117 1 841 . 1 1 76 76 TYR N N 15 125.016 0.000 . 1 . . . A 1583 TYR N . 19117 1 842 . 1 1 77 77 VAL H H 1 8.337 0.000 . 1 . . . A 1584 VAL H . 19117 1 843 . 1 1 77 77 VAL HA H 1 3.866 0.000 . 1 . . . A 1584 VAL HA . 19117 1 844 . 1 1 77 77 VAL HB H 1 1.492 0.000 . 1 . . . A 1584 VAL HB . 19117 1 845 . 1 1 77 77 VAL HG11 H 1 0.406 0.000 . 2 . . . A 1584 VAL HG11 . 19117 1 846 . 1 1 77 77 VAL HG12 H 1 0.406 0.000 . 2 . . . A 1584 VAL HG12 . 19117 1 847 . 1 1 77 77 VAL HG13 H 1 0.406 0.000 . 2 . . . A 1584 VAL HG13 . 19117 1 848 . 1 1 77 77 VAL HG21 H 1 -0.233 0.000 . 2 . . . A 1584 VAL HG21 . 19117 1 849 . 1 1 77 77 VAL HG22 H 1 -0.233 0.000 . 2 . . . A 1584 VAL HG22 . 19117 1 850 . 1 1 77 77 VAL HG23 H 1 -0.233 0.000 . 2 . . . A 1584 VAL HG23 . 19117 1 851 . 1 1 77 77 VAL C C 13 175.545 0.000 . 1 . . . A 1584 VAL C . 19117 1 852 . 1 1 77 77 VAL CA C 13 60.957 0.000 . 1 . . . A 1584 VAL CA . 19117 1 853 . 1 1 77 77 VAL CB C 13 34.076 0.000 . 1 . . . A 1584 VAL CB . 19117 1 854 . 1 1 77 77 VAL CG1 C 13 20.703 0.000 . 1 . . . A 1584 VAL CG1 . 19117 1 855 . 1 1 77 77 VAL CG2 C 13 23.587 0.000 . 1 . . . A 1584 VAL CG2 . 19117 1 856 . 1 1 77 77 VAL N N 15 128.199 0.000 . 1 . . . A 1584 VAL N . 19117 1 857 . 1 1 78 78 ASP H H 1 8.592 0.000 . 1 . . . A 1585 ASP H . 19117 1 858 . 1 1 78 78 ASP HA H 1 3.869 0.000 . 1 . . . A 1585 ASP HA . 19117 1 859 . 1 1 78 78 ASP HB2 H 1 2.192 0.000 . 2 . . . A 1585 ASP HB2 . 19117 1 860 . 1 1 78 78 ASP HB3 H 1 2.534 0.000 . 2 . . . A 1585 ASP HB3 . 19117 1 861 . 1 1 78 78 ASP C C 13 174.903 0.000 . 1 . . . A 1585 ASP C . 19117 1 862 . 1 1 78 78 ASP CA C 13 56.173 0.000 . 1 . . . A 1585 ASP CA . 19117 1 863 . 1 1 78 78 ASP CB C 13 39.453 0.000 . 1 . . . A 1585 ASP CB . 19117 1 864 . 1 1 78 78 ASP N N 15 126.060 0.000 . 1 . . . A 1585 ASP N . 19117 1 865 . 1 1 79 79 GLN H H 1 6.176 0.000 . 1 . . . A 1586 GLN H . 19117 1 866 . 1 1 79 79 GLN HA H 1 3.199 0.000 . 1 . . . A 1586 GLN HA . 19117 1 867 . 1 1 79 79 GLN HB2 H 1 2.174 0.000 . 2 . . . A 1586 GLN HB2 . 19117 1 868 . 1 1 79 79 GLN HB3 H 1 2.076 0.000 . 2 . . . A 1586 GLN HB3 . 19117 1 869 . 1 1 79 79 GLN HG2 H 1 2.104 0.000 . 2 . . . A 1586 GLN HG2 . 19117 1 870 . 1 1 79 79 GLN HG3 H 1 1.957 0.000 . 2 . . . A 1586 GLN HG3 . 19117 1 871 . 1 1 79 79 GLN HE21 H 1 6.479 0.000 . 1 . . . A 1586 GLN HE21 . 19117 1 872 . 1 1 79 79 GLN HE22 H 1 7.175 0.000 . 1 . . . A 1586 GLN HE22 . 19117 1 873 . 1 1 79 79 GLN C C 13 175.173 0.000 . 1 . . . A 1586 GLN C . 19117 1 874 . 1 1 79 79 GLN CA C 13 59.109 0.000 . 1 . . . A 1586 GLN CA . 19117 1 875 . 1 1 79 79 GLN CB C 13 28.402 0.000 . 1 . . . A 1586 GLN CB . 19117 1 876 . 1 1 79 79 GLN CG C 13 35.698 0.000 . 1 . . . A 1586 GLN CG . 19117 1 877 . 1 1 79 79 GLN N N 15 104.360 0.000 . 1 . . . A 1586 GLN N . 19117 1 878 . 1 1 79 79 GLN NE2 N 15 112.079 0.000 . 1 . . . A 1586 GLN NE2 . 19117 1 879 . 1 1 80 80 VAL H H 1 7.282 0.000 . 1 . . . A 1587 VAL H . 19117 1 880 . 1 1 80 80 VAL HA H 1 4.112 0.000 . 1 . . . A 1587 VAL HA . 19117 1 881 . 1 1 80 80 VAL HB H 1 1.759 0.000 . 1 . . . A 1587 VAL HB . 19117 1 882 . 1 1 80 80 VAL HG11 H 1 0.505 0.000 . 2 . . . A 1587 VAL HG11 . 19117 1 883 . 1 1 80 80 VAL HG12 H 1 0.505 0.000 . 2 . . . A 1587 VAL HG12 . 19117 1 884 . 1 1 80 80 VAL HG13 H 1 0.505 0.000 . 2 . . . A 1587 VAL HG13 . 19117 1 885 . 1 1 80 80 VAL HG21 H 1 0.536 0.000 . 2 . . . A 1587 VAL HG21 . 19117 1 886 . 1 1 80 80 VAL HG22 H 1 0.536 0.000 . 2 . . . A 1587 VAL HG22 . 19117 1 887 . 1 1 80 80 VAL HG23 H 1 0.536 0.000 . 2 . . . A 1587 VAL HG23 . 19117 1 888 . 1 1 80 80 VAL C C 13 175.038 0.000 . 1 . . . A 1587 VAL C . 19117 1 889 . 1 1 80 80 VAL CA C 13 61.182 0.000 . 1 . . . A 1587 VAL CA . 19117 1 890 . 1 1 80 80 VAL CB C 13 34.825 0.000 . 1 . . . A 1587 VAL CB . 19117 1 891 . 1 1 80 80 VAL CG1 C 13 21.406 0.000 . 1 . . . A 1587 VAL CG1 . 19117 1 892 . 1 1 80 80 VAL CG2 C 13 21.500 0.000 . 1 . . . A 1587 VAL CG2 . 19117 1 893 . 1 1 80 80 VAL N N 15 120.308 0.000 . 1 . . . A 1587 VAL N . 19117 1 894 . 1 1 81 81 LEU H H 1 7.825 0.000 . 1 . . . A 1588 LEU H . 19117 1 895 . 1 1 81 81 LEU HA H 1 5.033 0.000 . 1 . . . A 1588 LEU HA . 19117 1 896 . 1 1 81 81 LEU HB2 H 1 0.932 0.000 . 2 . . . A 1588 LEU HB2 . 19117 1 897 . 1 1 81 81 LEU HB3 H 1 1.395 0.000 . 2 . . . A 1588 LEU HB3 . 19117 1 898 . 1 1 81 81 LEU HG H 1 0.978 0.000 . 1 . . . A 1588 LEU HG . 19117 1 899 . 1 1 81 81 LEU HD11 H 1 -0.231 0.000 . 2 . . . A 1588 LEU HD11 . 19117 1 900 . 1 1 81 81 LEU HD12 H 1 -0.231 0.000 . 2 . . . A 1588 LEU HD12 . 19117 1 901 . 1 1 81 81 LEU HD13 H 1 -0.231 0.000 . 2 . . . A 1588 LEU HD13 . 19117 1 902 . 1 1 81 81 LEU HD21 H 1 0.073 0.000 . 2 . . . A 1588 LEU HD21 . 19117 1 903 . 1 1 81 81 LEU HD22 H 1 0.073 0.000 . 2 . . . A 1588 LEU HD22 . 19117 1 904 . 1 1 81 81 LEU HD23 H 1 0.073 0.000 . 2 . . . A 1588 LEU HD23 . 19117 1 905 . 1 1 81 81 LEU C C 13 177.890 0.000 . 1 . . . A 1588 LEU C . 19117 1 906 . 1 1 81 81 LEU CA C 13 52.855 0.000 . 1 . . . A 1588 LEU CA . 19117 1 907 . 1 1 81 81 LEU CB C 13 43.341 0.000 . 1 . . . A 1588 LEU CB . 19117 1 908 . 1 1 81 81 LEU CG C 13 27.662 0.000 . 1 . . . A 1588 LEU CG . 19117 1 909 . 1 1 81 81 LEU CD1 C 13 23.907 0.000 . 1 . . . A 1588 LEU CD1 . 19117 1 910 . 1 1 81 81 LEU CD2 C 13 25.967 0.000 . 1 . . . A 1588 LEU CD2 . 19117 1 911 . 1 1 81 81 LEU N N 15 122.110 0.000 . 1 . . . A 1588 LEU N . 19117 1 912 . 1 1 82 82 GLN H H 1 9.002 0.000 . 1 . . . A 1589 GLN H . 19117 1 913 . 1 1 82 82 GLN HA H 1 5.590 0.000 . 1 . . . A 1589 GLN HA . 19117 1 914 . 1 1 82 82 GLN HB2 H 1 1.461 0.000 . 2 . . . A 1589 GLN HB2 . 19117 1 915 . 1 1 82 82 GLN HB3 H 1 1.362 0.000 . 2 . . . A 1589 GLN HB3 . 19117 1 916 . 1 1 82 82 GLN HG2 H 1 1.787 0.000 . 2 . . . A 1589 GLN HG2 . 19117 1 917 . 1 1 82 82 GLN HG3 H 1 1.750 0.000 . 2 . . . A 1589 GLN HG3 . 19117 1 918 . 1 1 82 82 GLN HE21 H 1 6.307 0.000 . 1 . . . A 1589 GLN HE21 . 19117 1 919 . 1 1 82 82 GLN HE22 H 1 6.616 0.000 . 1 . . . A 1589 GLN HE22 . 19117 1 920 . 1 1 82 82 GLN C C 13 176.130 0.000 . 1 . . . A 1589 GLN C . 19117 1 921 . 1 1 82 82 GLN CA C 13 55.648 0.000 . 1 . . . A 1589 GLN CA . 19117 1 922 . 1 1 82 82 GLN CB C 13 35.843 0.000 . 1 . . . A 1589 GLN CB . 19117 1 923 . 1 1 82 82 GLN CG C 13 35.905 0.000 . 1 . . . A 1589 GLN CG . 19117 1 924 . 1 1 82 82 GLN N N 15 121.692 0.000 . 1 . . . A 1589 GLN N . 19117 1 925 . 1 1 82 82 GLN NE2 N 15 109.461 0.000 . 1 . . . A 1589 GLN NE2 . 19117 1 926 . 1 1 83 83 LEU H H 1 8.596 0.000 . 1 . . . A 1590 LEU H . 19117 1 927 . 1 1 83 83 LEU HA H 1 4.465 0.000 . 1 . . . A 1590 LEU HA . 19117 1 928 . 1 1 83 83 LEU HB2 H 1 1.062 0.000 . 2 . . . A 1590 LEU HB2 . 19117 1 929 . 1 1 83 83 LEU HB3 H 1 1.092 0.000 . 2 . . . A 1590 LEU HB3 . 19117 1 930 . 1 1 83 83 LEU HG H 1 1.195 0.000 . 1 . . . A 1590 LEU HG . 19117 1 931 . 1 1 83 83 LEU HD11 H 1 0.761 0.000 . 2 . . . A 1590 LEU HD11 . 19117 1 932 . 1 1 83 83 LEU HD12 H 1 0.761 0.000 . 2 . . . A 1590 LEU HD12 . 19117 1 933 . 1 1 83 83 LEU HD13 H 1 0.761 0.000 . 2 . . . A 1590 LEU HD13 . 19117 1 934 . 1 1 83 83 LEU HD21 H 1 0.634 0.000 . 2 . . . A 1590 LEU HD21 . 19117 1 935 . 1 1 83 83 LEU HD22 H 1 0.634 0.000 . 2 . . . A 1590 LEU HD22 . 19117 1 936 . 1 1 83 83 LEU HD23 H 1 0.634 0.000 . 2 . . . A 1590 LEU HD23 . 19117 1 937 . 1 1 83 83 LEU C C 13 175.605 0.000 . 1 . . . A 1590 LEU C . 19117 1 938 . 1 1 83 83 LEU CA C 13 54.312 0.000 . 1 . . . A 1590 LEU CA . 19117 1 939 . 1 1 83 83 LEU CB C 13 48.023 0.000 . 1 . . . A 1590 LEU CB . 19117 1 940 . 1 1 83 83 LEU CG C 13 26.222 0.000 . 1 . . . A 1590 LEU CG . 19117 1 941 . 1 1 83 83 LEU CD1 C 13 26.438 0.000 . 1 . . . A 1590 LEU CD1 . 19117 1 942 . 1 1 83 83 LEU CD2 C 13 24.966 0.000 . 1 . . . A 1590 LEU CD2 . 19117 1 943 . 1 1 83 83 LEU N N 15 126.163 0.000 . 1 . . . A 1590 LEU N . 19117 1 944 . 1 1 84 84 VAL H H 1 8.990 0.000 . 1 . . . A 1591 VAL H . 19117 1 945 . 1 1 84 84 VAL HA H 1 4.623 0.000 . 1 . . . A 1591 VAL HA . 19117 1 946 . 1 1 84 84 VAL HB H 1 1.694 0.000 . 1 . . . A 1591 VAL HB . 19117 1 947 . 1 1 84 84 VAL HG11 H 1 0.591 0.000 . 2 . . . A 1591 VAL HG11 . 19117 1 948 . 1 1 84 84 VAL HG12 H 1 0.591 0.000 . 2 . . . A 1591 VAL HG12 . 19117 1 949 . 1 1 84 84 VAL HG13 H 1 0.591 0.000 . 2 . . . A 1591 VAL HG13 . 19117 1 950 . 1 1 84 84 VAL HG21 H 1 0.481 0.000 . 2 . . . A 1591 VAL HG21 . 19117 1 951 . 1 1 84 84 VAL HG22 H 1 0.481 0.000 . 2 . . . A 1591 VAL HG22 . 19117 1 952 . 1 1 84 84 VAL HG23 H 1 0.481 0.000 . 2 . . . A 1591 VAL HG23 . 19117 1 953 . 1 1 84 84 VAL C C 13 177.215 0.000 . 1 . . . A 1591 VAL C . 19117 1 954 . 1 1 84 84 VAL CA C 13 61.640 0.000 . 1 . . . A 1591 VAL CA . 19117 1 955 . 1 1 84 84 VAL CB C 13 34.613 0.000 . 1 . . . A 1591 VAL CB . 19117 1 956 . 1 1 84 84 VAL CG1 C 13 21.676 0.000 . 1 . . . A 1591 VAL CG1 . 19117 1 957 . 1 1 84 84 VAL CG2 C 13 21.123 0.000 . 1 . . . A 1591 VAL CG2 . 19117 1 958 . 1 1 84 84 VAL N N 15 122.656 0.000 . 1 . . . A 1591 VAL N . 19117 1 959 . 1 1 85 85 TYR H H 1 9.050 0.000 . 1 . . . A 1592 TYR H . 19117 1 960 . 1 1 85 85 TYR HA H 1 4.879 0.000 . 1 . . . A 1592 TYR HA . 19117 1 961 . 1 1 85 85 TYR HB2 H 1 2.813 0.000 . 2 . . . A 1592 TYR HB2 . 19117 1 962 . 1 1 85 85 TYR HB3 H 1 2.542 0.000 . 2 . . . A 1592 TYR HB3 . 19117 1 963 . 1 1 85 85 TYR HD1 H 1 6.493 0.000 . 3 . . . A 1592 TYR HD1 . 19117 1 964 . 1 1 85 85 TYR HD2 H 1 6.493 0.000 . 1 . . . A 1592 TYR HD2 . 19117 1 965 . 1 1 85 85 TYR HE1 H 1 6.602 0.000 . 3 . . . A 1592 TYR HE1 . 19117 1 966 . 1 1 85 85 TYR HE2 H 1 6.602 0.000 . 3 . . . A 1592 TYR HE2 . 19117 1 967 . 1 1 85 85 TYR HH H 1 9.901 0.000 . 1 . . . A 1592 TYR HH . 19117 1 968 . 1 1 85 85 TYR C C 13 175.198 0.000 . 1 . . . A 1592 TYR C . 19117 1 969 . 1 1 85 85 TYR CA C 13 52.914 0.000 . 1 . . . A 1592 TYR CA . 19117 1 970 . 1 1 85 85 TYR CB C 13 38.581 0.000 . 1 . . . A 1592 TYR CB . 19117 1 971 . 1 1 85 85 TYR CD1 C 13 134.047 0.000 . 3 . . . A 1592 TYR CD1 . 19117 1 972 . 1 1 85 85 TYR CD2 C 13 134.047 0.000 . 3 . . . A 1592 TYR CD2 . 19117 1 973 . 1 1 85 85 TYR N N 15 129.344 0.000 . 1 . . . A 1592 TYR N . 19117 1 974 . 1 1 86 86 LYS H H 1 8.573 0.000 . 1 . . . A 1593 LYS H . 19117 1 975 . 1 1 86 86 LYS HA H 1 4.657 0.000 . 1 . . . A 1593 LYS HA . 19117 1 976 . 1 1 86 86 LYS HB2 H 1 1.570 0.000 . 2 . . . A 1593 LYS HB2 . 19117 1 977 . 1 1 86 86 LYS HB3 H 1 1.414 0.000 . 2 . . . A 1593 LYS HB3 . 19117 1 978 . 1 1 86 86 LYS HG2 H 1 1.078 0.000 . 2 . . . A 1593 LYS HG2 . 19117 1 979 . 1 1 86 86 LYS HG3 H 1 1.095 0.000 . 2 . . . A 1593 LYS HG3 . 19117 1 980 . 1 1 86 86 LYS HD2 H 1 1.385 0.000 . 1 . . . A 1593 LYS HD2 . 19117 1 981 . 1 1 86 86 LYS HD3 H 1 1.428 0.000 . 1 . . . A 1593 LYS HD3 . 19117 1 982 . 1 1 86 86 LYS HE2 H 1 2.559 0.000 . 1 . . . A 1593 LYS HE2 . 19117 1 983 . 1 1 86 86 LYS HE3 H 1 2.656 0.000 . 1 . . . A 1593 LYS HE3 . 19117 1 984 . 1 1 86 86 LYS C C 13 176.058 0.000 . 1 . . . A 1593 LYS C . 19117 1 985 . 1 1 86 86 LYS CA C 13 55.067 0.000 . 1 . . . A 1593 LYS CA . 19117 1 986 . 1 1 86 86 LYS CB C 13 36.004 0.000 . 1 . . . A 1593 LYS CB . 19117 1 987 . 1 1 86 86 LYS CG C 13 25.210 0.000 . 1 . . . A 1593 LYS CG . 19117 1 988 . 1 1 86 86 LYS CD C 13 30.386 0.000 . 1 . . . A 1593 LYS CD . 19117 1 989 . 1 1 86 86 LYS CE C 13 42.527 0.000 . 1 . . . A 1593 LYS CE . 19117 1 990 . 1 1 86 86 LYS N N 15 122.256 0.000 . 1 . . . A 1593 LYS N . 19117 1 991 . 1 1 87 87 ASP H H 1 8.739 0.000 . 1 . . . A 1594 ASP H . 19117 1 992 . 1 1 87 87 ASP HA H 1 3.991 0.000 . 1 . . . A 1594 ASP HA . 19117 1 993 . 1 1 87 87 ASP HB2 H 1 2.612 0.000 . 2 . . . A 1594 ASP HB2 . 19117 1 994 . 1 1 87 87 ASP HB3 H 1 2.576 0.000 . 2 . . . A 1594 ASP HB3 . 19117 1 995 . 1 1 87 87 ASP C C 13 177.516 0.000 . 1 . . . A 1594 ASP C . 19117 1 996 . 1 1 87 87 ASP CA C 13 56.310 0.000 . 1 . . . A 1594 ASP CA . 19117 1 997 . 1 1 87 87 ASP CB C 13 39.148 0.000 . 1 . . . A 1594 ASP CB . 19117 1 998 . 1 1 87 87 ASP N N 15 115.762 0.000 . 1 . . . A 1594 ASP N . 19117 1 999 . 1 1 88 88 GLY H H 1 7.585 0.000 . 1 . . . A 1595 GLY H . 19117 1 1000 . 1 1 88 88 GLY HA2 H 1 3.187 0.000 . 1 . . . A 1595 GLY HA2 . 19117 1 1001 . 1 1 88 88 GLY HA3 H 1 3.885 0.000 . 1 . . . A 1595 GLY HA3 . 19117 1 1002 . 1 1 88 88 GLY C C 13 173.140 0.000 . 1 . . . A 1595 GLY C . 19117 1 1003 . 1 1 88 88 GLY CA C 13 45.481 0.000 . 1 . . . A 1595 GLY CA . 19117 1 1004 . 1 1 88 88 GLY N N 15 103.173 0.000 . 1 . . . A 1595 GLY N . 19117 1 1005 . 1 1 89 89 SER H H 1 8.673 0.000 . 1 . . . A 1596 SER H . 19117 1 1006 . 1 1 89 89 SER HA H 1 4.312 0.000 . 1 . . . A 1596 SER HA . 19117 1 1007 . 1 1 89 89 SER HB2 H 1 3.834 0.000 . 2 . . . A 1596 SER HB2 . 19117 1 1008 . 1 1 89 89 SER HB3 H 1 3.624 0.000 . 2 . . . A 1596 SER HB3 . 19117 1 1009 . 1 1 89 89 SER CA C 13 60.439 0.000 . 1 . . . A 1596 SER CA . 19117 1 1010 . 1 1 89 89 SER CB C 13 63.003 0.000 . 1 . . . A 1596 SER CB . 19117 1 1011 . 1 1 89 89 SER N N 15 116.343 0.000 . 1 . . . A 1596 SER N . 19117 1 1012 . 1 1 90 90 PRO HA H 1 4.023 0.000 . 1 . . . A 1597 PRO HA . 19117 1 1013 . 1 1 90 90 PRO HB2 H 1 1.407 0.000 . 2 . . . A 1597 PRO HB2 . 19117 1 1014 . 1 1 90 90 PRO HB3 H 1 1.938 0.000 . 2 . . . A 1597 PRO HB3 . 19117 1 1015 . 1 1 90 90 PRO HG2 H 1 1.752 0.000 . 2 . . . A 1597 PRO HG2 . 19117 1 1016 . 1 1 90 90 PRO HG3 H 1 1.632 0.000 . 2 . . . A 1597 PRO HG3 . 19117 1 1017 . 1 1 90 90 PRO HD2 H 1 3.391 0.000 . 1 . . . A 1597 PRO HD2 . 19117 1 1018 . 1 1 90 90 PRO HD3 H 1 3.267 0.000 . 1 . . . A 1597 PRO HD3 . 19117 1 1019 . 1 1 90 90 PRO C C 13 175.939 0.000 . 1 . . . A 1597 PRO C . 19117 1 1020 . 1 1 90 90 PRO CA C 13 64.305 0.000 . 1 . . . A 1597 PRO CA . 19117 1 1021 . 1 1 90 90 PRO CB C 13 32.567 0.000 . 1 . . . A 1597 PRO CB . 19117 1 1022 . 1 1 90 90 PRO CG C 13 28.027 0.000 . 1 . . . A 1597 PRO CG . 19117 1 1023 . 1 1 91 91 CYS H H 1 8.017 0.000 . 1 . . . A 1598 CYS H . 19117 1 1024 . 1 1 91 91 CYS HA H 1 4.360 0.000 . 1 . . . A 1598 CYS HA . 19117 1 1025 . 1 1 91 91 CYS CA C 13 52.629 0.000 . 1 . . . A 1598 CYS CA . 19117 1 1026 . 1 1 91 91 CYS N N 15 121.694 0.000 . 1 . . . A 1598 CYS N . 19117 1 1027 . 1 1 92 92 PRO HA H 1 4.162 0.000 . 1 . . . A 1599 PRO HA . 19117 1 1028 . 1 1 92 92 PRO HB2 H 1 1.531 0.000 . 2 . . . A 1599 PRO HB2 . 19117 1 1029 . 1 1 92 92 PRO HB3 H 1 1.883 0.000 . 2 . . . A 1599 PRO HB3 . 19117 1 1030 . 1 1 92 92 PRO HD3 H 1 2.719 0.000 . 1 . . . A 1599 PRO HD3 . 19117 1 1031 . 1 1 92 92 PRO C C 13 176.050 0.000 . 1 . . . A 1599 PRO C . 19117 1 1032 . 1 1 92 92 PRO CA C 13 63.971 0.000 . 1 . . . A 1599 PRO CA . 19117 1 1033 . 1 1 92 92 PRO CB C 13 29.562 0.000 . 1 . . . A 1599 PRO CB . 19117 1 1034 . 1 1 92 92 PRO CD C 13 47.735 0.000 . 1 . . . A 1599 PRO CD . 19117 1 1035 . 1 1 93 93 SER H H 1 7.836 0.000 . 1 . . . A 1600 SER H . 19117 1 1036 . 1 1 93 93 SER HA H 1 4.326 0.000 . 1 . . . A 1600 SER HA . 19117 1 1037 . 1 1 93 93 SER HB2 H 1 4.390 0.000 . 2 . . . A 1600 SER HB2 . 19117 1 1038 . 1 1 93 93 SER HB3 H 1 3.530 0.000 . 2 . . . A 1600 SER HB3 . 19117 1 1039 . 1 1 93 93 SER C C 13 175.156 0.000 . 1 . . . A 1600 SER C . 