data_17127 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17127 _Entry.Title ; COMPLEX STRUCTURE OF E4 mutant HUMAN IGF2R DOMAIN 11 BOUND TO IGF-II ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-08-13 _Entry.Accession_date 2010-08-13 _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 'Solution structure of IGF-II in complex with the mutant form of human domain 11 from the 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 . . . 17127 2 Hans Hoppe . . . 17127 3 Dellel Rezgui . . . 17127 4 Madeline Strickland . . . 17127 5 Susana Frago . . . 17127 6 Rosamund Ellis . Z. . 17127 7 Pakorn Wattana-Amorn . . . 17127 8 Stuart Prince . N. . 17127 9 Oliver Zaccheo . J. . 17127 10 Briony Forbes . . . 17127 11 E. Jones . Yvonne . 17127 12 Matthew Crump . P. . 17127 13 A. Hassan . Bassim . 17127 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' . 17127 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Genomic imprinting' . 17127 'Insulin-like growth factor 2' . 17127 'ligand trap' . 17127 'mannose 6 phosphate receptor' . 17127 'NMR complex structure' . 17127 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17127 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 768 17127 '15N chemical shifts' 215 17127 '1H chemical shifts' 1282 17127 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 2010-08-13 update author 'update entry citation' 17127 1 . . 2012-08-30 2010-08-13 original author 'original release' 17127 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2L29 'BMRB Entry Tracking System' 17127 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17127 _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 . . . 17127 1 2 Hans Hoppe . . . 17127 1 3 Dellel Rezgui . . . 17127 1 4 Madeline Strickland . . . 17127 1 5 Susana Frago . . . 17127 1 6 Rosamund Ellis . Z. . 17127 1 7 Pakorn Wattana-Amorn . . . 17127 1 8 Stuart Prince . N. . 17127 1 9 Oliver Zaccheo . J. . 17127 1 10 Briony Forbes . E. . 17127 1 11 E. Jones . Yvonne . 17127 1 12 Matthew Crump . P. . 17127 1 13 A. Hassan . Bassim . 17127 1 14 Frank Grutzner . . . 17127 1 15 Catherine Nolan . M. . 17127 1 16 Andrew Mungall . J. . 17127 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'CATION-INDEPENDENT MANNOSE-6-PHOSPHATE' 17127 1 'Genomic imprinting' 17127 1 'Insulin-like growth factor 2' 17127 1 'mannose 6 phosphate receptor' 17127 1 'NMR structure' 17127 1 'protein evolution' 17127 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17127 _Assembly.ID 1 _Assembly.Name 'IGF-II in complex with the mutant form of human domain 11' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'human domain 11' 1 $HD11 A . yes native no no . . . 17127 1 2 IGF2 2 $IGF2 B . yes native no no . . . 17127 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 . . 1516 CYS SG . . 1553 CYS SG 17127 1 2 disulfide single . 1 . 1 CYS 52 52 SG . 1 . 1 CYS 59 59 SG . . 1559 CYS SG . . 1566 CYS SG 17127 1 3 disulfide single . 1 . 1 CYS 91 91 SG . 1 . 1 CYS 127 127 SG . . 1598 CYS SG . . 1634 CYS SG 17127 1 4 disulfide single . 1 . 1 CYS 107 107 SG . 1 . 1 CYS 139 139 SG . . 1614 CYS SG . . 1646 CYS SG 17127 1 5 disulfide single . 2 . 2 CYS 9 9 SG . 2 . 2 CYS 47 47 SG . . . . . . . . . . 17127 1 6 disulfide single . 2 . 2 CYS 46 46 SG . 2 . 2 CYS 51 51 SG . . . . . . . . . . 17127 1 7 disulfide single . 2 . 2 CYS 21 21 SG . 2 . 2 CYS 60 60 SG . . . . . . . . . . 17127 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_HD11 _Entity.Sf_category entity _Entity.Sf_framecode HD11 _Entity.Entry_ID 17127 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name HD11 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MKSNEHDDCQVTNPSTGHLF DLSSLSGRAGFTAAYSKSGV VYMSICGENENCPPGVGACF GQTRISVGKANKRLRYVDQV LQLVYKDGSPCPSKSGLSYK SVISFVCRPEAGPTNRPMLI SLDKQTCTLFFSWHTPLACE PE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'Domain starts at residue K1509. C-terminal residues PE are vector derived residues' _Entity.Polymer_author_seq_details 'Mutated Domain 11 of the Cytoplasmic region of the Cation-independent mannose-6-phosphate receptor E4 IGF2R domain 11 in complex with IGF-II' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 142 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'Complexed E4 IGF2R domain 11' _Entity.Mutation 'Specific mutations in the AB loop region; E1544K, K1545S and L1547V' _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15434.610 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'Disulfide linkages: Cys1516-Cys1553, Cys1559-Cys-1566, Cys1598-Cys1634, Cys1614-1646' _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 BMRB 17128 . domain_11 . . . . . 100.00 142 100.00 100.00 1.76e-100 . . . . 17127 1 2 no BMRB 19117 . Domain_11 . . . . . 98.59 142 97.14 97.86 2.40e-95 . . . . 17127 1 3 no BMRB 19153 . IGF2R . . . . . 98.59 142 97.14 97.86 2.40e-95 . . . . 17127 1 4 no PDB 1E6F . "Human Mir-Receptor, Repeat 11" . . . . . 98.59 143 97.86 99.29 2.37e-97 . . . . 17127 1 5 no PDB 1GP0 . "Human Igf2r Domain 11" . . . . . 98.59 143 97.86 99.29 2.37e-97 . . . . 17127 1 6 no PDB 1GP3 . "Human Igf2r Domain 11" . . . . . 98.59 143 97.86 99.29 2.37e-97 . . . . 17127 1 7 no PDB 1GQB . "Human Mir-Receptor, Repeat 11" . . . . . 98.59 143 97.86 99.29 2.37e-97 . . . . 17127 1 8 no PDB 2CNJ . "Nmr Studies On The Interaction Of Insulin-Growth Factor Ii ( Igf-Ii) With Igf2r Domain 11" . . . . . 98.59 151 97.86 99.29 2.49e-97 . . . . 17127 1 9 no PDB 2L29 . "Complex Structure Of E4 Mutant Human Igf2r Domain 11 Bound To Igf-Ii" . . . . . 100.00 142 100.00 100.00 1.76e-100 . . . . 17127 1 10 no PDB 2L2A . "Mutated Domain 11 Of The Cytoplasmic Region Of The Cation-Independent Mannose-6-Phosphate Receptor" . . . . . 100.00 142 100.00 100.00 1.76e-100 . . . . 17127 1 11 no PDB 2M68 . "Nmr Solution Structure Ensemble Of 3-4d Mutant Domain 11 Igf2r In Complex With Igf2 (domain 11 Structure Only)" . . . . . 98.59 142 97.14 97.86 2.40e-95 . . . . 17127 1 12 no PDB 2M6T . "Nmr Solution Structure Ensemble Of 3-4d Mutant Domain 11 Igf2r" . . . . . 98.59 142 97.14 97.86 2.40e-95 . . . . 17127 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Domain 11 of IGF2R in complex with IGF-II' 17127 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1508 MET . 17127 1 2 1509 LYS . 17127 1 3 1510 SER . 17127 1 4 1511 ASN . 17127 1 5 1512 GLU . 17127 1 6 1513 HIS . 17127 1 7 1514 ASP . 17127 1 8 1515 ASP . 17127 1 9 1516 CYS . 17127 1 10 1517 GLN . 17127 1 11 1518 VAL . 17127 1 12 1519 THR . 17127 1 13 1520 ASN . 17127 1 14 1521 PRO . 17127 1 15 1522 SER . 17127 1 16 1523 THR . 17127 1 17 1524 GLY . 17127 1 18 1525 HIS . 17127 1 19 1526 LEU . 17127 1 20 1527 PHE . 17127 1 21 1528 ASP . 17127 1 22 1529 LEU . 17127 1 23 1530 SER . 17127 1 24 1531 SER . 17127 1 25 1532 LEU . 17127 1 26 1533 SER . 17127 1 27 1534 GLY . 17127 1 28 1535 ARG . 17127 1 29 1536 ALA . 17127 1 30 1537 GLY . 17127 1 31 1538 PHE . 17127 1 32 1539 THR . 17127 1 33 1540 ALA . 17127 1 34 1541 ALA . 17127 1 35 1542 TYR . 17127 1 36 1543 SER . 17127 1 37 1544 LYS . 17127 1 38 1545 SER . 17127 1 39 1546 GLY . 17127 1 40 1547 VAL . 17127 1 41 1548 VAL . 17127 1 42 1549 TYR . 17127 1 43 1550 MET . 17127 1 44 1551 SER . 17127 1 45 1552 ILE . 17127 1 46 1553 CYS . 17127 1 47 1554 GLY . 17127 1 48 1555 GLU . 17127 1 49 1556 ASN . 17127 1 50 1557 GLU . 17127 1 51 1558 ASN . 17127 1 52 1559 CYS . 17127 1 53 1560 PRO . 17127 1 54 1561 PRO . 17127 1 55 1562 GLY . 17127 1 56 1563 VAL . 17127 1 57 1564 GLY . 17127 1 58 1565 ALA . 17127 1 59 1566 CYS . 17127 1 60 1567 PHE . 17127 1 61 1568 GLY . 17127 1 62 1569 GLN . 17127 1 63 1570 THR . 17127 1 64 1571 ARG . 17127 1 65 1572 ILE . 17127 1 66 1573 SER . 17127 1 67 1574 VAL . 17127 1 68 1575 GLY . 17127 1 69 1576 LYS . 17127 1 70 1577 ALA . 17127 1 71 1578 ASN . 17127 1 72 1579 LYS . 17127 1 73 1580 ARG . 17127 1 74 1581 LEU . 17127 1 75 1582 ARG . 17127 1 76 1583 TYR . 17127 1 77 1584 VAL . 17127 1 78 1585 ASP . 17127 1 79 1586 GLN . 17127 1 80 1587 VAL . 17127 1 81 1588 LEU . 17127 1 82 1589 GLN . 17127 1 83 1590 LEU . 17127 1 84 1591 VAL . 17127 1 85 1592 TYR . 17127 1 86 1593 LYS . 17127 1 87 1594 ASP . 17127 1 88 1595 GLY . 17127 1 89 1596 SER . 17127 1 90 1597 PRO . 17127 1 91 1598 CYS . 17127 1 92 1599 PRO . 17127 1 93 1600 SER . 17127 1 94 1601 LYS . 17127 1 95 1602 SER . 17127 1 96 1603 GLY . 17127 1 97 1604 LEU . 17127 1 98 1605 SER . 17127 1 99 1606 TYR . 17127 1 100 1607 LYS . 17127 1 101 1608 SER . 17127 1 102 1609 VAL . 17127 1 103 1610 ILE . 17127 1 104 1611 SER . 17127 1 105 1612 PHE . 17127 1 106 1613 VAL . 17127 1 107 1614 CYS . 17127 1 108 1615 ARG . 17127 1 109 1616 PRO . 17127 1 110 1617 GLU . 17127 1 111 1618 ALA . 17127 1 112 1619 GLY . 17127 1 113 1620 PRO . 17127 1 114 1621 THR . 17127 1 115 1622 ASN . 17127 1 116 1623 ARG . 17127 1 117 1624 PRO . 17127 1 118 1625 MET . 17127 1 119 1626 LEU . 17127 1 120 1627 ILE . 17127 1 121 1628 SER . 17127 1 122 1629 LEU . 17127 1 123 1630 ASP . 17127 1 124 1631 LYS . 17127 1 125 1632 GLN . 17127 1 126 1633 THR . 17127 1 127 1634 CYS . 17127 1 128 1635 THR . 17127 1 129 1636 LEU . 17127 1 130 1637 PHE . 17127 1 131 1638 PHE . 17127 1 132 1639 SER . 17127 1 133 1640 TRP . 17127 1 134 1641 HIS . 17127 1 135 1642 THR . 17127 1 136 1643 PRO . 17127 1 137 1644 LEU . 17127 1 138 1645 ALA . 17127 1 139 1646 CYS . 17127 1 140 1647 GLU . 17127 1 141 1648 PRO . 17127 1 142 1649 GLU . 17127 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 17127 1 . LYS 2 2 17127 1 . SER 3 3 17127 1 . ASN 4 4 17127 1 . GLU 5 5 17127 1 . HIS 6 6 17127 1 . ASP 7 7 17127 1 . ASP 8 8 17127 1 . CYS 9 9 17127 1 . GLN 10 10 17127 1 . VAL 11 11 17127 1 . THR 12 12 17127 1 . ASN 13 13 17127 1 . PRO 14 14 17127 1 . SER 15 15 17127 1 . THR 16 16 17127 1 . GLY 17 17 17127 1 . HIS 18 18 17127 1 . LEU 19 19 17127 1 . PHE 20 20 17127 1 . ASP 21 21 17127 1 . LEU 22 22 17127 1 . SER 23 23 17127 1 . SER 24 24 17127 1 . LEU 25 25 17127 1 . SER 26 26 17127 1 . GLY 27 27 17127 1 . ARG 28 28 17127 1 . ALA 29 29 17127 1 . GLY 30 30 17127 1 . PHE 31 31 17127 1 . THR 32 32 17127 1 . ALA 33 33 17127 1 . ALA 34 34 17127 1 . TYR 35 35 17127 1 . SER 36 36 17127 1 . LYS 37 37 17127 1 . SER 38 38 17127 1 . GLY 39 39 17127 1 . VAL 40 40 17127 1 . VAL 41 41 17127 1 . TYR 42 42 17127 1 . MET 43 43 17127 1 . SER 44 44 17127 1 . ILE 45 45 17127 1 . CYS 46 46 17127 1 . GLY 47 47 17127 1 . GLU 48 48 17127 1 . ASN 49 49 17127 1 . GLU 50 50 17127 1 . ASN 51 51 17127 1 . CYS 52 52 17127 1 . PRO 53 53 17127 1 . PRO 54 54 17127 1 . GLY 55 55 17127 1 . VAL 56 56 17127 1 . GLY 57 57 17127 1 . ALA 58 58 17127 1 . CYS 59 59 17127 1 . PHE 60 60 17127 1 . GLY 61 61 17127 1 . GLN 62 62 17127 1 . THR 63 63 17127 1 . ARG 64 64 17127 1 . ILE 65 65 17127 1 . SER 66 66 17127 1 . VAL 67 67 17127 1 . GLY 68 68 17127 1 . LYS 69 69 17127 1 . ALA 70 70 17127 1 . ASN 71 71 17127 1 . LYS 72 72 17127 1 . ARG 73 73 17127 1 . LEU 74 74 17127 1 . ARG 75 75 17127 1 . TYR 76 76 17127 1 . VAL 77 77 17127 1 . ASP 78 78 17127 1 . GLN 79 79 17127 1 . VAL 80 80 17127 1 . LEU 81 81 17127 1 . GLN 82 82 17127 1 . LEU 83 83 17127 1 . VAL 84 84 17127 1 . TYR 85 85 17127 1 . LYS 86 86 17127 1 . ASP 87 87 17127 1 . GLY 88 88 17127 1 . SER 89 89 17127 1 . PRO 90 90 17127 1 . CYS 91 91 17127 1 . PRO 92 92 17127 1 . SER 93 93 17127 1 . LYS 94 94 17127 1 . SER 95 95 17127 1 . GLY 96 96 17127 1 . LEU 97 97 17127 1 . SER 98 98 17127 1 . TYR 99 99 17127 1 . LYS 100 100 17127 1 . SER 101 101 17127 1 . VAL 102 102 17127 1 . ILE 103 103 17127 1 . SER 104 104 17127 1 . PHE 105 105 17127 1 . VAL 106 106 17127 1 . CYS 107 107 17127 1 . ARG 108 108 17127 1 . PRO 109 109 17127 1 . GLU 110 110 17127 1 . ALA 111 111 17127 1 . GLY 112 112 17127 1 . PRO 113 113 17127 1 . THR 114 114 17127 1 . ASN 115 115 17127 1 . ARG 116 116 17127 1 . PRO 117 117 17127 1 . MET 118 118 17127 1 . LEU 119 119 17127 1 . ILE 120 120 17127 1 . SER 121 121 17127 1 . LEU 122 122 17127 1 . ASP 123 123 17127 1 . LYS 124 124 17127 1 . GLN 125 125 17127 1 . THR 126 126 17127 1 . CYS 127 127 17127 1 . THR 128 128 17127 1 . LEU 129 129 17127 1 . PHE 130 130 17127 1 . PHE 131 131 17127 1 . SER 132 132 17127 1 . TRP 133 133 17127 1 . HIS 134 134 17127 1 . THR 135 135 17127 1 . PRO 136 136 17127 1 . LEU 137 137 17127 1 . ALA 138 138 17127 1 . CYS 139 139 17127 1 . GLU 140 140 17127 1 . PRO 141 141 17127 1 . GLU 142 142 17127 1 stop_ save_ save_IGF2 _Entity.Sf_category entity _Entity.Sf_framecode IGF2 _Entity.Entry_ID 17127 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name IGF2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AYRPSETLCGGELVDTLQFV CGDRGFYFSRPASRVSRRSR GIVEECCFRSCDLALLETYC ATPAKSE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 67 _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 _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 7484.514 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-30 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes PDB 1IGL . . . . . . . . . . . . . . . . 17127 2 2 no PDB 1IGL . "Solution Structure Of Human Insulin-Like Growth Factor Ii Relationship To Receptor And Binding Protein Interactions" . . . . . 100.00 67 100.00 100.00 3.70e-39 . . . . 17127 2 3 no PDB 2L29 . "Complex Structure Of E4 Mutant Human Igf2r Domain 11 Bound To Igf-Ii" . . . . . 100.00 67 100.00 100.00 3.70e-39 . . . . 17127 2 4 no PDB 2V5P . "Complex Structure Of Human Igf2r Domains 11-13 Bound To Igf-Ii" . . . . . 100.00 67 100.00 100.00 3.70e-39 . . . . 17127 2 5 no PDB 3E4Z . "Crystal Structure Of Human Insulin Degrading Enzyme In Complex With Insulin-Like Growth Factor Ii" . . . . . 100.00 67 100.00 100.00 3.70e-39 . . . . 17127 2 6 no PDB 3KR3 . "Crystal Structure Of Igf-Ii Antibody Complex" . . . . . 100.00 67 100.00 100.00 3.70e-39 . . . . 17127 2 7 no DBJ BAF84283 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 180 98.51 100.00 1.47e-38 . . . . 17127 2 8 no DBJ BAG36657 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 9 no DBJ BAG54360 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 10 no DBJ BAI46830 . "insulin-like growth factor 2 [synthetic construct]" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 11 no DBJ BAO53964 . "insulin-like growth factor 2 [Equus caballus]" . . . . . 100.00 181 97.01 100.00 2.11e-38 . . . . 17127 2 12 no EMBL CAA04657 . "IGF2 protein [Callithrix jacchus]" . . . . . 100.00 72 98.51 98.51 2.15e-38 . . . . 17127 2 13 no EMBL CAA25426 . "preproinsulin-like growth factor II [Homo sapiens]" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 14 no EMBL CAA27156 . "unnamed protein product [Homo sapiens]" . . . . . 56.72 49 100.00 100.00 1.92e-16 . . . . 17127 2 15 no EMBL CAA27249 . "put. IGF-II [Homo sapiens]" . . . . . 100.00 180 100.00 100.00 5.05e-39 . . . . 17127 2 16 no EMBL CAA29516 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 17 no GB AAA52544 . "insulin-like growth factor II precursor [Homo sapiens]" . . . . . 100.00 180 100.00 100.00 5.33e-39 . . . . 17127 2 18 no GB AAA52545 . "insulin-like growth factor II precursor [Homo sapiens]" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 19 no GB AAA60088 . "insulin-like growth factor II [Homo sapiens]" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 20 no GB AAA73915 . "insulin-like growth factor II precursor, partial [Equus caballus]" . . . . . 100.00 93 97.01 100.00 1.65e-38 . . . . 17127 2 21 no GB AAB26479 . "insulin-like growth factor II, partial [Cavia porcellus]" . . . . . 100.00 128 100.00 100.00 3.84e-39 . . . . 17127 2 22 no PRF 0407244A:PDB=1GF2 . "insulin-like growth factor II" . . . . . 100.00 67 100.00 100.00 3.70e-39 . . . . 17127 2 23 no PRF 1009249A . "insulin-like growth factor II precursor" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 24 no PRF 1203258B . "insulin-like growth factor II" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 25 no PRF 1707201B . "insulin-like growth factor 2" . . . . . 100.00 67 98.51 100.00 7.66e-39 . . . . 17127 2 26 no PRF 1904317A . "insulin-like growth factor II" . . . . . 100.00 128 100.00 100.00 3.84e-39 . . . . 17127 2 27 no REF NP_000603 . "insulin-like growth factor II isoform 1 preproprotein [Homo sapiens]" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 28 no REF NP_001007140 . "insulin-like growth factor II isoform 1 preproprotein [Homo sapiens]" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 29 no REF NP_001108011 . "insulin-like growth factor II precursor [Equus caballus]" . . . . . 100.00 181 97.01 100.00 2.11e-38 . . . . 17127 2 30 no REF NP_001121070 . "insulin-like growth factor II isoform 2 [Homo sapiens]" . . . . . 100.00 236 100.00 100.00 5.86e-39 . . . . 17127 2 31 no REF NP_001164877 . "insulin-like growth factor II precursor [Oryctolagus cuniculus]" . . . . . 100.00 181 98.51 100.00 5.48e-39 . . . . 17127 2 32 no SP P01344 . "RecName: Full=Insulin-like growth factor II; Short=IGF-II; AltName: Full=Somatomedin-A; Contains: RecName: Full=Insulin-like gr" . . . . . 100.00 180 100.00 100.00 6.20e-39 . . . . 17127 2 33 no SP P23695 . "RecName: Full=Insulin-like growth factor II; Short=IGF-II; Contains: RecName: Full=Insulin-like growth factor II; Contains: Rec" . . . . . 100.00 181 98.51 100.00 1.91e-38 . . . . 17127 2 34 no SP P41694 . "RecName: Full=Insulin-like growth factor II; Short=IGF-II; Contains: RecName: Full=Insulin-like growth factor II; Contains: Rec" . . . . . 101.49 129 98.53 98.53 4.17e-37 . . . . 17127 2 35 no SP P51459 . "RecName: Full=Insulin-like growth factor II; Short=IGF-II; AltName: Full=Somatomedin-A; Contains: RecName: Full=Insulin-like gr" . . . . . 100.00 181 97.01 100.00 2.11e-38 . . . . 17127 2 36 no SP Q08279 . "RecName: Full=Insulin-like growth factor II; Short=IGF-II; AltName: Full=Somatomedin-A; Contains: RecName: Full=Insulin-like gr" . . . . . 100.00 128 100.00 100.00 3.84e-39 . . . . 17127 2 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Free IGF-II is regulated by IGF2R' 17127 2 'IGF-II act via the tyrosine kinase type 1 IGF receptor (IGF-1R) to promote cell survival and proliferation' 17127 2 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 . ALA . 17127 2 2 . TYR . 17127 2 3 . ARG . 17127 2 4 . PRO . 17127 2 5 . SER . 17127 2 6 . GLU . 17127 2 7 . THR . 17127 2 8 . LEU . 17127 2 9 . CYS . 17127 2 10 . GLY . 17127 2 11 . GLY . 17127 2 12 . GLU . 17127 2 13 . LEU . 17127 2 14 . VAL . 17127 2 15 . ASP . 17127 2 16 . THR . 17127 2 17 . LEU . 17127 2 18 . GLN . 17127 2 19 . PHE . 17127 2 20 . VAL . 17127 2 21 . CYS . 17127 2 22 . GLY . 17127 2 23 . ASP . 17127 2 24 . ARG . 17127 2 25 . GLY . 17127 2 26 . PHE . 17127 2 27 . TYR . 17127 2 28 . PHE . 17127 2 29 . SER . 17127 2 30 . ARG . 17127 2 31 . PRO . 17127 2 32 . ALA . 17127 2 33 . SER . 17127 2 34 . ARG . 17127 2 35 . VAL . 17127 2 36 . SER . 17127 2 37 . ARG . 17127 2 38 . ARG . 17127 2 39 . SER . 17127 2 40 . ARG . 17127 2 41 . GLY . 17127 2 42 . ILE . 17127 2 43 . VAL . 17127 2 44 . GLU . 17127 2 45 . GLU . 17127 2 46 . CYS . 17127 2 47 . CYS . 17127 2 48 . PHE . 17127 2 49 . ARG . 17127 2 50 . SER . 17127 2 51 . CYS . 17127 2 52 . ASP . 17127 2 53 . LEU . 17127 2 54 . ALA . 17127 2 55 . LEU . 17127 2 56 . LEU . 17127 2 57 . GLU . 17127 2 58 . THR . 17127 2 59 . TYR . 17127 2 60 . CYS . 17127 2 61 . ALA . 17127 2 62 . THR . 17127 2 63 . PRO . 17127 2 64 . ALA . 17127 2 65 . LYS . 17127 2 66 . SER . 17127 2 67 . GLU . 