data_17110 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17110 _Entry.Title ; chicken IGF2R domain 11 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-08-10 _Entry.Accession_date 2010-08-10 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details 'Domain 11 of Gallus gallus Cation-independent mannose-6-phosphate receptor' _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 Christopher Williams . . . 17110 2 Hans Hoppe . . . 17110 3 Madeline Strickland . . . 17110 4 Susana Frago . . . 17110 5 Rosamund Ellis . Z. . 17110 6 Pakorn Wattana-Amorn . . . 17110 7 Stuart Prince . N. . 17110 8 Oliver Zaccheo . J. . 17110 9 Briony Forbes . . . 17110 10 Yvonne Jones . E. . 17110 11 Dellel Rezgui . Z. . 17110 12 Matthew Crump . P. . 17110 13 Bassim Hassan . A. . 17110 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' . 17110 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Genomic imprinting' . 17110 'Insulin-like growth factor 2' . 17110 'mannose 6 phosphate receptor' . 17110 'NMR structure' . 17110 'protein evolution' . 17110 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17110 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 592 17110 '15N chemical shifts' 154 17110 '1H chemical shifts' 959 17110 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 2 . . 2014-03-04 2010-08-10 update author 'update entry citation' 17110 1 . . 2012-08-30 2010-08-10 original author 'original release' 17110 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1GP0 'Structure of a functional IGF2R fragment determined from the anomalous scattering of sulfur' 17110 PDB 2CNJ 'NMR STUDIES ON THE INTERACTION OF INSULIN-GROWTH FACTOR II (IGF-II) WITH IGF2R DOMAIN 11' 17110 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17110 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23197533 _Citation.Full_citation . _Citation.Title 'An exon splice enhancer primes IGF2:IGF2R binding site structure and function evolution' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Science _Citation.Journal_name_full . _Citation.Journal_volume 338 _Citation.Journal_issue 6111 _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 1209 _Citation.Page_last 1213 _Citation.Year 2012 _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 Christopher Williams . . . 17110 1 2 Hans Hoppe . . . 17110 1 3 Dellel Rezgui . . . 17110 1 4 Madeline Strickland . . . 17110 1 5 Susana Frago . . . 17110 1 6 Rosamund Ellis . Z. . 17110 1 7 Pakorn Wattana-Amorn . . . 17110 1 8 Stuart Prince . N. . 17110 1 9 Oliver Zaccheo . J. . 17110 1 10 Briony Forbes . E. . 17110 1 11 E. Jones . Yvonne . 17110 1 12 Matthew Crump . P. . 17110 1 13 A. Hassan . Bassim . 17110 1 14 Frank Grutzner . . . 17110 1 15 Catherine Nolan . M. . 17110 1 16 Andrew Mungall . J. . 17110 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Genomic imprinting' 17110 1 'Insulin-like growth factor 2' 17110 1 'mannose 6 phosphate receptor' 17110 1 'NMR structure' 17110 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17110 _Assembly.ID 1 _Assembly.Name IGF2R _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 . _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 IGF2R 1 $IGF2R A . yes native no no . . . 17110 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 . 1 CYS 9 9 SG . 1 . 1 CYS 46 46 SG 1 . 1596 CYS SG 1 . 1633 CYS SG 17110 1 2 disulfide single . 1 . 1 CYS 110 110 SG . 1 . 1 CYS 142 142 SG 1 . 1697 CYS SG 1 . 1729 CYS SG 17110 1 3 disulfide single . 1 . 1 CYS 53 53 SG . 1 . 1 CYS 60 60 SG 1 . 1640 CYS SG 1 . 1647 CYS SG 17110 1 4 disulfide single . 1 . 1 CYS 94 94 SG . 1 . 1 CYS 130 130 SG 1 . 1681 CYS SG 1 . 1717 CYS SG 17110 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 1GP0 . . X-ray 1.4 'human IGF2R domain 11' . 17110 1 yes PDB 2V5P . . X-ray 4.2 'human IGF2R domains 11-13 in complex with IGF-II' . 17110 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'binds IGF-II' 17110 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_IGF2R _Entity.Sf_category entity _Entity.Sf_framecode IGF2R _Entity.Entry_ID 17110 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name IGF2R _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 ; MKSNVQNDCRVTNPATGHLF DLTSLKRESGYTITDSHNRK IELNVCAEAKSSCANGAAVC ITDGPKTLNAGKLSKTLTYE DQVLKLVYEDGDPCPTDLKM KHKSYFSFVCKSDAGDDSQP VFLSFDEQTCTSYFSWHTSL ACEEEVPRHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'The native domain starts at residue K1886' _Entity.Polymer_author_seq_details 'Domain 11 of the IGF2R from Gallus gallus (chicken). The C-terminal residues EEVPRHHHHHH are a non-native affinity tag' _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 154 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'IGF2 binding domain of Cation-independent mannose-6-phosphate receptor' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 16408.426 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2L21 . "Chicken Igf2r Domain 11" . . . . . 100.00 154 100.00 100.00 2.57e-110 . . . . 17110 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 1588 MET . 17110 1 2 1589 LYS . 17110 1 3 1590 SER . 17110 1 4 1591 ASN . 17110 1 5 1592 VAL . 17110 1 6 1593 GLN . 17110 1 7 1594 ASN . 17110 1 8 1595 ASP . 17110 1 9 1596 CYS . 17110 1 10 1597 ARG . 17110 1 11 1598 VAL . 17110 1 12 1599 THR . 17110 1 13 1600 ASN . 17110 1 14 1601 PRO . 17110 1 15 1602 ALA . 17110 1 16 1603 THR . 17110 1 17 1604 GLY . 17110 1 18 1605 HIS . 17110 1 19 1606 LEU . 17110 1 20 1607 PHE . 17110 1 21 1608 ASP . 17110 1 22 1609 LEU . 17110 1 23 1610 THR . 17110 1 24 1611 SER . 17110 1 25 1612 LEU . 17110 1 26 1613 LYS . 17110 1 27 1614 ARG . 17110 1 28 1615 GLU . 17110 1 29 1616 SER . 17110 1 30 1617 GLY . 17110 1 31 1618 TYR . 17110 1 32 1619 THR . 17110 1 33 1620 ILE . 17110 1 34 1621 THR . 17110 1 35 1622 ASP . 17110 1 36 1623 SER . 17110 1 37 1624 HIS . 17110 1 38 1625 ASN . 17110 1 39 1626 ARG . 17110 1 40 1627 LYS . 17110 1 41 1628 ILE . 17110 1 42 1629 GLU . 17110 1 43 1630 LEU . 17110 1 44 1631 ASN . 17110 1 45 1632 VAL . 17110 1 46 1633 CYS . 17110 1 47 1634 ALA . 17110 1 48 1635 GLU . 17110 1 49 1636 ALA . 17110 1 50 1637 LYS . 17110 1 51 1638 SER . 17110 1 52 1639 SER . 17110 1 53 1640 CYS . 17110 1 54 1641 ALA . 17110 1 55 1642 ASN . 17110 1 56 1643 GLY . 17110 1 57 1644 ALA . 17110 1 58 1645 ALA . 17110 1 59 1646 VAL . 17110 1 60 1647 CYS . 17110 1 61 1648 ILE . 17110 1 62 1649 THR . 17110 1 63 1650 ASP . 17110 1 64 1651 GLY . 17110 1 65 1652 PRO . 17110 1 66 1653 LYS . 17110 1 67 1654 THR . 17110 1 68 1655 LEU . 17110 1 69 1656 ASN . 17110 1 70 1657 ALA . 17110 1 71 1658 GLY . 17110 1 72 1659 LYS . 17110 1 73 1660 LEU . 17110 1 74 1661 SER . 17110 1 75 1662 LYS . 17110 1 76 1663 THR . 17110 1 77 1664 LEU . 17110 1 78 1665 THR . 17110 1 79 1666 TYR . 17110 1 80 1667 GLU . 17110 1 81 1668 ASP . 17110 1 82 1669 GLN . 17110 1 83 1670 VAL . 17110 1 84 1671 LEU . 17110 1 85 1672 LYS . 17110 1 86 1673 LEU . 17110 1 87 1674 VAL . 17110 1 88 1675 TYR . 17110 1 89 1676 GLU . 17110 1 90 1677 ASP . 17110 1 91 1678 GLY . 17110 1 92 1679 ASP . 17110 1 93 1680 PRO . 17110 1 94 1681 CYS . 17110 1 95 1682 PRO . 17110 1 96 1683 THR . 17110 1 97 1684 ASP . 17110 1 98 1685 LEU . 17110 1 99 1686 LYS . 17110 1 100 1687 MET . 17110 1 101 1688 LYS . 17110 1 102 1689 HIS . 17110 1 103 1690 LYS . 17110 1 104 1691 SER . 17110 1 105 1692 TYR . 17110 1 106 1693 PHE . 17110 1 107 1694 SER . 17110 1 108 1695 PHE . 17110 1 109 1696 VAL . 17110 1 110 1697 CYS . 17110 1 111 1698 LYS . 17110 1 112 1699 SER . 17110 1 113 1700 ASP . 17110 1 114 1701 ALA . 17110 1 115 1702 GLY . 17110 1 116 1703 ASP . 17110 1 117 1704 ASP . 17110 1 118 1705 SER . 17110 1 119 1706 GLN . 17110 1 120 1707 PRO . 17110 1 121 1708 VAL . 17110 1 122 1709 PHE . 17110 1 123 1710 LEU . 17110 1 124 1711 SER . 17110 1 125 1712 PHE . 17110 1 126 1713 ASP . 17110 1 127 1714 GLU . 17110 1 128 1715 GLN . 17110 1 129 1716 THR . 17110 1 130 1717 CYS . 17110 1 131 1718 THR . 17110 1 132 1719 SER . 17110 1 133 1720 TYR . 17110 1 134 1721 PHE . 17110 1 135 1722 SER . 17110 1 136 1723 TRP . 17110 1 137 1724 HIS . 17110 1 138 1725 THR . 17110 1 139 1726 SER . 17110 1 140 1727 LEU . 17110 1 141 1728 ALA . 17110 1 142 1729 CYS . 17110 1 143 1730 GLU . 17110 1 144 1731 GLU . 17110 1 145 1732 GLU . 17110 1 146 1733 VAL . 17110 1 147 1734 PRO . 17110 1 148 1735 ARG . 17110 1 149 1736 HIS . 17110 1 150 1737 HIS . 17110 1 151 1738 HIS . 17110 1 152 1739 HIS . 17110 1 153 1740 HIS . 17110 1 154 1741 HIS . 17110 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 17110 1 . LYS 2 2 17110 1 . SER 3 3 17110 1 . ASN 4 4 17110 1 . VAL 5 5 17110 1 . GLN 6 6 17110 1 . ASN 7 7 17110 1 . ASP 8 8 17110 1 . CYS 9 9 17110 1 . ARG 10 10 17110 1 . VAL 11 11 17110 1 . THR 12 12 17110 1 . ASN 13 13 17110 1 . PRO 14 14 17110 1 . ALA 15 15 17110 1 . THR 16 16 17110 1 . GLY 17 17 17110 1 . HIS 18 18 17110 1 . LEU 19 19 17110 1 . PHE 20 20 17110 1 . ASP 21 21 17110 1 . LEU 22 22 17110 1 . THR 23 23 17110 1 . SER 24 24 17110 1 . LEU 25 25 17110 1 . LYS 26 26 17110 1 . ARG 27 27 17110 1 . GLU 28 28 17110 1 . SER 29 29 17110 1 . GLY 30 30 17110 1 . TYR 31 31 17110 1 . THR 32 32 17110 1 . ILE 33 33 17110 1 . THR 34 34 17110 1 . ASP 35 35 17110 1 . SER 36 36 17110 1 . HIS 37 37 17110 1 . ASN 38 38 17110 1 . ARG 39 39 17110 1 . LYS 40 40 17110 1 . ILE 41 41 17110 1 . GLU 42 42 17110 1 . LEU 43 43 17110 1 . ASN 44 44 17110 1 . VAL 45 45 17110 1 . CYS 46 46 17110 1 . ALA 47 47 17110 1 . GLU 48 48 17110 1 . ALA 49 49 17110 1 . LYS 50 50 17110 1 . SER 51 51 17110 1 . SER 52 52 17110 1 . CYS 53 53 17110 1 . ALA 54 54 17110 1 . ASN 55 55 17110 1 . GLY 56 56 17110 1 . ALA 57 57 17110 1 . ALA 58 58 17110 1 . VAL 59 59 17110 1 . CYS 60 60 17110 1 . ILE 61 61 17110 1 . THR 62 62 17110 1 . ASP 63 63 17110 1 . GLY 64 64 17110 1 . PRO 65 65 17110 1 . LYS 66 66 17110 1 . THR 67 67 17110 1 . LEU 68 68 17110 1 . ASN 69 69 17110 1 . ALA 70 70 17110 1 . GLY 71 71 17110 1 . LYS 72 72 17110 1 . LEU 73 73 17110 1 . SER 74 74 17110 1 . LYS 75 75 17110 1 . THR 76 76 17110 1 . LEU 77 77 17110 1 . THR 78 78 17110 1 . TYR 79 79 17110 1 . GLU 80 80 17110 1 . ASP 81 81 17110 1 . GLN 82 82 17110 1 . VAL 83 83 17110 1 . LEU 84 84 17110 1 . LYS 85 85 17110 1 . LEU 86 86 17110 1 . VAL 87 87 17110 1 . TYR 88 88 17110 1 . GLU 89 89 17110 1 . ASP 90 90 17110 1 . GLY 91 91 17110 1 . ASP 92 92 17110 1 . PRO 93 93 17110 1 . CYS 94 94 17110 1 . PRO 95 95 17110 1 . THR 96 96 17110 1 . ASP 97 97 17110 1 . LEU 98 98 17110 1 . LYS 99 99 17110 1 . MET 100 100 17110 1 . LYS 101 101 17110 1 . HIS 102 102 17110 1 . LYS 103 103 17110 1 . SER 104 104 17110 1 . TYR 105 105 17110 1 . PHE 106 106 17110 1 . SER 107 107 17110 1 . PHE 108 108 17110 1 . VAL 109 109 17110 1 . CYS 110 110 17110 1 . LYS 111 111 17110 1 . SER 112 112 17110 1 . ASP 113 113 17110 1 . ALA 114 114 17110 1 . GLY 115 115 17110 1 . ASP 116 116 17110 1 . ASP 117 117 17110 1 . SER 118 118 17110 1 . GLN 119 119 17110 1 . PRO 120 120 17110 1 . VAL 121 121 17110 1 . PHE 122 122 17110 1 . LEU 123 123 17110 1 . SER 124 124 17110 1 . PHE 125 125 17110 1 . ASP 126 126 17110 1 . GLU 127 127 17110 1 . GLN 128 128 17110 1 . THR 129 129 17110 1 . CYS 130 130 17110 1 . THR 131 131 17110 1 . SER 132 132 17110 1 . TYR 133 133 17110 1 . PHE 134 134 17110 1 . SER 135 135 17110 1 . TRP 136 136 17110 1 . HIS 137 137 17110 1 . THR 138 138 17110 1 . SER 139 139 17110 1 . LEU 140 140 17110 1 . ALA 141 141 17110 1 . CYS 142 142 17110 1 . GLU 143 143 17110 1 . GLU 144 144 17110 1 . GLU 145 145 17110 1 . VAL 146 146 17110 1 . PRO 147 147 17110 1 . ARG 148 148 17110 1 . HIS 149 149 17110 1 . HIS 150 150 17110 1 . HIS 151 151 17110 1 . HIS 152 152 17110 1 . HIS 153 153 17110 1 . HIS 154 154 17110 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 17110 _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 $IGF2R . 9031 organism . 'Gallus gallus' chicken . . Eukaryota Metazoa Gallus gallus . . . . . . . . . . . . . . . . igf2r . . . . 17110 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 17110 _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 $IGF2R . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3)' . . . . . . . . . . . . . . . pET26a . . . . . . 17110 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17110 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 D2O 'natural abundance' . . . . . . 5 . . % 0.1 . . . 17110 1 2 'sodium acetate' 'natural abundance' . . . . . . 20 . . mM 0.1 . . . 17110 1 3 EDTA 'natural abundance' . . . . . . 0.1 . . mM 0.01 . . . 17110 1 4 'sodium azide' 'natural abundance' . . . . . . 100 . . uM 0.1 . . . 17110 1 5 IGF2R '[U-98% 15N]' . . 1 $IGF2R . . . 0.5 1 mM 0.05 . . . 17110 1 6 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17110 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 17110 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 D2O 'natural abundance' . . . . . . 5 . . % 0.1 . . . 17110 2 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM 0.1 . . . 17110 2 3 EDTA 'natural abundance' . . . . . . 0.1 . . mM 0.01 . . . 17110 2 4 'sodium azide' 'natural abundance' . . . . . . 100 . . uM 0.1 . . . 17110 2 5 IGF2R '[U-98% 13C; U-98% 15N]' . . 1 $IGF2R . . . 0.5 1 mM 0.05 . . . 17110 2 6 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17110 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 17110 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0 . M 17110 1 pH 5.5 . pH 17110 1 pressure 1 . atm 17110 1 temperature 273 . K 17110 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMRJ _Software.Sf_category software _Software.Sf_framecode VNMRJ _Software.Entry_ID 17110 _Software.ID 1 _Software.Name VNMRJ _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 17110 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17110 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 17110 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17110 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17110 2 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 17110 _Software.ID 3 _Software.Name CNS _Software.Version 1.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 17110 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17110 3 'structure solution' 17110 3 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 17110 _Software.ID 4 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 17110 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17110 4 'geometry optimization' 17110 4 stop_ save_ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 17110 _Software.ID 5 _Software.Name ARIA _Software.Version 1.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Linge, O'Donoghue and Nilges' . . 17110 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17110 5 'structure solution' 17110 5 stop_ save_ save_iCing _Software.Sf_category software _Software.Sf_framecode iCing _Software.Entry_ID 17110 _Software.ID 6 _Software.Name iCing _Software.Version r765 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Vuister, Doreleijers, Sousa da Silva' . . 17110 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17110 6 stop_ save_ save_ccpNMR_Analysis _Software.Sf_category software _Software.Sf_framecode ccpNMR_Analysis _Software.Entry_ID 17110 _Software.ID 7 _Software.Name ANALYSIS _Software.Version 2.13 _Software.Details ; The CCPN Data Model for NMR Spectroscopy: Development of a Software Pipeline. Proteins 59, 687 - 696 ; loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Vranken, Boucher, Stevens, Fogh, Pajon, Llinas, Ulrich, Markley, Ionides, Laue' . . 17110 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17110 7 'data analysis' 17110 7 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17110 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'cryoprobe 600MHz' _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 17110 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'room temp probe' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17110 _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 'cryoprobe 600MHz' . . 17110 1 2 spectrometer_2 Varian INOVA . 600 'room temp probe' . . 17110 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 17110 _Experiment_list.ID 1 _Experiment_list.Details 'Some backbone datasets acquired using ASCOM with a reduced number of points in the nitrogen dimension' loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 3 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 4 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 5 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 6 '3D C(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 8 '3D HN(CO)CA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 9 '3D H(CCO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 10 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 11 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 12 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17110 1 13 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17110 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 17110 _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 water protons . . . . ppm 4.773 internal indirect 0.251449530 . . . . . . . . . 17110 1 H 1 water protons . . . . ppm 4.773 internal direct 1 . . . . . . . . . 17110 1 N 15 water protons . . . . ppm 7.773 internal indirect 0.101329118 . . . . . . . . . 17110 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 17110 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.05 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.05 _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 2 '2D 1H-13C HSQC' . . . 17110 1 3 '3D HNCO' . . . 17110 1 4 '3D HNCA' . . . 17110 1 5 '3D HNCACB' . . . 17110 1 6 '3D C(CO)NH' . . . 17110 1 7 '3D CBCA(CO)NH' . . . 17110 1 8 '3D HN(CO)CA' . . . 17110 1 10 '3D HCCH-TOCSY' . . . 17110 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 7 $ccpNMR_Analysis . . 17110 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 HE1 H 1 2.115 0.05 . 1 . . . . 1588 Met HE1 . 17110 1 2 . 1 1 1 1 MET HE2 H 1 2.115 0.05 . 1 . . . . 1588 Met HE2 . 17110 1 3 . 1 1 1 1 MET HE3 H 1 2.115 0.05 . 