19117 1 1040 . 1 1 93 93 SER CA C 13 58.373 0.000 . 1 . . . A 1600 SER CA . 19117 1 1041 . 1 1 93 93 SER CB C 13 65.336 0.000 . 1 . . . A 1600 SER CB . 19117 1 1042 . 1 1 93 93 SER N N 15 123.224 0.000 . 1 . . . A 1600 SER N . 19117 1 1043 . 1 1 94 94 LYS H H 1 9.009 0.000 . 1 . . . A 1601 LYS H . 19117 1 1044 . 1 1 94 94 LYS HA H 1 3.995 0.000 . 1 . . . A 1601 LYS HA . 19117 1 1045 . 1 1 94 94 LYS HB2 H 1 1.515 0.000 . 2 . . . A 1601 LYS HB2 . 19117 1 1046 . 1 1 94 94 LYS HB3 H 1 1.604 0.000 . 2 . . . A 1601 LYS HB3 . 19117 1 1047 . 1 1 94 94 LYS HG2 H 1 1.138 0.000 . 2 . . . A 1601 LYS HG2 . 19117 1 1048 . 1 1 94 94 LYS HG3 H 1 1.078 0.000 . 2 . . . A 1601 LYS HG3 . 19117 1 1049 . 1 1 94 94 LYS HD2 H 1 1.355 0.000 . 1 . . . A 1601 LYS HD2 . 19117 1 1050 . 1 1 94 94 LYS HD3 H 1 1.337 0.000 . 1 . . . A 1601 LYS HD3 . 19117 1 1051 . 1 1 94 94 LYS HE2 H 1 2.630 0.000 . 1 . . . A 1601 LYS HE2 . 19117 1 1052 . 1 1 94 94 LYS HE3 H 1 2.725 0.000 . 1 . . . A 1601 LYS HE3 . 19117 1 1053 . 1 1 94 94 LYS C C 13 178.604 0.000 . 1 . . . A 1601 LYS C . 19117 1 1054 . 1 1 94 94 LYS CA C 13 58.902 0.000 . 1 . . . A 1601 LYS CA . 19117 1 1055 . 1 1 94 94 LYS CB C 13 32.888 0.000 . 1 . . . A 1601 LYS CB . 19117 1 1056 . 1 1 94 94 LYS CG C 13 26.027 0.000 . 1 . . . A 1601 LYS CG . 19117 1 1057 . 1 1 94 94 LYS CD C 13 29.800 0.000 . 1 . . . A 1601 LYS CD . 19117 1 1058 . 1 1 94 94 LYS CE C 13 42.825 0.000 . 1 . . . A 1601 LYS CE . 19117 1 1059 . 1 1 94 94 LYS N N 15 125.377 0.000 . 1 . . . A 1601 LYS N . 19117 1 1060 . 1 1 95 95 SER H H 1 7.806 0.000 . 1 . . . A 1602 SER H . 19117 1 1061 . 1 1 95 95 SER HA H 1 4.265 0.000 . 1 . . . A 1602 SER HA . 19117 1 1062 . 1 1 95 95 SER HB2 H 1 3.490 0.000 . 2 . . . A 1602 SER HB2 . 19117 1 1063 . 1 1 95 95 SER HB3 H 1 3.523 0.000 . 2 . . . A 1602 SER HB3 . 19117 1 1064 . 1 1 95 95 SER C C 13 175.765 0.000 . 1 . . . A 1602 SER C . 19117 1 1065 . 1 1 95 95 SER CA C 13 58.340 0.000 . 1 . . . A 1602 SER CA . 19117 1 1066 . 1 1 95 95 SER CB C 13 64.280 0.000 . 1 . . . A 1602 SER CB . 19117 1 1067 . 1 1 95 95 SER N N 15 111.332 0.000 . 1 . . . A 1602 SER N . 19117 1 1068 . 1 1 96 96 GLY H H 1 7.339 0.000 . 1 . . . A 1603 GLY H . 19117 1 1069 . 1 1 96 96 GLY HA2 H 1 3.492 0.000 . 1 . . . A 1603 GLY HA2 . 19117 1 1070 . 1 1 96 96 GLY HA3 H 1 3.651 0.000 . 1 . . . A 1603 GLY HA3 . 19117 1 1071 . 1 1 96 96 GLY C C 13 175.985 0.000 . 1 . . . A 1603 GLY C . 19117 1 1072 . 1 1 96 96 GLY CA C 13 47.968 0.000 . 1 . . . A 1603 GLY CA . 19117 1 1073 . 1 1 96 96 GLY N N 15 110.284 0.000 . 1 . . . A 1603 GLY N . 19117 1 1074 . 1 1 97 97 LEU H H 1 7.061 0.000 . 1 . . . A 1604 LEU H . 19117 1 1075 . 1 1 97 97 LEU HA H 1 3.986 0.000 . 1 . . . A 1604 LEU HA . 19117 1 1076 . 1 1 97 97 LEU HB2 H 1 1.027 0.000 . 2 . . . A 1604 LEU HB2 . 19117 1 1077 . 1 1 97 97 LEU HB3 H 1 1.318 0.000 . 2 . . . A 1604 LEU HB3 . 19117 1 1078 . 1 1 97 97 LEU HG H 1 1.162 0.000 . 1 . . . A 1604 LEU HG . 19117 1 1079 . 1 1 97 97 LEU HD11 H 1 0.469 0.000 . 2 . . . A 1604 LEU HD11 . 19117 1 1080 . 1 1 97 97 LEU HD12 H 1 0.469 0.000 . 2 . . . A 1604 LEU HD12 . 19117 1 1081 . 1 1 97 97 LEU HD13 H 1 0.469 0.000 . 2 . . . A 1604 LEU HD13 . 19117 1 1082 . 1 1 97 97 LEU HD21 H 1 0.498 0.000 . 2 . . . A 1604 LEU HD21 . 19117 1 1083 . 1 1 97 97 LEU HD22 H 1 0.498 0.000 . 2 . . . A 1604 LEU HD22 . 19117 1 1084 . 1 1 97 97 LEU HD23 H 1 0.498 0.000 . 2 . . . A 1604 LEU HD23 . 19117 1 1085 . 1 1 97 97 LEU C C 13 176.908 0.000 . 1 . . . A 1604 LEU C . 19117 1 1086 . 1 1 97 97 LEU CA C 13 55.076 0.000 . 1 . . . A 1604 LEU CA . 19117 1 1087 . 1 1 97 97 LEU CB C 13 44.026 0.000 . 1 . . . A 1604 LEU CB . 19117 1 1088 . 1 1 97 97 LEU CG C 13 26.327 0.000 . 1 . . . A 1604 LEU CG . 19117 1 1089 . 1 1 97 97 LEU CD1 C 13 22.709 0.000 . 1 . . . A 1604 LEU CD1 . 19117 1 1090 . 1 1 97 97 LEU CD2 C 13 26.713 0.000 . 1 . . . A 1604 LEU CD2 . 19117 1 1091 . 1 1 97 97 LEU N N 15 118.525 0.000 . 1 . . . A 1604 LEU N . 19117 1 1092 . 1 1 98 98 SER H H 1 7.638 0.000 . 1 . . . A 1605 SER H . 19117 1 1093 . 1 1 98 98 SER HA H 1 4.510 0.000 . 1 . . . A 1605 SER HA . 19117 1 1094 . 1 1 98 98 SER HB2 H 1 3.278 0.000 . 2 . . . A 1605 SER HB2 . 19117 1 1095 . 1 1 98 98 SER HB3 H 1 3.391 0.000 . 2 . . . A 1605 SER HB3 . 19117 1 1096 . 1 1 98 98 SER C C 13 174.772 0.000 . 1 . . . A 1605 SER C . 19117 1 1097 . 1 1 98 98 SER CA C 13 57.305 0.000 . 1 . . . A 1605 SER CA . 19117 1 1098 . 1 1 98 98 SER CB C 13 66.654 0.000 . 1 . . . A 1605 SER CB . 19117 1 1099 . 1 1 98 98 SER N N 15 115.118 0.000 . 1 . . . A 1605 SER N . 19117 1 1100 . 1 1 99 99 TYR H H 1 8.026 0.000 . 1 . . . A 1606 TYR H . 19117 1 1101 . 1 1 99 99 TYR HA H 1 4.723 0.000 . 1 . . . A 1606 TYR HA . 19117 1 1102 . 1 1 99 99 TYR HB2 H 1 2.568 0.000 . 2 . . . A 1606 TYR HB2 . 19117 1 1103 . 1 1 99 99 TYR HB3 H 1 2.616 0.000 . 2 . . . A 1606 TYR HB3 . 19117 1 1104 . 1 1 99 99 TYR HD1 H 1 6.703 0.000 . 3 . . . A 1606 TYR HD1 . 19117 1 1105 . 1 1 99 99 TYR HD2 H 1 6.703 0.000 . 1 . . . A 1606 TYR HD2 . 19117 1 1106 . 1 1 99 99 TYR HE1 H 1 6.594 0.000 . 3 . . . A 1606 TYR HE1 . 19117 1 1107 . 1 1 99 99 TYR HE2 H 1 6.594 0.000 . 3 . . . A 1606 TYR HE2 . 19117 1 1108 . 1 1 99 99 TYR C C 13 176.742 0.000 . 1 . . . A 1606 TYR C . 19117 1 1109 . 1 1 99 99 TYR CA C 13 60.744 0.000 . 1 . . . A 1606 TYR CA . 19117 1 1110 . 1 1 99 99 TYR CB C 13 42.686 0.000 . 1 . . . A 1606 TYR CB . 19117 1 1111 . 1 1 99 99 TYR N N 15 119.507 0.000 . 1 . . . A 1606 TYR N . 19117 1 1112 . 1 1 100 100 LYS H H 1 7.933 0.000 . 1 . . . A 1607 LYS H . 19117 1 1113 . 1 1 100 100 LYS HA H 1 4.690 0.000 . 1 . . . A 1607 LYS HA . 19117 1 1114 . 1 1 100 100 LYS HB2 H 1 1.605 0.000 . 2 . . . A 1607 LYS HB2 . 19117 1 1115 . 1 1 100 100 LYS HB3 H 1 1.581 0.000 . 2 . . . A 1607 LYS HB3 . 19117 1 1116 . 1 1 100 100 LYS HG2 H 1 1.179 0.000 . 2 . . . A 1607 LYS HG2 . 19117 1 1117 . 1 1 100 100 LYS HG3 H 1 0.942 0.000 . 2 . . . A 1607 LYS HG3 . 19117 1 1118 . 1 1 100 100 LYS HD2 H 1 1.193 0.000 . 1 . . . A 1607 LYS HD2 . 19117 1 1119 . 1 1 100 100 LYS HD3 H 1 1.229 0.000 . 1 . . . A 1607 LYS HD3 . 19117 1 1120 . 1 1 100 100 LYS HE2 H 1 2.579 0.000 . 1 . . . A 1607 LYS HE2 . 19117 1 1121 . 1 1 100 100 LYS HE3 H 1 2.535 0.000 . 1 . . . A 1607 LYS HE3 . 19117 1 1122 . 1 1 100 100 LYS C C 13 175.492 0.000 . 1 . . . A 1607 LYS C . 19117 1 1123 . 1 1 100 100 LYS CA C 13 55.573 0.000 . 1 . . . A 1607 LYS CA . 19117 1 1124 . 1 1 100 100 LYS CB C 13 37.050 0.000 . 1 . . . A 1607 LYS CB . 19117 1 1125 . 1 1 100 100 LYS CG C 13 24.298 0.000 . 1 . . . A 1607 LYS CG . 19117 1 1126 . 1 1 100 100 LYS CD C 13 30.292 0.000 . 1 . . . A 1607 LYS CD . 19117 1 1127 . 1 1 100 100 LYS CE C 13 42.416 0.000 . 1 . . . A 1607 LYS CE . 19117 1 1128 . 1 1 100 100 LYS N N 15 116.832 0.000 . 1 . . . A 1607 LYS N . 19117 1 1129 . 1 1 101 101 SER H H 1 8.907 0.000 . 1 . . . A 1608 SER H . 19117 1 1130 . 1 1 101 101 SER HA H 1 5.275 0.000 . 1 . . . A 1608 SER HA . 19117 1 1131 . 1 1 101 101 SER HB2 H 1 3.309 0.000 . 2 . . . A 1608 SER HB2 . 19117 1 1132 . 1 1 101 101 SER HB3 H 1 3.410 0.000 . 2 . . . A 1608 SER HB3 . 19117 1 1133 . 1 1 101 101 SER C C 13 173.025 0.000 . 1 . . . A 1608 SER C . 19117 1 1134 . 1 1 101 101 SER CA C 13 59.500 0.000 . 1 . . . A 1608 SER CA . 19117 1 1135 . 1 1 101 101 SER CB C 13 67.553 0.000 . 1 . . . A 1608 SER CB . 19117 1 1136 . 1 1 101 101 SER N N 15 116.987 0.000 . 1 . . . A 1608 SER N . 19117 1 1137 . 1 1 102 102 VAL H H 1 8.831 0.000 . 1 . . . A 1609 VAL H . 19117 1 1138 . 1 1 102 102 VAL HA H 1 4.109 0.000 . 1 . . . A 1609 VAL HA . 19117 1 1139 . 1 1 102 102 VAL HB H 1 1.566 0.000 . 1 . . . A 1609 VAL HB . 19117 1 1140 . 1 1 102 102 VAL HG11 H 1 0.533 0.000 . 2 . . . A 1609 VAL HG11 . 19117 1 1141 . 1 1 102 102 VAL HG12 H 1 0.533 0.000 . 2 . . . A 1609 VAL HG12 . 19117 1 1142 . 1 1 102 102 VAL HG13 H 1 0.533 0.000 . 2 . . . A 1609 VAL HG13 . 19117 1 1143 . 1 1 102 102 VAL HG21 H 1 0.321 0.000 . 2 . . . A 1609 VAL HG21 . 19117 1 1144 . 1 1 102 102 VAL HG22 H 1 0.321 0.000 . 2 . . . A 1609 VAL HG22 . 19117 1 1145 . 1 1 102 102 VAL HG23 H 1 0.321 0.000 . 2 . . . A 1609 VAL HG23 . 19117 1 1146 . 1 1 102 102 VAL C C 13 175.854 0.000 . 1 . . . A 1609 VAL C . 19117 1 1147 . 1 1 102 102 VAL CA C 13 61.989 0.000 . 1 . . . A 1609 VAL CA . 19117 1 1148 . 1 1 102 102 VAL CB C 13 33.456 0.000 . 1 . . . A 1609 VAL CB . 19117 1 1149 . 1 1 102 102 VAL CG1 C 13 21.405 0.000 . 1 . . . A 1609 VAL CG1 . 19117 1 1150 . 1 1 102 102 VAL CG2 C 13 21.094 0.000 . 1 . . . A 1609 VAL CG2 . 19117 1 1151 . 1 1 102 102 VAL N N 15 125.411 0.000 . 1 . . . A 1609 VAL N . 19117 1 1152 . 1 1 103 103 ILE H H 1 8.973 0.000 . 1 . . . A 1610 ILE H . 19117 1 1153 . 1 1 103 103 ILE HA H 1 4.003 0.000 . 1 . . . A 1610 ILE HA . 19117 1 1154 . 1 1 103 103 ILE HB H 1 1.197 0.000 . 1 . . . A 1610 ILE HB . 19117 1 1155 . 1 1 103 103 ILE HG12 H 1 -0.023 0.000 . 2 . . . A 1610 ILE HG12 . 19117 1 1156 . 1 1 103 103 ILE HG13 H 1 0.775 0.000 . 2 . . . A 1610 ILE HG13 . 19117 1 1157 . 1 1 103 103 ILE HG21 H 1 -0.200 0.000 . 1 . . . A 1610 ILE HG21 . 19117 1 1158 . 1 1 103 103 ILE HG22 H 1 -0.200 0.000 . 1 . . . A 1610 ILE HG22 . 19117 1 1159 . 1 1 103 103 ILE HG23 H 1 -0.200 0.000 . 1 . . . A 1610 ILE HG23 . 19117 1 1160 . 1 1 103 103 ILE HD11 H 1 -0.197 0.000 . 1 . . . A 1610 ILE HD11 . 19117 1 1161 . 1 1 103 103 ILE HD12 H 1 -0.197 0.000 . 1 . . . A 1610 ILE HD12 . 19117 1 1162 . 1 1 103 103 ILE HD13 H 1 -0.197 0.000 . 1 . . . A 1610 ILE HD13 . 19117 1 1163 . 1 1 103 103 ILE C C 13 175.160 0.000 . 1 . . . A 1610 ILE C . 19117 1 1164 . 1 1 103 103 ILE CA C 13 61.650 0.000 . 1 . . . A 1610 ILE CA . 19117 1 1165 . 1 1 103 103 ILE CB C 13 40.404 0.000 . 1 . . . A 1610 ILE CB . 19117 1 1166 . 1 1 103 103 ILE CG1 C 13 28.120 0.000 . 1 . . . A 1610 ILE CG1 . 19117 1 1167 . 1 1 103 103 ILE CG2 C 13 18.943 0.000 . 1 . . . A 1610 ILE CG2 . 19117 1 1168 . 1 1 103 103 ILE CD1 C 13 14.312 0.000 . 1 . . . A 1610 ILE CD1 . 19117 1 1169 . 1 1 103 103 ILE N N 15 129.478 0.000 . 1 . . . A 1610 ILE N . 19117 1 1170 . 1 1 104 104 SER H H 1 7.824 0.000 . 1 . . . A 1611 SER H . 19117 1 1171 . 1 1 104 104 SER HA H 1 4.978 0.000 . 1 . . . A 1611 SER HA . 19117 1 1172 . 1 1 104 104 SER HB2 H 1 3.486 0.000 . 2 . . . A 1611 SER HB2 . 19117 1 1173 . 1 1 104 104 SER HB3 H 1 3.226 0.000 . 2 . . . A 1611 SER HB3 . 19117 1 1174 . 1 1 104 104 SER C C 13 173.151 0.000 . 1 . . . A 1611 SER C . 19117 1 1175 . 1 1 104 104 SER CA C 13 58.093 0.000 . 1 . . . A 1611 SER CA . 19117 1 1176 . 1 1 104 104 SER CB C 13 64.901 0.000 . 1 . . . A 1611 SER CB . 19117 1 1177 . 1 1 104 104 SER N N 15 121.808 0.000 . 1 . . . A 1611 SER N . 19117 1 1178 . 1 1 105 105 PHE H H 1 9.285 0.000 . 1 . . . A 1612 PHE H . 19117 1 1179 . 1 1 105 105 PHE HA H 1 5.017 0.000 . 1 . . . A 1612 PHE HA . 19117 1 1180 . 1 1 105 105 PHE HB2 H 1 2.500 0.000 . 2 . . . A 1612 PHE HB2 . 19117 1 1181 . 1 1 105 105 PHE HB3 H 1 2.061 0.000 . 2 . . . A 1612 PHE HB3 . 19117 1 1182 . 1 1 105 105 PHE HD1 H 1 6.315 0.000 . 3 . . . A 1612 PHE HD1 . 19117 1 1183 . 1 1 105 105 PHE HD2 H 1 6.315 0.000 . 1 . . . A 1612 PHE HD2 . 19117 1 1184 . 1 1 105 105 PHE HE1 H 1 6.476 0.000 . 3 . . . A 1612 PHE HE1 . 19117 1 1185 . 1 1 105 105 PHE HE2 H 1 6.476 0.000 . 3 . . . A 1612 PHE HE2 . 19117 1 1186 . 1 1 105 105 PHE HZ H 1 6.064 0.000 . 1 . . . A 1612 PHE HZ . 19117 1 1187 . 1 1 105 105 PHE C C 13 175.040 0.000 . 1 . . . A 1612 PHE C . 19117 1 1188 . 1 1 105 105 PHE CA C 13 56.806 0.000 . 1 . . . A 1612 PHE CA . 19117 1 1189 . 1 1 105 105 PHE CB C 13 39.685 0.000 . 1 . . . A 1612 PHE CB . 19117 1 1190 . 1 1 105 105 PHE CD1 C 13 132.582 0.000 . 3 . . . A 1612 PHE CD1 . 19117 1 1191 . 1 1 105 105 PHE CD2 C 13 132.582 0.000 . 3 . . . A 1612 PHE CD2 . 19117 1 1192 . 1 1 105 105 PHE N N 15 124.539 0.000 . 1 . . . A 1612 PHE N . 19117 1 1193 . 1 1 106 106 VAL H H 1 7.972 0.000 . 1 . . . A 1613 VAL H . 19117 1 1194 . 1 1 106 106 VAL HA H 1 4.058 0.000 . 1 . . . A 1613 VAL HA . 19117 1 1195 . 1 1 106 106 VAL HB H 1 0.959 0.000 . 1 . . . A 1613 VAL HB . 19117 1 1196 . 1 1 106 106 VAL HG11 H 1 0.504 0.000 . 2 . . . A 1613 VAL HG11 . 19117 1 1197 . 1 1 106 106 VAL HG12 H 1 0.504 0.000 . 2 . . . A 1613 VAL HG12 . 19117 1 1198 . 1 1 106 106 VAL HG13 H 1 0.504 0.000 . 2 . . . A 1613 VAL HG13 . 19117 1 1199 . 1 1 106 106 VAL HG21 H 1 0.277 0.000 . 2 . . . A 1613 VAL HG21 . 19117 1 1200 . 1 1 106 106 VAL HG22 H 1 0.277 0.000 . 2 . . . A 1613 VAL HG22 . 19117 1 1201 . 1 1 106 106 VAL HG23 H 1 0.277 0.000 . 2 . . . A 1613 VAL HG23 . 19117 1 1202 . 1 1 106 106 VAL C C 13 176.151 0.000 . 1 . . . A 1613 VAL C . 19117 1 1203 . 1 1 106 106 VAL CA C 13 60.413 0.000 . 1 . . . A 1613 VAL CA . 19117 1 1204 . 1 1 106 106 VAL CB C 13 35.845 0.000 . 1 . . . A 1613 VAL CB . 19117 1 1205 . 1 1 106 106 VAL CG1 C 13 21.773 0.000 . 1 . . . A 1613 VAL CG1 . 19117 1 1206 . 1 1 106 106 VAL CG2 C 13 20.467 0.000 . 1 . . . A 1613 VAL CG2 . 19117 1 1207 . 1 1 106 106 VAL N N 15 120.550 0.000 . 1 . . . A 1613 VAL N . 19117 1 1208 . 1 1 107 107 CYS H H 1 8.807 0.000 . 1 . . . A 1614 CYS H . 19117 1 1209 . 1 1 107 107 CYS HA H 1 4.058 0.000 . 1 . . . A 1614 CYS HA . 19117 1 1210 . 1 1 107 107 CYS HB2 H 1 2.468 0.000 . 2 . . . A 1614 CYS HB2 . 19117 1 1211 . 1 1 107 107 CYS HB3 H 1 2.752 0.000 . 2 . . . A 1614 CYS HB3 . 19117 1 1212 . 1 1 107 107 CYS C C 13 175.861 0.000 . 1 . . . A 1614 CYS C . 19117 1 1213 . 1 1 107 107 CYS CA C 13 57.662 0.000 . 1 . . . A 1614 CYS CA . 19117 1 1214 . 1 1 107 107 CYS CB C 13 39.415 0.000 . 1 . . . A 1614 CYS CB . 19117 1 1215 . 1 1 107 107 CYS N N 15 124.104 0.000 . 1 . . . A 1614 CYS N . 19117 1 1216 . 1 1 108 108 ARG H H 1 6.841 0.000 . 1 . . . A 1615 ARG H . 19117 1 1217 . 1 1 108 108 ARG HA H 1 4.391 0.000 . 1 . . . A 1615 ARG HA . 19117 1 1218 . 1 1 108 108 ARG HB2 H 1 1.406 0.000 . 2 . . . A 1615 ARG HB2 . 19117 1 1219 . 1 1 108 108 ARG HB3 H 1 1.309 0.000 . 2 . . . A 1615 ARG HB3 . 19117 1 1220 . 1 1 108 108 ARG HG2 H 1 1.293 0.000 . 2 . . . A 1615 ARG HG2 . 19117 1 1221 . 1 1 108 108 ARG HG3 H 1 1.313 0.000 . 2 . . . A 1615 ARG HG3 . 19117 1 1222 . 1 1 108 108 ARG HD2 H 1 2.810 0.000 . 1 . . . A 1615 ARG HD2 . 19117 1 1223 . 1 1 108 108 ARG HD3 H 1 2.922 0.000 . 1 . . . A 1615 ARG HD3 . 19117 1 1224 . 1 1 108 108 ARG HE H 1 6.821 0.000 . 1 . . . A 1615 ARG HE . 19117 1 1225 . 1 1 108 108 ARG CA C 13 54.370 0.000 . 1 . . . A 1615 ARG CA . 19117 1 1226 . 1 1 108 108 ARG CB C 13 34.070 0.000 . 1 . . . A 1615 ARG CB . 19117 1 1227 . 1 1 108 108 ARG CG C 13 27.699 0.000 . 1 . . . A 1615 ARG CG . 19117 1 1228 . 1 1 108 108 ARG CD C 13 44.019 0.000 . 1 . . . A 1615 ARG CD . 19117 1 1229 . 1 1 108 108 ARG N N 15 130.722 0.000 . 1 . . . A 1615 ARG N . 19117 1 1230 . 1 1 108 108 ARG NE N 15 85.043 0.000 . 1 . . . A 1615 ARG NE . 19117 1 1231 . 1 1 109 109 PRO HA H 1 4.004 0.000 . 1 . . . A 1616 PRO HA . 19117 1 1232 . 1 1 109 109 PRO HB2 H 1 1.697 0.000 . 2 . . . A 1616 PRO HB2 . 19117 1 1233 . 1 1 109 109 PRO HB3 H 1 1.963 0.000 . 