17127 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ALA 1 1 17127 2 . TYR 2 2 17127 2 . ARG 3 3 17127 2 . PRO 4 4 17127 2 . SER 5 5 17127 2 . GLU 6 6 17127 2 . THR 7 7 17127 2 . LEU 8 8 17127 2 . CYS 9 9 17127 2 . GLY 10 10 17127 2 . GLY 11 11 17127 2 . GLU 12 12 17127 2 . LEU 13 13 17127 2 . VAL 14 14 17127 2 . ASP 15 15 17127 2 . THR 16 16 17127 2 . LEU 17 17 17127 2 . GLN 18 18 17127 2 . PHE 19 19 17127 2 . VAL 20 20 17127 2 . CYS 21 21 17127 2 . GLY 22 22 17127 2 . ASP 23 23 17127 2 . ARG 24 24 17127 2 . GLY 25 25 17127 2 . PHE 26 26 17127 2 . TYR 27 27 17127 2 . PHE 28 28 17127 2 . SER 29 29 17127 2 . ARG 30 30 17127 2 . PRO 31 31 17127 2 . ALA 32 32 17127 2 . SER 33 33 17127 2 . ARG 34 34 17127 2 . VAL 35 35 17127 2 . SER 36 36 17127 2 . ARG 37 37 17127 2 . ARG 38 38 17127 2 . SER 39 39 17127 2 . ARG 40 40 17127 2 . GLY 41 41 17127 2 . ILE 42 42 17127 2 . VAL 43 43 17127 2 . GLU 44 44 17127 2 . GLU 45 45 17127 2 . CYS 46 46 17127 2 . CYS 47 47 17127 2 . PHE 48 48 17127 2 . ARG 49 49 17127 2 . SER 50 50 17127 2 . CYS 51 51 17127 2 . ASP 52 52 17127 2 . LEU 53 53 17127 2 . ALA 54 54 17127 2 . LEU 55 55 17127 2 . LEU 56 56 17127 2 . GLU 57 57 17127 2 . THR 58 58 17127 2 . TYR 59 59 17127 2 . CYS 60 60 17127 2 . ALA 61 61 17127 2 . THR 62 62 17127 2 . PRO 63 63 17127 2 . ALA 64 64 17127 2 . LYS 65 65 17127 2 . SER 66 66 17127 2 . GLU 67 67 17127 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 17127 _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 $HD11 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17127 1 2 2 $IGF2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17127 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 17127 _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 $HD11 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3)' . . . . . . . . . . . . . . . pET26a . . . . . . 17127 1 2 2 $IGF2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli JM101 . . . . . . . . . . . . . . . PGEM-TEASY . . . . . . 17127 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17127 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HD11 '[U-98% 13C; U-98% 15N]' . . 1 $HD11 . . . 0.5 1 mM 0.05 . . . 17127 1 2 IGF2 'natural abundance' . . 2 $IGF2 . . . 1 1.5 mM 0.05 . . . 17127 1 3 D2O 'natural abundance' . . . . . . 5 . . % 0.1 . . . 17127 1 4 'sodium azide' 'natural abundance' . . . . . . 100 . . uM 0.1 . . . 17127 1 5 'sodium acetate' 'natural abundance' . . . . . . 5 . . mM 0.1 . . . 17127 1 6 EDTA 'natural abundance' . . . . . . 0.1 . . mM 0.1 . . . 17127 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 17127 _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 IGF2 '[U-98% 13C; U-98% 15N]' . . 2 $IGF2 . . . 0.5 1 mM 0.05 . . . 17127 2 2 HD11 'natural abundance' . . 1 $HD11 . . . 1 1.5 mM 0.05 . . . 17127 2 3 D2O 'natural abundance' . . . . . . 5 . . % 0.1 . . . 17127 2 4 'sodium azide' 'natural abundance' . . . . . . 100 . . uM 0.1 . . . 17127 2 5 'sodium acetate' 'natural abundance' . . . . . . 5 . . mM 0.1 . . . 17127 2 6 EDTA 'natural abundance' . . . . . . 0.1 . . mM 0.1 . . . 17127 2 7 H2O 'natural abundance' . . . . . . 95 . . % 0.1 . . . 17127 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 17127 _Sample.ID 3 _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 IGF2 '[U-98% 15N; U-95% 2H]' . . 2 $IGF2 . . . 0.5 1 mM 0.05 . . . 17127 3 2 HD11 'natural abundance' . . 1 $HD11 . . . 1 1.5 mM 0.05 . . . 17127 3 3 D2O 'natural abundance' . . . . . . 5 . . % 0.1 . . . 17127 3 4 'sodium azide' 'natural abundance' . . . . . . 100 . . uM 0.1 . . . 17127 3 5 'sodium acetate' 'natural abundance' . . . . . . 5 . . mM 0.1 . . . 17127 3 6 EDTA 'natural abundance' . . . . . . 0.1 . . mM 0.1 . . . 17127 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17127 _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 pH 4.2 0.1 pH 17127 1 pressure 1 . atm 17127 1 temperature 273 . K 17127 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMRJ _Software.Sf_category software _Software.Sf_framecode VNMRJ _Software.Entry_ID 17127 _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 . . 17127 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17127 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 17127 _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' . . 17127 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17127 2 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 17127 _Software.ID 3 _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' . . 17127 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 17127 3 stop_ save_ save_iCing _Software.Sf_category software _Software.Sf_framecode iCing _Software.Entry_ID 17127 _Software.ID 4 _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' . . 17127 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17127 4 stop_ save_ save_Analysis _Software.Sf_category software _Software.Sf_framecode Analysis _Software.Entry_ID 17127 _Software.ID 5 _Software.Name Analysis _Software.Version 2.13 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 17127 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17127 5 'data analysis' 17127 5 stop_ save_ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 17127 _Software.ID 6 _Software.Name ARIA _Software.Version 2.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Linge, O'Donoghue and Nilges' . . 17127 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17127 6 'structure solution' 17127 6 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 17127 _Software.ID 7 _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' . . 17127 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17127 7 'structure solution' 17127 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 17127 _NMR_spectrometer.ID 1 _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_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17127 _NMR_spectrometer.ID 2 _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_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 17127 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details 'cryoprobe 900MHz' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model UnityPlus _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17127 _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 INOVA . 600 'room temp probe' . . 17127 1 2 spectrometer_2 Varian VNMRS . 600 'cryoprobe 600MHz' . . 17127 1 3 spectrometer_3 Varian UnityPlus . 900 'cryoprobe 900MHz' . . 17127 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 17127 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 17127 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 17127 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 17127 1 4 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 17127 1 5 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17127 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 17127 1 7 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 8 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 9 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 10 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 11 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 12 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 13 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 14 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 15 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 16 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 17 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 18 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 19 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 20 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 21 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 22 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 23 '3D C(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 24 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 25 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 26 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 27 '3D HN(CO)CA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 28 '3D H(CCO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 29 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 30 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 31 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 32 '2D f2 filter noesy' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 33 '2D f2 filter noesy' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 34 '2D f2 filter noesy' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 17127 1 35 '2D f2 filter noesy' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 17127 1 36 '2D CN filtered noesy' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 37 '2D CN filtered noesy' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 38 '2D CN filtered noesy' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 17127 1 39 '2D CN filtered noesy' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 17127 1 40 '2D CN filtered tocsy' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 1 41 '2D CN filtered tocsy' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17127 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 17127 _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 4.658 internal indirect 0.251449530 . . . . . . . . . 17127 1 H 1 water protons . . . . ppm 4.658 internal direct 1 . . . . . . . . . 17127 1 N 15 water protons . . . . ppm 4.658 internal indirect 0.101329118 . . . . . . . . . 17127 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_bound_E4_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_bound_E4_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17127 _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 5 '2D 1H-15N HSQC' . . . 17127 1 6 '3D 1H-15N NOESY' . . . 17127 1 9 '3D HNCO' . . . 17127 1 10 '3D CBCA(CO)NH' . . . 17127 1 11 '3D C(CO)NH' . . . 17127 1 12 '3D HNCA' . . . 17127 1 15 '3D HCCH-TOCSY' . . . 17127 1 16 '3D HN(CO)CA' . . . 17127 1 17 '3D H(CCO)NH' . . . 17127 1 21 '2D 1H-13C HSQC' . . . 17127 1 22 '3D CBCA(CO)NH' . . . 17127 1 23 '3D C(CO)NH' . . . 17127 1 24 '3D HNCO' . . . 17127 1 25 '3D HNCA' . . . 17127 1 26 '3D HNCACB' . . . 17127 1 27 '3D HN(CO)CA' . . . 17127 1 28 '3D H(CCO)NH' . . . 17127 1 29 '3D HCCH-TOCSY' . . . 17127 1 32 '2D f2 filter noesy' . . . 17127 1 36 '2D CN filtered noesy' . . . 17127 1 37 '2D CN filtered noesy' . . . 17127 1 40 '2D CN filtered tocsy' . . . 17127 1 41 '2D CN filtered tocsy' . . . 17127 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 5 $Analysis . . 17127 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.190 0.05 . 1 . . . . 1508 Met HA . 17127 1 2 . 1 1 1 1 MET HB2 H 1 2.186 0.05 . 1 . . . . 1508 Met HB2 . 17127 1 3 . 1 1 1 1 MET HB3 H 1 2.186 0.05 . 1 . . . . 1508 Met HB3 . 17127 1 4 . 1 1 1 1 MET HE1 H 1 2.083 0.05 . 1 . . . . 1508 Met HE1 . 17127 1 5 . 1 1 1 1 MET HE2 H 1 2.083 0.05 . 1 . . . . 1508 Met HE2 . 17127 1 6 . 1 1 1 1 MET HE3 H 1 2.083 0.05 . 1 . . . . 1508 Met HE3 . 17127 1 7 . 1 1 1 1 MET HG2 H 1 2.586 0.05 . 1 . . . . 1508 Met HG2 . 17127 1 8 . 1 1 1 1 MET HG3 H 1 2.586 0.05 . 1 . . . . 1508 Met HG3 . 17127 1 9 . 1 1 1 1 MET C C 13 172.251 0.20 . 1 . . . . 1508 Met C . 17127 1 10 . 1 1 1 1 MET CA C 13 55.369 0.20 . 1 . . . . 1508 Met CA . 17127 1 11 . 1 1 1 1 MET CB C 13 34.401 0.20 . 1 . . . . 1508 Met CB . 17127 1 12 . 1 1 1 1 MET CE C 13 16.902 0.20 . 1 . . . . 1508 Met CE . 17127 1 13 . 1 1 1 1 MET CG C 13 31.376 0.20 . 1 . . . . 1508 Met CG . 17127 1 14 . 1 1 2 2 LYS H H 1 8.773 0.05 . 1 . . . . 1509 Lys H . 17127 1 15 . 1 1 2 2 LYS HA H 1 4.441 0.05 . 1 . . . . 1509 Lys HA . 17127 1 16 . 1 1 2 2 LYS HB2 H 1 1.837 0.05 . 2 . . . . 1509 Lys HB2 . 17127 1 17 . 1 1 2 2 LYS HB3 H 1 1.832 0.05 . 2 . . . . 1509 Lys HB3 . 17127 1 18 . 1 1 2 2 LYS HD2 H 1 1.671 0.05 . 1 . . . . 1509 Lys HD2 . 17127 1 19 . 1 1 2 2 LYS HD3 H 1 1.671 0.05 . 1 . . . . 1509 Lys HD3 . 17127 1 20 . 1 1 2 2 LYS HE2 H 1 2.975 0.05 . 1 . . . . 1509 Lys HE2 . 17127 1 21 . 1 1 2 2 LYS HE3 H 1 2.975 0.05 . 1 . . . . 1509 Lys HE3 . 17127 1 22 . 1 1 2 2 LYS HG2 H 1 1.458 0.05 . 1 . . . . 1509 Lys HG2 . 17127 1 23 . 1 1 2 2 LYS HG3 H 1 1.458 0.05 . 1 . . . . 1509 Lys HG3 . 17127 1 24 . 1 1 2 2 LYS C C 13 175.990 0.20 . 1 . . . . 1509 Lys C . 17127 1 25 . 1 1 2 2 LYS CA C 13 56.775 0.20 . 1 . . . . 1509 Lys CA . 17127 1 26 . 1 1 2 2 LYS CB C 13 33.421 0.20 . 1 . . . . 1509 Lys CB . 17127 1 27 . 1 1 2 2 LYS CD C 13 29.262 0.20 . 1 . . . . 1509 Lys CD . 17127 1 28 . 1 1 2 2 LYS CE C 13 42.274 0.20 . 1 . . . . 1509 Lys CE . 17127 1 29 . 1 1 2 2 LYS CG C 13 24.790 0.20 . 1 . . . . 1509 Lys CG . 17127 1 30 . 1 1 2 2 LYS N N 15 124.542 0.05 . 1 . . . . 1509 Lys N . 17127 1 31 . 1 1 3 3 SER H H 1 8.470 0.05 . 1 . . . . 1510 Ser H . 17127 1 32 . 1 1 3 3 SER HA H 1 4.600 0.05 . 1 . . . . 1510 Ser HA . 17127 1 33 . 1 1 3 3 SER HB2 H 1 3.875 0.05 . 2 . . . . 1510 Ser HB2 . 17127 1 34 . 1 1 3 3 SER HB3 H 1 3.915 0.05 . 2 . . . . 1510 Ser HB3 . 17127 1 35 . 1 1 3 3 SER C C 13 174.055 0.20 . 1 . . . . 1510 Ser C . 17127 1 36 . 1 1 3 3 SER CA C 13 58.291 0.20 . 1 . . . . 1510 Ser CA . 17127 1 37 . 1 1 3 3 SER CB C 13 64.502 0.20 . 1 . . . . 1510 Ser CB . 17127 1 38 . 1 1 3 3 SER N N 15 117.531 0.05 . 1 . . . . 1510 Ser N . 17127 1 39 . 1 1 4 4 ASN H H 1 8.610 0.05 . 1 . . . . 1511 Asn H . 17127 1 40 . 1 1 4 4 ASN HA H 1 4.842 0.05 . 1 . . . . 1511 Asn HA . 17127 1 41 . 1 1 4 4 ASN HB2 H 1 2.822 0.05 . 2 . . . . 1511 Asn HB2 . 17127 1 42 . 1 1 4 4 ASN HB3 H 1 2.845 0.05 . 2 . . . . 1511 Asn HB3 . 17127 1 43 . 1 1 4 4 ASN HD21 H 1 7.630 0.05 . 1 . . . . 1511 Asn HD21 . 17127 1 44 . 1 1 4 4 ASN HD22 H 1 6.910 0.05 . 1 . . . . 1511 Asn HD22 . 17127 1 45 . 1 1 4 4 ASN C C 13 174.630 0.20 . 1 . . . . 1511 Asn C . 17127 1 46 . 1 1 4 4 ASN CA C 13 53.323 0.20 . 1 . . . . 1511 Asn CA . 17127 1 47 . 1 1 4 4 ASN CB C 13 39.461 0.20 . 1 . . . . 1511 Asn CB . 17127 1 48 . 1 1 4 4 ASN N N 15 120.184 0.05 . 1 . . . . 1511 Asn N . 17127 1 49 . 1 1 4 4 ASN ND2 N 15 112.534 0.05 . 1 . . . . 1511 Asn ND2 . 17127 1 50 . 1 1 5 5 GLU H H 1 8.217 0.05 . 1 . . . . 1512 Glu H . 17127 1 51 . 1 1 5 5 GLU HA H 1 4.510 0.05 . 1 . . . . 1512 Glu HA . 17127 1 52 . 1 1 5 5 GLU HB2 H 1 1.979 0.05 . 2 . . . . 1512 Glu HB2 . 17127 1 53 . 1 1 5 5 GLU HB3 H 1 1.904 0.05 . 2 . . . . 1512 Glu HB3 . 17127 1 54 . 1 1 5 5 GLU HG2 H 1 2.203 0.05 . 1 . . . . 1512 Glu HG2 . 17127 1 55 . 1 1 5 5 GLU HG3 H 1 2.203 0.05 . 1 . . . . 1512 Glu HG3 . 17127 1 56 . 1 1 5 5 GLU C C 13 175.584 0.20 . 1 . . . . 1512 Glu C . 17127 1 57 . 1 1 5 5 GLU CA C 13 56.461 0.20 . 1 . . . . 1512 Glu CA . 17127 1 58 . 1 1 5 5 GLU CB C 13 30.058 0.20 . 1 . . . . 1512 Glu CB . 17127 1 59 . 1 1 5 5 GLU CG C 13 35.587 0.20 . 1 . . . . 1512 Glu CG . 17127 1 60 . 1 1 5 5 GLU N N 15 120.655 0.05 . 1 . . . . 1512 Glu N . 17127 1 61 . 1 1 6 6 HIS H H 1 8.617 0.05 . 1 . . . . 1513 His H . 17127 1 62 . 1 1 6 6 HIS HA H 1 4.688 0.05 . 1 . . . . 1513 His HA . 17127 1 63 . 1 1 6 6 HIS HB2 H 1 3.557 0.05 . 2 . . . . 1513 His HB2 . 17127 1 64 . 1 1 6 6 HIS HB3 H 1 3.228 0.05 . 2 . . . . 1513 His HB3 . 17127 1 65 . 1 1 6 6 HIS C C 13 173.193 0.20 . 1 . . . . 1513 His C . 17127 1 66 . 1 1 6 6 HIS CA C 13 55.559 0.20 . 1 . . . . 1513 His CA . 17127 1 67 . 1 1 6 6 HIS CB C 13 29.586 0.20 . 1 . . . . 1513 His CB . 17127 1 68 . 1 1 6 6 HIS N N 15 119.985 0.05 . 1 . . . . 1513 His N . 17127 1 69 . 1 1 7 7 ASP H H 1 8.302 0.05 . 1 . . . . 1514 Asp H . 17127 1 70 . 1 1 7 7 ASP HA H 1 4.854 0.05 . 1 . . . . 1514 Asp HA . 17127 1 71 . 1 1 7 7 ASP HB2 H 1 2.737 0.05 . 2 . . . . 1514 Asp HB2 . 17127 1 72 . 1 1 7 7 ASP HB3 H 1 2.570 0.05 . 2 . . . . 1514 Asp HB3 . 17127 1 73 . 1 1 7 7 ASP C C 13 175.657 0.20 . 1 . . . . 1514 Asp C . 17127 1 74 . 1 1 7 7 ASP CA C 13 53.867 0.20 . 1 . . . . 1514 Asp CA . 17127 1 75 . 1 1 7 7 ASP CB C 13 41.004 0.20 . 1 . . . . 1514 Asp CB . 17127 1 76 . 1 1 7 7 ASP N N 15 121.252 0.05 . 1 . . . . 1514 Asp N . 17127 1 77 . 1 1 8 8 ASP H H 1 8.585 0.05 . 1 . . . . 1515 Asp H . 17127 1 78 . 1 1 8 8 ASP HA H 1 4.536 0.05 . 1 . . . . 1515 Asp HA . 17127 1 79 . 1 1 8 8 ASP HB2 H 1 2.727 0.05 . 2 . . . . 1515 Asp HB2 . 17127 1 80 . 1 1 8 8 ASP HB3 H 1 2.750 0.05 . 2 . . . . 1515 Asp HB3 . 17127 1 81 . 1 1 8 8 ASP C C 13 174.949 0.20 . 1 . . . . 1515 Asp C . 17127 1 82 . 1 1 8 8 ASP CA C 13 54.358 0.20 . 1 . . . . 1515 Asp CA . 17127 1 83 . 1 1 8 8 ASP CB C 13 40.003 0.20 . 1 . . . . 1515 Asp CB . 17127 1 84 . 1 1 8 8 ASP N N 15 117.770 0.05 . 1 . . . . 1515 Asp N . 17127 1 85 . 1 1 9 9 CYS H H 1 9.553 0.05 . 1 . . . . 1516 Cys H . 17127 1 86 . 1 1 9 9 CYS HA H 1 4.046 0.05 . 1 . . . . 1516 Cys HA . 17127 1 87 . 1 1 9 9 CYS HB2 H 1 3.531 0.05 . 2 . . . . 1516 Cys HB2 . 17127 1 88 . 1 1 9 9 CYS HB3 H 1 2.643 0.05 . 2 . . . . 1516 Cys HB3 . 17127 1 89 . 1 1 9 9 CYS C C 13 171.841 0.20 . 1 . . . . 1516 Cys C . 17127 1 90 . 1 1 9 9 CYS CA C 13 58.286 0.20 . 1 . . . . 1516 Cys CA . 17127 1 91 . 1 1 9 9 CYS CB C 13 41.604 0.20 . 1 . . . . 1516 Cys CB . 17127 1 92 . 1 1 9 9 CYS N N 15 123.080 0.05 . 1 . . . . 1516 Cys N . 17127 1 93 . 1 1 10 10 GLN H H 1 7.723 0.05 . 1 . . . . 1517 Gln H . 17127 1 94 . 1 1 10 10 GLN HA H 1 5.401 0.05 . 1 . . . . 1517 Gln HA . 17127 1 95 . 1 1 10 10 GLN HB2 H 1 2.029 0.05 . 1 . . . . 1517 Gln HB2 . 17127 1 96 . 1 1 10 10 GLN HB3 H 1 2.029 0.05 . 1 . . . . 1517 Gln HB3 . 17127 1 97 . 1 1 10 10 GLN HE21 H 1 7.162 0.05 . 1 . . . . 1517 Gln HE21 . 17127 1 98 . 1 1 10 10 GLN HE22 H 1 6.673 0.05 . 1 . . . . 1517 Gln HE22 . 17127 1 99 . 1 1 10 10 GLN HG2 H 1 2.252 0.05 . 2 . . . . 1517 Gln HG2 . 17127 1 100 . 1 1 10 10 GLN HG3 H 1 2.110 0.05 . 2 . . . . 1517 Gln HG3 . 17127 1 101 . 1 1 10 10 GLN C C 13 174.010 0.20 . 1 . . . . 1517 Gln C . 17127 1 102 . 1 1 10 10 GLN CA C 13 54.375 0.20 . 1 . . . . 1517 Gln CA . 17127 1 103 . 1 1 10 10 GLN CG C 13 33.876 0.20 . 1 . . . . 1517 Gln CG . 17127 1 104 . 1 1 10 10 GLN N N 15 113.486 0.05 . 1 . . . . 1517 Gln N . 17127 1 105 . 1 1 10 10 GLN NE2 N 15 109.739 0.05 . 1 . . . . 1517 Gln NE2 . 17127 1 106 . 1 1 11 11 VAL H H 1 8.709 0.05 . 1 . . . . 1518 Val H . 17127 1 107 . 1 1 11 11 VAL HA H 1 4.461 0.05 . 1 . . . . 1518 Val HA . 17127 1 108 . 1 1 11 11 VAL HB H 1 2.207 0.05 . 1 . . . . 1518 Val HB . 17127 1 109 . 1 1 11 11 VAL HG11 H 1 1.286 0.05 . 2 . . . . 1518 Val HG11 . 17127 1 110 . 1 1 11 11 VAL HG12 H 1 1.286 0.05 . 2 . . . . 1518 Val HG12 . 17127 1 111 . 1 1 11 11 VAL HG13 H 1 1.286 0.05 . 2 . . . . 1518 Val HG13 . 17127 1 112 . 1 1 11 11 VAL HG21 H 1 0.646 0.05 . 2 . . . . 1518 Val HG21 . 17127 1 113 . 1 1 11 11 VAL HG22 H 1 0.646 0.05 . 2 . . . . 1518 Val HG22 . 17127 1 114 . 1 1 11 11 VAL HG23 H 1 0.646 0.05 . 2 . . . . 1518 Val HG23 . 17127 1 115 . 1 1 11 11 VAL C C 13 171.922 0.20 . 1 . . . . 1518 Val C . 17127 1 116 . 1 1 11 11 VAL CA C 13 61.470 0.20 . 1 . . . . 1518 Val CA . 17127 1 117 . 1 1 11 11 VAL CB C 13 34.026 0.20 . 1 . . . . 1518 Val CB . 17127 1 118 . 1 1 11 11 VAL CG1 C 13 22.827 0.20 . 2 . . . . 1518 Val CG1 . 17127 1 119 . 1 1 11 11 VAL CG2 C 13 20.293 0.20 . 2 . . . . 1518 Val CG2 . 17127 1 120 . 1 1 11 11 VAL N N 15 118.448 0.05 . 1 . . . . 1518 Val N . 17127 1 121 . 1 1 12 12 THR H H 1 7.843 0.05 . 1 . . . . 1519 Thr H . 17127 1 122 . 1 1 12 12 THR HA H 1 5.471 0.05 . 1 . . . . 1519 Thr HA . 17127 1 123 . 1 1 12 12 THR HB H 1 3.670 0.05 . 1 . . . . 1519 Thr HB . 17127 1 124 . 1 1 12 12 THR HG21 H 1 0.865 0.05 . 1 . . . . 1519 Thr HG21 . 17127 1 125 . 1 1 12 12 THR HG22 H 1 0.865 0.05 . 1 . . . . 1519 Thr HG22 . 17127 1 126 . 1 1 12 12 THR HG23 H 1 0.865 0.05 . 1 . . . . 1519 Thr HG23 . 17127 1 127 . 1 1 12 12 THR C C 13 175.114 0.20 . 1 . . . . 1519 Thr C . 17127 1 128 . 1 1 12 12 THR CA C 13 60.063 0.20 . 1 . . . . 1519 Thr CA . 17127 1 129 . 1 1 12 12 THR CB C 13 71.167 0.20 . 1 . . . . 1519 Thr CB . 17127 1 130 . 1 1 12 12 THR CG2 C 13 22.007 0.20 . 1 . . . . 1519 Thr CG2 . 17127 1 131 . 1 1 12 12 THR N N 15 118.607 0.05 . 1 . . . . 1519 Thr N . 17127 1 132 . 1 1 13 13 ASN H H 1 8.175 0.05 . 1 . . . . 1520 Asn H . 17127 1 133 . 1 1 13 13 ASN HA H 1 4.170 0.05 . 1 . . . . 1520 Asn HA . 17127 1 134 . 1 1 13 13 ASN HB2 H 1 2.418 0.05 . 2 . . . . 1520 Asn HB2 . 17127 1 135 . 1 1 13 13 ASN HB3 H 1 3.216 0.05 . 2 . . . . 1520 Asn HB3 . 17127 1 136 . 1 1 13 13 ASN HD21 H 1 7.162 0.05 . 1 . . . . 1520 Asn HD21 . 17127 1 137 . 1 1 13 13 ASN HD22 H 1 9.333 0.05 . 1 . . . . 1520 Asn HD22 . 