1 . . . . 1588 Met HE3 . 17110 1 4 . 1 1 1 1 MET CE C 13 16.888 0.2 . 1 . . . . 1588 Met CE . 17110 1 5 . 1 1 2 2 LYS HA H 1 4.412 0.05 . 1 . . . . 1589 Lys HA . 17110 1 6 . 1 1 2 2 LYS HB2 H 1 1.814 0.05 . 1 . . . . 1589 Lys HB2 . 17110 1 7 . 1 1 2 2 LYS HB3 H 1 1.814 0.05 . 1 . . . . 1589 Lys HB3 . 17110 1 8 . 1 1 2 2 LYS HD2 H 1 1.713 0.05 . 1 . . . . 1589 Lys HD2 . 17110 1 9 . 1 1 2 2 LYS HD3 H 1 1.713 0.05 . 1 . . . . 1589 Lys HD3 . 17110 1 10 . 1 1 2 2 LYS HE2 H 1 3.003 0.05 . 1 . . . . 1589 Lys HE2 . 17110 1 11 . 1 1 2 2 LYS HE3 H 1 3.003 0.05 . 1 . . . . 1589 Lys HE3 . 17110 1 12 . 1 1 2 2 LYS HG2 H 1 1.464 0.05 . 2 . . . . 1589 Lys HG2 . 17110 1 13 . 1 1 2 2 LYS HG3 H 1 1.456 0.05 . 2 . . . . 1589 Lys HG3 . 17110 1 14 . 1 1 2 2 LYS C C 13 176.050 0.2 . 1 . . . . 1589 Lys C . 17110 1 15 . 1 1 2 2 LYS CA C 13 56.480 0.2 . 1 . . . . 1589 Lys CA . 17110 1 16 . 1 1 2 2 LYS CB C 13 32.781 0.2 . 1 . . . . 1589 Lys CB . 17110 1 17 . 1 1 2 2 LYS CD C 13 28.674 0.2 . 1 . . . . 1589 Lys CD . 17110 1 18 . 1 1 2 2 LYS CE C 13 41.807 0.2 . 1 . . . . 1589 Lys CE . 17110 1 19 . 1 1 2 2 LYS CG C 13 24.223 0.2 . 1 . . . . 1589 Lys CG . 17110 1 20 . 1 1 3 3 SER H H 1 8.499 0.05 . 1 . . . . 1590 Ser H . 17110 1 21 . 1 1 3 3 SER HA H 1 4.784 0.05 . 1 . . . . 1590 Ser HA . 17110 1 22 . 1 1 3 3 SER HB2 H 1 3.867 0.05 . 2 . . . . 1590 Ser HB2 . 17110 1 23 . 1 1 3 3 SER HB3 H 1 3.856 0.05 . 2 . . . . 1590 Ser HB3 . 17110 1 24 . 1 1 3 3 SER C C 13 174.148 0.2 . 1 . . . . 1590 Ser C . 17110 1 25 . 1 1 3 3 SER CA C 13 58.033 0.2 . 1 . . . . 1590 Ser CA . 17110 1 26 . 1 1 3 3 SER CB C 13 63.695 0.2 . 1 . . . . 1590 Ser CB . 17110 1 27 . 1 1 3 3 SER N N 15 117.300 0.05 . 1 . . . . 1590 Ser N . 17110 1 28 . 1 1 4 4 ASN H H 1 8.629 0.05 . 1 . . . . 1591 Asn H . 17110 1 29 . 1 1 4 4 ASN HA H 1 4.785 0.05 . 1 . . . . 1591 Asn HA . 17110 1 30 . 1 1 4 4 ASN HB2 H 1 2.871 0.05 . 2 . . . . 1591 Asn HB2 . 17110 1 31 . 1 1 4 4 ASN HB3 H 1 2.782 0.05 . 2 . . . . 1591 Asn HB3 . 17110 1 32 . 1 1 4 4 ASN HD21 H 1 7.600 0.05 . 1 . . . . 1591 Asn HD21 . 17110 1 33 . 1 1 4 4 ASN HD22 H 1 6.953 0.05 . 1 . . . . 1591 Asn HD22 . 17110 1 34 . 1 1 4 4 ASN C C 13 175.202 0.2 . 1 . . . . 1591 Asn C . 17110 1 35 . 1 1 4 4 ASN CA C 13 53.137 0.2 . 1 . . . . 1591 Asn CA . 17110 1 36 . 1 1 4 4 ASN CB C 13 38.911 0.2 . 1 . . . . 1591 Asn CB . 17110 1 37 . 1 1 4 4 ASN N N 15 120.836 0.05 . 1 . . . . 1591 Asn N . 17110 1 38 . 1 1 4 4 ASN ND2 N 15 112.135 0.05 . 1 . . . . 1591 Asn ND2 . 17110 1 39 . 1 1 5 5 VAL H H 1 8.090 0.05 . 1 . . . . 1592 Val H . 17110 1 40 . 1 1 5 5 VAL HA H 1 4.156 0.05 . 1 . . . . 1592 Val HA . 17110 1 41 . 1 1 5 5 VAL HB H 1 2.081 0.05 . 1 . . . . 1592 Val HB . 17110 1 42 . 1 1 5 5 VAL HG11 H 1 0.920 0.05 . 2 . . . . 1592 Val HG11 . 17110 1 43 . 1 1 5 5 VAL HG12 H 1 0.920 0.05 . 2 . . . . 1592 Val HG12 . 17110 1 44 . 1 1 5 5 VAL HG13 H 1 0.920 0.05 . 2 . . . . 1592 Val HG13 . 17110 1 45 . 1 1 5 5 VAL HG21 H 1 0.923 0.05 . 2 . . . . 1592 Val HG21 . 17110 1 46 . 1 1 5 5 VAL HG22 H 1 0.923 0.05 . 2 . . . . 1592 Val HG22 . 17110 1 47 . 1 1 5 5 VAL HG23 H 1 0.923 0.05 . 2 . . . . 1592 Val HG23 . 17110 1 48 . 1 1 5 5 VAL C C 13 176.170 0.2 . 1 . . . . 1592 Val C . 17110 1 49 . 1 1 5 5 VAL CA C 13 62.588 0.2 . 1 . . . . 1592 Val CA . 17110 1 50 . 1 1 5 5 VAL CB C 13 38.920 0.2 . 1 . . . . 1592 Val CB . 17110 1 51 . 1 1 5 5 VAL CG1 C 13 20.261 0.2 . 2 . . . . 1592 Val CG1 . 17110 1 52 . 1 1 5 5 VAL CG2 C 13 20.743 0.2 . 2 . . . . 1592 Val CG2 . 17110 1 53 . 1 1 5 5 VAL N N 15 119.515 0.05 . 1 . . . . 1592 Val N . 17110 1 54 . 1 1 6 6 GLN H H 1 8.485 0.05 . 1 . . . . 1593 Gln H . 17110 1 55 . 1 1 6 6 GLN HA H 1 4.326 0.05 . 1 . . . . 1593 Gln HA . 17110 1 56 . 1 1 6 6 GLN HB2 H 1 2.029 0.05 . 2 . . . . 1593 Gln HB2 . 17110 1 57 . 1 1 6 6 GLN HB3 H 1 2.117 0.05 . 2 . . . . 1593 Gln HB3 . 17110 1 58 . 1 1 6 6 GLN HE21 H 1 7.660 0.05 . 1 . . . . 1593 Gln HE21 . 17110 1 59 . 1 1 6 6 GLN HE22 H 1 6.819 0.05 . 1 . . . . 1593 Gln HE22 . 17110 1 60 . 1 1 6 6 GLN HG2 H 1 2.369 0.05 . 2 . . . . 1593 Gln HG2 . 17110 1 61 . 1 1 6 6 GLN HG3 H 1 2.430 0.05 . 2 . . . . 1593 Gln HG3 . 17110 1 62 . 1 1 6 6 GLN C C 13 175.562 0.2 . 1 . . . . 1593 Gln C . 17110 1 63 . 1 1 6 6 GLN CA C 13 56.206 0.2 . 1 . . . . 1593 Gln CA . 17110 1 64 . 1 1 6 6 GLN CB C 13 29.437 0.2 . 1 . . . . 1593 Gln CB . 17110 1 65 . 1 1 6 6 GLN CG C 13 33.259 0.2 . 1 . . . . 1593 Gln CG . 17110 1 66 . 1 1 6 6 GLN N N 15 122.876 0.05 . 1 . . . . 1593 Gln N . 17110 1 67 . 1 1 6 6 GLN NE2 N 15 111.932 0.05 . 1 . . . . 1593 Gln NE2 . 17110 1 68 . 1 1 7 7 ASN H H 1 8.390 0.05 . 1 . . . . 1594 Asn H . 17110 1 69 . 1 1 7 7 ASN HA H 1 4.816 0.05 . 1 . . . . 1594 Asn HA . 17110 1 70 . 1 1 7 7 ASN HB2 H 1 2.936 0.05 . 2 . . . . 1594 Asn HB2 . 17110 1 71 . 1 1 7 7 ASN HB3 H 1 2.747 0.05 . 2 . . . . 1594 Asn HB3 . 17110 1 72 . 1 1 7 7 ASN HD21 H 1 7.632 0.05 . 1 . . . . 1594 Asn HD21 . 17110 1 73 . 1 1 7 7 ASN HD22 H 1 6.949 0.05 . 1 . . . . 1594 Asn HD22 . 17110 1 74 . 1 1 7 7 ASN C C 13 174.588 0.2 . 1 . . . . 1594 Asn C . 17110 1 75 . 1 1 7 7 ASN CA C 13 52.729 0.2 . 1 . . . . 1594 Asn CA . 17110 1 76 . 1 1 7 7 ASN CB C 13 39.274 0.2 . 1 . . . . 1594 Asn CB . 17110 1 77 . 1 1 7 7 ASN N N 15 118.907 0.05 . 1 . . . . 1594 Asn N . 17110 1 78 . 1 1 7 7 ASN ND2 N 15 112.110 0.05 . 1 . . . . 1594 Asn ND2 . 17110 1 79 . 1 1 8 8 ASP H H 1 8.168 0.05 . 1 . . . . 1595 Asp H . 17110 1 80 . 1 1 8 8 ASP HA H 1 4.562 0.05 . 1 . . . . 1595 Asp HA . 17110 1 81 . 1 1 8 8 ASP HB2 H 1 2.632 0.05 . 1 . . . . 1595 Asp HB2 . 17110 1 82 . 1 1 8 8 ASP HB3 H 1 2.632 0.05 . 1 . . . . 1595 Asp HB3 . 17110 1 83 . 1 1 8 8 ASP C C 13 175.256 0.2 . 1 . . . . 1595 Asp C . 17110 1 84 . 1 1 8 8 ASP CA C 13 53.937 0.2 . 1 . . . . 1595 Asp CA . 17110 1 85 . 1 1 8 8 ASP CB C 13 40.806 0.2 . 1 . . . . 1595 Asp CB . 17110 1 86 . 1 1 8 8 ASP N N 15 119.673 0.05 . 1 . . . . 1595 Asp N . 17110 1 87 . 1 1 9 9 CYS H H 1 9.629 0.05 . 1 . . . . 1596 Cys H . 17110 1 88 . 1 1 9 9 CYS HA H 1 3.662 0.05 . 1 . . . . 1596 Cys HA . 17110 1 89 . 1 1 9 9 CYS HB2 H 1 2.678 0.05 . 2 . . . . 1596 Cys HB2 . 17110 1 90 . 1 1 9 9 CYS HB3 H 1 3.757 0.05 . 2 . . . . 1596 Cys HB3 . 17110 1 91 . 1 1 9 9 CYS C C 13 171.928 0.2 . 1 . . . . 1596 Cys C . 17110 1 92 . 1 1 9 9 CYS CA C 13 59.818 0.2 . 1 . . . . 1596 Cys CA . 17110 1 93 . 1 1 9 9 CYS CB C 13 42.710 0.2 . 1 . . . . 1596 Cys CB . 17110 1 94 . 1 1 9 9 CYS N N 15 124.350 0.05 . 1 . . . . 1596 Cys N . 17110 1 95 . 1 1 10 10 ARG H H 1 7.343 0.05 . 1 . . . . 1597 Arg H . 17110 1 96 . 1 1 10 10 ARG HA H 1 5.345 0.05 . 1 . . . . 1597 Arg HA . 17110 1 97 . 1 1 10 10 ARG HB2 H 1 1.804 0.05 . 2 . . . . 1597 Arg HB2 . 17110 1 98 . 1 1 10 10 ARG HB3 H 1 1.523 0.05 . 2 . . . . 1597 Arg HB3 . 17110 1 99 . 1 1 10 10 ARG HD2 H 1 3.070 0.05 . 2 . . . . 1597 Arg HD2 . 17110 1 100 . 1 1 10 10 ARG HD3 H 1 2.956 0.05 . 2 . . . . 1597 Arg HD3 . 17110 1 101 . 1 1 10 10 ARG HE H 1 6.900 0.05 . 1 . . . . 1597 Arg HE . 17110 1 102 . 1 1 10 10 ARG HG2 H 1 1.625 0.05 . 2 . . . . 1597 Arg HG2 . 17110 1 103 . 1 1 10 10 ARG HG3 H 1 1.451 0.05 . 2 . . . . 1597 Arg HG3 . 17110 1 104 . 1 1 10 10 ARG C C 13 174.817 0.2 . 1 . . . . 1597 Arg C . 17110 1 105 . 1 1 10 10 ARG CA C 13 54.528 0.2 . 1 . . . . 1597 Arg CA . 17110 1 106 . 1 1 10 10 ARG CB C 13 35.228 0.2 . 1 . . . . 1597 Arg CB . 17110 1 107 . 1 1 10 10 ARG CD C 13 44.113 0.2 . 1 . . . . 1597 Arg CD . 17110 1 108 . 1 1 10 10 ARG CG C 13 26.678 0.2 . 1 . . . . 1597 Arg CG . 17110 1 109 . 1 1 10 10 ARG N N 15 111.693 0.05 . 1 . . . . 1597 Arg N . 17110 1 110 . 1 1 10 10 ARG NE N 15 84.310 0.05 . 1 . . . . 1597 Arg NE . 17110 1 111 . 1 1 11 11 VAL H H 1 8.838 0.05 . 1 . . . . 1598 Val H . 17110 1 112 . 1 1 11 11 VAL HA H 1 4.548 0.05 . 1 . . . . 1598 Val HA . 17110 1 113 . 1 1 11 11 VAL HB H 1 2.237 0.05 . 1 . . . . 1598 Val HB . 17110 1 114 . 1 1 11 11 VAL HG11 H 1 0.691 0.05 . 2 . . . . 1598 Val HG11 . 17110 1 115 . 1 1 11 11 VAL HG12 H 1 0.691 0.05 . 2 . . . . 1598 Val HG12 . 17110 1 116 . 1 1 11 11 VAL HG13 H 1 0.691 0.05 . 2 . . . . 1598 Val HG13 . 17110 1 117 . 1 1 11 11 VAL HG21 H 1 1.269 0.05 . 2 . . . . 1598 Val HG21 . 17110 1 118 . 1 1 11 11 VAL HG22 H 1 1.269 0.05 . 2 . . . . 1598 Val HG22 . 17110 1 119 . 1 1 11 11 VAL HG23 H 1 1.269 0.05 . 2 . . . . 1598 Val HG23 . 17110 1 120 . 1 1 11 11 VAL C C 13 171.787 0.2 . 1 . . . . 1598 Val C . 17110 1 121 . 1 1 11 11 VAL CA C 13 61.188 0.2 . 1 . . . . 1598 Val CA . 17110 1 122 . 1 1 11 11 VAL CB C 13 33.946 0.2 . 1 . . . . 1598 Val CB . 17110 1 123 . 1 1 11 11 VAL CG1 C 13 20.114 0.2 . 2 . . . . 1598 Val CG1 . 17110 1 124 . 1 1 11 11 VAL CG2 C 13 22.878 0.2 . 2 . . . . 1598 Val CG2 . 17110 1 125 . 1 1 11 11 VAL N N 15 119.042 0.05 . 1 . . . . 1598 Val N . 17110 1 126 . 1 1 12 12 THR H H 1 7.981 0.05 . 1 . . . . 1599 Thr H . 17110 1 127 . 1 1 12 12 THR HA H 1 5.501 0.05 . 1 . . . . 1599 Thr HA . 17110 1 128 . 1 1 12 12 THR HB H 1 3.726 0.05 . 1 . . . . 1599 Thr HB . 17110 1 129 . 1 1 12 12 THR HG21 H 1 0.866 0.05 . 1 . . . . 1599 Thr HG21 . 17110 1 130 . 1 1 12 12 THR HG22 H 1 0.866 0.05 . 1 . . . . 1599 Thr HG22 . 17110 1 131 . 1 1 12 12 THR HG23 H 1 0.866 0.05 . 1 . . . . 1599 Thr HG23 . 17110 1 132 . 1 1 12 12 THR C C 13 174.975 0.2 . 1 . . . . 1599 Thr C . 17110 1 133 . 1 1 12 12 THR CA C 13 60.178 0.2 . 1 . . . . 1599 Thr CA . 17110 1 134 . 1 1 12 12 THR CB C 13 70.849 0.2 . 1 . . . . 1599 Thr CB . 17110 1 135 . 1 1 12 12 THR CG2 C 13 21.494 0.2 . 1 . . . . 1599 Thr CG2 . 17110 1 136 . 1 1 12 12 THR N N 15 119.060 0.05 . 1 . . . . 1599 Thr N . 17110 1 137 . 1 1 13 13 ASN H H 1 8.217 0.05 . 1 . . . . 1600 Asn H . 17110 1 138 . 1 1 13 13 ASN HA H 1 4.389 0.05 . 1 . . . . 1600 Asn HA . 17110 1 139 . 1 1 13 13 ASN HB2 H 1 3.189 0.05 . 2 . . . . 1600 Asn HB2 . 17110 1 140 . 1 1 13 13 ASN HB3 H 1 2.313 0.05 . 2 . . . . 1600 Asn HB3 . 17110 1 141 . 1 1 13 13 ASN HD21 H 1 7.297 0.05 . 1 . . . . 1600 Asn HD21 . 17110 1 142 . 1 1 13 13 ASN HD22 H 1 9.451 0.05 . 1 . . . . 1600 Asn HD22 . 17110 1 143 . 1 1 13 13 ASN CA C 13 49.776 0.2 . 1 . . . . 1600 Asn CA . 17110 1 144 . 1 1 13 13 ASN CB C 13 38.870 0.2 . 1 . . . . 1600 Asn CB . 17110 1 145 . 1 1 13 13 ASN N N 15 119.869 0.05 . 1 . . . . 1600 Asn N . 17110 1 146 . 1 1 13 13 ASN ND2 N 15 117.254 0.05 . 1 . . . . 1600 Asn ND2 . 17110 1 147 . 1 1 14 14 PRO HA H 1 4.275 0.05 . 1 . . . . 1601 Pro HA . 17110 1 148 . 1 1 14 14 PRO HB2 H 1 2.382 0.05 . 2 . . . . 1601 Pro HB2 . 17110 1 149 . 1 1 14 14 PRO HB3 H 1 2.040 0.05 . 2 . . . . 1601 Pro HB3 . 17110 1 150 . 1 1 14 14 PRO HD2 H 1 3.938 0.05 . 1 . . . . 1601 Pro HD2 . 17110 1 151 . 1 1 14 14 PRO HD3 H 1 3.938 0.05 . 1 . . . . 1601 Pro HD3 . 17110 1 152 . 1 1 14 14 PRO HG2 H 1 2.145 0.05 . 2 . . . . 1601 Pro HG2 . 17110 1 153 . 1 1 14 14 PRO HG3 H 1 2.143 0.05 . 2 . . . . 1601 Pro HG3 . 17110 1 154 . 1 1 14 14 PRO C C 13 177.787 0.2 . 1 . . . . 1601 Pro C . 17110 1 155 . 1 1 14 14 PRO CA C 13 63.991 0.2 . 1 . . . . 1601 Pro CA . 17110 1 156 . 1 1 14 14 PRO CB C 13 31.913 0.2 . 1 . . . . 1601 Pro CB . 17110 1 157 . 1 1 14 14 PRO CD C 13 51.880 0.2 . 1 . . . . 1601 Pro CD . 17110 1 158 . 1 1 14 14 PRO CG C 13 27.159 0.2 . 1 . . . . 1601 Pro CG . 17110 1 159 . 1 1 15 15 ALA H H 1 7.760 0.05 . 1 . . . . 1602 Ala H . 17110 1 160 . 1 1 15 15 ALA HA H 1 4.298 0.05 . 1 . . . . 1602 Ala HA . 17110 1 161 . 1 1 15 15 ALA HB1 H 1 1.543 0.05 . 1 . . . . 1602 Ala HB1 . 17110 1 162 . 1 1 15 15 ALA HB2 H 1 1.543 0.05 . 1 . . . . 1602 Ala HB2 . 17110 1 163 . 1 1 15 15 ALA HB3 H 1 1.543 0.05 . 1 . . . . 1602 Ala HB3 . 17110 1 164 . 1 1 15 15 ALA C C 13 178.865 0.2 . 1 . . . . 1602 Ala C . 17110 1 165 . 1 1 15 15 ALA CA C 13 54.084 0.2 . 1 . . . . 1602 Ala CA . 17110 1 166 . 1 1 15 15 ALA CB C 13 19.517 0.2 . 1 . . . . 1602 Ala CB . 17110 1 167 . 1 1 15 15 ALA N N 15 117.316 0.05 . 1 . . . . 1602 Ala N . 17110 1 168 . 1 1 16 16 THR H H 1 6.743 0.05 . 1 . . . . 1603 Thr H . 17110 1 169 . 1 1 16 16 THR HA H 1 4.497 0.05 . 1 . . . . 1603 Thr HA . 17110 1 170 . 1 1 16 16 THR HB H 1 4.315 0.05 . 1 . . . . 1603 Thr HB . 17110 1 171 . 1 1 16 16 THR HG21 H 1 1.081 0.05 . 1 . . . . 1603 Thr HG21 . 17110 1 172 . 1 1 16 16 THR HG22 H 1 1.081 0.05 . 1 . . . . 1603 Thr HG22 . 17110 1 173 . 1 1 16 16 THR HG23 H 1 1.081 0.05 . 1 . . . . 1603 Thr HG23 . 17110 1 174 . 1 1 16 16 THR C C 13 176.386 0.2 . 1 . . . . 1603 Thr C . 17110 1 175 . 1 1 16 16 THR CA C 13 60.657 0.2 . 1 . . . . 1603 Thr CA . 17110 1 176 . 1 1 16 16 THR CB C 13 71.088 0.2 . 1 . . . . 1603 Thr CB . 17110 1 177 . 1 1 16 16 THR CG2 C 13 21.229 0.2 . 1 . . . . 1603 Thr CG2 . 17110 1 178 . 1 1 16 16 THR N N 15 102.415 0.05 . 1 . . . . 1603 Thr N . 17110 1 179 . 1 1 17 17 GLY H H 1 8.732 0.05 . 1 . . . . 1604 Gly H . 17110 1 180 . 1 1 17 17 GLY HA2 H 1 4.182 0.05 . 2 . . . . 1604 Gly HA2 . 17110 1 181 . 1 1 17 17 GLY HA3 H 1 3.500 0.05 . 2 . . . . 1604 Gly HA3 . 17110 1 182 . 1 1 17 17 GLY C C 13 173.579 0.2 . 1 . . . . 1604 Gly C . 17110 1 183 . 1 1 17 17 GLY CA C 13 45.247 0.2 . 1 . . . . 1604 Gly CA . 17110 1 184 . 1 1 17 17 GLY N N 15 111.144 0.05 . 1 . . . . 1604 Gly N . 17110 1 185 . 1 1 18 18 HIS H H 1 7.872 0.05 . 1 . . . . 1605 His H . 17110 1 186 . 1 1 18 18 HIS HA H 1 3.955 0.05 . 1 . . . . 1605 His HA . 17110 1 187 . 1 1 18 18 HIS HB2 H 1 2.966 0.05 . 2 . . . . 1605 His HB2 . 17110 1 188 . 1 1 18 18 HIS HB3 H 1 2.524 0.05 . 2 . . . . 1605 His HB3 . 17110 1 189 . 1 1 18 18 HIS C C 13 172.591 0.2 . 1 . . . . 1605 His C . 17110 1 190 . 1 1 18 18 HIS CA C 13 56.876 0.2 . 1 . . . . 1605 His CA . 17110 1 191 . 1 1 18 18 HIS CB C 13 29.366 0.2 . 1 . . . . 1605 His CB . 17110 1 192 . 1 1 18 18 HIS N N 15 118.884 0.05 . 1 . . . . 1605 His N . 17110 1 193 . 1 1 19 19 LEU H H 1 7.807 0.05 . 1 . . . . 1606 Leu H . 17110 1 194 . 1 1 19 19 LEU HA H 1 4.265 0.05 . 1 . . . . 1606 Leu HA . 17110 1 195 . 1 1 19 19 LEU HB2 H 1 1.483 0.05 . 2 . . . . 1606 Leu HB2 . 17110 1 196 . 1 1 19 19 LEU HB3 H 1 1.187 0.05 . 2 . . . . 1606 Leu HB3 . 17110 1 197 . 1 1 19 19 LEU HD11 H 1 0.671 0.05 . 2 . . . . 1606 Leu HD11 . 17110 1 198 . 1 1 19 19 LEU HD12 H 1 0.671 0.05 . 2 . . . . 1606 Leu HD12 . 17110 1 199 . 1 1 19 19 LEU HD13 H 1 0.671 0.05 . 2 . . . . 1606 Leu HD13 . 17110 1 200 . 1 1 19 19 LEU HD21 H 1 0.739 0.05 . 2 . . . . 1606 Leu HD21 . 17110 1 201 . 1 1 19 19 LEU HD22 H 1 0.739 0.05 . 2 . . . . 1606 Leu HD22 . 17110 1 202 . 1 1 19 19 LEU HD23 H 1 0.739 0.05 . 2 . . . . 1606 Leu HD23 . 17110 1 203 . 1 1 19 19 LEU HG H 1 1.473 0.05 . 1 . . . . 1606 Leu HG . 17110 1 204 . 1 1 19 19 LEU C C 13 174.821 0.2 . 1 . . . . 1606 Leu C . 17110 1 205 . 1 1 19 19 LEU CA C 13 54.168 0.2 . 1 . . . . 1606 Leu CA . 17110 1 206 . 1 1 19 19 LEU CB C 13 42.880 0.2 . 1 . . . . 1606 Leu CB . 17110 1 207 . 1 1 19 19 LEU CD1 C 13 23.994 0.2 . 2 . . . . 1606 Leu CD1 . 17110 1 208 . 1 1 19 19 LEU CD2 C 13 25.730 0.2 . 2 . . . . 1606 Leu CD2 . 17110 1 209 . 1 1 19 19 LEU CG C 13 25.699 0.2 . 1 . . . . 1606 Leu CG . 17110 1 210 . 1 1 19 19 LEU N N 15 128.614 0.05 . 1 . . . . 1606 Leu N . 17110 1 211 . 1 1 20 20 PHE H H 1 9.293 0.05 . 1 . . . . 1607 Phe H . 17110 1 212 . 1 1 20 20 PHE HA H 1 4.733 0.05 . 1 . . . . 1607 Phe HA . 17110 1 213 . 1 1 20 20 PHE HB2 H 1 3.017 0.05 . 2 . . . . 1607 Phe HB2 . 17110 1 214 . 1 1 20 20 PHE HB3 H 1 2.643 0.05 . 2 . . . . 1607 Phe HB3 . 17110 1 215 . 1 1 20 20 PHE HD1 H 1 7.434 0.05 . 3 . . . . 1607 Phe HD1 . 17110 1 216 . 1 1 20 20 PHE HD2 H 1 7.434 0.05 . 3 . . . . 1607 Phe HD2 . 17110 1 217 . 1 1 20 20 PHE HE1 H 1 6.808 0.05 . 3 . . . . 1607 Phe HE1 . 17110 1 218 . 1 1 20 20 PHE HE2 H 1 6.808 0.05 . 3 . . . . 1607 Phe HE2 . 17110 1 219 . 1 1 20 20 PHE C C 13 174.358 0.2 . 1 . . . . 1607 Phe C . 17110 1 220 . 1 1 20 20 PHE CA C 13 57.028 0.2 . 1 . . . . 1607 Phe CA . 17110 1 221 . 1 1 20 20 PHE CB C 13 40.325 0.2 . 1 . . . . 1607 Phe CB . 17110 1 222 . 1 1 20 20 PHE CD1 C 13 133.286 0.2 . 3 . . . . 1607 Phe CD1 . 17110 1 223 . 1 1 20 20 PHE CD2 C 13 133.286 0.2 . 3 . . . . 1607 Phe CD2 . 17110 1 224 . 1 1 20 20 PHE CE1 C 13 130.795 0.2 . 3 . . . . 1607 Phe CE1 . 17110 1 225 . 1 1 20 20 PHE CE2 C 13 130.795 0.2 . 3 . . . . 1607 Phe CE2 . 17110 1 226 . 1 1 20 20 PHE N N 15 125.843 0.05 . 1 . . . . 1607 Phe N . 17110 1 227 . 1 1 21 21 ASP H H 1 8.560 0.05 . 1 . . . . 1608 Asp H . 17110 1 228 . 1 1 21 21 ASP HA H 1 5.036 0.05 . 1 . . . . 1608 Asp HA . 17110 1 229 . 1 1 21 21 ASP HB2 H 1 2.919 0.05 . 2 . . . . 1608 Asp HB2 . 17110 1 230 . 1 1 21 21 ASP HB3 H 1 2.175 0.05 . 2 . . . . 1608 Asp HB3 . 17110 1 231 . 1 1 21 21 ASP C C 13 176.839 0.2 . 1 . . . . 1608 Asp C . 17110 1 232 . 1 1 21 21 ASP CA C 13 52.804 0.2 . 1 . . . . 1608 Asp CA . 17110 1 233 . 1 1 21 21 ASP CB C 13 43.042 0.2 . 1 . . . . 1608 Asp CB . 17110 1 234 . 1 1 21 21 ASP N N 15 120.399 0.05 . 1 . . . . 1608 Asp N . 17110 1 235 . 1 1 22 22 LEU H H 1 8.195 0.05 . 1 . . . . 1609 Leu H . 17110 1 236 . 1 1 22 22 LEU HA H 1 4.371 0.05 . 1 . . . . 1609 Leu HA . 17110 1 237 . 1 1 22 22 LEU HB2 H 1 1.222 0.05 . 1 . . . . 1609 Leu HB2 . 17110 1 238 . 1 1 22 22 LEU HB3 H 1 1.222 0.05 . 1 . . . . 1609 Leu HB3 . 17110 1 239 . 1 1 22 22 LEU HD11 H 1 -0.047 0.05 . 2 . . . . 1609 Leu HD11 . 17110 1 240 . 1 1 22 22 LEU HD12 H 1 -0.047 0.05 . 2 . . . . 1609 Leu HD12 . 17110 1 241 . 1 1 22 22 LEU HD13 H 1 -0.047 0.05 . 2 . . . . 1609 Leu HD13 . 17110 1 242 . 1 1 22 22 LEU HD21 H 1 -0.455 0.05 . 2 . . . . 1609 Leu HD21 . 17110 1 243 . 1 1 22 22 LEU HD22 H 1 -0.455 0.05 . 2 . . . . 1609 Leu HD22 . 17110 1 244 . 1 1 22 22 LEU HD23 H 1 -0.455 0.05 . 2 . . . . 1609 Leu HD23 . 17110 1 245 . 1 1 22 22 LEU HG H 1 0.907 0.05 . 1 . . . . 1609 Leu HG . 17110 1 246 . 1 1 22 22 LEU C C 13 177.101 0.2 . 1 . . . . 1609 Leu C . 17110 1 247 . 1 1 22 22 LEU CA C 13 54.068 0.2 . 1 . . . . 1609 Leu CA . 17110 1 248 . 1 1 22 22 LEU CB C 13 40.673 0.2 . 1 . . . . 1609 Leu CB . 17110 1 249 . 1 1 22 22 LEU CD1 C 13 22.373 0.2 . 2 . . . . 1609 Leu CD1 . 17110 1 250 . 1 1 22 22 LEU CD2 C 13 24.153 0.2 . 2 . . . . 1609 Leu CD2 . 17110 1 251 . 1 1 22 22 LEU CG C 13 26.927 0.2 . 1 . . . . 1609 Leu CG . 17110 1 252 . 1 1 22 22 LEU N N 15 124.589 0.05 . 1 . . . . 1609 Leu N . 17110 1 253 . 