2 . . . A 1616 PRO HB3 . 19117 1 1234 . 1 1 109 109 PRO HG2 H 1 1.704 0.000 . 2 . . . A 1616 PRO HG2 . 19117 1 1235 . 1 1 109 109 PRO HD2 H 1 3.457 0.000 . 1 . . . A 1616 PRO HD2 . 19117 1 1236 . 1 1 109 109 PRO HD3 H 1 3.476 0.000 . 1 . . . A 1616 PRO HD3 . 19117 1 1237 . 1 1 109 109 PRO C C 13 177.541 0.000 . 1 . . . A 1616 PRO C . 19117 1 1238 . 1 1 109 109 PRO CA C 13 65.284 0.000 . 1 . . . A 1616 PRO CA . 19117 1 1239 . 1 1 109 109 PRO CB C 13 32.712 0.000 . 1 . . . A 1616 PRO CB . 19117 1 1240 . 1 1 109 109 PRO CG C 13 27.819 0.000 . 1 . . . A 1616 PRO CG . 19117 1 1241 . 1 1 109 109 PRO CD C 13 51.544 0.000 . 1 . . . A 1616 PRO CD . 19117 1 1242 . 1 1 110 110 GLU H H 1 7.668 0.000 . 1 . . . A 1617 GLU H . 19117 1 1243 . 1 1 110 110 GLU HA H 1 4.069 0.000 . 1 . . . A 1617 GLU HA . 19117 1 1244 . 1 1 110 110 GLU HB2 H 1 1.694 0.000 . 2 . . . A 1617 GLU HB2 . 19117 1 1245 . 1 1 110 110 GLU HB3 H 1 1.613 0.000 . 2 . . . A 1617 GLU HB3 . 19117 1 1246 . 1 1 110 110 GLU HG2 H 1 1.972 0.000 . 2 . . . A 1617 GLU HG2 . 19117 1 1247 . 1 1 110 110 GLU HG3 H 1 1.986 0.000 . 2 . . . A 1617 GLU HG3 . 19117 1 1248 . 1 1 110 110 GLU C C 13 176.392 0.000 . 1 . . . A 1617 GLU C . 19117 1 1249 . 1 1 110 110 GLU CA C 13 56.580 0.000 . 1 . . . A 1617 GLU CA . 19117 1 1250 . 1 1 110 110 GLU CB C 13 30.432 0.000 . 1 . . . A 1617 GLU CB . 19117 1 1251 . 1 1 110 110 GLU CG C 13 35.517 0.000 . 1 . . . A 1617 GLU CG . 19117 1 1252 . 1 1 110 110 GLU N N 15 117.110 0.000 . 1 . . . A 1617 GLU N . 19117 1 1253 . 1 1 111 111 ALA H H 1 7.931 0.000 . 1 . . . A 1618 ALA H . 19117 1 1254 . 1 1 111 111 ALA HA H 1 3.958 0.000 . 1 . . . A 1618 ALA HA . 19117 1 1255 . 1 1 111 111 ALA HB1 H 1 1.119 0.000 . 1 . . . A 1618 ALA HB1 . 19117 1 1256 . 1 1 111 111 ALA HB2 H 1 1.119 0.000 . 1 . . . A 1618 ALA HB2 . 19117 1 1257 . 1 1 111 111 ALA HB3 H 1 1.119 0.000 . 1 . . . A 1618 ALA HB3 . 19117 1 1258 . 1 1 111 111 ALA C C 13 178.330 0.000 . 1 . . . A 1618 ALA C . 19117 1 1259 . 1 1 111 111 ALA CA C 13 53.122 0.000 . 1 . . . A 1618 ALA CA . 19117 1 1260 . 1 1 111 111 ALA CB C 13 19.980 0.000 . 1 . . . A 1618 ALA CB . 19117 1 1261 . 1 1 111 111 ALA N N 15 125.252 0.000 . 1 . . . A 1618 ALA N . 19117 1 1262 . 1 1 112 112 GLY H H 1 7.772 0.000 . 1 . . . A 1619 GLY H . 19117 1 1263 . 1 1 112 112 GLY HA2 H 1 3.800 0.000 . 1 . . . A 1619 GLY HA2 . 19117 1 1264 . 1 1 112 112 GLY HA3 H 1 3.946 0.000 . 1 . . . A 1619 GLY HA3 . 19117 1 1265 . 1 1 112 112 GLY CA C 13 45.844 0.000 . 1 . . . A 1619 GLY CA . 19117 1 1266 . 1 1 112 112 GLY N N 15 108.520 0.000 . 1 . . . A 1619 GLY N . 19117 1 1267 . 1 1 113 113 PRO HA H 1 4.215 0.000 . 1 . . . A 1620 PRO HA . 19117 1 1268 . 1 1 113 113 PRO HB2 H 1 2.024 0.000 . 2 . . . A 1620 PRO HB2 . 19117 1 1269 . 1 1 113 113 PRO HB3 H 1 1.710 0.000 . 2 . . . A 1620 PRO HB3 . 19117 1 1270 . 1 1 113 113 PRO HG2 H 1 1.707 0.000 . 2 . . . A 1620 PRO HG2 . 19117 1 1271 . 1 1 113 113 PRO HG3 H 1 1.751 0.000 . 2 . . . A 1620 PRO HG3 . 19117 1 1272 . 1 1 113 113 PRO HD2 H 1 3.427 0.000 . 1 . . . A 1620 PRO HD2 . 19117 1 1273 . 1 1 113 113 PRO HD3 H 1 3.316 0.000 . 1 . . . A 1620 PRO HD3 . 19117 1 1274 . 1 1 113 113 PRO C C 13 178.378 0.000 . 1 . . . A 1620 PRO C . 19117 1 1275 . 1 1 113 113 PRO CA C 13 64.583 0.000 . 1 . . . A 1620 PRO CA . 19117 1 1276 . 1 1 113 113 PRO CB C 13 32.881 0.000 . 1 . . . A 1620 PRO CB . 19117 1 1277 . 1 1 113 113 PRO CG C 13 27.814 0.000 . 1 . . . A 1620 PRO CG . 19117 1 1278 . 1 1 113 113 PRO CD C 13 50.926 0.000 . 1 . . . A 1620 PRO CD . 19117 1 1279 . 1 1 114 114 THR H H 1 7.690 0.000 . 1 . . . A 1621 THR H . 19117 1 1280 . 1 1 114 114 THR HA H 1 4.089 0.000 . 1 . . . A 1621 THR HA . 19117 1 1281 . 1 1 114 114 THR HB H 1 4.066 0.000 . 1 . . . A 1621 THR HB . 19117 1 1282 . 1 1 114 114 THR HG21 H 1 0.896 0.000 . 1 . . . A 1621 THR HG21 . 19117 1 1283 . 1 1 114 114 THR HG22 H 1 0.896 0.000 . 1 . . . A 1621 THR HG22 . 19117 1 1284 . 1 1 114 114 THR HG23 H 1 0.896 0.000 . 1 . . . A 1621 THR HG23 . 19117 1 1285 . 1 1 114 114 THR C C 13 175.423 0.000 . 1 . . . A 1621 THR C . 19117 1 1286 . 1 1 114 114 THR CA C 13 62.633 0.000 . 1 . . . A 1621 THR CA . 19117 1 1287 . 1 1 114 114 THR CB C 13 69.781 0.000 . 1 . . . A 1621 THR CB . 19117 1 1288 . 1 1 114 114 THR CG2 C 13 22.347 0.000 . 1 . . . A 1621 THR CG2 . 19117 1 1289 . 1 1 114 114 THR N N 15 110.739 0.000 . 1 . . . A 1621 THR N . 19117 1 1290 . 1 1 115 115 ASN H H 1 7.903 0.000 . 1 . . . A 1622 ASN H . 19117 1 1291 . 1 1 115 115 ASN HA H 1 4.843 0.000 . 1 . . . A 1622 ASN HA . 19117 1 1292 . 1 1 115 115 ASN HB2 H 1 2.969 0.000 . 2 . . . A 1622 ASN HB2 . 19117 1 1293 . 1 1 115 115 ASN HB3 H 1 2.784 0.000 . 2 . . . A 1622 ASN HB3 . 19117 1 1294 . 1 1 115 115 ASN HD21 H 1 7.571 0.000 . 2 . . . A 1622 ASN HD21 . 19117 1 1295 . 1 1 115 115 ASN HD22 H 1 6.765 0.000 . 2 . . . A 1622 ASN HD22 . 19117 1 1296 . 1 1 115 115 ASN C C 13 174.210 0.000 . 1 . . . A 1622 ASN C . 19117 1 1297 . 1 1 115 115 ASN CA C 13 53.578 0.000 . 1 . . . A 1622 ASN CA . 19117 1 1298 . 1 1 115 115 ASN CB C 13 38.708 0.000 . 1 . . . A 1622 ASN CB . 19117 1 1299 . 1 1 115 115 ASN N N 15 123.673 0.000 . 1 . . . A 1622 ASN N . 19117 1 1300 . 1 1 115 115 ASN ND2 N 15 111.657 0.000 . 1 . . . A 1622 ASN ND2 . 19117 1 1301 . 1 1 116 116 ARG H H 1 7.499 0.000 . 1 . . . A 1623 ARG H . 19117 1 1302 . 1 1 116 116 ARG HA H 1 3.558 0.000 . 1 . . . A 1623 ARG HA . 19117 1 1303 . 1 1 116 116 ARG HB2 H 1 1.461 0.000 . 2 . . . A 1623 ARG HB2 . 19117 1 1304 . 1 1 116 116 ARG HB3 H 1 1.135 0.000 . 2 . . . A 1623 ARG HB3 . 19117 1 1305 . 1 1 116 116 ARG HG2 H 1 1.198 0.000 . 2 . . . A 1623 ARG HG2 . 19117 1 1306 . 1 1 116 116 ARG HG3 H 1 1.149 0.000 . 2 . . . A 1623 ARG HG3 . 19117 1 1307 . 1 1 116 116 ARG HD2 H 1 2.679 0.000 . 1 . . . A 1623 ARG HD2 . 19117 1 1308 . 1 1 116 116 ARG HD3 H 1 2.889 0.000 . 1 . . . A 1623 ARG HD3 . 19117 1 1309 . 1 1 116 116 ARG HE H 1 6.787 0.000 . 1 . . . A 1623 ARG HE . 19117 1 1310 . 1 1 116 116 ARG CA C 13 53.114 0.000 . 1 . . . A 1623 ARG CA . 19117 1 1311 . 1 1 116 116 ARG CB C 13 29.279 0.000 . 1 . . . A 1623 ARG CB . 19117 1 1312 . 1 1 116 116 ARG CG C 13 26.766 0.000 . 1 . . . A 1623 ARG CG . 19117 1 1313 . 1 1 116 116 ARG CD C 13 44.202 0.000 . 1 . . . A 1623 ARG CD . 19117 1 1314 . 1 1 116 116 ARG N N 15 120.681 0.000 . 1 . . . A 1623 ARG N . 19117 1 1315 . 1 1 116 116 ARG NE N 15 85.380 0.000 . 1 . . . A 1623 ARG NE . 19117 1 1316 . 1 1 117 117 PRO HA H 1 3.719 0.000 . 1 . . . A 1624 PRO HA . 19117 1 1317 . 1 1 117 117 PRO HB2 H 1 2.152 0.000 . 2 . . . A 1624 PRO HB2 . 19117 1 1318 . 1 1 117 117 PRO HB3 H 1 2.252 0.000 . 2 . . . A 1624 PRO HB3 . 19117 1 1319 . 1 1 117 117 PRO C C 13 176.471 0.000 . 1 . . . A 1624 PRO C . 19117 1 1320 . 1 1 117 117 PRO CA C 13 62.780 0.000 . 1 . . . A 1624 PRO CA . 19117 1 1321 . 1 1 117 117 PRO CB C 13 32.201 0.000 . 1 . . . A 1624 PRO CB . 19117 1 1322 . 1 1 117 117 PRO CG C 13 26.608 0.000 . 1 . . . A 1624 PRO CG . 19117 1 1323 . 1 1 118 118 MET H H 1 8.247 0.000 . 1 . . . A 1625 MET H . 19117 1 1324 . 1 1 118 118 MET HA H 1 4.514 0.000 . 1 . . . A 1625 MET HA . 19117 1 1325 . 1 1 118 118 MET HB2 H 1 1.642 0.000 . 2 . . . A 1625 MET HB2 . 19117 1 1326 . 1 1 118 118 MET HB3 H 1 1.607 0.000 . 2 . . . A 1625 MET HB3 . 19117 1 1327 . 1 1 118 118 MET HG2 H 1 2.258 0.000 . 2 . . . A 1625 MET HG2 . 19117 1 1328 . 1 1 118 118 MET HE1 H 1 1.724 0.000 . 1 . . . A 1625 MET HE1 . 19117 1 1329 . 1 1 118 118 MET HE2 H 1 1.724 0.000 . 1 . . . A 1625 MET HE2 . 19117 1 1330 . 1 1 118 118 MET HE3 H 1 1.724 0.000 . 1 . . . A 1625 MET HE3 . 19117 1 1331 . 1 1 118 118 MET C C 13 176.478 0.000 . 1 . . . A 1625 MET C . 19117 1 1332 . 1 1 118 118 MET CA C 13 54.240 0.000 . 1 . . . A 1625 MET CA . 19117 1 1333 . 1 1 118 118 MET CB C 13 36.101 0.000 . 1 . . . A 1625 MET CB . 19117 1 1334 . 1 1 118 118 MET CG C 13 32.264 0.000 . 1 . . . A 1625 MET CG . 19117 1 1335 . 1 1 118 118 MET CE C 13 17.470 0.000 . 1 . . . A 1625 MET CE . 19117 1 1336 . 1 1 118 118 MET N N 15 117.767 0.000 . 1 . . . A 1625 MET N . 19117 1 1337 . 1 1 119 119 LEU H H 1 8.838 0.000 . 1 . . . A 1626 LEU H . 19117 1 1338 . 1 1 119 119 LEU HA H 1 3.805 0.000 . 1 . . . A 1626 LEU HA . 19117 1 1339 . 1 1 119 119 LEU HB2 H 1 0.749 0.000 . 2 . . . A 1626 LEU HB2 . 19117 1 1340 . 1 1 119 119 LEU HB3 H 1 1.572 0.000 . 2 . . . A 1626 LEU HB3 . 19117 1 1341 . 1 1 119 119 LEU HG H 1 0.763 0.000 . 1 . . . A 1626 LEU HG . 19117 1 1342 . 1 1 119 119 LEU HD11 H 1 -0.118 0.000 . 2 . . . A 1626 LEU HD11 . 19117 1 1343 . 1 1 119 119 LEU HD12 H 1 -0.118 0.000 . 2 . . . A 1626 LEU HD12 . 19117 1 1344 . 1 1 119 119 LEU HD13 H 1 -0.118 0.000 . 2 . . . A 1626 LEU HD13 . 19117 1 1345 . 1 1 119 119 LEU HD21 H 1 0.334 0.000 . 2 . . . A 1626 LEU HD21 . 19117 1 1346 . 1 1 119 119 LEU HD22 H 1 0.334 0.000 . 2 . . . A 1626 LEU HD22 . 19117 1 1347 . 1 1 119 119 LEU HD23 H 1 0.334 0.000 . 2 . . . A 1626 LEU HD23 . 19117 1 1348 . 1 1 119 119 LEU C C 13 176.308 0.000 . 1 . . . A 1626 LEU C . 19117 1 1349 . 1 1 119 119 LEU CA C 13 55.918 0.000 . 1 . . . A 1626 LEU CA . 19117 1 1350 . 1 1 119 119 LEU CB C 13 42.229 0.000 . 1 . . . A 1626 LEU CB . 19117 1 1351 . 1 1 119 119 LEU CG C 13 27.845 0.000 . 1 . . . A 1626 LEU CG . 19117 1 1352 . 1 1 119 119 LEU CD1 C 13 23.025 0.000 . 1 . . . A 1626 LEU CD1 . 19117 1 1353 . 1 1 119 119 LEU CD2 C 13 27.773 0.000 . 1 . . . A 1626 LEU CD2 . 19117 1 1354 . 1 1 119 119 LEU N N 15 126.504 0.000 . 1 . . . A 1626 LEU N . 19117 1 1355 . 1 1 120 120 ILE H H 1 8.829 0.000 . 1 . . . A 1627 ILE H . 19117 1 1356 . 1 1 120 120 ILE HA H 1 3.890 0.000 . 1 . . . A 1627 ILE HA . 19117 1 1357 . 1 1 120 120 ILE HB H 1 1.529 0.000 . 1 . . . A 1627 ILE HB . 19117 1 1358 . 1 1 120 120 ILE HG12 H 1 1.003 0.000 . 2 . . . A 1627 ILE HG12 . 19117 1 1359 . 1 1 120 120 ILE HG13 H 1 1.008 0.000 . 2 . . . A 1627 ILE HG13 . 19117 1 1360 . 1 1 120 120 ILE HG21 H 1 0.507 0.000 . 1 . . . A 1627 ILE HG21 . 19117 1 1361 . 1 1 120 120 ILE HG22 H 1 0.507 0.000 . 1 . . . A 1627 ILE HG22 . 19117 1 1362 . 1 1 120 120 ILE HG23 H 1 0.507 0.000 . 1 . . . A 1627 ILE HG23 . 19117 1 1363 . 1 1 120 120 ILE HD11 H 1 0.387 0.000 . 1 . . . A 1627 ILE HD11 . 19117 1 1364 . 1 1 120 120 ILE HD12 H 1 0.387 0.000 . 1 . . . A 1627 ILE HD12 . 19117 1 1365 . 1 1 120 120 ILE HD13 H 1 0.387 0.000 . 1 . . . A 1627 ILE HD13 . 19117 1 1366 . 1 1 120 120 ILE C C 13 177.523 0.000 . 1 . . . A 1627 ILE C . 19117 1 1367 . 1 1 120 120 ILE CA C 13 61.512 0.000 . 1 . . . A 1627 ILE CA . 19117 1 1368 . 1 1 120 120 ILE CB C 13 38.173 0.000 . 1 . . . A 1627 ILE CB . 19117 1 1369 . 1 1 120 120 ILE CG1 C 13 27.258 0.000 . 1 . . . A 1627 ILE CG1 . 19117 1 1370 . 1 1 120 120 ILE CG2 C 13 18.182 0.000 . 1 . . . A 1627 ILE CG2 . 19117 1 1371 . 1 1 120 120 ILE CD1 C 13 11.401 0.000 . 1 . . . A 1627 ILE CD1 . 19117 1 1372 . 1 1 120 120 ILE N N 15 128.361 0.000 . 1 . . . A 1627 ILE N . 19117 1 1373 . 1 1 121 121 SER H H 1 7.172 0.000 . 1 . . . A 1628 SER H . 19117 1 1374 . 1 1 121 121 SER HA H 1 4.148 0.000 . 1 . . . A 1628 SER HA . 19117 1 1375 . 1 1 121 121 SER HB2 H 1 3.369 0.000 . 2 . . . A 1628 SER HB2 . 19117 1 1376 . 1 1 121 121 SER HB3 H 1 3.425 0.000 . 2 . . . A 1628 SER HB3 . 19117 1 1377 . 1 1 121 121 SER C C 13 171.754 0.000 . 1 . . . A 1628 SER C . 19117 1 1378 . 1 1 121 121 SER CA C 13 58.696 0.000 . 1 . . . A 1628 SER CA . 19117 1 1379 . 1 1 121 121 SER CB C 13 65.713 0.000 . 1 . . . A 1628 SER CB . 19117 1 1380 . 1 1 121 121 SER N N 15 110.948 0.000 . 1 . . . A 1628 SER N . 19117 1 1381 . 1 1 122 122 LEU H H 1 7.767 0.000 . 1 . . . A 1629 LEU H . 19117 1 1382 . 1 1 122 122 LEU HA H 1 4.677 0.000 . 1 . . . A 1629 LEU HA . 19117 1 1383 . 1 1 122 122 LEU HB2 H 1 1.364 0.000 . 2 . . . A 1629 LEU HB2 . 19117 1 1384 . 1 1 122 122 LEU HB3 H 1 0.820 0.000 . 2 . . . A 1629 LEU HB3 . 19117 1 1385 . 1 1 122 122 LEU HG H 1 0.827 0.000 . 1 . . . A 1629 LEU HG . 19117 1 1386 . 1 1 122 122 LEU HD11 H 1 0.468 0.000 . 2 . . . A 1629 LEU HD11 . 19117 1 1387 . 1 1 122 122 LEU HD12 H 1 0.468 0.000 . 2 . . . A 1629 LEU HD12 . 19117 1 1388 . 1 1 122 122 LEU HD13 H 1 0.468 0.000 . 2 . . . A 1629 LEU HD13 . 19117 1 1389 . 1 1 122 122 LEU HD21 H 1 0.452 0.000 . 2 . . . A 1629 LEU HD21 . 19117 1 1390 . 1 1 122 122 LEU HD22 H 1 0.452 0.000 . 2 . . . A 1629 LEU HD22 . 19117 1 1391 . 1 1 122 122 LEU HD23 H 1 0.452 0.000 . 2 . . . A 1629 LEU HD23 . 19117 1 1392 . 1 1 122 122 LEU C C 13 176.073 0.000 . 1 . . . A 1629 LEU C . 19117 1 1393 . 1 1 122 122 LEU CA C 13 53.967 0.000 . 1 . . . A 1629 LEU CA . 19117 1 1394 . 1 1 122 122 LEU CB C 13 45.225 0.000 . 1 . . . A 1629 LEU CB . 19117 1 1395 . 1 1 122 122 LEU CD1 C 13 23.665 0.000 . 1 . . . A 1629 LEU CD1 . 19117 1 1396 . 1 1 122 122 LEU CD2 C 13 26.730 0.000 . 1 . . . A 1629 LEU CD2 . 19117 1 1397 . 1 1 122 122 LEU N N 15 122.860 0.000 . 1 . . . A 1629 LEU N . 19117 1 1398 . 1 1 123 123 ASP H H 1 9.194 0.000 . 1 . . . A 1630 ASP H . 19117 1 1399 . 1 1 123 123 ASP HA H 1 4.631 0.000 . 1 . . . A 1630 ASP HA . 19117 1 1400 . 1 1 123 123 ASP HB2 H 1 2.723 0.000 . 2 . . . A 1630 ASP HB2 . 19117 1 1401 . 1 1 123 123 ASP HB3 H 1 4.320 0.000 . 2 . . . A 1630 ASP HB3 . 19117 1 1402 . 1 1 123 123 ASP C C 13 177.904 0.000 . 1 . . . A 1630 ASP C . 19117 1 1403 . 1 1 123 123 ASP CA C 13 53.720 0.000 . 1 . . . A 1630 ASP CA . 19117 1 1404 . 1 1 123 123 ASP CB C 13 42.453 0.000 . 1 . . . A 1630 ASP CB . 19117 1 1405 . 1 1 123 123 ASP N N 15 127.548 0.000 . 1 . . . A 1630 ASP N . 19117 1 1406 . 1 1 124 124 LYS H H 1 8.599 0.000 . 1 . . . A 1631 LYS H . 19117 1 1407 . 1 1 124 124 LYS HA H 1 3.452 0.000 . 1 . . . A 1631 LYS HA . 19117 1 1408 . 1 1 124 124 LYS HB2 H 1 1.416 0.000 . 2 . . . A 1631 LYS HB2 . 19117 1 1409 . 1 1 124 124 LYS HB3 H 1 1.536 0.000 . 2 . . . A 1631 LYS HB3 . 19117 1 1410 . 1 1 124 124 LYS HG2 H 1 1.142 0.000 . 2 . . . A 1631 LYS HG2 . 19117 1 1411 . 1 1 124 124 LYS HG3 H 1 1.055 0.000 . 2 . . . A 1631 LYS HG3 . 19117 1 1412 . 1 1 124 124 LYS HD2 H 1 1.296 0.000 . 1 . . . A 1631 LYS HD2 . 19117 1 1413 . 1 1 124 124 LYS HD3 H 1 1.397 0.000 . 1 . . . A 1631 LYS HD3 . 19117 1 1414 . 1 1 124 124 LYS HE2 H 1 2.518 0.000 . 1 . . . A 1631 LYS HE2 . 19117 1 1415 . 1 1 124 124 LYS HE3 H 1 2.724 0.000 . 1 . . . A 1631 LYS HE3 . 19117 1 1416 . 1 1 124 124 LYS C C 13 178.382 0.000 . 1 . . . A 1631 LYS C . 19117 1 1417 . 1 1 124 124 LYS CA C 13 60.360 0.000 . 1 . . . A 1631 LYS CA . 19117 1 1418 . 1 1 124 124 LYS CB C 13 32.466 0.000 . 1 . . . A 1631 LYS CB . 19117 1 1419 . 1 1 124 124 LYS CG C 13 25.747 0.000 . 1 . . . A 1631 LYS CG . 19117 1 1420 . 1 1 124 124 LYS CD C 13 29.293 0.000 . 1 . . . A 1631 LYS CD . 19117 1 1421 . 1 1 124 124 LYS CE C 13 41.037 0.000 . 1 . . . A 1631 LYS CE . 19117 1 1422 . 1 1 124 124 LYS N N 15 126.175 0.000 . 1 . . . A 1631 LYS N . 19117 1 1423 . 1 1 125 125 GLN H H 1 8.072 0.000 . 1 . . . A 1632 GLN H . 19117 1 1424 . 1 1 125 125 GLN HA H 1 3.798 0.000 . 1 . . . A 1632 GLN HA . 19117 1 1425 . 1 1 125 125 GLN HB2 H 1 1.971 0.000 . 