17127 1 138 . 1 1 13 13 ASN CA C 13 50.306 0.20 . 1 . . . . 1520 Asn CA . 17127 1 139 . 1 1 13 13 ASN CB C 13 39.392 0.20 . 1 . . . . 1520 Asn CB . 17127 1 140 . 1 1 13 13 ASN N N 15 120.605 0.05 . 1 . . . . 1520 Asn N . 17127 1 141 . 1 1 13 13 ASN ND2 N 15 118.208 0.05 . 1 . . . . 1520 Asn ND2 . 17127 1 142 . 1 1 14 14 PRO HA H 1 4.528 0.05 . 1 . . . . 1521 Pro HA . 17127 1 143 . 1 1 14 14 PRO HB2 H 1 2.355 0.05 . 1 . . . . 1521 Pro HB2 . 17127 1 144 . 1 1 14 14 PRO HB3 H 1 2.355 0.05 . 1 . . . . 1521 Pro HB3 . 17127 1 145 . 1 1 14 14 PRO HD2 H 1 3.733 0.05 . 1 . . . . 1521 Pro HD2 . 17127 1 146 . 1 1 14 14 PRO HD3 H 1 3.733 0.05 . 1 . . . . 1521 Pro HD3 . 17127 1 147 . 1 1 14 14 PRO HG2 H 1 2.041 0.05 . 1 . . . . 1521 Pro HG2 . 17127 1 148 . 1 1 14 14 PRO HG3 H 1 2.041 0.05 . 1 . . . . 1521 Pro HG3 . 17127 1 149 . 1 1 14 14 PRO C C 13 178.109 0.20 . 1 . . . . 1521 Pro C . 17127 1 150 . 1 1 14 14 PRO CA C 13 64.348 0.20 . 1 . . . . 1521 Pro CA . 17127 1 151 . 1 1 14 14 PRO CB C 13 32.403 0.20 . 1 . . . . 1521 Pro CB . 17127 1 152 . 1 1 14 14 PRO CD C 13 50.922 0.20 . 1 . . . . 1521 Pro CD . 17127 1 153 . 1 1 14 14 PRO CG C 13 27.285 0.20 . 1 . . . . 1521 Pro CG . 17127 1 154 . 1 1 15 15 SER H H 1 8.030 0.05 . 1 . . . . 1522 Ser H . 17127 1 155 . 1 1 15 15 SER HA H 1 4.423 0.05 . 1 . . . . 1522 Ser HA . 17127 1 156 . 1 1 15 15 SER HB2 H 1 3.943 0.05 . 1 . . . . 1522 Ser HB2 . 17127 1 157 . 1 1 15 15 SER HB3 H 1 3.943 0.05 . 1 . . . . 1522 Ser HB3 . 17127 1 158 . 1 1 15 15 SER C C 13 175.156 0.20 . 1 . . . . 1522 Ser C . 17127 1 159 . 1 1 15 15 SER CA C 13 61.117 0.20 . 1 . . . . 1522 Ser CA . 17127 1 160 . 1 1 15 15 SER CB C 13 63.575 0.20 . 1 . . . . 1522 Ser CB . 17127 1 161 . 1 1 15 15 SER N N 15 111.787 0.05 . 1 . . . . 1522 Ser N . 17127 1 162 . 1 1 16 16 THR H H 1 6.775 0.05 . 1 . . . . 1523 Thr H . 17127 1 163 . 1 1 16 16 THR HA H 1 4.450 0.05 . 1 . . . . 1523 Thr HA . 17127 1 164 . 1 1 16 16 THR HB H 1 4.296 0.05 . 1 . . . . 1523 Thr HB . 17127 1 165 . 1 1 16 16 THR HG21 H 1 1.106 0.05 . 1 . . . . 1523 Thr HG21 . 17127 1 166 . 1 1 16 16 THR HG22 H 1 1.106 0.05 . 1 . . . . 1523 Thr HG22 . 17127 1 167 . 1 1 16 16 THR HG23 H 1 1.106 0.05 . 1 . . . . 1523 Thr HG23 . 17127 1 168 . 1 1 16 16 THR C C 13 176.263 0.20 . 1 . . . . 1523 Thr C . 17127 1 169 . 1 1 16 16 THR CA C 13 61.377 0.20 . 1 . . . . 1523 Thr CA . 17127 1 170 . 1 1 16 16 THR CB C 13 71.294 0.20 . 1 . . . . 1523 Thr CB . 17127 1 171 . 1 1 16 16 THR CG2 C 13 20.896 0.20 . 1 . . . . 1523 Thr CG2 . 17127 1 172 . 1 1 16 16 THR N N 15 106.781 0.05 . 1 . . . . 1523 Thr N . 17127 1 173 . 1 1 17 17 GLY H H 1 8.626 0.05 . 1 . . . . 1524 Gly H . 17127 1 174 . 1 1 17 17 GLY HA2 H 1 4.180 0.05 . 2 . . . . 1524 Gly HA2 . 17127 1 175 . 1 1 17 17 GLY HA3 H 1 3.577 0.05 . 2 . . . . 1524 Gly HA3 . 17127 1 176 . 1 1 17 17 GLY C C 13 173.614 0.20 . 1 . . . . 1524 Gly C . 17127 1 177 . 1 1 17 17 GLY CA C 13 45.957 0.20 . 1 . . . . 1524 Gly CA . 17127 1 178 . 1 1 17 17 GLY N N 15 111.289 0.05 . 1 . . . . 1524 Gly N . 17127 1 179 . 1 1 18 18 HIS H H 1 7.810 0.05 . 1 . . . . 1525 His H . 17127 1 180 . 1 1 18 18 HIS HA H 1 3.999 0.05 . 1 . . . . 1525 His HA . 17127 1 181 . 1 1 18 18 HIS HB2 H 1 2.923 0.05 . 2 . . . . 1525 His HB2 . 17127 1 182 . 1 1 18 18 HIS HB3 H 1 2.536 0.05 . 2 . . . . 1525 His HB3 . 17127 1 183 . 1 1 18 18 HIS HE1 H 1 8.591 0.05 . 1 . . . . 1525 His HE1 . 17127 1 184 . 1 1 18 18 HIS C C 13 172.603 0.20 . 1 . . . . 1525 His C . 17127 1 185 . 1 1 18 18 HIS CA C 13 56.856 0.20 . 1 . . . . 1525 His CA . 17127 1 186 . 1 1 18 18 HIS CB C 13 29.344 0.20 . 1 . . . . 1525 His CB . 17127 1 187 . 1 1 18 18 HIS CE1 C 13 136.562 0.20 . 1 . . . . 1525 His CE1 . 17127 1 188 . 1 1 18 18 HIS N N 15 118.862 0.05 . 1 . . . . 1525 His N . 17127 1 189 . 1 1 19 19 LEU H H 1 7.809 0.05 . 1 . . . . 1526 Leu H . 17127 1 190 . 1 1 19 19 LEU HA H 1 4.037 0.05 . 1 . . . . 1526 Leu HA . 17127 1 191 . 1 1 19 19 LEU HB2 H 1 1.479 0.05 . 2 . . . . 1526 Leu HB2 . 17127 1 192 . 1 1 19 19 LEU HB3 H 1 1.156 0.05 . 2 . . . . 1526 Leu HB3 . 17127 1 193 . 1 1 19 19 LEU HD11 H 1 0.615 0.05 . 2 . . . . 1526 Leu HD11 . 17127 1 194 . 1 1 19 19 LEU HD12 H 1 0.615 0.05 . 2 . . . . 1526 Leu HD12 . 17127 1 195 . 1 1 19 19 LEU HD13 H 1 0.615 0.05 . 2 . . . . 1526 Leu HD13 . 17127 1 196 . 1 1 19 19 LEU HD21 H 1 0.687 0.05 . 2 . . . . 1526 Leu HD21 . 17127 1 197 . 1 1 19 19 LEU HD22 H 1 0.687 0.05 . 2 . . . . 1526 Leu HD22 . 17127 1 198 . 1 1 19 19 LEU HD23 H 1 0.687 0.05 . 2 . . . . 1526 Leu HD23 . 17127 1 199 . 1 1 19 19 LEU HG H 1 1.087 0.05 . 1 . . . . 1526 Leu HG . 17127 1 200 . 1 1 19 19 LEU C C 13 174.874 0.20 . 1 . . . . 1526 Leu C . 17127 1 201 . 1 1 19 19 LEU CA C 13 54.888 0.20 . 1 . . . . 1526 Leu CA . 17127 1 202 . 1 1 19 19 LEU CB C 13 43.260 0.20 . 1 . . . . 1526 Leu CB . 17127 1 203 . 1 1 19 19 LEU CD1 C 13 23.831 0.20 . 2 . . . . 1526 Leu CD1 . 17127 1 204 . 1 1 19 19 LEU CD2 C 13 25.534 0.20 . 2 . . . . 1526 Leu CD2 . 17127 1 205 . 1 1 19 19 LEU CG C 13 27.733 0.20 . 1 . . . . 1526 Leu CG . 17127 1 206 . 1 1 19 19 LEU N N 15 128.714 0.05 . 1 . . . . 1526 Leu N . 17127 1 207 . 1 1 20 20 PHE H H 1 9.194 0.05 . 1 . . . . 1527 Phe H . 17127 1 208 . 1 1 20 20 PHE HA H 1 4.685 0.05 . 1 . . . . 1527 Phe HA . 17127 1 209 . 1 1 20 20 PHE HB2 H 1 3.000 0.05 . 2 . . . . 1527 Phe HB2 . 17127 1 210 . 1 1 20 20 PHE HB3 H 1 2.650 0.05 . 2 . . . . 1527 Phe HB3 . 17127 1 211 . 1 1 20 20 PHE HD1 H 1 7.443 0.05 . 3 . . . . 1527 Phe HD1 . 17127 1 212 . 1 1 20 20 PHE HD2 H 1 7.443 0.05 . 3 . . . . 1527 Phe HD2 . 17127 1 213 . 1 1 20 20 PHE HE1 H 1 6.923 0.05 . 3 . . . . 1527 Phe HE1 . 17127 1 214 . 1 1 20 20 PHE HE2 H 1 6.923 0.05 . 3 . . . . 1527 Phe HE2 . 17127 1 215 . 1 1 20 20 PHE HZ H 1 7.347 0.05 . 1 . . . . 1527 Phe HZ . 17127 1 216 . 1 1 20 20 PHE C C 13 174.375 0.20 . 1 . . . . 1527 Phe C . 17127 1 217 . 1 1 20 20 PHE CA C 13 57.323 0.20 . 1 . . . . 1527 Phe CA . 17127 1 218 . 1 1 20 20 PHE CB C 13 40.436 0.20 . 1 . . . . 1527 Phe CB . 17127 1 219 . 1 1 20 20 PHE CD1 C 13 132.932 0.20 . 3 . . . . 1527 Phe CD1 . 17127 1 220 . 1 1 20 20 PHE CD2 C 13 132.932 0.20 . 3 . . . . 1527 Phe CD2 . 17127 1 221 . 1 1 20 20 PHE CE1 C 13 131.156 0.20 . 3 . . . . 1527 Phe CE1 . 17127 1 222 . 1 1 20 20 PHE CE2 C 13 131.156 0.20 . 3 . . . . 1527 Phe CE2 . 17127 1 223 . 1 1 20 20 PHE CZ C 13 129.970 0.20 . 1 . . . . 1527 Phe CZ . 17127 1 224 . 1 1 20 20 PHE N N 15 126.148 0.05 . 1 . . . . 1527 Phe N . 17127 1 225 . 1 1 21 21 ASP H H 1 8.415 0.05 . 1 . . . . 1528 Asp H . 17127 1 226 . 1 1 21 21 ASP HA H 1 5.011 0.05 . 1 . . . . 1528 Asp HA . 17127 1 227 . 1 1 21 21 ASP HB2 H 1 2.264 0.05 . 2 . . . . 1528 Asp HB2 . 17127 1 228 . 1 1 21 21 ASP HB3 H 1 2.877 0.05 . 2 . . . . 1528 Asp HB3 . 17127 1 229 . 1 1 21 21 ASP C C 13 176.514 0.20 . 1 . . . . 1528 Asp C . 17127 1 230 . 1 1 21 21 ASP CA C 13 53.091 0.20 . 1 . . . . 1528 Asp CA . 17127 1 231 . 1 1 21 21 ASP CB C 13 42.860 0.20 . 1 . . . . 1528 Asp CB . 17127 1 232 . 1 1 21 21 ASP N N 15 120.561 0.05 . 1 . . . . 1528 Asp N . 17127 1 233 . 1 1 22 22 LEU H H 1 8.308 0.05 . 1 . . . . 1529 Leu H . 17127 1 234 . 1 1 22 22 LEU HA H 1 4.357 0.05 . 1 . . . . 1529 Leu HA . 17127 1 235 . 1 1 22 22 LEU HB2 H 1 1.218 0.05 . 2 . . . . 1529 Leu HB2 . 17127 1 236 . 1 1 22 22 LEU HB3 H 1 1.366 0.05 . 2 . . . . 1529 Leu HB3 . 17127 1 237 . 1 1 22 22 LEU HD11 H 1 -0.070 0.05 . 2 . . . . 1529 Leu HD11 . 17127 1 238 . 1 1 22 22 LEU HD12 H 1 -0.070 0.05 . 2 . . . . 1529 Leu HD12 . 17127 1 239 . 1 1 22 22 LEU HD13 H 1 -0.070 0.05 . 2 . . . . 1529 Leu HD13 . 17127 1 240 . 1 1 22 22 LEU HD21 H 1 -0.330 0.05 . 2 . . . . 1529 Leu HD21 . 17127 1 241 . 1 1 22 22 LEU HD22 H 1 -0.330 0.05 . 2 . . . . 1529 Leu HD22 . 17127 1 242 . 1 1 22 22 LEU HD23 H 1 -0.330 0.05 . 2 . . . . 1529 Leu HD23 . 17127 1 243 . 1 1 22 22 LEU HG H 1 0.936 0.05 . 1 . . . . 1529 Leu HG . 17127 1 244 . 1 1 22 22 LEU C C 13 177.140 0.20 . 1 . . . . 1529 Leu C . 17127 1 245 . 1 1 22 22 LEU CA C 13 54.133 0.20 . 1 . . . . 1529 Leu CA . 17127 1 246 . 1 1 22 22 LEU CB C 13 41.152 0.20 . 1 . . . . 1529 Leu CB . 17127 1 247 . 1 1 22 22 LEU CD1 C 13 24.449 0.20 . 2 . . . . 1529 Leu CD1 . 17127 1 248 . 1 1 22 22 LEU CD2 C 13 22.621 0.20 . 2 . . . . 1529 Leu CD2 . 17127 1 249 . 1 1 22 22 LEU CG C 13 27.290 0.20 . 1 . . . . 1529 Leu CG . 17127 1 250 . 1 1 22 22 LEU N N 15 126.367 0.05 . 1 . . . . 1529 Leu N . 17127 1 251 . 1 1 23 23 SER H H 1 8.949 0.05 . 1 . . . . 1530 Ser H . 17127 1 252 . 1 1 23 23 SER HA H 1 3.927 0.05 . 1 . . . . 1530 Ser HA . 17127 1 253 . 1 1 23 23 SER HB2 H 1 4.021 0.05 . 1 . . . . 1530 Ser HB2 . 17127 1 254 . 1 1 23 23 SER HB3 H 1 4.021 0.05 . 1 . . . . 1530 Ser HB3 . 17127 1 255 . 1 1 23 23 SER C C 13 177.602 0.20 . 1 . . . . 1530 Ser C . 17127 1 256 . 1 1 23 23 SER CA C 13 63.181 0.20 . 1 . . . . 1530 Ser CA . 17127 1 257 . 1 1 23 23 SER CB C 13 62.665 0.20 . 1 . . . . 1530 Ser CB . 17127 1 258 . 1 1 23 23 SER N N 15 116.958 0.05 . 1 . . . . 1530 Ser N . 17127 1 259 . 1 1 24 24 SER H H 1 8.834 0.05 . 1 . . . . 1531 Ser H . 17127 1 260 . 1 1 24 24 SER HA H 1 4.278 0.05 . 1 . . . . 1531 Ser HA . 17127 1 261 . 1 1 24 24 SER HB2 H 1 3.945 0.05 . 2 . . . . 1531 Ser HB2 . 17127 1 262 . 1 1 24 24 SER HB3 H 1 3.975 0.05 . 2 . . . . 1531 Ser HB3 . 17127 1 263 . 1 1 24 24 SER C C 13 175.648 0.20 . 1 . . . . 1531 Ser C . 17127 1 264 . 1 1 24 24 SER CA C 13 61.393 0.20 . 1 . . . . 1531 Ser CA . 17127 1 265 . 1 1 24 24 SER CB C 13 62.600 0.20 . 1 . . . . 1531 Ser CB . 17127 1 266 . 1 1 24 24 SER N N 15 118.663 0.05 . 1 . . . . 1531 Ser N . 17127 1 267 . 1 1 25 25 LEU H H 1 7.972 0.05 . 1 . . . . 1532 Leu H . 17127 1 268 . 1 1 25 25 LEU HA H 1 4.693 0.05 . 1 . . . . 1532 Leu HA . 17127 1 269 . 1 1 25 25 LEU HB2 H 1 1.644 0.05 . 2 . . . . 1532 Leu HB2 . 17127 1 270 . 1 1 25 25 LEU HB3 H 1 1.562 0.05 . 2 . . . . 1532 Leu HB3 . 17127 1 271 . 1 1 25 25 LEU HD11 H 1 0.676 0.05 . 2 . . . . 1532 Leu HD11 . 17127 1 272 . 1 1 25 25 LEU HD12 H 1 0.676 0.05 . 2 . . . . 1532 Leu HD12 . 17127 1 273 . 1 1 25 25 LEU HD13 H 1 0.676 0.05 . 2 . . . . 1532 Leu HD13 . 17127 1 274 . 1 1 25 25 LEU HD21 H 1 -0.036 0.05 . 2 . . . . 1532 Leu HD21 . 17127 1 275 . 1 1 25 25 LEU HD22 H 1 -0.036 0.05 . 2 . . . . 1532 Leu HD22 . 17127 1 276 . 1 1 25 25 LEU HD23 H 1 -0.036 0.05 . 2 . . . . 1532 Leu HD23 . 17127 1 277 . 1 1 25 25 LEU HG H 1 1.231 0.05 . 1 . . . . 1532 Leu HG . 17127 1 278 . 1 1 25 25 LEU C C 13 177.148 0.20 . 1 . . . . 1532 Leu C . 17127 1 279 . 1 1 25 25 LEU CA C 13 54.931 0.20 . 1 . . . . 1532 Leu CA . 17127 1 280 . 1 1 25 25 LEU CB C 13 42.338 0.20 . 1 . . . . 1532 Leu CB . 17127 1 281 . 1 1 25 25 LEU CD1 C 13 25.016 0.20 . 2 . . . . 1532 Leu CD1 . 17127 1 282 . 1 1 25 25 LEU CD2 C 13 21.466 0.20 . 2 . . . . 1532 Leu CD2 . 17127 1 283 . 1 1 25 25 LEU CG C 13 26.516 0.20 . 1 . . . . 1532 Leu CG . 17127 1 284 . 1 1 25 25 LEU N N 15 120.469 0.05 . 1 . . . . 1532 Leu N . 17127 1 285 . 1 1 26 26 SER H H 1 7.671 0.05 . 1 . . . . 1533 Ser H . 17127 1 286 . 1 1 26 26 SER HA H 1 4.898 0.05 . 1 . . . . 1533 Ser HA . 17127 1 287 . 1 1 26 26 SER HB2 H 1 4.148 0.05 . 2 . . . . 1533 Ser HB2 . 17127 1 288 . 1 1 26 26 SER HB3 H 1 3.942 0.05 . 2 . . . . 1533 Ser HB3 . 17127 1 289 . 1 1 26 26 SER C C 13 174.113 0.20 . 1 . . . . 1533 Ser C . 17127 1 290 . 1 1 26 26 SER CA C 13 59.574 0.20 . 1 . . . . 1533 Ser CA . 17127 1 291 . 1 1 26 26 SER CB C 13 65.142 0.20 . 1 . . . . 1533 Ser CB . 17127 1 292 . 1 1 26 26 SER N N 15 114.709 0.05 . 1 . . . . 1533 Ser N . 17127 1 293 . 1 1 27 27 GLY H H 1 8.968 0.05 . 1 . . . . 1534 Gly H . 17127 1 294 . 1 1 27 27 GLY HA2 H 1 4.776 0.05 . 2 . . . . 1534 Gly HA2 . 17127 1 295 . 1 1 27 27 GLY HA3 H 1 3.830 0.05 . 2 . . . . 1534 Gly HA3 . 17127 1 296 . 1 1 27 27 GLY C C 13 176.278 0.20 . 1 . . . . 1534 Gly C . 17127 1 297 . 1 1 27 27 GLY CA C 13 45.008 0.20 . 1 . . . . 1534 Gly CA . 17127 1 298 . 1 1 27 27 GLY N N 15 110.461 0.05 . 1 . . . . 1534 Gly N . 17127 1 299 . 1 1 28 28 ARG H H 1 8.688 0.05 . 1 . . . . 1535 Arg H . 17127 1 300 . 1 1 28 28 ARG HA H 1 4.552 0.05 . 1 . . . . 1535 Arg HA . 17127 1 301 . 1 1 28 28 ARG HB2 H 1 1.745 0.05 . 1 . . . . 1535 Arg HB2 . 17127 1 302 . 1 1 28 28 ARG HB3 H 1 1.745 0.05 . 1 . . . . 1535 Arg HB3 . 17127 1 303 . 1 1 28 28 ARG HD2 H 1 3.231 0.05 . 2 . . . . 1535 Arg HD2 . 17127 1 304 . 1 1 28 28 ARG HD3 H 1 3.171 0.05 . 2 . . . . 1535 Arg HD3 . 17127 1 305 . 1 1 28 28 ARG HE H 1 7.739 0.05 . 1 . . . . 1535 Arg HE . 17127 1 306 . 1 1 28 28 ARG HG2 H 1 1.582 0.05 . 1 . . . . 1535 Arg HG2 . 17127 1 307 . 1 1 28 28 ARG HG3 H 1 1.582 0.05 . 1 . . . . 1535 Arg HG3 . 17127 1 308 . 1 1 28 28 ARG C C 13 177.548 0.20 . 1 . . . . 1535 Arg C . 17127 1 309 . 1 1 28 28 ARG CA C 13 58.470 0.20 . 1 . . . . 1535 Arg CA . 17127 1 310 . 1 1 28 28 ARG CB C 13 31.270 0.20 . 1 . . . . 1535 Arg CB . 17127 1 311 . 1 1 28 28 ARG CD C 13 43.271 0.20 . 1 . . . . 1535 Arg CD . 17127 1 312 . 1 1 28 28 ARG CG C 13 28.891 0.20 . 1 . . . . 1535 Arg CG . 17127 1 313 . 1 1 28 28 ARG N N 15 123.274 0.05 . 1 . . . . 1535 Arg N . 17127 1 314 . 1 1 28 28 ARG NE N 15 84.095 0.05 . 1 . . . . 1535 Arg NE . 17127 1 315 . 1 1 29 29 ALA H H 1 8.347 0.05 . 1 . . . . 1536 Ala H . 17127 1 316 . 1 1 29 29 ALA HA H 1 3.972 0.05 . 1 . . . . 1536 Ala HA . 17127 1 317 . 1 1 29 29 ALA HB1 H 1 1.308 0.05 . 1 . . . . 1536 Ala HB1 . 17127 1 318 . 1 1 29 29 ALA HB2 H 1 1.308 0.05 . 1 . . . . 1536 Ala HB2 . 17127 1 319 . 1 1 29 29 ALA HB3 H 1 1.308 0.05 . 1 . . . . 1536 Ala HB3 . 17127 1 320 . 1 1 29 29 ALA C C 13 179.877 0.20 . 1 . . . . 1536 Ala C . 17127 1 321 . 1 1 29 29 ALA CA C 13 54.965 0.20 . 1 . . . . 1536 Ala CA . 17127 1 322 . 1 1 29 29 ALA CB C 13 17.866 0.20 . 1 . . . . 1536 Ala CB . 17127 1 323 . 1 1 29 29 ALA N N 15 122.736 0.05 . 1 . . . . 1536 Ala N . 17127 1 324 . 1 1 30 30 GLY H H 1 7.264 0.05 . 1 . . . . 1537 Gly H . 17127 1 325 . 1 1 30 30 GLY HA2 H 1 3.848 0.05 . 2 . . . . 1537 Gly HA2 . 17127 1 326 . 1 1 30 30 GLY HA3 H 1 3.919 0.05 . 2 . . . . 1537 Gly HA3 . 17127 1 327 . 1 1 30 30 GLY C C 13 172.767 0.20 . 1 . . . . 1537 Gly C . 17127 1 328 . 1 1 30 30 GLY CA C 13 47.115 0.20 . 1 . . . . 1537 Gly CA . 17127 1 329 . 1 1 30 30 GLY N N 15 102.096 0.05 . 1 . . . . 1537 Gly N . 17127 1 330 . 1 1 31 31 PHE H H 1 9.343 0.05 . 1 . . . . 1538 Phe H . 17127 1 331 . 1 1 31 31 PHE HA H 1 4.990 0.05 . 1 . . . . 1538 Phe HA . 17127 1 332 . 1 1 31 31 PHE HB2 H 1 3.211 0.05 . 2 . . . . 1538 Phe HB2 . 17127 1 333 . 1 1 31 31 PHE HB3 H 1 2.420 0.05 . 2 . . . . 1538 Phe HB3 . 17127 1 334 . 1 1 31 31 PHE HD1 H 1 7.424 0.05 . 3 . . . . 1538 Phe HD1 . 17127 1 335 . 1 1 31 31 PHE HD2 H 1 7.424 0.05 . 3 . . . . 1538 Phe HD2 . 17127 1 336 . 1 1 31 31 PHE HE1 H 1 7.904 0.05 . 3 . . . . 1538 Phe HE1 . 17127 1 337 . 1 1 31 31 PHE HE2 H 1 7.904 0.05 . 3 . . . . 1538 Phe HE2 . 17127 1 338 . 1 1 31 31 PHE HZ H 1 7.682 0.05 . 1 . . . . 1538 Phe HZ . 17127 1 339 . 1 1 31 31 PHE C C 13 175.517 0.20 . 1 . . . . 1538 Phe C . 17127 1 340 . 1 1 31 31 PHE CA C 13 56.842 0.20 . 1 . . . . 1538 Phe CA . 17127 1 341 . 1 1 31 31 PHE CB C 13 45.046 0.20 . 1 . . . . 1538 Phe CB . 17127 1 342 . 1 1 31 31 PHE CD1 C 13 132.143 0.20 . 3 . . . . 1538 Phe CD1 . 17127 1 343 . 1 1 31 31 PHE CD2 C 13 132.143 0.20 . 3 . . . . 1538 Phe CD2 . 17127 1 344 . 1 1 31 31 PHE CE1 C 13 132.385 0.20 . 3 . . . . 1538 Phe CE1 . 17127 1 345 . 1 1 31 31 PHE CE2 C 13 132.385 0.20 . 3 . . . . 1538 Phe CE2 . 17127 1 346 . 1 1 31 31 PHE CZ C 13 130.834 0.20 . 1 . . . . 1538 Phe CZ . 17127 1 347 . 1 1 31 31 PHE N N 15 119.950 0.05 . 1 . . . . 1538 Phe N . 17127 1 348 . 1 1 32 32 THR H H 1 8.538 0.05 . 1 . . . . 1539 Thr H . 17127 1 349 . 1 1 32 32 THR HA H 1 5.538 0.05 . 1 . . . . 1539 Thr HA . 17127 1 350 . 1 1 32 32 THR HB H 1 3.772 0.05 . 1 . . . . 1539 Thr HB . 17127 1 351 . 1 1 32 32 THR HG21 H 1 1.128 0.05 . 1 . . . . 1539 Thr HG21 . 17127 1 352 . 1 1 32 32 THR HG22 H 1 1.128 0.05 . 1 . . . . 1539 Thr HG22 . 17127 1 353 . 1 1 32 32 THR HG23 H 1 1.128 0.05 . 1 . . . . 1539 Thr HG23 . 17127 1 354 . 1 1 32 32 THR C C 13 173.327 0.20 . 1 . . . . 1539 Thr C . 17127 1 355 . 1 1 32 32 THR CA C 13 59.322 0.20 . 1 . . . . 1539 Thr CA . 17127 1 356 . 1 1 32 32 THR CB C 13 72.529 0.20 . 1 . . . . 1539 Thr CB . 17127 1 357 . 1 1 32 32 THR CG2 C 13 23.084 0.20 . 1 . . . . 1539 Thr CG2 . 17127 1 358 . 1 1 32 32 THR N N 15 110.952 0.05 . 1 . . . . 1539 Thr N . 17127 1 359 . 1 1 33 33 ALA H H 1 8.651 0.05 . 1 . . . . 1540 Ala H . 17127 1 360 . 1 1 33 33 ALA HA H 1 4.821 0.05 . 1 . . . . 1540 Ala HA . 17127 1 361 . 1 1 33 33 ALA HB1 H 1 1.244 0.05 . 1 . . . . 1540 Ala HB1 . 17127 1 362 . 1 1 33 33 ALA HB2 H 1 1.244 0.05 . 1 . . . . 1540 Ala HB2 . 17127 1 363 . 1 1 33 33 ALA HB3 H 1 1.244 0.05 . 1 . . . . 1540 Ala HB3 . 17127 1 364 . 1 1 33 33 ALA C C 13 176.284 0.20 . 1 . . . . 1540 Ala C . 17127 1 365 . 1 1 33 33 ALA CA C 13 50.670 0.20 . 1 . . . . 1540 Ala CA . 17127 1 366 . 1 1 33 33 ALA CB C 13 21.853 0.20 . 1 . . . . 1540 Ala CB . 17127 1 367 . 1 1 33 33 ALA N N 15 122.369 0.05 . 1 . . . . 1540 Ala N . 17127 1 368 . 1 1 34 34 ALA H H 1 8.681 0.05 . 1 . . . . 1541 Ala H . 17127 1 369 . 1 1 34 34 ALA HA H 1 4.677 0.05 . 1 . . . . 1541 Ala HA . 17127 1 370 . 1 1 34 34 ALA HB1 H 1 1.424 0.05 . 1 . . . . 1541 Ala HB1 . 17127 1 371 . 1 1 34 34 ALA HB2 H 1 1.424 0.05 . 1 . . . . 1541 Ala HB2 . 17127 1 372 . 1 1 34 34 ALA HB3 H 1 1.424 0.05 . 1 . . . . 1541 Ala HB3 . 17127 1 373 . 1 1 34 34 ALA C C 13 178.014 0.20 . 1 . . . . 1541 Ala C . 17127 1 374 . 1 1 34 34 ALA CA C 13 53.557 0.20 . 1 . . . . 1541 Ala CA . 17127 1 375 . 1 1 34 34 ALA CB C 13 19.855 0.20 . 1 . . . . 1541 Ala CB . 17127 1 376 . 1 1 34 34 ALA N N 15 126.451 0.05 . 1 . . . . 1541 Ala N . 17127 1 377 . 1 1 35 35 TYR H H 1 7.786 0.05 . 1 . . . . 1542 Tyr H . 17127 1 378 . 1 1 35 35 TYR HA H 1 4.958 0.05 . 1 . . . . 1542 Tyr HA . 17127 1 379 . 1 1 35 35 TYR HB2 H 1 2.441 0.05 . 2 . . . . 1542 Tyr HB2 . 17127 1 380 . 1 1 35 35 TYR HB3 H 1 3.229 0.05 . 2 . . . . 1542 Tyr HB3 . 17127 1 381 . 1 1 35 35 TYR HD1 H 1 6.891 0.05 . 3 . . . . 1542 Tyr HD1 . 17127 1 382 . 1 1 35 35 TYR HD2 H 1 6.891 0.05 . 3 . . . . 1542 Tyr HD2 . 17127 1 383 . 1 1 35 35 TYR HE1 H 1 6.669 0.05 . 3 . . . . 1542 Tyr HE1 . 17127 1 384 . 1 1 35 35 TYR HE2 H 1 6.669 0.05 . 3 . . . . 1542 Tyr HE2 . 17127 1 385 . 1 1 35 35 TYR C C 13 173.829 0.20 . 1 . . . . 1542 Tyr C . 17127 1 386 . 1 1 35 35 TYR CA C 13 56.156 0.20 . 1 . . . . 1542 Tyr CA . 17127 1 387 . 1 1 35 35 TYR CB C 13 39.704 0.20 . 1 . . . . 1542 Tyr CB . 17127 1 388 . 1 1 35 35 TYR CD1 C 13 133.754 0.20 . 3 . . . . 1542 Tyr CD1 . 17127 1 389 . 1 1 35 35 TYR CD2 C 13 133.754 0.20 . 3 . . . . 1542 Tyr CD2 . 17127 1 390 . 1 1 35 35 TYR CE1 C 13 118.953 0.20 . 3 . . . . 1542 Tyr CE1 . 17127 1 391 . 1 1 35 35 TYR CE2 C 13 118.953 0.20 . 3 . . . . 1542 Tyr CE2 . 17127 1 392 . 1 1 35 35 TYR N N 15 115.444 0.05 . 1 . . . . 1542 Tyr N . 17127 1 393 . 1 1 36 36 SER H H 1 7.964 0.05 . 1 . . . . 1543 Ser H . 17127 1 394 . 1 1 36 36 SER HA H 1 4.575 0.05 . 1 . . . . 1543 Ser HA . 17127 1 395 . 1 1 36 36 SER HB2 H 1 4.198 0.05 . 2 . . . . 1543 Ser HB2 . 17127 1 396 . 1 1 36 36 SER HB3 H 1 3.899 0.05 . 2 . . . . 1543 Ser HB3 . 17127 1 397 . 1 1 36 36 SER C C 13 173.852 0.20 . 1 . . . . 1543 Ser C . 17127 1 398 . 1 1 36 36 SER CA C 13 57.144 0.20 . 1 . . . . 1543 Ser CA . 17127 1 399 . 1 1 36 36 SER CB C 13 64.653 0.20 . 1 . . . . 1543 Ser CB . 17127 1 400 . 1 1 36 36 SER N N 15 117.694 0.05 . 1 . . . . 1543 Ser N . 17127 1 401 . 1 1 37 37 LYS H H 1 10.311 0.05 . 1 . . . . 1544 Lys H . 17127 1 402 . 1 1 37 37 LYS HA H 1 4.082 0.05 . 1 . . . . 1544 Lys HA . 17127 1 403 . 1 1 37 37 LYS HB2 H 1 1.864 0.05 . 2 . . . . 1544 Lys HB2 . 17127 1 404 . 1 1 37 37 LYS HB3 H 1 1.859 0.05 . 2 . . . . 1544 Lys HB3 . 17127 1 405 . 1 1 37 37 LYS HD2 H 1 1.652 0.05 . 2 . . . . 1544 Lys HD2 . 17127 1 406 . 1 1 37 37 LYS HD3 H 1 1.649 0.05 . 2 . . . . 1544 Lys HD3 . 