1 1 23 23 THR H H 1 8.860 0.05 . 1 . . . . 1610 Thr H . 17110 1 254 . 1 1 23 23 THR HA H 1 3.636 0.05 . 1 . . . . 1610 Thr HA . 17110 1 255 . 1 1 23 23 THR HB H 1 3.720 0.05 . 1 . . . . 1610 Thr HB . 17110 1 256 . 1 1 23 23 THR HG21 H 1 1.279 0.05 . 1 . . . . 1610 Thr HG21 . 17110 1 257 . 1 1 23 23 THR HG22 H 1 1.279 0.05 . 1 . . . . 1610 Thr HG22 . 17110 1 258 . 1 1 23 23 THR HG23 H 1 1.279 0.05 . 1 . . . . 1610 Thr HG23 . 17110 1 259 . 1 1 23 23 THR C C 13 177.433 0.2 . 1 . . . . 1610 Thr C . 17110 1 260 . 1 1 23 23 THR CA C 13 67.237 0.2 . 1 . . . . 1610 Thr CA . 17110 1 261 . 1 1 23 23 THR CB C 13 68.856 0.2 . 1 . . . . 1610 Thr CB . 17110 1 262 . 1 1 23 23 THR CG2 C 13 22.891 0.2 . 1 . . . . 1610 Thr CG2 . 17110 1 263 . 1 1 23 23 THR N N 15 114.894 0.05 . 1 . . . . 1610 Thr N . 17110 1 264 . 1 1 24 24 SER H H 1 8.581 0.05 . 1 . . . . 1611 Ser H . 17110 1 265 . 1 1 24 24 SER HA H 1 4.230 0.05 . 1 . . . . 1611 Ser HA . 17110 1 266 . 1 1 24 24 SER HB2 H 1 4.023 0.05 . 1 . . . . 1611 Ser HB2 . 17110 1 267 . 1 1 24 24 SER HB3 H 1 4.023 0.05 . 1 . . . . 1611 Ser HB3 . 17110 1 268 . 1 1 24 24 SER C C 13 175.325 0.2 . 1 . . . . 1611 Ser C . 17110 1 269 . 1 1 24 24 SER CA C 13 60.906 0.2 . 1 . . . . 1611 Ser CA . 17110 1 270 . 1 1 24 24 SER CB C 13 62.527 0.2 . 1 . . . . 1611 Ser CB . 17110 1 271 . 1 1 24 24 SER N N 15 114.224 0.05 . 1 . . . . 1611 Ser N . 17110 1 272 . 1 1 25 25 LEU H H 1 7.910 0.05 . 1 . . . . 1612 Leu H . 17110 1 273 . 1 1 25 25 LEU HA H 1 4.360 0.05 . 1 . . . . 1612 Leu HA . 17110 1 274 . 1 1 25 25 LEU HB2 H 1 1.621 0.05 . 2 . . . . 1612 Leu HB2 . 17110 1 275 . 1 1 25 25 LEU HB3 H 1 1.267 0.05 . 2 . . . . 1612 Leu HB3 . 17110 1 276 . 1 1 25 25 LEU HD11 H 1 -0.012 0.05 . 2 . . . . 1612 Leu HD11 . 17110 1 277 . 1 1 25 25 LEU HD12 H 1 -0.012 0.05 . 2 . . . . 1612 Leu HD12 . 17110 1 278 . 1 1 25 25 LEU HD13 H 1 -0.012 0.05 . 2 . . . . 1612 Leu HD13 . 17110 1 279 . 1 1 25 25 LEU HD21 H 1 0.680 0.05 . 2 . . . . 1612 Leu HD21 . 17110 1 280 . 1 1 25 25 LEU HD22 H 1 0.680 0.05 . 2 . . . . 1612 Leu HD22 . 17110 1 281 . 1 1 25 25 LEU HD23 H 1 0.680 0.05 . 2 . . . . 1612 Leu HD23 . 17110 1 282 . 1 1 25 25 LEU HG H 1 0.798 0.05 . 1 . . . . 1612 Leu HG . 17110 1 283 . 1 1 25 25 LEU C C 13 178.717 0.2 . 1 . . . . 1612 Leu C . 17110 1 284 . 1 1 25 25 LEU CA C 13 54.987 0.2 . 1 . . . . 1612 Leu CA . 17110 1 285 . 1 1 25 25 LEU CB C 13 41.844 0.2 . 1 . . . . 1612 Leu CB . 17110 1 286 . 1 1 25 25 LEU CD1 C 13 25.331 0.2 . 2 . . . . 1612 Leu CD1 . 17110 1 287 . 1 1 25 25 LEU CD2 C 13 21.733 0.2 . 2 . . . . 1612 Leu CD2 . 17110 1 288 . 1 1 25 25 LEU CG C 13 26.101 0.2 . 1 . . . . 1612 Leu CG . 17110 1 289 . 1 1 25 25 LEU N N 15 118.513 0.05 . 1 . . . . 1612 Leu N . 17110 1 290 . 1 1 26 26 LYS H H 1 7.556 0.05 . 1 . . . . 1613 Lys H . 17110 1 291 . 1 1 26 26 LYS HA H 1 4.305 0.05 . 1 . . . . 1613 Lys HA . 17110 1 292 . 1 1 26 26 LYS HB2 H 1 1.334 0.05 . 2 . . . . 1613 Lys HB2 . 17110 1 293 . 1 1 26 26 LYS HB3 H 1 1.888 0.05 . 2 . . . . 1613 Lys HB3 . 17110 1 294 . 1 1 26 26 LYS HD2 H 1 1.674 0.05 . 1 . . . . 1613 Lys HD2 . 17110 1 295 . 1 1 26 26 LYS HD3 H 1 1.674 0.05 . 1 . . . . 1613 Lys HD3 . 17110 1 296 . 1 1 26 26 LYS HE2 H 1 2.975 0.05 . 1 . . . . 1613 Lys HE2 . 17110 1 297 . 1 1 26 26 LYS HE3 H 1 2.975 0.05 . 1 . . . . 1613 Lys HE3 . 17110 1 298 . 1 1 26 26 LYS HG2 H 1 1.961 0.05 . 2 . . . . 1613 Lys HG2 . 17110 1 299 . 1 1 26 26 LYS HG3 H 1 1.435 0.05 . 2 . . . . 1613 Lys HG3 . 17110 1 300 . 1 1 26 26 LYS C C 13 176.493 0.2 . 1 . . . . 1613 Lys C . 17110 1 301 . 1 1 26 26 LYS CA C 13 58.251 0.2 . 1 . . . . 1613 Lys CA . 17110 1 302 . 1 1 26 26 LYS CB C 13 32.193 0.2 . 1 . . . . 1613 Lys CB . 17110 1 303 . 1 1 26 26 LYS CD C 13 29.146 0.2 . 1 . . . . 1613 Lys CD . 17110 1 304 . 1 1 26 26 LYS CE C 13 41.827 0.2 . 1 . . . . 1613 Lys CE . 17110 1 305 . 1 1 26 26 LYS CG C 13 24.797 0.2 . 1 . . . . 1613 Lys CG . 17110 1 306 . 1 1 26 26 LYS N N 15 121.148 0.05 . 1 . . . . 1613 Lys N . 17110 1 307 . 1 1 27 27 ARG H H 1 8.217 0.05 . 1 . . . . 1614 Arg H . 17110 1 308 . 1 1 27 27 ARG HA H 1 4.898 0.05 . 1 . . . . 1614 Arg HA . 17110 1 309 . 1 1 27 27 ARG HB2 H 1 1.891 0.05 . 2 . . . . 1614 Arg HB2 . 17110 1 310 . 1 1 27 27 ARG HB3 H 1 1.373 0.05 . 2 . . . . 1614 Arg HB3 . 17110 1 311 . 1 1 27 27 ARG HD2 H 1 2.898 0.05 . 2 . . . . 1614 Arg HD2 . 17110 1 312 . 1 1 27 27 ARG HD3 H 1 2.504 0.05 . 2 . . . . 1614 Arg HD3 . 17110 1 313 . 1 1 27 27 ARG HE H 1 6.843 0.05 . 1 . . . . 1614 Arg HE . 17110 1 314 . 1 1 27 27 ARG HG2 H 1 1.619 0.05 . 2 . . . . 1614 Arg HG2 . 17110 1 315 . 1 1 27 27 ARG HG3 H 1 1.446 0.05 . 2 . . . . 1614 Arg HG3 . 17110 1 316 . 1 1 27 27 ARG C C 13 177.527 0.2 . 1 . . . . 1614 Arg C . 17110 1 317 . 1 1 27 27 ARG CA C 13 54.047 0.2 . 1 . . . . 1614 Arg CA . 17110 1 318 . 1 1 27 27 ARG CB C 13 34.016 0.2 . 1 . . . . 1614 Arg CB . 17110 1 319 . 1 1 27 27 ARG CD C 13 43.301 0.2 . 1 . . . . 1614 Arg CD . 17110 1 320 . 1 1 27 27 ARG CG C 13 26.469 0.2 . 1 . . . . 1614 Arg CG . 17110 1 321 . 1 1 27 27 ARG N N 15 124.003 0.05 . 1 . . . . 1614 Arg N . 17110 1 322 . 1 1 27 27 ARG NE N 15 84.566 0.05 . 1 . . . . 1614 Arg NE . 17110 1 323 . 1 1 28 28 GLU H H 1 9.191 0.05 . 1 . . . . 1615 Glu H . 17110 1 324 . 1 1 28 28 GLU HA H 1 4.009 0.05 . 1 . . . . 1615 Glu HA . 17110 1 325 . 1 1 28 28 GLU HB2 H 1 2.083 0.05 . 1 . . . . 1615 Glu HB2 . 17110 1 326 . 1 1 28 28 GLU HB3 H 1 2.083 0.05 . 1 . . . . 1615 Glu HB3 . 17110 1 327 . 1 1 28 28 GLU HG2 H 1 2.308 0.05 . 1 . . . . 1615 Glu HG2 . 17110 1 328 . 1 1 28 28 GLU HG3 H 1 2.308 0.05 . 1 . . . . 1615 Glu HG3 . 17110 1 329 . 1 1 28 28 GLU C C 13 177.682 0.2 . 1 . . . . 1615 Glu C . 17110 1 330 . 1 1 28 28 GLU CA C 13 59.877 0.2 . 1 . . . . 1615 Glu CA . 17110 1 331 . 1 1 28 28 GLU CB C 13 29.206 0.2 . 1 . . . . 1615 Glu CB . 17110 1 332 . 1 1 28 28 GLU CG C 13 35.579 0.2 . 1 . . . . 1615 Glu CG . 17110 1 333 . 1 1 28 28 GLU N N 15 125.448 0.05 . 1 . . . . 1615 Glu N . 17110 1 334 . 1 1 29 29 SER H H 1 8.205 0.05 . 1 . . . . 1616 Ser H . 17110 1 335 . 1 1 29 29 SER HA H 1 4.431 0.05 . 1 . . . . 1616 Ser HA . 17110 1 336 . 1 1 29 29 SER HB2 H 1 3.934 0.05 . 2 . . . . 1616 Ser HB2 . 17110 1 337 . 1 1 29 29 SER HB3 H 1 3.873 0.05 . 2 . . . . 1616 Ser HB3 . 17110 1 338 . 1 1 29 29 SER C C 13 174.564 0.2 . 1 . . . . 1616 Ser C . 17110 1 339 . 1 1 29 29 SER CA C 13 58.408 0.2 . 1 . . . . 1616 Ser CA . 17110 1 340 . 1 1 29 29 SER CB C 13 63.511 0.2 . 1 . . . . 1616 Ser CB . 17110 1 341 . 1 1 29 29 SER N N 15 109.517 0.05 . 1 . . . . 1616 Ser N . 17110 1 342 . 1 1 30 30 GLY H H 1 7.359 0.05 . 1 . . . . 1617 Gly H . 17110 1 343 . 1 1 30 30 GLY HA2 H 1 4.577 0.05 . 2 . . . . 1617 Gly HA2 . 17110 1 344 . 1 1 30 30 GLY HA3 H 1 3.589 0.05 . 2 . . . . 1617 Gly HA3 . 17110 1 345 . 1 1 30 30 GLY C C 13 170.782 0.2 . 1 . . . . 1617 Gly C . 17110 1 346 . 1 1 30 30 GLY CA C 13 44.925 0.2 . 1 . . . . 1617 Gly CA . 17110 1 347 . 1 1 30 30 GLY N N 15 106.551 0.05 . 1 . . . . 1617 Gly N . 17110 1 348 . 1 1 31 31 TYR H H 1 9.193 0.05 . 1 . . . . 1618 Tyr H . 17110 1 349 . 1 1 31 31 TYR HA H 1 4.777 0.05 . 1 . . . . 1618 Tyr HA . 17110 1 350 . 1 1 31 31 TYR HB2 H 1 2.695 0.05 . 2 . . . . 1618 Tyr HB2 . 17110 1 351 . 1 1 31 31 TYR HB3 H 1 2.775 0.05 . 2 . . . . 1618 Tyr HB3 . 17110 1 352 . 1 1 31 31 TYR HD1 H 1 7.297 0.05 . 3 . . . . 1618 Tyr HD1 . 17110 1 353 . 1 1 31 31 TYR HD2 H 1 7.297 0.05 . 3 . . . . 1618 Tyr HD2 . 17110 1 354 . 1 1 31 31 TYR HE1 H 1 7.304 0.05 . 3 . . . . 1618 Tyr HE1 . 17110 1 355 . 1 1 31 31 TYR HE2 H 1 7.304 0.05 . 3 . . . . 1618 Tyr HE2 . 17110 1 356 . 1 1 31 31 TYR C C 13 175.243 0.2 . 1 . . . . 1618 Tyr C . 17110 1 357 . 1 1 31 31 TYR CA C 13 57.306 0.2 . 1 . . . . 1618 Tyr CA . 17110 1 358 . 1 1 31 31 TYR CB C 13 41.131 0.2 . 1 . . . . 1618 Tyr CB . 17110 1 359 . 1 1 31 31 TYR CD1 C 13 133.552 0.2 . 3 . . . . 1618 Tyr CD1 . 17110 1 360 . 1 1 31 31 TYR CD2 C 13 133.552 0.2 . 3 . . . . 1618 Tyr CD2 . 17110 1 361 . 1 1 31 31 TYR CE1 C 13 118.039 0.2 . 3 . . . . 1618 Tyr CE1 . 17110 1 362 . 1 1 31 31 TYR CE2 C 13 118.039 0.2 . 3 . . . . 1618 Tyr CE2 . 17110 1 363 . 1 1 31 31 TYR N N 15 119.148 0.05 . 1 . . . . 1618 Tyr N . 17110 1 364 . 1 1 32 32 THR H H 1 8.722 0.05 . 1 . . . . 1619 Thr H . 17110 1 365 . 1 1 32 32 THR HA H 1 5.504 0.05 . 1 . . . . 1619 Thr HA . 17110 1 366 . 1 1 32 32 THR HB H 1 3.960 0.05 . 1 . . . . 1619 Thr HB . 17110 1 367 . 1 1 32 32 THR HG21 H 1 1.164 0.05 . 1 . . . . 1619 Thr HG21 . 17110 1 368 . 1 1 32 32 THR HG22 H 1 1.164 0.05 . 1 . . . . 1619 Thr HG22 . 17110 1 369 . 1 1 32 32 THR HG23 H 1 1.164 0.05 . 1 . . . . 1619 Thr HG23 . 17110 1 370 . 1 1 32 32 THR C C 13 174.300 0.2 . 1 . . . . 1619 Thr C . 17110 1 371 . 1 1 32 32 THR CA C 13 61.859 0.2 . 1 . . . . 1619 Thr CA . 17110 1 372 . 1 1 32 32 THR CB C 13 70.759 0.2 . 1 . . . . 1619 Thr CB . 17110 1 373 . 1 1 32 32 THR CG2 C 13 21.783 0.2 . 1 . . . . 1619 Thr CG2 . 17110 1 374 . 1 1 32 32 THR N N 15 117.585 0.05 . 1 . . . . 1619 Thr N . 17110 1 375 . 1 1 33 33 ILE H H 1 9.343 0.05 . 1 . . . . 1620 Ile H . 17110 1 376 . 1 1 33 33 ILE HA H 1 4.901 0.05 . 1 . . . . 1620 Ile HA . 17110 1 377 . 1 1 33 33 ILE HB H 1 2.208 0.05 . 1 . . . . 1620 Ile HB . 17110 1 378 . 1 1 33 33 ILE HD11 H 1 0.902 0.05 . 1 . . . . 1620 Ile HD11 . 17110 1 379 . 1 1 33 33 ILE HD12 H 1 0.902 0.05 . 1 . . . . 1620 Ile HD12 . 17110 1 380 . 1 1 33 33 ILE HD13 H 1 0.902 0.05 . 1 . . . . 1620 Ile HD13 . 17110 1 381 . 1 1 33 33 ILE HG12 H 1 1.386 0.05 . 1 . . . . 1620 Ile HG12 . 17110 1 382 . 1 1 33 33 ILE HG13 H 1 1.386 0.05 . 1 . . . . 1620 Ile HG13 . 17110 1 383 . 1 1 33 33 ILE HG21 H 1 0.970 0.05 . 1 . . . . 1620 Ile HG21 . 17110 1 384 . 1 1 33 33 ILE HG22 H 1 0.970 0.05 . 1 . . . . 1620 Ile HG22 . 17110 1 385 . 1 1 33 33 ILE HG23 H 1 0.970 0.05 . 1 . . . . 1620 Ile HG23 . 17110 1 386 . 1 1 33 33 ILE C C 13 174.091 0.2 . 1 . . . . 1620 Ile C . 17110 1 387 . 1 1 33 33 ILE CA C 13 59.570 0.2 . 1 . . . . 1620 Ile CA . 17110 1 388 . 1 1 33 33 ILE CB C 13 42.123 0.2 . 1 . . . . 1620 Ile CB . 17110 1 389 . 1 1 33 33 ILE CD1 C 13 13.964 0.2 . 1 . . . . 1620 Ile CD1 . 17110 1 390 . 1 1 33 33 ILE CG1 C 13 26.868 0.2 . 1 . . . . 1620 Ile CG1 . 17110 1 391 . 1 1 33 33 ILE CG2 C 13 17.581 0.2 . 1 . . . . 1620 Ile CG2 . 17110 1 392 . 1 1 33 33 ILE N N 15 121.332 0.05 . 1 . . . . 1620 Ile N . 17110 1 393 . 1 1 34 34 THR H H 1 8.315 0.05 . 1 . . . . 1621 Thr H . 17110 1 394 . 1 1 34 34 THR HA H 1 5.481 0.05 . 1 . . . . 1621 Thr HA . 17110 1 395 . 1 1 34 34 THR HB H 1 4.074 0.05 . 1 . . . . 1621 Thr HB . 17110 1 396 . 1 1 34 34 THR HG21 H 1 1.222 0.05 . 1 . . . . 1621 Thr HG21 . 17110 1 397 . 1 1 34 34 THR HG22 H 1 1.222 0.05 . 1 . . . . 1621 Thr HG22 . 17110 1 398 . 1 1 34 34 THR HG23 H 1 1.222 0.05 . 1 . . . . 1621 Thr HG23 . 17110 1 399 . 1 1 34 34 THR C C 13 174.052 0.2 . 1 . . . . 1621 Thr C . 17110 1 400 . 1 1 34 34 THR CA C 13 59.429 0.2 . 1 . . . . 1621 Thr CA . 17110 1 401 . 1 1 34 34 THR CB C 13 71.606 0.2 . 1 . . . . 1621 Thr CB . 17110 1 402 . 1 1 34 34 THR CG2 C 13 20.479 0.2 . 1 . . . . 1621 Thr CG2 . 17110 1 403 . 1 1 34 34 THR N N 15 113.397 0.05 . 1 . . . . 1621 Thr N . 17110 1 404 . 1 1 35 35 ASP H H 1 8.213 0.05 . 1 . . . . 1622 Asp H . 17110 1 405 . 1 1 35 35 ASP HA H 1 4.907 0.05 . 1 . . . . 1622 Asp HA . 17110 1 406 . 1 1 35 35 ASP HB2 H 1 2.177 0.05 . 2 . . . . 1622 Asp HB2 . 17110 1 407 . 1 1 35 35 ASP HB3 H 1 3.043 0.05 . 2 . . . . 1622 Asp HB3 . 17110 1 408 . 1 1 35 35 ASP C C 13 178.770 0.2 . 1 . . . . 1622 Asp C . 17110 1 409 . 1 1 35 35 ASP CA C 13 52.298 0.2 . 1 . . . . 1622 Asp CA . 17110 1 410 . 1 1 35 35 ASP CB C 13 42.863 0.2 . 1 . . . . 1622 Asp CB . 17110 1 411 . 1 1 35 35 ASP N N 15 121.210 0.05 . 1 . . . . 1622 Asp N . 17110 1 412 . 1 1 36 36 SER H H 1 8.147 0.05 . 1 . . . . 1623 Ser H . 17110 1 413 . 1 1 36 36 SER HA H 1 4.276 0.05 . 1 . . . . 1623 Ser HA . 17110 1 414 . 1 1 36 36 SER HB2 H 1 3.959 0.05 . 1 . . . . 1623 Ser HB2 . 17110 1 415 . 1 1 36 36 SER HB3 H 1 3.959 0.05 . 1 . . . . 1623 Ser HB3 . 17110 1 416 . 1 1 36 36 SER C C 13 175.086 0.2 . 1 . . . . 1623 Ser C . 17110 1 417 . 1 1 36 36 SER CA C 13 60.230 0.2 . 1 . . . . 1623 Ser CA . 17110 1 418 . 1 1 36 36 SER CB C 13 62.804 0.2 . 1 . . . . 1623 Ser CB . 17110 1 419 . 1 1 36 36 SER N N 15 112.229 0.05 . 1 . . . . 1623 Ser N . 17110 1 420 . 1 1 37 37 HIS H H 1 8.261 0.05 . 1 . . . . 1624 His H . 17110 1 421 . 1 1 37 37 HIS HA H 1 4.795 0.05 . 1 . . . . 1624 His HA . 17110 1 422 . 1 1 37 37 HIS HB2 H 1 3.513 0.05 . 2 . . . . 1624 His HB2 . 17110 1 423 . 1 1 37 37 HIS HB3 H 1 2.891 0.05 . 2 . . . . 1624 His HB3 . 17110 1 424 . 1 1 37 37 HIS HD2 H 1 7.165 0.05 . 1 . . . . 1624 His HD2 . 17110 1 425 . 1 1 37 37 HIS C C 13 173.658 0.2 . 1 . . . . 1624 His C . 17110 1 426 . 1 1 37 37 HIS CA C 13 55.006 0.2 . 1 . . . . 1624 His CA . 17110 1 427 . 1 1 37 37 HIS CB C 13 28.485 0.2 . 1 . . . . 1624 His CB . 17110 1 428 . 1 1 37 37 HIS N N 15 119.514 0.05 . 1 . . . . 1624 His N . 17110 1 429 . 1 1 38 38 ASN H H 1 8.312 0.05 . 1 . . . . 1625 Asn H . 17110 1 430 . 1 1 38 38 ASN HA H 1 4.330 0.05 . 1 . . . . 1625 Asn HA . 17110 1 431 . 1 1 38 38 ASN HB2 H 1 3.137 0.05 . 2 . . . . 1625 Asn HB2 . 17110 1 432 . 1 1 38 38 ASN HB3 H 1 2.845 0.05 . 2 . . . . 1625 Asn HB3 . 17110 1 433 . 1 1 38 38 ASN HD21 H 1 6.827 0.05 . 1 . . . . 1625 Asn HD21 . 17110 1 434 . 1 1 38 38 ASN HD22 H 1 7.593 0.05 . 1 . . . . 1625 Asn HD22 . 17110 1 435 . 1 1 38 38 ASN C C 13 174.673 0.2 . 1 . . . . 1625 Asn C . 17110 1 436 . 1 1 38 38 ASN CA C 13 54.794 0.2 . 1 . . . . 1625 Asn CA . 17110 1 437 . 1 1 38 38 ASN CB C 13 36.971 0.2 . 1 . . . . 1625 Asn CB . 17110 1 438 . 1 1 38 38 ASN N N 15 113.868 0.05 . 1 . . . . 1625 Asn N . 17110 1 439 . 1 1 38 38 ASN ND2 N 15 111.950 0.05 . 1 . . . . 1625 Asn ND2 . 17110 1 440 . 1 1 39 39 ARG H H 1 8.399 0.05 . 1 . . . . 1626 Arg H . 17110 1 441 . 1 1 39 39 ARG HA H 1 4.360 0.05 . 1 . . . . 1626 Arg HA . 17110 1 442 . 1 1 39 39 ARG HB2 H 1 1.710 0.05 . 1 . . . . 1626 Arg HB2 . 17110 1 443 . 1 1 39 39 ARG HB3 H 1 1.710 0.05 . 1 . . . . 1626 Arg HB3 . 17110 1 444 . 1 1 39 39 ARG HD2 H 1 3.099 0.05 . 1 . . . . 1626 Arg HD2 . 17110 1 445 . 1 1 39 39 ARG HD3 H 1 3.099 0.05 . 1 . . . . 1626 Arg HD3 . 17110 1 446 . 1 1 39 39 ARG HE H 1 8.982 0.05 . 1 . . . . 1626 Arg HE . 17110 1 447 . 1 1 39 39 ARG HG2 H 1 1.290 0.05 . 2 . . . . 1626 Arg HG2 . 17110 1 448 . 1 1 39 39 ARG HG3 H 1 1.275 0.05 . 2 . . . . 1626 Arg HG3 . 17110 1 449 . 1 1 39 39 ARG C C 13 176.267 0.2 . 1 . . . . 1626 Arg C . 17110 1 450 . 1 1 39 39 ARG CA C 13 56.702 0.2 . 1 . . . . 1626 Arg CA . 17110 1 451 . 1 1 39 39 ARG CB C 13 30.681 0.2 . 1 . . . . 1626 Arg CB . 17110 1 452 . 1 1 39 39 ARG CG C 13 26.263 0.2 . 1 . . . . 1626 Arg CG . 17110 1 453 . 1 1 39 39 ARG N N 15 117.873 0.05 . 1 . . . . 1626 Arg N . 17110 1 454 . 1 1 39 39 ARG NE N 15 84.572 0.05 . 1 . . . . 1626 Arg NE . 17110 1 455 . 1 1 40 40 LYS H H 1 8.164 0.05 . 1 . . . . 1627 Lys H . 17110 1 456 . 1 1 40 40 LYS HA H 1 4.600 0.05 . 1 . . . . 1627 Lys HA . 17110 1 457 . 1 1 40 40 LYS HB2 H 1 1.682 0.05 . 1 . . . . 1627 Lys HB2 . 17110 1 458 . 1 1 40 40 LYS HB3 H 1 1.682 0.05 . 1 . . . . 1627 Lys HB3 . 17110 1 459 . 1 1 40 40 LYS HE2 H 1 2.895 0.05 . 1 . . . . 1627 Lys HE2 . 17110 1 460 . 1 1 40 40 LYS HE3 H 1 2.895 0.05 . 1 . . . . 1627 Lys HE3 . 17110 1 461 . 1 1 40 40 LYS HG2 H 1 1.322 0.05 . 1 . . . . 1627 Lys HG2 . 17110 1 462 . 1 1 40 40 LYS HG3 H 1 1.322 0.05 . 1 . . . . 1627 Lys HG3 . 17110 1 463 . 1 1 40 40 LYS C C 13 174.673 0.2 . 1 . . . . 1627 Lys C . 17110 1 464 . 1 1 40 40 LYS CA C 13 55.851 0.2 . 1 . . . . 1627 Lys CA . 17110 1 465 . 1 1 40 40 LYS CB C 13 33.695 0.2 . 1 . . . . 1627 Lys CB . 17110 1 466 . 1 1 40 40 LYS CD C 13 29.445 0.2 . 1 . . . . 1627 Lys CD . 17110 1 467 . 1 1 40 40 LYS CG C 13 25.315 0.2 . 1 . . . . 1627 Lys CG . 17110 1 468 . 1 1 40 40 LYS N N 15 122.174 0.05 . 1 . . . . 1627 Lys N . 17110 1 469 . 1 1 41 41 ILE H H 1 9.088 0.05 . 1 . . . . 1628 Ile H . 17110 1 470 . 1 1 41 41 ILE HA H 1 4.705 0.05 . 1 . . . . 1628 Ile HA . 17110 1 471 . 1 1 41 41 ILE HB H 1 1.862 0.05 . 1 . . . . 1628 Ile HB . 17110 1 472 . 1 1 41 41 ILE HD11 H 1 0.609 0.05 . 1 . . . . 1628 Ile HD11 . 17110 1 473 . 1 1 41 41 ILE HD12 H 1 0.609 0.05 . 1 . . . . 1628 Ile HD12 . 17110 1 474 . 1 1 41 41 ILE HD13 H 1 0.609 0.05 . 1 . . . . 1628 Ile HD13 . 17110 1 475 . 1 1 41 41 ILE HG12 H 1 1.407 0.05 . 1 . . . . 1628 Ile HG12 . 17110 1 476 . 1 1 41 41 ILE HG13 H 1 1.407 0.05 . 1 . . . . 1628 Ile HG13 . 17110 1 477 . 1 1 41 41 ILE HG21 H 1 0.867 0.05 . 1 . . . . 1628 Ile HG21 . 17110 1 478 . 1 1 41 41 ILE HG22 H 1 0.867 0.05 . 1 . . . . 1628 Ile HG22 . 17110 1 479 . 1 1 41 41 ILE HG23 H 1 0.867 0.05 . 1 . . . . 1628 Ile HG23 . 17110 1 480 . 1 1 41 41 ILE C C 13 174.341 0.2 . 1 . . . . 1628 Ile C . 17110 1 481 . 1 1 41 41 ILE CA C 13 61.047 0.2 . 1 . . . . 1628 Ile CA . 17110 1 482 . 1 1 41 41 ILE CB C 13 38.671 0.2 . 1 . . . . 1628 Ile CB . 17110 1 483 . 1 1 41 41 ILE CD1 C 13 13.708 0.2 . 1 . . . . 1628 Ile CD1 . 17110 1 484 . 1 1 41 41 ILE CG1 C 13 26.950 0.2 . 1 . . . . 1628 Ile CG1 . 17110 1 485 . 1 1 41 41 ILE CG2 C 13 18.507 0.2 . 1 . . . . 1628 Ile CG2 . 17110 1 486 . 1 1 41 41 ILE N N 15 126.658 0.05 . 1 . . . . 1628 Ile N . 17110 1 487 . 1 1 42 42 GLU H H 1 8.875 0.05 . 1 . . . . 1629 Glu H . 17110 1 488 . 1 1 42 42 GLU HA H 1 5.447 0.05 . 1 . . . . 1629 Glu HA . 17110 1 489 . 1 1 42 42 GLU HB2 H 1 1.916 0.05 . 1 . . . . 1629 Glu HB2 . 17110 1 490 . 1 1 42 42 GLU HB3 H 1 1.916 0.05 . 1 . . . . 1629 Glu HB3 . 17110 1 491 . 1 1 42 42 GLU HG2 H 1 2.087 0.05 . 1 . . . . 1629 Glu HG2 . 17110 1 492 . 1 1 42 42 GLU HG3 H 1 2.087 0.05 . 1 . . . . 1629 Glu HG3 . 17110 1 493 . 1 1 42 42 GLU C C 13 175.151 0.2 . 1 . . . . 1629 Glu C . 17110 1 494 . 1 1 42 42 GLU CA C 13 54.053 0.2 . 1 . . . . 1629 Glu CA . 17110 1 495 . 1 1 42 42 GLU CB C 13 31.671 0.2 . 1 . . . . 1629 Glu CB . 17110 1 496 . 1 1 42 42 GLU CG C 13 36.356 0.2 . 1 . . . . 1629 Glu CG . 17110 1 497 . 1 1 42 42 GLU N N 15 126.408 0.05 . 1 . . . . 1629 Glu N . 17110 1 498 . 1 1 43 43 LEU H H 1 9.360 0.05 . 1 . . . . 1630 Leu H . 17110 1 499 . 1 1 43 43 LEU HA H 1 5.864 0.05 . 