2 . . . A 1632 GLN HB2 . 19117 1 1426 . 1 1 125 125 GLN HB3 H 1 1.824 0.000 . 2 . . . A 1632 GLN HB3 . 19117 1 1427 . 1 1 125 125 GLN HG2 H 1 2.106 0.000 . 2 . . . A 1632 GLN HG2 . 19117 1 1428 . 1 1 125 125 GLN HG3 H 1 2.097 0.000 . 2 . . . A 1632 GLN HG3 . 19117 1 1429 . 1 1 125 125 GLN HE21 H 1 6.523 0.000 . 1 . . . A 1632 GLN HE21 . 19117 1 1430 . 1 1 125 125 GLN HE22 H 1 7.198 0.000 . 1 . . . A 1632 GLN HE22 . 19117 1 1431 . 1 1 125 125 GLN C C 13 180.785 0.000 . 1 . . . A 1632 GLN C . 19117 1 1432 . 1 1 125 125 GLN CA C 13 58.981 0.000 . 1 . . . A 1632 GLN CA . 19117 1 1433 . 1 1 125 125 GLN CB C 13 29.430 0.000 . 1 . . . A 1632 GLN CB . 19117 1 1434 . 1 1 125 125 GLN CG C 13 34.945 0.000 . 1 . . . A 1632 GLN CG . 19117 1 1435 . 1 1 125 125 GLN N N 15 116.162 0.000 . 1 . . . A 1632 GLN N . 19117 1 1436 . 1 1 125 125 GLN NE2 N 15 112.084 0.000 . 1 . . . A 1632 GLN NE2 . 19117 1 1437 . 1 1 126 126 THR H H 1 6.905 0.000 . 1 . . . A 1633 THR H . 19117 1 1438 . 1 1 126 126 THR HA H 1 4.036 0.000 . 1 . . . A 1633 THR HA . 19117 1 1439 . 1 1 126 126 THR HB H 1 4.092 0.000 . 1 . . . A 1633 THR HB . 19117 1 1440 . 1 1 126 126 THR HG21 H 1 0.823 0.000 . 1 . . . A 1633 THR HG21 . 19117 1 1441 . 1 1 126 126 THR HG22 H 1 0.823 0.000 . 1 . . . A 1633 THR HG22 . 19117 1 1442 . 1 1 126 126 THR HG23 H 1 0.823 0.000 . 1 . . . A 1633 THR HG23 . 19117 1 1443 . 1 1 126 126 THR C C 13 175.083 0.000 . 1 . . . A 1633 THR C . 19117 1 1444 . 1 1 126 126 THR CA C 13 61.418 0.000 . 1 . . . A 1633 THR CA . 19117 1 1445 . 1 1 126 126 THR CB C 13 71.002 0.000 . 1 . . . A 1633 THR CB . 19117 1 1446 . 1 1 126 126 THR CG2 C 13 21.236 0.000 . 1 . . . A 1633 THR CG2 . 19117 1 1447 . 1 1 126 126 THR N N 15 104.387 0.000 . 1 . . . A 1633 THR N . 19117 1 1448 . 1 1 127 127 CYS H H 1 7.522 0.000 . 1 . . . A 1634 CYS H . 19117 1 1449 . 1 1 127 127 CYS HA H 1 3.232 0.000 . 1 . . . A 1634 CYS HA . 19117 1 1450 . 1 1 127 127 CYS HB2 H 1 3.043 0.000 . 2 . . . A 1634 CYS HB2 . 19117 1 1451 . 1 1 127 127 CYS HB3 H 1 2.695 0.000 . 2 . . . A 1634 CYS HB3 . 19117 1 1452 . 1 1 127 127 CYS C C 13 172.638 0.000 . 1 . . . A 1634 CYS C . 19117 1 1453 . 1 1 127 127 CYS CA C 13 58.071 0.000 . 1 . . . A 1634 CYS CA . 19117 1 1454 . 1 1 127 127 CYS CB C 13 41.759 0.000 . 1 . . . A 1634 CYS CB . 19117 1 1455 . 1 1 127 127 CYS N N 15 116.480 0.000 . 1 . . . A 1634 CYS N . 19117 1 1456 . 1 1 128 128 THR H H 1 7.089 0.000 . 1 . . . A 1635 THR H . 19117 1 1457 . 1 1 128 128 THR HA H 1 4.634 0.000 . 1 . . . A 1635 THR HA . 19117 1 1458 . 1 1 128 128 THR HB H 1 3.290 0.000 . 1 . . . A 1635 THR HB . 19117 1 1459 . 1 1 128 128 THR HG21 H 1 -0.018 0.000 . 1 . . . A 1635 THR HG21 . 19117 1 1460 . 1 1 128 128 THR HG22 H 1 -0.018 0.000 . 1 . . . A 1635 THR HG22 . 19117 1 1461 . 1 1 128 128 THR HG23 H 1 -0.018 0.000 . 1 . . . A 1635 THR HG23 . 19117 1 1462 . 1 1 128 128 THR C C 13 173.326 0.000 . 1 . . . A 1635 THR C . 19117 1 1463 . 1 1 128 128 THR CA C 13 62.828 0.000 . 1 . . . A 1635 THR CA . 19117 1 1464 . 1 1 128 128 THR CB C 13 70.993 0.000 . 1 . . . A 1635 THR CB . 19117 1 1465 . 1 1 128 128 THR CG2 C 13 22.830 0.000 . 1 . . . A 1635 THR CG2 . 19117 1 1466 . 1 1 128 128 THR N N 15 110.874 0.000 . 1 . . . A 1635 THR N . 19117 1 1467 . 1 1 129 129 LEU H H 1 8.948 0.000 . 1 . . . A 1636 LEU H . 19117 1 1468 . 1 1 129 129 LEU HA H 1 4.250 0.000 . 1 . . . A 1636 LEU HA . 19117 1 1469 . 1 1 129 129 LEU HB2 H 1 0.925 0.000 . 2 . . . A 1636 LEU HB2 . 19117 1 1470 . 1 1 129 129 LEU HB3 H 1 1.640 0.000 . 2 . . . A 1636 LEU HB3 . 19117 1 1471 . 1 1 129 129 LEU HG H 1 1.305 0.000 . 1 . . . A 1636 LEU HG . 19117 1 1472 . 1 1 129 129 LEU HD11 H 1 0.519 0.000 . 2 . . . A 1636 LEU HD11 . 19117 1 1473 . 1 1 129 129 LEU HD12 H 1 0.519 0.000 . 2 . . . A 1636 LEU HD12 . 19117 1 1474 . 1 1 129 129 LEU HD13 H 1 0.519 0.000 . 2 . . . A 1636 LEU HD13 . 19117 1 1475 . 1 1 129 129 LEU HD21 H 1 0.636 0.000 . 2 . . . A 1636 LEU HD21 . 19117 1 1476 . 1 1 129 129 LEU HD22 H 1 0.636 0.000 . 2 . . . A 1636 LEU HD22 . 19117 1 1477 . 1 1 129 129 LEU HD23 H 1 0.636 0.000 . 2 . . . A 1636 LEU HD23 . 19117 1 1478 . 1 1 129 129 LEU C C 13 174.936 0.000 . 1 . . . A 1636 LEU C . 19117 1 1479 . 1 1 129 129 LEU CA C 13 56.865 0.000 . 1 . . . A 1636 LEU CA . 19117 1 1480 . 1 1 129 129 LEU CB C 13 44.079 0.000 . 1 . . . A 1636 LEU CB . 19117 1 1481 . 1 1 129 129 LEU CG C 13 32.299 0.000 . 1 . . . A 1636 LEU CG . 19117 1 1482 . 1 1 129 129 LEU CD1 C 13 29.129 0.000 . 1 . . . A 1636 LEU CD1 . 19117 1 1483 . 1 1 129 129 LEU CD2 C 13 25.327 0.000 . 1 . . . A 1636 LEU CD2 . 19117 1 1484 . 1 1 129 129 LEU N N 15 130.581 0.000 . 1 . . . A 1636 LEU N . 19117 1 1485 . 1 1 130 130 PHE H H 1 8.213 0.000 . 1 . . . A 1637 PHE H . 19117 1 1486 . 1 1 130 130 PHE HA H 1 4.796 0.000 . 1 . . . A 1637 PHE HA . 19117 1 1487 . 1 1 130 130 PHE HB2 H 1 2.501 0.000 . 2 . . . A 1637 PHE HB2 . 19117 1 1488 . 1 1 130 130 PHE HB3 H 1 2.513 0.000 . 2 . . . A 1637 PHE HB3 . 19117 1 1489 . 1 1 130 130 PHE HD1 H 1 6.820 0.000 . 3 . . . A 1637 PHE HD1 . 19117 1 1490 . 1 1 130 130 PHE HD2 H 1 6.820 0.000 . 1 . . . A 1637 PHE HD2 . 19117 1 1491 . 1 1 130 130 PHE HE1 H 1 6.938 0.000 . 3 . . . A 1637 PHE HE1 . 19117 1 1492 . 1 1 130 130 PHE HE2 H 1 6.938 0.000 . 3 . . . A 1637 PHE HE2 . 19117 1 1493 . 1 1 130 130 PHE C C 13 175.770 0.000 . 1 . . . A 1637 PHE C . 19117 1 1494 . 1 1 130 130 PHE CA C 13 58.118 0.000 . 1 . . . A 1637 PHE CA . 19117 1 1495 . 1 1 130 130 PHE CB C 13 40.699 0.000 . 1 . . . A 1637 PHE CB . 19117 1 1496 . 1 1 130 130 PHE CE1 C 13 130.664 0.000 . 3 . . . A 1637 PHE CE1 . 19117 1 1497 . 1 1 130 130 PHE CE2 C 13 130.664 0.000 . 3 . . . A 1637 PHE CE2 . 19117 1 1498 . 1 1 130 130 PHE N N 15 119.163 0.000 . 1 . . . A 1637 PHE N . 19117 1 1499 . 1 1 131 131 PHE H H 1 9.089 0.000 . 1 . . . A 1638 PHE H . 19117 1 1500 . 1 1 131 131 PHE HA H 1 5.395 0.000 . 1 . . . A 1638 PHE HA . 19117 1 1501 . 1 1 131 131 PHE HB2 H 1 2.338 0.000 . 2 . . . A 1638 PHE HB2 . 19117 1 1502 . 1 1 131 131 PHE HB3 H 1 2.501 0.000 . 2 . . . A 1638 PHE HB3 . 19117 1 1503 . 1 1 131 131 PHE HD1 H 1 6.824 0.000 . 3 . . . A 1638 PHE HD1 . 19117 1 1504 . 1 1 131 131 PHE HD2 H 1 6.824 0.000 . 1 . . . A 1638 PHE HD2 . 19117 1 1505 . 1 1 131 131 PHE HE1 H 1 6.750 0.000 . 3 . . . A 1638 PHE HE1 . 19117 1 1506 . 1 1 131 131 PHE HE2 H 1 6.750 0.000 . 3 . . . A 1638 PHE HE2 . 19117 1 1507 . 1 1 131 131 PHE HZ H 1 6.884 0.000 . 1 . . . A 1638 PHE HZ . 19117 1 1508 . 1 1 131 131 PHE C C 13 176.948 0.000 . 1 . . . A 1638 PHE C . 19117 1 1509 . 1 1 131 131 PHE CA C 13 56.379 0.000 . 1 . . . A 1638 PHE CA . 19117 1 1510 . 1 1 131 131 PHE CB C 13 43.561 0.000 . 1 . . . A 1638 PHE CB . 19117 1 1511 . 1 1 131 131 PHE CD1 C 13 133.626 0.000 . 3 . . . A 1638 PHE CD1 . 19117 1 1512 . 1 1 131 131 PHE CD2 C 13 133.626 0.000 . 3 . . . A 1638 PHE CD2 . 19117 1 1513 . 1 1 131 131 PHE CE1 C 13 130.295 0.000 . 3 . . . A 1638 PHE CE1 . 19117 1 1514 . 1 1 131 131 PHE CE2 C 13 130.295 0.000 . 3 . . . A 1638 PHE CE2 . 19117 1 1515 . 1 1 131 131 PHE CZ C 13 128.291 0.000 . 1 . . . A 1638 PHE CZ . 19117 1 1516 . 1 1 131 131 PHE N N 15 120.317 0.000 . 1 . . . A 1638 PHE N . 19117 1 1517 . 1 1 132 132 SER H H 1 8.962 0.000 . 1 . . . A 1639 SER H . 19117 1 1518 . 1 1 132 132 SER HA H 1 5.128 0.000 . 1 . . . A 1639 SER HA . 19117 1 1519 . 1 1 132 132 SER HB2 H 1 3.346 0.000 . 2 . . . A 1639 SER HB2 . 19117 1 1520 . 1 1 132 132 SER HB3 H 1 3.290 0.000 . 2 . . . A 1639 SER HB3 . 19117 1 1521 . 1 1 132 132 SER C C 13 174.359 0.000 . 1 . . . A 1639 SER C . 19117 1 1522 . 1 1 132 132 SER CA C 13 57.298 0.000 . 1 . . . A 1639 SER CA . 19117 1 1523 . 1 1 132 132 SER CB C 13 67.071 0.000 . 1 . . . A 1639 SER CB . 19117 1 1524 . 1 1 132 132 SER N N 15 117.123 0.000 . 1 . . . A 1639 SER N . 19117 1 1525 . 1 1 133 133 TRP H H 1 8.631 0.000 . 1 . . . A 1640 TRP H . 19117 1 1526 . 1 1 133 133 TRP HA H 1 4.560 0.000 . 1 . . . A 1640 TRP HA . 19117 1 1527 . 1 1 133 133 TRP HB2 H 1 2.671 0.000 . 2 . . . A 1640 TRP HB2 . 19117 1 1528 . 1 1 133 133 TRP HB3 H 1 1.950 0.000 . 2 . . . A 1640 TRP HB3 . 19117 1 1529 . 1 1 133 133 TRP HD1 H 1 6.404 0.000 . 1 . . . A 1640 TRP HD1 . 19117 1 1530 . 1 1 133 133 TRP HE1 H 1 9.285 0.000 . 1 . . . A 1640 TRP HE1 . 19117 1 1531 . 1 1 133 133 TRP HE3 H 1 6.736 0.000 . 1 . . . A 1640 TRP HE3 . 19117 1 1532 . 1 1 133 133 TRP C C 13 176.389 0.000 . 1 . . . A 1640 TRP C . 19117 1 1533 . 1 1 133 133 TRP CA C 13 56.084 0.000 . 1 . . . A 1640 TRP CA . 19117 1 1534 . 1 1 133 133 TRP CB C 13 32.258 0.000 . 1 . . . A 1640 TRP CB . 19117 1 1535 . 1 1 133 133 TRP CE3 C 13 117.392 0.000 . 1 . . . A 1640 TRP CE3 . 19117 1 1536 . 1 1 133 133 TRP N N 15 129.306 0.000 . 1 . . . A 1640 TRP N . 19117 1 1537 . 1 1 133 133 TRP NE1 N 15 127.216 0.000 . 1 . . . A 1640 TRP NE1 . 19117 1 1538 . 1 1 134 134 HIS H H 1 8.975 0.000 . 1 . . . A 1641 HIS H . 19117 1 1539 . 1 1 134 134 HIS HA H 1 5.156 0.000 . 1 . . . A 1641 HIS HA . 19117 1 1540 . 1 1 134 134 HIS HB2 H 1 2.628 0.000 . 2 . . . A 1641 HIS HB2 . 19117 1 1541 . 1 1 134 134 HIS HB3 H 1 3.024 0.000 . 2 . . . A 1641 HIS HB3 . 19117 1 1542 . 1 1 134 134 HIS C C 13 174.056 0.000 . 1 . . . A 1641 HIS C . 19117 1 1543 . 1 1 134 134 HIS CA C 13 55.553 0.000 . 1 . . . A 1641 HIS CA . 19117 1 1544 . 1 1 134 134 HIS CB C 13 29.143 0.000 . 1 . . . A 1641 HIS CB . 19117 1 1545 . 1 1 134 134 HIS N N 15 127.182 0.000 . 1 . . . A 1641 HIS N . 19117 1 1546 . 1 1 135 135 THR H H 1 8.601 0.000 . 1 . . . A 1642 THR H . 19117 1 1547 . 1 1 135 135 THR HA H 1 5.092 0.000 . 1 . . . A 1642 THR HA . 19117 1 1548 . 1 1 135 135 THR HB H 1 3.966 0.000 . 1 . . . A 1642 THR HB . 19117 1 1549 . 1 1 135 135 THR HG1 H 1 6.535 0.000 . 1 . . . A 1642 THR HG1 . 19117 1 1550 . 1 1 135 135 THR HG21 H 1 0.696 0.000 . 1 . . . A 1642 THR HG21 . 19117 1 1551 . 1 1 135 135 THR HG22 H 1 0.696 0.000 . 1 . . . A 1642 THR HG22 . 19117 1 1552 . 1 1 135 135 THR HG23 H 1 0.696 0.000 . 1 . . . A 1642 THR HG23 . 19117 1 1553 . 1 1 135 135 THR CA C 13 57.211 0.000 . 1 . . . A 1642 THR CA . 19117 1 1554 . 1 1 135 135 THR CB C 13 69.833 0.000 . 1 . . . A 1642 THR CB . 19117 1 1555 . 1 1 135 135 THR CG2 C 13 20.565 0.000 . 1 . . . A 1642 THR CG2 . 19117 1 1556 . 1 1 135 135 THR N N 15 119.951 0.000 . 1 . . . A 1642 THR N . 19117 1 1557 . 1 1 136 136 PRO HA H 1 4.393 0.000 . 1 . . . A 1643 PRO HA . 19117 1 1558 . 1 1 136 136 PRO HB2 H 1 1.641 0.000 . 2 . . . A 1643 PRO HB2 . 19117 1 1559 . 1 1 136 136 PRO HB3 H 1 2.159 0.000 . 2 . . . A 1643 PRO HB3 . 19117 1 1560 . 1 1 136 136 PRO HG2 H 1 1.634 0.000 . 2 . . . A 1643 PRO HG2 . 19117 1 1561 . 1 1 136 136 PRO HG3 H 1 1.768 0.000 . 2 . . . A 1643 PRO HG3 . 19117 1 1562 . 1 1 136 136 PRO HD2 H 1 3.758 0.000 . 1 . . . A 1643 PRO HD2 . 19117 1 1563 . 1 1 136 136 PRO HD3 H 1 3.481 0.000 . 1 . . . A 1643 PRO HD3 . 19117 1 1564 . 1 1 136 136 PRO C C 13 180.172 0.000 . 1 . . . A 1643 PRO C . 19117 1 1565 . 1 1 136 136 PRO CA C 13 65.280 0.000 . 1 . . . A 1643 PRO CA . 19117 1 1566 . 1 1 136 136 PRO CB C 13 32.672 0.000 . 1 . . . A 1643 PRO CB . 19117 1 1567 . 1 1 136 136 PRO CG C 13 27.850 0.000 . 1 . . . A 1643 PRO CG . 19117 1 1568 . 1 1 136 136 PRO CD C 13 53.046 0.000 . 1 . . . A 1643 PRO CD . 19117 1 1569 . 1 1 137 137 LEU H H 1 8.056 0.000 . 1 . . . A 1644 LEU H . 19117 1 1570 . 1 1 137 137 LEU HA H 1 3.824 0.000 . 1 . . . A 1644 LEU HA . 19117 1 1571 . 1 1 137 137 LEU HB2 H 1 1.016 0.000 . 2 . . . A 1644 LEU HB2 . 19117 1 1572 . 1 1 137 137 LEU HB3 H 1 1.105 0.000 . 2 . . . A 1644 LEU HB3 . 19117 1 1573 . 1 1 137 137 LEU HG H 1 1.203 0.000 . 1 . . . A 1644 LEU HG . 19117 1 1574 . 1 1 137 137 LEU HD11 H 1 0.573 0.000 . 2 . . . A 1644 LEU HD11 . 19117 1 1575 . 1 1 137 137 LEU HD12 H 1 0.573 0.000 . 2 . . . A 1644 LEU HD12 . 19117 1 1576 . 1 1 137 137 LEU HD13 H 1 0.573 0.000 . 2 . . . A 1644 LEU HD13 . 19117 1 1577 . 1 1 137 137 LEU HD21 H 1 0.391 0.000 . 2 . . . A 1644 LEU HD21 . 19117 1 1578 . 1 1 137 137 LEU HD22 H 1 0.391 0.000 . 2 . . . A 1644 LEU HD22 . 19117 1 1579 . 1 1 137 137 LEU HD23 H 1 0.391 0.000 . 2 . . . A 1644 LEU HD23 . 19117 1 1580 . 1 1 137 137 LEU C C 13 177.798 0.000 . 1 . . . A 1644 LEU C . 19117 1 1581 . 1 1 137 137 LEU CA C 13 57.087 0.000 . 1 . . . A 1644 LEU CA . 19117 1 1582 . 1 1 137 137 LEU CB C 13 42.400 0.000 . 1 . . . A 1644 LEU CB . 19117 1 1583 . 1 1 137 137 LEU CG C 13 27.775 0.000 . 1 . . . A 1644 LEU CG . 19117 1 1584 . 1 1 137 137 LEU CD1 C 13 22.758 0.000 . 1 . . . A 1644 LEU CD1 . 19117 1 1585 . 1 1 137 137 LEU CD2 C 13 26.247 0.000 . 1 . . . A 1644 LEU CD2 . 19117 1 1586 . 1 1 137 137 LEU N N 15 118.529 0.000 . 1 . . . A 1644 LEU N . 19117 1 1587 . 1 1 138 138 ALA H H 1 6.777 0.000 . 1 . . . A 1645 ALA H . 19117 1 1588 . 1 1 138 138 ALA HA H 1 4.163 0.000 . 1 . . . A 1645 ALA HA . 19117 1 1589 . 1 1 138 138 ALA HB1 H 1 0.785 0.000 . 1 . . . A 1645 ALA HB1 . 19117 1 1590 . 1 1 138 138 ALA HB2 H 1 0.785 0.000 . 1 . . . A 1645 ALA HB2 . 19117 1 1591 . 1 1 138 138 ALA HB3 H 1 0.785 0.000 . 1 . . . A 1645 ALA HB3 . 19117 1 1592 . 1 1 138 138 ALA C C 13 175.970 0.000 . 1 . . . A 1645 ALA C . 19117 1 1593 . 1 1 138 138 ALA CA C 13 51.662 0.000 . 1 . . . A 1645 ALA CA . 19117 1 1594 . 1 1 138 138 ALA CB C 13 19.642 0.000 . 1 . . . A 1645 ALA CB . 19117 1 1595 . 1 1 138 138 ALA N N 15 116.698 0.000 . 1 . . . A 1645 ALA N . 19117 1 1596 . 1 1 139 139 CYS H H 1 7.248 0.000 . 1 . . . A 1646 CYS H . 19117 1 1597 . 1 1 139 139 CYS HA H 1 4.485 0.000 . 1 . . . A 1646 CYS HA . 19117 1 1598 . 1 1 139 139 CYS HB2 H 1 2.870 0.000 . 2 . . . A 1646 CYS HB2 . 19117 1 1599 . 1 1 139 139 CYS HB3 H 1 2.760 0.000 . 2 . . . A 1646 CYS HB3 . 19117 1 1600 . 1 1 139 139 CYS C C 13 174.521 0.000 . 1 . . . A 1646 CYS C . 19117 1 1601 . 1 1 139 139 CYS CA C 13 54.822 0.000 . 1 . . . A 1646 CYS CA . 19117 1 1602 . 1 1 139 139 CYS CB C 13 43.250 0.000 . 1 . . . A 1646 CYS CB . 19117 1 1603 . 1 1 139 139 CYS N N 15 116.825 0.000 . 1 . . . A 1646 CYS N . 19117 1 1604 . 1 1 140 140 GLU H H 1 8.632 0.000 . 1 . . . A 1647 GLU H . 19117 1 1605 . 1 1 140 140 GLU HA H 1 3.359 0.000 . 1 . . . A 1647 GLU HA . 19117 1 1606 . 1 1 140 140 GLU HB2 H 1 1.347 0.000 . 2 . . . A 1647 GLU HB2 . 19117 1 1607 . 1 1 140 140 GLU HB3 H 1 1.326 0.000 . 2 . . . A 1647 GLU HB3 . 19117 1 1608 . 1 1 140 140 GLU HG2 H 1 1.486 0.000 . 2 . . . A 1647 GLU HG2 . 19117 1 1609 . 1 1 140 140 GLU HG3 H 1 1.226 0.000 . 2 . . . A 1647 GLU HG3 . 19117 1 1610 . 1 1 140 140 GLU C C 13 175.418 0.000 . 1 . . . A 1647 GLU C . 19117 1 1611 . 1 1 140 140 GLU CA C 13 56.637 0.000 . 1 . . . A 1647 GLU CA . 19117 1 1612 . 1 1 140 140 GLU CB C 13 30.671 0.000 . 1 . . . A 1647 GLU CB . 19117 1 1613 . 1 1 140 140 GLU CG C 13 36.121 0.000 . 1 . . . A 1647 GLU CG . 19117 1 1614 . 1 1 140 140 GLU N N 15 124.737 0.000 . 1 . . . A 1647 GLU N . 19117 1 1615 . 1 1 141 141 LEU H H 1 7.655 0.000 . 1 . . . A 1648 LEU H . 19117 1 1616 . 1 1 141 141 LEU HA H 1 4.020 0.000 . 1 . . . A 1648 LEU HA . 19117 1 1617 . 1 1 141 141 LEU HB2 H 1 1.251 0.000 . 