17127 1 407 . 1 1 37 37 LYS HE2 H 1 2.961 0.05 . 2 . . . . 1544 Lys HE2 . 17127 1 408 . 1 1 37 37 LYS HE3 H 1 2.963 0.05 . 2 . . . . 1544 Lys HE3 . 17127 1 409 . 1 1 37 37 LYS HG2 H 1 1.486 0.05 . 2 . . . . 1544 Lys HG2 . 17127 1 410 . 1 1 37 37 LYS HG3 H 1 1.512 0.05 . 2 . . . . 1544 Lys HG3 . 17127 1 411 . 1 1 37 37 LYS C C 13 177.719 0.20 . 1 . . . . 1544 Lys C . 17127 1 412 . 1 1 37 37 LYS CA C 13 59.691 0.20 . 1 . . . . 1544 Lys CA . 17127 1 413 . 1 1 37 37 LYS CB C 13 32.238 0.20 . 1 . . . . 1544 Lys CB . 17127 1 414 . 1 1 37 37 LYS CD C 13 29.217 0.20 . 1 . . . . 1544 Lys CD . 17127 1 415 . 1 1 37 37 LYS CE C 13 42.085 0.20 . 1 . . . . 1544 Lys CE . 17127 1 416 . 1 1 37 37 LYS CG C 13 25.278 0.20 . 1 . . . . 1544 Lys CG . 17127 1 417 . 1 1 37 37 LYS N N 15 121.292 0.05 . 1 . . . . 1544 Lys N . 17127 1 418 . 1 1 38 38 SER H H 1 8.040 0.05 . 1 . . . . 1545 Ser H . 17127 1 419 . 1 1 38 38 SER HA H 1 4.638 0.05 . 1 . . . . 1545 Ser HA . 17127 1 420 . 1 1 38 38 SER HB2 H 1 3.828 0.05 . 2 . . . . 1545 Ser HB2 . 17127 1 421 . 1 1 38 38 SER HB3 H 1 3.715 0.05 . 2 . . . . 1545 Ser HB3 . 17127 1 422 . 1 1 38 38 SER C C 13 173.908 0.20 . 1 . . . . 1545 Ser C . 17127 1 423 . 1 1 38 38 SER CA C 13 57.770 0.20 . 1 . . . . 1545 Ser CA . 17127 1 424 . 1 1 38 38 SER CB C 13 65.081 0.20 . 1 . . . . 1545 Ser CB . 17127 1 425 . 1 1 38 38 SER N N 15 109.484 0.05 . 1 . . . . 1545 Ser N . 17127 1 426 . 1 1 39 39 GLY H H 1 7.435 0.05 . 1 . . . . 1546 Gly H . 17127 1 427 . 1 1 39 39 GLY HA2 H 1 4.160 0.05 . 2 . . . . 1546 Gly HA2 . 17127 1 428 . 1 1 39 39 GLY HA3 H 1 2.874 0.05 . 2 . . . . 1546 Gly HA3 . 17127 1 429 . 1 1 39 39 GLY C C 13 172.582 0.20 . 1 . . . . 1546 Gly C . 17127 1 430 . 1 1 39 39 GLY CA C 13 45.046 0.20 . 1 . . . . 1546 Gly CA . 17127 1 431 . 1 1 39 39 GLY N N 15 112.372 0.05 . 1 . . . . 1546 Gly N . 17127 1 432 . 1 1 40 40 VAL H H 1 7.490 0.05 . 1 . . . . 1547 Val H . 17127 1 433 . 1 1 40 40 VAL HA H 1 4.839 0.05 . 1 . . . . 1547 Val HA . 17127 1 434 . 1 1 40 40 VAL HB H 1 1.534 0.05 . 1 . . . . 1547 Val HB . 17127 1 435 . 1 1 40 40 VAL HG11 H 1 0.183 0.05 . 2 . . . . 1547 Val HG11 . 17127 1 436 . 1 1 40 40 VAL HG12 H 1 0.183 0.05 . 2 . . . . 1547 Val HG12 . 17127 1 437 . 1 1 40 40 VAL HG13 H 1 0.183 0.05 . 2 . . . . 1547 Val HG13 . 17127 1 438 . 1 1 40 40 VAL HG21 H 1 0.577 0.05 . 2 . . . . 1547 Val HG21 . 17127 1 439 . 1 1 40 40 VAL HG22 H 1 0.577 0.05 . 2 . . . . 1547 Val HG22 . 17127 1 440 . 1 1 40 40 VAL HG23 H 1 0.577 0.05 . 2 . . . . 1547 Val HG23 . 17127 1 441 . 1 1 40 40 VAL C C 13 175.307 0.20 . 1 . . . . 1547 Val C . 17127 1 442 . 1 1 40 40 VAL CA C 13 58.798 0.20 . 1 . . . . 1547 Val CA . 17127 1 443 . 1 1 40 40 VAL CB C 13 36.112 0.20 . 1 . . . . 1547 Val CB . 17127 1 444 . 1 1 40 40 VAL CG1 C 13 21.264 0.20 . 2 . . . . 1547 Val CG1 . 17127 1 445 . 1 1 40 40 VAL CG2 C 13 17.782 0.20 . 2 . . . . 1547 Val CG2 . 17127 1 446 . 1 1 40 40 VAL N N 15 114.610 0.05 . 1 . . . . 1547 Val N . 17127 1 447 . 1 1 41 41 VAL H H 1 9.113 0.05 . 1 . . . . 1548 Val H . 17127 1 448 . 1 1 41 41 VAL HA H 1 4.639 0.05 . 1 . . . . 1548 Val HA . 17127 1 449 . 1 1 41 41 VAL HB H 1 2.220 0.05 . 1 . . . . 1548 Val HB . 17127 1 450 . 1 1 41 41 VAL HG11 H 1 0.981 0.05 . 2 . . . . 1548 Val HG11 . 17127 1 451 . 1 1 41 41 VAL HG12 H 1 0.981 0.05 . 2 . . . . 1548 Val HG12 . 17127 1 452 . 1 1 41 41 VAL HG13 H 1 0.981 0.05 . 2 . . . . 1548 Val HG13 . 17127 1 453 . 1 1 41 41 VAL HG21 H 1 1.201 0.05 . 2 . . . . 1548 Val HG21 . 17127 1 454 . 1 1 41 41 VAL HG22 H 1 1.201 0.05 . 2 . . . . 1548 Val HG22 . 17127 1 455 . 1 1 41 41 VAL HG23 H 1 1.201 0.05 . 2 . . . . 1548 Val HG23 . 17127 1 456 . 1 1 41 41 VAL C C 13 175.986 0.20 . 1 . . . . 1548 Val C . 17127 1 457 . 1 1 41 41 VAL CA C 13 61.383 0.20 . 1 . . . . 1548 Val CA . 17127 1 458 . 1 1 41 41 VAL CB C 13 33.934 0.20 . 1 . . . . 1548 Val CB . 17127 1 459 . 1 1 41 41 VAL CG1 C 13 21.676 0.20 . 2 . . . . 1548 Val CG1 . 17127 1 460 . 1 1 41 41 VAL CG2 C 13 21.892 0.20 . 2 . . . . 1548 Val CG2 . 17127 1 461 . 1 1 41 41 VAL N N 15 121.647 0.05 . 1 . . . . 1548 Val N . 17127 1 462 . 1 1 42 42 TYR H H 1 8.928 0.05 . 1 . . . . 1549 Tyr H . 17127 1 463 . 1 1 42 42 TYR HA H 1 4.674 0.05 . 1 . . . . 1549 Tyr HA . 17127 1 464 . 1 1 42 42 TYR HB2 H 1 3.098 0.05 . 2 . . . . 1549 Tyr HB2 . 17127 1 465 . 1 1 42 42 TYR HB3 H 1 2.849 0.05 . 2 . . . . 1549 Tyr HB3 . 17127 1 466 . 1 1 42 42 TYR HD1 H 1 7.108 0.05 . 3 . . . . 1549 Tyr HD1 . 17127 1 467 . 1 1 42 42 TYR HD2 H 1 7.108 0.05 . 3 . . . . 1549 Tyr HD2 . 17127 1 468 . 1 1 42 42 TYR HE1 H 1 6.631 0.05 . 3 . . . . 1549 Tyr HE1 . 17127 1 469 . 1 1 42 42 TYR HE2 H 1 6.631 0.05 . 3 . . . . 1549 Tyr HE2 . 17127 1 470 . 1 1 42 42 TYR C C 13 175.588 0.20 . 1 . . . . 1549 Tyr C . 17127 1 471 . 1 1 42 42 TYR CA C 13 58.085 0.20 . 1 . . . . 1549 Tyr CA . 17127 1 472 . 1 1 42 42 TYR CB C 13 39.110 0.20 . 1 . . . . 1549 Tyr CB . 17127 1 473 . 1 1 42 42 TYR CD1 C 13 133.355 0.20 . 3 . . . . 1549 Tyr CD1 . 17127 1 474 . 1 1 42 42 TYR CD2 C 13 133.355 0.20 . 3 . . . . 1549 Tyr CD2 . 17127 1 475 . 1 1 42 42 TYR CE1 C 13 117.438 0.20 . 3 . . . . 1549 Tyr CE1 . 17127 1 476 . 1 1 42 42 TYR CE2 C 13 117.438 0.20 . 3 . . . . 1549 Tyr CE2 . 17127 1 477 . 1 1 42 42 TYR N N 15 128.189 0.05 . 1 . . . . 1549 Tyr N . 17127 1 478 . 1 1 43 43 MET H H 1 8.669 0.05 . 1 . . . . 1550 Met H . 17127 1 479 . 1 1 43 43 MET HA H 1 5.761 0.05 . 1 . . . . 1550 Met HA . 17127 1 480 . 1 1 43 43 MET HB2 H 1 1.831 0.05 . 2 . . . . 1550 Met HB2 . 17127 1 481 . 1 1 43 43 MET HB3 H 1 1.806 0.05 . 2 . . . . 1550 Met HB3 . 17127 1 482 . 1 1 43 43 MET HE1 H 1 0.783 0.05 . 1 . . . . 1550 Met HE1 . 17127 1 483 . 1 1 43 43 MET HE2 H 1 0.783 0.05 . 1 . . . . 1550 Met HE2 . 17127 1 484 . 1 1 43 43 MET HE3 H 1 0.783 0.05 . 1 . . . . 1550 Met HE3 . 17127 1 485 . 1 1 43 43 MET HG2 H 1 2.192 0.05 . 2 . . . . 1550 Met HG2 . 17127 1 486 . 1 1 43 43 MET HG3 H 1 2.097 0.05 . 2 . . . . 1550 Met HG3 . 17127 1 487 . 1 1 43 43 MET C C 13 174.957 0.20 . 1 . . . . 1550 Met C . 17127 1 488 . 1 1 43 43 MET CA C 13 55.099 0.20 . 1 . . . . 1550 Met CA . 17127 1 489 . 1 1 43 43 MET CB C 13 37.759 0.20 . 1 . . . . 1550 Met CB . 17127 1 490 . 1 1 43 43 MET CE C 13 14.936 0.20 . 1 . . . . 1550 Met CE . 17127 1 491 . 1 1 43 43 MET CG C 13 30.364 0.20 . 1 . . . . 1550 Met CG . 17127 1 492 . 1 1 43 43 MET N N 15 118.454 0.05 . 1 . . . . 1550 Met N . 17127 1 493 . 1 1 44 44 SER H H 1 9.343 0.05 . 1 . . . . 1551 Ser H . 17127 1 494 . 1 1 44 44 SER HA H 1 5.563 0.05 . 1 . . . . 1551 Ser HA . 17127 1 495 . 1 1 44 44 SER HB2 H 1 3.725 0.05 . 2 . . . . 1551 Ser HB2 . 17127 1 496 . 1 1 44 44 SER HB3 H 1 3.621 0.05 . 2 . . . . 1551 Ser HB3 . 17127 1 497 . 1 1 44 44 SER C C 13 173.019 0.20 . 1 . . . . 1551 Ser C . 17127 1 498 . 1 1 44 44 SER CA C 13 58.754 0.20 . 1 . . . . 1551 Ser CA . 17127 1 499 . 1 1 44 44 SER CB C 13 68.102 0.20 . 1 . . . . 1551 Ser CB . 17127 1 500 . 1 1 44 44 SER N N 15 120.779 0.05 . 1 . . . . 1551 Ser N . 17127 1 501 . 1 1 45 45 ILE H H 1 9.926 0.05 . 1 . . . . 1552 Ile H . 17127 1 502 . 1 1 45 45 ILE HA H 1 4.142 0.05 . 1 . . . . 1552 Ile HA . 17127 1 503 . 1 1 45 45 ILE HB H 1 2.072 0.05 . 1 . . . . 1552 Ile HB . 17127 1 504 . 1 1 45 45 ILE HD11 H 1 0.800 0.05 . 1 . . . . 1552 Ile HD11 . 17127 1 505 . 1 1 45 45 ILE HD12 H 1 0.800 0.05 . 1 . . . . 1552 Ile HD12 . 17127 1 506 . 1 1 45 45 ILE HD13 H 1 0.800 0.05 . 1 . . . . 1552 Ile HD13 . 17127 1 507 . 1 1 45 45 ILE HG12 H 1 1.775 0.05 . 2 . . . . 1552 Ile HG12 . 17127 1 508 . 1 1 45 45 ILE HG13 H 1 1.267 0.05 . 2 . . . . 1552 Ile HG13 . 17127 1 509 . 1 1 45 45 ILE HG21 H 1 0.760 0.05 . 1 . . . . 1552 Ile HG21 . 17127 1 510 . 1 1 45 45 ILE HG22 H 1 0.760 0.05 . 1 . . . . 1552 Ile HG22 . 17127 1 511 . 1 1 45 45 ILE HG23 H 1 0.760 0.05 . 1 . . . . 1552 Ile HG23 . 17127 1 512 . 1 1 45 45 ILE C C 13 175.780 0.20 . 1 . . . . 1552 Ile C . 17127 1 513 . 1 1 45 45 ILE CA C 13 58.212 0.20 . 1 . . . . 1552 Ile CA . 17127 1 514 . 1 1 45 45 ILE CD1 C 13 9.415 0.20 . 1 . . . . 1552 Ile CD1 . 17127 1 515 . 1 1 45 45 ILE CG1 C 13 27.453 0.20 . 1 . . . . 1552 Ile CG1 . 17127 1 516 . 1 1 45 45 ILE CG2 C 13 17.489 0.20 . 1 . . . . 1552 Ile CG2 . 17127 1 517 . 1 1 45 45 ILE N N 15 123.834 0.05 . 1 . . . . 1552 Ile N . 17127 1 518 . 1 1 46 46 CYS H H 1 8.134 0.05 . 1 . . . . 1553 Cys H . 17127 1 519 . 1 1 46 46 CYS HA H 1 4.483 0.05 . 1 . . . . 1553 Cys HA . 17127 1 520 . 1 1 46 46 CYS HB2 H 1 4.096 0.05 . 2 . . . . 1553 Cys HB2 . 17127 1 521 . 1 1 46 46 CYS HB3 H 1 3.186 0.05 . 2 . . . . 1553 Cys HB3 . 17127 1 522 . 1 1 46 46 CYS C C 13 172.029 0.20 . 1 . . . . 1553 Cys C . 17127 1 523 . 1 1 46 46 CYS CA C 13 56.623 0.20 . 1 . . . . 1553 Cys CA . 17127 1 524 . 1 1 46 46 CYS CB C 13 41.042 0.20 . 1 . . . . 1553 Cys CB . 17127 1 525 . 1 1 46 46 CYS N N 15 118.027 0.05 . 1 . . . . 1553 Cys N . 17127 1 526 . 1 1 47 47 GLY H H 1 6.943 0.05 . 1 . . . . 1554 Gly H . 17127 1 527 . 1 1 47 47 GLY HA2 H 1 4.025 0.05 . 2 . . . . 1554 Gly HA2 . 17127 1 528 . 1 1 47 47 GLY HA3 H 1 3.657 0.05 . 2 . . . . 1554 Gly HA3 . 17127 1 529 . 1 1 47 47 GLY C C 13 169.794 0.20 . 1 . . . . 1554 Gly C . 17127 1 530 . 1 1 47 47 GLY CA C 13 45.442 0.20 . 1 . . . . 1554 Gly CA . 17127 1 531 . 1 1 47 47 GLY N N 15 100.487 0.05 . 1 . . . . 1554 Gly N . 17127 1 532 . 1 1 48 48 GLU H H 1 7.824 0.05 . 1 . . . . 1555 Glu H . 17127 1 533 . 1 1 48 48 GLU HA H 1 3.758 0.05 . 1 . . . . 1555 Glu HA . 17127 1 534 . 1 1 48 48 GLU HB2 H 1 1.512 0.05 . 1 . . . . 1555 Glu HB2 . 17127 1 535 . 1 1 48 48 GLU HB3 H 1 1.512 0.05 . 1 . . . . 1555 Glu HB3 . 17127 1 536 . 1 1 48 48 GLU HG2 H 1 2.085 0.05 . 2 . . . . 1555 Glu HG2 . 17127 1 537 . 1 1 48 48 GLU HG3 H 1 1.813 0.05 . 2 . . . . 1555 Glu HG3 . 17127 1 538 . 1 1 48 48 GLU C C 13 173.848 0.20 . 1 . . . . 1555 Glu C . 17127 1 539 . 1 1 48 48 GLU CA C 13 55.174 0.20 . 1 . . . . 1555 Glu CA . 17127 1 540 . 1 1 48 48 GLU CB C 13 28.907 0.20 . 1 . . . . 1555 Glu CB . 17127 1 541 . 1 1 48 48 GLU CG C 13 34.609 0.20 . 1 . . . . 1555 Glu CG . 17127 1 542 . 1 1 48 48 GLU N N 15 115.179 0.05 . 1 . . . . 1555 Glu N . 17127 1 543 . 1 1 49 49 ASN H H 1 8.031 0.05 . 1 . . . . 1556 Asn H . 17127 1 544 . 1 1 49 49 ASN HA H 1 5.461 0.05 . 1 . . . . 1556 Asn HA . 17127 1 545 . 1 1 49 49 ASN HB2 H 1 2.094 0.05 . 2 . . . . 1556 Asn HB2 . 17127 1 546 . 1 1 49 49 ASN HB3 H 1 2.223 0.05 . 2 . . . . 1556 Asn HB3 . 17127 1 547 . 1 1 49 49 ASN HD21 H 1 7.160 0.05 . 1 . . . . 1556 Asn HD21 . 17127 1 548 . 1 1 49 49 ASN HD22 H 1 7.901 0.05 . 1 . . . . 1556 Asn HD22 . 17127 1 549 . 1 1 49 49 ASN C C 13 177.755 0.20 . 1 . . . . 1556 Asn C . 17127 1 550 . 1 1 49 49 ASN CA C 13 52.608 0.20 . 1 . . . . 1556 Asn CA . 17127 1 551 . 1 1 49 49 ASN CB C 13 43.772 0.20 . 1 . . . . 1556 Asn CB . 17127 1 552 . 1 1 49 49 ASN N N 15 117.424 0.05 . 1 . . . . 1556 Asn N . 17127 1 553 . 1 1 49 49 ASN ND2 N 15 117.022 0.05 . 1 . . . . 1556 Asn ND2 . 17127 1 554 . 1 1 50 50 GLU H H 1 9.240 0.05 . 1 . . . . 1557 Glu H . 17127 1 555 . 1 1 50 50 GLU HA H 1 4.127 0.05 . 1 . . . . 1557 Glu HA . 17127 1 556 . 1 1 50 50 GLU HB2 H 1 1.664 0.05 . 2 . . . . 1557 Glu HB2 . 17127 1 557 . 1 1 50 50 GLU HB3 H 1 1.714 0.05 . 2 . . . . 1557 Glu HB3 . 17127 1 558 . 1 1 50 50 GLU HG2 H 1 1.830 0.05 . 2 . . . . 1557 Glu HG2 . 17127 1 559 . 1 1 50 50 GLU HG3 H 1 2.322 0.05 . 2 . . . . 1557 Glu HG3 . 17127 1 560 . 1 1 50 50 GLU C C 13 174.882 0.20 . 1 . . . . 1557 Glu C . 17127 1 561 . 1 1 50 50 GLU CA C 13 57.759 0.20 . 1 . . . . 1557 Glu CA . 17127 1 562 . 1 1 50 50 GLU CB C 13 29.121 0.20 . 1 . . . . 1557 Glu CB . 17127 1 563 . 1 1 50 50 GLU CG C 13 32.073 0.20 . 1 . . . . 1557 Glu CG . 17127 1 564 . 1 1 50 50 GLU N N 15 125.380 0.05 . 1 . . . . 1557 Glu N . 17127 1 565 . 1 1 51 51 ASN H H 1 8.495 0.05 . 1 . . . . 1558 Asn H . 17127 1 566 . 1 1 51 51 ASN HA H 1 4.396 0.05 . 1 . . . . 1558 Asn HA . 17127 1 567 . 1 1 51 51 ASN HB2 H 1 1.570 0.05 . 2 . . . . 1558 Asn HB2 . 17127 1 568 . 1 1 51 51 ASN HB3 H 1 2.205 0.05 . 2 . . . . 1558 Asn HB3 . 17127 1 569 . 1 1 51 51 ASN HD21 H 1 7.473 0.05 . 1 . . . . 1558 Asn HD21 . 17127 1 570 . 1 1 51 51 ASN HD22 H 1 7.570 0.05 . 1 . . . . 1558 Asn HD22 . 17127 1 571 . 1 1 51 51 ASN C C 13 173.378 0.20 . 1 . . . . 1558 Asn C . 17127 1 572 . 1 1 51 51 ASN CA C 13 54.231 0.20 . 1 . . . . 1558 Asn CA . 17127 1 573 . 1 1 51 51 ASN CB C 13 38.853 0.20 . 1 . . . . 1558 Asn CB . 17127 1 574 . 1 1 51 51 ASN N N 15 117.490 0.05 . 1 . . . . 1558 Asn N . 17127 1 575 . 1 1 51 51 ASN ND2 N 15 119.157 0.05 . 1 . . . . 1558 Asn ND2 . 17127 1 576 . 1 1 52 52 CYS H H 1 7.571 0.05 . 1 . . . . 1559 Cys H . 17127 1 577 . 1 1 52 52 CYS HA H 1 5.126 0.05 . 1 . . . . 1559 Cys HA . 17127 1 578 . 1 1 52 52 CYS HB2 H 1 2.442 0.05 . 2 . . . . 1559 Cys HB2 . 17127 1 579 . 1 1 52 52 CYS HB3 H 1 3.070 0.05 . 2 . . . . 1559 Cys HB3 . 17127 1 580 . 1 1 52 52 CYS CA C 13 51.111 0.20 . 1 . . . . 1559 Cys CA . 17127 1 581 . 1 1 52 52 CYS CB C 13 40.123 0.20 . 1 . . . . 1559 Cys CB . 17127 1 582 . 1 1 52 52 CYS N N 15 116.916 0.05 . 1 . . . . 1559 Cys N . 17127 1 583 . 1 1 53 53 PRO HA H 1 4.132 0.05 . 1 . . . . 1560 Pro HA . 17127 1 584 . 1 1 53 53 PRO HB2 H 1 2.300 0.05 . 1 . . . . 1560 Pro HB2 . 17127 1 585 . 1 1 53 53 PRO HB3 H 1 2.300 0.05 . 1 . . . . 1560 Pro HB3 . 17127 1 586 . 1 1 54 54 PRO HA H 1 4.146 0.05 . 1 . . . . 1561 Pro HA . 17127 1 587 . 1 1 54 54 PRO HB2 H 1 1.814 0.05 . 1 . . . . 1561 Pro HB2 . 17127 1 588 . 1 1 54 54 PRO HB3 H 1 1.814 0.05 . 1 . . . . 1561 Pro HB3 . 17127 1 589 . 1 1 54 54 PRO HG2 H 1 1.522 0.05 . 1 . . . . 1561 Pro HG2 . 17127 1 590 . 1 1 54 54 PRO HG3 H 1 1.522 0.05 . 1 . . . . 1561 Pro HG3 . 17127 1 591 . 1 1 54 54 PRO C C 13 177.874 0.20 . 1 . . . . 1561 Pro C . 17127 1 592 . 1 1 54 54 PRO CA C 13 64.772 0.20 . 1 . . . . 1561 Pro CA . 17127 1 593 . 1 1 54 54 PRO CB C 13 31.731 0.20 . 1 . . . . 1561 Pro CB . 17127 1 594 . 1 1 55 55 GLY H H 1 9.183 0.05 . 1 . . . . 1562 Gly H . 17127 1 595 . 1 1 55 55 GLY HA2 H 1 4.169 0.05 . 2 . . . . 1562 Gly HA2 . 17127 1 596 . 1 1 55 55 GLY HA3 H 1 3.665 0.05 . 2 . . . . 1562 Gly HA3 . 17127 1 597 . 1 1 55 55 GLY C C 13 174.279 0.20 . 1 . . . . 1562 Gly C . 17127 1 598 . 1 1 55 55 GLY CA C 13 45.633 0.20 . 1 . . . . 1562 Gly CA . 17127 1 599 . 1 1 55 55 GLY N N 15 112.141 0.05 . 1 . . . . 1562 Gly N . 17127 1 600 . 1 1 56 56 VAL H H 1 8.189 0.05 . 1 . . . . 1563 Val H . 17127 1 601 . 1 1 56 56 VAL HA H 1 3.827 0.05 . 1 . . . . 1563 Val HA . 17127 1 602 . 1 1 56 56 VAL HB H 1 2.433 0.05 . 1 . . . . 1563 Val HB . 17127 1 603 . 1 1 56 56 VAL HG11 H 1 0.857 0.05 . 2 . . . . 1563 Val HG11 . 17127 1 604 . 1 1 56 56 VAL HG12 H 1 0.857 0.05 . 2 . . . . 1563 Val HG12 . 17127 1 605 . 1 1 56 56 VAL HG13 H 1 0.857 0.05 . 2 . . . . 1563 Val HG13 . 17127 1 606 . 1 1 56 56 VAL HG21 H 1 1.219 0.05 . 2 . . . . 1563 Val HG21 . 17127 1 607 . 1 1 56 56 VAL HG22 H 1 1.219 0.05 . 2 . . . . 1563 Val HG22 . 17127 1 608 . 1 1 56 56 VAL HG23 H 1 1.219 0.05 . 2 . . . . 1563 Val HG23 . 17127 1 609 . 1 1 56 56 VAL C C 13 175.093 0.20 . 1 . . . . 1563 Val C . 17127 1 610 . 1 1 56 56 VAL CA C 13 64.999 0.20 . 1 . . . . 1563 Val CA . 17127 1 611 . 1 1 56 56 VAL CB C 13 31.480 0.20 . 1 . . . . 1563 Val CB . 17127 1 612 . 1 1 56 56 VAL CG1 C 13 22.616 0.20 . 2 . . . . 1563 Val CG1 . 17127 1 613 . 1 1 56 56 VAL CG2 C 13 24.140 0.20 . 2 . . . . 1563 Val CG2 . 17127 1 614 . 1 1 56 56 VAL N N 15 124.746 0.05 . 1 . . . . 1563 Val N . 17127 1 615 . 1 1 57 57 GLY H H 1 8.614 0.05 . 1 . . . . 1564 Gly H . 17127 1 616 . 1 1 57 57 GLY HA2 H 1 4.219 0.05 . 2 . . . . 1564 Gly HA2 . 17127 1 617 . 1 1 57 57 GLY HA3 H 1 4.058 0.05 . 2 . . . . 1564 Gly HA3 . 17127 1 618 . 1 1 57 57 GLY C C 13 171.151 0.20 . 1 . . . . 1564 Gly C . 17127 1 619 . 1 1 57 57 GLY CA C 13 46.570 0.20 . 1 . . . . 1564 Gly CA . 17127 1 620 . 1 1 57 57 GLY N N 15 114.423 0.05 . 1 . . . . 1564 Gly N . 17127 1 621 . 1 1 58 58 ALA H H 1 7.335 0.05 . 1 . . . . 1565 Ala H . 17127 1 622 . 1 1 58 58 ALA HA H 1 5.961 0.05 . 1 . . . . 1565 Ala HA . 17127 1 623 . 1 1 58 58 ALA HB1 H 1 1.224 0.05 . 1 . . . . 1565 Ala HB1 . 17127 1 624 . 1 1 58 58 ALA HB2 H 1 1.224 0.05 . 1 . . . . 1565 Ala HB2 . 17127 1 625 . 1 1 58 58 ALA HB3 H 1 1.224 0.05 . 1 . . . . 1565 Ala HB3 . 17127 1 626 . 1 1 58 58 ALA C C 13 175.554 0.20 . 1 . . . . 1565 Ala C . 17127 1 627 . 1 1 58 58 ALA CA C 13 51.352 0.20 . 1 . . . . 1565 Ala CA . 17127 1 628 . 1 1 58 58 ALA CB C 13 21.895 0.20 . 1 . . . . 1565 Ala CB . 17127 1 629 . 1 1 58 58 ALA N N 15 119.576 0.05 . 1 . . . . 1565 Ala N . 17127 1 630 . 1 1 59 59 CYS H H 1 9.183 0.05 . 1 . . . . 1566 Cys H . 17127 1 631 . 1 1 59 59 CYS HA H 1 5.465 0.05 . 1 . . . . 1566 Cys HA . 17127 1 632 . 1 1 59 59 CYS HB2 H 1 3.123 0.05 . 2 . . . . 1566 Cys HB2 . 17127 1 633 . 1 1 59 59 CYS HB3 H 1 2.702 0.05 . 2 . . . . 1566 Cys HB3 . 17127 1 634 . 1 1 59 59 CYS C C 13 171.136 0.20 . 1 . . . . 1566 Cys C . 17127 1 635 . 1 1 59 59 CYS CA C 13 56.429 0.20 . 1 . . . . 1566 Cys CA . 17127 1 636 . 1 1 59 59 CYS CB C 13 43.547 0.20 . 1 . . . . 1566 Cys CB . 17127 1 637 . 1 1 59 59 CYS N N 15 114.878 0.05 . 1 . . . . 1566 Cys N . 17127 1 638 . 1 1 60 60 PHE H H 1 8.436 0.05 . 1 . . . . 1567 Phe H . 17127 1 639 . 1 1 60 60 PHE HA H 1 5.689 0.05 . 1 . . . . 1567 Phe HA . 17127 1 640 . 1 1 60 60 PHE HB2 H 1 2.611 0.05 . 2 . . . . 1567 Phe HB2 . 17127 1 641 . 1 1 60 60 PHE HB3 H 1 2.828 0.05 . 2 . . . . 1567 Phe HB3 . 17127 1 642 . 1 1 60 60 PHE HD1 H 1 6.185 0.05 . 3 . . . . 1567 Phe HD1 . 17127 1 643 . 1 1 60 60 PHE HD2 H 1 6.185 0.05 . 3 . . . . 1567 Phe HD2 . 17127 1 644 . 1 1 60 60 PHE HE1 H 1 6.448 0.05 . 3 . . . . 1567 Phe HE1 . 17127 1 645 . 1 1 60 60 PHE HE2 H 1 6.448 0.05 . 3 . . . . 1567 Phe HE2 . 17127 1 646 . 1 1 60 60 PHE HZ H 1 6.537 0.05 . 1 . . . . 1567 Phe HZ . 17127 1 647 . 1 1 60 60 PHE C C 13 172.645 0.20 . 1 . . . . 1567 Phe C . 17127 1 648 . 1 1 60 60 PHE CA C 13 56.654 0.20 . 1 . . . . 1567 Phe CA . 17127 1 649 . 1 1 60 60 PHE CB C 13 44.040 0.20 . 1 . . . . 1567 Phe CB . 17127 1 650 . 1 1 60 60 PHE CD1 C 13 130.376 0.20 . 3 . . . . 1567 Phe CD1 . 17127 1 651 . 1 1 60 60 PHE CD2 C 13 130.376 0.20 . 3 . . . . 1567 Phe CD2 . 17127 1 652 . 1 1 60 60 PHE CE1 C 13 130.599 0.20 . 3 . . . . 1567 Phe CE1 . 17127 1 653 . 1 1 60 60 PHE CE2 C 13 130.599 0.20 . 3 . . . . 1567 Phe CE2 . 17127 1 654 . 1 1 60 60 PHE CZ C 13 129.937 0.20 . 1 . . . . 1567 Phe CZ . 17127 1 655 . 1 1 60 60 PHE N N 15 115.218 0.05 . 1 . . . . 1567 Phe N . 17127 1 656 . 1 1 61 61 GLY H H 1 8.802 0.05 . 1 . . . . 1568 Gly H . 17127 1 657 . 1 1 61 61 GLY HA2 H 1 4.116 0.05 . 2 . . . . 1568 Gly HA2 . 17127 1 658 . 1 1 61 61 GLY HA3 H 1 4.258 0.05 . 2 . . . . 1568 Gly HA3 . 17127 1 659 . 1 1 61 61 GLY C C 13 175.953 0.20 . 1 . . . . 1568 Gly C . 17127 1 660 . 1 1 61 61 GLY CA C 13 43.711 0.20 . 1 . . . . 1568 Gly CA . 17127 1 661 . 1 1 61 61 GLY N N 15 105.731 0.05 . 1 . . . . 1568 Gly N . 17127 1 662 . 1 1 62 62 GLN H H 1 9.519 0.05 . 1 . . . . 1569 Gln H . 17127 1 663 . 1 1 62 62 GLN HA H 1 4.138 0.05 . 1 . . . . 1569 Gln HA . 17127 1 664 . 1 1 62 62 GLN HB2 H 1 2.279 0.05 . 2 . . . . 1569 Gln HB2 . 17127 1 665 . 1 1 62 62 GLN HB3 H 1 2.166 0.05 . 2 . . . . 1569 Gln HB3 . 17127 1 666 . 1 1 62 62 GLN HE21 H 1 6.897 0.05 . 1 . . . . 1569 Gln HE21 . 17127 1 667 . 1 1 62 62 GLN HE22 H 1 7.588 0.05 . 1 . . . . 1569 Gln HE22 . 17127 1 668 . 1 1 62 62 GLN HG2 H 1 2.538 0.05 . 2 . . . . 1569 Gln HG2 . 17127 1 669 . 1 1 62 62 GLN HG3 H 1 2.535 0.05 . 2 . . . . 1569 Gln HG3 . 17127 1 670 . 1 1 62 62 GLN CA C 13 59.583 0.20 . 1 . . . . 1569 Gln CA . 17127 1 671 . 1 1 62 62 GLN CB C 13 29.019 0.20 . 1 . . . . 1569 Gln CB . 17127 1 672 . 1 1 62 62 GLN CG C 13 34.360 0.20 . 1 . . . . 1569 Gln CG . 17127 1 673 . 1 1 62 62 GLN N N 15 123.198 0.05 . 1 . . . . 1569 Gln N . 17127 1 674 . 1 1 62 62 GLN NE2 N 15 111.989 0.05 . 1 . . . . 1569 Gln NE2 . 17127 1 675 . 1 1 63 63 THR H H 1 10.323 0.05 . 1 . . . . 1570 Thr H . 17127 1 676 . 