1 . . . . 1630 Leu HA . 17110 1 500 . 1 1 43 43 LEU HB2 H 1 1.730 0.05 . 2 . . . . 1630 Leu HB2 . 17110 1 501 . 1 1 43 43 LEU HB3 H 1 1.853 0.05 . 2 . . . . 1630 Leu HB3 . 17110 1 502 . 1 1 43 43 LEU HD11 H 1 0.674 0.05 . 2 . . . . 1630 Leu HD11 . 17110 1 503 . 1 1 43 43 LEU HD12 H 1 0.674 0.05 . 2 . . . . 1630 Leu HD12 . 17110 1 504 . 1 1 43 43 LEU HD13 H 1 0.674 0.05 . 2 . . . . 1630 Leu HD13 . 17110 1 505 . 1 1 43 43 LEU HD21 H 1 0.624 0.05 . 2 . . . . 1630 Leu HD21 . 17110 1 506 . 1 1 43 43 LEU HD22 H 1 0.624 0.05 . 2 . . . . 1630 Leu HD22 . 17110 1 507 . 1 1 43 43 LEU HD23 H 1 0.624 0.05 . 2 . . . . 1630 Leu HD23 . 17110 1 508 . 1 1 43 43 LEU C C 13 174.626 0.2 . 1 . . . . 1630 Leu C . 17110 1 509 . 1 1 43 43 LEU CA C 13 53.614 0.2 . 1 . . . . 1630 Leu CA . 17110 1 510 . 1 1 43 43 LEU CB C 13 46.293 0.2 . 1 . . . . 1630 Leu CB . 17110 1 511 . 1 1 43 43 LEU CD1 C 13 26.042 0.2 . 2 . . . . 1630 Leu CD1 . 17110 1 512 . 1 1 43 43 LEU CD2 C 13 27.481 0.2 . 2 . . . . 1630 Leu CD2 . 17110 1 513 . 1 1 43 43 LEU N N 15 118.709 0.05 . 1 . . . . 1630 Leu N . 17110 1 514 . 1 1 44 44 ASN H H 1 8.117 0.05 . 1 . . . . 1631 Asn H . 17110 1 515 . 1 1 44 44 ASN HA H 1 5.213 0.05 . 1 . . . . 1631 Asn HA . 17110 1 516 . 1 1 44 44 ASN HB2 H 1 3.048 0.05 . 2 . . . . 1631 Asn HB2 . 17110 1 517 . 1 1 44 44 ASN HB3 H 1 2.358 0.05 . 2 . . . . 1631 Asn HB3 . 17110 1 518 . 1 1 44 44 ASN HD21 H 1 7.590 0.05 . 1 . . . . 1631 Asn HD21 . 17110 1 519 . 1 1 44 44 ASN HD22 H 1 7.057 0.05 . 1 . . . . 1631 Asn HD22 . 17110 1 520 . 1 1 44 44 ASN C C 13 175.816 0.2 . 1 . . . . 1631 Asn C . 17110 1 521 . 1 1 44 44 ASN CA C 13 50.135 0.2 . 1 . . . . 1631 Asn CA . 17110 1 522 . 1 1 44 44 ASN CB C 13 42.791 0.2 . 1 . . . . 1631 Asn CB . 17110 1 523 . 1 1 44 44 ASN N N 15 116.774 0.05 . 1 . . . . 1631 Asn N . 17110 1 524 . 1 1 44 44 ASN ND2 N 15 109.313 0.05 . 1 . . . . 1631 Asn ND2 . 17110 1 525 . 1 1 45 45 VAL H H 1 8.483 0.05 . 1 . . . . 1632 Val H . 17110 1 526 . 1 1 45 45 VAL HA H 1 3.742 0.05 . 1 . . . . 1632 Val HA . 17110 1 527 . 1 1 45 45 VAL HB H 1 1.540 0.05 . 1 . . . . 1632 Val HB . 17110 1 528 . 1 1 45 45 VAL HG11 H 1 0.544 0.05 . 2 . . . . 1632 Val HG11 . 17110 1 529 . 1 1 45 45 VAL HG12 H 1 0.544 0.05 . 2 . . . . 1632 Val HG12 . 17110 1 530 . 1 1 45 45 VAL HG13 H 1 0.544 0.05 . 2 . . . . 1632 Val HG13 . 17110 1 531 . 1 1 45 45 VAL HG21 H 1 0.640 0.05 . 2 . . . . 1632 Val HG21 . 17110 1 532 . 1 1 45 45 VAL HG22 H 1 0.640 0.05 . 2 . . . . 1632 Val HG22 . 17110 1 533 . 1 1 45 45 VAL HG23 H 1 0.640 0.05 . 2 . . . . 1632 Val HG23 . 17110 1 534 . 1 1 45 45 VAL C C 13 177.353 0.2 . 1 . . . . 1632 Val C . 17110 1 535 . 1 1 45 45 VAL CA C 13 62.497 0.2 . 1 . . . . 1632 Val CA . 17110 1 536 . 1 1 45 45 VAL CB C 13 33.347 0.2 . 1 . . . . 1632 Val CB . 17110 1 537 . 1 1 45 45 VAL CG1 C 13 21.120 0.2 . 2 . . . . 1632 Val CG1 . 17110 1 538 . 1 1 45 45 VAL CG2 C 13 23.284 0.2 . 2 . . . . 1632 Val CG2 . 17110 1 539 . 1 1 45 45 VAL N N 15 119.629 0.05 . 1 . . . . 1632 Val N . 17110 1 540 . 1 1 46 46 CYS H H 1 8.299 0.05 . 1 . . . . 1633 Cys H . 17110 1 541 . 1 1 46 46 CYS HA H 1 4.277 0.05 . 1 . . . . 1633 Cys HA . 17110 1 542 . 1 1 46 46 CYS HB2 H 1 3.100 0.05 . 2 . . . . 1633 Cys HB2 . 17110 1 543 . 1 1 46 46 CYS HB3 H 1 3.982 0.05 . 2 . . . . 1633 Cys HB3 . 17110 1 544 . 1 1 46 46 CYS C C 13 171.877 0.2 . 1 . . . . 1633 Cys C . 17110 1 545 . 1 1 46 46 CYS CA C 13 55.858 0.2 . 1 . . . . 1633 Cys CA . 17110 1 546 . 1 1 46 46 CYS CB C 13 42.349 0.2 . 1 . . . . 1633 Cys CB . 17110 1 547 . 1 1 46 46 CYS N N 15 117.797 0.05 . 1 . . . . 1633 Cys N . 17110 1 548 . 1 1 47 47 ALA H H 1 7.268 0.05 . 1 . . . . 1634 Ala H . 17110 1 549 . 1 1 47 47 ALA HA H 1 4.220 0.05 . 1 . . . . 1634 Ala HA . 17110 1 550 . 1 1 47 47 ALA HB1 H 1 1.267 0.05 . 1 . . . . 1634 Ala HB1 . 17110 1 551 . 1 1 47 47 ALA HB2 H 1 1.267 0.05 . 1 . . . . 1634 Ala HB2 . 17110 1 552 . 1 1 47 47 ALA HB3 H 1 1.267 0.05 . 1 . . . . 1634 Ala HB3 . 17110 1 553 . 1 1 47 47 ALA C C 13 172.983 0.2 . 1 . . . . 1634 Ala C . 17110 1 554 . 1 1 47 47 ALA CA C 13 51.470 0.2 . 1 . . . . 1634 Ala CA . 17110 1 555 . 1 1 47 47 ALA CB C 13 21.983 0.2 . 1 . . . . 1634 Ala CB . 17110 1 556 . 1 1 47 47 ALA N N 15 114.238 0.05 . 1 . . . . 1634 Ala N . 17110 1 557 . 1 1 48 48 GLU H H 1 8.451 0.05 . 1 . . . . 1635 Glu H . 17110 1 558 . 1 1 48 48 GLU HA H 1 3.784 0.05 . 1 . . . . 1635 Glu HA . 17110 1 559 . 1 1 48 48 GLU HB2 H 1 1.941 0.05 . 2 . . . . 1635 Glu HB2 . 17110 1 560 . 1 1 48 48 GLU HB3 H 1 1.796 0.05 . 2 . . . . 1635 Glu HB3 . 17110 1 561 . 1 1 48 48 GLU HG2 H 1 2.143 0.05 . 1 . . . . 1635 Glu HG2 . 17110 1 562 . 1 1 48 48 GLU HG3 H 1 2.143 0.05 . 1 . . . . 1635 Glu HG3 . 17110 1 563 . 1 1 48 48 GLU C C 13 177.076 0.2 . 1 . . . . 1635 Glu C . 17110 1 564 . 1 1 48 48 GLU CA C 13 56.730 0.2 . 1 . . . . 1635 Glu CA . 17110 1 565 . 1 1 48 48 GLU CB C 13 30.229 0.2 . 1 . . . . 1635 Glu CB . 17110 1 566 . 1 1 48 48 GLU CG C 13 36.551 0.2 . 1 . . . . 1635 Glu CG . 17110 1 567 . 1 1 48 48 GLU N N 15 115.214 0.05 . 1 . . . . 1635 Glu N . 17110 1 568 . 1 1 49 49 ALA H H 1 8.684 0.05 . 1 . . . . 1636 Ala H . 17110 1 569 . 1 1 49 49 ALA HA H 1 4.254 0.05 . 1 . . . . 1636 Ala HA . 17110 1 570 . 1 1 49 49 ALA HB1 H 1 1.044 0.05 . 1 . . . . 1636 Ala HB1 . 17110 1 571 . 1 1 49 49 ALA HB2 H 1 1.044 0.05 . 1 . . . . 1636 Ala HB2 . 17110 1 572 . 1 1 49 49 ALA HB3 H 1 1.044 0.05 . 1 . . . . 1636 Ala HB3 . 17110 1 573 . 1 1 49 49 ALA C C 13 176.734 0.2 . 1 . . . . 1636 Ala C . 17110 1 574 . 1 1 49 49 ALA CA C 13 51.223 0.2 . 1 . . . . 1636 Ala CA . 17110 1 575 . 1 1 49 49 ALA CB C 13 18.187 0.2 . 1 . . . . 1636 Ala CB . 17110 1 576 . 1 1 49 49 ALA N N 15 123.379 0.05 . 1 . . . . 1636 Ala N . 17110 1 577 . 1 1 50 50 LYS H H 1 8.458 0.05 . 1 . . . . 1637 Lys H . 17110 1 578 . 1 1 50 50 LYS HA H 1 4.479 0.05 . 1 . . . . 1637 Lys HA . 17110 1 579 . 1 1 50 50 LYS HB2 H 1 1.769 0.05 . 2 . . . . 1637 Lys HB2 . 17110 1 580 . 1 1 50 50 LYS HB3 H 1 1.691 0.05 . 2 . . . . 1637 Lys HB3 . 17110 1 581 . 1 1 50 50 LYS HD2 H 1 1.683 0.05 . 1 . . . . 1637 Lys HD2 . 17110 1 582 . 1 1 50 50 LYS HD3 H 1 1.683 0.05 . 1 . . . . 1637 Lys HD3 . 17110 1 583 . 1 1 50 50 LYS HE2 H 1 2.980 0.05 . 1 . . . . 1637 Lys HE2 . 17110 1 584 . 1 1 50 50 LYS HE3 H 1 2.980 0.05 . 1 . . . . 1637 Lys HE3 . 17110 1 585 . 1 1 50 50 LYS HG2 H 1 1.442 0.05 . 1 . . . . 1637 Lys HG2 . 17110 1 586 . 1 1 50 50 LYS HG3 H 1 1.442 0.05 . 1 . . . . 1637 Lys HG3 . 17110 1 587 . 1 1 50 50 LYS C C 13 175.202 0.2 . 1 . . . . 1637 Lys C . 17110 1 588 . 1 1 50 50 LYS CA C 13 55.485 0.2 . 1 . . . . 1637 Lys CA . 17110 1 589 . 1 1 50 50 LYS CB C 13 30.902 0.2 . 1 . . . . 1637 Lys CB . 17110 1 590 . 1 1 50 50 LYS CD C 13 28.454 0.2 . 1 . . . . 1637 Lys CD . 17110 1 591 . 1 1 50 50 LYS CE C 13 41.852 0.2 . 1 . . . . 1637 Lys CE . 17110 1 592 . 1 1 50 50 LYS CG C 13 24.109 0.2 . 1 . . . . 1637 Lys CG . 17110 1 593 . 1 1 50 50 LYS N N 15 124.342 0.05 . 1 . . . . 1637 Lys N . 17110 1 594 . 1 1 51 51 SER H H 1 8.198 0.05 . 1 . . . . 1638 Ser H . 17110 1 595 . 1 1 51 51 SER HA H 1 4.792 0.05 . 1 . . . . 1638 Ser HA . 17110 1 596 . 1 1 51 51 SER HB2 H 1 3.983 0.05 . 2 . . . . 1638 Ser HB2 . 17110 1 597 . 1 1 51 51 SER HB3 H 1 3.468 0.05 . 2 . . . . 1638 Ser HB3 . 17110 1 598 . 1 1 51 51 SER C C 13 173.977 0.2 . 1 . . . . 1638 Ser C . 17110 1 599 . 1 1 51 51 SER CA C 13 57.935 0.2 . 1 . . . . 1638 Ser CA . 17110 1 600 . 1 1 51 51 SER CB C 13 66.727 0.2 . 1 . . . . 1638 Ser CB . 17110 1 601 . 1 1 51 51 SER N N 15 118.688 0.05 . 1 . . . . 1638 Ser N . 17110 1 602 . 1 1 52 52 SER H H 1 9.112 0.05 . 1 . . . . 1639 Ser H . 17110 1 603 . 1 1 52 52 SER HA H 1 4.459 0.05 . 1 . . . . 1639 Ser HA . 17110 1 604 . 1 1 52 52 SER HB2 H 1 3.954 0.05 . 2 . . . . 1639 Ser HB2 . 17110 1 605 . 1 1 52 52 SER HB3 H 1 3.818 0.05 . 2 . . . . 1639 Ser HB3 . 17110 1 606 . 1 1 52 52 SER C C 13 174.761 0.2 . 1 . . . . 1639 Ser C . 17110 1 607 . 1 1 52 52 SER CA C 13 58.925 0.2 . 1 . . . . 1639 Ser CA . 17110 1 608 . 1 1 52 52 SER CB C 13 63.287 0.2 . 1 . . . . 1639 Ser CB . 17110 1 609 . 1 1 52 52 SER N N 15 113.333 0.05 . 1 . . . . 1639 Ser N . 17110 1 610 . 1 1 53 53 CYS H H 1 8.159 0.05 . 1 . . . . 1640 Cys H . 17110 1 611 . 1 1 53 53 CYS HA H 1 4.384 0.05 . 1 . . . . 1640 Cys HA . 17110 1 612 . 1 1 53 53 CYS HB2 H 1 3.121 0.05 . 2 . . . . 1640 Cys HB2 . 17110 1 613 . 1 1 53 53 CYS HB3 H 1 2.776 0.05 . 2 . . . . 1640 Cys HB3 . 17110 1 614 . 1 1 53 53 CYS C C 13 174.130 0.2 . 1 . . . . 1640 Cys C . 17110 1 615 . 1 1 53 53 CYS CA C 13 62.289 0.2 . 1 . . . . 1640 Cys CA . 17110 1 616 . 1 1 53 53 CYS CB C 13 38.445 0.2 . 1 . . . . 1640 Cys CB . 17110 1 617 . 1 1 53 53 CYS N N 15 118.999 0.05 . 1 . . . . 1640 Cys N . 17110 1 618 . 1 1 54 54 ALA H H 1 8.321 0.05 . 1 . . . . 1641 Ala H . 17110 1 619 . 1 1 54 54 ALA HA H 1 4.286 0.05 . 1 . . . . 1641 Ala HA . 17110 1 620 . 1 1 54 54 ALA HB1 H 1 1.424 0.05 . 1 . . . . 1641 Ala HB1 . 17110 1 621 . 1 1 54 54 ALA HB2 H 1 1.424 0.05 . 1 . . . . 1641 Ala HB2 . 17110 1 622 . 1 1 54 54 ALA HB3 H 1 1.424 0.05 . 1 . . . . 1641 Ala HB3 . 17110 1 623 . 1 1 54 54 ALA C C 13 176.707 0.2 . 1 . . . . 1641 Ala C . 17110 1 624 . 1 1 54 54 ALA CA C 13 52.227 0.2 . 1 . . . . 1641 Ala CA . 17110 1 625 . 1 1 54 54 ALA CB C 13 19.791 0.2 . 1 . . . . 1641 Ala CB . 17110 1 626 . 1 1 54 54 ALA N N 15 122.523 0.05 . 1 . . . . 1641 Ala N . 17110 1 627 . 1 1 55 55 ASN H H 1 8.393 0.05 . 1 . . . . 1642 Asn H . 17110 1 628 . 1 1 55 55 ASN HA H 1 4.367 0.05 . 1 . . . . 1642 Asn HA . 17110 1 629 . 1 1 55 55 ASN HB2 H 1 2.885 0.05 . 2 . . . . 1642 Asn HB2 . 17110 1 630 . 1 1 55 55 ASN HB3 H 1 2.798 0.05 . 2 . . . . 1642 Asn HB3 . 17110 1 631 . 1 1 55 55 ASN HD21 H 1 7.004 0.05 . 1 . . . . 1642 Asn HD21 . 17110 1 632 . 1 1 55 55 ASN HD22 H 1 7.780 0.05 . 1 . . . . 1642 Asn HD22 . 17110 1 633 . 1 1 55 55 ASN C C 13 175.434 0.2 . 1 . . . . 1642 Asn C . 17110 1 634 . 1 1 55 55 ASN CA C 13 54.240 0.2 . 1 . . . . 1642 Asn CA . 17110 1 635 . 1 1 55 55 ASN CB C 13 37.680 0.2 . 1 . . . . 1642 Asn CB . 17110 1 636 . 1 1 55 55 ASN N N 15 113.302 0.05 . 1 . . . . 1642 Asn N . 17110 1 637 . 1 1 55 55 ASN ND2 N 15 113.234 0.05 . 1 . . . . 1642 Asn ND2 . 17110 1 638 . 1 1 56 56 GLY H H 1 8.426 0.05 . 1 . . . . 1643 Gly H . 17110 1 639 . 1 1 56 56 GLY HA2 H 1 3.989 0.05 . 2 . . . . 1643 Gly HA2 . 17110 1 640 . 1 1 56 56 GLY HA3 H 1 3.626 0.05 . 2 . . . . 1643 Gly HA3 . 17110 1 641 . 1 1 56 56 GLY C C 13 174.351 0.2 . 1 . . . . 1643 Gly C . 17110 1 642 . 1 1 56 56 GLY CA C 13 46.166 0.2 . 1 . . . . 1643 Gly CA . 17110 1 643 . 1 1 56 56 GLY N N 15 106.840 0.05 . 1 . . . . 1643 Gly N . 17110 1 644 . 1 1 57 57 ALA H H 1 7.553 0.05 . 1 . . . . 1644 Ala H . 17110 1 645 . 1 1 57 57 ALA HA H 1 4.047 0.05 . 1 . . . . 1644 Ala HA . 17110 1 646 . 1 1 57 57 ALA HB1 H 1 1.203 0.05 . 1 . . . . 1644 Ala HB1 . 17110 1 647 . 1 1 57 57 ALA HB2 H 1 1.203 0.05 . 1 . . . . 1644 Ala HB2 . 17110 1 648 . 1 1 57 57 ALA HB3 H 1 1.203 0.05 . 1 . . . . 1644 Ala HB3 . 17110 1 649 . 1 1 57 57 ALA C C 13 177.402 0.2 . 1 . . . . 1644 Ala C . 17110 1 650 . 1 1 57 57 ALA CA C 13 53.212 0.2 . 1 . . . . 1644 Ala CA . 17110 1 651 . 1 1 57 57 ALA CB C 13 19.103 0.2 . 1 . . . . 1644 Ala CB . 17110 1 652 . 1 1 57 57 ALA N N 15 121.234 0.05 . 1 . . . . 1644 Ala N . 17110 1 653 . 1 1 58 58 ALA H H 1 9.643 0.05 . 1 . . . . 1645 Ala H . 17110 1 654 . 1 1 58 58 ALA HA H 1 4.264 0.05 . 1 . . . . 1645 Ala HA . 17110 1 655 . 1 1 58 58 ALA HB1 H 1 0.260 0.05 . 1 . . . . 1645 Ala HB1 . 17110 1 656 . 1 1 58 58 ALA HB2 H 1 0.260 0.05 . 1 . . . . 1645 Ala HB2 . 17110 1 657 . 1 1 58 58 ALA HB3 H 1 0.260 0.05 . 1 . . . . 1645 Ala HB3 . 17110 1 658 . 1 1 58 58 ALA C C 13 175.224 0.2 . 1 . . . . 1645 Ala C . 17110 1 659 . 1 1 58 58 ALA CA C 13 52.920 0.2 . 1 . . . . 1645 Ala CA . 17110 1 660 . 1 1 58 58 ALA CB C 13 18.950 0.2 . 1 . . . . 1645 Ala CB . 17110 1 661 . 1 1 58 58 ALA N N 15 126.924 0.05 . 1 . . . . 1645 Ala N . 17110 1 662 . 1 1 59 59 VAL H H 1 6.897 0.05 . 1 . . . . 1646 Val H . 17110 1 663 . 1 1 59 59 VAL HA H 1 4.596 0.05 . 1 . . . . 1646 Val HA . 17110 1 664 . 1 1 59 59 VAL HB H 1 1.879 0.05 . 1 . . . . 1646 Val HB . 17110 1 665 . 1 1 59 59 VAL HG11 H 1 0.956 0.05 . 2 . . . . 1646 Val HG11 . 17110 1 666 . 1 1 59 59 VAL HG12 H 1 0.956 0.05 . 2 . . . . 1646 Val HG12 . 17110 1 667 . 1 1 59 59 VAL HG13 H 1 0.956 0.05 . 2 . . . . 1646 Val HG13 . 17110 1 668 . 1 1 59 59 VAL HG21 H 1 1.157 0.05 . 2 . . . . 1646 Val HG21 . 17110 1 669 . 1 1 59 59 VAL HG22 H 1 1.157 0.05 . 2 . . . . 1646 Val HG22 . 17110 1 670 . 1 1 59 59 VAL HG23 H 1 1.157 0.05 . 2 . . . . 1646 Val HG23 . 17110 1 671 . 1 1 59 59 VAL C C 13 173.852 0.2 . 1 . . . . 1646 Val C . 17110 1 672 . 1 1 59 59 VAL CA C 13 61.613 0.2 . 1 . . . . 1646 Val CA . 17110 1 673 . 1 1 59 59 VAL CB C 13 35.335 0.2 . 1 . . . . 1646 Val CB . 17110 1 674 . 1 1 59 59 VAL CG1 C 13 22.374 0.2 . 2 . . . . 1646 Val CG1 . 17110 1 675 . 1 1 59 59 VAL CG2 C 13 22.184 0.2 . 2 . . . . 1646 Val CG2 . 17110 1 676 . 1 1 59 59 VAL N N 15 113.320 0.05 . 1 . . . . 1646 Val N . 17110 1 677 . 1 1 60 60 CYS H H 1 9.761 0.05 . 1 . . . . 1647 Cys H . 17110 1 678 . 1 1 60 60 CYS HA H 1 5.640 0.05 . 1 . . . . 1647 Cys HA . 17110 1 679 . 1 1 60 60 CYS HB2 H 1 3.050 0.05 . 2 . . . . 1647 Cys HB2 . 17110 1 680 . 1 1 60 60 CYS HB3 H 1 2.613 0.05 . 2 . . . . 1647 Cys HB3 . 17110 1 681 . 1 1 60 60 CYS C C 13 174.437 0.2 . 1 . . . . 1647 Cys C . 17110 1 682 . 1 1 60 60 CYS CA C 13 52.897 0.2 . 1 . . . . 1647 Cys CA . 17110 1 683 . 1 1 60 60 CYS CB C 13 42.887 0.2 . 1 . . . . 1647 Cys CB . 17110 1 684 . 1 1 60 60 CYS N N 15 126.968 0.05 . 1 . . . . 1647 Cys N . 17110 1 685 . 1 1 61 61 ILE H H 1 9.764 0.05 . 1 . . . . 1648 Ile H . 17110 1 686 . 1 1 61 61 ILE HA H 1 4.914 0.05 . 1 . . . . 1648 Ile HA . 17110 1 687 . 1 1 61 61 ILE HB H 1 1.684 0.05 . 1 . . . . 1648 Ile HB . 17110 1 688 . 1 1 61 61 ILE HD11 H 1 0.692 0.05 . 1 . . . . 1648 Ile HD11 . 17110 1 689 . 1 1 61 61 ILE HD12 H 1 0.692 0.05 . 1 . . . . 1648 Ile HD12 . 17110 1 690 . 1 1 61 61 ILE HD13 H 1 0.692 0.05 . 1 . . . . 1648 Ile HD13 . 17110 1 691 . 1 1 61 61 ILE HG12 H 1 1.586 0.05 . 1 . . . . 1648 Ile HG12 . 17110 1 692 . 1 1 61 61 ILE HG13 H 1 1.586 0.05 . 1 . . . . 1648 Ile HG13 . 17110 1 693 . 1 1 61 61 ILE HG21 H 1 0.543 0.05 . 1 . . . . 1648 Ile HG21 . 17110 1 694 . 1 1 61 61 ILE HG22 H 1 0.543 0.05 . 1 . . . . 1648 Ile HG22 . 17110 1 695 . 1 1 61 61 ILE HG23 H 1 0.543 0.05 . 1 . . . . 1648 Ile HG23 . 17110 1 696 . 1 1 61 61 ILE C C 13 175.454 0.2 . 1 . . . . 1648 Ile C . 17110 1 697 . 1 1 61 61 ILE CA C 13 61.017 0.2 . 1 . . . . 1648 Ile CA . 17110 1 698 . 1 1 61 61 ILE CB C 13 39.895 0.2 . 1 . . . . 1648 Ile CB . 17110 1 699 . 1 1 61 61 ILE CD1 C 13 12.711 0.2 . 1 . . . . 1648 Ile CD1 . 17110 1 700 . 1 1 61 61 ILE CG1 C 13 27.652 0.2 . 1 . . . . 1648 Ile CG1 . 17110 1 701 . 1 1 61 61 ILE CG2 C 13 16.236 0.2 . 1 . . . . 1648 Ile CG2 . 17110 1 702 . 1 1 61 61 ILE N N 15 131.033 0.05 . 1 . . . . 1648 Ile N . 17110 1 703 . 1 1 62 62 THR H H 1 9.655 0.05 . 1 . . . . 1649 Thr H . 17110 1 704 . 1 1 62 62 THR HA H 1 4.928 0.05 . 1 . . . . 1649 Thr HA . 17110 1 705 . 1 1 62 62 THR HB H 1 4.063 0.05 . 1 . . . . 1649 Thr HB . 17110 1 706 . 1 1 62 62 THR HG21 H 1 1.173 0.05 . 1 . . . . 1649 Thr HG21 . 17110 1 707 . 1 1 62 62 THR HG22 H 1 1.173 0.05 . 1 . . . . 1649 Thr HG22 . 17110 1 708 . 1 1 62 62 THR HG23 H 1 1.173 0.05 . 1 . . . . 1649 Thr HG23 . 17110 1 709 . 1 1 62 62 THR C C 13 173.122 0.2 . 1 . . . . 1649 Thr C . 17110 1 710 . 1 1 62 62 THR CA C 13 62.379 0.2 . 1 . . . . 1649 Thr CA . 17110 1 711 . 1 1 62 62 THR CB C 13 69.727 0.2 . 1 . . . . 1649 Thr CB . 17110 1 712 . 1 1 62 62 THR CG2 C 13 21.438 0.2 . 1 . . . . 1649 Thr CG2 . 17110 1 713 . 1 1 62 62 THR N N 15 125.739 0.05 . 1 . . . . 1649 Thr N . 17110 1 714 . 1 1 63 63 ASP H H 1 8.542 0.05 . 1 . . . . 1650 Asp H . 17110 1 715 . 1 1 63 63 ASP HA H 1 4.828 0.05 . 1 . . . . 1650 Asp HA . 17110 1 716 . 1 1 63 63 ASP HB2 H 1 2.787 0.05 . 2 . . . . 1650 Asp HB2 . 17110 1 717 . 1 1 63 63 ASP HB3 H 1 1.992 0.05 . 2 . . . . 1650 Asp HB3 . 17110 1 718 . 1 1 63 63 ASP C C 13 176.079 0.2 . 1 . . . . 1650 Asp C . 17110 1 719 . 1 1 63 63 ASP CA C 13 51.581 0.2 . 1 . . . . 1650 Asp CA . 17110 1 720 . 1 1 63 63 ASP CB C 13 41.999 0.2 . 1 . . . . 1650 Asp CB . 17110 1 721 . 1 1 63 63 ASP N N 15 126.613 0.05 . 1 . . . . 1650 Asp N . 17110 1 722 . 1 1 64 64 GLY H H 1 8.977 0.05 . 1 . . . . 1651 Gly H . 17110 1 723 . 1 1 64 64 GLY HA2 H 1 4.267 0.05 . 2 . . . . 1651 Gly HA2 . 17110 1 724 . 1 1 64 64 GLY HA3 H 1 3.578 0.05 . 2 . . . . 1651 Gly HA3 . 17110 1 725 . 1 1 64 64 GLY CA C 13 45.089 0.2 . 1 . . . . 1651 Gly CA . 17110 1 726 . 1 1 64 64 GLY N N 15 117.050 0.05 . 1 . . . . 1651 Gly N . 17110 1 727 . 1 1 65 65 PRO HA H 1 4.550 0.05 . 1 . . . . 1652 Pro HA . 17110 1 728 . 1 1 65 65 PRO HB2 H 1 2.220 0.05 . 2 . . . . 1652 Pro HB2 . 17110 1 729 . 1 1 65 65 PRO HB3 H 1 2.115 0.05 . 2 . . . . 1652 Pro HB3 . 17110 1 730 . 1 1 65 65 PRO HD2 H 1 4.021 0.05 . 2 . . . . 1652 Pro HD2 . 17110 1 731 . 1 1 65 65 PRO HD3 H 1 3.728 0.05 . 2 . . . . 1652 Pro HD3 . 17110 1 732 . 1 1 65 65 PRO HG2 H 1 2.067 0.05 . 2 . . . . 1652 Pro HG2 . 17110 1 733 . 1 1 65 65 PRO HG3 H 1 1.881 0.05 . 2 . . . . 1652 Pro HG3 . 17110 1 734 . 1 1 65 65 PRO C C 13 176.096 0.2 . 1 . . . . 1652 Pro C . 17110 1 735 . 1 1 65 65 PRO CA C 13 63.391 0.2 . 1 . . . . 1652 Pro CA . 17110 1 736 . 1 1 65 65 PRO CB C 13 32.135 0.2 . 1 . . . . 1652 Pro CB . 17110 1 737 . 1 1 65 65 PRO CD C 13 50.420 0.2 . 1 . . . . 1652 Pro CD . 17110 1 738 . 1 1 65 65 PRO CG C 13 26.140 0.2 . 1 . . . . 1652 Pro CG . 17110 1 739 . 1 1 66 66 LYS H H 1 7.580 0.05 . 1 . . . . 1653 Lys H . 17110 1 740 . 1 1 66 66 LYS HA H 1 4.525 0.05 . 1 . . . . 1653 Lys HA . 17110 1 741 . 1 1 66 66 LYS HB2 H 1 1.849 0.05 . 1 . . . . 1653 Lys HB2 . 17110 1 742 . 1 1 66 66 LYS HB3 H 1 1.849 0.05 . 1 . . . . 1653 Lys HB3 . 17110 1 743 . 1 1 66 66 LYS HD2 H 1 1.697 0.05 . 1 . . . . 1653 Lys HD2 . 17110 1 744 . 1 1 66 66 LYS HD3 H 1 1.697 0.05 . 1 . . . . 1653 Lys HD3 . 17110 1 745 . 1 1 66 66 LYS HE2 H 1 2.996 0.05 . 1 . . . . 