2 . . . A 1648 LEU HB2 . 19117 1 1618 . 1 1 141 141 LEU HB3 H 1 1.266 0.000 . 2 . . . A 1648 LEU HB3 . 19117 1 1619 . 1 1 141 141 LEU HG H 1 1.194 0.000 . 1 . . . A 1648 LEU HG . 19117 1 1620 . 1 1 141 141 LEU HD11 H 1 0.533 0.000 . 2 . . . A 1648 LEU HD11 . 19117 1 1621 . 1 1 141 141 LEU HD12 H 1 0.533 0.000 . 2 . . . A 1648 LEU HD12 . 19117 1 1622 . 1 1 141 141 LEU HD13 H 1 0.533 0.000 . 2 . . . A 1648 LEU HD13 . 19117 1 1623 . 1 1 141 141 LEU HD21 H 1 0.580 0.000 . 2 . . . A 1648 LEU HD21 . 19117 1 1624 . 1 1 141 141 LEU HD22 H 1 0.580 0.000 . 2 . . . A 1648 LEU HD22 . 19117 1 1625 . 1 1 141 141 LEU HD23 H 1 0.580 0.000 . 2 . . . A 1648 LEU HD23 . 19117 1 1626 . 1 1 141 141 LEU C C 13 176.746 0.000 . 1 . . . A 1648 LEU C . 19117 1 1627 . 1 1 141 141 LEU CA C 13 55.376 0.000 . 1 . . . A 1648 LEU CA . 19117 1 1628 . 1 1 141 141 LEU CB C 13 43.092 0.000 . 1 . . . A 1648 LEU CB . 19117 1 1629 . 1 1 141 141 LEU CG C 13 27.724 0.000 . 1 . . . A 1648 LEU CG . 19117 1 1630 . 1 1 141 141 LEU CD1 C 13 23.930 0.000 . 1 . . . A 1648 LEU CD1 . 19117 1 1631 . 1 1 141 141 LEU CD2 C 13 25.573 0.000 . 1 . . . A 1648 LEU CD2 . 19117 1 1632 . 1 1 141 141 LEU N N 15 123.858 0.000 . 1 . . . A 1648 LEU N . 19117 1 1633 . 1 1 142 142 ALA H H 1 7.588 0.000 . 1 . . . A 1649 ALA H . 19117 1 1634 . 1 1 142 142 ALA HA H 1 3.820 0.000 . 1 . . . A 1649 ALA HA . 19117 1 1635 . 1 1 142 142 ALA HB1 H 1 0.991 0.000 . 1 . . . A 1649 ALA HB1 . 19117 1 1636 . 1 1 142 142 ALA HB2 H 1 0.991 0.000 . 1 . . . A 1649 ALA HB2 . 19117 1 1637 . 1 1 142 142 ALA HB3 H 1 0.991 0.000 . 1 . . . A 1649 ALA HB3 . 19117 1 1638 . 1 1 142 142 ALA CA C 13 53.960 0.000 . 1 . . . A 1649 ALA CA . 19117 1 1639 . 1 1 142 142 ALA CB C 13 20.622 0.000 . 1 . . . A 1649 ALA CB . 19117 1 1640 . 1 1 142 142 ALA N N 15 129.538 0.000 . 1 . . . A 1649 ALA N . 19117 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_heteronuclear_noe_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_1 _Heteronucl_NOE_list.Entry_ID 19117 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 2 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 0 _Heteronucl_NOE_list.NOE_ref_description 'NOE ratio calculated.' _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 2 2 LYS N N 15 . 1 1 2 2 LYS H H 1 -0.7884 0.0088 . . . 1509 LYS N . 1509 LYS H 19117 1 2 . 1 1 3 3 SER N N 15 . 1 1 3 3 SER H H 1 -0.4657 0.0078 . . . 1510 SER N . 1510 SER H 19117 1 3 . 1 1 4 4 ASN N N 15 . 1 1 4 4 ASN H H 1 -0.2569 0.0096 . . . 1511 ASN N . 1511 ASN H 19117 1 4 . 1 1 5 5 GLU N N 15 . 1 1 5 5 GLU H H 1 0.1671 0.0081 . . . 1512 GLU N . 1512 GLU H 19117 1 5 . 1 1 6 6 HIS N N 15 . 1 1 6 6 HIS H H 1 0.2258 0.0135 . . . 1513 HIS N . 1513 HIS H 19117 1 6 . 1 1 7 7 ASP N N 15 . 1 1 7 7 ASP H H 1 0.4107 0.0159 . . . 1514 ASP N . 1514 ASP H 19117 1 7 . 1 1 8 8 ASP N N 15 . 1 1 8 8 ASP H H 1 -0.4695 0.0362 . . . 1515 ASP N . 1515 ASP H 19117 1 8 . 1 1 9 9 CYS N N 15 . 1 1 9 9 CYS H H 1 0.7971 0.0906 . . . 1516 CYS N . 1516 CYS H 19117 1 9 . 1 1 10 10 GLN N N 15 . 1 1 10 10 GLN H H 1 0.7801 0.0437 . . . 1517 GLN N . 1517 GLN H 19117 1 10 . 1 1 11 11 VAL N N 15 . 1 1 11 11 VAL H H 1 0.8014 0.0381 . . . 1518 VAL N . 1518 VAL H 19117 1 11 . 1 1 12 12 THR N N 15 . 1 1 12 12 THR H H 1 0.7233 0.0436 . . . 1519 THR N . 1519 THR H 19117 1 12 . 1 1 15 15 SER N N 15 . 1 1 15 15 SER H H 1 0.6895 0.0295 . . . 1522 SER N . 1522 SER H 19117 1 13 . 1 1 16 16 THR N N 15 . 1 1 16 16 THR H H 1 0.6897 0.0431 . . . 1523 THR N . 1523 THR H 19117 1 14 . 1 1 17 17 GLY N N 15 . 1 1 17 17 GLY H H 1 0.7757 0.0455 . . . 1524 GLY N . 1524 GLY H 19117 1 15 . 1 1 18 18 HIS N N 15 . 1 1 18 18 HIS H H 1 0.7816 0.0371 . . . 1525 HIS N . 1525 HIS H 19117 1 16 . 1 1 19 19 LEU N N 15 . 1 1 19 19 LEU H H 1 0.7944 0.0398 . . . 1526 LEU N . 1526 LEU H 19117 1 17 . 1 1 20 20 PHE N N 15 . 1 1 20 20 PHE H H 1 0.7921 0.0306 . . . 1527 PHE N . 1527 PHE H 19117 1 18 . 1 1 21 21 ASP N N 15 . 1 1 21 21 ASP H H 1 0.7193 0.0340 . . . 1528 ASP N . 1528 ASP H 19117 1 19 . 1 1 22 22 LEU N N 15 . 1 1 22 22 LEU H H 1 0.8567 0.0767 . . . 1529 LEU N . 1529 LEU H 19117 1 20 . 1 1 23 23 SER N N 15 . 1 1 23 23 SER H H 1 0.8606 0.0415 . . . 1530 SER N . 1530 SER H 19117 1 21 . 1 1 24 24 SER N N 15 . 1 1 24 24 SER H H 1 0.7666 0.0316 . . . 1531 SER N . 1531 SER H 19117 1 22 . 1 1 25 25 LEU N N 15 . 1 1 25 25 LEU H H 1 0.7780 0.0483 . . . 1532 LEU N . 1532 LEU H 19117 1 23 . 1 1 26 26 SER N N 15 . 1 1 26 26 SER H H 1 0.7759 0.0371 . . . 1533 SER N . 1533 SER H 19117 1 24 . 1 1 27 27 GLY N N 15 . 1 1 27 27 GLY H H 1 0.7937 0.0431 . . . 1534 GLY N . 1534 GLY H 19117 1 25 . 1 1 28 28 ARG N N 15 . 1 1 28 28 ARG H H 1 0.7466 0.0405 . . . 1535 ARG N . 1535 ARG H 19117 1 26 . 1 1 29 29 ALA N N 15 . 1 1 29 29 ALA H H 1 0.8653 0.0353 . . . 1536 ALA N . 1536 ALA H 19117 1 27 . 1 1 30 30 GLY N N 15 . 1 1 30 30 GLY H H 1 0.8061 0.0425 . . . 1537 GLY N . 1537 GLY H 19117 1 28 . 1 1 32 32 THR N N 15 . 1 1 32 32 THR H H 1 0.7431 0.0469 . . . 1539 THR N . 1539 THR H 19117 1 29 . 1 1 33 33 ALA N N 15 . 1 1 33 33 ALA H H 1 0.8197 0.0781 . . . 1540 ALA N . 1540 ALA H 19117 1 30 . 1 1 34 34 ALA N N 15 . 1 1 34 34 ALA H H 1 0.8236 0.0488 . . . 1541 ALA N . 1541 ALA H 19117 1 31 . 1 1 36 36 ALA N N 15 . 1 1 36 36 ALA H H 1 0.8443 0.0541 . . . 1543 ALA N . 1543 ALA H 19117 1 32 . 1 1 37 37 LYS N N 15 . 1 1 37 37 LYS H H 1 0.7589 0.0541 . . . 1544 LYS N . 1544 LYS H 19117 1 33 . 1 1 38 38 GLY N N 15 . 1 1 38 38 GLY H H 1 0.7604 0.0538 . . . 1545 GLY N . 1545 GLY H 19117 1 34 . 1 1 39 39 TRP N N 15 . 1 1 39 39 TRP H H 1 0.7063 0.0377 . . . 1546 TRP N . 1546 TRP H 19117 1 35 . 1 1 40 40 GLY N N 15 . 1 1 40 40 GLY H H 1 0.7827 0.0457 . . . 1547 GLY N . 1547 GLY H 19117 1 36 . 1 1 41 41 VAL N N 15 . 1 1 41 41 VAL H H 1 0.9315 0.0819 . . . 1548 VAL N . 1548 VAL H 19117 1 37 . 1 1 42 42 TYR N N 15 . 1 1 42 42 TYR H H 1 0.8994 0.0657 . . . 1549 TYR N . 1549 TYR H 19117 1 38 . 1 1 43 43 MET N N 15 . 1 1 43 43 MET H H 1 0.8305 0.0401 . . . 1550 MET N . 1550 MET H 19117 1 39 . 1 1 45 45 ILE N N 15 . 1 1 45 45 ILE H H 1 0.9716 0.1127 . . . 1552 ILE N . 1552 ILE H 19117 1 40 . 1 1 46 46 CYS N N 15 . 1 1 46 46 CYS H H 1 0.7929 0.0690 . . . 1553 CYS N . 1553 CYS H 19117 1 41 . 1 1 47 47 GLY N N 15 . 1 1 47 47 GLY H H 1 0.8511 0.0481 . . . 1554 GLY N . 1554 GLY H 19117 1 42 . 1 1 48 48 GLU N N 15 . 1 1 48 48 GLU H H 1 0.8485 0.0456 . . . 1555 GLU N . 1555 GLU H 19117 1 43 . 1 1 49 49 ASN N N 15 . 1 1 49 49 ASN H H 1 0.8900 0.0574 . . . 1556 ASN N . 1556 ASN H 19117 1 44 . 1 1 50 50 GLU N N 15 . 1 1 50 50 GLU H H 1 0.9064 0.0661 . . . 1557 GLU N . 1557 GLU H 19117 1 45 . 1 1 51 51 ASN N N 15 . 1 1 51 51 ASN H H 1 0.7519 0.0464 . . . 1558 ASN N . 1558 ASN H 19117 1 46 . 1 1 52 52 CYS N N 15 . 1 1 52 52 CYS H H 1 0.8490 0.0370 . . . 1559 CYS N . 1559 CYS H 19117 1 47 . 1 1 55 55 GLY N N 15 . 1 1 55 55 GLY H H 1 0.8099 0.0556 . . . 1562 GLY N . 1562 GLY H 19117 1 48 . 1 1 56 56 VAL N N 15 . 1 1 56 56 VAL H H 1 0.8342 0.0384 . . . 1563 VAL N . 1563 VAL H 19117 1 49 . 1 1 57 57 GLY N N 15 . 1 1 57 57 GLY H H 1 0.7934 0.0835 . . . 1564 GLY N . 1564 GLY H 19117 1 50 . 1 1 58 58 ALA N N 15 . 1 1 58 58 ALA H H 1 0.9346 0.0430 . . . 1565 ALA N . 1565 ALA H 19117 1 51 . 1 1 59 59 CYS N N 15 . 1 1 59 59 CYS H H 1 0.8214 0.0449 . . . 1566 CYS N . 1566 CYS H 19117 1 52 . 1 1 60 60 PHE N N 15 . 1 1 60 60 PHE H H 1 0.8226 0.0542 . . . 1567 PHE N . 1567 PHE H 19117 1 53 . 1 1 61 61 GLY N N 15 . 1 1 61 61 GLY H H 1 0.8723 0.0903 . . . 1568 GLY N . 1568 GLY H 19117 1 54 . 1 1 62 62 GLN N N 15 . 1 1 62 62 GLN H H 1 0.8025 0.0633 . . . 1569 GLN N . 1569 GLN H 19117 1 55 . 1 1 63 63 THR N N 15 . 1 1 63 63 THR H H 1 0.8168 0.0851 . . . 1570 THR N . 1570 THR H 19117 1 56 . 1 1 64 64 ARG N N 15 . 1 1 64 64 ARG H H 1 0.8685 0.0482 . . . 1571 ARG N . 1571 ARG H 19117 1 57 . 1 1 65 65 ILE N N 15 . 1 1 65 65 ILE H H 1 0.8831 0.0623 . . . 1572 ILE N . 1572 ILE H 19117 1 58 . 1 1 67 67 VAL N N 15 . 1 1 67 67 VAL H H 1 0.8457 0.0806 . . . 1574 VAL N . 1574 VAL H 19117 1 59 . 1 1 68 68 GLY N N 15 . 1 1 68 68 GLY H H 1 0.9018 0.0709 . . . 1575 GLY N . 1575 GLY H 19117 1 60 . 1 1 70 70 ALA N N 15 . 1 1 70 70 ALA H H 1 0.9040 0.0592 . . . 1577 ALA N . 1577 ALA H 19117 1 61 . 1 1 71 71 ASN N N 15 . 1 1 71 71 ASN H H 1 0.9208 0.0437 . . . 1578 ASN N . 1578 ASN H 19117 1 62 . 1 1 72 72 LYS N N 15 . 1 1 72 72 LYS H H 1 0.7317 0.0471 . . . 1579 LYS N . 1579 LYS H 19117 1 63 . 1 1 73 73 ARG N N 15 . 1 1 73 73 ARG H H 1 0.7375 0.0377 . . . 1580 ARG N . 1580 ARG H 19117 1 64 . 1 1 74 74 LEU N N 15 . 1 1 74 74 LEU H H 1 0.7679 0.0446 . . . 1581 LEU N . 1581 LEU H 19117 1 65 . 1 1 75 75 ARG N N 15 . 1 1 75 75 ARG H H 1 0.7735 0.0470 . . . 1582 ARG N . 1582 ARG H 19117 1 66 . 1 1 76 76 TYR N N 15 . 1 1 76 76 TYR H H 1 0.7410 0.0370 . . . 1583 TYR N . 1583 TYR H 19117 1 67 . 1 1 77 77 VAL N N 15 . 1 1 77 77 VAL H H 1 0.7515 0.0348 . . . 1584 VAL N . 1584 VAL H 19117 1 68 . 1 1 79 79 GLN N N 15 . 1 1 79 79 GLN H H 1 0.6396 0.0510 . . . 1586 GLN N . 1586 GLN H 19117 1 69 . 1 1 80 80 VAL N N 15 . 1 1 80 80 VAL H H 1 0.7178 0.0278 . . . 1587 VAL N . 1587 VAL H 19117 1 70 . 1 1 81 81 LEU N N 15 . 1 1 81 81 LEU H H 1 0.7438 0.0404 . . . 1588 LEU N . 1588 LEU H 19117 1 71 . 1 1 82 82 GLN N N 15 . 1 1 82 82 GLN H H 1 0.7913 0.0451 . . . 1589 GLN N . 1589 GLN H 19117 1 72 . 1 1 84 84 VAL N N 15 . 1 1 84 84 VAL H H 1 0.8093 0.0483 . . . 1591 VAL N . 1591 VAL H 19117 1 73 . 1 1 85 85 TYR N N 15 . 1 1 85 85 TYR H H 1 0.8547 0.0516 . . . 1592 TYR N . 1592 TYR H 19117 1 74 . 1 1 86 86 LYS N N 15 . 1 1 86 86 LYS H H 1 0.7604 0.0507 . . . 1593 LYS N . 1593 LYS H 19117 1 75 . 1 1 87 87 ASP N N 15 . 1 1 87 87 ASP H H 1 0.8274 0.0498 . . . 1594 ASP N . 1594 ASP H 19117 1 76 . 1 1 88 88 GLY N N 15 . 1 1 88 88 GLY H H 1 0.8070 0.0560 . . . 1595 GLY N . 1595 GLY H 19117 1 77 . 1 1 89 89 SER N N 15 . 1 1 89 89 SER H H 1 0.7892 0.0636 . . . 1596 SER N . 1596 SER H 19117 1 78 . 1 1 93 93 SER N N 15 . 1 1 93 93 SER H H 1 0.6908 0.0344 . . . 1600 SER N . 1600 SER H 19117 1 79 . 1 1 94 94 LYS N N 15 . 1 1 94 94 LYS H H 1 0.6430 0.0471 . . . 1601 LYS N . 1601 LYS H 19117 1 80 . 1 1 95 95 SER N N 15 . 1 1 95 95 SER H H 1 0.5845 0.0318 . . . 1602 SER N . 1602 SER H 19117 1 81 . 1 1 96 96 GLY N N 15 . 1 1 96 96 GLY H H 1 0.6139 0.0387 . . . 1603 GLY N . 1603 GLY H 19117 1 82 . 1 1 97 97 LEU N N 15 . 1 1 97 97 LEU H H 1 0.6381 0.0546 . . . 1604 LEU N . 1604 LEU H 19117 1 83 . 1 1 98 98 SER N N 15 . 1 1 98 98 SER H H 1 0.7950 0.0488 . . . 1605 SER N . 1605 SER H 19117 1 84 . 1 1 99 99 TYR N N 15 . 1 1 99 99 TYR H H 1 0.8257 0.0512 . . . 1606 TYR N . 1606 TYR H 19117 1 85 . 1 1 100 100 LYS N N 15 . 1 1 100 100 LYS H H 1 0.6653 0.0444 . . . 1607 LYS N . 1607 LYS H 19117 1 86 . 1 1 101 101 SER N N 15 . 1 1 101 101 SER H H 1 0.8861 0.0535 . . . 1608 SER N . 1608 SER H 19117 1 87 . 1 1 102 102 VAL N N 15 . 1 1 102 102 VAL H H 1 0.8512 0.0637 . . . 1609 VAL N . 1609 VAL H 19117 1 88 . 1 1 103 103 ILE N N 15 . 1 1 103 103 ILE H H 1 0.8356 0.0507 . . . 1610 ILE N . 1610 ILE H 19117 1 89 . 1 1 104 104 SER N N 15 . 1 1 104 104 SER H H 1 0.7583 0.0507 . . . 1611 SER N . 1611 SER H 19117 1 90 . 1 1 105 105 PHE N N 15 . 1 1 105 105 PHE H H 1 0.7613 0.0608 . . . 1612 PHE N . 1612 PHE H 19117 1 91 . 1 1 106 106 VAL N N 15 . 1 1 106 106 VAL H H 1 0.6023 0.0410 . . . 1613 VAL N . 1613 VAL H 19117 1 92 . 1 1 107 107 CYS N N 15 . 1 1 107 107 CYS H H 1 0.8786 0.0548 . . . 1614 CYS N . 1614 CYS H 19117 1 93 . 1 1 108 108 ARG N N 15 . 1 1 108 108 ARG H H 1 0.8029 0.0513 . . . 1615 ARG N . 1615 ARG H 19117 1 94 . 1 1 110 110 GLU N N 15 . 1 1 110 110 GLU H H 1 0.4070 0.0213 . . . 1617 GLU N . 1617 GLU H 19117 1 95 . 1 1 111 111 ALA N N 15 . 1 1 111 111 ALA H H 1 0.4454 0.0178 . . . 1618 ALA N . 1618 ALA H 19117 1 96 . 1 1 112 112 GLY N N 15 . 1 1 112 112 GLY H H 1 0.3516 0.0157 . . . 1619 GLY N . 1619 GLY H 19117 1 97 . 1 1 114 114 THR N N 15 . 1 1 114 114 THR H H 1 0.5580 0.0224 . . . 1621 THR N . 1621 THR H 19117 1 98 . 1 1 115 115 ASN N N 15 . 1 1 115 115 ASN H H 1 0.5088 0.0220 . . . 1622 ASN N . 1622 ASN H 19117 1 99 . 1 1 116 116 ARG N N 15 . 1 1 116 116 ARG H H 1 0.7041 0.0375 . . . 1623 ARG N . 1623 ARG H 19117 1 100 . 1 1 118 118 MET N N 15 . 1 1 118 118 MET H H 1 0.7229 0.0569 . . . 1625 MET N . 1625 MET H 19117 1 101 . 1 1 120 120 ILE N N 15 . 1 1 120 120 ILE H H 1 0.9237 0.1053 . . . 1627 ILE N . 1627 ILE H 19117 1 102 . 1 1 121 121 SER N N 15 . 1 1 121 121 SER H H 1 0.7989 0.0439 . . . 1628 SER N . 1628 SER H 19117 1 103 . 1 1 122 122 LEU N N 15 . 1 1 122 122 LEU H H 1 0.7655 0.0404 . . . 1629 LEU N . 1629 LEU H 19117 1 104 . 1 1 123 123 ASP N N 15 . 1 1 123 123 ASP H H 1 0.7369 0.0484 . . . 1630 ASP N . 1630 ASP H 19117 1 105 . 1 1 125 125 GLN N N 15 . 1 1 125 125 GLN H H 1 0.5941 0.0286 . . . 1632 GLN N . 1632 GLN H 19117 1 106 . 1 1 126 126 THR N N 15 . 1 1 126 126 THR H H 1 0.8266 0.0637 . . . 1633 THR N . 1633 THR H 19117 1 107 . 1 1 127 127 CYS N N 15 . 1 1 127 127 CYS H H 1 0.8668 0.0622 . . . 1634 CYS N . 1634 CYS H 19117 1 108 . 1 1 128 128 THR N N 15 . 1 1 128 128 THR H H 1 0.8807 0.0480 . . . 1635 THR N . 1635 THR H 19117 1 109 . 1 1 129 129 LEU N N 15 . 1 1 129 129 LEU H H 1 0.9071 0.0765 . . . 1636 LEU N . 1636 LEU H 19117 1 110 . 1 1 131 131 PHE N N 15 . 1 1 131 131 PHE H H 1 0.9648 0.0761 . . . 1638 PHE N . 1638 PHE H 19117 1 111 . 1 1 132 132 SER N N 15 . 1 1 132 132 SER H H 1 0.7860 0.0486 . . . 1639 SER N . 1639 SER H 19117 1 112 . 1 1 133 133 TRP N N 15 . 1 1 133 133 TRP H H 1 0.8466 0.0624 . . . 1640 TRP N . 1640 TRP H 19117 1 113 . 1 1 134 134 HIS N N 15 . 1 1 134 134 HIS H H 1 0.8098 0.0606 . . . 1641 HIS N . 1641 HIS H 19117 1 114 . 1 1 135 135 THR N N 15 . 1 1 135 135 THR H H 1 0.8544 0.0560 . . . 1642 THR N . 1642 THR H 19117 1 115 . 1 1 137 137 LEU N N 15 . 1 1 137 137 LEU H H 1 0.5240 0.0322 . . . 1644 LEU N . 1644 LEU H 19117 1 116 . 1 1 139 139 CYS N N 15 . 1 1 139 139 CYS H H 1 0.8536 0.0308 . . . 1646 CYS N . 1646 CYS H 19117 1 117 . 1 1 140 140 GLU N N 15 . 1 1 140 140 GLU H H 1 0.6493 0.0297 . . . 1647 GLU N . 1647 GLU H 19117 1 118 . 1 1 141 141 LEU N N 15 . 1 1 141 141 LEU H H 1 0.0867 0.0091 . . . 1648 LEU N . 1648 LEU H 19117 1 119 . 1 1 142 142 ALA N N 15 . 1 1 142 142 ALA H H 1 -0.6332 0.0067 . . . 1649 ALA N . 1649 ALA H 19117 1 stop_ save_ save_heteronuclear_noe_list_2 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_2 _Heteronucl_NOE_list.Entry_ID 19117 _Heteronucl_NOE_list.ID 2 _Heteronucl_NOE_list.Sample_condition_list_ID 2 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 0 _Heteronucl_NOE_list.NOE_ref_description 'NOE ratio calculated.' _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 2 2 LYS N N 15 . 1 1 2 2 LYS H H 1 -0.1136 0.0078 . . . 1509 LYS N . 1509 LYS H 19117 2 2 . 1 1 3 3 SER N N 15 . 1 1 3 3 SER H H 1 0.0305 0.0072 . . . 1510 SER N . 1510 SER H 19117 2 3 . 1 1 4 4 ASN N N 15 . 1 1 4 4 ASN H H 1 0.2453 0.0110 . . . 1511 ASN N . 1511 ASN H 19117 2 4 . 1 1 5 5 GLU N N 15 . 