1 1 63 63 THR HA H 1 4.129 0.05 . 1 . . . . 1570 Thr HA . 17127 1 677 . 1 1 63 63 THR HB H 1 4.243 0.05 . 1 . . . . 1570 Thr HB . 17127 1 678 . 1 1 63 63 THR HG21 H 1 1.129 0.05 . 1 . . . . 1570 Thr HG21 . 17127 1 679 . 1 1 63 63 THR HG22 H 1 1.129 0.05 . 1 . . . . 1570 Thr HG22 . 17127 1 680 . 1 1 63 63 THR HG23 H 1 1.129 0.05 . 1 . . . . 1570 Thr HG23 . 17127 1 681 . 1 1 63 63 THR C C 13 174.569 0.20 . 1 . . . . 1570 Thr C . 17127 1 682 . 1 1 63 63 THR CA C 13 62.813 0.20 . 1 . . . . 1570 Thr CA . 17127 1 683 . 1 1 63 63 THR CB C 13 69.102 0.20 . 1 . . . . 1570 Thr CB . 17127 1 684 . 1 1 63 63 THR CG2 C 13 20.851 0.20 . 1 . . . . 1570 Thr CG2 . 17127 1 685 . 1 1 63 63 THR N N 15 110.264 0.05 . 1 . . . . 1570 Thr N . 17127 1 686 . 1 1 64 64 ARG H H 1 7.283 0.05 . 1 . . . . 1571 Arg H . 17127 1 687 . 1 1 64 64 ARG HA H 1 4.128 0.05 . 1 . . . . 1571 Arg HA . 17127 1 688 . 1 1 64 64 ARG HB2 H 1 2.234 0.05 . 1 . . . . 1571 Arg HB2 . 17127 1 689 . 1 1 64 64 ARG HB3 H 1 2.234 0.05 . 1 . . . . 1571 Arg HB3 . 17127 1 690 . 1 1 64 64 ARG HD2 H 1 3.381 0.05 . 2 . . . . 1571 Arg HD2 . 17127 1 691 . 1 1 64 64 ARG HD3 H 1 3.059 0.05 . 2 . . . . 1571 Arg HD3 . 17127 1 692 . 1 1 64 64 ARG HE H 1 6.599 0.05 . 1 . . . . 1571 Arg HE . 17127 1 693 . 1 1 64 64 ARG HG2 H 1 1.584 0.05 . 1 . . . . 1571 Arg HG2 . 17127 1 694 . 1 1 64 64 ARG HG3 H 1 1.584 0.05 . 1 . . . . 1571 Arg HG3 . 17127 1 695 . 1 1 64 64 ARG C C 13 174.442 0.20 . 1 . . . . 1571 Arg C . 17127 1 696 . 1 1 64 64 ARG CA C 13 54.725 0.20 . 1 . . . . 1571 Arg CA . 17127 1 697 . 1 1 64 64 ARG CD C 13 42.356 0.20 . 1 . . . . 1571 Arg CD . 17127 1 698 . 1 1 64 64 ARG CZ C 13 158.789 0.20 . 1 . . . . 1571 Arg CZ . 17127 1 699 . 1 1 64 64 ARG N N 15 116.691 0.05 . 1 . . . . 1571 Arg N . 17127 1 700 . 1 1 64 64 ARG NE N 15 86.482 0.05 . 1 . . . . 1571 Arg NE . 17127 1 701 . 1 1 65 65 ILE H H 1 7.601 0.05 . 1 . . . . 1572 Ile H . 17127 1 702 . 1 1 65 65 ILE HA H 1 3.212 0.05 . 1 . . . . 1572 Ile HA . 17127 1 703 . 1 1 65 65 ILE HB H 1 0.064 0.05 . 1 . . . . 1572 Ile HB . 17127 1 704 . 1 1 65 65 ILE HD11 H 1 0.600 0.05 . 1 . . . . 1572 Ile HD11 . 17127 1 705 . 1 1 65 65 ILE HD12 H 1 0.600 0.05 . 1 . . . . 1572 Ile HD12 . 17127 1 706 . 1 1 65 65 ILE HD13 H 1 0.600 0.05 . 1 . . . . 1572 Ile HD13 . 17127 1 707 . 1 1 65 65 ILE HG12 H 1 1.495 0.05 . 2 . . . . 1572 Ile HG12 . 17127 1 708 . 1 1 65 65 ILE HG13 H 1 0.613 0.05 . 2 . . . . 1572 Ile HG13 . 17127 1 709 . 1 1 65 65 ILE HG21 H 1 0.457 0.05 . 1 . . . . 1572 Ile HG21 . 17127 1 710 . 1 1 65 65 ILE HG22 H 1 0.457 0.05 . 1 . . . . 1572 Ile HG22 . 17127 1 711 . 1 1 65 65 ILE HG23 H 1 0.457 0.05 . 1 . . . . 1572 Ile HG23 . 17127 1 712 . 1 1 65 65 ILE C C 13 176.718 0.20 . 1 . . . . 1572 Ile C . 17127 1 713 . 1 1 65 65 ILE CA C 13 63.274 0.20 . 1 . . . . 1572 Ile CA . 17127 1 714 . 1 1 65 65 ILE CB C 13 37.991 0.20 . 1 . . . . 1572 Ile CB . 17127 1 715 . 1 1 65 65 ILE CD1 C 13 14.759 0.20 . 1 . . . . 1572 Ile CD1 . 17127 1 716 . 1 1 65 65 ILE CG1 C 13 28.879 0.20 . 1 . . . . 1572 Ile CG1 . 17127 1 717 . 1 1 65 65 ILE CG2 C 13 17.806 0.20 . 1 . . . . 1572 Ile CG2 . 17127 1 718 . 1 1 65 65 ILE N N 15 122.886 0.05 . 1 . . . . 1572 Ile N . 17127 1 719 . 1 1 66 66 SER H H 1 8.098 0.05 . 1 . . . . 1573 Ser H . 17127 1 720 . 1 1 66 66 SER HA H 1 4.300 0.05 . 1 . . . . 1573 Ser HA . 17127 1 721 . 1 1 66 66 SER HB2 H 1 3.831 0.05 . 1 . . . . 1573 Ser HB2 . 17127 1 722 . 1 1 66 66 SER HB3 H 1 3.831 0.05 . 1 . . . . 1573 Ser HB3 . 17127 1 723 . 1 1 66 66 SER HG H 1 5.970 0.05 . 1 . . . . 1573 Ser HG . 17127 1 724 . 1 1 66 66 SER C C 13 176.977 0.20 . 1 . . . . 1573 Ser C . 17127 1 725 . 1 1 66 66 SER CA C 13 56.996 0.20 . 1 . . . . 1573 Ser CA . 17127 1 726 . 1 1 66 66 SER CB C 13 63.729 0.20 . 1 . . . . 1573 Ser CB . 17127 1 727 . 1 1 66 66 SER N N 15 119.922 0.05 . 1 . . . . 1573 Ser N . 17127 1 728 . 1 1 67 67 VAL H H 1 8.906 0.05 . 1 . . . . 1574 Val H . 17127 1 729 . 1 1 67 67 VAL HA H 1 4.709 0.05 . 1 . . . . 1574 Val HA . 17127 1 730 . 1 1 67 67 VAL HB H 1 2.345 0.05 . 1 . . . . 1574 Val HB . 17127 1 731 . 1 1 67 67 VAL HG11 H 1 0.316 0.05 . 2 . . . . 1574 Val HG11 . 17127 1 732 . 1 1 67 67 VAL HG12 H 1 0.316 0.05 . 2 . . . . 1574 Val HG12 . 17127 1 733 . 1 1 67 67 VAL HG13 H 1 0.316 0.05 . 2 . . . . 1574 Val HG13 . 17127 1 734 . 1 1 67 67 VAL HG21 H 1 0.640 0.05 . 2 . . . . 1574 Val HG21 . 17127 1 735 . 1 1 67 67 VAL HG22 H 1 0.640 0.05 . 2 . . . . 1574 Val HG22 . 17127 1 736 . 1 1 67 67 VAL HG23 H 1 0.640 0.05 . 2 . . . . 1574 Val HG23 . 17127 1 737 . 1 1 67 67 VAL C C 13 174.272 0.20 . 1 . . . . 1574 Val C . 17127 1 738 . 1 1 67 67 VAL CA C 13 59.753 0.20 . 1 . . . . 1574 Val CA . 17127 1 739 . 1 1 67 67 VAL CB C 13 29.022 0.20 . 1 . . . . 1574 Val CB . 17127 1 740 . 1 1 67 67 VAL CG1 C 13 22.672 0.20 . 2 . . . . 1574 Val CG1 . 17127 1 741 . 1 1 67 67 VAL CG2 C 13 20.034 0.20 . 2 . . . . 1574 Val CG2 . 17127 1 742 . 1 1 67 67 VAL N N 15 120.335 0.05 . 1 . . . . 1574 Val N . 17127 1 743 . 1 1 68 68 GLY H H 1 7.825 0.05 . 1 . . . . 1575 Gly H . 17127 1 744 . 1 1 68 68 GLY HA2 H 1 4.660 0.05 . 2 . . . . 1575 Gly HA2 . 17127 1 745 . 1 1 68 68 GLY HA3 H 1 2.968 0.05 . 2 . . . . 1575 Gly HA3 . 17127 1 746 . 1 1 68 68 GLY C C 13 173.347 0.20 . 1 . . . . 1575 Gly C . 17127 1 747 . 1 1 68 68 GLY CA C 13 45.585 0.20 . 1 . . . . 1575 Gly CA . 17127 1 748 . 1 1 68 68 GLY N N 15 106.445 0.05 . 1 . . . . 1575 Gly N . 17127 1 749 . 1 1 69 69 LYS H H 1 8.949 0.05 . 1 . . . . 1576 Lys H . 17127 1 750 . 1 1 69 69 LYS HA H 1 4.265 0.05 . 1 . . . . 1576 Lys HA . 17127 1 751 . 1 1 69 69 LYS HB2 H 1 1.769 0.05 . 2 . . . . 1576 Lys HB2 . 17127 1 752 . 1 1 69 69 LYS HB3 H 1 1.908 0.05 . 2 . . . . 1576 Lys HB3 . 17127 1 753 . 1 1 69 69 LYS HD2 H 1 1.727 0.05 . 1 . . . . 1576 Lys HD2 . 17127 1 754 . 1 1 69 69 LYS HD3 H 1 1.727 0.05 . 1 . . . . 1576 Lys HD3 . 17127 1 755 . 1 1 69 69 LYS HE2 H 1 3.070 0.05 . 1 . . . . 1576 Lys HE2 . 17127 1 756 . 1 1 69 69 LYS HE3 H 1 3.070 0.05 . 1 . . . . 1576 Lys HE3 . 17127 1 757 . 1 1 69 69 LYS HG2 H 1 1.346 0.05 . 1 . . . . 1576 Lys HG2 . 17127 1 758 . 1 1 69 69 LYS HG3 H 1 1.346 0.05 . 1 . . . . 1576 Lys HG3 . 17127 1 759 . 1 1 69 69 LYS C C 13 176.554 0.20 . 1 . . . . 1576 Lys C . 17127 1 760 . 1 1 69 69 LYS CA C 13 57.201 0.20 . 1 . . . . 1576 Lys CA . 17127 1 761 . 1 1 69 69 LYS CB C 13 32.921 0.20 . 1 . . . . 1576 Lys CB . 17127 1 762 . 1 1 69 69 LYS CD C 13 25.859 0.20 . 1 . . . . 1576 Lys CD . 17127 1 763 . 1 1 69 69 LYS CE C 13 45.670 0.20 . 1 . . . . 1576 Lys CE . 17127 1 764 . 1 1 69 69 LYS CG C 13 29.917 0.20 . 1 . . . . 1576 Lys CG . 17127 1 765 . 1 1 69 69 LYS N N 15 126.584 0.05 . 1 . . . . 1576 Lys N . 17127 1 766 . 1 1 70 70 ALA H H 1 7.853 0.05 . 1 . . . . 1577 Ala H . 17127 1 767 . 1 1 70 70 ALA HA H 1 2.481 0.05 . 1 . . . . 1577 Ala HA . 17127 1 768 . 1 1 70 70 ALA HB1 H 1 0.600 0.05 . 1 . . . . 1577 Ala HB1 . 17127 1 769 . 1 1 70 70 ALA HB2 H 1 0.600 0.05 . 1 . . . . 1577 Ala HB2 . 17127 1 770 . 1 1 70 70 ALA HB3 H 1 0.600 0.05 . 1 . . . . 1577 Ala HB3 . 17127 1 771 . 1 1 70 70 ALA C C 13 176.248 0.20 . 1 . . . . 1577 Ala C . 17127 1 772 . 1 1 70 70 ALA CA C 13 52.125 0.20 . 1 . . . . 1577 Ala CA . 17127 1 773 . 1 1 70 70 ALA CB C 13 18.690 0.20 . 1 . . . . 1577 Ala CB . 17127 1 774 . 1 1 70 70 ALA N N 15 123.804 0.05 . 1 . . . . 1577 Ala N . 17127 1 775 . 1 1 71 71 ASN H H 1 6.935 0.05 . 1 . . . . 1578 Asn H . 17127 1 776 . 1 1 71 71 ASN HA H 1 4.603 0.05 . 1 . . . . 1578 Asn HA . 17127 1 777 . 1 1 71 71 ASN HB2 H 1 2.952 0.05 . 1 . . . . 1578 Asn HB2 . 17127 1 778 . 1 1 71 71 ASN HB3 H 1 2.952 0.05 . 1 . . . . 1578 Asn HB3 . 17127 1 779 . 1 1 71 71 ASN HD21 H 1 7.936 0.05 . 1 . . . . 1578 Asn HD21 . 17127 1 780 . 1 1 71 71 ASN HD22 H 1 8.116 0.05 . 1 . . . . 1578 Asn HD22 . 17127 1 781 . 1 1 71 71 ASN C C 13 172.253 0.20 . 1 . . . . 1578 Asn C . 17127 1 782 . 1 1 71 71 ASN CA C 13 53.469 0.20 . 1 . . . . 1578 Asn CA . 17127 1 783 . 1 1 71 71 ASN CB C 13 41.255 0.20 . 1 . . . . 1578 Asn CB . 17127 1 784 . 1 1 71 71 ASN N N 15 113.446 0.05 . 1 . . . . 1578 Asn N . 17127 1 785 . 1 1 71 71 ASN ND2 N 15 119.059 0.05 . 1 . . . . 1578 Asn ND2 . 17127 1 786 . 1 1 72 72 LYS H H 1 8.636 0.05 . 1 . . . . 1579 Lys H . 17127 1 787 . 1 1 72 72 LYS HA H 1 4.839 0.05 . 1 . . . . 1579 Lys HA . 17127 1 788 . 1 1 72 72 LYS HB2 H 1 2.009 0.05 . 1 . . . . 1579 Lys HB2 . 17127 1 789 . 1 1 72 72 LYS HB3 H 1 2.009 0.05 . 1 . . . . 1579 Lys HB3 . 17127 1 790 . 1 1 72 72 LYS HD2 H 1 1.750 0.05 . 1 . . . . 1579 Lys HD2 . 17127 1 791 . 1 1 72 72 LYS HD3 H 1 1.750 0.05 . 1 . . . . 1579 Lys HD3 . 17127 1 792 . 1 1 72 72 LYS HE2 H 1 3.000 0.05 . 2 . . . . 1579 Lys HE2 . 17127 1 793 . 1 1 72 72 LYS HE3 H 1 3.005 0.05 . 2 . . . . 1579 Lys HE3 . 17127 1 794 . 1 1 72 72 LYS HG2 H 1 1.243 0.05 . 1 . . . . 1579 Lys HG2 . 17127 1 795 . 1 1 72 72 LYS HG3 H 1 1.243 0.05 . 1 . . . . 1579 Lys HG3 . 17127 1 796 . 1 1 72 72 LYS C C 13 176.171 0.20 . 1 . . . . 1579 Lys C . 17127 1 797 . 1 1 72 72 LYS CA C 13 54.925 0.20 . 1 . . . . 1579 Lys CA . 17127 1 798 . 1 1 72 72 LYS CB C 13 32.857 0.20 . 1 . . . . 1579 Lys CB . 17127 1 799 . 1 1 72 72 LYS CD C 13 30.105 0.20 . 1 . . . . 1579 Lys CD . 17127 1 800 . 1 1 72 72 LYS CE C 13 42.462 0.20 . 1 . . . . 1579 Lys CE . 17127 1 801 . 1 1 72 72 LYS CG C 13 24.743 0.20 . 1 . . . . 1579 Lys CG . 17127 1 802 . 1 1 72 72 LYS N N 15 115.608 0.05 . 1 . . . . 1579 Lys N . 17127 1 803 . 1 1 73 73 ARG H H 1 8.488 0.05 . 1 . . . . 1580 Arg H . 17127 1 804 . 1 1 73 73 ARG HA H 1 4.633 0.05 . 1 . . . . 1580 Arg HA . 17127 1 805 . 1 1 73 73 ARG HB2 H 1 1.806 0.05 . 2 . . . . 1580 Arg HB2 . 17127 1 806 . 1 1 73 73 ARG HB3 H 1 1.805 0.05 . 2 . . . . 1580 Arg HB3 . 17127 1 807 . 1 1 73 73 ARG HD2 H 1 3.230 0.05 . 2 . . . . 1580 Arg HD2 . 17127 1 808 . 1 1 73 73 ARG HD3 H 1 3.252 0.05 . 2 . . . . 1580 Arg HD3 . 17127 1 809 . 1 1 73 73 ARG HE H 1 7.434 0.05 . 1 . . . . 1580 Arg HE . 17127 1 810 . 1 1 73 73 ARG HG2 H 1 1.623 0.05 . 1 . . . . 1580 Arg HG2 . 17127 1 811 . 1 1 73 73 ARG HG3 H 1 1.623 0.05 . 1 . . . . 1580 Arg HG3 . 17127 1 812 . 1 1 73 73 ARG C C 13 174.379 0.20 . 1 . . . . 1580 Arg C . 17127 1 813 . 1 1 73 73 ARG CA C 13 55.419 0.20 . 1 . . . . 1580 Arg CA . 17127 1 814 . 1 1 73 73 ARG CB C 13 29.012 0.20 . 1 . . . . 1580 Arg CB . 17127 1 815 . 1 1 73 73 ARG CD C 13 43.436 0.20 . 1 . . . . 1580 Arg CD . 17127 1 816 . 1 1 73 73 ARG CG C 13 27.384 0.20 . 1 . . . . 1580 Arg CG . 17127 1 817 . 1 1 73 73 ARG N N 15 122.777 0.05 . 1 . . . . 1580 Arg N . 17127 1 818 . 1 1 73 73 ARG NE N 15 84.981 0.05 . 1 . . . . 1580 Arg NE . 17127 1 819 . 1 1 74 74 LEU H H 1 8.340 0.05 . 1 . . . . 1581 Leu H . 17127 1 820 . 1 1 74 74 LEU HA H 1 4.519 0.05 . 1 . . . . 1581 Leu HA . 17127 1 821 . 1 1 74 74 LEU HB2 H 1 0.970 0.05 . 2 . . . . 1581 Leu HB2 . 17127 1 822 . 1 1 74 74 LEU HB3 H 1 1.576 0.05 . 2 . . . . 1581 Leu HB3 . 17127 1 823 . 1 1 74 74 LEU HD11 H 1 0.547 0.05 . 2 . . . . 1581 Leu HD11 . 17127 1 824 . 1 1 74 74 LEU HD12 H 1 0.547 0.05 . 2 . . . . 1581 Leu HD12 . 17127 1 825 . 1 1 74 74 LEU HD13 H 1 0.547 0.05 . 2 . . . . 1581 Leu HD13 . 17127 1 826 . 1 1 74 74 LEU HD21 H 1 0.632 0.05 . 2 . . . . 1581 Leu HD21 . 17127 1 827 . 1 1 74 74 LEU HD22 H 1 0.632 0.05 . 2 . . . . 1581 Leu HD22 . 17127 1 828 . 1 1 74 74 LEU HD23 H 1 0.632 0.05 . 2 . . . . 1581 Leu HD23 . 17127 1 829 . 1 1 74 74 LEU HG H 1 1.360 0.05 . 1 . . . . 1581 Leu HG . 17127 1 830 . 1 1 74 74 LEU C C 13 175.647 0.20 . 1 . . . . 1581 Leu C . 17127 1 831 . 1 1 74 74 LEU CA C 13 55.027 0.20 . 1 . . . . 1581 Leu CA . 17127 1 832 . 1 1 74 74 LEU CB C 13 44.852 0.20 . 1 . . . . 1581 Leu CB . 17127 1 833 . 1 1 74 74 LEU CD1 C 13 26.319 0.20 . 2 . . . . 1581 Leu CD1 . 17127 1 834 . 1 1 74 74 LEU CD2 C 13 24.820 0.20 . 2 . . . . 1581 Leu CD2 . 17127 1 835 . 1 1 74 74 LEU CG C 13 26.727 0.20 . 1 . . . . 1581 Leu CG . 17127 1 836 . 1 1 74 74 LEU N N 15 129.383 0.05 . 1 . . . . 1581 Leu N . 17127 1 837 . 1 1 75 75 ARG H H 1 8.861 0.05 . 1 . . . . 1582 Arg H . 17127 1 838 . 1 1 75 75 ARG HA H 1 4.984 0.05 . 1 . . . . 1582 Arg HA . 17127 1 839 . 1 1 75 75 ARG HB2 H 1 1.769 0.05 . 1 . . . . 1582 Arg HB2 . 17127 1 840 . 1 1 75 75 ARG HB3 H 1 1.769 0.05 . 1 . . . . 1582 Arg HB3 . 17127 1 841 . 1 1 75 75 ARG HD2 H 1 3.208 0.05 . 1 . . . . 1582 Arg HD2 . 17127 1 842 . 1 1 75 75 ARG HD3 H 1 3.208 0.05 . 1 . . . . 1582 Arg HD3 . 17127 1 843 . 1 1 75 75 ARG HE H 1 7.130 0.05 . 1 . . . . 1582 Arg HE . 17127 1 844 . 1 1 75 75 ARG HG2 H 1 1.620 0.05 . 1 . . . . 1582 Arg HG2 . 17127 1 845 . 1 1 75 75 ARG HG3 H 1 1.620 0.05 . 1 . . . . 1582 Arg HG3 . 17127 1 846 . 1 1 75 75 ARG C C 13 174.471 0.20 . 1 . . . . 1582 Arg C . 17127 1 847 . 1 1 75 75 ARG CA C 13 54.733 0.20 . 1 . . . . 1582 Arg CA . 17127 1 848 . 1 1 75 75 ARG CB C 13 34.084 0.20 . 1 . . . . 1582 Arg CB . 17127 1 849 . 1 1 75 75 ARG CD C 13 43.784 0.20 . 1 . . . . 1582 Arg CD . 17127 1 850 . 1 1 75 75 ARG CG C 13 27.329 0.20 . 1 . . . . 1582 Arg CG . 17127 1 851 . 1 1 75 75 ARG N N 15 123.232 0.05 . 1 . . . . 1582 Arg N . 17127 1 852 . 1 1 75 75 ARG NE N 15 85.116 0.05 . 1 . . . . 1582 Arg NE . 17127 1 853 . 1 1 76 76 TYR H H 1 8.892 0.05 . 1 . . . . 1583 Tyr H . 17127 1 854 . 1 1 76 76 TYR HA H 1 4.859 0.05 . 1 . . . . 1583 Tyr HA . 17127 1 855 . 1 1 76 76 TYR HB2 H 1 3.074 0.05 . 2 . . . . 1583 Tyr HB2 . 17127 1 856 . 1 1 76 76 TYR HB3 H 1 2.598 0.05 . 2 . . . . 1583 Tyr HB3 . 17127 1 857 . 1 1 76 76 TYR HD1 H 1 6.816 0.05 . 3 . . . . 1583 Tyr HD1 . 17127 1 858 . 1 1 76 76 TYR HD2 H 1 6.816 0.05 . 3 . . . . 1583 Tyr HD2 . 17127 1 859 . 1 1 76 76 TYR HE1 H 1 6.784 0.05 . 3 . . . . 1583 Tyr HE1 . 17127 1 860 . 1 1 76 76 TYR HE2 H 1 6.784 0.05 . 3 . . . . 1583 Tyr HE2 . 17127 1 861 . 1 1 76 76 TYR C C 13 174.595 0.20 . 1 . . . . 1583 Tyr C . 17127 1 862 . 1 1 76 76 TYR CA C 13 57.790 0.20 . 1 . . . . 1583 Tyr CA . 17127 1 863 . 1 1 76 76 TYR CB C 13 40.225 0.20 . 1 . . . . 1583 Tyr CB . 17127 1 864 . 1 1 76 76 TYR CD1 C 13 132.896 0.20 . 3 . . . . 1583 Tyr CD1 . 17127 1 865 . 1 1 76 76 TYR CD2 C 13 132.896 0.20 . 3 . . . . 1583 Tyr CD2 . 17127 1 866 . 1 1 76 76 TYR CE1 C 13 117.584 0.20 . 3 . . . . 1583 Tyr CE1 . 17127 1 867 . 1 1 76 76 TYR CE2 C 13 117.584 0.20 . 3 . . . . 1583 Tyr CE2 . 17127 1 868 . 1 1 76 76 TYR N N 15 124.786 0.05 . 1 . . . . 1583 Tyr N . 17127 1 869 . 1 1 77 77 VAL H H 1 8.655 0.05 . 1 . . . . 1584 Val H . 17127 1 870 . 1 1 77 77 VAL HA H 1 4.207 0.05 . 1 . . . . 1584 Val HA . 17127 1 871 . 1 1 77 77 VAL HB H 1 2.091 0.05 . 1 . . . . 1584 Val HB . 17127 1 872 . 1 1 77 77 VAL HG11 H 1 0.796 0.05 . 2 . . . . 1584 Val HG11 . 17127 1 873 . 1 1 77 77 VAL HG12 H 1 0.796 0.05 . 2 . . . . 1584 Val HG12 . 17127 1 874 . 1 1 77 77 VAL HG13 H 1 0.796 0.05 . 2 . . . . 1584 Val HG13 . 17127 1 875 . 1 1 77 77 VAL HG21 H 1 0.774 0.05 . 2 . . . . 1584 Val HG21 . 17127 1 876 . 1 1 77 77 VAL HG22 H 1 0.774 0.05 . 2 . . . . 1584 Val HG22 . 17127 1 877 . 1 1 77 77 VAL HG23 H 1 0.774 0.05 . 2 . . . . 1584 Val HG23 . 17127 1 878 . 1 1 77 77 VAL C C 13 174.584 0.20 . 1 . . . . 1584 Val C . 17127 1 879 . 1 1 77 77 VAL CA C 13 60.477 0.20 . 1 . . . . 1584 Val CA . 17127 1 880 . 1 1 77 77 VAL CB C 13 33.777 0.20 . 1 . . . . 1584 Val CB . 17127 1 881 . 1 1 77 77 VAL CG1 C 13 20.225 0.20 . 2 . . . . 1584 Val CG1 . 17127 1 882 . 1 1 77 77 VAL CG2 C 13 21.399 0.20 . 2 . . . . 1584 Val CG2 . 17127 1 883 . 1 1 77 77 VAL N N 15 127.777 0.05 . 1 . . . . 1584 Val N . 17127 1 884 . 1 1 78 78 ASP H H 1 8.945 0.05 . 1 . . . . 1585 Asp H . 17127 1 885 . 1 1 78 78 ASP HA H 1 4.210 0.05 . 1 . . . . 1585 Asp HA . 17127 1 886 . 1 1 78 78 ASP HB2 H 1 2.537 0.05 . 2 . . . . 1585 Asp HB2 . 17127 1 887 . 1 1 78 78 ASP HB3 H 1 2.872 0.05 . 2 . . . . 1585 Asp HB3 . 17127 1 888 . 1 1 78 78 ASP C C 13 174.001 0.20 . 1 . . . . 1585 Asp C . 17127 1 889 . 1 1 78 78 ASP CA C 13 55.604 0.20 . 1 . . . . 1585 Asp CA . 17127 1 890 . 1 1 78 78 ASP CB C 13 38.945 0.20 . 1 . . . . 1585 Asp CB . 17127 1 891 . 1 1 78 78 ASP N N 15 125.839 0.05 . 1 . . . . 1585 Asp N . 17127 1 892 . 1 1 79 79 GLN H H 1 6.621 0.05 . 1 . . . . 1586 Gln H . 17127 1 893 . 1 1 79 79 GLN HA H 1 3.562 0.05 . 1 . . . . 1586 Gln HA . 17127 1 894 . 1 1 79 79 GLN HB2 H 1 2.287 0.05 . 2 . . . . 1586 Gln HB2 . 17127 1 895 . 1 1 79 79 GLN HB3 H 1 2.481 0.05 . 2 . . . . 1586 Gln HB3 . 17127 1 896 . 1 1 79 79 GLN HE21 H 1 6.855 0.05 . 1 . . . . 1586 Gln HE21 . 17127 1 897 . 1 1 79 79 GLN HE22 H 1 7.536 0.05 . 1 . . . . 1586 Gln HE22 . 17127 1 898 . 1 1 79 79 GLN HG2 H 1 2.285 0.05 . 2 . . . . 1586 Gln HG2 . 17127 1 899 . 1 1 79 79 GLN HG3 H 1 2.420 0.05 . 2 . . . . 1586 Gln HG3 . 17127 1 900 . 1 1 79 79 GLN C C 13 174.232 0.20 . 1 . . . . 1586 Gln C . 17127 1 901 . 1 1 79 79 GLN CA C 13 58.488 0.20 . 1 . . . . 1586 Gln CA . 17127 1 902 . 1 1 79 79 GLN CB C 13 27.834 0.20 . 1 . . . . 1586 Gln CB . 17127 1 903 . 1 1 79 79 GLN CG C 13 35.235 0.20 . 1 . . . . 1586 Gln CG . 17127 1 904 . 1 1 79 79 GLN N N 15 104.367 0.05 . 1 . . . . 1586 Gln N . 17127 1 905 . 1 1 79 79 GLN NE2 N 15 111.996 0.05 . 1 . . . . 1586 Gln NE2 . 17127 1 906 . 1 1 80 80 VAL H H 1 7.618 0.05 . 1 . . . . 1587 Val H . 17127 1 907 . 1 1 80 80 VAL HA H 1 4.452 0.05 . 1 . . . . 1587 Val HA . 17127 1 908 . 1 1 80 80 VAL HB H 1 2.092 0.05 . 1 . . . . 1587 Val HB . 17127 1 909 . 1 1 80 80 VAL HG11 H 1 0.848 0.05 . 2 . . . . 1587 Val HG11 . 17127 1 910 . 1 1 80 80 VAL HG12 H 1 0.848 0.05 . 2 . . . . 1587 Val HG12 . 17127 1 911 . 1 1 80 80 VAL HG13 H 1 0.848 0.05 . 2 . . . . 1587 Val HG13 . 17127 1 912 . 1 1 80 80 VAL HG21 H 1 0.718 0.05 . 2 . . . . 1587 Val HG21 . 17127 1 913 . 1 1 80 80 VAL HG22 H 1 0.718 0.05 . 2 . . . . 1587 Val HG22 . 17127 1 914 . 1 1 80 80 VAL HG23 H 1 0.718 0.05 . 2 . . . . 1587 Val HG23 . 17127 1 915 . 1 1 80 80 VAL C C 13 174.135 0.20 . 1 . . . . 1587 Val C . 17127 1 916 . 1 1 80 80 VAL CA C 13 60.438 0.20 . 1 . . . . 1587 Val CA . 17127 1 917 . 1 1 80 80 VAL CB C 13 34.286 0.20 . 1 . . . . 1587 Val CB . 17127 1 918 . 1 1 80 80 VAL CG1 C 13 20.822 0.20 . 2 . . . . 1587 Val CG1 . 17127 1 919 . 1 1 80 80 VAL CG2 C 13 21.896 0.20 . 2 . . . . 1587 Val CG2 . 17127 1 920 . 1 1 80 80 VAL N N 15 119.750 0.05 . 1 . . . . 1587 Val N . 17127 1 921 . 1 1 81 81 LEU H H 1 8.162 0.05 . 1 . . . . 1588 Leu H . 17127 1 922 . 1 1 81 81 LEU HA H 1 5.361 0.05 . 1 . . . . 1588 Leu HA . 17127 1 923 . 1 1 81 81 LEU HB2 H 1 1.720 0.05 . 2 . . . . 1588 Leu HB2 . 17127 1 924 . 1 1 81 81 LEU HB3 H 1 1.303 0.05 . 2 . . . . 1588 Leu HB3 . 17127 1 925 . 1 1 81 81 LEU HD11 H 1 0.130 0.05 . 2 . . . . 1588 Leu HD11 . 17127 1 926 . 1 1 81 81 LEU HD12 H 1 0.130 0.05 . 2 . . . . 1588 Leu HD12 . 17127 1 927 . 1 1 81 81 LEU HD13 H 1 0.130 0.05 . 2 . . . . 1588 Leu HD13 . 17127 1 928 . 1 1 81 81 LEU HD21 H 1 0.411 0.05 . 2 . . . . 1588 Leu HD21 . 17127 1 929 . 1 1 81 81 LEU HD22 H 1 0.411 0.05 . 2 . . . . 1588 Leu HD22 . 17127 1 930 . 1 1 81 81 LEU HD23 H 1 0.411 0.05 . 2 . . . . 1588 Leu HD23 . 17127 1 931 . 1 1 81 81 LEU HG H 1 1.308 0.05 . 1 . . . . 1588 Leu HG . 17127 1 932 . 1 1 81 81 LEU C C 13 177.001 0.20 . 1 . . . . 1588 Leu C . 17127 1 933 . 1 1 81 81 LEU CA C 13 52.441 0.20 . 1 . . . . 1588 Leu CA . 17127 1 934 . 1 1 81 81 LEU CB C 13 43.283 0.20 . 1 . . . . 1588 Leu CB . 17127 1 935 . 1 1 81 81 LEU CD1 C 13 23.095 0.20 . 2 . . . . 1588 Leu CD1 . 17127 1 936 . 1 1 81 81 LEU CD2 C 13 25.333 0.20 . 2 . . . . 1588 Leu CD2 . 17127 1 937 . 1 1 81 81 LEU CG C 13 27.492 0.20 . 1 . . . . 1588 Leu CG . 17127 1 938 . 1 1 81 81 LEU N N 15 121.985 0.05 . 1 . . . . 1588 Leu N . 17127 1 939 . 1 1 82 82 GLN H H 1 9.353 0.05 . 1 . . . . 1589 Gln H . 17127 1 940 . 1 1 82 82 GLN HA H 1 5.918 0.05 . 1 . . . . 1589 Gln HA . 17127 1 941 . 1 1 82 82 GLN HB2 H 1 1.686 0.05 . 2 . . . . 1589 Gln HB2 . 17127 1 942 . 1 1 82 82 GLN HB3 H 1 1.801 0.05 . 2 . . . . 1589 Gln HB3 . 17127 1 943 . 1 1 82 82 GLN HE21 H 1 6.654 0.05 . 1 . . . . 1589 Gln HE21 . 17127 1 944 . 1 1 82 82 GLN HE22 H 1 6.954 0.05 . 