1653 Lys HE2 . 17110 1 746 . 1 1 66 66 LYS HE3 H 1 2.996 0.05 . 1 . . . . 1653 Lys HE3 . 17110 1 747 . 1 1 66 66 LYS HG2 H 1 1.370 0.05 . 1 . . . . 1653 Lys HG2 . 17110 1 748 . 1 1 66 66 LYS HG3 H 1 1.370 0.05 . 1 . . . . 1653 Lys HG3 . 17110 1 749 . 1 1 66 66 LYS C C 13 175.311 0.2 . 1 . . . . 1653 Lys C . 17110 1 750 . 1 1 66 66 LYS CA C 13 55.847 0.2 . 1 . . . . 1653 Lys CA . 17110 1 751 . 1 1 66 66 LYS CB C 13 34.335 0.2 . 1 . . . . 1653 Lys CB . 17110 1 752 . 1 1 66 66 LYS CD C 13 28.863 0.2 . 1 . . . . 1653 Lys CD . 17110 1 753 . 1 1 66 66 LYS CG C 13 24.484 0.2 . 1 . . . . 1653 Lys CG . 17110 1 754 . 1 1 66 66 LYS N N 15 121.094 0.05 . 1 . . . . 1653 Lys N . 17110 1 755 . 1 1 67 67 THR H H 1 8.373 0.05 . 1 . . . . 1654 Thr H . 17110 1 756 . 1 1 67 67 THR HA H 1 4.816 0.05 . 1 . . . . 1654 Thr HA . 17110 1 757 . 1 1 67 67 THR HB H 1 4.007 0.05 . 1 . . . . 1654 Thr HB . 17110 1 758 . 1 1 67 67 THR HG21 H 1 1.072 0.05 . 1 . . . . 1654 Thr HG21 . 17110 1 759 . 1 1 67 67 THR HG22 H 1 1.072 0.05 . 1 . . . . 1654 Thr HG22 . 17110 1 760 . 1 1 67 67 THR HG23 H 1 1.072 0.05 . 1 . . . . 1654 Thr HG23 . 17110 1 761 . 1 1 67 67 THR C C 13 173.591 0.2 . 1 . . . . 1654 Thr C . 17110 1 762 . 1 1 67 67 THR CA C 13 60.814 0.2 . 1 . . . . 1654 Thr CA . 17110 1 763 . 1 1 67 67 THR CB C 13 70.894 0.2 . 1 . . . . 1654 Thr CB . 17110 1 764 . 1 1 67 67 THR CG2 C 13 21.942 0.2 . 1 . . . . 1654 Thr CG2 . 17110 1 765 . 1 1 67 67 THR N N 15 117.352 0.05 . 1 . . . . 1654 Thr N . 17110 1 766 . 1 1 68 68 LEU H H 1 8.997 0.05 . 1 . . . . 1655 Leu H . 17110 1 767 . 1 1 68 68 LEU HA H 1 4.501 0.05 . 1 . . . . 1655 Leu HA . 17110 1 768 . 1 1 68 68 LEU HB2 H 1 1.544 0.05 . 2 . . . . 1655 Leu HB2 . 17110 1 769 . 1 1 68 68 LEU HB3 H 1 1.280 0.05 . 2 . . . . 1655 Leu HB3 . 17110 1 770 . 1 1 68 68 LEU HD11 H 1 0.317 0.05 . 2 . . . . 1655 Leu HD11 . 17110 1 771 . 1 1 68 68 LEU HD12 H 1 0.317 0.05 . 2 . . . . 1655 Leu HD12 . 17110 1 772 . 1 1 68 68 LEU HD13 H 1 0.317 0.05 . 2 . . . . 1655 Leu HD13 . 17110 1 773 . 1 1 68 68 LEU HD21 H 1 0.469 0.05 . 2 . . . . 1655 Leu HD21 . 17110 1 774 . 1 1 68 68 LEU HD22 H 1 0.469 0.05 . 2 . . . . 1655 Leu HD22 . 17110 1 775 . 1 1 68 68 LEU HD23 H 1 0.469 0.05 . 2 . . . . 1655 Leu HD23 . 17110 1 776 . 1 1 68 68 LEU HG H 1 1.055 0.05 . 1 . . . . 1655 Leu HG . 17110 1 777 . 1 1 68 68 LEU C C 13 174.096 0.2 . 1 . . . . 1655 Leu C . 17110 1 778 . 1 1 68 68 LEU CA C 13 54.113 0.2 . 1 . . . . 1655 Leu CA . 17110 1 779 . 1 1 68 68 LEU CB C 13 45.821 0.2 . 1 . . . . 1655 Leu CB . 17110 1 780 . 1 1 68 68 LEU CD1 C 13 22.992 0.2 . 2 . . . . 1655 Leu CD1 . 17110 1 781 . 1 1 68 68 LEU CD2 C 13 24.812 0.2 . 2 . . . . 1655 Leu CD2 . 17110 1 782 . 1 1 68 68 LEU CG C 13 26.877 0.2 . 1 . . . . 1655 Leu CG . 17110 1 783 . 1 1 68 68 LEU N N 15 127.083 0.05 . 1 . . . . 1655 Leu N . 17110 1 784 . 1 1 69 69 ASN H H 1 8.464 0.05 . 1 . . . . 1656 Asn H . 17110 1 785 . 1 1 69 69 ASN HA H 1 4.822 0.05 . 1 . . . . 1656 Asn HA . 17110 1 786 . 1 1 69 69 ASN HB2 H 1 3.083 0.05 . 2 . . . . 1656 Asn HB2 . 17110 1 787 . 1 1 69 69 ASN HB3 H 1 2.582 0.05 . 2 . . . . 1656 Asn HB3 . 17110 1 788 . 1 1 69 69 ASN HD21 H 1 7.689 0.05 . 1 . . . . 1656 Asn HD21 . 17110 1 789 . 1 1 69 69 ASN HD22 H 1 7.689 0.05 . 1 . . . . 1656 Asn HD22 . 17110 1 790 . 1 1 69 69 ASN C C 13 173.867 0.2 . 1 . . . . 1656 Asn C . 17110 1 791 . 1 1 69 69 ASN CA C 13 52.537 0.2 . 1 . . . . 1656 Asn CA . 17110 1 792 . 1 1 69 69 ASN CB C 13 37.584 0.2 . 1 . . . . 1656 Asn CB . 17110 1 793 . 1 1 69 69 ASN N N 15 126.103 0.05 . 1 . . . . 1656 Asn N . 17110 1 794 . 1 1 69 69 ASN ND2 N 15 104.677 0.05 . 1 . . . . 1656 Asn ND2 . 17110 1 795 . 1 1 70 70 ALA H H 1 8.626 0.05 . 1 . . . . 1657 Ala H . 17110 1 796 . 1 1 70 70 ALA HA H 1 4.534 0.05 . 1 . . . . 1657 Ala HA . 17110 1 797 . 1 1 70 70 ALA HB1 H 1 1.295 0.05 . 1 . . . . 1657 Ala HB1 . 17110 1 798 . 1 1 70 70 ALA HB2 H 1 1.295 0.05 . 1 . . . . 1657 Ala HB2 . 17110 1 799 . 1 1 70 70 ALA HB3 H 1 1.295 0.05 . 1 . . . . 1657 Ala HB3 . 17110 1 800 . 1 1 70 70 ALA C C 13 178.180 0.2 . 1 . . . . 1657 Ala C . 17110 1 801 . 1 1 70 70 ALA CA C 13 50.536 0.2 . 1 . . . . 1657 Ala CA . 17110 1 802 . 1 1 70 70 ALA CB C 13 17.928 0.2 . 1 . . . . 1657 Ala CB . 17110 1 803 . 1 1 70 70 ALA N N 15 129.561 0.05 . 1 . . . . 1657 Ala N . 17110 1 804 . 1 1 71 71 GLY H H 1 8.438 0.05 . 1 . . . . 1658 Gly H . 17110 1 805 . 1 1 71 71 GLY HA2 H 1 3.780 0.05 . 2 . . . . 1658 Gly HA2 . 17110 1 806 . 1 1 71 71 GLY HA3 H 1 4.003 0.05 . 2 . . . . 1658 Gly HA3 . 17110 1 807 . 1 1 71 71 GLY C C 13 172.411 0.2 . 1 . . . . 1658 Gly C . 17110 1 808 . 1 1 71 71 GLY CA C 13 45.390 0.2 . 1 . . . . 1658 Gly CA . 17110 1 809 . 1 1 71 71 GLY N N 15 107.697 0.05 . 1 . . . . 1658 Gly N . 17110 1 810 . 1 1 72 72 LYS H H 1 8.831 0.05 . 1 . . . . 1659 Lys H . 17110 1 811 . 1 1 72 72 LYS HA H 1 4.501 0.05 . 1 . . . . 1659 Lys HA . 17110 1 812 . 1 1 72 72 LYS HB2 H 1 1.976 0.05 . 1 . . . . 1659 Lys HB2 . 17110 1 813 . 1 1 72 72 LYS HB3 H 1 1.976 0.05 . 1 . . . . 1659 Lys HB3 . 17110 1 814 . 1 1 72 72 LYS HE2 H 1 2.094 0.05 . 1 . . . . 1659 Lys HE2 . 17110 1 815 . 1 1 72 72 LYS HE3 H 1 2.094 0.05 . 1 . . . . 1659 Lys HE3 . 17110 1 816 . 1 1 72 72 LYS HG2 H 1 1.396 0.05 . 2 . . . . 1659 Lys HG2 . 17110 1 817 . 1 1 72 72 LYS HG3 H 1 1.664 0.05 . 2 . . . . 1659 Lys HG3 . 17110 1 818 . 1 1 72 72 LYS C C 13 175.672 0.2 . 1 . . . . 1659 Lys C . 17110 1 819 . 1 1 72 72 LYS CA C 13 56.477 0.2 . 1 . . . . 1659 Lys CA . 17110 1 820 . 1 1 72 72 LYS CB C 13 34.910 0.2 . 1 . . . . 1659 Lys CB . 17110 1 821 . 1 1 72 72 LYS CG C 13 26.342 0.2 . 1 . . . . 1659 Lys CG . 17110 1 822 . 1 1 72 72 LYS N N 15 124.636 0.05 . 1 . . . . 1659 Lys N . 17110 1 823 . 1 1 73 73 LEU H H 1 7.738 0.05 . 1 . . . . 1660 Leu H . 17110 1 824 . 1 1 73 73 LEU HA H 1 3.287 0.05 . 1 . . . . 1660 Leu HA . 17110 1 825 . 1 1 73 73 LEU HB2 H 1 1.481 0.05 . 2 . . . . 1660 Leu HB2 . 17110 1 826 . 1 1 73 73 LEU HB3 H 1 1.169 0.05 . 2 . . . . 1660 Leu HB3 . 17110 1 827 . 1 1 73 73 LEU HD11 H 1 0.635 0.05 . 2 . . . . 1660 Leu HD11 . 17110 1 828 . 1 1 73 73 LEU HD12 H 1 0.635 0.05 . 2 . . . . 1660 Leu HD12 . 17110 1 829 . 1 1 73 73 LEU HD13 H 1 0.635 0.05 . 2 . . . . 1660 Leu HD13 . 17110 1 830 . 1 1 73 73 LEU HD21 H 1 0.834 0.05 . 2 . . . . 1660 Leu HD21 . 17110 1 831 . 1 1 73 73 LEU HD22 H 1 0.834 0.05 . 2 . . . . 1660 Leu HD22 . 17110 1 832 . 1 1 73 73 LEU HD23 H 1 0.834 0.05 . 2 . . . . 1660 Leu HD23 . 17110 1 833 . 1 1 73 73 LEU C C 13 174.829 0.2 . 1 . . . . 1660 Leu C . 17110 1 834 . 1 1 73 73 LEU CA C 13 57.450 0.2 . 1 . . . . 1660 Leu CA . 17110 1 835 . 1 1 73 73 LEU CB C 13 42.929 0.2 . 1 . . . . 1660 Leu CB . 17110 1 836 . 1 1 73 73 LEU CD1 C 13 26.300 0.2 . 2 . . . . 1660 Leu CD1 . 17110 1 837 . 1 1 73 73 LEU CD2 C 13 24.880 0.2 . 2 . . . . 1660 Leu CD2 . 17110 1 838 . 1 1 73 73 LEU N N 15 116.192 0.05 . 1 . . . . 1660 Leu N . 17110 1 839 . 1 1 74 74 SER H H 1 6.923 0.05 . 1 . . . . 1661 Ser H . 17110 1 840 . 1 1 74 74 SER HA H 1 4.575 0.05 . 1 . . . . 1661 Ser HA . 17110 1 841 . 1 1 74 74 SER HB2 H 1 3.794 0.05 . 1 . . . . 1661 Ser HB2 . 17110 1 842 . 1 1 74 74 SER HB3 H 1 3.794 0.05 . 1 . . . . 1661 Ser HB3 . 17110 1 843 . 1 1 74 74 SER C C 13 173.255 0.2 . 1 . . . . 1661 Ser C . 17110 1 844 . 1 1 74 74 SER CA C 13 56.745 0.2 . 1 . . . . 1661 Ser CA . 17110 1 845 . 1 1 74 74 SER CB C 13 65.993 0.2 . 1 . . . . 1661 Ser CB . 17110 1 846 . 1 1 74 74 SER N N 15 115.163 0.05 . 1 . . . . 1661 Ser N . 17110 1 847 . 1 1 75 75 LYS H H 1 8.723 0.05 . 1 . . . . 1662 Lys H . 17110 1 848 . 1 1 75 75 LYS HA H 1 4.845 0.05 . 1 . . . . 1662 Lys HA . 17110 1 849 . 1 1 75 75 LYS HB2 H 1 1.646 0.05 . 2 . . . . 1662 Lys HB2 . 17110 1 850 . 1 1 75 75 LYS HB3 H 1 2.083 0.05 . 2 . . . . 1662 Lys HB3 . 17110 1 851 . 1 1 75 75 LYS HD2 H 1 1.582 0.05 . 1 . . . . 1662 Lys HD2 . 17110 1 852 . 1 1 75 75 LYS HD3 H 1 1.582 0.05 . 1 . . . . 1662 Lys HD3 . 17110 1 853 . 1 1 75 75 LYS HE2 H 1 2.905 0.05 . 1 . . . . 1662 Lys HE2 . 17110 1 854 . 1 1 75 75 LYS HE3 H 1 2.905 0.05 . 1 . . . . 1662 Lys HE3 . 17110 1 855 . 1 1 75 75 LYS HG2 H 1 1.226 0.05 . 2 . . . . 1662 Lys HG2 . 17110 1 856 . 1 1 75 75 LYS HG3 H 1 1.179 0.05 . 2 . . . . 1662 Lys HG3 . 17110 1 857 . 1 1 75 75 LYS C C 13 175.436 0.2 . 1 . . . . 1662 Lys C . 17110 1 858 . 1 1 75 75 LYS CA C 13 54.949 0.2 . 1 . . . . 1662 Lys CA . 17110 1 859 . 1 1 75 75 LYS CB C 13 32.864 0.2 . 1 . . . . 1662 Lys CB . 17110 1 860 . 1 1 75 75 LYS CD C 13 29.083 0.2 . 1 . . . . 1662 Lys CD . 17110 1 861 . 1 1 75 75 LYS CE C 13 42.150 0.2 . 1 . . . . 1662 Lys CE . 17110 1 862 . 1 1 75 75 LYS CG C 13 25.009 0.2 . 1 . . . . 1662 Lys CG . 17110 1 863 . 1 1 75 75 LYS N N 15 121.598 0.05 . 1 . . . . 1662 Lys N . 17110 1 864 . 1 1 76 76 THR H H 1 8.046 0.05 . 1 . . . . 1663 Thr H . 17110 1 865 . 1 1 76 76 THR HA H 1 4.510 0.05 . 1 . . . . 1663 Thr HA . 17110 1 866 . 1 1 76 76 THR HB H 1 4.046 0.05 . 1 . . . . 1663 Thr HB . 17110 1 867 . 1 1 76 76 THR HG21 H 1 1.228 0.05 . 1 . . . . 1663 Thr HG21 . 17110 1 868 . 1 1 76 76 THR HG22 H 1 1.228 0.05 . 1 . . . . 1663 Thr HG22 . 17110 1 869 . 1 1 76 76 THR HG23 H 1 1.228 0.05 . 1 . . . . 1663 Thr HG23 . 17110 1 870 . 1 1 76 76 THR C C 13 172.498 0.2 . 1 . . . . 1663 Thr C . 17110 1 871 . 1 1 76 76 THR CA C 13 62.370 0.2 . 1 . . . . 1663 Thr CA . 17110 1 872 . 1 1 76 76 THR CB C 13 69.897 0.2 . 1 . . . . 1663 Thr CB . 17110 1 873 . 1 1 76 76 THR N N 15 117.511 0.05 . 1 . . . . 1663 Thr N . 17110 1 874 . 1 1 77 77 LEU H H 1 8.888 0.05 . 1 . . . . 1664 Leu H . 17110 1 875 . 1 1 77 77 LEU HA H 1 5.037 0.05 . 1 . . . . 1664 Leu HA . 17110 1 876 . 1 1 77 77 LEU HB2 H 1 1.336 0.05 . 2 . . . . 1664 Leu HB2 . 17110 1 877 . 1 1 77 77 LEU HB3 H 1 1.196 0.05 . 2 . . . . 1664 Leu HB3 . 17110 1 878 . 1 1 77 77 LEU HD11 H 1 0.515 0.05 . 1 . . . . 1664 Leu HD11 . 17110 1 879 . 1 1 77 77 LEU HD12 H 1 0.515 0.05 . 1 . . . . 1664 Leu HD12 . 17110 1 880 . 1 1 77 77 LEU HD13 H 1 0.515 0.05 . 1 . . . . 1664 Leu HD13 . 17110 1 881 . 1 1 77 77 LEU HD21 H 1 0.515 0.05 . 1 . . . . 1664 Leu HD21 . 17110 1 882 . 1 1 77 77 LEU HD22 H 1 0.515 0.05 . 1 . . . . 1664 Leu HD22 . 17110 1 883 . 1 1 77 77 LEU HD23 H 1 0.515 0.05 . 1 . . . . 1664 Leu HD23 . 17110 1 884 . 1 1 77 77 LEU HG H 1 1.340 0.05 . 1 . . . . 1664 Leu HG . 17110 1 885 . 1 1 77 77 LEU C C 13 176.159 0.2 . 1 . . . . 1664 Leu C . 17110 1 886 . 1 1 77 77 LEU CA C 13 53.164 0.2 . 1 . . . . 1664 Leu CA . 17110 1 887 . 1 1 77 77 LEU CB C 13 45.249 0.2 . 1 . . . . 1664 Leu CB . 17110 1 888 . 1 1 77 77 LEU CD1 C 13 25.280 0.2 . 1 . . . . 1664 Leu CD1 . 17110 1 889 . 1 1 77 77 LEU CD2 C 13 25.280 0.2 . 1 . . . . 1664 Leu CD2 . 17110 1 890 . 1 1 77 77 LEU CG C 13 27.089 0.2 . 1 . . . . 1664 Leu CG . 17110 1 891 . 1 1 77 77 LEU N N 15 128.553 0.05 . 1 . . . . 1664 Leu N . 17110 1 892 . 1 1 78 78 THR H H 1 8.703 0.05 . 1 . . . . 1665 Thr H . 17110 1 893 . 1 1 78 78 THR HA H 1 4.754 0.05 . 1 . . . . 1665 Thr HA . 17110 1 894 . 1 1 78 78 THR HB H 1 4.091 0.05 . 1 . . . . 1665 Thr HB . 17110 1 895 . 1 1 78 78 THR HG21 H 1 1.183 0.05 . 1 . . . . 1665 Thr HG21 . 17110 1 896 . 1 1 78 78 THR HG22 H 1 1.183 0.05 . 1 . . . . 1665 Thr HG22 . 17110 1 897 . 1 1 78 78 THR HG23 H 1 1.183 0.05 . 1 . . . . 1665 Thr HG23 . 17110 1 898 . 1 1 78 78 THR C C 13 172.700 0.2 . 1 . . . . 1665 Thr C . 17110 1 899 . 1 1 78 78 THR CA C 13 60.615 0.2 . 1 . . . . 1665 Thr CA . 17110 1 900 . 1 1 78 78 THR CB C 13 71.553 0.2 . 1 . . . . 1665 Thr CB . 17110 1 901 . 1 1 78 78 THR CG2 C 13 21.873 0.2 . 1 . . . . 1665 Thr CG2 . 17110 1 902 . 1 1 78 78 THR N N 15 113.346 0.05 . 1 . . . . 1665 Thr N . 17110 1 903 . 1 1 79 79 TYR H H 1 8.866 0.05 . 1 . . . . 1666 Tyr H . 17110 1 904 . 1 1 79 79 TYR HA H 1 4.910 0.05 . 1 . . . . 1666 Tyr HA . 17110 1 905 . 1 1 79 79 TYR HB2 H 1 3.060 0.05 . 2 . . . . 1666 Tyr HB2 . 17110 1 906 . 1 1 79 79 TYR HB3 H 1 2.574 0.05 . 2 . . . . 1666 Tyr HB3 . 17110 1 907 . 1 1 79 79 TYR HD1 H 1 6.807 0.05 . 3 . . . . 1666 Tyr HD1 . 17110 1 908 . 1 1 79 79 TYR HD2 H 1 6.807 0.05 . 3 . . . . 1666 Tyr HD2 . 17110 1 909 . 1 1 79 79 TYR HE1 H 1 6.760 0.05 . 3 . . . . 1666 Tyr HE1 . 17110 1 910 . 1 1 79 79 TYR HE2 H 1 6.760 0.05 . 3 . . . . 1666 Tyr HE2 . 17110 1 911 . 1 1 79 79 TYR C C 13 174.623 0.2 . 1 . . . . 1666 Tyr C . 17110 1 912 . 1 1 79 79 TYR CA C 13 57.393 0.2 . 1 . . . . 1666 Tyr CA . 17110 1 913 . 1 1 79 79 TYR CB C 13 40.425 0.2 . 1 . . . . 1666 Tyr CB . 17110 1 914 . 1 1 79 79 TYR CD1 C 13 133.463 0.2 . 3 . . . . 1666 Tyr CD1 . 17110 1 915 . 1 1 79 79 TYR CD2 C 13 133.463 0.2 . 3 . . . . 1666 Tyr CD2 . 17110 1 916 . 1 1 79 79 TYR CE1 C 13 118.141 0.2 . 3 . . . . 1666 Tyr CE1 . 17110 1 917 . 1 1 79 79 TYR CE2 C 13 118.141 0.2 . 3 . . . . 1666 Tyr CE2 . 17110 1 918 . 1 1 79 79 TYR N N 15 123.895 0.05 . 1 . . . . 1666 Tyr N . 17110 1 919 . 1 1 80 80 GLU H H 1 8.409 0.05 . 1 . . . . 1667 Glu H . 17110 1 920 . 1 1 80 80 GLU HA H 1 4.337 0.05 . 1 . . . . 1667 Glu HA . 17110 1 921 . 1 1 80 80 GLU HB2 H 1 1.820 0.05 . 2 . . . . 1667 Glu HB2 . 17110 1 922 . 1 1 80 80 GLU HB3 H 1 1.728 0.05 . 2 . . . . 1667 Glu HB3 . 17110 1 923 . 1 1 80 80 GLU HG2 H 1 2.081 0.05 . 1 . . . . 1667 Glu HG2 . 17110 1 924 . 1 1 80 80 GLU HG3 H 1 2.081 0.05 . 1 . . . . 1667 Glu HG3 . 17110 1 925 . 1 1 80 80 GLU C C 13 174.959 0.2 . 1 . . . . 1667 Glu C . 17110 1 926 . 1 1 80 80 GLU CA C 13 55.138 0.2 . 1 . . . . 1667 Glu CA . 17110 1 927 . 1 1 80 80 GLU CB C 13 32.310 0.2 . 1 . . . . 1667 Glu CB . 17110 1 928 . 1 1 80 80 GLU CG C 13 35.332 0.2 . 1 . . . . 1667 Glu CG . 17110 1 929 . 1 1 80 80 GLU N N 15 127.001 0.05 . 1 . . . . 1667 Glu N . 17110 1 930 . 1 1 81 81 ASP H H 1 9.080 0.05 . 1 . . . . 1668 Asp H . 17110 1 931 . 1 1 81 81 ASP HA H 1 4.226 0.05 . 1 . . . . 1668 Asp HA . 17110 1 932 . 1 1 81 81 ASP HB2 H 1 2.823 0.05 . 2 . . . . 1668 Asp HB2 . 17110 1 933 . 1 1 81 81 ASP HB3 H 1 2.466 0.05 . 2 . . . . 1668 Asp HB3 . 17110 1 934 . 1 1 81 81 ASP C C 13 174.270 0.2 . 1 . . . . 1668 Asp C . 17110 1 935 . 1 1 81 81 ASP CA C 13 55.515 0.2 . 1 . . . . 1668 Asp CA . 17110 1 936 . 1 1 81 81 ASP CB C 13 39.512 0.2 . 1 . . . . 1668 Asp CB . 17110 1 937 . 1 1 81 81 ASP N N 15 124.444 0.05 . 1 . . . . 1668 Asp N . 17110 1 938 . 1 1 82 82 GLN H H 1 6.831 0.05 . 1 . . . . 1669 Gln H . 17110 1 939 . 1 1 82 82 GLN HA H 1 3.563 0.05 . 1 . . . . 1669 Gln HA . 17110 1 940 . 1 1 82 82 GLN HB2 H 1 2.495 0.05 . 2 . . . . 1669 Gln HB2 . 17110 1 941 . 1 1 82 82 GLN HB3 H 1 2.370 0.05 . 2 . . . . 1669 Gln HB3 . 17110 1 942 . 1 1 82 82 GLN HE21 H 1 7.621 0.05 . 1 . . . . 1669 Gln HE21 . 17110 1 943 . 1 1 82 82 GLN HE22 H 1 6.881 0.05 . 1 . . . . 1669 Gln HE22 . 17110 1 944 . 1 1 82 82 GLN HG2 H 1 2.385 0.05 . 2 . . . . 1669 Gln HG2 . 17110 1 945 . 1 1 82 82 GLN HG3 H 1 2.296 0.05 . 2 . . . . 1669 Gln HG3 . 17110 1 946 . 1 1 82 82 GLN C C 13 174.134 0.2 . 1 . . . . 1669 Gln C . 17110 1 947 . 1 1 82 82 GLN CA C 13 58.150 0.2 . 1 . . . . 1669 Gln CA . 17110 1 948 . 1 1 82 82 GLN CB C 13 27.407 0.2 . 1 . . . . 1669 Gln CB . 17110 1 949 . 1 1 82 82 GLN CG C 13 34.612 0.2 . 1 . . . . 1669 Gln CG . 17110 1 950 . 1 1 82 82 GLN N N 15 103.877 0.05 . 1 . . . . 1669 Gln N . 17110 1 951 . 1 1 82 82 GLN NE2 N 15 111.682 0.05 . 1 . . . . 1669 Gln NE2 . 17110 1 952 . 1 1 83 83 VAL H H 1 7.515 0.05 . 1 . . . . 1670 Val H . 17110 1 953 . 1 1 83 83 VAL HA H 1 4.427 0.05 . 1 . . . . 1670 Val HA . 17110 1 954 . 1 1 83 83 VAL HB H 1 1.999 0.05 . 1 . . . . 1670 Val HB . 17110 1 955 . 1 1 83 83 VAL HG11 H 1 0.858 0.05 . 1 . . . . 1670 Val HG11 . 17110 1 956 . 1 1 83 83 VAL HG12 H 1 0.858 0.05 . 1 . . . . 1670 Val HG12 . 17110 1 957 . 1 1 83 83 VAL HG13 H 1 0.858 0.05 . 1 . . . . 1670 Val HG13 . 17110 1 958 . 1 1 83 83 VAL HG21 H 1 0.858 0.05 . 1 . . . . 1670 Val HG21 . 17110 1 959 . 1 1 83 83 VAL HG22 H 1 0.858 0.05 . 1 . . . . 1670 Val HG22 . 17110 1 960 . 1 1 83 83 VAL HG23 H 1 0.858 0.05 . 1 . . . . 1670 Val HG23 . 17110 1 961 . 1 1 83 83 VAL C C 13 173.819 0.2 . 1 . . . . 1670 Val C . 17110 1 962 . 1 1 83 83 VAL CA C 13 60.873 0.2 . 1 . . . . 1670 Val CA . 17110 1 963 . 1 1 83 83 VAL CB C 13 34.616 0.2 . 1 . . . . 1670 Val CB . 17110 1 964 . 1 1 83 83 VAL CG1 C 13 21.539 0.2 . 1 . . . . 1670 Val CG1 . 17110 1 965 . 1 1 83 83 VAL CG2 C 13 21.539 0.2 . 1 . . . . 1670 Val CG2 . 17110 1 966 . 1 1 83 83 VAL N N 15 119.987 0.05 . 1 . . . . 1670 Val N . 17110 1 967 . 1 1 84 84 LEU H H 1 8.293 0.05 . 1 . . . . 1671 Leu H . 17110 1 968 . 1 1 84 84 LEU HA H 1 5.239 0.05 . 1 . . . . 1671 Leu HA . 17110 1 969 . 1 1 84 84 LEU HB2 H 1 1.723 0.05 . 2 . . . . 1671 Leu HB2 . 17110 1 970 . 1 1 84 84 LEU HB3 H 1 1.310 0.05 . 2 . . . . 1671 Leu HB3 . 17110 1 971 . 1 1 84 84 LEU HD11 H 1 0.168 0.05 . 2 . . . . 1671 Leu HD11 . 17110 1 972 . 1 1 84 84 LEU HD12 H 1 0.168 0.05 . 2 . . . . 1671 Leu HD12 . 17110 1 973 . 1 1 84 84 LEU HD13 H 1 0.168 0.05 . 2 . . . . 1671 Leu HD13 . 17110 1 974 . 1 1 84 84 LEU HD21 H 1 0.430 0.05 . 2 . . . . 1671 Leu HD21 . 17110 1 975 . 1 1 84 84 LEU HD22 H 1 0.430 0.05 . 2 . . . . 1671 Leu HD22 . 17110 1 976 . 1 1 84 84 LEU HD23 H 1 0.430 0.05 . 2 . . . . 1671 Leu HD23 . 17110 1 977 . 1 1 84 84 LEU HG H 1 1.324 0.05 . 1 . . . . 1671 Leu HG . 17110 1 978 . 1 1 84 84 LEU C C 13 175.932 0.2 . 1 . . . . 1671 Leu C . 17110 1 979 . 1 1 84 84 LEU CA C 13 52.590 0.2 . 1 . . . . 1671 Leu CA . 17110 1 980 . 1 1 84 84 LEU CB C 13 42.662 0.2 . 1 . . . . 1671 Leu CB . 17110 1 981 . 1 1 84 84 LEU CD1 C 13 23.662 0.2 . 2 . . . . 1671 Leu CD1 . 17110 1 982 . 1 1 84 84 LEU CD2 C 13 26.772 0.2 . 2 . . . . 1671 Leu CD2 . 17110 1 983 . 1 1 84 84 LEU CG C 13 26.985 0.2 . 1 . . . . 1671 Leu CG . 17110 1 984 . 1 1 84 84 LEU N N 15 122.965 0.05 . 1 . . . . 1671 Leu N . 17110 1 985 . 1 1 85 85 LYS H H 1 9.055 0.05 . 1 . . . . 1672 Lys H . 17110 1 986 . 1 1 85 85 LYS HA H 1 5.630 0.05 . 1 . . . . 1672 Lys HA . 17110 1 987 . 1 1 85 85 LYS HB2 H 1 1.599 0.05 . 1 . . . . 1672 Lys HB2 . 17110 1 988 . 1 1 85 85 LYS HB3 H 1 1.599 0.05 . 1 . . . . 1672 Lys HB3 . 17110 1 989 . 1 1 85 85 LYS HD2 H 1 1.482 0.05 . 1 . . . . 1672 Lys HD2 . 17110 1 990 . 1 1 85 85 LYS HD3 H 1 1.482 0.05 . 1 . . . . 1672 Lys HD3 . 17110 1 991 . 1 1 85 85 LYS HE2 H 1 2.716 0.05 . 