1 1 5 5 GLU H H 1 0.3477 0.0082 . . . 1512 GLU N . 1512 GLU H 19117 2 5 . 1 1 6 6 HIS N N 15 . 1 1 6 6 HIS H H 1 0.4610 0.0153 . . . 1513 HIS N . 1513 HIS H 19117 2 6 . 1 1 7 7 ASP N N 15 . 1 1 7 7 ASP H H 1 0.5592 0.0198 . . . 1514 ASP N . 1514 ASP H 19117 2 7 . 1 1 8 8 ASP N N 15 . 1 1 8 8 ASP H H 1 0.1402 0.0711 . . . 1515 ASP N . 1515 ASP H 19117 2 8 . 1 1 9 9 CYS N N 15 . 1 1 9 9 CYS H H 1 0.4864 0.1094 . . . 1516 CYS N . 1516 CYS H 19117 2 9 . 1 1 10 10 GLN N N 15 . 1 1 10 10 GLN H H 1 0.8831 0.0512 . . . 1517 GLN N . 1517 GLN H 19117 2 10 . 1 1 11 11 VAL N N 15 . 1 1 11 11 VAL H H 1 0.8678 0.0390 . . . 1518 VAL N . 1518 VAL H 19117 2 11 . 1 1 12 12 THR N N 15 . 1 1 12 12 THR H H 1 0.8594 0.0377 . . . 1519 THR N . 1519 THR H 19117 2 12 . 1 1 15 15 SER N N 15 . 1 1 15 15 SER H H 1 0.6868 0.0255 . . . 1522 SER N . 1522 SER H 19117 2 13 . 1 1 16 16 THR N N 15 . 1 1 16 16 THR H H 1 0.7090 0.0342 . . . 1523 THR N . 1523 THR H 19117 2 14 . 1 1 17 17 GLY N N 15 . 1 1 17 17 GLY H H 1 0.8204 0.0450 . . . 1524 GLY N . 1524 GLY H 19117 2 15 . 1 1 18 18 HIS N N 15 . 1 1 18 18 HIS H H 1 0.7942 0.0314 . . . 1525 HIS N . 1525 HIS H 19117 2 16 . 1 1 19 19 LEU N N 15 . 1 1 19 19 LEU H H 1 0.7787 0.0371 . . . 1526 LEU N . 1526 LEU H 19117 2 17 . 1 1 20 20 PHE N N 15 . 1 1 20 20 PHE H H 1 0.8424 0.0342 . . . 1527 PHE N . 1527 PHE H 19117 2 18 . 1 1 21 21 ASP N N 15 . 1 1 21 21 ASP H H 1 0.7732 0.0360 . . . 1528 ASP N . 1528 ASP H 19117 2 19 . 1 1 22 22 LEU N N 15 . 1 1 22 22 LEU H H 1 0.7824 0.0712 . . . 1529 LEU N . 1529 LEU H 19117 2 20 . 1 1 23 23 SER N N 15 . 1 1 23 23 SER H H 1 0.8580 0.0424 . . . 1530 SER N . 1530 SER H 19117 2 21 . 1 1 24 24 SER N N 15 . 1 1 24 24 SER H H 1 0.8296 0.0356 . . . 1531 SER N . 1531 SER H 19117 2 22 . 1 1 25 25 LEU N N 15 . 1 1 25 25 LEU H H 1 0.8007 0.0400 . . . 1532 LEU N . 1532 LEU H 19117 2 23 . 1 1 26 26 SER N N 15 . 1 1 26 26 SER H H 1 0.8266 0.0383 . . . 1533 SER N . 1533 SER H 19117 2 24 . 1 1 27 27 GLY N N 15 . 1 1 27 27 GLY H H 1 0.8287 0.0466 . . . 1534 GLY N . 1534 GLY H 19117 2 25 . 1 1 28 28 ARG N N 15 . 1 1 28 28 ARG H H 1 0.8321 0.0494 . . . 1535 ARG N . 1535 ARG H 19117 2 26 . 1 1 29 29 ALA N N 15 . 1 1 29 29 ALA H H 1 0.8145 0.0345 . . . 1536 ALA N . 1536 ALA H 19117 2 27 . 1 1 30 30 GLY N N 15 . 1 1 30 30 GLY H H 1 0.8516 0.0409 . . . 1537 GLY N . 1537 GLY H 19117 2 28 . 1 1 32 32 THR N N 15 . 1 1 32 32 THR H H 1 0.9200 0.0580 . . . 1539 THR N . 1539 THR H 19117 2 29 . 1 1 33 33 ALA N N 15 . 1 1 33 33 ALA H H 1 0.8588 0.0781 . . . 1540 ALA N . 1540 ALA H 19117 2 30 . 1 1 34 34 ALA N N 15 . 1 1 34 34 ALA H H 1 0.8604 0.0518 . . . 1541 ALA N . 1541 ALA H 19117 2 31 . 1 1 36 36 ALA N N 15 . 1 1 36 36 ALA H H 1 0.8845 0.0488 . . . 1543 ALA N . 1543 ALA H 19117 2 32 . 1 1 37 37 LYS N N 15 . 1 1 37 37 LYS H H 1 0.7676 0.0840 . . . 1544 LYS N . 1544 LYS H 19117 2 33 . 1 1 38 38 GLY N N 15 . 1 1 38 38 GLY H H 1 0.8138 0.0553 . . . 1545 GLY N . 1545 GLY H 19117 2 34 . 1 1 39 39 TRP N N 15 . 1 1 39 39 TRP H H 1 0.8840 0.0392 . . . 1546 TRP N . 1546 TRP H 19117 2 35 . 1 1 40 40 GLY N N 15 . 1 1 40 40 GLY H H 1 0.8270 0.0467 . . . 1547 GLY N . 1547 GLY H 19117 2 36 . 1 1 41 41 VAL N N 15 . 1 1 41 41 VAL H H 1 0.8047 0.0772 . . . 1548 VAL N . 1548 VAL H 19117 2 37 . 1 1 42 42 TYR N N 15 . 1 1 42 42 TYR H H 1 0.8741 0.0630 . . . 1549 TYR N . 1549 TYR H 19117 2 38 . 1 1 43 43 MET N N 15 . 1 1 43 43 MET H H 1 0.9356 0.0461 . . . 1550 MET N . 1550 MET H 19117 2 39 . 1 1 45 45 ILE N N 15 . 1 1 45 45 ILE H H 1 0.7941 0.1199 . . . 1552 ILE N . 1552 ILE H 19117 2 40 . 1 1 46 46 CYS N N 15 . 1 1 46 46 CYS H H 1 0.8037 0.0555 . . . 1553 CYS N . 1553 CYS H 19117 2 41 . 1 1 47 47 GLY N N 15 . 1 1 47 47 GLY H H 1 0.7882 0.0296 . . . 1554 GLY N . 1554 GLY H 19117 2 42 . 1 1 48 48 GLU N N 15 . 1 1 48 48 GLU H H 1 0.8521 0.0411 . . . 1555 GLU N . 1555 GLU H 19117 2 43 . 1 1 49 49 ASN N N 15 . 1 1 49 49 ASN H H 1 0.9037 0.0489 . . . 1556 ASN N . 1556 ASN H 19117 2 44 . 1 1 50 50 GLU N N 15 . 1 1 50 50 GLU H H 1 0.8569 0.0689 . . . 1557 GLU N . 1557 GLU H 19117 2 45 . 1 1 51 51 ASN N N 15 . 1 1 51 51 ASN H H 1 0.8812 0.0527 . . . 1558 ASN N . 1558 ASN H 19117 2 46 . 1 1 52 52 CYS N N 15 . 1 1 52 52 CYS H H 1 0.8424 0.0351 . . . 1559 CYS N . 1559 CYS H 19117 2 47 . 1 1 55 55 GLY N N 15 . 1 1 55 55 GLY H H 1 0.7430 0.0555 . . . 1562 GLY N . 1562 GLY H 19117 2 48 . 1 1 56 56 VAL N N 15 . 1 1 56 56 VAL H H 1 0.7879 0.0379 . . . 1563 VAL N . 1563 VAL H 19117 2 49 . 1 1 57 57 GLY N N 15 . 1 1 57 57 GLY H H 1 0.9449 0.0972 . . . 1564 GLY N . 1564 GLY H 19117 2 50 . 1 1 58 58 ALA N N 15 . 1 1 58 58 ALA H H 1 0.8564 0.0334 . . . 1565 ALA N . 1565 ALA H 19117 2 51 . 1 1 59 59 CYS N N 15 . 1 1 59 59 CYS H H 1 0.9104 0.0545 . . . 1566 CYS N . 1566 CYS H 19117 2 52 . 1 1 60 60 PHE N N 15 . 1 1 60 60 PHE H H 1 0.8623 0.0554 . . . 1567 PHE N . 1567 PHE H 19117 2 53 . 1 1 61 61 GLY N N 15 . 1 1 61 61 GLY H H 1 0.8184 0.0800 . . . 1568 GLY N . 1568 GLY H 19117 2 54 . 1 1 62 62 GLN N N 15 . 1 1 62 62 GLN H H 1 0.8981 0.0949 . . . 1569 GLN N . 1569 GLN H 19117 2 55 . 1 1 63 63 THR N N 15 . 1 1 63 63 THR H H 1 0.6957 0.1037 . . . 1570 THR N . 1570 THR H 19117 2 56 . 1 1 64 64 ARG N N 15 . 1 1 64 64 ARG H H 1 0.9007 0.0489 . . . 1571 ARG N . 1571 ARG H 19117 2 57 . 1 1 65 65 ILE N N 15 . 1 1 65 65 ILE H H 1 0.9008 0.0535 . . . 1572 ILE N . 1572 ILE H 19117 2 58 . 1 1 67 67 VAL N N 15 . 1 1 67 67 VAL H H 1 0.8455 0.0739 . . . 1574 VAL N . 1574 VAL H 19117 2 59 . 1 1 68 68 GLY N N 15 . 1 1 68 68 GLY H H 1 0.8234 0.0504 . . . 1575 GLY N . 1575 GLY H 19117 2 60 . 1 1 70 70 ALA N N 15 . 1 1 70 70 ALA H H 1 0.8439 0.0462 . . . 1577 ALA N . 1577 ALA H 19117 2 61 . 1 1 71 71 ASN N N 15 . 1 1 71 71 ASN H H 1 1.0190 0.0437 . . . 1578 ASN N . 1578 ASN H 19117 2 62 . 1 1 72 72 LYS N N 15 . 1 1 72 72 LYS H H 1 0.7504 0.0507 . . . 1579 LYS N . 1579 LYS H 19117 2 63 . 1 1 73 73 ARG N N 15 . 1 1 73 73 ARG H H 1 0.8796 0.0501 . . . 1580 ARG N . 1580 ARG H 19117 2 64 . 1 1 74 74 LEU N N 15 . 1 1 74 74 LEU H H 1 0.8279 0.0515 . . . 1581 LEU N . 1581 LEU H 19117 2 65 . 1 1 75 75 ARG N N 15 . 1 1 75 75 ARG H H 1 0.7872 0.0494 . . . 1582 ARG N . 1582 ARG H 19117 2 66 . 1 1 76 76 TYR N N 15 . 1 1 76 76 TYR H H 1 0.7576 0.0388 . . . 1583 TYR N . 1583 TYR H 19117 2 67 . 1 1 77 77 VAL N N 15 . 1 1 77 77 VAL H H 1 0.7716 0.0352 . . . 1584 VAL N . 1584 VAL H 19117 2 68 . 1 1 79 79 GLN N N 15 . 1 1 79 79 GLN H H 1 0.7275 0.0464 . . . 1586 GLN N . 1586 GLN H 19117 2 69 . 1 1 80 80 VAL N N 15 . 1 1 80 80 VAL H H 1 0.7323 0.0255 . . . 1587 VAL N . 1587 VAL H 19117 2 70 . 1 1 81 81 LEU N N 15 . 1 1 81 81 LEU H H 1 0.8333 0.0430 . . . 1588 LEU N . 1588 LEU H 19117 2 71 . 1 1 82 82 GLN N N 15 . 1 1 82 82 GLN H H 1 0.8368 0.0490 . . . 1589 GLN N . 1589 GLN H 19117 2 72 . 1 1 84 84 VAL N N 15 . 1 1 84 84 VAL H H 1 0.9478 0.0615 . . . 1591 VAL N . 1591 VAL H 19117 2 73 . 1 1 85 85 TYR N N 15 . 1 1 85 85 TYR H H 1 0.8606 0.0636 . . . 1592 TYR N . 1592 TYR H 19117 2 74 . 1 1 86 86 LYS N N 15 . 1 1 86 86 LYS H H 1 0.9759 0.0616 . . . 1593 LYS N . 1593 LYS H 19117 2 75 . 1 1 87 87 ASP N N 15 . 1 1 87 87 ASP H H 1 0.7546 0.0490 . . . 1594 ASP N . 1594 ASP H 19117 2 76 . 1 1 88 88 GLY N N 15 . 1 1 88 88 GLY H H 1 0.8662 0.0440 . . . 1595 GLY N . 1595 GLY H 19117 2 77 . 1 1 89 89 SER N N 15 . 1 1 89 89 SER H H 1 0.8870 0.0730 . . . 1596 SER N . 1596 SER H 19117 2 78 . 1 1 93 93 SER N N 15 . 1 1 93 93 SER H H 1 0.7571 0.0362 . . . 1600 SER N . 1600 SER H 19117 2 79 . 1 1 94 94 LYS N N 15 . 1 1 94 94 LYS H H 1 0.6761 0.0578 . . . 1601 LYS N . 1601 LYS H 19117 2 80 . 1 1 95 95 SER N N 15 . 1 1 95 95 SER H H 1 0.6571 0.0337 . . . 1602 SER N . 1602 SER H 19117 2 81 . 1 1 96 96 GLY N N 15 . 1 1 96 96 GLY H H 1 0.7070 0.0406 . . . 1603 GLY N . 1603 GLY H 19117 2 82 . 1 1 97 97 LEU N N 15 . 1 1 97 97 LEU H H 1 0.6715 0.0491 . . . 1604 LEU N . 1604 LEU H 19117 2 83 . 1 1 98 98 SER N N 15 . 1 1 98 98 SER H H 1 0.8615 0.0571 . . . 1605 SER N . 1605 SER H 19117 2 84 . 1 1 99 99 TYR N N 15 . 1 1 99 99 TYR H H 1 0.8515 0.0471 . . . 1606 TYR N . 1606 TYR H 19117 2 85 . 1 1 100 100 LYS N N 15 . 1 1 100 100 LYS H H 1 0.7585 0.0474 . . . 1607 LYS N . 1607 LYS H 19117 2 86 . 1 1 101 101 SER N N 15 . 1 1 101 101 SER H H 1 0.9320 0.0555 . . . 1608 SER N . 1608 SER H 19117 2 87 . 1 1 102 102 VAL N N 15 . 1 1 102 102 VAL H H 1 0.8597 0.0676 . . . 1609 VAL N . 1609 VAL H 19117 2 88 . 1 1 103 103 ILE N N 15 . 1 1 103 103 ILE H H 1 0.8310 0.0579 . . . 1610 ILE N . 1610 ILE H 19117 2 89 . 1 1 104 104 SER N N 15 . 1 1 104 104 SER H H 1 0.8514 0.0462 . . . 1611 SER N . 1611 SER H 19117 2 90 . 1 1 105 105 PHE N N 15 . 1 1 105 105 PHE H H 1 0.8652 0.0800 . . . 1612 PHE N . 1612 PHE H 19117 2 91 . 1 1 106 106 VAL N N 15 . 1 1 106 106 VAL H H 1 0.7133 0.0451 . . . 1613 VAL N . 1613 VAL H 19117 2 92 . 1 1 107 107 CYS N N 15 . 1 1 107 107 CYS H H 1 0.8683 0.0531 . . . 1614 CYS N . 1614 CYS H 19117 2 93 . 1 1 108 108 ARG N N 15 . 1 1 108 108 ARG H H 1 0.9042 0.0602 . . . 1615 ARG N . 1615 ARG H 19117 2 94 . 1 1 110 110 GLU N N 15 . 1 1 110 110 GLU H H 1 0.4366 0.0224 . . . 1617 GLU N . 1617 GLU H 19117 2 95 . 1 1 111 111 ALA N N 15 . 1 1 111 111 ALA H H 1 0.6058 0.0214 . . . 1618 ALA N . 1618 ALA H 19117 2 96 . 1 1 112 112 GLY N N 15 . 1 1 112 112 GLY H H 1 0.4805 0.0148 . . . 1619 GLY N . 1619 GLY H 19117 2 97 . 1 1 114 114 THR N N 15 . 1 1 114 114 THR H H 1 0.6093 0.0212 . . . 1621 THR N . 1621 THR H 19117 2 98 . 1 1 115 115 ASN N N 15 . 1 1 115 115 ASN H H 1 0.5705 0.0226 . . . 1622 ASN N . 1622 ASN H 19117 2 99 . 1 1 116 116 ARG N N 15 . 1 1 116 116 ARG H H 1 0.7846 0.0312 . . . 1623 ARG N . 1623 ARG H 19117 2 100 . 1 1 118 118 MET N N 15 . 1 1 118 118 MET H H 1 0.6798 0.0636 . . . 1625 MET N . 1625 MET H 19117 2 101 . 1 1 120 120 ILE N N 15 . 1 1 120 120 ILE H H 1 0.8949 0.0977 . . . 1627 ILE N . 1627 ILE H 19117 2 102 . 1 1 121 121 SER N N 15 . 1 1 121 121 SER H H 1 0.8420 0.0416 . . . 1628 SER N . 1628 SER H 19117 2 103 . 1 1 122 122 LEU N N 15 . 1 1 122 122 LEU H H 1 0.8002 0.0398 . . . 1629 LEU N . 1629 LEU H 19117 2 104 . 1 1 123 123 ASP N N 15 . 1 1 123 123 ASP H H 1 0.7474 0.0547 . . . 1630 ASP N . 1630 ASP H 19117 2 105 . 1 1 125 125 GLN N N 15 . 1 1 125 125 GLN H H 1 0.6677 0.0324 . . . 1632 GLN N . 1632 GLN H 19117 2 106 . 1 1 126 126 THR N N 15 . 1 1 126 126 THR H H 1 0.8579 0.0424 . . . 1633 THR N . 1633 THR H 19117 2 107 . 1 1 127 127 CYS N N 15 . 1 1 127 127 CYS H H 1 0.8633 0.0557 . . . 1634 CYS N . 1634 CYS H 19117 2 108 . 1 1 128 128 THR N N 15 . 1 1 128 128 THR H H 1 0.8737 0.0405 . . . 1635 THR N . 1635 THR H 19117 2 109 . 1 1 129 129 LEU N N 15 . 1 1 129 129 LEU H H 1 0.9485 0.0867 . . . 1636 LEU N . 1636 LEU H 19117 2 110 . 1 1 131 131 PHE N N 15 . 1 1 131 131 PHE H H 1 0.8014 0.0756 . . . 1638 PHE N . 1638 PHE H 19117 2 111 . 1 1 132 132 SER N N 15 . 1 1 132 132 SER H H 1 0.9122 0.0662 . . . 1639 SER N . 1639 SER H 19117 2 112 . 1 1 133 133 TRP N N 15 . 1 1 133 133 TRP H H 1 0.8646 0.0654 . . . 1640 TRP N . 1640 TRP H 19117 2 113 . 1 1 134 134 HIS N N 15 . 1 1 134 134 HIS H H 1 0.9224 0.0731 . . . 1641 HIS N . 1641 HIS H 19117 2 114 . 1 1 135 135 THR N N 15 . 1 1 135 135 THR H H 1 0.8138 0.0438 . . . 1642 THR N . 1642 THR H 19117 2 115 . 1 1 137 137 LEU N N 15 . 1 1 137 137 LEU H H 1 0.5496 0.0574 . . . 1644 LEU N . 1644 LEU H 19117 2 116 . 1 1 139 139 CYS N N 15 . 1 1 139 139 CYS H H 1 0.8096 0.0286 . . . 1646 CYS N . 1646 CYS H 19117 2 117 . 1 1 140 140 GLU N N 15 . 1 1 140 140 GLU H H 1 0.7277 0.0352 . . . 1647 GLU N . 1647 GLU H 19117 2 118 . 1 1 141 141 LEU N N 15 . 1 1 141 141 LEU H H 1 0.3830 0.0096 . . . 1648 LEU N . 1648 LEU H 19117 2 119 . 1 1 142 142 ALA N N 15 . 1 1 142 142 ALA H H 1 -0.0939 0.0055 . . . 1649 ALA N . 1649 ALA H 19117 2 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronuclear_T1_list_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_1 _Heteronucl_T1_list.Entry_ID 19117 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Sample_condition_list_ID 2 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_T1_list.Spectrometer_frequency_1H 600 _Heteronucl_T1_list.T1_coherence_type Iz;Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 LYS N N 15 1.1635 0.0053 . . 1509 LYS N 19117 1 2 . 1 1 3 3 SER N N 15 1.1844 0.0048 . . 1510 SER N 19117 1 3 . 1 1 4 4 ASN N N 15 1.3155 0.0080 . . 1511 ASN N 19117 1 4 . 1 1 5 5 GLU N N 15 1.3404 0.0071 . . 1512 GLU N 19117 1 5 . 1 1 6 6 HIS N N 15 1.3910 0.0136 . . 1513 HIS N 19117 1 6 . 1 1 7 7 ASP N N 15 1.3375 0.0153 . . 1514 ASP N 19117 1 7 . 1 1 8 8 ASP N N 15 1.2961 0.0366 . . 1515 ASP N 19117 1 8 . 1 1 9 9 CYS N N 15 1.0846 0.0952 . . 1516 CYS N 19117 1 9 . 1 1 10 10 GLN N N 15 0.9664 0.0347 . . 1517 GLN N 19117 1 10 . 1 1 11 11 VAL N N 15 0.9652 0.0320 . . 1518 VAL N 19117 1 11 . 1 1 12 12 THR N N 15 1.0183 0.0360 . . 1519 THR N 19117 1 12 . 1 1 15 15 SER N N 15 0.8837 0.0208 . . 1522 SER N 19117 1 13 . 1 1 16 16 THR N N 15 0.8821 0.0381 . . 1523 THR N 19117 1 14 . 1 1 17 17 GLY N N 15 0.9286 0.0440 . . 1524 GLY N 19117 1 15 . 1 1 18 18 HIS N N 15 1.1474 0.0382 . . 1525 HIS N 19117 1 16 . 1 1 19 19 LEU N N 15 0.8527 0.0296 . . 1526 LEU N 19117 1 17 . 1 1 20 20 PHE N N 15 0.9575 0.0312 . . 1527 PHE N 19117 1 18 . 1 1 21 21 ASP N N 15 1.0119 0.0262 . . 1528 ASP N 19117 1 19 . 1 1 22 22 LEU N N 15 0.9240 0.0563 . . 1529 LEU N 19117 1 20 . 1 1 23 23 SER N N 15 0.9896 0.0374 . . 1530 SER N 19117 1 21 . 1 1 24 24 SER N N 15 1.1313 0.0376 . . 1531 SER N 19117 1 22 . 1 1 25 25 LEU N N 15 1.0029 0.0429 . . 1532 LEU N 19117 1 23 . 1 1 26 26 SER N N 15 0.9140 0.0294 . . 1533 SER N 19117 1 24 . 1 1 27 27 GLY N N 15 1.0290 0.0434 . . 1534 GLY N 19117 1 25 . 1 1 28 28 ARG N N 15 0.9549 0.0429 . . 1535 ARG N 19117 1 26 . 1 1 29 29 ALA N N 15 0.8151 0.0216 . . 1536 ALA N 19117 1 27 . 1 1 30 30 GLY N N 15 0.8065 0.0383 . . 1537 GLY N 19117 1 28 . 1 1 32 32 THR N N 15 0.8317 0.0404 . . 1539 THR N 19117 1 29 . 1 1 33 33 ALA N N 15 0.9087 0.0667 . . 1540 ALA N 19117 1 30 . 1 1 34 34 ALA N N 15 0.7488 0.0319 . . 1541 ALA N 19117 1 31 . 1 1 36 36 ALA N N 15 0.8279 0.0411 . . 1543 ALA N 19117 1 32 . 1 1 37 37 LYS N N 15 0.7768 0.0372 . . 1544 LYS N 19117 1 33 . 1 1 38 38 GLY N N 15 0.7543 0.0403 . . 1545 GLY N 19117 1 34 . 1 1 39 39 TRP N N 15 0.9776 0.0324 . . 1546 TRP N 19117 1 35 . 1 1 40 40 GLY N N 15 0.8843 0.0415 . . 1547 GLY N 19117 1 36 . 1 1 41 41 VAL N N 15 0.9548 0.0799 . . 1548 VAL N 19117 1 37 . 1 1 42 42 TYR N N 15 0.8728 0.0630 . . 1549 TYR N 19117 1 38 . 1 1 43 43 MET N N 15 1.0084 0.0445 . . 1550 MET N 19117 1 39 . 1 1 45 45 ILE N N 15 0.9380 0.1206 . . 1552 ILE N 19117 1 40 . 1 1 46 46 CYS N N 15 1.0059 0.0802 . . 1553 CYS N 19117 1 41 . 1 1 47 47 GLY N N 15 0.8554 0.0374 . . 1554 GLY N 19117 1 42 . 1 1 48 48 GLU N N 15 0.8948 0.0377 . . 1555 GLU N 19117 1 43 . 1 1 49 49 ASN N N 15 0.9167 0.0525 . . 1556 ASN N 19117 1 44 . 1 1 50 50 GLU N N 15 0.8340 0.0669 . . 1557 GLU N 19117 1 45 . 1 1 51 51 ASN N N 15 0.9014 0.0464 . . 