1 . . . . 1589 Gln HE22 . 17127 1 945 . 1 1 82 82 GLN HG2 H 1 2.103 0.05 . 2 . . . . 1589 Gln HG2 . 17127 1 946 . 1 1 82 82 GLN HG3 H 1 2.085 0.05 . 2 . . . . 1589 Gln HG3 . 17127 1 947 . 1 1 82 82 GLN C C 13 175.233 0.20 . 1 . . . . 1589 Gln C . 17127 1 948 . 1 1 82 82 GLN CA C 13 54.994 0.20 . 1 . . . . 1589 Gln CA . 17127 1 949 . 1 1 82 82 GLN CB C 13 35.499 0.20 . 1 . . . . 1589 Gln CB . 17127 1 950 . 1 1 82 82 GLN CG C 13 35.404 0.20 . 1 . . . . 1589 Gln CG . 17127 1 951 . 1 1 82 82 GLN N N 15 121.550 0.05 . 1 . . . . 1589 Gln N . 17127 1 952 . 1 1 82 82 GLN NE2 N 15 109.421 0.05 . 1 . . . . 1589 Gln NE2 . 17127 1 953 . 1 1 83 83 LEU H H 1 8.922 0.05 . 1 . . . . 1590 Leu H . 17127 1 954 . 1 1 83 83 LEU HA H 1 4.784 0.05 . 1 . . . . 1590 Leu HA . 17127 1 955 . 1 1 83 83 LEU HB2 H 1 1.387 0.05 . 1 . . . . 1590 Leu HB2 . 17127 1 956 . 1 1 83 83 LEU HB3 H 1 1.387 0.05 . 1 . . . . 1590 Leu HB3 . 17127 1 957 . 1 1 83 83 LEU HD11 H 1 1.071 0.05 . 2 . . . . 1590 Leu HD11 . 17127 1 958 . 1 1 83 83 LEU HD12 H 1 1.071 0.05 . 2 . . . . 1590 Leu HD12 . 17127 1 959 . 1 1 83 83 LEU HD13 H 1 1.071 0.05 . 2 . . . . 1590 Leu HD13 . 17127 1 960 . 1 1 83 83 LEU HD21 H 1 0.973 0.05 . 2 . . . . 1590 Leu HD21 . 17127 1 961 . 1 1 83 83 LEU HD22 H 1 0.973 0.05 . 2 . . . . 1590 Leu HD22 . 17127 1 962 . 1 1 83 83 LEU HD23 H 1 0.973 0.05 . 2 . . . . 1590 Leu HD23 . 17127 1 963 . 1 1 83 83 LEU HG H 1 1.508 0.05 . 1 . . . . 1590 Leu HG . 17127 1 964 . 1 1 83 83 LEU C C 13 174.760 0.20 . 1 . . . . 1590 Leu C . 17127 1 965 . 1 1 83 83 LEU CA C 13 53.965 0.20 . 1 . . . . 1590 Leu CA . 17127 1 966 . 1 1 83 83 LEU CB C 13 47.434 0.20 . 1 . . . . 1590 Leu CB . 17127 1 967 . 1 1 83 83 LEU CD1 C 13 26.408 0.20 . 2 . . . . 1590 Leu CD1 . 17127 1 968 . 1 1 83 83 LEU CD2 C 13 24.404 0.20 . 2 . . . . 1590 Leu CD2 . 17127 1 969 . 1 1 83 83 LEU CG C 13 27.635 0.20 . 1 . . . . 1590 Leu CG . 17127 1 970 . 1 1 83 83 LEU N N 15 126.016 0.05 . 1 . . . . 1590 Leu N . 17127 1 971 . 1 1 84 84 VAL H H 1 9.347 0.05 . 1 . . . . 1591 Val H . 17127 1 972 . 1 1 84 84 VAL HA H 1 4.955 0.05 . 1 . . . . 1591 Val HA . 17127 1 973 . 1 1 84 84 VAL HB H 1 2.026 0.05 . 1 . . . . 1591 Val HB . 17127 1 974 . 1 1 84 84 VAL HG11 H 1 0.810 0.05 . 2 . . . . 1591 Val HG11 . 17127 1 975 . 1 1 84 84 VAL HG12 H 1 0.810 0.05 . 2 . . . . 1591 Val HG12 . 17127 1 976 . 1 1 84 84 VAL HG13 H 1 0.810 0.05 . 2 . . . . 1591 Val HG13 . 17127 1 977 . 1 1 84 84 VAL HG21 H 1 0.924 0.05 . 2 . . . . 1591 Val HG21 . 17127 1 978 . 1 1 84 84 VAL HG22 H 1 0.924 0.05 . 2 . . . . 1591 Val HG22 . 17127 1 979 . 1 1 84 84 VAL HG23 H 1 0.924 0.05 . 2 . . . . 1591 Val HG23 . 17127 1 980 . 1 1 84 84 VAL C C 13 176.273 0.20 . 1 . . . . 1591 Val C . 17127 1 981 . 1 1 84 84 VAL CA C 13 61.203 0.20 . 1 . . . . 1591 Val CA . 17127 1 982 . 1 1 84 84 VAL CB C 13 34.153 0.20 . 1 . . . . 1591 Val CB . 17127 1 983 . 1 1 84 84 VAL CG1 C 13 20.204 0.20 . 2 . . . . 1591 Val CG1 . 17127 1 984 . 1 1 84 84 VAL CG2 C 13 21.168 0.20 . 2 . . . . 1591 Val CG2 . 17127 1 985 . 1 1 84 84 VAL N N 15 122.441 0.05 . 1 . . . . 1591 Val N . 17127 1 986 . 1 1 85 85 TYR H H 1 9.399 0.05 . 1 . . . . 1592 Tyr H . 17127 1 987 . 1 1 85 85 TYR HA H 1 5.183 0.05 . 1 . . . . 1592 Tyr HA . 17127 1 988 . 1 1 85 85 TYR HB2 H 1 3.160 0.05 . 2 . . . . 1592 Tyr HB2 . 17127 1 989 . 1 1 85 85 TYR HB3 H 1 2.873 0.05 . 2 . . . . 1592 Tyr HB3 . 17127 1 990 . 1 1 85 85 TYR HD1 H 1 6.807 0.05 . 3 . . . . 1592 Tyr HD1 . 17127 1 991 . 1 1 85 85 TYR HD2 H 1 6.807 0.05 . 3 . . . . 1592 Tyr HD2 . 17127 1 992 . 1 1 85 85 TYR HE1 H 1 7.067 0.05 . 3 . . . . 1592 Tyr HE1 . 17127 1 993 . 1 1 85 85 TYR HE2 H 1 7.067 0.05 . 3 . . . . 1592 Tyr HE2 . 17127 1 994 . 1 1 85 85 TYR HH H 1 10.219 0.05 . 1 . . . . 1592 Tyr HH . 17127 1 995 . 1 1 85 85 TYR C C 13 174.304 0.20 . 1 . . . . 1592 Tyr C . 17127 1 996 . 1 1 85 85 TYR CA C 13 52.556 0.20 . 1 . . . . 1592 Tyr CA . 17127 1 997 . 1 1 85 85 TYR CB C 13 38.187 0.20 . 1 . . . . 1592 Tyr CB . 17127 1 998 . 1 1 85 85 TYR CD1 C 13 130.995 0.20 . 3 . . . . 1592 Tyr CD1 . 17127 1 999 . 1 1 85 85 TYR CD2 C 13 130.995 0.20 . 3 . . . . 1592 Tyr CD2 . 17127 1 1000 . 1 1 85 85 TYR CE1 C 13 116.849 0.20 . 3 . . . . 1592 Tyr CE1 . 17127 1 1001 . 1 1 85 85 TYR CE2 C 13 116.849 0.20 . 3 . . . . 1592 Tyr CE2 . 17127 1 1002 . 1 1 85 85 TYR N N 15 129.163 0.05 . 1 . . . . 1592 Tyr N . 17127 1 1003 . 1 1 86 86 LYS H H 1 8.909 0.05 . 1 . . . . 1593 Lys H . 17127 1 1004 . 1 1 86 86 LYS HA H 1 4.985 0.05 . 1 . . . . 1593 Lys HA . 17127 1 1005 . 1 1 86 86 LYS HB2 H 1 1.691 0.05 . 2 . . . . 1593 Lys HB2 . 17127 1 1006 . 1 1 86 86 LYS HB3 H 1 1.876 0.05 . 2 . . . . 1593 Lys HB3 . 17127 1 1007 . 1 1 86 86 LYS HD2 H 1 1.679 0.05 . 2 . . . . 1593 Lys HD2 . 17127 1 1008 . 1 1 86 86 LYS HD3 H 1 1.690 0.05 . 2 . . . . 1593 Lys HD3 . 17127 1 1009 . 1 1 86 86 LYS HE2 H 1 2.963 0.05 . 2 . . . . 1593 Lys HE2 . 17127 1 1010 . 1 1 86 86 LYS HE3 H 1 2.954 0.05 . 2 . . . . 1593 Lys HE3 . 17127 1 1011 . 1 1 86 86 LYS HG2 H 1 1.430 0.05 . 2 . . . . 1593 Lys HG2 . 17127 1 1012 . 1 1 86 86 LYS HG3 H 1 1.423 0.05 . 2 . . . . 1593 Lys HG3 . 17127 1 1013 . 1 1 86 86 LYS C C 13 175.148 0.20 . 1 . . . . 1593 Lys C . 17127 1 1014 . 1 1 86 86 LYS CA C 13 54.583 0.20 . 1 . . . . 1593 Lys CA . 17127 1 1015 . 1 1 86 86 LYS CB C 13 35.386 0.20 . 1 . . . . 1593 Lys CB . 17127 1 1016 . 1 1 86 86 LYS CD C 13 29.771 0.20 . 1 . . . . 1593 Lys CD . 17127 1 1017 . 1 1 86 86 LYS CE C 13 42.197 0.20 . 1 . . . . 1593 Lys CE . 17127 1 1018 . 1 1 86 86 LYS CG C 13 24.716 0.20 . 1 . . . . 1593 Lys CG . 17127 1 1019 . 1 1 86 86 LYS N N 15 122.057 0.05 . 1 . . . . 1593 Lys N . 17127 1 1020 . 1 1 87 87 ASP H H 1 9.096 0.05 . 1 . . . . 1594 Asp H . 17127 1 1021 . 1 1 87 87 ASP HA H 1 4.329 0.05 . 1 . . . . 1594 Asp HA . 17127 1 1022 . 1 1 87 87 ASP HB2 H 1 2.903 0.05 . 1 . . . . 1594 Asp HB2 . 17127 1 1023 . 1 1 87 87 ASP HB3 H 1 2.903 0.05 . 1 . . . . 1594 Asp HB3 . 17127 1 1024 . 1 1 87 87 ASP C C 13 176.658 0.20 . 1 . . . . 1594 Asp C . 17127 1 1025 . 1 1 87 87 ASP CA C 13 55.898 0.20 . 1 . . . . 1594 Asp CA . 17127 1 1026 . 1 1 87 87 ASP CB C 13 38.440 0.20 . 1 . . . . 1594 Asp CB . 17127 1 1027 . 1 1 87 87 ASP N N 15 115.489 0.05 . 1 . . . . 1594 Asp N . 17127 1 1028 . 1 1 88 88 GLY H H 1 7.962 0.05 . 1 . . . . 1595 Gly H . 17127 1 1029 . 1 1 88 88 GLY HA2 H 1 3.508 0.05 . 2 . . . . 1595 Gly HA2 . 17127 1 1030 . 1 1 88 88 GLY HA3 H 1 4.267 0.05 . 2 . . . . 1595 Gly HA3 . 17127 1 1031 . 1 1 88 88 GLY C C 13 172.253 0.20 . 1 . . . . 1595 Gly C . 17127 1 1032 . 1 1 88 88 GLY CA C 13 45.018 0.20 . 1 . . . . 1595 Gly CA . 17127 1 1033 . 1 1 88 88 GLY N N 15 103.027 0.05 . 1 . . . . 1595 Gly N . 17127 1 1034 . 1 1 89 89 SER H H 1 9.044 0.05 . 1 . . . . 1596 Ser H . 17127 1 1035 . 1 1 89 89 SER HA H 1 4.653 0.05 . 1 . . . . 1596 Ser HA . 17127 1 1036 . 1 1 89 89 SER HB2 H 1 3.967 0.05 . 2 . . . . 1596 Ser HB2 . 17127 1 1037 . 1 1 89 89 SER HB3 H 1 4.293 0.05 . 2 . . . . 1596 Ser HB3 . 17127 1 1038 . 1 1 89 89 SER CA C 13 59.930 0.20 . 1 . . . . 1596 Ser CA . 17127 1 1039 . 1 1 89 89 SER N N 15 116.182 0.05 . 1 . . . . 1596 Ser N . 17127 1 1040 . 1 1 90 90 PRO HA H 1 4.367 0.05 . 1 . . . . 1597 Pro HA . 17127 1 1041 . 1 1 90 90 PRO HB2 H 1 2.237 0.05 . 2 . . . . 1597 Pro HB2 . 17127 1 1042 . 1 1 90 90 PRO HB3 H 1 1.753 0.05 . 2 . . . . 1597 Pro HB3 . 17127 1 1043 . 1 1 90 90 PRO HG2 H 1 1.895 0.05 . 1 . . . . 1597 Pro HG2 . 17127 1 1044 . 1 1 90 90 PRO HG3 H 1 1.895 0.05 . 1 . . . . 1597 Pro HG3 . 17127 1 1045 . 1 1 90 90 PRO C C 13 175.086 0.20 . 1 . . . . 1597 Pro C . 17127 1 1046 . 1 1 90 90 PRO CA C 13 63.903 0.20 . 1 . . . . 1597 Pro CA . 17127 1 1047 . 1 1 90 90 PRO CB C 13 31.949 0.20 . 1 . . . . 1597 Pro CB . 17127 1 1048 . 1 1 91 91 CYS H H 1 8.387 0.05 . 1 . . . . 1598 Cys H . 17127 1 1049 . 1 1 91 91 CYS HA H 1 5.014 0.05 . 1 . . . . 1598 Cys HA . 17127 1 1050 . 1 1 91 91 CYS HB2 H 1 2.111 0.05 . 2 . . . . 1598 Cys HB2 . 17127 1 1051 . 1 1 91 91 CYS HB3 H 1 2.276 0.05 . 2 . . . . 1598 Cys HB3 . 17127 1 1052 . 1 1 91 91 CYS CA C 13 52.210 0.20 . 1 . . . . 1598 Cys CA . 17127 1 1053 . 1 1 91 91 CYS CB C 13 42.704 0.20 . 1 . . . . 1598 Cys CB . 17127 1 1054 . 1 1 91 91 CYS N N 15 121.659 0.05 . 1 . . . . 1598 Cys N . 17127 1 1055 . 1 1 92 92 PRO HA H 1 4.713 0.05 . 1 . . . . 1599 Pro HA . 17127 1 1056 . 1 1 92 92 PRO C C 13 175.248 0.20 . 1 . . . . 1599 Pro C . 17127 1 1057 . 1 1 92 92 PRO CA C 13 63.548 0.20 . 1 . . . . 1599 Pro CA . 17127 1 1058 . 1 1 92 92 PRO CB C 13 29.360 0.20 . 1 . . . . 1599 Pro CB . 17127 1 1059 . 1 1 93 93 SER H H 1 8.208 0.05 . 1 . . . . 1600 Ser H . 17127 1 1060 . 1 1 93 93 SER HA H 1 4.719 0.05 . 1 . . . . 1600 Ser HA . 17127 1 1061 . 1 1 93 93 SER HB2 H 1 3.891 0.05 . 1 . . . . 1600 Ser HB2 . 17127 1 1062 . 1 1 93 93 SER HB3 H 1 3.891 0.05 . 1 . . . . 1600 Ser HB3 . 17127 1 1063 . 1 1 93 93 SER C C 13 174.239 0.20 . 1 . . . . 1600 Ser C . 17127 1 1064 . 1 1 93 93 SER CA C 13 57.979 0.20 . 1 . . . . 1600 Ser CA . 17127 1 1065 . 1 1 93 93 SER CB C 13 65.002 0.20 . 1 . . . . 1600 Ser CB . 17127 1 1066 . 1 1 93 93 SER N N 15 123.032 0.05 . 1 . . . . 1600 Ser N . 17127 1 1067 . 1 1 94 94 LYS H H 1 9.369 0.05 . 1 . . . . 1601 Lys H . 17127 1 1068 . 1 1 94 94 LYS HA H 1 4.334 0.05 . 1 . . . . 1601 Lys HA . 17127 1 1069 . 1 1 94 94 LYS HB2 H 1 1.861 0.05 . 2 . . . . 1601 Lys HB2 . 17127 1 1070 . 1 1 94 94 LYS HB3 H 1 1.644 0.05 . 2 . . . . 1601 Lys HB3 . 17127 1 1071 . 1 1 94 94 LYS HD2 H 1 1.674 0.05 . 2 . . . . 1601 Lys HD2 . 17127 1 1072 . 1 1 94 94 LYS HD3 H 1 1.661 0.05 . 2 . . . . 1601 Lys HD3 . 17127 1 1073 . 1 1 94 94 LYS HE2 H 1 2.997 0.05 . 2 . . . . 1601 Lys HE2 . 17127 1 1074 . 1 1 94 94 LYS HE3 H 1 2.960 0.05 . 2 . . . . 1601 Lys HE3 . 17127 1 1075 . 1 1 94 94 LYS HG2 H 1 1.477 0.05 . 1 . . . . 1601 Lys HG2 . 17127 1 1076 . 1 1 94 94 LYS HG3 H 1 1.477 0.05 . 1 . . . . 1601 Lys HG3 . 17127 1 1077 . 1 1 94 94 LYS C C 13 177.734 0.20 . 1 . . . . 1601 Lys C . 17127 1 1078 . 1 1 94 94 LYS CA C 13 58.318 0.20 . 1 . . . . 1601 Lys CA . 17127 1 1079 . 1 1 94 94 LYS CB C 13 32.374 0.20 . 1 . . . . 1601 Lys CB . 17127 1 1080 . 1 1 94 94 LYS CD C 13 29.184 0.20 . 1 . . . . 1601 Lys CD . 17127 1 1081 . 1 1 94 94 LYS CE C 13 42.239 0.20 . 1 . . . . 1601 Lys CE . 17127 1 1082 . 1 1 94 94 LYS CG C 13 25.686 0.20 . 1 . . . . 1601 Lys CG . 17127 1 1083 . 1 1 94 94 LYS N N 15 125.115 0.05 . 1 . . . . 1601 Lys N . 17127 1 1084 . 1 1 95 95 SER H H 1 8.164 0.05 . 1 . . . . 1602 Ser H . 17127 1 1085 . 1 1 95 95 SER HA H 1 4.599 0.05 . 1 . . . . 1602 Ser HA . 17127 1 1086 . 1 1 95 95 SER HB2 H 1 3.841 0.05 . 1 . . . . 1602 Ser HB2 . 17127 1 1087 . 1 1 95 95 SER HB3 H 1 3.841 0.05 . 1 . . . . 1602 Ser HB3 . 17127 1 1088 . 1 1 95 95 SER C C 13 174.842 0.20 . 1 . . . . 1602 Ser C . 17127 1 1089 . 1 1 95 95 SER CA C 13 57.860 0.20 . 1 . . . . 1602 Ser CA . 17127 1 1090 . 1 1 95 95 SER CB C 13 63.928 0.20 . 1 . . . . 1602 Ser CB . 17127 1 1091 . 1 1 95 95 SER N N 15 111.129 0.05 . 1 . . . . 1602 Ser N . 17127 1 1092 . 1 1 96 96 GLY H H 1 7.693 0.05 . 1 . . . . 1603 Gly H . 17127 1 1093 . 1 1 96 96 GLY HA2 H 1 3.839 0.05 . 2 . . . . 1603 Gly HA2 . 17127 1 1094 . 1 1 96 96 GLY HA3 H 1 3.997 0.05 . 2 . . . . 1603 Gly HA3 . 17127 1 1095 . 1 1 96 96 GLY C C 13 175.108 0.20 . 1 . . . . 1603 Gly C . 17127 1 1096 . 1 1 96 96 GLY CA C 13 47.441 0.20 . 1 . . . . 1603 Gly CA . 17127 1 1097 . 1 1 96 96 GLY N N 15 110.083 0.05 . 1 . . . . 1603 Gly N . 17127 1 1098 . 1 1 97 97 LEU H H 1 7.448 0.05 . 1 . . . . 1604 Leu H . 17127 1 1099 . 1 1 97 97 LEU HA H 1 4.329 0.05 . 1 . . . . 1604 Leu HA . 17127 1 1100 . 1 1 97 97 LEU HB2 H 1 1.652 0.05 . 2 . . . . 1604 Leu HB2 . 17127 1 1101 . 1 1 97 97 LEU HB3 H 1 1.364 0.05 . 2 . . . . 1604 Leu HB3 . 17127 1 1102 . 1 1 97 97 LEU HD11 H 1 0.819 0.05 . 2 . . . . 1604 Leu HD11 . 17127 1 1103 . 1 1 97 97 LEU HD12 H 1 0.819 0.05 . 2 . . . . 1604 Leu HD12 . 17127 1 1104 . 1 1 97 97 LEU HD13 H 1 0.819 0.05 . 2 . . . . 1604 Leu HD13 . 17127 1 1105 . 1 1 97 97 LEU HD21 H 1 0.834 0.05 . 2 . . . . 1604 Leu HD21 . 17127 1 1106 . 1 1 97 97 LEU HD22 H 1 0.834 0.05 . 2 . . . . 1604 Leu HD22 . 17127 1 1107 . 1 1 97 97 LEU HD23 H 1 0.834 0.05 . 2 . . . . 1604 Leu HD23 . 17127 1 1108 . 1 1 97 97 LEU C C 13 176.028 0.20 . 1 . . . . 1604 Leu C . 17127 1 1109 . 1 1 97 97 LEU CA C 13 54.638 0.20 . 1 . . . . 1604 Leu CA . 17127 1 1110 . 1 1 97 97 LEU CB C 13 43.152 0.20 . 1 . . . . 1604 Leu CB . 17127 1 1111 . 1 1 97 97 LEU CD1 C 13 23.025 0.20 . 2 . . . . 1604 Leu CD1 . 17127 1 1112 . 1 1 97 97 LEU CD2 C 13 26.597 0.20 . 2 . . . . 1604 Leu CD2 . 17127 1 1113 . 1 1 97 97 LEU N N 15 118.344 0.05 . 1 . . . . 1604 Leu N . 17127 1 1114 . 1 1 98 98 SER H H 1 7.987 0.05 . 1 . . . . 1605 Ser H . 17127 1 1115 . 1 1 98 98 SER HA H 1 4.846 0.05 . 1 . . . . 1605 Ser HA . 17127 1 1116 . 1 1 98 98 SER HB2 H 1 3.735 0.05 . 2 . . . . 1605 Ser HB2 . 17127 1 1117 . 1 1 98 98 SER HB3 H 1 3.629 0.05 . 2 . . . . 1605 Ser HB3 . 17127 1 1118 . 1 1 98 98 SER C C 13 173.908 0.20 . 1 . . . . 1605 Ser C . 17127 1 1119 . 1 1 98 98 SER CA C 13 56.812 0.20 . 1 . . . . 1605 Ser CA . 17127 1 1120 . 1 1 98 98 SER CB C 13 66.062 0.20 . 1 . . . . 1605 Ser CB . 17127 1 1121 . 1 1 98 98 SER N N 15 114.902 0.05 . 1 . . . . 1605 Ser N . 17127 1 1122 . 1 1 99 99 TYR H H 1 8.384 0.05 . 1 . . . . 1606 Tyr H . 17127 1 1123 . 1 1 99 99 TYR HA H 1 5.063 0.05 . 1 . . . . 1606 Tyr HA . 17127 1 1124 . 1 1 99 99 TYR HB2 H 1 2.889 0.05 . 2 . . . . 1606 Tyr HB2 . 17127 1 1125 . 1 1 99 99 TYR HB3 H 1 3.018 0.05 . 2 . . . . 1606 Tyr HB3 . 17127 1 1126 . 1 1 99 99 TYR HD1 H 1 7.058 0.05 . 3 . . . . 1606 Tyr HD1 . 17127 1 1127 . 1 1 99 99 TYR HD2 H 1 7.058 0.05 . 3 . . . . 1606 Tyr HD2 . 17127 1 1128 . 1 1 99 99 TYR HE1 H 1 6.761 0.05 . 3 . . . . 1606 Tyr HE1 . 17127 1 1129 . 1 1 99 99 TYR HE2 H 1 6.761 0.05 . 3 . . . . 1606 Tyr HE2 . 17127 1 1130 . 1 1 99 99 TYR C C 13 175.804 0.20 . 1 . . . . 1606 Tyr C . 17127 1 1131 . 1 1 99 99 TYR CA C 13 60.392 0.20 . 1 . . . . 1606 Tyr CA . 17127 1 1132 . 1 1 99 99 TYR CB C 13 42.026 0.20 . 1 . . . . 1606 Tyr CB . 17127 1 1133 . 1 1 99 99 TYR CD1 C 13 133.684 0.20 . 3 . . . . 1606 Tyr CD1 . 17127 1 1134 . 1 1 99 99 TYR CD2 C 13 133.684 0.20 . 3 . . . . 1606 Tyr CD2 . 17127 1 1135 . 1 1 99 99 TYR CE1 C 13 117.913 0.20 . 3 . . . . 1606 Tyr CE1 . 17127 1 1136 . 1 1 99 99 TYR CE2 C 13 117.913 0.20 . 3 . . . . 1606 Tyr CE2 . 17127 1 1137 . 1 1 99 99 TYR N N 15 119.308 0.05 . 1 . . . . 1606 Tyr N . 17127 1 1138 . 1 1 100 100 LYS H H 1 8.290 0.05 . 1 . . . . 1607 Lys H . 17127 1 1139 . 1 1 100 100 LYS HA H 1 5.049 0.05 . 1 . . . . 1607 Lys HA . 17127 1 1140 . 1 1 100 100 LYS HB2 H 1 1.928 0.05 . 1 . . . . 1607 Lys HB2 . 17127 1 1141 . 1 1 100 100 LYS HB3 H 1 1.928 0.05 . 1 . . . . 1607 Lys HB3 . 17127 1 1142 . 1 1 100 100 LYS HD2 H 1 1.555 0.05 . 1 . . . . 1607 Lys HD2 . 17127 1 1143 . 1 1 100 100 LYS HD3 H 1 1.555 0.05 . 1 . . . . 1607 Lys HD3 . 17127 1 1144 . 1 1 100 100 LYS HE2 H 1 2.923 0.05 . 1 . . . . 1607 Lys HE2 . 17127 1 1145 . 1 1 100 100 LYS HE3 H 1 2.923 0.05 . 1 . . . . 1607 Lys HE3 . 17127 1 1146 . 1 1 100 100 LYS HG2 H 1 1.265 0.05 . 2 . . . . 1607 Lys HG2 . 17127 1 1147 . 1 1 100 100 LYS HG3 H 1 1.491 0.05 . 2 . . . . 1607 Lys HG3 . 17127 1 1148 . 1 1 100 100 LYS C C 13 174.668 0.20 . 1 . . . . 1607 Lys C . 17127 1 1149 . 1 1 100 100 LYS CA C 13 55.043 0.20 . 1 . . . . 1607 Lys CA . 17127 1 1150 . 1 1 100 100 LYS CB C 13 36.561 0.20 . 1 . . . . 1607 Lys CB . 17127 1 1151 . 1 1 100 100 LYS CD C 13 29.830 0.20 . 1 . . . . 1607 Lys CD . 17127 1 1152 . 1 1 100 100 LYS CG C 13 23.850 0.20 . 1 . . . . 1607 Lys CG . 17127 1 1153 . 1 1 100 100 LYS N N 15 116.687 0.05 . 1 . . . . 1607 Lys N . 17127 1 1154 . 1 1 101 101 SER H H 1 9.249 0.05 . 1 . . . . 1608 Ser H . 17127 1 1155 . 1 1 101 101 SER HA H 1 5.610 0.05 . 1 . . . . 1608 Ser HA . 17127 1 1156 . 1 1 101 101 SER HB2 H 1 3.678 0.05 . 2 . . . . 1608 Ser HB2 . 17127 1 1157 . 1 1 101 101 SER HB3 H 1 3.612 0.05 . 2 . . . . 1608 Ser HB3 . 17127 1 1158 . 1 1 101 101 SER C C 13 172.145 0.20 . 1 . . . . 1608 Ser C . 17127 1 1159 . 1 1 101 101 SER CA C 13 58.902 0.20 . 1 . . . . 1608 Ser CA . 17127 1 1160 . 1 1 101 101 SER CB C 13 66.998 0.20 . 1 . . . . 1608 Ser CB . 17127 1 1161 . 1 1 101 101 SER N N 15 116.724 0.05 . 1 . . . . 1608 Ser N . 17127 1 1162 . 1 1 102 102 VAL H H 1 9.173 0.05 . 1 . . . . 1609 Val H . 17127 1 1163 . 1 1 102 102 VAL HA H 1 4.433 0.05 . 1 . . . . 1609 Val HA . 17127 1 1164 . 1 1 102 102 VAL HB H 1 1.883 0.05 . 1 . . . . 1609 Val HB . 17127 1 1165 . 1 1 102 102 VAL HG11 H 1 0.651 0.05 . 2 . . . . 1609 Val HG11 . 17127 1 1166 . 1 1 102 102 VAL HG12 H 1 0.651 0.05 . 2 . . . . 1609 Val HG12 . 17127 1 1167 . 1 1 102 102 VAL HG13 H 1 0.651 0.05 . 2 . . . . 1609 Val HG13 . 17127 1 1168 . 1 1 102 102 VAL HG21 H 1 0.873 0.05 . 2 . . . . 1609 Val HG21 . 17127 1 1169 . 1 1 102 102 VAL HG22 H 1 0.873 0.05 . 2 . . . . 1609 Val HG22 . 17127 1 1170 . 1 1 102 102 VAL HG23 H 1 0.873 0.05 . 2 . . . . 1609 Val HG23 . 17127 1 1171 . 1 1 102 102 VAL C C 13 174.984 0.20 . 1 . . . . 1609 Val C . 17127 1 1172 . 1 1 102 102 VAL CA C 13 61.717 0.20 . 1 . . . . 1609 Val CA . 17127 1 1173 . 1 1 102 102 VAL CB C 13 32.994 0.20 . 1 . . . . 1609 Val CB . 17127 1 1174 . 1 1 102 102 VAL CG1 C 13 20.634 0.20 . 2 . . . . 1609 Val CG1 . 17127 1 1175 . 1 1 102 102 VAL CG2 C 13 20.681 0.20 . 2 . . . . 1609 Val CG2 . 17127 1 1176 . 1 1 102 102 VAL N N 15 125.251 0.05 . 1 . . . . 1609 Val N . 17127 1 1177 . 1 1 103 103 ILE H H 1 9.311 0.05 . 1 . . . . 1610 Ile H . 17127 1 1178 . 1 1 103 103 ILE HA H 1 4.332 0.05 . 1 . . . . 1610 Ile HA . 17127 1 1179 . 1 1 103 103 ILE HB H 1 1.511 0.05 . 1 . . . . 1610 Ile HB . 17127 1 1180 . 1 1 103 103 ILE HD11 H 1 0.136 0.05 . 1 . . . . 1610 Ile HD11 . 17127 1 1181 . 1 1 103 103 ILE HD12 H 1 0.136 0.05 . 1 . . . . 1610 Ile HD12 . 17127 1 1182 . 1 1 103 103 ILE HD13 H 1 0.136 0.05 . 1 . . . . 1610 Ile HD13 . 17127 1 1183 . 1 1 103 103 ILE HG12 H 1 0.319 0.05 . 2 . . . . 1610 Ile HG12 . 17127 1 1184 . 1 1 103 103 ILE HG13 H 1 1.105 0.05 . 2 . . . . 1610 Ile HG13 . 17127 1 1185 . 1 1 103 103 ILE HG21 H 1 0.127 0.05 . 1 . . . . 1610 Ile HG21 . 17127 1 1186 . 1 1 103 103 ILE HG22 H 1 0.127 0.05 . 1 . . . . 1610 Ile HG22 . 17127 1 1187 . 1 1 103 103 ILE HG23 H 1 0.127 0.05 . 1 . . . . 1610 Ile HG23 . 17127 1 1188 . 1 1 103 103 ILE C C 13 174.185 0.20 . 1 . . . . 1610 Ile C . 17127 1 1189 . 1 1 103 103 ILE CA C 13 61.154 0.20 . 1 . . . . 1610 Ile CA . 17127 1 1190 . 1 1 103 103 ILE CB C 13 40.130 0.20 . 1 . . . . 1610 Ile CB . 17127 1 1191 . 1 1 103 103 ILE CD1 C 13 13.912 0.20 . 1 . . . . 1610 Ile CD1 . 17127 1 1192 . 1 1 103 103 ILE CG1 C 13 27.787 0.20 . 1 . . . . 1610 Ile CG1 . 17127 1 1193 . 1 1 103 103 ILE CG2 C 13 18.568 0.20 . 1 . . . . 1610 Ile CG2 . 17127 1 1194 . 1 1 103 103 ILE N N 15 129.270 0.05 . 1 . . . . 1610 Ile N . 17127 1 1195 . 1 1 104 104 SER H H 1 8.161 0.05 . 1 . . . . 1611 Ser H . 17127 1 1196 . 1 1 104 104 SER HA H 1 5.298 0.05 . 1 . . . . 1611 Ser HA . 17127 1 1197 . 1 1 104 104 SER HB2 H 1 3.563 0.05 . 2 . . . . 1611 Ser HB2 . 17127 1 1198 . 1 1 104 104 SER HB3 H 1 3.831 0.05 . 2 . . . . 1611 Ser HB3 . 17127 1 1199 . 1 1 104 104 SER C C 13 172.248 0.20 . 1 . . . . 1611 Ser C . 17127 1 1200 . 1 1 104 104 SER CA C 13 57.581 0.20 . 1 . . . . 1611 Ser CA . 17127 1 1201 . 1 1 104 104 SER CB C 13 64.498 0.20 . 1 . . . . 1611 Ser CB . 17127 1 1202 . 1 1 104 104 SER N N 15 121.675 0.05 . 1 . . . . 1611 Ser N . 17127 1 1203 . 1 1 105 105 PHE H H 1 9.606 0.05 . 1 . . . . 1612 Phe H . 17127 1 1204 . 1 1 105 105 PHE HA H 1 5.340 0.05 . 1 . . . . 1612 Phe HA . 17127 1 1205 . 1 1 105 105 PHE HB2 H 1 2.824 0.05 . 2 . . . . 1612 Phe HB2 . 17127 1 1206 . 1 1 105 105 PHE HB3 H 1 2.397 0.05 . 2 . . . . 1612 Phe HB3 . 17127 1 1207 . 1 1 105 105 PHE HD1 H 1 6.645 0.05 . 3 . . . . 1612 Phe HD1 . 17127 1 1208 . 1 1 105 105 PHE HD2 H 1 6.645 0.05 . 3 . . . . 