2 . . . . 1672 Lys HE2 . 17110 1 992 . 1 1 85 85 LYS HE3 H 1 2.781 0.05 . 2 . . . . 1672 Lys HE3 . 17110 1 993 . 1 1 85 85 LYS HG2 H 1 1.251 0.05 . 2 . . . . 1672 Lys HG2 . 17110 1 994 . 1 1 85 85 LYS HG3 H 1 1.241 0.05 . 2 . . . . 1672 Lys HG3 . 17110 1 995 . 1 1 85 85 LYS C C 13 174.884 0.2 . 1 . . . . 1672 Lys C . 17110 1 996 . 1 1 85 85 LYS CA C 13 54.633 0.2 . 1 . . . . 1672 Lys CA . 17110 1 997 . 1 1 85 85 LYS CB C 13 36.023 0.2 . 1 . . . . 1672 Lys CB . 17110 1 998 . 1 1 85 85 LYS CD C 13 29.500 0.2 . 1 . . . . 1672 Lys CD . 17110 1 999 . 1 1 85 85 LYS CE C 13 42.041 0.2 . 1 . . . . 1672 Lys CE . 17110 1 1000 . 1 1 85 85 LYS CG C 13 25.078 0.2 . 1 . . . . 1672 Lys CG . 17110 1 1001 . 1 1 85 85 LYS N N 15 122.173 0.05 . 1 . . . . 1672 Lys N . 17110 1 1002 . 1 1 86 86 LEU H H 1 8.490 0.05 . 1 . . . . 1673 Leu H . 17110 1 1003 . 1 1 86 86 LEU HA H 1 4.655 0.05 . 1 . . . . 1673 Leu HA . 17110 1 1004 . 1 1 86 86 LEU HB2 H 1 1.616 0.05 . 2 . . . . 1673 Leu HB2 . 17110 1 1005 . 1 1 86 86 LEU HB3 H 1 1.301 0.05 . 2 . . . . 1673 Leu HB3 . 17110 1 1006 . 1 1 86 86 LEU HD11 H 1 0.516 0.05 . 2 . . . . 1673 Leu HD11 . 17110 1 1007 . 1 1 86 86 LEU HD12 H 1 0.516 0.05 . 2 . . . . 1673 Leu HD12 . 17110 1 1008 . 1 1 86 86 LEU HD13 H 1 0.516 0.05 . 2 . . . . 1673 Leu HD13 . 17110 1 1009 . 1 1 86 86 LEU HD21 H 1 0.637 0.05 . 2 . . . . 1673 Leu HD21 . 17110 1 1010 . 1 1 86 86 LEU HD22 H 1 0.637 0.05 . 2 . . . . 1673 Leu HD22 . 17110 1 1011 . 1 1 86 86 LEU HD23 H 1 0.637 0.05 . 2 . . . . 1673 Leu HD23 . 17110 1 1012 . 1 1 86 86 LEU HG H 1 0.857 0.05 . 1 . . . . 1673 Leu HG . 17110 1 1013 . 1 1 86 86 LEU C C 13 173.718 0.2 . 1 . . . . 1673 Leu C . 17110 1 1014 . 1 1 86 86 LEU CA C 13 54.008 0.2 . 1 . . . . 1673 Leu CA . 17110 1 1015 . 1 1 86 86 LEU CB C 13 48.104 0.2 . 1 . . . . 1673 Leu CB . 17110 1 1016 . 1 1 86 86 LEU CD1 C 13 25.457 0.2 . 2 . . . . 1673 Leu CD1 . 17110 1 1017 . 1 1 86 86 LEU CD2 C 13 26.491 0.2 . 2 . . . . 1673 Leu CD2 . 17110 1 1018 . 1 1 86 86 LEU CG C 13 23.714 0.2 . 1 . . . . 1673 Leu CG . 17110 1 1019 . 1 1 86 86 LEU N N 15 124.779 0.05 . 1 . . . . 1673 Leu N . 17110 1 1020 . 1 1 87 87 VAL H H 1 8.759 0.05 . 1 . . . . 1674 Val H . 17110 1 1021 . 1 1 87 87 VAL HA H 1 4.836 0.05 . 1 . . . . 1674 Val HA . 17110 1 1022 . 1 1 87 87 VAL HB H 1 1.813 0.05 . 1 . . . . 1674 Val HB . 17110 1 1023 . 1 1 87 87 VAL HG11 H 1 0.489 0.05 . 2 . . . . 1674 Val HG11 . 17110 1 1024 . 1 1 87 87 VAL HG12 H 1 0.489 0.05 . 2 . . . . 1674 Val HG12 . 17110 1 1025 . 1 1 87 87 VAL HG13 H 1 0.489 0.05 . 2 . . . . 1674 Val HG13 . 17110 1 1026 . 1 1 87 87 VAL HG21 H 1 0.767 0.05 . 2 . . . . 1674 Val HG21 . 17110 1 1027 . 1 1 87 87 VAL HG22 H 1 0.767 0.05 . 2 . . . . 1674 Val HG22 . 17110 1 1028 . 1 1 87 87 VAL HG23 H 1 0.767 0.05 . 2 . . . . 1674 Val HG23 . 17110 1 1029 . 1 1 87 87 VAL C C 13 174.589 0.2 . 1 . . . . 1674 Val C . 17110 1 1030 . 1 1 87 87 VAL CA C 13 60.497 0.2 . 1 . . . . 1674 Val CA . 17110 1 1031 . 1 1 87 87 VAL CB C 13 34.325 0.2 . 1 . . . . 1674 Val CB . 17110 1 1032 . 1 1 87 87 VAL CG1 C 13 20.892 0.2 . 2 . . . . 1674 Val CG1 . 17110 1 1033 . 1 1 87 87 VAL CG2 C 13 20.740 0.2 . 2 . . . . 1674 Val CG2 . 17110 1 1034 . 1 1 87 87 VAL N N 15 124.743 0.05 . 1 . . . . 1674 Val N . 17110 1 1035 . 1 1 88 88 TYR H H 1 9.214 0.05 . 1 . . . . 1675 Tyr H . 17110 1 1036 . 1 1 88 88 TYR HA H 1 5.382 0.05 . 1 . . . . 1675 Tyr HA . 17110 1 1037 . 1 1 88 88 TYR HB2 H 1 3.263 0.05 . 2 . . . . 1675 Tyr HB2 . 17110 1 1038 . 1 1 88 88 TYR HB3 H 1 2.966 0.05 . 2 . . . . 1675 Tyr HB3 . 17110 1 1039 . 1 1 88 88 TYR HD1 H 1 7.126 0.05 . 3 . . . . 1675 Tyr HD1 . 17110 1 1040 . 1 1 88 88 TYR HD2 H 1 7.126 0.05 . 3 . . . . 1675 Tyr HD2 . 17110 1 1041 . 1 1 88 88 TYR HE1 H 1 6.607 0.05 . 3 . . . . 1675 Tyr HE1 . 17110 1 1042 . 1 1 88 88 TYR HE2 H 1 6.607 0.05 . 3 . . . . 1675 Tyr HE2 . 17110 1 1043 . 1 1 88 88 TYR HH H 1 9.229 0.05 . 1 . . . . 1675 Tyr HH . 17110 1 1044 . 1 1 88 88 TYR C C 13 175.742 0.2 . 1 . . . . 1675 Tyr C . 17110 1 1045 . 1 1 88 88 TYR CA C 13 53.916 0.2 . 1 . . . . 1675 Tyr CA . 17110 1 1046 . 1 1 88 88 TYR CB C 13 39.116 0.2 . 1 . . . . 1675 Tyr CB . 17110 1 1047 . 1 1 88 88 TYR CD1 C 13 132.553 0.2 . 3 . . . . 1675 Tyr CD1 . 17110 1 1048 . 1 1 88 88 TYR CD2 C 13 132.553 0.2 . 3 . . . . 1675 Tyr CD2 . 17110 1 1049 . 1 1 88 88 TYR CE1 C 13 118.530 0.2 . 3 . . . . 1675 Tyr CE1 . 17110 1 1050 . 1 1 88 88 TYR CE2 C 13 118.530 0.2 . 3 . . . . 1675 Tyr CE2 . 17110 1 1051 . 1 1 88 88 TYR N N 15 127.672 0.05 . 1 . . . . 1675 Tyr N . 17110 1 1052 . 1 1 89 89 GLU H H 1 9.119 0.05 . 1 . . . . 1676 Glu H . 17110 1 1053 . 1 1 89 89 GLU HA H 1 5.148 0.05 . 1 . . . . 1676 Glu HA . 17110 1 1054 . 1 1 89 89 GLU HB2 H 1 2.177 0.05 . 2 . . . . 1676 Glu HB2 . 17110 1 1055 . 1 1 89 89 GLU HB3 H 1 2.123 0.05 . 2 . . . . 1676 Glu HB3 . 17110 1 1056 . 1 1 89 89 GLU HG2 H 1 2.295 0.05 . 2 . . . . 1676 Glu HG2 . 17110 1 1057 . 1 1 89 89 GLU HG3 H 1 2.219 0.05 . 2 . . . . 1676 Glu HG3 . 17110 1 1058 . 1 1 89 89 GLU C C 13 175.943 0.2 . 1 . . . . 1676 Glu C . 17110 1 1059 . 1 1 89 89 GLU CA C 13 54.989 0.2 . 1 . . . . 1676 Glu CA . 17110 1 1060 . 1 1 89 89 GLU CB C 13 33.750 0.2 . 1 . . . . 1676 Glu CB . 17110 1 1061 . 1 1 89 89 GLU CG C 13 36.481 0.2 . 1 . . . . 1676 Glu CG . 17110 1 1062 . 1 1 89 89 GLU N N 15 121.597 0.05 . 1 . . . . 1676 Glu N . 17110 1 1063 . 1 1 90 90 ASP H H 1 9.219 0.05 . 1 . . . . 1677 Asp H . 17110 1 1064 . 1 1 90 90 ASP HA H 1 4.228 0.05 . 1 . . . . 1677 Asp HA . 17110 1 1065 . 1 1 90 90 ASP HB2 H 1 3.080 0.05 . 2 . . . . 1677 Asp HB2 . 17110 1 1066 . 1 1 90 90 ASP HB3 H 1 2.720 0.05 . 2 . . . . 1677 Asp HB3 . 17110 1 1067 . 1 1 90 90 ASP C C 13 175.326 0.2 . 1 . . . . 1677 Asp C . 17110 1 1068 . 1 1 90 90 ASP CA C 13 56.318 0.2 . 1 . . . . 1677 Asp CA . 17110 1 1069 . 1 1 90 90 ASP CB C 13 39.412 0.2 . 1 . . . . 1677 Asp CB . 17110 1 1070 . 1 1 90 90 ASP N N 15 114.581 0.05 . 1 . . . . 1677 Asp N . 17110 1 1071 . 1 1 91 91 GLY H H 1 8.517 0.05 . 1 . . . . 1678 Gly H . 17110 1 1072 . 1 1 91 91 GLY HA2 H 1 4.072 0.05 . 2 . . . . 1678 Gly HA2 . 17110 1 1073 . 1 1 91 91 GLY HA3 H 1 3.460 0.05 . 2 . . . . 1678 Gly HA3 . 17110 1 1074 . 1 1 91 91 GLY C C 13 172.749 0.2 . 1 . . . . 1678 Gly C . 17110 1 1075 . 1 1 91 91 GLY CA C 13 43.700 0.2 . 1 . . . . 1678 Gly CA . 17110 1 1076 . 1 1 91 91 GLY N N 15 102.277 0.05 . 1 . . . . 1678 Gly N . 17110 1 1077 . 1 1 92 92 ASP H H 1 8.742 0.05 . 1 . . . . 1679 Asp H . 17110 1 1078 . 1 1 92 92 ASP HA H 1 4.919 0.05 . 1 . . . . 1679 Asp HA . 17110 1 1079 . 1 1 92 92 ASP HB2 H 1 2.372 0.05 . 2 . . . . 1679 Asp HB2 . 17110 1 1080 . 1 1 92 92 ASP HB3 H 1 2.821 0.05 . 2 . . . . 1679 Asp HB3 . 17110 1 1081 . 1 1 92 92 ASP CA C 13 54.471 0.2 . 1 . . . . 1679 Asp CA . 17110 1 1082 . 1 1 92 92 ASP CB C 13 39.441 0.2 . 1 . . . . 1679 Asp CB . 17110 1 1083 . 1 1 92 92 ASP N N 15 118.452 0.05 . 1 . . . . 1679 Asp N . 17110 1 1084 . 1 1 93 93 PRO HA H 1 4.614 0.05 . 1 . . . . 1680 Pro HA . 17110 1 1085 . 1 1 93 93 PRO HD2 H 1 3.672 0.05 . 2 . . . . 1680 Pro HD2 . 17110 1 1086 . 1 1 93 93 PRO HD3 H 1 4.120 0.05 . 2 . . . . 1680 Pro HD3 . 17110 1 1087 . 1 1 93 93 PRO HG2 H 1 2.243 0.05 . 1 . . . . 1680 Pro HG2 . 17110 1 1088 . 1 1 93 93 PRO HG3 H 1 2.243 0.05 . 1 . . . . 1680 Pro HG3 . 17110 1 1089 . 1 1 93 93 PRO C C 13 175.788 0.2 . 1 . . . . 1680 Pro C . 17110 1 1090 . 1 1 93 93 PRO CA C 13 64.068 0.2 . 1 . . . . 1680 Pro CA . 17110 1 1091 . 1 1 93 93 PRO CB C 13 32.191 0.2 . 1 . . . . 1680 Pro CB . 17110 1 1092 . 1 1 93 93 PRO CD C 13 50.603 0.2 . 1 . . . . 1680 Pro CD . 17110 1 1093 . 1 1 93 93 PRO CG C 13 28.186 0.2 . 1 . . . . 1680 Pro CG . 17110 1 1094 . 1 1 94 94 CYS H H 1 8.457 0.05 . 1 . . . . 1681 Cys H . 17110 1 1095 . 1 1 94 94 CYS HA H 1 5.168 0.05 . 1 . . . . 1681 Cys HA . 17110 1 1096 . 1 1 94 94 CYS HB2 H 1 3.263 0.05 . 2 . . . . 1681 Cys HB2 . 17110 1 1097 . 1 1 94 94 CYS HB3 H 1 2.275 0.05 . 2 . . . . 1681 Cys HB3 . 17110 1 1098 . 1 1 94 94 CYS CA C 13 51.708 0.2 . 1 . . . . 1681 Cys CA . 17110 1 1099 . 1 1 94 94 CYS CB C 13 39.443 0.2 . 1 . . . . 1681 Cys CB . 17110 1 1100 . 1 1 94 94 CYS N N 15 122.803 0.05 . 1 . . . . 1681 Cys N . 17110 1 1101 . 1 1 95 95 PRO HA H 1 4.262 0.05 . 1 . . . . 1682 Pro HA . 17110 1 1102 . 1 1 95 95 PRO HB2 H 1 2.388 0.05 . 2 . . . . 1682 Pro HB2 . 17110 1 1103 . 1 1 95 95 PRO HB3 H 1 2.043 0.05 . 2 . . . . 1682 Pro HB3 . 17110 1 1104 . 1 1 95 95 PRO HD2 H 1 4.380 0.05 . 2 . . . . 1682 Pro HD2 . 17110 1 1105 . 1 1 95 95 PRO HD3 H 1 4.077 0.05 . 2 . . . . 1682 Pro HD3 . 17110 1 1106 . 1 1 95 95 PRO HG2 H 1 2.143 0.05 . 2 . . . . 1682 Pro HG2 . 17110 1 1107 . 1 1 95 95 PRO HG3 H 1 2.236 0.05 . 2 . . . . 1682 Pro HG3 . 17110 1 1108 . 1 1 95 95 PRO C C 13 177.406 0.2 . 1 . . . . 1682 Pro C . 17110 1 1109 . 1 1 95 95 PRO CA C 13 65.341 0.2 . 1 . . . . 1682 Pro CA . 17110 1 1110 . 1 1 95 95 PRO CB C 13 31.755 0.2 . 1 . . . . 1682 Pro CB . 17110 1 1111 . 1 1 95 95 PRO CD C 13 50.972 0.2 . 1 . . . . 1682 Pro CD . 17110 1 1112 . 1 1 95 95 PRO CG C 13 27.872 0.2 . 1 . . . . 1682 Pro CG . 17110 1 1113 . 1 1 96 96 THR H H 1 7.086 0.05 . 1 . . . . 1683 Thr H . 17110 1 1114 . 1 1 96 96 THR HA H 1 3.974 0.05 . 1 . . . . 1683 Thr HA . 17110 1 1115 . 1 1 96 96 THR HB H 1 4.088 0.05 . 1 . . . . 1683 Thr HB . 17110 1 1116 . 1 1 96 96 THR HG21 H 1 1.266 0.05 . 1 . . . . 1683 Thr HG21 . 17110 1 1117 . 1 1 96 96 THR HG22 H 1 1.266 0.05 . 1 . . . . 1683 Thr HG22 . 17110 1 1118 . 1 1 96 96 THR HG23 H 1 1.266 0.05 . 1 . . . . 1683 Thr HG23 . 17110 1 1119 . 1 1 96 96 THR C C 13 174.503 0.2 . 1 . . . . 1683 Thr C . 17110 1 1120 . 1 1 96 96 THR CA C 13 63.485 0.2 . 1 . . . . 1683 Thr CA . 17110 1 1121 . 1 1 96 96 THR CB C 13 68.938 0.2 . 1 . . . . 1683 Thr CB . 17110 1 1122 . 1 1 96 96 THR CG2 C 13 22.928 0.2 . 1 . . . . 1683 Thr CG2 . 17110 1 1123 . 1 1 96 96 THR N N 15 108.180 0.05 . 1 . . . . 1683 Thr N . 17110 1 1124 . 1 1 97 97 ASP H H 1 7.060 0.05 . 1 . . . . 1684 Asp H . 17110 1 1125 . 1 1 97 97 ASP HA H 1 4.468 0.05 . 1 . . . . 1684 Asp HA . 17110 1 1126 . 1 1 97 97 ASP HB2 H 1 2.686 0.05 . 2 . . . . 1684 Asp HB2 . 17110 1 1127 . 1 1 97 97 ASP HB3 H 1 2.578 0.05 . 2 . . . . 1684 Asp HB3 . 17110 1 1128 . 1 1 97 97 ASP C C 13 175.465 0.2 . 1 . . . . 1684 Asp C . 17110 1 1129 . 1 1 97 97 ASP CA C 13 54.399 0.2 . 1 . . . . 1684 Asp CA . 17110 1 1130 . 1 1 97 97 ASP CB C 13 41.295 0.2 . 1 . . . . 1684 Asp CB . 17110 1 1131 . 1 1 97 97 ASP N N 15 117.566 0.05 . 1 . . . . 1684 Asp N . 17110 1 1132 . 1 1 98 98 LEU H H 1 8.432 0.05 . 1 . . . . 1685 Leu H . 17110 1 1133 . 1 1 98 98 LEU HA H 1 4.365 0.05 . 1 . . . . 1685 Leu HA . 17110 1 1134 . 1 1 98 98 LEU HB2 H 1 1.764 0.05 . 2 . . . . 1685 Leu HB2 . 17110 1 1135 . 1 1 98 98 LEU HB3 H 1 1.712 0.05 . 2 . . . . 1685 Leu HB3 . 17110 1 1136 . 1 1 98 98 LEU HD11 H 1 0.876 0.05 . 2 . . . . 1685 Leu HD11 . 17110 1 1137 . 1 1 98 98 LEU HD12 H 1 0.876 0.05 . 2 . . . . 1685 Leu HD12 . 17110 1 1138 . 1 1 98 98 LEU HD13 H 1 0.876 0.05 . 2 . . . . 1685 Leu HD13 . 17110 1 1139 . 1 1 98 98 LEU HD21 H 1 0.956 0.05 . 2 . . . . 1685 Leu HD21 . 17110 1 1140 . 1 1 98 98 LEU HD22 H 1 0.956 0.05 . 2 . . . . 1685 Leu HD22 . 17110 1 1141 . 1 1 98 98 LEU HD23 H 1 0.956 0.05 . 2 . . . . 1685 Leu HD23 . 17110 1 1142 . 1 1 98 98 LEU HG H 1 1.770 0.05 . 1 . . . . 1685 Leu HG . 17110 1 1143 . 1 1 98 98 LEU C C 13 178.250 0.2 . 1 . . . . 1685 Leu C . 17110 1 1144 . 1 1 98 98 LEU CA C 13 56.910 0.2 . 1 . . . . 1685 Leu CA . 17110 1 1145 . 1 1 98 98 LEU CB C 13 41.563 0.2 . 1 . . . . 1685 Leu CB . 17110 1 1146 . 1 1 98 98 LEU CD1 C 13 23.662 0.2 . 2 . . . . 1685 Leu CD1 . 17110 1 1147 . 1 1 98 98 LEU CD2 C 13 25.322 0.2 . 2 . . . . 1685 Leu CD2 . 17110 1 1148 . 1 1 98 98 LEU CG C 13 27.575 0.2 . 1 . . . . 1685 Leu CG . 17110 1 1149 . 1 1 98 98 LEU N N 15 123.543 0.05 . 1 . . . . 1685 Leu N . 17110 1 1150 . 1 1 99 99 LYS H H 1 8.242 0.05 . 1 . . . . 1686 Lys H . 17110 1 1151 . 1 1 99 99 LYS HA H 1 4.269 0.05 . 1 . . . . 1686 Lys HA . 17110 1 1152 . 1 1 99 99 LYS HB2 H 1 1.893 0.05 . 1 . . . . 1686 Lys HB2 . 17110 1 1153 . 1 1 99 99 LYS HB3 H 1 1.893 0.05 . 1 . . . . 1686 Lys HB3 . 17110 1 1154 . 1 1 99 99 LYS HD2 H 1 1.714 0.05 . 1 . . . . 1686 Lys HD2 . 17110 1 1155 . 1 1 99 99 LYS HD3 H 1 1.714 0.05 . 1 . . . . 1686 Lys HD3 . 17110 1 1156 . 1 1 99 99 LYS HE2 H 1 3.010 0.05 . 1 . . . . 1686 Lys HE2 . 17110 1 1157 . 1 1 99 99 LYS HE3 H 1 3.010 0.05 . 1 . . . . 1686 Lys HE3 . 17110 1 1158 . 1 1 99 99 LYS HG2 H 1 1.473 0.05 . 1 . . . . 1686 Lys HG2 . 17110 1 1159 . 1 1 99 99 LYS HG3 H 1 1.473 0.05 . 1 . . . . 1686 Lys HG3 . 17110 1 1160 . 1 1 99 99 LYS C C 13 177.571 0.2 . 1 . . . . 1686 Lys C . 17110 1 1161 . 1 1 99 99 LYS CA C 13 57.443 0.2 . 1 . . . . 1686 Lys CA . 17110 1 1162 . 1 1 99 99 LYS CB C 13 32.121 0.2 . 1 . . . . 1686 Lys CB . 17110 1 1163 . 1 1 99 99 LYS CD C 13 28.434 0.2 . 1 . . . . 1686 Lys CD . 17110 1 1164 . 1 1 99 99 LYS CE C 13 41.843 0.2 . 1 . . . . 1686 Lys CE . 17110 1 1165 . 1 1 99 99 LYS CG C 13 24.449 0.2 . 1 . . . . 1686 Lys CG . 17110 1 1166 . 1 1 99 99 LYS N N 15 117.036 0.05 . 1 . . . . 1686 Lys N . 17110 1 1167 . 1 1 100 100 MET H H 1 8.563 0.05 . 1 . . . . 1687 Met H . 17110 1 1168 . 1 1 100 100 MET HA H 1 4.684 0.05 . 1 . . . . 1687 Met HA . 17110 1 1169 . 1 1 100 100 MET HB2 H 1 2.087 0.05 . 2 . . . . 1687 Met HB2 . 17110 1 1170 . 1 1 100 100 MET HB3 H 1 2.009 0.05 . 2 . . . . 1687 Met HB3 . 17110 1 1171 . 1 1 100 100 MET HE1 H 1 2.102 0.05 . 1 . . . . 1687 Met HE1 . 17110 1 1172 . 1 1 100 100 MET HE2 H 1 2.102 0.05 . 1 . . . . 1687 Met HE2 . 17110 1 1173 . 1 1 100 100 MET HE3 H 1 2.102 0.05 . 1 . . . . 1687 Met HE3 . 17110 1 1174 . 1 1 100 100 MET HG2 H 1 2.528 0.05 . 2 . . . . 1687 Met HG2 . 17110 1 1175 . 1 1 100 100 MET HG3 H 1 2.431 0.05 . 2 . . . . 1687 Met HG3 . 17110 1 1176 . 1 1 100 100 MET C C 13 174.779 0.2 . 1 . . . . 1687 Met C . 17110 1 1177 . 1 1 100 100 MET CA C 13 54.444 0.2 . 1 . . . . 1687 Met CA . 17110 1 1178 . 1 1 100 100 MET CB C 13 34.784 0.2 . 1 . . . . 1687 Met CB . 17110 1 1179 . 1 1 100 100 MET CE C 13 17.651 0.2 . 1 . . . . 1687 Met CE . 17110 1 1180 . 1 1 100 100 MET CG C 13 32.203 0.2 . 1 . . . . 1687 Met CG . 17110 1 1181 . 1 1 100 100 MET N N 15 119.049 0.05 . 1 . . . . 1687 Met N . 17110 1 1182 . 1 1 101 101 LYS H H 1 8.468 0.05 . 1 . . . . 1688 Lys H . 17110 1 1183 . 1 1 101 101 LYS HA H 1 4.684 0.05 . 1 . . . . 1688 Lys HA . 17110 1 1184 . 1 1 101 101 LYS HB2 H 1 1.693 0.05 . 1 . . . . 1688 Lys HB2 . 17110 1 1185 . 1 1 101 101 LYS HB3 H 1 1.693 0.05 . 1 . . . . 1688 Lys HB3 . 17110 1 1186 . 1 1 101 101 LYS CA C 13 54.331 0.2 . 1 . . . . 1688 Lys CA . 17110 1 1187 . 1 1 101 101 LYS CB C 13 30.601 0.2 . 1 . . . . 1688 Lys CB . 17110 1 1188 . 1 1 101 101 LYS N N 15 119.572 0.05 . 1 . . . . 1688 Lys N . 17110 1 1189 . 1 1 102 102 HIS H H 1 9.226 0.05 . 1 . . . . 1689 His H . 17110 1 1190 . 1 1 102 102 HIS HA H 1 3.730 0.05 . 1 . . . . 1689 His HA . 17110 1 1191 . 1 1 102 102 HIS CA C 13 62.722 0.2 . 1 . . . . 1689 His CA . 17110 1 1192 . 1 1 103 103 LYS H H 1 8.477 0.05 . 1 . . . . 1690 Lys H . 17110 1 1193 . 1 1 103 103 LYS HA H 1 4.339 0.05 . 1 . . . . 1690 Lys HA . 17110 1 1194 . 1 1 103 103 LYS HB2 H 1 1.580 0.05 . 1 . . . . 1690 Lys HB2 . 17110 1 1195 . 1 1 103 103 LYS HB3 H 1 1.580 0.05 . 1 . . . . 1690 Lys HB3 . 17110 1 1196 . 1 1 103 103 LYS HE2 H 1 3.103 0.05 . 1 . . . . 1690 Lys HE2 . 17110 1 1197 . 1 1 103 103 LYS HE3 H 1 3.103 0.05 . 1 . . . . 1690 Lys HE3 . 17110 1 1198 . 1 1 103 103 LYS C C 13 173.235 0.2 . 1 . . . . 1690 Lys C . 17110 1 1199 . 1 1 103 103 LYS CA C 13 56.448 0.2 . 1 . . . . 1690 Lys CA . 17110 1 1200 . 1 1 103 103 LYS CB C 13 41.672 0.2 . 1 . . . . 1690 Lys CB . 17110 1 1201 . 1 1 103 103 LYS N N 15 119.908 0.05 . 1 . . . . 1690 Lys N . 17110 1 1202 . 1 1 104 104 SER H H 1 9.097 0.05 . 1 . . . . 1691 Ser H . 17110 1 1203 . 1 1 104 104 SER HA H 1 5.899 0.05 . 1 . . . . 1691 Ser HA . 17110 1 1204 . 1 1 104 104 SER HB2 H 1 3.746 0.05 . 2 . . . . 1691 Ser HB2 . 17110 1 1205 . 1 1 104 104 SER HB3 H 1 3.976 0.05 . 2 . . . . 1691 Ser HB3 . 17110 1 1206 . 1 1 104 104 SER C C 13 171.606 0.2 . 1 . . . . 1691 Ser C . 17110 1 1207 . 1 1 104 104 SER CA C 13 59.085 0.2 . 1 . . . . 1691 Ser CA . 17110 1 1208 . 1 1 104 104 SER CB C 13 68.203 0.2 . 1 . . . . 1691 Ser CB . 17110 1 1209 . 1 1 104 104 SER N N 15 124.026 0.05 . 1 . . . . 1691 Ser N . 17110 1 1210 . 1 1 105 105 TYR H H 1 9.347 0.05 . 1 . . . . 1692 Tyr H . 17110 1 1211 . 1 1 105 105 TYR HA H 1 5.055 0.05 . 1 . . . . 1692 Tyr HA . 17110 1 1212 . 1 1 105 105 TYR HB2 H 1 3.043 0.05 . 2 . . . . 1692 Tyr HB2 . 17110 1 1213 . 1 1 105 105 TYR HB3 H 1 2.647 0.05 . 2 . . . . 1692 Tyr HB3 . 17110 1 1214 . 1 1 105 105 TYR HD1 H 1 6.967 0.05 . 3 . . . . 1692 Tyr HD1 . 17110 1 1215 . 1 1 105 105 TYR HD2 H 1 6.967 0.05 . 3 . . . . 1692 Tyr HD2 . 17110 1 1216 . 1 1 105 105 TYR HE1 H 1 6.735 0.05 . 3 . . . . 1692 Tyr HE1 . 17110 1 1217 . 1 1 105 105 TYR HE2 H 1 6.735 0.05 . 3 . . . . 1692 Tyr HE2 . 17110 1 1218 . 1 1 105 105 TYR C C 13 174.492 0.2 . 1 . . . . 1692 Tyr C . 17110 1 1219 . 1 1 105 105 TYR CA C 13 55.901 0.2 . 1 . . . . 1692 Tyr CA . 17110 1 1220 . 1 1 105 105 TYR CB C 13 42.404 0.2 . 1 . . . . 1692 Tyr CB . 17110 1 1221 . 1 1 105 105 TYR CD1 C 13 132.918 0.2 . 3 . . . . 1692 Tyr CD1 . 17110 1 1222 . 1 1 105 105 TYR CD2 C 13 132.918 0.2 . 3 . . . . 1692 Tyr CD2 . 17110 1 1223 . 1 1 105 105 TYR CE1 C 13 118.418 0.2 . 3 . . . . 1692 Tyr CE1 . 17110 1 1224 . 1 1 105 105 TYR CE2 C 13 118.418 0.2 . 3 . . . . 1692 Tyr CE2 . 17110 1 1225 . 1 1 105 105 TYR N N 15 125.399 0.05 . 1 . . . . 1692 Tyr N . 17110 1 1226 . 1 1 106 106 PHE H H 1 9.416 0.05 . 1 . . . . 1693 Phe H . 17110 1 1227 . 1 1 106 106 PHE HA H 1 4.746 0.05 . 1 . . . . 1693 Phe HA . 17110 1 1228 . 1 1 106 106 PHE HB2 H 1 3.094 0.05 . 2 . . . . 1693 Phe HB2 . 17110 1 1229 . 1 1 106 106 PHE HB3 H 1 2.140 0.05 . 2 . . . . 1693 Phe HB3 . 17110 1 1230 . 1 1 106 106 PHE HD1 H 1 6.747 0.05 . 3 . . . . 1693 Phe HD1 . 17110 1 1231 . 1 1 106 106 PHE HD2 H 1 6.747 0.05 . 3 . . . . 1693 Phe HD2 . 17110 1 1232 . 1 1 106 106 PHE HE1 H 1 6.293 0.05 . 3 . . . . 