1558 ASN N 19117 1 46 . 1 1 52 52 CYS N N 15 0.8160 0.0286 . . 1559 CYS N 19117 1 47 . 1 1 55 55 GLY N N 15 0.8965 0.0610 . . 1562 GLY N 19117 1 48 . 1 1 56 56 VAL N N 15 0.9939 0.0353 . . 1563 VAL N 19117 1 49 . 1 1 57 57 GLY N N 15 0.9333 0.0993 . . 1564 GLY N 19117 1 50 . 1 1 58 58 ALA N N 15 0.9875 0.0372 . . 1565 ALA N 19117 1 51 . 1 1 59 59 CYS N N 15 0.8871 0.0431 . . 1566 CYS N 19117 1 52 . 1 1 60 60 PHE N N 15 0.9714 0.0563 . . 1567 PHE N 19117 1 53 . 1 1 61 61 GLY N N 15 0.8825 0.0963 . . 1568 GLY N 19117 1 54 . 1 1 62 62 GLN N N 15 0.8247 0.0625 . . 1569 GLN N 19117 1 55 . 1 1 63 63 THR N N 15 0.9142 0.0836 . . 1570 THR N 19117 1 56 . 1 1 64 64 ARG N N 15 0.9895 0.0294 . . 1571 ARG N 19117 1 57 . 1 1 65 65 ILE N N 15 0.9218 0.0581 . . 1572 ILE N 19117 1 58 . 1 1 67 67 VAL N N 15 0.9629 0.0984 . . 1574 VAL N 19117 1 59 . 1 1 68 68 GLY N N 15 0.8486 0.0578 . . 1575 GLY N 19117 1 60 . 1 1 70 70 ALA N N 15 0.9573 0.0465 . . 1577 ALA N 19117 1 61 . 1 1 71 71 ASN N N 15 0.8831 0.0386 . . 1578 ASN N 19117 1 62 . 1 1 72 72 LYS N N 15 0.9092 0.0411 . . 1579 LYS N 19117 1 63 . 1 1 73 73 ARG N N 15 0.7922 0.0287 . . 1580 ARG N 19117 1 64 . 1 1 74 74 LEU N N 15 0.8571 0.0321 . . 1581 LEU N 19117 1 65 . 1 1 75 75 ARG N N 15 0.9017 0.0404 . . 1582 ARG N 19117 1 66 . 1 1 76 76 TYR N N 15 0.9432 0.0321 . . 1583 TYR N 19117 1 67 . 1 1 77 77 VAL N N 15 0.9914 0.0286 . . 1584 VAL N 19117 1 68 . 1 1 79 79 GLN N N 15 0.9099 0.0438 . . 1586 GLN N 19117 1 69 . 1 1 80 80 VAL N N 15 1.0283 0.0202 . . 1587 VAL N 19117 1 70 . 1 1 81 81 LEU N N 15 1.0905 0.0373 . . 1588 LEU N 19117 1 71 . 1 1 82 82 GLN N N 15 0.8638 0.0368 . . 1589 GLN N 19117 1 72 . 1 1 84 84 VAL N N 15 0.8039 0.0394 . . 1591 VAL N 19117 1 73 . 1 1 85 85 TYR N N 15 0.8838 0.0481 . . 1592 TYR N 19117 1 74 . 1 1 86 86 LYS N N 15 0.8039 0.0431 . . 1593 LYS N 19117 1 75 . 1 1 87 87 ASP N N 15 0.9287 0.0454 . . 1594 ASP N 19117 1 76 . 1 1 88 88 GLY N N 15 0.9824 0.0518 . . 1595 GLY N 19117 1 77 . 1 1 89 89 SER N N 15 1.0166 0.0779 . . 1596 SER N 19117 1 78 . 1 1 93 93 SER N N 15 1.0411 0.0288 . . 1600 SER N 19117 1 79 . 1 1 94 94 LYS N N 15 0.9966 0.0482 . . 1601 LYS N 19117 1 80 . 1 1 95 95 SER N N 15 0.9660 0.0281 . . 1602 SER N 19117 1 81 . 1 1 96 96 GLY N N 15 0.9285 0.0336 . . 1603 GLY N 19117 1 82 . 1 1 97 97 LEU N N 15 0.9641 0.0522 . . 1604 LEU N 19117 1 83 . 1 1 98 98 SER N N 15 0.8777 0.0374 . . 1605 SER N 19117 1 84 . 1 1 99 99 TYR N N 15 0.9602 0.0453 . . 1606 TYR N 19117 1 85 . 1 1 100 100 LYS N N 15 1.0413 0.0408 . . 1607 LYS N 19117 1 86 . 1 1 101 101 SER N N 15 0.8925 0.0425 . . 1608 SER N 19117 1 87 . 1 1 102 102 VAL N N 15 0.8014 0.0563 . . 1609 VAL N 19117 1 88 . 1 1 103 103 ILE N N 15 0.9673 0.0507 . . 1610 ILE N 19117 1 89 . 1 1 104 104 SER N N 15 0.8965 0.0391 . . 1611 SER N 19117 1 90 . 1 1 105 105 PHE N N 15 0.9371 0.0663 . . 1612 PHE N 19117 1 91 . 1 1 106 106 VAL N N 15 1.1086 0.0442 . . 1613 VAL N 19117 1 92 . 1 1 107 107 CYS N N 15 0.9643 0.0456 . . 1614 CYS N 19117 1 93 . 1 1 108 108 ARG N N 15 0.9495 0.0428 . . 1615 ARG N 19117 1 94 . 1 1 110 110 GLU N N 15 0.8983 0.0163 . . 1617 GLU N 19117 1 95 . 1 1 111 111 ALA N N 15 1.0254 0.0146 . . 1618 ALA N 19117 1 96 . 1 1 112 112 GLY N N 15 1.0379 0.0118 . . 1619 GLY N 19117 1 97 . 1 1 114 114 THR N N 15 1.1139 0.0195 . . 1621 THR N 19117 1 98 . 1 1 115 115 ASN N N 15 1.2134 0.0211 . . 1622 ASN N 19117 1 99 . 1 1 116 116 ARG N N 15 1.0232 0.0287 . . 1623 ARG N 19117 1 100 . 1 1 118 118 MET N N 15 0.7480 0.0578 . . 1625 MET N 19117 1 101 . 1 1 120 120 ILE N N 15 0.8513 0.0973 . . 1627 ILE N 19117 1 102 . 1 1 121 121 SER N N 15 0.8679 0.0377 . . 1628 SER N 19117 1 103 . 1 1 122 122 LEU N N 15 0.8821 0.0306 . . 1629 LEU N 19117 1 104 . 1 1 123 123 ASP N N 15 0.8808 0.0462 . . 1630 ASP N 19117 1 105 . 1 1 125 125 GLN N N 15 0.9123 0.0228 . . 1632 GLN N 19117 1 106 . 1 1 126 126 THR N N 15 1.0125 0.0551 . . 1633 THR N 19117 1 107 . 1 1 127 127 CYS N N 15 0.9402 0.0440 . . 1634 CYS N 19117 1 108 . 1 1 128 128 THR N N 15 0.9383 0.0361 . . 1635 THR N 19117 1 109 . 1 1 129 129 LEU N N 15 0.9264 0.0745 . . 1636 LEU N 19117 1 110 . 1 1 131 131 PHE N N 15 0.9284 0.0710 . . 1638 PHE N 19117 1 111 . 1 1 132 132 SER N N 15 0.8448 0.0487 . . 1639 SER N 19117 1 112 . 1 1 133 133 TRP N N 15 0.9169 0.0535 . . 1640 TRP N 19117 1 113 . 1 1 134 134 HIS N N 15 0.8970 0.0619 . . 1641 HIS N 19117 1 114 . 1 1 135 135 THR N N 15 0.9936 0.0506 . . 1642 THR N 19117 1 115 . 1 1 137 137 LEU N N 15 1.1992 0.0368 . . 1644 LEU N 19117 1 116 . 1 1 139 139 CYS N N 15 0.9653 0.0235 . . 1646 CYS N 19117 1 117 . 1 1 140 140 GLU N N 15 0.8532 0.0262 . . 1647 GLU N 19117 1 118 . 1 1 141 141 LEU N N 15 1.3129 0.0079 . . 1648 LEU N 19117 1 119 . 1 1 142 142 ALA N N 15 0.9046 0.0028 . . 1649 ALA N 19117 1 stop_ save_ save_heteronuclear_T1_list_2 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_2 _Heteronucl_T1_list.Entry_ID 19117 _Heteronucl_T1_list.ID 2 _Heteronucl_T1_list.Sample_condition_list_ID 2 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_T1_list.Spectrometer_frequency_1H 600 _Heteronucl_T1_list.T1_coherence_type Iz;Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 LYS N N 15 0.9338 0.0076 . . 1509 LYS N 19117 2 2 . 1 1 3 3 SER N N 15 1.0296 0.0057 . . 1510 SER N 19117 2 3 . 1 1 4 4 ASN N N 15 1.1314 0.0098 . . 1511 ASN N 19117 2 4 . 1 1 5 5 GLU N N 15 1.0898 0.0075 . . 1512 GLU N 19117 2 5 . 1 1 6 6 HIS N N 15 1.0358 0.0156 . . 1513 HIS N 19117 2 6 . 1 1 7 7 ASP N N 15 0.9102 0.0179 . . 1514 ASP N 19117 2 7 . 1 1 8 8 ASP N N 15 1.0114 0.0551 . . 1515 ASP N 19117 2 8 . 1 1 9 9 CYS N N 15 0.4269 0.1261 . . 1516 CYS N 19117 2 9 . 1 1 10 10 GLN N N 15 0.5444 0.0344 . . 1517 GLN N 19117 2 10 . 1 1 11 11 VAL N N 15 0.5060 0.0256 . . 1518 VAL N 19117 2 11 . 1 1 12 12 THR N N 15 0.5682 0.0270 . . 1519 THR N 19117 2 12 . 1 1 15 15 SER N N 15 0.4824 0.0171 . . 1522 SER N 19117 2 13 . 1 1 16 16 THR N N 15 0.4379 0.0234 . . 1523 THR N 19117 2 14 . 1 1 17 17 GLY N N 15 0.4901 0.0315 . . 1524 GLY N 19117 2 15 . 1 1 18 18 HIS N N 15 0.5971 0.0277 . . 1525 HIS N 19117 2 16 . 1 1 19 19 LEU N N 15 0.4706 0.0254 . . 1526 LEU N 19117 2 17 . 1 1 20 20 PHE N N 15 0.5084 0.0286 . . 1527 PHE N 19117 2 18 . 1 1 21 21 ASP N N 15 0.5081 0.0203 . . 1528 ASP N 19117 2 19 . 1 1 22 22 LEU N N 15 0.4377 0.0488 . . 1529 LEU N 19117 2 20 . 1 1 23 23 SER N N 15 0.4804 0.0324 . . 1530 SER N 19117 2 21 . 1 1 24 24 SER N N 15 0.6016 0.0304 . . 1531 SER N 19117 2 22 . 1 1 25 25 LEU N N 15 0.5546 0.0313 . . 1532 LEU N 19117 2 23 . 1 1 26 26 SER N N 15 0.4376 0.0232 . . 1533 SER N 19117 2 24 . 1 1 27 27 GLY N N 15 0.5050 0.0374 . . 1534 GLY N 19117 2 25 . 1 1 28 28 ARG N N 15 0.4178 0.0311 . . 1535 ARG N 19117 2 26 . 1 1 29 29 ALA N N 15 0.4311 0.0192 . . 1536 ALA N 19117 2 27 . 1 1 30 30 GLY N N 15 0.4015 0.0224 . . 1537 GLY N 19117 2 28 . 1 1 32 32 THR N N 15 0.4164 0.0287 . . 1539 THR N 19117 2 29 . 1 1 33 33 ALA N N 15 0.5443 0.0567 . . 1540 ALA N 19117 2 30 . 1 1 34 34 ALA N N 15 0.4047 0.0282 . . 1541 ALA N 19117 2 31 . 1 1 36 36 ALA N N 15 0.5241 0.0354 . . 1543 ALA N 19117 2 32 . 1 1 37 37 LYS N N 15 0.4835 0.0567 . . 1544 LYS N 19117 2 33 . 1 1 38 38 GLY N N 15 0.4503 0.0321 . . 1545 GLY N 19117 2 34 . 1 1 39 39 TRP N N 15 0.5266 0.0255 . . 1546 TRP N 19117 2 35 . 1 1 40 40 GLY N N 15 0.4758 0.0312 . . 1547 GLY N 19117 2 36 . 1 1 41 41 VAL N N 15 0.4178 0.0772 . . 1548 VAL N 19117 2 37 . 1 1 42 42 TYR N N 15 0.4247 0.0533 . . 1549 TYR N 19117 2 38 . 1 1 43 43 MET N N 15 0.4891 0.0298 . . 1550 MET N 19117 2 39 . 1 1 45 45 ILE N N 15 0.3775 0.1086 . . 1552 ILE N 19117 2 40 . 1 1 46 46 CYS N N 15 0.4126 0.0469 . . 1553 CYS N 19117 2 41 . 1 1 47 47 GLY N N 15 0.5041 0.0186 . . 1554 GLY N 19117 2 42 . 1 1 48 48 GLU N N 15 0.4741 0.0255 . . 1555 GLU N 19117 2 43 . 1 1 49 49 ASN N N 15 0.4720 0.0346 . . 1556 ASN N 19117 2 44 . 1 1 50 50 GLU N N 15 0.4821 0.0595 . . 1557 GLU N 19117 2 45 . 1 1 51 51 ASN N N 15 0.5584 0.0366 . . 1558 ASN N 19117 2 46 . 1 1 52 52 CYS N N 15 0.4100 0.0218 . . 1559 CYS N 19117 2 47 . 1 1 55 55 GLY N N 15 0.4581 0.0448 . . 1562 GLY N 19117 2 48 . 1 1 56 56 VAL N N 15 0.5419 0.0272 . . 1563 VAL N 19117 2 49 . 1 1 57 57 GLY N N 15 0.5206 0.0737 . . 1564 GLY N 19117 2 50 . 1 1 58 58 ALA N N 15 0.4882 0.0206 . . 1565 ALA N 19117 2 51 . 1 1 59 59 CYS N N 15 0.5317 0.0368 . . 1566 CYS N 19117 2 52 . 1 1 60 60 PHE N N 15 0.4817 0.0382 . . 1567 PHE N 19117 2 53 . 1 1 61 61 GLY N N 15 0.3944 0.0634 . . 1568 GLY N 19117 2 54 . 1 1 62 62 GLN N N 15 0.5567 0.0759 . . 1569 GLN N 19117 2 55 . 1 1 63 63 THR N N 15 0.4253 0.0906 . . 1570 THR N 19117 2 56 . 1 1 64 64 ARG N N 15 0.5028 0.0284 . . 1571 ARG N 19117 2 57 . 1 1 65 65 ILE N N 15 0.4861 0.0431 . . 1572 ILE N 19117 2 58 . 1 1 67 67 VAL N N 15 0.6270 0.0761 . . 1574 VAL N 19117 2 59 . 1 1 68 68 GLY N N 15 0.4873 0.0369 . . 1575 GLY N 19117 2 60 . 1 1 70 70 ALA N N 15 0.4989 0.0371 . . 1577 ALA N 19117 2 61 . 1 1 71 71 ASN N N 15 0.4711 0.0244 . . 1578 ASN N 19117 2 62 . 1 1 72 72 LYS N N 15 0.4800 0.0319 . . 1579 LYS N 19117 2 63 . 1 1 73 73 ARG N N 15 0.4173 0.0262 . . 1580 ARG N 19117 2 64 . 1 1 74 74 LEU N N 15 0.4765 0.0328 . . 1581 LEU N 19117 2 65 . 1 1 75 75 ARG N N 15 0.5055 0.0368 . . 1582 ARG N 19117 2 66 . 1 1 76 76 TYR N N 15 0.5231 0.0247 . . 1583 TYR N 19117 2 67 . 1 1 77 77 VAL N N 15 0.5752 0.0252 . . 1584 VAL N 19117 2 68 . 1 1 79 79 GLN N N 15 0.4804 0.0290 . . 1586 GLN N 19117 2 69 . 1 1 80 80 VAL N N 15 0.6248 0.0174 . . 1587 VAL N 19117 2 70 . 1 1 81 81 LEU N N 15 0.6671 0.0316 . . 1588 LEU N 19117 2 71 . 1 1 82 82 GLN N N 15 0.3969 0.0332 . . 1589 GLN N 19117 2 72 . 1 1 84 84 VAL N N 15 0.3968 0.0382 . . 1591 VAL N 19117 2 73 . 1 1 85 85 TYR N N 15 0.4978 0.0541 . . 1592 TYR N 19117 2 74 . 1 1 86 86 LYS N N 15 0.4036 0.0389 . . 1593 LYS N 19117 2 75 . 1 1 87 87 ASP N N 15 0.5700 0.0385 . . 1594 ASP N 19117 2 76 . 1 1 88 88 GLY N N 15 0.5359 0.0309 . . 1595 GLY N 19117 2 77 . 1 1 89 89 SER N N 15 0.5087 0.0598 . . 1596 SER N 19117 2 78 . 1 1 93 93 SER N N 15 0.5923 0.0261 . . 1600 SER N 19117 2 79 . 1 1 94 94 LYS N N 15 0.6460 0.0652 . . 1601 LYS N 19117 2 80 . 1 1 95 95 SER N N 15 0.5954 0.0218 . . 1602 SER N 19117 2 81 . 1 1 96 96 GLY N N 15 0.5316 0.0294 . . 1603 GLY N 19117 2 82 . 1 1 97 97 LEU N N 15 0.5168 0.0381 . . 1604 LEU N 19117 2 83 . 1 1 98 98 SER N N 15 0.4648 0.0315 . . 1605 SER N 19117 2 84 . 1 1 99 99 TYR N N 15 0.5952 0.0376 . . 1606 TYR N 19117 2 85 . 1 1 100 100 LYS N N 15 0.5778 0.0328 . . 1607 LYS N 19117 2 86 . 1 1 101 101 SER N N 15 0.4694 0.0371 . . 1608 SER N 19117 2 87 . 1 1 102 102 VAL N N 15 0.4328 0.0477 . . 1609 VAL N 19117 2 88 . 1 1 103 103 ILE N N 15 0.4212 0.0453 . . 1610 ILE N 19117 2 89 . 1 1 104 104 SER N N 15 0.5082 0.0320 . . 1611 SER N 19117 2 90 . 1 1 105 105 PHE N N 15 0.4827 0.0612 . . 1612 PHE N 19117 2 91 . 1 1 106 106 VAL N N 15 0.5846 0.0370 . . 1613 VAL N 19117 2 92 . 1 1 107 107 CYS N N 15 0.4690 0.0378 . . 1614 CYS N 19117 2 93 . 1 1 108 108 ARG N N 15 0.4905 0.0423 . . 1615 ARG N 19117 2 94 . 1 1 110 110 GLU N N 15 0.5986 0.0157 . . 1617 GLU N 19117 2 95 . 1 1 111 111 ALA N N 15 0.7215 0.0146 . . 1618 ALA N 19117 2 96 . 1 1 112 112 GLY N N 15 0.7267 0.0101 . . 1619 GLY N 19117 2 97 . 1 1 114 114 THR N N 15 0.7299 0.0164 . . 1621 THR N 19117 2 98 . 1 1 115 115 ASN N N 15 0.8319 0.0215 . . 1622 ASN N 19117 2 99 . 1 1 116 116 ARG N N 15 0.6305 0.0218 . . 1623 ARG N 19117 2 100 . 1 1 118 118 MET N N 15 0.4682 0.0448 . . 1625 MET N 19117 2 101 . 1 1 120 120 ILE N N 15 0.4662 0.0846 . . 1627 ILE N 19117 2 102 . 1 1 121 121 SER N N 15 0.4926 0.0259 . . 1628 SER N 19117 2 103 . 1 1 122 122 LEU N N 15 0.5668 0.0275 . . 1629 LEU N 19117 2 104 . 1 1 123 123 ASP N N 15 0.5018 0.0541 . . 1630 ASP N 19117 2 105 . 1 1 125 125 GLN N N 15 0.5534 0.0199 . . 1632 GLN N 19117 2 106 . 1 1 126 126 THR N N 15 0.4840 0.0318 . . 1633 THR N 19117 2 107 . 1 1 127 127 CYS N N 15 0.5607 0.0428 . . 1634 CYS N 19117 2 108 . 1 1 128 128 THR N N 15 0.4128 0.0244 . . 1635 THR N 19117 2 109 . 1 1 129 129 LEU N N 15 0.4685 0.0833 . . 1636 LEU N 19117 2 110 . 1 1 131 131 PHE N N 15 0.5573 0.0572 . . 1638 PHE N 19117 2 111 . 1 1 132 132 SER N N 15 0.4805 0.0470 . . 1639 SER N 19117 2 112 . 1 1 133 133 TRP N N 15 0.5663 0.0545 . . 1640 TRP N 19117 2 113 . 1 1 134 134 HIS N N 15 0.4008 0.0526 . . 1641 HIS N 19117 2 114 . 1 1 135 135 THR N N 15 0.5027 0.0345 . . 1642 THR N 19117 2 115 . 1 1 137 137 LEU N N 15 0.7478 0.0584 . . 1644 LEU N 19117 2 116 . 1 1 139 139 CYS N N 15 0.5582 0.0195 . . 1646 CYS N 19117 2 117 . 1 1 140 140 GLU N N 15 0.4693 0.0221 . . 1647 GLU N 19117 2 118 . 1 1 141 141 LEU N N 15 1.0567 0.0096 . . 1648 LEU N 19117 2 119 . 1 1 142 142 ALA N N 15 0.8094 0.0039 . . 1649 ALA N 19117 2 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronuclear_T2_list_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_1 _Heteronucl_T2_list.Entry_ID 19117 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Sample_condition_list_ID 2 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'single scan interleaving' _Heteronucl_T2_list.Spectrometer_frequency_1H 600 _Heteronucl_T2_list.T2_coherence_type I(+,-)S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 LYS N N 15 1.8658 0.0190 . . . . 1509 LYS N 19117 1 2 . 1 1 3 3 SER N N 15 3.0988 0.0195 . . . . 1510 SER N 19117 1 3 . 1 1 4 4 ASN N N 15 5.6258 0.0339 . . . . 1511 ASN N 19117 1 4 . 1 1 5 5 GLU N N 15 6.3494 0.0332 . . . . 1512 GLU N 19117 1 5 . 1 1 6 6 HIS N N 15 11.8720 0.1215 . . . . 1513 HIS N 19117 1 6 . 1 1 7 7 ASP N N 15 9.5278 0.1084 . . . . 1514 ASP N 19117 1 7 . 1 1 8 8 ASP N N 15 2.9731 0.1073 . . . . 1515 ASP N 19117 1 8 . 1 1 9 9 CYS N N 15 15.8438 1.8168 . . . . 1516 CYS N 19117 1 9 . 1 1 10 10 GLN N N 15 19.4549 0.7670 . . . . 1517 GLN N 19117 1 10 . 1 1 11 11 VAL N N 15 20.8713 0.9120 . . . . 1518 VAL N 19117 1 11 . 1 1 12 12 THR N N 15 18.0402 0.7567 . . . . 1519 THR N 19117 1 12 . 1 1 15 15 SER N N 15 16.9091 0.4698 . . . . 1522 SER N 19117 1 13 . 1 1 16 16 THR N N 15 16.3828 0.7748 . . . . 1523 THR N 19117 1 14 . 1 1 17 17 GLY N N 15 19.1508 1.0307 . . . . 1524 GLY N 19117 1 15 . 1 1 18 18 HIS N N 15 18.0851 0.7219 . . . . 1525 HIS N 19117 1 16 . 1 1 19 19 LEU N N 15 20.1700 0.8540 . . . . 1526 LEU N 19117 1 17 . 1 1 20 20 PHE N N 15 18.7760 0.6375 . . . . 1527 PHE N 19117 1 18 . 1 1 21 21 ASP N N 15 14.0977 0.3859 . . . . 1528 ASP N 19117 1 19 . 1 1 22 22 LEU N N 15 7.7925 0.5345 . . . . 1529 LEU N 19117 1 20 . 1 1 23 23 SER N N 15 21.7529 1.0668 . . . . 1530 SER N 19117 1 21 . 1 1 24 24 SER N N 15 20.5847 0.8393 . . . . 1531 SER N 19117 1 22 . 1 1 25 25 LEU N N 15 19.7824 1.0858 . . . . 1532 LEU N 19117 1 23 . 1 1 26 26 SER N N 15 23.5400 0.9522 . . . . 1533 SER N 19117 1 24 . 1 1 27 27 GLY N N 15 16.1714 0.7214 . . . . 1534 GLY N 19117 1 25 . 1 1 28 28 ARG N N 15 22.0462 1.1655 . . . . 1535 ARG N 19117 1 26 . 1 1 29 29 ALA N N 15 19.9585 0.6385 . . . . 1536 ALA N 19117 1 27 . 1 1 30 30 GLY N N 15 19.8200 1.0022 . . . . 