1612 Phe HD2 . 17127 1 1209 . 1 1 105 105 PHE HE1 H 1 6.328 0.05 . 3 . . . . 1612 Phe HE1 . 17127 1 1210 . 1 1 105 105 PHE HE2 H 1 6.328 0.05 . 3 . . . . 1612 Phe HE2 . 17127 1 1211 . 1 1 105 105 PHE HZ H 1 6.664 0.05 . 1 . . . . 1612 Phe HZ . 17127 1 1212 . 1 1 105 105 PHE C C 13 174.178 0.20 . 1 . . . . 1612 Phe C . 17127 1 1213 . 1 1 105 105 PHE CA C 13 56.493 0.20 . 1 . . . . 1612 Phe CA . 17127 1 1214 . 1 1 105 105 PHE CB C 13 39.359 0.20 . 1 . . . . 1612 Phe CB . 17127 1 1215 . 1 1 105 105 PHE CD1 C 13 131.894 0.20 . 3 . . . . 1612 Phe CD1 . 17127 1 1216 . 1 1 105 105 PHE CD2 C 13 131.894 0.20 . 3 . . . . 1612 Phe CD2 . 17127 1 1217 . 1 1 105 105 PHE CE1 C 13 130.499 0.20 . 3 . . . . 1612 Phe CE1 . 17127 1 1218 . 1 1 105 105 PHE CE2 C 13 130.499 0.20 . 3 . . . . 1612 Phe CE2 . 17127 1 1219 . 1 1 105 105 PHE CZ C 13 128.145 0.20 . 1 . . . . 1612 Phe CZ . 17127 1 1220 . 1 1 105 105 PHE N N 15 124.403 0.05 . 1 . . . . 1612 Phe N . 17127 1 1221 . 1 1 106 106 VAL H H 1 8.315 0.05 . 1 . . . . 1613 Val H . 17127 1 1222 . 1 1 106 106 VAL HA H 1 4.388 0.05 . 1 . . . . 1613 Val HA . 17127 1 1223 . 1 1 106 106 VAL HB H 1 1.303 0.05 . 1 . . . . 1613 Val HB . 17127 1 1224 . 1 1 106 106 VAL HG11 H 1 0.838 0.05 . 2 . . . . 1613 Val HG11 . 17127 1 1225 . 1 1 106 106 VAL HG12 H 1 0.838 0.05 . 2 . . . . 1613 Val HG12 . 17127 1 1226 . 1 1 106 106 VAL HG13 H 1 0.838 0.05 . 2 . . . . 1613 Val HG13 . 17127 1 1227 . 1 1 106 106 VAL HG21 H 1 0.611 0.05 . 2 . . . . 1613 Val HG21 . 17127 1 1228 . 1 1 106 106 VAL HG22 H 1 0.611 0.05 . 2 . . . . 1613 Val HG22 . 17127 1 1229 . 1 1 106 106 VAL HG23 H 1 0.611 0.05 . 2 . . . . 1613 Val HG23 . 17127 1 1230 . 1 1 106 106 VAL C C 13 175.246 0.20 . 1 . . . . 1613 Val C . 17127 1 1231 . 1 1 106 106 VAL CA C 13 59.746 0.20 . 1 . . . . 1613 Val CA . 17127 1 1232 . 1 1 106 106 VAL CB C 13 35.426 0.20 . 1 . . . . 1613 Val CB . 17127 1 1233 . 1 1 106 106 VAL CG1 C 13 20.002 0.20 . 2 . . . . 1613 Val CG1 . 17127 1 1234 . 1 1 106 106 VAL CG2 C 13 21.365 0.20 . 2 . . . . 1613 Val CG2 . 17127 1 1235 . 1 1 106 106 VAL N N 15 120.181 0.05 . 1 . . . . 1613 Val N . 17127 1 1236 . 1 1 107 107 CYS H H 1 9.135 0.05 . 1 . . . . 1614 Cys H . 17127 1 1237 . 1 1 107 107 CYS HA H 1 4.398 0.05 . 1 . . . . 1614 Cys HA . 17127 1 1238 . 1 1 107 107 CYS HB2 H 1 2.792 0.05 . 2 . . . . 1614 Cys HB2 . 17127 1 1239 . 1 1 107 107 CYS HB3 H 1 3.087 0.05 . 2 . . . . 1614 Cys HB3 . 17127 1 1240 . 1 1 107 107 CYS C C 13 174.975 0.20 . 1 . . . . 1614 Cys C . 17127 1 1241 . 1 1 107 107 CYS CA C 13 57.158 0.20 . 1 . . . . 1614 Cys CA . 17127 1 1242 . 1 1 107 107 CYS CB C 13 38.969 0.20 . 1 . . . . 1614 Cys CB . 17127 1 1243 . 1 1 107 107 CYS N N 15 123.973 0.05 . 1 . . . . 1614 Cys N . 17127 1 1244 . 1 1 108 108 ARG H H 1 7.203 0.05 . 1 . . . . 1615 Arg H . 17127 1 1245 . 1 1 108 108 ARG HA H 1 4.750 0.05 . 1 . . . . 1615 Arg HA . 17127 1 1246 . 1 1 108 108 ARG HB2 H 1 1.770 0.05 . 1 . . . . 1615 Arg HB2 . 17127 1 1247 . 1 1 108 108 ARG HB3 H 1 1.770 0.05 . 1 . . . . 1615 Arg HB3 . 17127 1 1248 . 1 1 108 108 ARG HD2 H 1 3.189 0.05 . 1 . . . . 1615 Arg HD2 . 17127 1 1249 . 1 1 108 108 ARG HD3 H 1 3.189 0.05 . 1 . . . . 1615 Arg HD3 . 17127 1 1250 . 1 1 108 108 ARG HE H 1 7.221 0.05 . 1 . . . . 1615 Arg HE . 17127 1 1251 . 1 1 108 108 ARG HG2 H 1 1.642 0.05 . 1 . . . . 1615 Arg HG2 . 17127 1 1252 . 1 1 108 108 ARG HG3 H 1 1.642 0.05 . 1 . . . . 1615 Arg HG3 . 17127 1 1253 . 1 1 108 108 ARG CA C 13 53.834 0.20 . 1 . . . . 1615 Arg CA . 17127 1 1254 . 1 1 108 108 ARG N N 15 130.380 0.05 . 1 . . . . 1615 Arg N . 17127 1 1255 . 1 1 108 108 ARG NE N 15 84.641 0.05 . 1 . . . . 1615 Arg NE . 17127 1 1256 . 1 1 109 109 PRO HA H 1 4.343 0.05 . 1 . . . . 1616 Pro HA . 17127 1 1257 . 1 1 109 109 PRO HB2 H 1 2.320 0.05 . 2 . . . . 1616 Pro HB2 . 17127 1 1258 . 1 1 109 109 PRO HB3 H 1 2.035 0.05 . 2 . . . . 1616 Pro HB3 . 17127 1 1259 . 1 1 109 109 PRO HD2 H 1 3.802 0.05 . 1 . . . . 1616 Pro HD2 . 17127 1 1260 . 1 1 109 109 PRO HD3 H 1 3.802 0.05 . 1 . . . . 1616 Pro HD3 . 17127 1 1261 . 1 1 109 109 PRO HG2 H 1 2.022 0.05 . 1 . . . . 1616 Pro HG2 . 17127 1 1262 . 1 1 109 109 PRO HG3 H 1 2.022 0.05 . 1 . . . . 1616 Pro HG3 . 17127 1 1263 . 1 1 109 109 PRO C C 13 176.776 0.20 . 1 . . . . 1616 Pro C . 17127 1 1264 . 1 1 109 109 PRO CA C 13 64.524 0.20 . 1 . . . . 1616 Pro CA . 17127 1 1265 . 1 1 109 109 PRO CB C 13 32.164 0.20 . 1 . . . . 1616 Pro CB . 17127 1 1266 . 1 1 109 109 PRO CD C 13 51.027 0.20 . 1 . . . . 1616 Pro CD . 17127 1 1267 . 1 1 109 109 PRO CG C 13 27.340 0.20 . 1 . . . . 1616 Pro CG . 17127 1 1268 . 1 1 110 110 GLU H H 1 8.034 0.05 . 1 . . . . 1617 Glu H . 17127 1 1269 . 1 1 110 110 GLU HA H 1 4.402 0.05 . 1 . . . . 1617 Glu HA . 17127 1 1270 . 1 1 110 110 GLU HB2 H 1 2.034 0.05 . 2 . . . . 1617 Glu HB2 . 17127 1 1271 . 1 1 110 110 GLU HB3 H 1 1.944 0.05 . 2 . . . . 1617 Glu HB3 . 17127 1 1272 . 1 1 110 110 GLU HG2 H 1 2.314 0.05 . 1 . . . . 1617 Glu HG2 . 17127 1 1273 . 1 1 110 110 GLU HG3 H 1 2.314 0.05 . 1 . . . . 1617 Glu HG3 . 17127 1 1274 . 1 1 110 110 GLU C C 13 175.497 0.20 . 1 . . . . 1617 Glu C . 17127 1 1275 . 1 1 110 110 GLU CA C 13 56.037 0.20 . 1 . . . . 1617 Glu CA . 17127 1 1276 . 1 1 110 110 GLU CB C 13 29.846 0.20 . 1 . . . . 1617 Glu CB . 17127 1 1277 . 1 1 110 110 GLU CG C 13 34.991 0.20 . 1 . . . . 1617 Glu CG . 17127 1 1278 . 1 1 110 110 GLU N N 15 117.021 0.05 . 1 . . . . 1617 Glu N . 17127 1 1279 . 1 1 111 111 ALA H H 1 8.275 0.05 . 1 . . . . 1618 Ala H . 17127 1 1280 . 1 1 111 111 ALA HA H 1 4.301 0.05 . 1 . . . . 1618 Ala HA . 17127 1 1281 . 1 1 111 111 ALA HB1 H 1 1.444 0.05 . 1 . . . . 1618 Ala HB1 . 17127 1 1282 . 1 1 111 111 ALA HB2 H 1 1.444 0.05 . 1 . . . . 1618 Ala HB2 . 17127 1 1283 . 1 1 111 111 ALA HB3 H 1 1.444 0.05 . 1 . . . . 1618 Ala HB3 . 17127 1 1284 . 1 1 111 111 ALA C C 13 177.488 0.20 . 1 . . . . 1618 Ala C . 17127 1 1285 . 1 1 111 111 ALA CA C 13 52.614 0.20 . 1 . . . . 1618 Ala CA . 17127 1 1286 . 1 1 111 111 ALA CB C 13 19.382 0.20 . 1 . . . . 1618 Ala CB . 17127 1 1287 . 1 1 111 111 ALA N N 15 125.040 0.05 . 1 . . . . 1618 Ala N . 17127 1 1288 . 1 1 112 112 GLY H H 1 8.124 0.05 . 1 . . . . 1619 Gly H . 17127 1 1289 . 1 1 112 112 GLY HA2 H 1 4.247 0.05 . 2 . . . . 1619 Gly HA2 . 17127 1 1290 . 1 1 112 112 GLY HA3 H 1 4.124 0.05 . 2 . . . . 1619 Gly HA3 . 17127 1 1291 . 1 1 112 112 GLY CA C 13 45.226 0.20 . 1 . . . . 1619 Gly CA . 17127 1 1292 . 1 1 112 112 GLY N N 15 108.276 0.05 . 1 . . . . 1619 Gly N . 17127 1 1293 . 1 1 113 113 PRO HA H 1 4.528 0.05 . 1 . . . . 1620 Pro HA . 17127 1 1294 . 1 1 113 113 PRO HB2 H 1 2.006 0.05 . 2 . . . . 1620 Pro HB2 . 17127 1 1295 . 1 1 113 113 PRO HB3 H 1 2.347 0.05 . 2 . . . . 1620 Pro HB3 . 17127 1 1296 . 1 1 113 113 PRO HD2 H 1 3.757 0.05 . 2 . . . . 1620 Pro HD2 . 17127 1 1297 . 1 1 113 113 PRO HD3 H 1 3.654 0.05 . 2 . . . . 1620 Pro HD3 . 17127 1 1298 . 1 1 113 113 PRO HG2 H 1 2.043 0.05 . 1 . . . . 1620 Pro HG2 . 17127 1 1299 . 1 1 113 113 PRO HG3 H 1 2.043 0.05 . 1 . . . . 1620 Pro HG3 . 17127 1 1300 . 1 1 113 113 PRO C C 13 177.495 0.20 . 1 . . . . 1620 Pro C . 17127 1 1301 . 1 1 113 113 PRO CA C 13 64.128 0.20 . 1 . . . . 1620 Pro CA . 17127 1 1302 . 1 1 113 113 PRO CB C 13 32.339 0.20 . 1 . . . . 1620 Pro CB . 17127 1 1303 . 1 1 113 113 PRO CD C 13 50.470 0.20 . 1 . . . . 1620 Pro CD . 17127 1 1304 . 1 1 113 113 PRO CG C 13 27.289 0.20 . 1 . . . . 1620 Pro CG . 17127 1 1305 . 1 1 114 114 THR H H 1 8.053 0.05 . 1 . . . . 1621 Thr H . 17127 1 1306 . 1 1 114 114 THR HA H 1 4.325 0.05 . 1 . . . . 1621 Thr HA . 17127 1 1307 . 1 1 114 114 THR HB H 1 4.194 0.05 . 1 . . . . 1621 Thr HB . 17127 1 1308 . 1 1 114 114 THR HG21 H 1 1.215 0.05 . 1 . . . . 1621 Thr HG21 . 17127 1 1309 . 1 1 114 114 THR HG22 H 1 1.215 0.05 . 1 . . . . 1621 Thr HG22 . 17127 1 1310 . 1 1 114 114 THR HG23 H 1 1.215 0.05 . 1 . . . . 1621 Thr HG23 . 17127 1 1311 . 1 1 114 114 THR C C 13 174.519 0.20 . 1 . . . . 1621 Thr C . 17127 1 1312 . 1 1 114 114 THR CA C 13 62.129 0.20 . 1 . . . . 1621 Thr CA . 17127 1 1313 . 1 1 114 114 THR CB C 13 69.423 0.20 . 1 . . . . 1621 Thr CB . 17127 1 1314 . 1 1 114 114 THR CG2 C 13 21.897 0.20 . 1 . . . . 1621 Thr CG2 . 17127 1 1315 . 1 1 114 114 THR N N 15 110.965 0.05 . 1 . . . . 1621 Thr N . 17127 1 1316 . 1 1 115 115 ASN H H 1 8.294 0.05 . 1 . . . . 1622 Asn H . 17127 1 1317 . 1 1 115 115 ASN HA H 1 5.132 0.05 . 1 . . . . 1622 Asn HA . 17127 1 1318 . 1 1 115 115 ASN HB2 H 1 3.293 0.05 . 2 . . . . 1622 Asn HB2 . 17127 1 1319 . 1 1 115 115 ASN HB3 H 1 3.111 0.05 . 2 . . . . 1622 Asn HB3 . 17127 1 1320 . 1 1 115 115 ASN HD21 H 1 7.932 0.05 . 1 . . . . 1622 Asn HD21 . 17127 1 1321 . 1 1 115 115 ASN HD22 H 1 7.111 0.05 . 1 . . . . 1622 Asn HD22 . 17127 1 1322 . 1 1 115 115 ASN C C 13 173.298 0.20 . 1 . . . . 1622 Asn C . 17127 1 1323 . 1 1 115 115 ASN CA C 13 53.106 0.20 . 1 . . . . 1622 Asn CA . 17127 1 1324 . 1 1 115 115 ASN CB C 13 38.298 0.20 . 1 . . . . 1622 Asn CB . 17127 1 1325 . 1 1 115 115 ASN N N 15 123.343 0.05 . 1 . . . . 1622 Asn N . 17127 1 1326 . 1 1 115 115 ASN ND2 N 15 111.744 0.05 . 1 . . . . 1622 Asn ND2 . 17127 1 1327 . 1 1 116 116 ARG H H 1 7.850 0.05 . 1 . . . . 1623 Arg H . 17127 1 1328 . 1 1 116 116 ARG HA H 1 3.945 0.05 . 1 . . . . 1623 Arg HA . 17127 1 1329 . 1 1 116 116 ARG HB2 H 1 1.588 0.05 . 2 . . . . 1623 Arg HB2 . 17127 1 1330 . 1 1 116 116 ARG HB3 H 1 1.800 0.05 . 2 . . . . 1623 Arg HB3 . 17127 1 1331 . 1 1 116 116 ARG HD2 H 1 3.236 0.05 . 1 . . . . 1623 Arg HD2 . 17127 1 1332 . 1 1 116 116 ARG HD3 H 1 3.236 0.05 . 1 . . . . 1623 Arg HD3 . 17127 1 1333 . 1 1 116 116 ARG HE H 1 7.087 0.05 . 1 . . . . 1623 Arg HE . 17127 1 1334 . 1 1 116 116 ARG HG2 H 1 1.588 0.05 . 2 . . . . 1623 Arg HG2 . 17127 1 1335 . 1 1 116 116 ARG HG3 H 1 1.611 0.05 . 2 . . . . 1623 Arg HG3 . 17127 1 1336 . 1 1 116 116 ARG CA C 13 52.963 0.20 . 1 . . . . 1623 Arg CA . 17127 1 1337 . 1 1 116 116 ARG CB C 13 28.770 0.20 . 1 . . . . 1623 Arg CB . 17127 1 1338 . 1 1 116 116 ARG CD C 13 43.954 0.20 . 1 . . . . 1623 Arg CD . 17127 1 1339 . 1 1 116 116 ARG CG C 13 25.944 0.20 . 1 . . . . 1623 Arg CG . 17127 1 1340 . 1 1 116 116 ARG N N 15 120.609 0.05 . 1 . . . . 1623 Arg N . 17127 1 1341 . 1 1 116 116 ARG NE N 15 85.286 0.05 . 1 . . . . 1623 Arg NE . 17127 1 1342 . 1 1 117 117 PRO HA H 1 4.080 0.05 . 1 . . . . 1624 Pro HA . 17127 1 1343 . 1 1 117 117 PRO C C 13 175.366 0.20 . 1 . . . . 1624 Pro C . 17127 1 1344 . 1 1 117 117 PRO CA C 13 62.222 0.20 . 1 . . . . 1624 Pro CA . 17127 1 1345 . 1 1 117 117 PRO CB C 13 29.360 0.20 . 1 . . . . 1624 Pro CB . 17127 1 1346 . 1 1 118 118 MET H H 1 8.572 0.05 . 1 . . . . 1625 Met H . 17127 1 1347 . 1 1 118 118 MET HA H 1 4.829 0.05 . 1 . . . . 1625 Met HA . 17127 1 1348 . 1 1 118 118 MET HB2 H 1 1.970 0.05 . 2 . . . . 1625 Met HB2 . 17127 1 1349 . 1 1 118 118 MET HB3 H 1 1.946 0.05 . 2 . . . . 1625 Met HB3 . 17127 1 1350 . 1 1 118 118 MET HE1 H 1 2.060 0.05 . 1 . . . . 1625 Met HE1 . 17127 1 1351 . 1 1 118 118 MET HE2 H 1 2.060 0.05 . 1 . . . . 1625 Met HE2 . 17127 1 1352 . 1 1 118 118 MET HE3 H 1 2.060 0.05 . 1 . . . . 1625 Met HE3 . 17127 1 1353 . 1 1 118 118 MET HG2 H 1 2.503 0.05 . 2 . . . . 1625 Met HG2 . 17127 1 1354 . 1 1 118 118 MET HG3 H 1 2.542 0.05 . 2 . . . . 1625 Met HG3 . 17127 1 1355 . 1 1 118 118 MET C C 13 175.571 0.20 . 1 . . . . 1625 Met C . 17127 1 1356 . 1 1 118 118 MET CA C 13 53.881 0.20 . 1 . . . . 1625 Met CA . 17127 1 1357 . 1 1 118 118 MET CB C 13 35.548 0.20 . 1 . . . . 1625 Met CB . 17127 1 1358 . 1 1 118 118 MET CE C 13 16.957 0.20 . 1 . . . . 1625 Met CE . 17127 1 1359 . 1 1 118 118 MET CG C 13 31.806 0.20 . 1 . . . . 1625 Met CG . 17127 1 1360 . 1 1 118 118 MET N N 15 117.230 0.05 . 1 . . . . 1625 Met N . 17127 1 1361 . 1 1 119 119 LEU H H 1 9.137 0.05 . 1 . . . . 1626 Leu H . 17127 1 1362 . 1 1 119 119 LEU HA H 1 4.094 0.05 . 1 . . . . 1626 Leu HA . 17127 1 1363 . 1 1 119 119 LEU HB2 H 1 1.035 0.05 . 2 . . . . 1626 Leu HB2 . 17127 1 1364 . 1 1 119 119 LEU HB3 H 1 1.869 0.05 . 2 . . . . 1626 Leu HB3 . 17127 1 1365 . 1 1 119 119 LEU HD11 H 1 0.184 0.05 . 2 . . . . 1626 Leu HD11 . 17127 1 1366 . 1 1 119 119 LEU HD12 H 1 0.184 0.05 . 2 . . . . 1626 Leu HD12 . 17127 1 1367 . 1 1 119 119 LEU HD13 H 1 0.184 0.05 . 2 . . . . 1626 Leu HD13 . 17127 1 1368 . 1 1 119 119 LEU HD21 H 1 0.650 0.05 . 2 . . . . 1626 Leu HD21 . 17127 1 1369 . 1 1 119 119 LEU HD22 H 1 0.650 0.05 . 2 . . . . 1626 Leu HD22 . 17127 1 1370 . 1 1 119 119 LEU HD23 H 1 0.650 0.05 . 2 . . . . 1626 Leu HD23 . 17127 1 1371 . 1 1 119 119 LEU HG H 1 1.059 0.05 . 1 . . . . 1626 Leu HG . 17127 1 1372 . 1 1 119 119 LEU C C 13 175.375 0.20 . 1 . . . . 1626 Leu C . 17127 1 1373 . 1 1 119 119 LEU CA C 13 55.436 0.20 . 1 . . . . 1626 Leu CA . 17127 1 1374 . 1 1 119 119 LEU CB C 13 41.579 0.20 . 1 . . . . 1626 Leu CB . 17127 1 1375 . 1 1 119 119 LEU CD1 C 13 22.393 0.20 . 2 . . . . 1626 Leu CD1 . 17127 1 1376 . 1 1 119 119 LEU CD2 C 13 27.187 0.20 . 2 . . . . 1626 Leu CD2 . 17127 1 1377 . 1 1 119 119 LEU CG C 13 27.172 0.20 . 1 . . . . 1626 Leu CG . 17127 1 1378 . 1 1 119 119 LEU N N 15 126.254 0.05 . 1 . . . . 1626 Leu N . 17127 1 1379 . 1 1 120 120 ILE H H 1 9.181 0.05 . 1 . . . . 1627 Ile H . 17127 1 1380 . 1 1 120 120 ILE HA H 1 4.207 0.05 . 1 . . . . 1627 Ile HA . 17127 1 1381 . 1 1 120 120 ILE HB H 1 1.855 0.05 . 1 . . . . 1627 Ile HB . 17127 1 1382 . 1 1 120 120 ILE HD11 H 1 0.710 0.05 . 1 . . . . 1627 Ile HD11 . 17127 1 1383 . 1 1 120 120 ILE HD12 H 1 0.710 0.05 . 1 . . . . 1627 Ile HD12 . 17127 1 1384 . 1 1 120 120 ILE HD13 H 1 0.710 0.05 . 1 . . . . 1627 Ile HD13 . 17127 1 1385 . 1 1 120 120 ILE HG12 H 1 1.334 0.05 . 1 . . . . 1627 Ile HG12 . 17127 1 1386 . 1 1 120 120 ILE HG13 H 1 1.334 0.05 . 1 . . . . 1627 Ile HG13 . 17127 1 1387 . 1 1 120 120 ILE HG21 H 1 0.822 0.05 . 1 . . . . 1627 Ile HG21 . 17127 1 1388 . 1 1 120 120 ILE HG22 H 1 0.822 0.05 . 1 . . . . 1627 Ile HG22 . 17127 1 1389 . 1 1 120 120 ILE HG23 H 1 0.822 0.05 . 1 . . . . 1627 Ile HG23 . 17127 1 1390 . 1 1 120 120 ILE C C 13 176.631 0.20 . 1 . . . . 1627 Ile C . 17127 1 1391 . 1 1 120 120 ILE CA C 13 61.004 0.20 . 1 . . . . 1627 Ile CA . 17127 1 1392 . 1 1 120 120 ILE CB C 13 37.840 0.20 . 1 . . . . 1627 Ile CB . 17127 1 1393 . 1 1 120 120 ILE CD1 C 13 10.941 0.20 . 1 . . . . 1627 Ile CD1 . 17127 1 1394 . 1 1 120 120 ILE CG1 C 13 26.817 0.20 . 1 . . . . 1627 Ile CG1 . 17127 1 1395 . 1 1 120 120 ILE CG2 C 13 17.642 0.20 . 1 . . . . 1627 Ile CG2 . 17127 1 1396 . 1 1 120 120 ILE N N 15 128.187 0.05 . 1 . . . . 1627 Ile N . 17127 1 1397 . 1 1 121 121 SER H H 1 7.492 0.05 . 1 . . . . 1628 Ser H . 17127 1 1398 . 1 1 121 121 SER HA H 1 4.465 0.05 . 1 . . . . 1628 Ser HA . 17127 1 1399 . 1 1 121 121 SER HB2 H 1 3.730 0.05 . 1 . . . . 1628 Ser HB2 . 17127 1 1400 . 1 1 121 121 SER HB3 H 1 3.730 0.05 . 1 . . . . 1628 Ser HB3 . 17127 1 1401 . 1 1 121 121 SER C C 13 170.934 0.20 . 1 . . . . 1628 Ser C . 17127 1 1402 . 1 1 121 121 SER CA C 13 58.192 0.20 . 1 . . . . 1628 Ser CA . 17127 1 1403 . 1 1 121 121 SER CB C 13 65.150 0.20 . 1 . . . . 1628 Ser CB . 17127 1 1404 . 1 1 121 121 SER N N 15 110.574 0.05 . 1 . . . . 1628 Ser N . 17127 1 1405 . 1 1 122 122 LEU H H 1 8.121 0.05 . 1 . . . . 1629 Leu H . 17127 1 1406 . 1 1 122 122 LEU HA H 1 5.012 0.05 . 1 . . . . 1629 Leu HA . 17127 1 1407 . 1 1 122 122 LEU HB2 H 1 1.715 0.05 . 2 . . . . 1629 Leu HB2 . 17127 1 1408 . 1 1 122 122 LEU HB3 H 1 1.154 0.05 . 2 . . . . 1629 Leu HB3 . 17127 1 1409 . 1 1 122 122 LEU HD11 H 1 0.802 0.05 . 2 . . . . 1629 Leu HD11 . 17127 1 1410 . 1 1 122 122 LEU HD12 H 1 0.802 0.05 . 2 . . . . 1629 Leu HD12 . 17127 1 1411 . 1 1 122 122 LEU HD13 H 1 0.802 0.05 . 2 . . . . 1629 Leu HD13 . 17127 1 1412 . 1 1 122 122 LEU HD21 H 1 0.816 0.05 . 2 . . . . 1629 Leu HD21 . 17127 1 1413 . 1 1 122 122 LEU HD22 H 1 0.816 0.05 . 2 . . . . 1629 Leu HD22 . 17127 1 1414 . 1 1 122 122 LEU HD23 H 1 0.816 0.05 . 2 . . . . 1629 Leu HD23 . 17127 1 1415 . 1 1 122 122 LEU C C 13 175.188 0.20 . 1 . . . . 1629 Leu C . 17127 1 1416 . 1 1 122 122 LEU CA C 13 53.644 0.20 . 1 . . . . 1629 Leu CA . 17127 1 1417 . 1 1 122 122 LEU CB C 13 44.413 0.20 . 1 . . . . 1629 Leu CB . 17127 1 1418 . 1 1 122 122 LEU CD1 C 13 26.208 0.20 . 2 . . . . 1629 Leu CD1 . 17127 1 1419 . 1 1 122 122 LEU CD2 C 13 23.215 0.20 . 2 . . . . 1629 Leu CD2 . 17127 1 1420 . 1 1 122 122 LEU N N 15 122.592 0.05 . 1 . . . . 1629 Leu N . 17127 1 1421 . 1 1 123 123 ASP H H 1 9.551 0.05 . 1 . . . . 1630 Asp H . 17127 1 1422 . 1 1 123 123 ASP HA H 1 4.983 0.05 . 1 . . . . 1630 Asp HA . 17127 1 1423 . 1 1 123 123 ASP HB2 H 1 2.858 0.05 . 2 . . . . 1630 Asp HB2 . 17127 1 1424 . 1 1 123 123 ASP HB3 H 1 3.067 0.05 . 2 . . . . 1630 Asp HB3 . 17127 1 1425 . 1 1 123 123 ASP C C 13 177.019 0.20 . 1 . . . . 1630 Asp C . 17127 1 1426 . 1 1 123 123 ASP CA C 13 53.226 0.20 . 1 . . . . 1630 Asp CA . 17127 1 1427 . 1 1 123 123 ASP CB C 13 41.674 0.20 . 1 . . . . 1630 Asp CB . 17127 1 1428 . 1 1 123 123 ASP N N 15 127.396 0.05 . 1 . . . . 1630 Asp N . 17127 1 1429 . 1 1 124 124 LYS H H 1 8.947 0.05 . 1 . . . . 1631 Lys H . 17127 1 1430 . 1 1 124 124 LYS HA H 1 3.790 0.05 . 1 . . . . 1631 Lys HA . 17127 1 1431 . 1 1 124 124 LYS HB2 H 1 1.833 0.05 . 1 . . . . 1631 Lys HB2 . 17127 1 1432 . 1 1 124 124 LYS HB3 H 1 1.833 0.05 . 1 . . . . 1631 Lys HB3 . 17127 1 1433 . 1 1 124 124 LYS HD2 H 1 1.700 0.05 . 1 . . . . 1631 Lys HD2 . 17127 1 1434 . 1 1 124 124 LYS HD3 H 1 1.700 0.05 . 1 . . . . 1631 Lys HD3 . 17127 1 1435 . 1 1 124 124 LYS HG2 H 1 1.485 0.05 . 1 . . . . 1631 Lys HG2 . 17127 1 1436 . 1 1 124 124 LYS HG3 H 1 1.485 0.05 . 1 . . . . 1631 Lys HG3 . 17127 1 1437 . 1 1 124 124 LYS C C 13 177.505 0.20 . 1 . . . . 1631 Lys C . 17127 1 1438 . 1 1 124 124 LYS CA C 13 59.871 0.20 . 1 . . . . 1631 Lys CA . 17127 1 1439 . 1 1 124 124 LYS CB C 13 31.987 0.20 . 1 . . . . 1631 Lys CB . 17127 1 1440 . 1 1 124 124 LYS CD C 13 28.833 0.20 . 1 . . . . 1631 Lys CD . 17127 1 1441 . 1 1 124 124 LYS CG C 13 26.007 0.20 . 1 . . . . 1631 Lys CG . 17127 1 1442 . 1 1 124 124 LYS N N 15 125.917 0.05 . 1 . . . . 1631 Lys N . 17127 1 1443 . 1 1 125 125 GLN H H 1 8.424 0.05 . 1 . . . . 1632 Gln H . 17127 1 1444 . 1 1 125 125 GLN HA H 1 4.130 0.05 . 1 . . . . 1632 Gln HA . 17127 1 1445 . 1 1 125 125 GLN HB2 H 1 2.308 0.05 . 2 . . . . 1632 Gln HB2 . 17127 1 1446 . 1 1 125 125 GLN HB3 H 1 2.169 0.05 . 2 . . . . 1632 Gln HB3 . 17127 1 1447 . 1 1 125 125 GLN HE21 H 1 6.893 0.05 . 1 . . . . 1632 Gln HE21 . 17127 1 1448 . 1 1 125 125 GLN HE22 H 1 7.543 0.05 . 1 . . . . 1632 Gln HE22 . 17127 1 1449 . 1 1 125 125 GLN HG2 H 1 2.445 0.05 . 2 . . . . 1632 Gln HG2 . 17127 1 1450 . 1 1 125 125 GLN HG3 H 1 2.446 0.05 . 2 . . . . 1632 Gln HG3 . 17127 1 1451 . 1 1 125 125 GLN C C 13 177.895 0.20 . 1 . . . . 1632 Gln C . 17127 1 1452 . 1 1 125 125 GLN CA C 13 58.732 0.20 . 1 . . . . 1632 Gln CA . 17127 1 1453 . 1 1 125 125 GLN CB C 13 28.778 0.20 . 1 . . . . 1632 Gln CB . 17127 1 1454 . 1 1 125 125 GLN CG C 13 34.402 0.20 . 1 . . . . 1632 Gln CG . 17127 1 1455 . 1 1 125 125 GLN N N 15 116.017 0.05 . 1 . . . . 1632 Gln N . 17127 1 1456 . 1 1 125 125 GLN NE2 N 15 111.955 0.05 . 1 . . . . 1632 Gln NE2 . 17127 1 1457 . 1 1 126 126 THR H H 1 7.258 0.05 . 1 . . . . 1633 Thr H . 17127 1 1458 . 1 1 126 126 THR HA H 1 4.396 0.05 . 1 . . . . 1633 Thr HA . 17127 1 1459 . 1 1 126 126 THR HB H 1 4.418 0.05 . 1 . . . . 1633 Thr HB . 17127 1 1460 . 1 1 126 126 THR HG21 H 1 1.166 0.05 . 1 . . . . 1633 Thr HG21 . 17127 1 1461 . 1 1 126 126 THR HG22 H 1 1.166 0.05 . 1 . . . . 1633 Thr HG22 . 17127 1 1462 . 1 1 126 126 THR HG23 H 1 1.166 0.05 . 1 . . . . 1633 Thr HG23 . 17127 1 1463 . 1 1 126 126 THR C C 13 174.212 0.20 . 1 . . . . 1633 Thr C . 17127 1 1464 . 1 1 126 126 THR CA C 13 60.927 0.20 . 1 . . . . 1633 Thr CA . 17127 1 1465 . 1 1 126 126 THR CB C 13 70.470 0.20 . 1 . . . . 1633 Thr CB . 17127 1 1466 . 1 1 126 126 THR CG2 C 13 21.366 0.20 . 1 . . . . 1633 Thr CG2 . 17127 1 1467 . 