1693 Phe HE1 . 17110 1 1233 . 1 1 106 106 PHE HE2 H 1 6.293 0.05 . 3 . . . . 1693 Phe HE2 . 17110 1 1234 . 1 1 106 106 PHE C C 13 174.728 0.2 . 1 . . . . 1693 Phe C . 17110 1 1235 . 1 1 106 106 PHE CA C 13 57.062 0.2 . 1 . . . . 1693 Phe CA . 17110 1 1236 . 1 1 106 106 PHE CB C 13 42.549 0.2 . 1 . . . . 1693 Phe CB . 17110 1 1237 . 1 1 106 106 PHE CD1 C 13 130.870 0.2 . 3 . . . . 1693 Phe CD1 . 17110 1 1238 . 1 1 106 106 PHE CD2 C 13 130.870 0.2 . 3 . . . . 1693 Phe CD2 . 17110 1 1239 . 1 1 106 106 PHE CE1 C 13 128.891 0.2 . 3 . . . . 1693 Phe CE1 . 17110 1 1240 . 1 1 106 106 PHE CE2 C 13 128.891 0.2 . 3 . . . . 1693 Phe CE2 . 17110 1 1241 . 1 1 106 106 PHE N N 15 122.736 0.05 . 1 . . . . 1693 Phe N . 17110 1 1242 . 1 1 107 107 SER H H 1 7.671 0.05 . 1 . . . . 1694 Ser H . 17110 1 1243 . 1 1 107 107 SER HA H 1 5.154 0.05 . 1 . . . . 1694 Ser HA . 17110 1 1244 . 1 1 107 107 SER HB2 H 1 3.706 0.05 . 2 . . . . 1694 Ser HB2 . 17110 1 1245 . 1 1 107 107 SER HB3 H 1 3.589 0.05 . 2 . . . . 1694 Ser HB3 . 17110 1 1246 . 1 1 107 107 SER C C 13 172.605 0.2 . 1 . . . . 1694 Ser C . 17110 1 1247 . 1 1 107 107 SER CA C 13 56.822 0.2 . 1 . . . . 1694 Ser CA . 17110 1 1248 . 1 1 107 107 SER CB C 13 64.554 0.2 . 1 . . . . 1694 Ser CB . 17110 1 1249 . 1 1 107 107 SER N N 15 115.923 0.05 . 1 . . . . 1694 Ser N . 17110 1 1250 . 1 1 108 108 PHE H H 1 9.646 0.05 . 1 . . . . 1695 Phe H . 17110 1 1251 . 1 1 108 108 PHE HA H 1 5.498 0.05 . 1 . . . . 1695 Phe HA . 17110 1 1252 . 1 1 108 108 PHE HB2 H 1 2.945 0.05 . 2 . . . . 1695 Phe HB2 . 17110 1 1253 . 1 1 108 108 PHE HB3 H 1 2.419 0.05 . 2 . . . . 1695 Phe HB3 . 17110 1 1254 . 1 1 108 108 PHE HD1 H 1 6.728 0.05 . 3 . . . . 1695 Phe HD1 . 17110 1 1255 . 1 1 108 108 PHE HD2 H 1 6.728 0.05 . 3 . . . . 1695 Phe HD2 . 17110 1 1256 . 1 1 108 108 PHE HE1 H 1 6.454 0.05 . 3 . . . . 1695 Phe HE1 . 17110 1 1257 . 1 1 108 108 PHE HE2 H 1 6.454 0.05 . 3 . . . . 1695 Phe HE2 . 17110 1 1258 . 1 1 108 108 PHE HZ H 1 6.805 0.05 . 1 . . . . 1695 Phe HZ . 17110 1 1259 . 1 1 108 108 PHE C C 13 174.185 0.2 . 1 . . . . 1695 Phe C . 17110 1 1260 . 1 1 108 108 PHE CA C 13 56.511 0.2 . 1 . . . . 1695 Phe CA . 17110 1 1261 . 1 1 108 108 PHE CB C 13 39.364 0.2 . 1 . . . . 1695 Phe CB . 17110 1 1262 . 1 1 108 108 PHE CD1 C 13 132.152 0.2 . 3 . . . . 1695 Phe CD1 . 17110 1 1263 . 1 1 108 108 PHE CD2 C 13 132.152 0.2 . 3 . . . . 1695 Phe CD2 . 17110 1 1264 . 1 1 108 108 PHE CE1 C 13 131.262 0.2 . 3 . . . . 1695 Phe CE1 . 17110 1 1265 . 1 1 108 108 PHE CE2 C 13 131.262 0.2 . 3 . . . . 1695 Phe CE2 . 17110 1 1266 . 1 1 108 108 PHE N N 15 124.473 0.05 . 1 . . . . 1695 Phe N . 17110 1 1267 . 1 1 109 109 VAL H H 1 8.344 0.05 . 1 . . . . 1696 Val H . 17110 1 1268 . 1 1 109 109 VAL HA H 1 4.333 0.05 . 1 . . . . 1696 Val HA . 17110 1 1269 . 1 1 109 109 VAL HB H 1 1.174 0.05 . 1 . . . . 1696 Val HB . 17110 1 1270 . 1 1 109 109 VAL HG11 H 1 0.575 0.05 . 2 . . . . 1696 Val HG11 . 17110 1 1271 . 1 1 109 109 VAL HG12 H 1 0.575 0.05 . 2 . . . . 1696 Val HG12 . 17110 1 1272 . 1 1 109 109 VAL HG13 H 1 0.575 0.05 . 2 . . . . 1696 Val HG13 . 17110 1 1273 . 1 1 109 109 VAL HG21 H 1 0.863 0.05 . 2 . . . . 1696 Val HG21 . 17110 1 1274 . 1 1 109 109 VAL HG22 H 1 0.863 0.05 . 2 . . . . 1696 Val HG22 . 17110 1 1275 . 1 1 109 109 VAL HG23 H 1 0.863 0.05 . 2 . . . . 1696 Val HG23 . 17110 1 1276 . 1 1 109 109 VAL C C 13 175.325 0.2 . 1 . . . . 1696 Val C . 17110 1 1277 . 1 1 109 109 VAL CA C 13 60.043 0.2 . 1 . . . . 1696 Val CA . 17110 1 1278 . 1 1 109 109 VAL CB C 13 35.354 0.2 . 1 . . . . 1696 Val CB . 17110 1 1279 . 1 1 109 109 VAL CG1 C 13 19.890 0.2 . 2 . . . . 1696 Val CG1 . 17110 1 1280 . 1 1 109 109 VAL CG2 C 13 21.625 0.2 . 2 . . . . 1696 Val CG2 . 17110 1 1281 . 1 1 109 109 VAL N N 15 120.340 0.05 . 1 . . . . 1696 Val N . 17110 1 1282 . 1 1 110 110 CYS H H 1 9.134 0.05 . 1 . . . . 1697 Cys H . 17110 1 1283 . 1 1 110 110 CYS HA H 1 4.440 0.05 . 1 . . . . 1697 Cys HA . 17110 1 1284 . 1 1 110 110 CYS HB2 H 1 3.148 0.05 . 2 . . . . 1697 Cys HB2 . 17110 1 1285 . 1 1 110 110 CYS HB3 H 1 2.764 0.05 . 2 . . . . 1697 Cys HB3 . 17110 1 1286 . 1 1 110 110 CYS C C 13 174.906 0.2 . 1 . . . . 1697 Cys C . 17110 1 1287 . 1 1 110 110 CYS CA C 13 56.827 0.2 . 1 . . . . 1697 Cys CA . 17110 1 1288 . 1 1 110 110 CYS CB C 13 38.845 0.2 . 1 . . . . 1697 Cys CB . 17110 1 1289 . 1 1 110 110 CYS N N 15 122.764 0.05 . 1 . . . . 1697 Cys N . 17110 1 1290 . 1 1 111 111 LYS H H 1 6.971 0.05 . 1 . . . . 1698 Lys H . 17110 1 1291 . 1 1 111 111 LYS HA H 1 4.565 0.05 . 1 . . . . 1698 Lys HA . 17110 1 1292 . 1 1 111 111 LYS HB2 H 1 1.817 0.05 . 1 . . . . 1698 Lys HB2 . 17110 1 1293 . 1 1 111 111 LYS HB3 H 1 1.817 0.05 . 1 . . . . 1698 Lys HB3 . 17110 1 1294 . 1 1 111 111 LYS HD2 H 1 1.693 0.05 . 1 . . . . 1698 Lys HD2 . 17110 1 1295 . 1 1 111 111 LYS HD3 H 1 1.693 0.05 . 1 . . . . 1698 Lys HD3 . 17110 1 1296 . 1 1 111 111 LYS HE2 H 1 2.955 0.05 . 1 . . . . 1698 Lys HE2 . 17110 1 1297 . 1 1 111 111 LYS HE3 H 1 2.955 0.05 . 1 . . . . 1698 Lys HE3 . 17110 1 1298 . 1 1 111 111 LYS HG2 H 1 1.477 0.05 . 1 . . . . 1698 Lys HG2 . 17110 1 1299 . 1 1 111 111 LYS HG3 H 1 1.477 0.05 . 1 . . . . 1698 Lys HG3 . 17110 1 1300 . 1 1 111 111 LYS C C 13 175.861 0.2 . 1 . . . . 1698 Lys C . 17110 1 1301 . 1 1 111 111 LYS CA C 13 56.318 0.2 . 1 . . . . 1698 Lys CA . 17110 1 1302 . 1 1 111 111 LYS CB C 13 35.577 0.2 . 1 . . . . 1698 Lys CB . 17110 1 1303 . 1 1 111 111 LYS CD C 13 29.406 0.2 . 1 . . . . 1698 Lys CD . 17110 1 1304 . 1 1 111 111 LYS CG C 13 25.239 0.2 . 1 . . . . 1698 Lys CG . 17110 1 1305 . 1 1 111 111 LYS N N 15 129.588 0.05 . 1 . . . . 1698 Lys N . 17110 1 1306 . 1 1 112 112 SER H H 1 9.176 0.05 . 1 . . . . 1699 Ser H . 17110 1 1307 . 1 1 112 112 SER HA H 1 4.187 0.05 . 1 . . . . 1699 Ser HA . 17110 1 1308 . 1 1 112 112 SER HB2 H 1 3.992 0.05 . 2 . . . . 1699 Ser HB2 . 17110 1 1309 . 1 1 112 112 SER HB3 H 1 3.907 0.05 . 2 . . . . 1699 Ser HB3 . 17110 1 1310 . 1 1 112 112 SER C C 13 174.355 0.2 . 1 . . . . 1699 Ser C . 17110 1 1311 . 1 1 112 112 SER CA C 13 61.232 0.2 . 1 . . . . 1699 Ser CA . 17110 1 1312 . 1 1 112 112 SER CB C 13 63.113 0.2 . 1 . . . . 1699 Ser CB . 17110 1 1313 . 1 1 112 112 SER N N 15 122.743 0.05 . 1 . . . . 1699 Ser N . 17110 1 1314 . 1 1 113 113 ASP H H 1 8.296 0.05 . 1 . . . . 1700 Asp H . 17110 1 1315 . 1 1 113 113 ASP HA H 1 4.730 0.05 . 1 . . . . 1700 Asp HA . 17110 1 1316 . 1 1 113 113 ASP HB2 H 1 2.944 0.05 . 2 . . . . 1700 Asp HB2 . 17110 1 1317 . 1 1 113 113 ASP HB3 H 1 2.622 0.05 . 2 . . . . 1700 Asp HB3 . 17110 1 1318 . 1 1 113 113 ASP C C 13 175.987 0.2 . 1 . . . . 1700 Asp C . 17110 1 1319 . 1 1 113 113 ASP CA C 13 52.783 0.2 . 1 . . . . 1700 Asp CA . 17110 1 1320 . 1 1 113 113 ASP CB C 13 40.165 0.2 . 1 . . . . 1700 Asp CB . 17110 1 1321 . 1 1 113 113 ASP N N 15 117.945 0.05 . 1 . . . . 1700 Asp N . 17110 1 1322 . 1 1 114 114 ALA H H 1 7.984 0.05 . 1 . . . . 1701 Ala H . 17110 1 1323 . 1 1 114 114 ALA HA H 1 4.403 0.05 . 1 . . . . 1701 Ala HA . 17110 1 1324 . 1 1 114 114 ALA HB1 H 1 1.569 0.05 . 1 . . . . 1701 Ala HB1 . 17110 1 1325 . 1 1 114 114 ALA HB2 H 1 1.569 0.05 . 1 . . . . 1701 Ala HB2 . 17110 1 1326 . 1 1 114 114 ALA HB3 H 1 1.569 0.05 . 1 . . . . 1701 Ala HB3 . 17110 1 1327 . 1 1 114 114 ALA C C 13 177.815 0.2 . 1 . . . . 1701 Ala C . 17110 1 1328 . 1 1 114 114 ALA CA C 13 52.838 0.2 . 1 . . . . 1701 Ala CA . 17110 1 1329 . 1 1 114 114 ALA CB C 13 19.479 0.2 . 1 . . . . 1701 Ala CB . 17110 1 1330 . 1 1 114 114 ALA N N 15 122.188 0.05 . 1 . . . . 1701 Ala N . 17110 1 1331 . 1 1 115 115 GLY H H 1 8.579 0.05 . 1 . . . . 1702 Gly H . 17110 1 1332 . 1 1 115 115 GLY HA2 H 1 4.218 0.05 . 2 . . . . 1702 Gly HA2 . 17110 1 1333 . 1 1 115 115 GLY HA3 H 1 4.014 0.05 . 2 . . . . 1702 Gly HA3 . 17110 1 1334 . 1 1 115 115 GLY C C 13 174.656 0.2 . 1 . . . . 1702 Gly C . 17110 1 1335 . 1 1 115 115 GLY CA C 13 44.732 0.2 . 1 . . . . 1702 Gly CA . 17110 1 1336 . 1 1 115 115 GLY N N 15 108.823 0.05 . 1 . . . . 1702 Gly N . 17110 1 1337 . 1 1 116 116 ASP H H 1 8.569 0.05 . 1 . . . . 1703 Asp H . 17110 1 1338 . 1 1 116 116 ASP HA H 1 4.684 0.05 . 1 . . . . 1703 Asp HA . 17110 1 1339 . 1 1 116 116 ASP HB2 H 1 2.818 0.05 . 2 . . . . 1703 Asp HB2 . 17110 1 1340 . 1 1 116 116 ASP HB3 H 1 2.721 0.05 . 2 . . . . 1703 Asp HB3 . 17110 1 1341 . 1 1 116 116 ASP C C 13 176.136 0.2 . 1 . . . . 1703 Asp C . 17110 1 1342 . 1 1 116 116 ASP CA C 13 55.329 0.2 . 1 . . . . 1703 Asp CA . 17110 1 1343 . 1 1 116 116 ASP CB C 13 40.896 0.2 . 1 . . . . 1703 Asp CB . 17110 1 1344 . 1 1 116 116 ASP N N 15 120.262 0.05 . 1 . . . . 1703 Asp N . 17110 1 1345 . 1 1 117 117 ASP H H 1 8.661 0.05 . 1 . . . . 1704 Asp H . 17110 1 1346 . 1 1 117 117 ASP HA H 1 4.909 0.05 . 1 . . . . 1704 Asp HA . 17110 1 1347 . 1 1 117 117 ASP HB2 H 1 2.830 0.05 . 1 . . . . 1704 Asp HB2 . 17110 1 1348 . 1 1 117 117 ASP HB3 H 1 2.830 0.05 . 1 . . . . 1704 Asp HB3 . 17110 1 1349 . 1 1 117 117 ASP C C 13 176.623 0.2 . 1 . . . . 1704 Asp C . 17110 1 1350 . 1 1 117 117 ASP CA C 13 53.641 0.2 . 1 . . . . 1704 Asp CA . 17110 1 1351 . 1 1 117 117 ASP CB C 13 40.708 0.2 . 1 . . . . 1704 Asp CB . 17110 1 1352 . 1 1 117 117 ASP N N 15 118.595 0.05 . 1 . . . . 1704 Asp N . 17110 1 1353 . 1 1 118 118 SER H H 1 8.153 0.05 . 1 . . . . 1705 Ser H . 17110 1 1354 . 1 1 118 118 SER HA H 1 4.610 0.05 . 1 . . . . 1705 Ser HA . 17110 1 1355 . 1 1 118 118 SER HB2 H 1 4.377 0.05 . 2 . . . . 1705 Ser HB2 . 17110 1 1356 . 1 1 118 118 SER HB3 H 1 4.330 0.05 . 2 . . . . 1705 Ser HB3 . 17110 1 1357 . 1 1 118 118 SER C C 13 173.832 0.2 . 1 . . . . 1705 Ser C . 17110 1 1358 . 1 1 118 118 SER CA C 13 58.958 0.2 . 1 . . . . 1705 Ser CA . 17110 1 1359 . 1 1 118 118 SER CB C 13 64.462 0.2 . 1 . . . . 1705 Ser CB . 17110 1 1360 . 1 1 118 118 SER N N 15 116.521 0.05 . 1 . . . . 1705 Ser N . 17110 1 1361 . 1 1 119 119 GLN H H 1 8.258 0.05 . 1 . . . . 1706 Gln H . 17110 1 1362 . 1 1 119 119 GLN HA H 1 4.366 0.05 . 1 . . . . 1706 Gln HA . 17110 1 1363 . 1 1 119 119 GLN HB2 H 1 2.052 0.05 . 2 . . . . 1706 Gln HB2 . 17110 1 1364 . 1 1 119 119 GLN HB3 H 1 1.756 0.05 . 2 . . . . 1706 Gln HB3 . 17110 1 1365 . 1 1 119 119 GLN HE21 H 1 6.833 0.05 . 1 . . . . 1706 Gln HE21 . 17110 1 1366 . 1 1 119 119 GLN HE22 H 1 7.571 0.05 . 1 . . . . 1706 Gln HE22 . 17110 1 1367 . 1 1 119 119 GLN HG2 H 1 2.441 0.05 . 2 . . . . 1706 Gln HG2 . 17110 1 1368 . 1 1 119 119 GLN HG3 H 1 2.431 0.05 . 2 . . . . 1706 Gln HG3 . 17110 1 1369 . 1 1 119 119 GLN CA C 13 52.246 0.2 . 1 . . . . 1706 Gln CA . 17110 1 1370 . 1 1 119 119 GLN CB C 13 30.724 0.2 . 1 . . . . 1706 Gln CB . 17110 1 1371 . 1 1 119 119 GLN CG C 13 34.097 0.2 . 1 . . . . 1706 Gln CG . 17110 1 1372 . 1 1 119 119 GLN N N 15 120.136 0.05 . 1 . . . . 1706 Gln N . 17110 1 1373 . 1 1 119 119 GLN NE2 N 15 111.699 0.05 . 1 . . . . 1706 Gln NE2 . 17110 1 1374 . 1 1 120 120 PRO HA H 1 4.239 0.05 . 1 . . . . 1707 Pro HA . 17110 1 1375 . 1 1 120 120 PRO HB2 H 1 1.578 0.05 . 2 . . . . 1707 Pro HB2 . 17110 1 1376 . 1 1 120 120 PRO HB3 H 1 1.450 0.05 . 2 . . . . 1707 Pro HB3 . 17110 1 1377 . 1 1 120 120 PRO HD2 H 1 3.165 0.05 . 1 . . . . 1707 Pro HD2 . 17110 1 1378 . 1 1 120 120 PRO HD3 H 1 3.165 0.05 . 1 . . . . 1707 Pro HD3 . 17110 1 1379 . 1 1 120 120 PRO HG2 H 1 1.624 0.05 . 2 . . . . 1707 Pro HG2 . 17110 1 1380 . 1 1 120 120 PRO HG3 H 1 1.453 0.05 . 2 . . . . 1707 Pro HG3 . 17110 1 1381 . 1 1 120 120 PRO C C 13 174.289 0.2 . 1 . . . . 1707 Pro C . 17110 1 1382 . 1 1 120 120 PRO CA C 13 61.986 0.2 . 1 . . . . 1707 Pro CA . 17110 1 1383 . 1 1 120 120 PRO CB C 13 31.746 0.2 . 1 . . . . 1707 Pro CB . 17110 1 1384 . 1 1 120 120 PRO CD C 13 46.414 0.2 . 1 . . . . 1707 Pro CD . 17110 1 1385 . 1 1 120 120 PRO CG C 13 27.155 0.2 . 1 . . . . 1707 Pro CG . 17110 1 1386 . 1 1 121 121 VAL H H 1 8.746 0.05 . 1 . . . . 1708 Val H . 17110 1 1387 . 1 1 121 121 VAL HA H 1 4.298 0.05 . 1 . . . . 1708 Val HA . 17110 1 1388 . 1 1 121 121 VAL HB H 1 1.988 0.05 . 1 . . . . 1708 Val HB . 17110 1 1389 . 1 1 121 121 VAL HG11 H 1 0.892 0.05 . 1 . . . . 1708 Val HG11 . 17110 1 1390 . 1 1 121 121 VAL HG12 H 1 0.892 0.05 . 1 . . . . 1708 Val HG12 . 17110 1 1391 . 1 1 121 121 VAL HG13 H 1 0.892 0.05 . 1 . . . . 1708 Val HG13 . 17110 1 1392 . 1 1 121 121 VAL HG21 H 1 0.892 0.05 . 1 . . . . 1708 Val HG21 . 17110 1 1393 . 1 1 121 121 VAL HG22 H 1 0.892 0.05 . 1 . . . . 1708 Val HG22 . 17110 1 1394 . 1 1 121 121 VAL HG23 H 1 0.892 0.05 . 1 . . . . 1708 Val HG23 . 17110 1 1395 . 1 1 121 121 VAL C C 13 175.535 0.2 . 1 . . . . 1708 Val C . 17110 1 1396 . 1 1 121 121 VAL CA C 13 60.757 0.2 . 1 . . . . 1708 Val CA . 17110 1 1397 . 1 1 121 121 VAL CB C 13 35.513 0.2 . 1 . . . . 1708 Val CB . 17110 1 1398 . 1 1 121 121 VAL CG1 C 13 20.960 0.2 . 2 . . . . 1708 Val CG1 . 17110 1 1399 . 1 1 121 121 VAL CG2 C 13 20.889 0.2 . 2 . . . . 1708 Val CG2 . 17110 1 1400 . 1 1 121 121 VAL N N 15 114.607 0.05 . 1 . . . . 1708 Val N . 17110 1 1401 . 1 1 122 122 PHE H H 1 8.781 0.05 . 1 . . . . 1709 Phe H . 17110 1 1402 . 1 1 122 122 PHE HA H 1 4.021 0.05 . 1 . . . . 1709 Phe HA . 17110 1 1403 . 1 1 122 122 PHE HB2 H 1 2.949 0.05 . 2 . . . . 1709 Phe HB2 . 17110 1 1404 . 1 1 122 122 PHE HB3 H 1 2.656 0.05 . 2 . . . . 1709 Phe HB3 . 17110 1 1405 . 1 1 122 122 PHE HD1 H 1 6.620 0.05 . 3 . . . . 1709 Phe HD1 . 17110 1 1406 . 1 1 122 122 PHE HD2 H 1 6.620 0.05 . 3 . . . . 1709 Phe HD2 . 17110 1 1407 . 1 1 122 122 PHE HE1 H 1 6.482 0.05 . 3 . . . . 1709 Phe HE1 . 17110 1 1408 . 1 1 122 122 PHE HE2 H 1 6.482 0.05 . 3 . . . . 1709 Phe HE2 . 17110 1 1409 . 1 1 122 122 PHE HZ H 1 6.624 0.05 . 1 . . . . 1709 Phe HZ . 17110 1 1410 . 1 1 122 122 PHE C C 13 174.209 0.2 . 1 . . . . 1709 Phe C . 17110 1 1411 . 1 1 122 122 PHE CA C 13 58.428 0.2 . 1 . . . . 1709 Phe CA . 17110 1 1412 . 1 1 122 122 PHE CB C 13 39.198 0.2 . 1 . . . . 1709 Phe CB . 17110 1 1413 . 1 1 122 122 PHE CD1 C 13 132.749 0.2 . 3 . . . . 1709 Phe CD1 . 17110 1 1414 . 1 1 122 122 PHE CD2 C 13 132.749 0.2 . 3 . . . . 1709 Phe CD2 . 17110 1 1415 . 1 1 122 122 PHE CE1 C 13 130.828 0.2 . 3 . . . . 1709 Phe CE1 . 17110 1 1416 . 1 1 122 122 PHE CE2 C 13 130.828 0.2 . 3 . . . . 1709 Phe CE2 . 17110 1 1417 . 1 1 122 122 PHE N N 15 125.155 0.05 . 1 . . . . 1709 Phe N . 17110 1 1418 . 1 1 123 123 LEU H H 1 8.546 0.05 . 1 . . . . 1710 Leu H . 17110 1 1419 . 1 1 123 123 LEU HA H 1 4.255 0.05 . 1 . . . . 1710 Leu HA . 17110 1 1420 . 1 1 123 123 LEU HB2 H 1 1.486 0.05 . 2 . . . . 1710 Leu HB2 . 17110 1 1421 . 1 1 123 123 LEU HB3 H 1 1.174 0.05 . 2 . . . . 1710 Leu HB3 . 17110 1 1422 . 1 1 123 123 LEU HD11 H 1 0.681 0.05 . 2 . . . . 1710 Leu HD11 . 17110 1 1423 . 1 1 123 123 LEU HD12 H 1 0.681 0.05 . 2 . . . . 1710 Leu HD12 . 17110 1 1424 . 1 1 123 123 LEU HD13 H 1 0.681 0.05 . 2 . . . . 1710 Leu HD13 . 17110 1 1425 . 1 1 123 123 LEU HD21 H 1 0.688 0.05 . 2 . . . . 1710 Leu HD21 . 17110 1 1426 . 1 1 123 123 LEU HD22 H 1 0.688 0.05 . 2 . . . . 1710 Leu HD22 . 17110 1 1427 . 1 1 123 123 LEU HD23 H 1 0.688 0.05 . 2 . . . . 1710 Leu HD23 . 17110 1 1428 . 1 1 123 123 LEU C C 13 176.576 0.2 . 1 . . . . 1710 Leu C . 17110 1 1429 . 1 1 123 123 LEU CA C 13 55.631 0.2 . 1 . . . . 1710 Leu CA . 17110 1 1430 . 1 1 123 123 LEU CB C 13 43.462 0.2 . 1 . . . . 1710 Leu CB . 17110 1 1431 . 1 1 123 123 LEU CD1 C 13 22.259 0.2 . 2 . . . . 1710 Leu CD1 . 17110 1 1432 . 1 1 123 123 LEU CD2 C 13 25.789 0.2 . 2 . . . . 1710 Leu CD2 . 17110 1 1433 . 1 1 123 123 LEU N N 15 127.569 0.05 . 1 . . . . 1710 Leu N . 17110 1 1434 . 1 1 124 124 SER H H 1 6.535 0.05 . 1 . . . . 1711 Ser H . 17110 1 1435 . 1 1 124 124 SER HA H 1 4.210 0.05 . 1 . . . . 1711 Ser HA . 17110 1 1436 . 1 1 124 124 SER HB2 H 1 3.672 0.05 . 1 . . . . 1711 Ser HB2 . 17110 1 1437 . 1 1 124 124 SER HB3 H 1 3.672 0.05 . 1 . . . . 1711 Ser HB3 . 17110 1 1438 . 1 1 124 124 SER C C 13 170.371 0.2 . 1 . . . . 1711 Ser C . 17110 1 1439 . 1 1 124 124 SER CA C 13 58.104 0.2 . 1 . . . . 1711 Ser CA . 17110 1 1440 . 1 1 124 124 SER CB C 13 63.905 0.2 . 1 . . . . 1711 Ser CB . 17110 1 1441 . 1 1 124 124 SER N N 15 108.406 0.05 . 1 . . . . 1711 Ser N . 17110 1 1442 . 1 1 125 125 PHE H H 1 8.524 0.05 . 1 . . . . 1712 Phe H . 17110 1 1443 . 1 1 125 125 PHE HA H 1 5.652 0.05 . 1 . . . . 1712 Phe HA . 17110 1 1444 . 1 1 125 125 PHE HB2 H 1 3.373 0.05 . 2 . . . . 1712 Phe HB2 . 17110 1 1445 . 1 1 125 125 PHE HB3 H 1 3.035 0.05 . 2 . . . . 1712 Phe HB3 . 17110 1 1446 . 1 1 125 125 PHE HD1 H 1 7.421 0.05 . 3 . . . . 1712 Phe HD1 . 17110 1 1447 . 1 1 125 125 PHE HD2 H 1 7.421 0.05 . 3 . . . . 1712 Phe HD2 . 17110 1 1448 . 1 1 125 125 PHE HE1 H 1 7.276 0.05 . 3 . . . . 1712 Phe HE1 . 17110 1 1449 . 1 1 125 125 PHE HE2 H 1 7.276 0.05 . 3 . . . . 1712 Phe HE2 . 17110 1 1450 . 1 1 125 125 PHE C C 13 174.001 0.2 . 1 . . . . 1712 Phe C . 17110 1 1451 . 1 1 125 125 PHE CA C 13 55.232 0.2 . 1 . . . . 1712 Phe CA . 17110 1 1452 . 1 1 125 125 PHE CB C 13 42.811 0.2 . 1 . . . . 1712 Phe CB . 17110 1 1453 . 1 1 125 125 PHE CD1 C 13 133.389 0.2 . 3 . . . . 1712 Phe CD1 . 17110 1 1454 . 1 1 125 125 PHE CD2 C 13 133.389 0.2 . 3 . . . . 1712 Phe CD2 . 17110 1 1455 . 1 1 125 125 PHE N N 15 119.445 0.05 . 1 . . . . 1712 Phe N . 17110 1 1456 . 1 1 126 126 ASP H H 1 8.868 0.05 . 1 . . . . 1713 Asp H . 17110 1 1457 . 1 1 126 126 ASP HA H 1 4.731 0.05 . 1 . . . . 1713 Asp HA . 17110 1 1458 . 1 1 126 126 ASP HB2 H 1 2.696 0.05 . 1 . . . . 1713 Asp HB2 . 17110 1 1459 . 1 1 126 126 ASP HB3 H 1 2.696 0.05 . 1 . . . . 1713 Asp HB3 . 17110 1 1460 . 1 1 126 126 ASP C C 13 175.902 0.2 . 1 . . . . 1713 Asp C . 17110 1 1461 . 1 1 126 126 ASP CA C 13 52.057 0.2 . 1 . . . . 1713 Asp CA . 17110 1 1462 . 1 1 126 126 ASP CB C 13 42.145 0.2 . 1 . . . . 1713 Asp CB . 17110 1 1463 . 1 1 126 126 ASP N N 15 126.819 0.05 . 1 . . . . 1713 Asp N . 17110 1 1464 . 1 1 127 127 GLU H H 1 8.846 0.05 . 1 . . . . 1714 Glu H . 17110 1 1465 . 1 1 127 127 GLU HA H 1 3.616 0.05 . 1 . . . . 1714 Glu HA . 17110 1 1466 . 1 1 127 127 GLU HB2 H 1 2.089 0.05 . 1 . . . . 1714 Glu HB2 . 17110 1 1467 . 1 1 127 127 GLU HB3 H 1 2.089 0.05 . 1 . . . . 1714 Glu HB3 . 17110 1 1468 . 1 1 127 127 GLU HG2 H 1 2.412 0.05 . 1 . . . . 1714 Glu HG2 . 17110 1 1469 . 