1537 GLY N 19117 1 28 . 1 1 32 32 THR N N 15 18.0746 0.8758 . . . . 1539 THR N 19117 1 29 . 1 1 33 33 ALA N N 15 17.0408 1.1861 . . . . 1540 ALA N 19117 1 30 . 1 1 34 34 ALA N N 15 20.1705 0.9119 . . . . 1541 ALA N 19117 1 31 . 1 1 36 36 ALA N N 15 22.3388 1.2395 . . . . 1543 ALA N 19117 1 32 . 1 1 37 37 LYS N N 15 19.7369 0.9956 . . . . 1544 LYS N 19117 1 33 . 1 1 38 38 GLY N N 15 20.5994 1.2028 . . . . 1545 GLY N 19117 1 34 . 1 1 39 39 TRP N N 15 18.9579 0.7415 . . . . 1546 TRP N 19117 1 35 . 1 1 40 40 GLY N N 15 18.0238 0.8357 . . . . 1547 GLY N 19117 1 36 . 1 1 41 41 VAL N N 15 18.8961 1.9648 . . . . 1548 VAL N 19117 1 37 . 1 1 42 42 TYR N N 15 17.7942 1.5743 . . . . 1549 TYR N 19117 1 38 . 1 1 43 43 MET N N 15 19.7633 0.9683 . . . . 1550 MET N 19117 1 39 . 1 1 45 45 ILE N N 15 12.7799 1.9061 . . . . 1552 ILE N 19117 1 40 . 1 1 46 46 CYS N N 15 15.8647 1.4304 . . . . 1553 CYS N 19117 1 41 . 1 1 47 47 GLY N N 15 20.3357 0.9354 . . . . 1554 GLY N 19117 1 42 . 1 1 48 48 GLU N N 15 17.3009 0.6966 . . . . 1555 GLU N 19117 1 43 . 1 1 49 49 ASN N N 15 17.6553 1.0777 . . . . 1556 ASN N 19117 1 44 . 1 1 50 50 GLU N N 15 17.9399 1.4998 . . . . 1557 GLU N 19117 1 45 . 1 1 51 51 ASN N N 15 15.9271 0.8591 . . . . 1558 ASN N 19117 1 46 . 1 1 52 52 CYS N N 15 23.3193 0.9404 . . . . 1559 CYS N 19117 1 47 . 1 1 55 55 GLY N N 15 16.4221 1.1305 . . . . 1562 GLY N 19117 1 48 . 1 1 56 56 VAL N N 15 16.2654 0.6262 . . . . 1563 VAL N 19117 1 49 . 1 1 57 57 GLY N N 15 13.3586 1.5604 . . . . 1564 GLY N 19117 1 50 . 1 1 58 58 ALA N N 15 19.7230 0.8205 . . . . 1565 ALA N 19117 1 51 . 1 1 59 59 CYS N N 15 19.2045 1.0561 . . . . 1566 CYS N 19117 1 52 . 1 1 60 60 PHE N N 15 19.1040 1.1833 . . . . 1567 PHE N 19117 1 53 . 1 1 61 61 GLY N N 15 14.3635 1.7394 . . . . 1568 GLY N 19117 1 54 . 1 1 62 62 GLN N N 15 22.6295 2.1387 . . . . 1569 GLN N 19117 1 55 . 1 1 63 63 THR N N 15 18.2115 2.0356 . . . . 1570 THR N 19117 1 56 . 1 1 64 64 ARG N N 15 6.3721 0.2187 . . . . 1571 ARG N 19117 1 57 . 1 1 65 65 ILE N N 15 20.2140 1.5166 . . . . 1572 ILE N 19117 1 58 . 1 1 67 67 VAL N N 15 18.6976 2.0325 . . . . 1574 VAL N 19117 1 59 . 1 1 68 68 GLY N N 15 18.2030 1.2444 . . . . 1575 GLY N 19117 1 60 . 1 1 70 70 ALA N N 15 19.0465 1.0738 . . . . 1577 ALA N 19117 1 61 . 1 1 71 71 ASN N N 15 14.9077 0.5549 . . . . 1578 ASN N 19117 1 62 . 1 1 72 72 LYS N N 15 16.3656 0.7742 . . . . 1579 LYS N 19117 1 63 . 1 1 73 73 ARG N N 15 20.8500 0.8715 . . . . 1580 ARG N 19117 1 64 . 1 1 74 74 LEU N N 15 17.6816 0.7097 . . . . 1581 LEU N 19117 1 65 . 1 1 75 75 ARG N N 15 21.0653 1.1760 . . . . 1582 ARG N 19117 1 66 . 1 1 76 76 TYR N N 15 17.0103 0.6125 . . . . 1583 TYR N 19117 1 67 . 1 1 77 77 VAL N N 15 16.8595 0.5325 . . . . 1584 VAL N 19117 1 68 . 1 1 79 79 GLN N N 15 13.7058 0.6932 . . . . 1586 GLN N 19117 1 69 . 1 1 80 80 VAL N N 15 19.0771 0.4409 . . . . 1587 VAL N 19117 1 70 . 1 1 81 81 LEU N N 15 14.3364 0.5103 . . . . 1588 LEU N 19117 1 71 . 1 1 82 82 GLN N N 15 20.6830 1.0265 . . . . 1589 GLN N 19117 1 72 . 1 1 84 84 VAL N N 15 20.4556 1.0774 . . . . 1591 VAL N 19117 1 73 . 1 1 85 85 TYR N N 15 19.0433 1.0881 . . . . 1592 TYR N 19117 1 74 . 1 1 86 86 LYS N N 15 24.0871 1.5583 . . . . 1593 LYS N 19117 1 75 . 1 1 87 87 ASP N N 15 16.9933 0.8659 . . . . 1594 ASP N 19117 1 76 . 1 1 88 88 GLY N N 15 17.6835 1.0131 . . . . 1595 GLY N 19117 1 77 . 1 1 89 89 SER N N 15 16.3859 1.4120 . . . . 1596 SER N 19117 1 78 . 1 1 93 93 SER N N 15 14.9828 0.4487 . . . . 1600 SER N 19117 1 79 . 1 1 94 94 LYS N N 15 17.0599 0.8642 . . . . 1601 LYS N 19117 1 80 . 1 1 95 95 SER N N 15 17.1670 0.5246 . . . . 1602 SER N 19117 1 81 . 1 1 96 96 GLY N N 15 19.1487 0.7469 . . . . 1603 GLY N 19117 1 82 . 1 1 97 97 LEU N N 15 16.6332 1.1171 . . . . 1604 LEU N 19117 1 83 . 1 1 98 98 SER N N 15 18.9120 0.8283 . . . . 1605 SER N 19117 1 84 . 1 1 99 99 TYR N N 15 16.9067 0.9456 . . . . 1606 TYR N 19117 1 85 . 1 1 100 100 LYS N N 15 10.1369 0.4328 . . . . 1607 LYS N 19117 1 86 . 1 1 101 101 SER N N 15 18.3576 0.9989 . . . . 1608 SER N 19117 1 87 . 1 1 102 102 VAL N N 15 21.9574 1.7170 . . . . 1609 VAL N 19117 1 88 . 1 1 103 103 ILE N N 15 19.2308 1.1587 . . . . 1610 ILE N 19117 1 89 . 1 1 104 104 SER N N 15 13.0454 0.5839 . . . . 1611 SER N 19117 1 90 . 1 1 105 105 PHE N N 15 16.0700 1.3575 . . . . 1612 PHE N 19117 1 91 . 1 1 106 106 VAL N N 15 13.6735 0.4981 . . . . 1613 VAL N 19117 1 92 . 1 1 107 107 CYS N N 15 18.6483 0.9773 . . . . 1614 CYS N 19117 1 93 . 1 1 108 108 ARG N N 15 17.3427 0.9010 . . . . 1615 ARG N 19117 1 94 . 1 1 110 110 GLU N N 15 13.6027 0.2240 . . . . 1617 GLU N 19117 1 95 . 1 1 111 111 ALA N N 15 12.4040 0.1709 . . . . 1618 ALA N 19117 1 96 . 1 1 112 112 GLY N N 15 9.8532 0.1056 . . . . 1619 GLY N 19117 1 97 . 1 1 114 114 THR N N 15 15.2123 0.2735 . . . . 1621 THR N 19117 1 98 . 1 1 115 115 ASN N N 15 12.3325 0.2069 . . . . 1622 ASN N 19117 1 99 . 1 1 116 116 ARG N N 15 17.6806 0.5692 . . . . 1623 ARG N 19117 1 100 . 1 1 118 118 MET N N 15 11.4901 0.7626 . . . . 1625 MET N 19117 1 101 . 1 1 120 120 ILE N N 15 15.8752 1.9024 . . . . 1627 ILE N 19117 1 102 . 1 1 121 121 SER N N 15 21.2539 0.9735 . . . . 1628 SER N 19117 1 103 . 1 1 122 122 LEU N N 15 15.8026 0.5743 . . . . 1629 LEU N 19117 1 104 . 1 1 123 123 ASP N N 15 18.8091 1.1237 . . . . 1630 ASP N 19117 1 105 . 1 1 125 125 GLN N N 15 15.6520 0.3996 . . . . 1632 GLN N 19117 1 106 . 1 1 126 126 THR N N 15 13.9764 0.9918 . . . . 1633 THR N 19117 1 107 . 1 1 127 127 CYS N N 15 23.7410 1.6432 . . . . 1634 CYS N 19117 1 108 . 1 1 128 128 THR N N 15 18.7672 0.8881 . . . . 1635 THR N 19117 1 109 . 1 1 129 129 LEU N N 15 16.1333 1.4738 . . . . 1636 LEU N 19117 1 110 . 1 1 131 131 PHE N N 15 18.8318 1.4812 . . . . 1638 PHE N 19117 1 111 . 1 1 132 132 SER N N 15 19.6958 1.2101 . . . . 1639 SER N 19117 1 112 . 1 1 133 133 TRP N N 15 17.3153 1.1824 . . . . 1640 TRP N 19117 1 113 . 1 1 134 134 HIS N N 15 19.7245 1.3916 . . . . 1641 HIS N 19117 1 114 . 1 1 135 135 THR N N 15 19.0765 1.1031 . . . . 1642 THR N 19117 1 115 . 1 1 137 137 LEU N N 15 16.1233 0.5411 . . . . 1644 LEU N 19117 1 116 . 1 1 139 139 CYS N N 15 18.1211 0.4880 . . . . 1646 CYS N 19117 1 117 . 1 1 140 140 GLU N N 15 17.2118 0.5088 . . . . 1647 GLU N 19117 1 118 . 1 1 141 141 LEU N N 15 6.2309 0.0404 . . . . 1648 LEU N 19117 1 119 . 1 1 142 142 ALA N N 15 3.0369 0.0141 . . . . 1649 ALA N 19117 1 stop_ save_ save_heteronuclear_T2_list_2 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_2 _Heteronucl_T2_list.Entry_ID 19117 _Heteronucl_T2_list.ID 2 _Heteronucl_T2_list.Sample_condition_list_ID 2 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_2 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'single scan interleaving' _Heteronucl_T2_list.Spectrometer_frequency_1H 600 _Heteronucl_T2_list.T2_coherence_type I(+,-)S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 LYS N N 15 2.5200 0.0556 . . . . 1509 LYS N 19117 2 2 . 1 1 3 3 SER N N 15 4.2787 0.0653 . . . . 1510 SER N 19117 2 3 . 1 1 4 4 ASN N N 15 6.4639 0.1032 . . . . 1511 ASN N 19117 2 4 . 1 1 5 5 GLU N N 15 6.6686 0.0878 . . . . 1512 GLU N 19117 2 5 . 1 1 6 6 HIS N N 15 16.2583 0.4934 . . . . 1513 HIS N 19117 2 6 . 1 1 7 7 ASP N N 15 10.4027 0.3539 . . . . 1514 ASP N 19117 2 7 . 1 1 8 8 ASP N N 15 3.6896 0.6267 . . . . 1515 ASP N 19117 2 8 . 1 1 9 9 CYS N N 15 3.1218 2.2340 . . . . 1516 CYS N 19117 2 9 . 1 1 10 10 GLN N N 15 14.3901 2.2442 . . . . 1517 GLN N 19117 2 10 . 1 1 11 11 VAL N N 15 16.6645 2.2311 . . . . 1518 VAL N 19117 2 11 . 1 1 12 12 THR N N 15 12.8966 1.6109 . . . . 1519 THR N 19117 2 12 . 1 1 16 16 THR N N 15 16.5843 1.6479 . . . . 1523 THR N 19117 2 13 . 1 1 17 17 GLY N N 15 14.0801 1.9605 . . . . 1524 GLY N 19117 2 14 . 1 1 18 18 HIS N N 15 17.5835 1.8128 . . . . 1525 HIS N 19117 2 15 . 1 1 19 19 LEU N N 15 17.5539 1.7429 . . . . 1526 LEU N 19117 2 16 . 1 1 20 20 PHE N N 15 16.2196 2.1569 . . . . 1527 PHE N 19117 2 17 . 1 1 21 21 ASP N N 15 15.3375 1.0417 . . . . 1528 ASP N 19117 2 18 . 1 1 22 22 LEU N N 15 6.0290 1.4158 . . . . 1529 LEU N 19117 2 19 . 1 1 23 23 SER N N 15 17.8108 2.8065 . . . . 1530 SER N 19117 2 20 . 1 1 24 24 SER N N 15 21.5764 3.0794 . . . . 1531 SER N 19117 2 21 . 1 1 25 25 LEU N N 15 12.7951 1.6534 . . . . 1532 LEU N 19117 2 22 . 1 1 26 26 SER N N 15 18.2089 2.2774 . . . . 1533 SER N 19117 2 23 . 1 1 27 27 GLY N N 15 12.9379 1.8059 . . . . 1534 GLY N 19117 2 24 . 1 1 28 28 ARG N N 15 13.4026 2.0785 . . . . 1535 ARG N 19117 2 25 . 1 1 29 29 ALA N N 15 21.5521 2.2605 . . . . 1536 ALA N 19117 2 26 . 1 1 30 30 GLY N N 15 15.1515 1.4342 . . . . 1537 GLY N 19117 2 27 . 1 1 32 32 THR N N 15 13.2848 1.8284 . . . . 1539 THR N 19117 2 28 . 1 1 33 33 ALA N N 15 13.5828 3.6889 . . . . 1540 ALA N 19117 2 29 . 1 1 34 34 ALA N N 15 15.2723 2.1803 . . . . 1541 ALA N 19117 2 30 . 1 1 36 36 ALA N N 15 13.5229 2.2137 . . . . 1543 ALA N 19117 2 31 . 1 1 37 37 LYS N N 15 8.9306 2.2759 . . . . 1544 LYS N 19117 2 32 . 1 1 38 38 GLY N N 15 19.0212 3.1390 . . . . 1545 GLY N 19117 2 33 . 1 1 39 39 TRP N N 15 14.9677 1.7972 . . . . 1546 TRP N 19117 2 34 . 1 1 40 40 GLY N N 15 15.2605 1.8662 . . . . 1547 GLY N 19117 2 35 . 1 1 41 41 VAL N N 15 7.3133 2.2104 . . . . 1548 VAL N 19117 2 36 . 1 1 42 42 TYR N N 15 7.0101 2.1309 . . . . 1549 TYR N 19117 2 37 . 1 1 43 43 MET N N 15 14.8773 2.1564 . . . . 1550 MET N 19117 2 38 . 1 1 45 45 ILE N N 15 6.9072 2.6855 . . . . 1552 ILE N 19117 2 39 . 1 1 46 46 CYS N N 15 9.8298 2.7483 . . . . 1553 CYS N 19117 2 40 . 1 1 47 47 GLY N N 15 18.8316 1.8259 . . . . 1554 GLY N 19117 2 41 . 1 1 48 48 GLU N N 15 21.1479 2.6206 . . . . 1555 GLU N 19117 2 42 . 1 1 49 49 ASN N N 15 13.3443 2.2978 . . . . 1556 ASN N 19117 2 43 . 1 1 50 50 GLU N N 15 9.6301 2.9151 . . . . 1557 GLU N 19117 2 44 . 1 1 51 51 ASN N N 15 11.6310 2.0331 . . . . 1558 ASN N 19117 2 45 . 1 1 52 52 CYS N N 15 15.8549 2.0429 . . . . 1559 CYS N 19117 2 46 . 1 1 55 55 GLY N N 15 11.1833 2.0582 . . . . 1562 GLY N 19117 2 47 . 1 1 56 56 VAL N N 15 18.8204 1.9772 . . . . 1563 VAL N 19117 2 48 . 1 1 57 57 GLY N N 15 8.6983 2.4032 . . . . 1564 GLY N 19117 2 49 . 1 1 58 58 ALA N N 15 14.0781 1.1189 . . . . 1565 ALA N 19117 2 50 . 1 1 59 59 CYS N N 15 16.7541 2.8540 . . . . 1566 CYS N 19117 2 51 . 1 1 60 60 PHE N N 15 15.6850 2.8826 . . . . 1567 PHE N 19117 2 52 . 1 1 61 61 GLY N N 15 7.2284 2.6306 . . . . 1568 GLY N 19117 2 53 . 1 1 62 62 GLN N N 15 8.8092 2.6175 . . . . 1569 GLN N 19117 2 54 . 1 1 63 63 THR N N 15 7.1969 2.7774 . . . . 1570 THR N 19117 2 55 . 1 1 64 64 ARG N N 15 16.7976 2.1988 . . . . 1571 ARG N 19117 2 56 . 1 1 65 65 ILE N N 15 12.2721 2.7761 . . . . 1572 ILE N 19117 2 57 . 1 1 67 67 VAL N N 15 9.4961 3.2849 . . . . 1574 VAL N 19117 2 58 . 1 1 68 68 GLY N N 15 12.5409 2.0551 . . . . 1575 GLY N 19117 2 59 . 1 1 70 70 ALA N N 15 17.5177 2.9128 . . . . 1577 ALA N 19117 2 60 . 1 1 71 71 ASN N N 15 17.4314 1.3549 . . . . 1578 ASN N 19117 2 61 . 1 1 72 72 LYS N N 15 13.8951 1.7205 . . . . 1579 LYS N 19117 2 62 . 1 1 73 73 ARG N N 15 17.5829 2.5543 . . . . 1580 ARG N 19117 2 63 . 1 1 74 74 LEU N N 15 14.5767 1.9385 . . . . 1581 LEU N 19117 2 64 . 1 1 75 75 ARG N N 15 15.3511 2.3623 . . . . 1582 ARG N 19117 2 65 . 1 1 76 76 TYR N N 15 14.5369 1.4328 . . . . 1583 TYR N 19117 2 66 . 1 1 77 77 VAL N N 15 18.4916 1.7090 . . . . 1584 VAL N 19117 2 67 . 1 1 79 79 GLN N N 15 13.0850 1.3566 . . . . 1586 GLN N 19117 2 68 . 1 1 80 80 VAL N N 15 21.5399 1.2756 . . . . 1587 VAL N 19117 2 69 . 1 1 81 81 LEU N N 15 13.0542 1.4253 . . . . 1588 LEU N 19117 2 70 . 1 1 82 82 GLN N N 15 15.9865 3.0751 . . . . 1589 GLN N 19117 2 71 . 1 1 84 84 VAL N N 15 10.4266 1.9420 . . . . 1591 VAL N 19117 2 72 . 1 1 85 85 TYR N N 15 11.0012 2.4104 . . . . 1592 TYR N 19117 2 73 . 1 1 86 86 LYS N N 15 11.4759 2.3741 . . . . 1593 LYS N 19117 2 74 . 1 1 87 87 ASP N N 15 14.4372 2.2224 . . . . 1594 ASP N 19117 2 75 . 1 1 88 88 GLY N N 15 17.1917 1.8094 . . . . 1595 GLY N 19117 2 76 . 1 1 89 89 SER N N 15 11.8001 2.8953 . . . . 1596 SER N 19117 2 77 . 1 1 93 93 SER N N 15 13.9456 1.4210 . . . . 1600 SER N 19117 2 78 . 1 1 94 94 LYS N N 15 9.5926 2.3313 . . . . 1601 LYS N 19117 2 79 . 1 1 95 95 SER N N 15 16.3404 1.3042 . . . . 1602 SER N 19117 2 80 . 1 1 96 96 GLY N N 15 16.2413 1.9983 . . . . 1603 GLY N 19117 2 81 . 1 1 97 97 LEU N N 15 12.7523 2.1217 . . . . 1604 LEU N 19117 2 82 . 1 1 98 98 SER N N 15 13.0352 1.7571 . . . . 1605 SER N 19117 2 83 . 1 1 99 99 TYR N N 15 13.7308 1.8145 . . . . 1606 TYR N 19117 2 84 . 1 1 100 100 LYS N N 15 9.4686 1.1989 . . . . 1607 LYS N 19117 2 85 . 1 1 101 101 SER N N 15 11.0574 1.8838 . . . . 1608 SER N 19117 2 86 . 1 1 102 102 VAL N N 15 9.0443 2.1330 . . . . 1609 VAL N 19117 2 87 . 1 1 103 103 ILE N N 15 9.9126 1.9430 . . . . 1610 ILE N 19117 2 88 . 1 1 104 104 SER N N 15 11.8335 1.3835 . . . . 1611 SER N 19117 2 89 . 1 1 105 105 PHE N N 15 6.7582 2.1260 . . . . 1612 PHE N 19117 2 90 . 1 1 106 106 VAL N N 15 11.2970 1.4978 . . . . 1613 VAL N 19117 2 91 . 1 1 107 107 CYS N N 15 17.5818 2.2839 . . . . 1614 CYS N 19117 2 92 . 1 1 108 108 ARG N N 15 8.8601 1.7275 . . . . 1615 ARG N 19117 2 93 . 1 1 110 110 GLU N N 15 15.5284 0.8712 . . . . 1617 GLU N 19117 2 94 . 1 1 111 111 ALA N N 15 15.6205 0.5928 . . . . 1618 ALA N 19117 2 95 . 1 1 112 112 GLY N N 15 11.4154 0.2724 . . . . 1619 GLY N 19117 2 96 . 1 1 114 114 THR N N 15 16.1506 0.7436 . . . . 1621 THR N 19117 2 97 . 1 1 115 115 ASN N N 15 16.1691 0.7612 . . . . 1622 ASN N 19117 2 98 . 1 1 116 116 ARG N N 15 16.2362 1.1662 . . . . 1623 ARG N 19117 2 99 . 1 1 118 118 MET N N 15 15.1984 3.6577 . . . . 1625 MET N 19117 2 100 . 1 1 120 120 ILE N N 15 6.3956 2.4783 . . . . 1627 ILE N 19117 2 101 . 1 1 121 121 SER N N 15 14.4398 1.8829 . . . . 1628 SER N 19117 2 102 . 1 1 122 122 LEU N N 15 12.3520 1.3032 . . . . 1629 LEU N 19117 2 103 . 1 1 123 123 ASP N N 15 10.0311 2.1394 . . . . 1630 ASP N 19117 2 104 . 1 1 125 125 GLN N N 15 20.3996 1.4385 . . . . 1632 GLN N 19117 2 105 . 1 1 126 126 THR N N 15 13.0985 1.5744 . . . . 1633 THR N 19117 2 106 . 1 1 127 127 CYS N N 15 13.0383 2.1127 . . . . 1634 CYS N 19117 2 107 . 1 1 128 128 THR N N 15 12.5482 1.5242 . . . . 1635 THR N 19117 2 108 . 1 1 129 129 LEU N N 15 8.3720 2.4642 . . . . 1636 LEU N 19117 2 109 . 1 1 131 131 PHE N N 15 9.1471 1.9376 . . . . 1638 PHE N 19117 2 110 . 1 1 132 132 SER N N 15 12.5690 2.4603 . . . . 1639 SER N 19117 2 111 . 1 1 133 133 TRP N N 15 11.4333 2.2339 . . . . 1640 TRP N 19117 2 112 . 1 1 134 134 HIS N N 15 6.9979 2.4485 . . . . 1641 HIS N 19117 2 113 . 1 1 135 135 THR N N 15 15.7420 1.9451 . . . . 1642 THR N 19117 2 114 . 1 1 137 137 LEU N N 15 12.3875 2.9305 . . . . 1644 LEU N 19117 2 115 . 1 1 139 139 CYS N N 15 22.0417 1.8421 . . . . 1646 CYS N 19117 2 116 . 1 1 140 140 GLU N N 15 17.0666 1.5575 . . . . 1647 GLU N 19117 2 117 . 1 1 141 141 LEU N N 15 7.4186 0.1131 . . . . 1648 LEU N 19117 2 118 . 1 1 142 142 ALA N N 15 3.4003 0.0347 . . . . 1649 ALA N 19117 2 stop_ save_