1 1 127 127 GLU HG3 H 1 2.412 0.05 . 1 . . . . 1714 Glu HG3 . 17110 1 1470 . 1 1 127 127 GLU C C 13 177.189 0.2 . 1 . . . . 1714 Glu C . 17110 1 1471 . 1 1 127 127 GLU CA C 13 58.438 0.2 . 1 . . . . 1714 Glu CA . 17110 1 1472 . 1 1 127 127 GLU CB C 13 29.880 0.2 . 1 . . . . 1714 Glu CB . 17110 1 1473 . 1 1 127 127 GLU CG C 13 35.615 0.2 . 1 . . . . 1714 Glu CG . 17110 1 1474 . 1 1 127 127 GLU N N 15 124.876 0.05 . 1 . . . . 1714 Glu N . 17110 1 1475 . 1 1 128 128 GLN H H 1 8.159 0.05 . 1 . . . . 1715 Gln H . 17110 1 1476 . 1 1 128 128 GLN HA H 1 4.011 0.05 . 1 . . . . 1715 Gln HA . 17110 1 1477 . 1 1 128 128 GLN HB2 H 1 2.255 0.05 . 2 . . . . 1715 Gln HB2 . 17110 1 1478 . 1 1 128 128 GLN HB3 H 1 2.110 0.05 . 2 . . . . 1715 Gln HB3 . 17110 1 1479 . 1 1 128 128 GLN HG2 H 1 2.418 0.05 . 2 . . . . 1715 Gln HG2 . 17110 1 1480 . 1 1 128 128 GLN HG3 H 1 2.364 0.05 . 2 . . . . 1715 Gln HG3 . 17110 1 1481 . 1 1 128 128 GLN C C 13 176.679 0.2 . 1 . . . . 1715 Gln C . 17110 1 1482 . 1 1 128 128 GLN CA C 13 58.362 0.2 . 1 . . . . 1715 Gln CA . 17110 1 1483 . 1 1 128 128 GLN CB C 13 28.597 0.2 . 1 . . . . 1715 Gln CB . 17110 1 1484 . 1 1 128 128 GLN CG C 13 33.956 0.2 . 1 . . . . 1715 Gln CG . 17110 1 1485 . 1 1 128 128 GLN N N 15 115.427 0.05 . 1 . . . . 1715 Gln N . 17110 1 1486 . 1 1 128 128 GLN NE2 N 15 112.023 0.05 . 1 . . . . 1715 Gln NE2 . 17110 1 1487 . 1 1 129 129 THR H H 1 6.661 0.05 . 1 . . . . 1716 Thr H . 17110 1 1488 . 1 1 129 129 THR HA H 1 4.453 0.05 . 1 . . . . 1716 Thr HA . 17110 1 1489 . 1 1 129 129 THR HB H 1 4.324 0.05 . 1 . . . . 1716 Thr HB . 17110 1 1490 . 1 1 129 129 THR HG21 H 1 1.094 0.05 . 1 . . . . 1716 Thr HG21 . 17110 1 1491 . 1 1 129 129 THR HG22 H 1 1.094 0.05 . 1 . . . . 1716 Thr HG22 . 17110 1 1492 . 1 1 129 129 THR HG23 H 1 1.094 0.05 . 1 . . . . 1716 Thr HG23 . 17110 1 1493 . 1 1 129 129 THR C C 13 173.849 0.2 . 1 . . . . 1716 Thr C . 17110 1 1494 . 1 1 129 129 THR CA C 13 59.944 0.2 . 1 . . . . 1716 Thr CA . 17110 1 1495 . 1 1 129 129 THR CB C 13 70.771 0.2 . 1 . . . . 1716 Thr CB . 17110 1 1496 . 1 1 129 129 THR CG2 C 13 21.050 0.2 . 1 . . . . 1716 Thr CG2 . 17110 1 1497 . 1 1 129 129 THR N N 15 101.452 0.05 . 1 . . . . 1716 Thr N . 17110 1 1498 . 1 1 130 130 CYS H H 1 7.755 0.05 . 1 . . . . 1717 Cys H . 17110 1 1499 . 1 1 130 130 CYS HA H 1 3.592 0.05 . 1 . . . . 1717 Cys HA . 17110 1 1500 . 1 1 130 130 CYS HB2 H 1 2.669 0.05 . 2 . . . . 1717 Cys HB2 . 17110 1 1501 . 1 1 130 130 CYS HB3 H 1 2.409 0.05 . 2 . . . . 1717 Cys HB3 . 17110 1 1502 . 1 1 130 130 CYS CA C 13 59.174 0.2 . 1 . . . . 1717 Cys CA . 17110 1 1503 . 1 1 130 130 CYS CB C 13 37.638 0.2 . 1 . . . . 1717 Cys CB . 17110 1 1504 . 1 1 130 130 CYS N N 15 115.395 0.05 . 1 . . . . 1717 Cys N . 17110 1 1505 . 1 1 131 131 THR H H 1 7.048 0.05 . 1 . . . . 1718 Thr H . 17110 1 1506 . 1 1 131 131 THR HA H 1 4.951 0.05 . 1 . . . . 1718 Thr HA . 17110 1 1507 . 1 1 131 131 THR HB H 1 3.512 0.05 . 1 . . . . 1718 Thr HB . 17110 1 1508 . 1 1 131 131 THR HG21 H 1 0.339 0.05 . 1 . . . . 1718 Thr HG21 . 17110 1 1509 . 1 1 131 131 THR HG22 H 1 0.339 0.05 . 1 . . . . 1718 Thr HG22 . 17110 1 1510 . 1 1 131 131 THR HG23 H 1 0.339 0.05 . 1 . . . . 1718 Thr HG23 . 17110 1 1511 . 1 1 131 131 THR CA C 13 59.932 0.2 . 1 . . . . 1718 Thr CA . 17110 1 1512 . 1 1 131 131 THR CB C 13 69.850 0.2 . 1 . . . . 1718 Thr CB . 17110 1 1513 . 1 1 131 131 THR CG2 C 13 21.270 0.2 . 1 . . . . 1718 Thr CG2 . 17110 1 1514 . 1 1 132 132 SER H H 1 7.745 0.05 . 1 . . . . 1719 Ser H . 17110 1 1515 . 1 1 132 132 SER HA H 1 5.224 0.05 . 1 . . . . 1719 Ser HA . 17110 1 1516 . 1 1 132 132 SER C C 13 171.889 0.2 . 1 . . . . 1719 Ser C . 17110 1 1517 . 1 1 132 132 SER CA C 13 59.461 0.2 . 1 . . . . 1719 Ser CA . 17110 1 1518 . 1 1 132 132 SER CB C 13 65.710 0.2 . 1 . . . . 1719 Ser CB . 17110 1 1519 . 1 1 132 132 SER N N 15 115.713 0.05 . 1 . . . . 1719 Ser N . 17110 1 1520 . 1 1 133 133 TYR H H 1 8.796 0.05 . 1 . . . . 1720 Tyr H . 17110 1 1521 . 1 1 133 133 TYR HA H 1 5.032 0.05 . 1 . . . . 1720 Tyr HA . 17110 1 1522 . 1 1 133 133 TYR HB2 H 1 2.703 0.05 . 2 . . . . 1720 Tyr HB2 . 17110 1 1523 . 1 1 133 133 TYR HB3 H 1 2.621 0.05 . 2 . . . . 1720 Tyr HB3 . 17110 1 1524 . 1 1 133 133 TYR HD1 H 1 6.938 0.05 . 3 . . . . 1720 Tyr HD1 . 17110 1 1525 . 1 1 133 133 TYR HD2 H 1 6.938 0.05 . 3 . . . . 1720 Tyr HD2 . 17110 1 1526 . 1 1 133 133 TYR HE1 H 1 6.244 0.05 . 3 . . . . 1720 Tyr HE1 . 17110 1 1527 . 1 1 133 133 TYR HE2 H 1 6.244 0.05 . 3 . . . . 1720 Tyr HE2 . 17110 1 1528 . 1 1 133 133 TYR C C 13 174.284 0.2 . 1 . . . . 1720 Tyr C . 17110 1 1529 . 1 1 133 133 TYR CA C 13 58.342 0.2 . 1 . . . . 1720 Tyr CA . 17110 1 1530 . 1 1 133 133 TYR CB C 13 40.513 0.2 . 1 . . . . 1720 Tyr CB . 17110 1 1531 . 1 1 133 133 TYR CD1 C 13 133.884 0.2 . 3 . . . . 1720 Tyr CD1 . 17110 1 1532 . 1 1 133 133 TYR CD2 C 13 133.884 0.2 . 3 . . . . 1720 Tyr CD2 . 17110 1 1533 . 1 1 133 133 TYR CE1 C 13 118.103 0.2 . 3 . . . . 1720 Tyr CE1 . 17110 1 1534 . 1 1 133 133 TYR CE2 C 13 118.103 0.2 . 3 . . . . 1720 Tyr CE2 . 17110 1 1535 . 1 1 133 133 TYR N N 15 121.880 0.05 . 1 . . . . 1720 Tyr N . 17110 1 1536 . 1 1 134 134 PHE H H 1 9.074 0.05 . 1 . . . . 1721 Phe H . 17110 1 1537 . 1 1 134 134 PHE HA H 1 5.271 0.05 . 1 . . . . 1721 Phe HA . 17110 1 1538 . 1 1 134 134 PHE HB2 H 1 2.292 0.05 . 2 . . . . 1721 Phe HB2 . 17110 1 1539 . 1 1 134 134 PHE HB3 H 1 1.858 0.05 . 2 . . . . 1721 Phe HB3 . 17110 1 1540 . 1 1 134 134 PHE HD1 H 1 6.610 0.05 . 3 . . . . 1721 Phe HD1 . 17110 1 1541 . 1 1 134 134 PHE HD2 H 1 6.610 0.05 . 3 . . . . 1721 Phe HD2 . 17110 1 1542 . 1 1 134 134 PHE HE1 H 1 7.094 0.05 . 3 . . . . 1721 Phe HE1 . 17110 1 1543 . 1 1 134 134 PHE HE2 H 1 7.094 0.05 . 3 . . . . 1721 Phe HE2 . 17110 1 1544 . 1 1 134 134 PHE C C 13 176.195 0.2 . 1 . . . . 1721 Phe C . 17110 1 1545 . 1 1 134 134 PHE CA C 13 56.007 0.2 . 1 . . . . 1721 Phe CA . 17110 1 1546 . 1 1 134 134 PHE CB C 13 44.061 0.2 . 1 . . . . 1721 Phe CB . 17110 1 1547 . 1 1 134 134 PHE N N 15 118.008 0.05 . 1 . . . . 1721 Phe N . 17110 1 1548 . 1 1 135 135 SER H H 1 9.081 0.05 . 1 . . . . 1722 Ser H . 17110 1 1549 . 1 1 135 135 SER HA H 1 5.370 0.05 . 1 . . . . 1722 Ser HA . 17110 1 1550 . 1 1 135 135 SER HB2 H 1 3.768 0.05 . 2 . . . . 1722 Ser HB2 . 17110 1 1551 . 1 1 135 135 SER HB3 H 1 3.658 0.05 . 2 . . . . 1722 Ser HB3 . 17110 1 1552 . 1 1 135 135 SER C C 13 173.119 0.2 . 1 . . . . 1722 Ser C . 17110 1 1553 . 1 1 135 135 SER CA C 13 56.295 0.2 . 1 . . . . 1722 Ser CA . 17110 1 1554 . 1 1 135 135 SER CB C 13 65.933 0.2 . 1 . . . . 1722 Ser CB . 17110 1 1555 . 1 1 135 135 SER N N 15 115.439 0.05 . 1 . . . . 1722 Ser N . 17110 1 1556 . 1 1 136 136 TRP H H 1 8.819 0.05 . 1 . . . . 1723 Trp H . 17110 1 1557 . 1 1 136 136 TRP HA H 1 4.899 0.05 . 1 . . . . 1723 Trp HA . 17110 1 1558 . 1 1 136 136 TRP HB2 H 1 3.167 0.05 . 2 . . . . 1723 Trp HB2 . 17110 1 1559 . 1 1 136 136 TRP HB3 H 1 2.522 0.05 . 2 . . . . 1723 Trp HB3 . 17110 1 1560 . 1 1 136 136 TRP HD1 H 1 6.908 0.05 . 1 . . . . 1723 Trp HD1 . 17110 1 1561 . 1 1 136 136 TRP HE1 H 1 9.781 0.05 . 1 . . . . 1723 Trp HE1 . 17110 1 1562 . 1 1 136 136 TRP HE3 H 1 7.076 0.05 . 1 . . . . 1723 Trp HE3 . 17110 1 1563 . 1 1 136 136 TRP HZ2 H 1 7.254 0.05 . 1 . . . . 1723 Trp HZ2 . 17110 1 1564 . 1 1 136 136 TRP HZ3 H 1 7.324 0.05 . 1 . . . . 1723 Trp HZ3 . 17110 1 1565 . 1 1 136 136 TRP C C 13 175.230 0.2 . 1 . . . . 1723 Trp C . 17110 1 1566 . 1 1 136 136 TRP CA C 13 56.336 0.2 . 1 . . . . 1723 Trp CA . 17110 1 1567 . 1 1 136 136 TRP CB C 13 32.338 0.2 . 1 . . . . 1723 Trp CB . 17110 1 1568 . 1 1 136 136 TRP N N 15 126.821 0.05 . 1 . . . . 1723 Trp N . 17110 1 1569 . 1 1 136 136 TRP NE1 N 15 127.401 0.05 . 1 . . . . 1723 Trp NE1 . 17110 1 1570 . 1 1 137 137 HIS H H 1 9.063 0.05 . 1 . . . . 1724 His H . 17110 1 1571 . 1 1 137 137 HIS HA H 1 5.523 0.05 . 1 . . . . 1724 His HA . 17110 1 1572 . 1 1 137 137 HIS HB2 H 1 3.321 0.05 . 2 . . . . 1724 His HB2 . 17110 1 1573 . 1 1 137 137 HIS HB3 H 1 2.935 0.05 . 2 . . . . 1724 His HB3 . 17110 1 1574 . 1 1 137 137 HIS C C 13 174.134 0.2 . 1 . . . . 1724 His C . 17110 1 1575 . 1 1 137 137 HIS CA C 13 55.728 0.2 . 1 . . . . 1724 His CA . 17110 1 1576 . 1 1 137 137 HIS CB C 13 29.439 0.2 . 1 . . . . 1724 His CB . 17110 1 1577 . 1 1 137 137 HIS N N 15 126.806 0.05 . 1 . . . . 1724 His N . 17110 1 1578 . 1 1 138 138 THR H H 1 9.096 0.05 . 1 . . . . 1725 Thr H . 17110 1 1579 . 1 1 138 138 THR HA H 1 5.208 0.05 . 1 . . . . 1725 Thr HA . 17110 1 1580 . 1 1 138 138 THR HB H 1 4.288 0.05 . 1 . . . . 1725 Thr HB . 17110 1 1581 . 1 1 138 138 THR HG21 H 1 1.094 0.05 . 1 . . . . 1725 Thr HG21 . 17110 1 1582 . 1 1 138 138 THR HG22 H 1 1.094 0.05 . 1 . . . . 1725 Thr HG22 . 17110 1 1583 . 1 1 138 138 THR HG23 H 1 1.094 0.05 . 1 . . . . 1725 Thr HG23 . 17110 1 1584 . 1 1 138 138 THR C C 13 174.653 0.2 . 1 . . . . 1725 Thr C . 17110 1 1585 . 1 1 138 138 THR CA C 13 59.146 0.2 . 1 . . . . 1725 Thr CA . 17110 1 1586 . 1 1 138 138 THR CB C 13 68.767 0.2 . 1 . . . . 1725 Thr CB . 17110 1 1587 . 1 1 138 138 THR CG2 C 13 19.080 0.2 . 1 . . . . 1725 Thr CG2 . 17110 1 1588 . 1 1 138 138 THR N N 15 118.539 0.05 . 1 . . . . 1725 Thr N . 17110 1 1589 . 1 1 139 139 SER H H 1 9.333 0.05 . 1 . . . . 1726 Ser H . 17110 1 1590 . 1 1 139 139 SER HA H 1 4.544 0.05 . 1 . . . . 1726 Ser HA . 17110 1 1591 . 1 1 139 139 SER HB2 H 1 4.103 0.05 . 2 . . . . 1726 Ser HB2 . 17110 1 1592 . 1 1 139 139 SER HB3 H 1 4.202 0.05 . 2 . . . . 1726 Ser HB3 . 17110 1 1593 . 1 1 139 139 SER C C 13 173.496 0.2 . 1 . . . . 1726 Ser C . 17110 1 1594 . 1 1 139 139 SER CA C 13 61.713 0.2 . 1 . . . . 1726 Ser CA . 17110 1 1595 . 1 1 139 139 SER CB C 13 69.669 0.2 . 1 . . . . 1726 Ser CB . 17110 1 1596 . 1 1 139 139 SER N N 15 129.139 0.05 . 1 . . . . 1726 Ser N . 17110 1 1597 . 1 1 140 140 LEU H H 1 7.960 0.05 . 1 . . . . 1727 Leu H . 17110 1 1598 . 1 1 140 140 LEU HA H 1 4.260 0.05 . 1 . . . . 1727 Leu HA . 17110 1 1599 . 1 1 140 140 LEU HB2 H 1 1.467 0.05 . 1 . . . . 1727 Leu HB2 . 17110 1 1600 . 1 1 140 140 LEU HB3 H 1 1.467 0.05 . 1 . . . . 1727 Leu HB3 . 17110 1 1601 . 1 1 140 140 LEU HD11 H 1 0.870 0.05 . 2 . . . . 1727 Leu HD11 . 17110 1 1602 . 1 1 140 140 LEU HD12 H 1 0.870 0.05 . 2 . . . . 1727 Leu HD12 . 17110 1 1603 . 1 1 140 140 LEU HD13 H 1 0.870 0.05 . 2 . . . . 1727 Leu HD13 . 17110 1 1604 . 1 1 140 140 LEU HD21 H 1 0.630 0.05 . 2 . . . . 1727 Leu HD21 . 17110 1 1605 . 1 1 140 140 LEU HD22 H 1 0.630 0.05 . 2 . . . . 1727 Leu HD22 . 17110 1 1606 . 1 1 140 140 LEU HD23 H 1 0.630 0.05 . 2 . . . . 1727 Leu HD23 . 17110 1 1607 . 1 1 140 140 LEU HG H 1 1.244 0.05 . 1 . . . . 1727 Leu HG . 17110 1 1608 . 1 1 140 140 LEU C C 13 177.027 0.2 . 1 . . . . 1727 Leu C . 17110 1 1609 . 1 1 140 140 LEU CA C 13 56.404 0.2 . 1 . . . . 1727 Leu CA . 17110 1 1610 . 1 1 140 140 LEU CB C 13 42.500 0.2 . 1 . . . . 1727 Leu CB . 17110 1 1611 . 1 1 140 140 LEU CD1 C 13 21.737 0.2 . 2 . . . . 1727 Leu CD1 . 17110 1 1612 . 1 1 140 140 LEU CD2 C 13 25.065 0.2 . 2 . . . . 1727 Leu CD2 . 17110 1 1613 . 1 1 140 140 LEU CG C 13 27.557 0.2 . 1 . . . . 1727 Leu CG . 17110 1 1614 . 1 1 140 140 LEU N N 15 129.802 0.05 . 1 . . . . 1727 Leu N . 17110 1 1615 . 1 1 141 141 ALA H H 1 7.098 0.05 . 1 . . . . 1728 Ala H . 17110 1 1616 . 1 1 141 141 ALA HA H 1 4.557 0.05 . 1 . . . . 1728 Ala HA . 17110 1 1617 . 1 1 141 141 ALA HB1 H 1 1.174 0.05 . 1 . . . . 1728 Ala HB1 . 17110 1 1618 . 1 1 141 141 ALA HB2 H 1 1.174 0.05 . 1 . . . . 1728 Ala HB2 . 17110 1 1619 . 1 1 141 141 ALA HB3 H 1 1.174 0.05 . 1 . . . . 1728 Ala HB3 . 17110 1 1620 . 1 1 141 141 ALA C C 13 174.832 0.2 . 1 . . . . 1728 Ala C . 17110 1 1621 . 1 1 141 141 ALA CA C 13 51.269 0.2 . 1 . . . . 1728 Ala CA . 17110 1 1622 . 1 1 141 141 ALA CB C 13 18.776 0.2 . 1 . . . . 1728 Ala CB . 17110 1 1623 . 1 1 141 141 ALA N N 15 116.397 0.05 . 1 . . . . 1728 Ala N . 17110 1 1624 . 1 1 142 142 CYS H H 1 7.522 0.05 . 1 . . . . 1729 Cys H . 17110 1 1625 . 1 1 142 142 CYS HA H 1 4.865 0.05 . 1 . . . . 1729 Cys HA . 17110 1 1626 . 1 1 142 142 CYS HB2 H 1 3.350 0.05 . 2 . . . . 1729 Cys HB2 . 17110 1 1627 . 1 1 142 142 CYS HB3 H 1 3.123 0.05 . 2 . . . . 1729 Cys HB3 . 17110 1 1628 . 1 1 142 142 CYS C C 13 173.691 0.2 . 1 . . . . 1729 Cys C . 17110 1 1629 . 1 1 142 142 CYS CA C 13 54.366 0.2 . 1 . . . . 1729 Cys CA . 17110 1 1630 . 1 1 142 142 CYS CB C 13 42.688 0.2 . 1 . . . . 1729 Cys CB . 17110 1 1631 . 1 1 142 142 CYS N N 15 116.488 0.05 . 1 . . . . 1729 Cys N . 17110 1 1632 . 1 1 143 143 GLU H H 1 8.965 0.05 . 1 . . . . 1730 Glu H . 17110 1 1633 . 1 1 143 143 GLU HA H 1 3.673 0.05 . 1 . . . . 1730 Glu HA . 17110 1 1634 . 1 1 143 143 GLU HB2 H 1 1.651 0.05 . 1 . . . . 1730 Glu HB2 . 17110 1 1635 . 1 1 143 143 GLU HB3 H 1 1.651 0.05 . 1 . . . . 1730 Glu HB3 . 17110 1 1636 . 1 1 143 143 GLU HG2 H 1 1.685 0.05 . 2 . . . . 1730 Glu HG2 . 17110 1 1637 . 1 1 143 143 GLU HG3 H 1 1.893 0.05 . 2 . . . . 1730 Glu HG3 . 17110 1 1638 . 1 1 143 143 GLU C C 13 174.885 0.2 . 1 . . . . 1730 Glu C . 17110 1 1639 . 1 1 143 143 GLU CA C 13 56.062 0.2 . 1 . . . . 1730 Glu CA . 17110 1 1640 . 1 1 143 143 GLU CB C 13 30.789 0.2 . 1 . . . . 1730 Glu CB . 17110 1 1641 . 1 1 143 143 GLU CG C 13 35.663 0.2 . 1 . . . . 1730 Glu CG . 17110 1 1642 . 1 1 143 143 GLU N N 15 122.883 0.05 . 1 . . . . 1730 Glu N . 17110 1 1643 . 1 1 144 144 GLU H H 1 8.178 0.05 . 1 . . . . 1731 Glu H . 17110 1 1644 . 1 1 144 144 GLU HA H 1 4.264 0.05 . 1 . . . . 1731 Glu HA . 17110 1 1645 . 1 1 144 144 GLU HB2 H 1 1.981 0.05 . 2 . . . . 1731 Glu HB2 . 17110 1 1646 . 1 1 144 144 GLU HB3 H 1 1.921 0.05 . 2 . . . . 1731 Glu HB3 . 17110 1 1647 . 1 1 144 144 GLU HG2 H 1 2.229 0.05 . 1 . . . . 1731 Glu HG2 . 17110 1 1648 . 1 1 144 144 GLU HG3 H 1 2.229 0.05 . 1 . . . . 1731 Glu HG3 . 17110 1 1649 . 1 1 144 144 GLU C C 13 176.075 0.2 . 1 . . . . 1731 Glu C . 17110 1 1650 . 1 1 144 144 GLU CA C 13 56.174 0.2 . 1 . . . . 1731 Glu CA . 17110 1 1651 . 1 1 144 144 GLU CB C 13 30.475 0.2 . 1 . . . . 1731 Glu CB . 17110 1 1652 . 1 1 144 144 GLU CG C 13 35.729 0.2 . 1 . . . . 1731 Glu CG . 17110 1 1653 . 1 1 144 144 GLU N N 15 120.355 0.05 . 1 . . . . 1731 Glu N . 17110 1 1654 . 1 1 145 145 GLU H H 1 8.572 0.05 . 1 . . . . 1732 Glu H . 17110 1 1655 . 1 1 145 145 GLU HA H 1 4.257 0.05 . 1 . . . . 1732 Glu HA . 17110 1 1656 . 1 1 145 145 GLU HB2 H 1 1.967 0.05 . 1 . . . . 1732 Glu HB2 . 17110 1 1657 . 1 1 145 145 GLU HB3 H 1 1.967 0.05 . 1 . . . . 1732 Glu HB3 . 17110 1 1658 . 1 1 145 145 GLU HG2 H 1 2.279 0.05 . 1 . . . . 1732 Glu HG2 . 17110 1 1659 . 1 1 145 145 GLU HG3 H 1 2.279 0.05 . 1 . . . . 1732 Glu HG3 . 17110 1 1660 . 1 1 145 145 GLU C C 13 176.239 0.2 . 1 . . . . 1732 Glu C . 17110 1 1661 . 1 1 145 145 GLU CA C 13 56.613 0.2 . 1 . . . . 1732 Glu CA . 17110 1 1662 . 1 1 145 145 GLU CB C 13 30.356 0.2 . 1 . . . . 1732 Glu CB . 17110 1 1663 . 1 1 145 145 GLU CG C 13 35.558 0.2 . 1 . . . . 1732 Glu CG . 17110 1 1664 . 1 1 145 145 GLU N N 15 122.189 0.05 . 1 . . . . 1732 Glu N . 17110 1 1665 . 1 1 146 146 VAL H H 1 8.188 0.05 . 1 . . . . 1733 Val H . 17110 1 1666 . 1 1 146 146 VAL HA H 1 4.408 0.05 . 1 . . . . 1733 Val HA . 17110 1 1667 . 1 1 146 146 VAL HB H 1 2.052 0.05 . 1 . . . . 1733 Val HB . 17110 1 1668 . 1 1 146 146 VAL HG11 H 1 0.932 0.05 . 2 . . . . 1733 Val HG11 . 17110 1 1669 . 1 1 146 146 VAL HG12 H 1 0.932 0.05 . 2 . . . . 1733 Val HG12 . 17110 1 1670 . 1 1 146 146 VAL HG13 H 1 0.932 0.05 . 2 . . . . 1733 Val HG13 . 17110 1 1671 . 1 1 146 146 VAL HG21 H 1 0.925 0.05 . 2 . . . . 1733 Val HG21 . 17110 1 1672 . 1 1 146 146 VAL HG22 H 1 0.925 0.05 . 2 . . . . 1733 Val HG22 . 17110 1 1673 . 1 1 146 146 VAL HG23 H 1 0.925 0.05 . 2 . . . . 1733 Val HG23 . 17110 1 1674 . 1 1 146 146 VAL CA C 13 59.902 0.2 . 1 . . . . 1733 Val CA . 17110 1 1675 . 1 1 146 146 VAL CB C 13 32.619 0.2 . 1 . . . . 1733 Val CB . 17110 1 1676 . 1 1 146 146 VAL CG1 C 13 20.610 0.2 . 2 . . . . 1733 Val CG1 . 17110 1 1677 . 1 1 146 146 VAL CG2 C 13 20.660 0.2 . 2 . . . . 1733 Val CG2 . 17110 1 1678 . 1 1 146 146 VAL N N 15 122.371 0.05 . 1 . . . . 1733 Val N . 17110 1 1679 . 1 1 147 147 PRO HA H 1 4.361 0.05 . 1 . . . . 1734 Pro HA . 17110 1 1680 . 1 1 147 147 PRO HB2 H 1 2.254 0.05 . 2 . . . . 1734 Pro HB2 . 17110 1 1681 . 1 1 147 147 PRO HB3 H 1 1.769 0.05 . 2 . . . . 1734 Pro HB3 . 17110 1 1682 . 1 1 147 147 PRO HD2 H 1 3.866 0.05 . 2 . . . . 1734 Pro HD2 . 17110 1 1683 . 1 1 147 147 PRO HD3 H 1 3.645 0.05 . 2 . . . . 1734 Pro HD3 . 17110 1 1684 . 1 1 147 147 PRO HG2 H 1 2.007 0.05 . 2 . . . . 1734 Pro HG2 . 17110 1 1685 . 1 1 147 147 PRO HG3 H 1 1.994 0.05 . 2 . . . . 1734 Pro HG3 . 17110 1 1686 . 1 1 147 147 PRO C C 13 176.991 0.2 . 1 . . . . 1734 Pro C . 17110 1 1687 . 1 1 147 147 PRO CA C 13 63.193 0.2 . 1 . . . . 1734 Pro CA . 17110 1 1688 . 1 1 147 147 PRO CB C 13 30.871 0.2 . 1 . . . . 1734 Pro CB . 17110 1 1689 . 1 1 147 147 PRO CD C 13 50.669 0.2 . 1 . . . . 1734 Pro CD . 17110 1 1690 . 1 1 147 147 PRO CG C 13 27.108 0.2 . 1 . . . . 1734 Pro CG . 17110 1 1691 . 1 1 148 148 ARG H H 1 8.371 0.05 . 1 . . . . 1735 Arg H . 17110 1 1692 . 1 1 148 148 ARG HA H 1 4.232 0.05 . 1 . . . . 1735 Arg HA . 17110 1 1693 . 1 1 148 148 ARG HB2 H 1 1.690 0.05 . 1 . . . . 1735 Arg HB2 . 17110 1 1694 . 1 1 148 148 ARG HB3 H 1 1.690 0.05 . 1 . . . . 1735 Arg HB3 . 17110 1 1695 . 1 1 148 148 ARG HD2 H 1 3.172 0.05 . 2 . . . . 1735 Arg HD2 . 17110 1 1696 . 1 1 148 148 ARG HD3 H 1 3.171 0.05 . 2 . . . . 1735 Arg HD3 . 17110 1 1697 . 1 1 148 148 ARG HE H 1 7.267 0.05 . 1 . . . . 1735 Arg HE . 17110 1 1698 . 1 1 148 148 ARG HG2 H 1 1.581 0.05 . 1 . . . . 1735 Arg HG2 . 17110 1 1699 . 1 1 148 148 ARG HG3 H 1 1.581 0.05 . 1 . . . . 1735 Arg HG3 . 17110 1 1700 . 1 1 148 148 ARG CA C 13 55.930 0.2 . 1 . . . . 1735 Arg CA . 17110 1 1701 . 1 1 148 148 ARG CB C 13 32.083 0.2 . 1 . . . . 1735 Arg CB . 17110 1 1702 . 1 1 148 148 ARG CD C 13 42.647 0.2 . 1 . . . . 1735 Arg CD . 17110 1 1703 . 1 1 148 148 ARG CG C 13 27.125 0.2 . 1 . . . . 1735 Arg CG . 17110 1 1704 . 1 1 148 148 ARG N N 15 120.079 0.05 . 1 . . . . 1735 Arg N . 17110 1 1705 . 1 1 148 148 ARG NE N 15 84.375 0.05 . 1 . . . . 1735 Arg NE . 17110 1 stop_ save_