1 1 126 126 THR N N 15 104.281 0.05 . 1 . . . . 1633 Thr N . 17127 1 1468 . 1 1 127 127 CYS H H 1 7.869 0.05 . 1 . . . . 1634 Cys H . 17127 1 1469 . 1 1 127 127 CYS HA H 1 3.571 0.05 . 1 . . . . 1634 Cys HA . 17127 1 1470 . 1 1 127 127 CYS HB2 H 1 3.006 0.05 . 2 . . . . 1634 Cys HB2 . 17127 1 1471 . 1 1 127 127 CYS HB3 H 1 3.388 0.05 . 2 . . . . 1634 Cys HB3 . 17127 1 1472 . 1 1 127 127 CYS C C 13 171.761 0.20 . 1 . . . . 1634 Cys C . 17127 1 1473 . 1 1 127 127 CYS CA C 13 57.607 0.20 . 1 . . . . 1634 Cys CA . 17127 1 1474 . 1 1 127 127 CYS CB C 13 41.570 0.20 . 1 . . . . 1634 Cys CB . 17127 1 1475 . 1 1 127 127 CYS N N 15 116.466 0.05 . 1 . . . . 1634 Cys N . 17127 1 1476 . 1 1 128 128 THR H H 1 7.454 0.05 . 1 . . . . 1635 Thr H . 17127 1 1477 . 1 1 128 128 THR HA H 1 4.988 0.05 . 1 . . . . 1635 Thr HA . 17127 1 1478 . 1 1 128 128 THR HB H 1 3.621 0.05 . 1 . . . . 1635 Thr HB . 17127 1 1479 . 1 1 128 128 THR HG21 H 1 0.319 0.05 . 1 . . . . 1635 Thr HG21 . 17127 1 1480 . 1 1 128 128 THR HG22 H 1 0.319 0.05 . 1 . . . . 1635 Thr HG22 . 17127 1 1481 . 1 1 128 128 THR HG23 H 1 0.319 0.05 . 1 . . . . 1635 Thr HG23 . 17127 1 1482 . 1 1 128 128 THR C C 13 172.494 0.20 . 1 . . . . 1635 Thr C . 17127 1 1483 . 1 1 128 128 THR CA C 13 62.365 0.20 . 1 . . . . 1635 Thr CA . 17127 1 1484 . 1 1 128 128 THR CB C 13 70.034 0.20 . 1 . . . . 1635 Thr CB . 17127 1 1485 . 1 1 128 128 THR CG2 C 13 22.345 0.20 . 1 . . . . 1635 Thr CG2 . 17127 1 1486 . 1 1 128 128 THR N N 15 110.684 0.05 . 1 . . . . 1635 Thr N . 17127 1 1487 . 1 1 129 129 LEU H H 1 9.318 0.05 . 1 . . . . 1636 Leu H . 17127 1 1488 . 1 1 129 129 LEU HA H 1 4.612 0.05 . 1 . . . . 1636 Leu HA . 17127 1 1489 . 1 1 129 129 LEU HB2 H 1 1.159 0.05 . 2 . . . . 1636 Leu HB2 . 17127 1 1490 . 1 1 129 129 LEU HB3 H 1 1.985 0.05 . 2 . . . . 1636 Leu HB3 . 17127 1 1491 . 1 1 129 129 LEU HD11 H 1 1.089 0.05 . 2 . . . . 1636 Leu HD11 . 17127 1 1492 . 1 1 129 129 LEU HD12 H 1 1.089 0.05 . 2 . . . . 1636 Leu HD12 . 17127 1 1493 . 1 1 129 129 LEU HD13 H 1 1.089 0.05 . 2 . . . . 1636 Leu HD13 . 17127 1 1494 . 1 1 129 129 LEU HD21 H 1 0.973 0.05 . 2 . . . . 1636 Leu HD21 . 17127 1 1495 . 1 1 129 129 LEU HD22 H 1 0.973 0.05 . 2 . . . . 1636 Leu HD22 . 17127 1 1496 . 1 1 129 129 LEU HD23 H 1 0.973 0.05 . 2 . . . . 1636 Leu HD23 . 17127 1 1497 . 1 1 129 129 LEU HG H 1 1.630 0.05 . 1 . . . . 1636 Leu HG . 17127 1 1498 . 1 1 129 129 LEU C C 13 174.092 0.20 . 1 . . . . 1636 Leu C . 17127 1 1499 . 1 1 129 129 LEU CA C 13 56.483 0.20 . 1 . . . . 1636 Leu CA . 17127 1 1500 . 1 1 129 129 LEU CB C 13 43.412 0.20 . 1 . . . . 1636 Leu CB . 17127 1 1501 . 1 1 129 129 LEU CD1 C 13 24.659 0.20 . 2 . . . . 1636 Leu CD1 . 17127 1 1502 . 1 1 129 129 LEU CD2 C 13 25.972 0.20 . 2 . . . . 1636 Leu CD2 . 17127 1 1503 . 1 1 129 129 LEU CG C 13 31.943 0.20 . 1 . . . . 1636 Leu CG . 17127 1 1504 . 1 1 129 129 LEU N N 15 130.310 0.05 . 1 . . . . 1636 Leu N . 17127 1 1505 . 1 1 130 130 PHE H H 1 8.558 0.05 . 1 . . . . 1637 Phe H . 17127 1 1506 . 1 1 130 130 PHE HA H 1 5.135 0.05 . 1 . . . . 1637 Phe HA . 17127 1 1507 . 1 1 130 130 PHE HB2 H 1 2.846 0.05 . 1 . . . . 1637 Phe HB2 . 17127 1 1508 . 1 1 130 130 PHE HB3 H 1 2.846 0.05 . 1 . . . . 1637 Phe HB3 . 17127 1 1509 . 1 1 130 130 PHE HD1 H 1 7.154 0.05 . 3 . . . . 1637 Phe HD1 . 17127 1 1510 . 1 1 130 130 PHE HD2 H 1 7.154 0.05 . 3 . . . . 1637 Phe HD2 . 17127 1 1511 . 1 1 130 130 PHE HE1 H 1 7.219 0.05 . 3 . . . . 1637 Phe HE1 . 17127 1 1512 . 1 1 130 130 PHE HE2 H 1 7.219 0.05 . 3 . . . . 1637 Phe HE2 . 17127 1 1513 . 1 1 130 130 PHE C C 13 174.875 0.20 . 1 . . . . 1637 Phe C . 17127 1 1514 . 1 1 130 130 PHE CA C 13 57.535 0.20 . 1 . . . . 1637 Phe CA . 17127 1 1515 . 1 1 130 130 PHE CB C 13 40.427 0.20 . 1 . . . . 1637 Phe CB . 17127 1 1516 . 1 1 130 130 PHE CD1 C 13 131.965 0.20 . 3 . . . . 1637 Phe CD1 . 17127 1 1517 . 1 1 130 130 PHE CD2 C 13 131.965 0.20 . 3 . . . . 1637 Phe CD2 . 17127 1 1518 . 1 1 130 130 PHE N N 15 118.979 0.05 . 1 . . . . 1637 Phe N . 17127 1 1519 . 1 1 131 131 PHE H H 1 9.458 0.05 . 1 . . . . 1638 Phe H . 17127 1 1520 . 1 1 131 131 PHE HA H 1 5.701 0.05 . 1 . . . . 1638 Phe HA . 17127 1 1521 . 1 1 131 131 PHE HB2 H 1 3.059 0.05 . 2 . . . . 1638 Phe HB2 . 17127 1 1522 . 1 1 131 131 PHE HB3 H 1 2.658 0.05 . 2 . . . . 1638 Phe HB3 . 17127 1 1523 . 1 1 131 131 PHE HD1 H 1 6.805 0.05 . 3 . . . . 1638 Phe HD1 . 17127 1 1524 . 1 1 131 131 PHE HD2 H 1 6.805 0.05 . 3 . . . . 1638 Phe HD2 . 17127 1 1525 . 1 1 131 131 PHE HE1 H 1 7.062 0.05 . 3 . . . . 1638 Phe HE1 . 17127 1 1526 . 1 1 131 131 PHE HE2 H 1 7.062 0.05 . 3 . . . . 1638 Phe HE2 . 17127 1 1527 . 1 1 131 131 PHE HZ H 1 6.929 0.05 . 1 . . . . 1638 Phe HZ . 17127 1 1528 . 1 1 131 131 PHE C C 13 176.025 0.20 . 1 . . . . 1638 Phe C . 17127 1 1529 . 1 1 131 131 PHE CA C 13 56.042 0.20 . 1 . . . . 1638 Phe CA . 17127 1 1530 . 1 1 131 131 PHE CB C 13 43.228 0.20 . 1 . . . . 1638 Phe CB . 17127 1 1531 . 1 1 131 131 PHE CD1 C 13 131.757 0.20 . 3 . . . . 1638 Phe CD1 . 17127 1 1532 . 1 1 131 131 PHE CD2 C 13 131.757 0.20 . 3 . . . . 1638 Phe CD2 . 17127 1 1533 . 1 1 131 131 PHE N N 15 120.108 0.05 . 1 . . . . 1638 Phe N . 17127 1 1534 . 1 1 132 132 SER H H 1 9.287 0.05 . 1 . . . . 1639 Ser H . 17127 1 1535 . 1 1 132 132 SER HA H 1 5.440 0.05 . 1 . . . . 1639 Ser HA . 17127 1 1536 . 1 1 132 132 SER HB2 H 1 3.646 0.05 . 2 . . . . 1639 Ser HB2 . 17127 1 1537 . 1 1 132 132 SER HB3 H 1 3.658 0.05 . 2 . . . . 1639 Ser HB3 . 17127 1 1538 . 1 1 132 132 SER C C 13 173.477 0.20 . 1 . . . . 1639 Ser C . 17127 1 1539 . 1 1 132 132 SER CA C 13 56.795 0.20 . 1 . . . . 1639 Ser CA . 17127 1 1540 . 1 1 132 132 SER CB C 13 66.299 0.20 . 1 . . . . 1639 Ser CB . 17127 1 1541 . 1 1 132 132 SER N N 15 116.875 0.05 . 1 . . . . 1639 Ser N . 17127 1 1542 . 1 1 133 133 TRP H H 1 8.992 0.05 . 1 . . . . 1640 Trp H . 17127 1 1543 . 1 1 133 133 TRP HA H 1 4.874 0.05 . 1 . . . . 1640 Trp HA . 17127 1 1544 . 1 1 133 133 TRP HB2 H 1 2.885 0.05 . 1 . . . . 1640 Trp HB2 . 17127 1 1545 . 1 1 133 133 TRP HB3 H 1 2.885 0.05 . 1 . . . . 1640 Trp HB3 . 17127 1 1546 . 1 1 133 133 TRP HD1 H 1 6.887 0.05 . 1 . . . . 1640 Trp HD1 . 17127 1 1547 . 1 1 133 133 TRP HE1 H 1 9.610 0.05 . 1 . . . . 1640 Trp HE1 . 17127 1 1548 . 1 1 133 133 TRP HE3 H 1 7.339 0.05 . 1 . . . . 1640 Trp HE3 . 17127 1 1549 . 1 1 133 133 TRP HZ2 H 1 6.765 0.05 . 1 . . . . 1640 Trp HZ2 . 17127 1 1550 . 1 1 133 133 TRP HZ3 H 1 6.414 0.05 . 1 . . . . 1640 Trp HZ3 . 17127 1 1551 . 1 1 133 133 TRP C C 13 175.473 0.20 . 1 . . . . 1640 Trp C . 17127 1 1552 . 1 1 133 133 TRP CA C 13 55.625 0.20 . 1 . . . . 1640 Trp CA . 17127 1 1553 . 1 1 133 133 TRP CB C 13 31.682 0.20 . 1 . . . . 1640 Trp CB . 17127 1 1554 . 1 1 133 133 TRP CD1 C 13 122.751 0.20 . 1 . . . . 1640 Trp CD1 . 17127 1 1555 . 1 1 133 133 TRP CE3 C 13 120.432 0.20 . 1 . . . . 1640 Trp CE3 . 17127 1 1556 . 1 1 133 133 TRP CZ2 C 13 114.421 0.20 . 1 . . . . 1640 Trp CZ2 . 17127 1 1557 . 1 1 133 133 TRP CZ3 C 13 120.630 0.20 . 1 . . . . 1640 Trp CZ3 . 17127 1 1558 . 1 1 133 133 TRP N N 15 129.224 0.05 . 1 . . . . 1640 Trp N . 17127 1 1559 . 1 1 133 133 TRP NE1 N 15 126.953 0.05 . 1 . . . . 1640 Trp NE1 . 17127 1 1560 . 1 1 134 134 HIS H H 1 9.305 0.05 . 1 . . . . 1641 His H . 17127 1 1561 . 1 1 134 134 HIS HA H 1 5.491 0.05 . 1 . . . . 1641 His HA . 17127 1 1562 . 1 1 134 134 HIS HB2 H 1 3.338 0.05 . 2 . . . . 1641 His HB2 . 17127 1 1563 . 1 1 134 134 HIS HB3 H 1 2.947 0.05 . 2 . . . . 1641 His HB3 . 17127 1 1564 . 1 1 134 134 HIS HD2 H 1 7.146 0.05 . 1 . . . . 1641 His HD2 . 17127 1 1565 . 1 1 134 134 HIS C C 13 173.218 0.20 . 1 . . . . 1641 His C . 17127 1 1566 . 1 1 134 134 HIS CA C 13 55.150 0.20 . 1 . . . . 1641 His CA . 17127 1 1567 . 1 1 134 134 HIS CB C 13 28.605 0.20 . 1 . . . . 1641 His CB . 17127 1 1568 . 1 1 134 134 HIS CD2 C 13 119.387 0.20 . 1 . . . . 1641 His CD2 . 17127 1 1569 . 1 1 134 134 HIS N N 15 127.049 0.05 . 1 . . . . 1641 His N . 17127 1 1570 . 1 1 135 135 THR H H 1 8.967 0.05 . 1 . . . . 1642 Thr H . 17127 1 1571 . 1 1 135 135 THR HA H 1 5.439 0.05 . 1 . . . . 1642 Thr HA . 17127 1 1572 . 1 1 135 135 THR HB H 1 4.257 0.05 . 1 . . . . 1642 Thr HB . 17127 1 1573 . 1 1 135 135 THR HG21 H 1 1.035 0.05 . 1 . . . . 1642 Thr HG21 . 17127 1 1574 . 1 1 135 135 THR HG22 H 1 1.035 0.05 . 1 . . . . 1642 Thr HG22 . 17127 1 1575 . 1 1 135 135 THR HG23 H 1 1.035 0.05 . 1 . . . . 1642 Thr HG23 . 17127 1 1576 . 1 1 135 135 THR CA C 13 56.654 0.20 . 1 . . . . 1642 Thr CA . 17127 1 1577 . 1 1 135 135 THR CB C 13 69.702 0.20 . 1 . . . . 1642 Thr CB . 17127 1 1578 . 1 1 135 135 THR CG2 C 13 19.965 0.20 . 1 . . . . 1642 Thr CG2 . 17127 1 1579 . 1 1 135 135 THR N N 15 119.861 0.05 . 1 . . . . 1642 Thr N . 17127 1 1580 . 1 1 136 136 PRO HA H 1 4.765 0.05 . 1 . . . . 1643 Pro HA . 17127 1 1581 . 1 1 136 136 PRO HB2 H 1 2.008 0.05 . 2 . . . . 1643 Pro HB2 . 17127 1 1582 . 1 1 136 136 PRO HB3 H 1 2.504 0.05 . 2 . . . . 1643 Pro HB3 . 17127 1 1583 . 1 1 136 136 PRO HD2 H 1 3.678 0.05 . 2 . . . . 1643 Pro HD2 . 17127 1 1584 . 1 1 136 136 PRO HD3 H 1 3.646 0.05 . 2 . . . . 1643 Pro HD3 . 17127 1 1585 . 1 1 136 136 PRO HG2 H 1 2.336 0.05 . 1 . . . . 1643 Pro HG2 . 17127 1 1586 . 1 1 136 136 PRO HG3 H 1 2.336 0.05 . 1 . . . . 1643 Pro HG3 . 17127 1 1587 . 1 1 136 136 PRO C C 13 179.339 0.20 . 1 . . . . 1643 Pro C . 17127 1 1588 . 1 1 136 136 PRO CA C 13 64.592 0.20 . 1 . . . . 1643 Pro CA . 17127 1 1589 . 1 1 136 136 PRO CB C 13 32.205 0.20 . 1 . . . . 1643 Pro CB . 17127 1 1590 . 1 1 136 136 PRO CD C 13 50.330 0.20 . 1 . . . . 1643 Pro CD . 17127 1 1591 . 1 1 136 136 PRO CG C 13 27.438 0.20 . 1 . . . . 1643 Pro CG . 17127 1 1592 . 1 1 137 137 LEU H H 1 8.405 0.05 . 1 . . . . 1644 Leu H . 17127 1 1593 . 1 1 137 137 LEU HA H 1 4.166 0.05 . 1 . . . . 1644 Leu HA . 17127 1 1594 . 1 1 137 137 LEU HB2 H 1 1.574 0.05 . 2 . . . . 1644 Leu HB2 . 17127 1 1595 . 1 1 137 137 LEU HB3 H 1 1.407 0.05 . 2 . . . . 1644 Leu HB3 . 17127 1 1596 . 1 1 137 137 LEU HD11 H 1 0.914 0.05 . 2 . . . . 1644 Leu HD11 . 17127 1 1597 . 1 1 137 137 LEU HD12 H 1 0.914 0.05 . 2 . . . . 1644 Leu HD12 . 17127 1 1598 . 1 1 137 137 LEU HD13 H 1 0.914 0.05 . 2 . . . . 1644 Leu HD13 . 17127 1 1599 . 1 1 137 137 LEU HD21 H 1 0.720 0.05 . 2 . . . . 1644 Leu HD21 . 17127 1 1600 . 1 1 137 137 LEU HD22 H 1 0.720 0.05 . 2 . . . . 1644 Leu HD22 . 17127 1 1601 . 1 1 137 137 LEU HD23 H 1 0.720 0.05 . 2 . . . . 1644 Leu HD23 . 17127 1 1602 . 1 1 137 137 LEU HG H 1 1.401 0.05 . 1 . . . . 1644 Leu HG . 17127 1 1603 . 1 1 137 137 LEU C C 13 176.860 0.20 . 1 . . . . 1644 Leu C . 17127 1 1604 . 1 1 137 137 LEU CA C 13 56.622 0.20 . 1 . . . . 1644 Leu CA . 17127 1 1605 . 1 1 137 137 LEU CB C 13 41.985 0.20 . 1 . . . . 1644 Leu CB . 17127 1 1606 . 1 1 137 137 LEU CD1 C 13 22.221 0.20 . 2 . . . . 1644 Leu CD1 . 17127 1 1607 . 1 1 137 137 LEU CD2 C 13 25.636 0.20 . 2 . . . . 1644 Leu CD2 . 17127 1 1608 . 1 1 137 137 LEU N N 15 118.512 0.05 . 1 . . . . 1644 Leu N . 17127 1 1609 . 1 1 138 138 ALA H H 1 7.130 0.05 . 1 . . . . 1645 Ala H . 17127 1 1610 . 1 1 138 138 ALA HA H 1 4.506 0.05 . 1 . . . . 1645 Ala HA . 17127 1 1611 . 1 1 138 138 ALA HB1 H 1 1.119 0.05 . 1 . . . . 1645 Ala HB1 . 17127 1 1612 . 1 1 138 138 ALA HB2 H 1 1.119 0.05 . 1 . . . . 1645 Ala HB2 . 17127 1 1613 . 1 1 138 138 ALA HB3 H 1 1.119 0.05 . 1 . . . . 1645 Ala HB3 . 17127 1 1614 . 1 1 138 138 ALA C C 13 175.012 0.20 . 1 . . . . 1645 Ala C . 17127 1 1615 . 1 1 138 138 ALA CA C 13 51.404 0.20 . 1 . . . . 1645 Ala CA . 17127 1 1616 . 1 1 138 138 ALA CB C 13 19.059 0.20 . 1 . . . . 1645 Ala CB . 17127 1 1617 . 1 1 138 138 ALA N N 15 116.660 0.05 . 1 . . . . 1645 Ala N . 17127 1 1618 . 1 1 139 139 CYS H H 1 7.535 0.05 . 1 . . . . 1646 Cys H . 17127 1 1619 . 1 1 139 139 CYS HA H 1 4.873 0.05 . 1 . . . . 1646 Cys HA . 17127 1 1620 . 1 1 139 139 CYS HB2 H 1 3.272 0.05 . 2 . . . . 1646 Cys HB2 . 17127 1 1621 . 1 1 139 139 CYS HB3 H 1 3.022 0.05 . 2 . . . . 1646 Cys HB3 . 17127 1 1622 . 1 1 139 139 CYS C C 13 173.382 0.20 . 1 . . . . 1646 Cys C . 17127 1 1623 . 1 1 139 139 CYS CA C 13 54.374 0.20 . 1 . . . . 1646 Cys CA . 17127 1 1624 . 1 1 139 139 CYS CB C 13 42.500 0.20 . 1 . . . . 1646 Cys CB . 17127 1 1625 . 1 1 139 139 CYS N N 15 116.891 0.05 . 1 . . . . 1646 Cys N . 17127 1 1626 . 1 1 140 140 GLU H H 1 8.876 0.05 . 1 . . . . 1647 Glu H . 17127 1 1627 . 1 1 140 140 GLU HA H 1 4.215 0.05 . 1 . . . . 1647 Glu HA . 17127 1 1628 . 1 1 140 140 GLU HB2 H 1 1.580 0.05 . 2 . . . . 1647 Glu HB2 . 17127 1 1629 . 1 1 140 140 GLU HB3 H 1 1.566 0.05 . 2 . . . . 1647 Glu HB3 . 17127 1 1630 . 1 1 140 140 GLU HG2 H 1 2.059 0.05 . 2 . . . . 1647 Glu HG2 . 17127 1 1631 . 1 1 140 140 GLU HG3 H 1 1.831 0.05 . 2 . . . . 1647 Glu HG3 . 17127 1 1632 . 1 1 140 140 GLU CA C 13 53.713 0.20 . 1 . . . . 1647 Glu CA . 17127 1 1633 . 1 1 140 140 GLU CB C 13 30.340 0.20 . 1 . . . . 1647 Glu CB . 17127 1 1634 . 1 1 140 140 GLU CG C 13 35.266 0.20 . 1 . . . . 1647 Glu CG . 17127 1 1635 . 1 1 140 140 GLU N N 15 122.731 0.05 . 1 . . . . 1647 Glu N . 17127 1 1636 . 1 1 141 141 PRO HA H 1 4.365 0.05 . 1 . . . . 1648 Pro HA . 17127 1 1637 . 1 1 141 141 PRO HB2 H 1 2.233 0.05 . 2 . . . . 1648 Pro HB2 . 17127 1 1638 . 1 1 141 141 PRO HB3 H 1 2.231 0.05 . 2 . . . . 1648 Pro HB3 . 17127 1 1639 . 1 1 141 141 PRO HD2 H 1 3.198 0.05 . 2 . . . . 1648 Pro HD2 . 17127 1 1640 . 1 1 141 141 PRO HD3 H 1 3.304 0.05 . 2 . . . . 1648 Pro HD3 . 17127 1 1641 . 1 1 141 141 PRO HG2 H 1 1.890 0.05 . 1 . . . . 1648 Pro HG2 . 17127 1 1642 . 1 1 141 141 PRO HG3 H 1 1.890 0.05 . 1 . . . . 1648 Pro HG3 . 17127 1 1643 . 1 1 141 141 PRO C C 13 176.052 0.20 . 1 . . . . 1648 Pro C . 17127 1 1644 . 1 1 141 141 PRO CA C 13 63.563 0.20 . 1 . . . . 1648 Pro CA . 17127 1 1645 . 1 1 141 141 PRO CB C 13 31.936 0.20 . 1 . . . . 1648 Pro CB . 17127 1 1646 . 1 1 141 141 PRO CD C 13 50.551 0.20 . 1 . . . . 1648 Pro CD . 17127 1 1647 . 1 1 141 141 PRO CG C 13 27.464 0.20 . 1 . . . . 1648 Pro CG . 17127 1 1648 . 1 1 142 142 GLU H H 1 8.076 0.05 . 1 . . . . 1649 Glu H . 17127 1 1649 . 1 1 142 142 GLU HA H 1 4.195 0.05 . 1 . . . . 1649 Glu HA . 17127 1 1650 . 1 1 142 142 GLU HB2 H 1 1.904 0.05 . 2 . . . . 1649 Glu HB2 . 17127 1 1651 . 1 1 142 142 GLU HB3 H 1 2.103 0.05 . 2 . . . . 1649 Glu HB3 . 17127 1 1652 . 1 1 142 142 GLU HG2 H 1 2.409 0.05 . 1 . . . . 1649 Glu HG2 . 17127 1 1653 . 1 1 142 142 GLU HG3 H 1 2.409 0.05 . 1 . . . . 1649 Glu HG3 . 17127 1 1654 . 1 1 142 142 GLU CA C 13 57.312 0.20 . 1 . . . . 1649 Glu CA . 17127 1 1655 . 1 1 142 142 GLU CB C 13 30.247 0.20 . 1 . . . . 1649 Glu CB . 17127 1 1656 . 1 1 142 142 GLU CG C 13 34.114 0.20 . 1 . . . . 1649 Glu CG . 17127 1 1657 . 1 1 142 142 GLU N N 15 124.908 0.05 . 1 . . . . 1649 Glu N . 17127 1 1658 . 2 2 1 1 ALA HA H 1 4.070 0.05 . 1 . . . . 1 Ala HA . 17127 1 1659 . 2 2 1 1 ALA HB1 H 1 1.502 0.05 . 1 . . . . 1 Ala HB1 . 17127 1 1660 . 2 2 1 1 ALA HB2 H 1 1.502 0.05 . 1 . . . . 1 Ala HB2 . 17127 1 1661 . 2 2 1 1 ALA HB3 H 1 1.502 0.05 . 1 . . . . 1 Ala HB3 . 17127 1 1662 . 2 2 1 1 ALA C C 13 173.793 0.20 . 1 . . . . 1 Ala C . 17127 1 1663 . 2 2 1 1 ALA CA C 13 51.321 0.20 . 1 . . . . 1 Ala CA . 17127 1 1664 . 2 2 1 1 ALA CB C 13 19.061 0.20 . 1 . . . . 1 Ala CB . 17127 1 1665 . 2 2 2 2 TYR H H 1 8.567 0.05 . 1 . . . . 2 Tyr H . 17127 1 1666 . 2 2 2 2 TYR HA H 1 4.597 0.05 . 1 . . . . 2 Tyr HA . 17127 1 1667 . 2 2 2 2 TYR HB2 H 1 2.948 0.05 . 2 . . . . 2 Tyr HB2 . 17127 1 1668 . 2 2 2 2 TYR HB3 H 1 3.007 0.05 . 2 . . . . 2 Tyr HB3 . 17127 1 1669 . 2 2 2 2 TYR HD1 H 1 7.116 0.05 . 3 . . . . 2 Tyr HD1 . 17127 1 1670 . 2 2 2 2 TYR HD2 H 1 7.116 0.05 . 3 . . . . 2 Tyr HD2 . 17127 1 1671 . 2 2 2 2 TYR HE1 H 1 6.813 0.05 . 3 . . . . 2 Tyr HE1 . 17127 1 1672 . 2 2 2 2 TYR HE2 H 1 6.813 0.05 . 3 . . . . 2 Tyr HE2 . 17127 1 1673 . 2 2 2 2 TYR C C 13 175.394 0.20 . 1 . . . . 2 Tyr C . 17127 1 1674 . 2 2 2 2 TYR CA C 13 57.681 0.20 . 1 . . . . 2 Tyr CA . 17127 1 1675 . 2 2 2 2 TYR CB C 13 38.476 0.20 . 1 . . . . 2 Tyr CB . 17127 1 1676 . 2 2 2 2 TYR N N 15 120.861 0.05 . 1 . . . . 2 Tyr N . 17127 1 1677 . 2 2 3 3 ARG H H 1 8.111 0.05 . 1 . . . . 3 Arg H . 17127 1 1678 . 2 2 3 3 ARG HA H 1 4.569 0.05 . 1 . . . . 3 Arg HA . 17127 1 1679 . 2 2 3 3 ARG HB2 H 1 1.645 0.05 . 2 . . . . 3 Arg HB2 . 17127 1 1680 . 2 2 3 3 ARG HB3 H 1 1.767 0.05 . 2 . . . . 3 Arg HB3 . 17127 1 1681 . 2 2 3 3 ARG HD2 H 1 3.171 0.05 . 1 . . . . 3 Arg HD2 . 17127 1 1682 . 2 2 3 3 ARG HD3 H 1 3.171 0.05 . 1 . . . . 3 Arg HD3 . 17127 1 1683 . 2 2 3 3 ARG HE H 1 7.131 0.05 . 1 . . . . 3 Arg HE . 17127 1 1684 . 2 2 3 3 ARG HG2 H 1 1.575 0.05 . 1 . . . . 3 Arg HG2 . 17127 1 1685 . 2 2 3 3 ARG HG3 H 1 1.575 0.05 . 1 . . . . 3 Arg HG3 . 17127 1 1686 . 2 2 3 3 ARG C C 13 173.749 0.20 . 1 . . . . 3 Arg C . 17127 1 1687 . 2 2 3 3 ARG CA C 13 52.907 0.20 . 1 . . . . 3 Arg CA . 17127 1 1688 . 2 2 3 3 ARG CB C 13 30.494 0.20 . 1 . . . . 3 Arg CB . 17127 1 1689 . 2 2 3 3 ARG CD C 13 43.357 0.20 . 1 . . . . 3 Arg CD . 17127 1 1690 . 2 2 3 3 ARG CG C 13 25.969 0.20 . 1 . . . . 3 Arg CG . 17127 1 1691 . 2 2 3 3 ARG N N 15 125.783 0.05 . 1 . . . . 3 Arg N . 17127 1 1692 . 2 2 3 3 ARG NE N 15 85.090 0.05 . 1 . . . . 3 Arg NE . 17127 1 1693 . 2 2 4 4 PRO HA H 1 4.353 0.05 . 1 . . . . 4 Pro HA . 17127 1 1694 . 2 2 4 4 PRO HB2 H 1 1.985 0.05 . 2 . . . . 4 Pro HB2 . 17127 1 1695 . 2 2 4 4 PRO HB3 H 1 2.305 0.05 . 2 . . . . 4 Pro HB3 . 17127 1 1696 . 2 2 4 4 PRO HD2 H 1 3.543 0.05 . 2 . . . . 4 Pro HD2 . 17127 1 1697 . 2 2 4 4 PRO HD3 H 1 3.575 0.05 . 2 . . . . 4 Pro HD3 . 17127 1 1698 . 2 2 4 4 PRO HG2 H 1 1.981 0.05 . 1 . . . . 4 Pro HG2 . 17127 1 1699 . 2 2 4 4 PRO HG3 H 1 1.981 0.05 . 1 . . . . 4 Pro HG3 . 17127 1 1700 . 2 2 4 4 PRO C C 13 177.124 0.20 . 1 . . . . 4 Pro C . 17127 1 1701 . 2 2 4 4 PRO CA C 13 62.631 0.20 . 1 . . . . 4 Pro CA . 17127 1 1702 . 2 2 4 4 PRO CB C 13 31.718 0.20 . 1 . . . . 4 Pro CB . 17127 1 1703 . 2 2 4 4 PRO CD C 13 50.119 0.20 . 1 . . . . 4 Pro CD . 17127 1 1704 . 2 2 4 4 PRO CG C 13 26.856 0.20 . 1 . . . . 4 Pro CG . 17127 1 1705 . 2 2 5 5 SER H H 1 8.203 0.05 . 1 . . . . 5 Ser H . 17127 1 1706 . 2 2 5 5 SER HA H 1 4.422 0.05 . 1 . . . . 5 Ser HA . 17127 1 1707 . 2 2 5 5 SER HB2 H 1 3.896 0.05 . 1 . . . . 5 Ser HB2 . 17127 1 1708 . 2 2 5 5 SER HB3 H 1 3.896 0.05 . 1 . . . . 5 Ser HB3 . 17127 1 1709 . 2 2 5 5 SER C C 13 174.744 0.20 . 1 . . . . 5 Ser C . 17127 1 1710 . 2 2 5 5 SER CA C 13 58.120 0.20 . 1 . . . . 5 Ser CA . 17127 1 1711 . 2 2 5 5 SER CB C 13 63.440 0.20 . 1 . . . . 5 Ser CB . 17127 1 1712 . 2 2 5 5 SER N N 15 115.351 0.05 . 1 . . . . 5 Ser N . 17127 1 1713 . 2 2 6 6 GLU H H 1 8.424 0.05 . 1 . . . . 6 Glu H . 17127 1 1714 . 2 2 6 6 GLU HA H 1 4.478 0.05 . 1 . . . . 6 Glu HA . 17127 1 1715 . 2 2 6 6 GLU HB2 H 1 2.137 0.05 . 2 . . . . 6 Glu HB2 . 17127 1 1716 . 2 2 6 6 GLU HB3 H 1 2.006 0.05 . 2 . . . . 6 Glu HB3 . 17127 1 1717 . 2 2 6 6 GLU HG2 H 1 2.358 0.05 . 1 . . . . 6 Glu HG2 . 17127 1 1718 . 2 2 6 6 GLU HG3 H 1 2.358 0.05 . 1 . . . . 6 Glu HG3 . 17127 1 1719 . 2 2 6 6 GLU C C 13 176.756 0.20 . 1 . . . . 6 Glu C . 17127 1 1720 . 2 2 6 6 GLU CA C 13 55.695 0.20 . 1 . . . . 6 Glu CA . 17127 1 1721 . 2 2 6 6 GLU CB C 13 29.049 0.20 . 1 . . . . 6 Glu CB . 17127 1 1722 . 2 2 6 6 GLU CG C 13 33.614 0.20 . 1 . . . . 6 Glu CG . 17127 1 1723 . 2 2 6 6 GLU N N 15 122.231 0.05 . 1 . . . . 6 Glu N . 17127 1 1724 . 2 2 7 7 THR H H 1 7.948 0.05 . 1 . . . . 7 Thr H . 17127 1 1725 . 2 2 7 7 THR HA H 1 4.493 0.05 . 1 . . . . 7 Thr HA . 17127 1 1726 . 2 2 7 7 THR HB H 1 4.519 0.05 . 1 . . . . 7 Thr HB . 17127 1 1727 . 2 2 7 7 THR HG21 H 1 0.956 0.05 . 1 . . . . 7 Thr HG21 . 17127 1 1728 . 2 2 7 7 THR HG22 H 1 0.956 0.05 . 1 . . . . 7 Thr HG22 . 17127 1 1729 . 2 2 7 7 THR HG23 H 1 0.956 0.05 . 1 . . . . 7 Thr HG23 . 17127 1 1730 . 2 2 7 7 THR C C 13 173.341 0.20 . 1 . . . . 7 Thr C . 17127 1 1731 . 2 2 7 7 THR CA C 13 60.512 0.20 . 1 . . . . 7 Thr CA . 17127 1 1732 . 2 2 7 7 THR CB C 13 70.213 0.20 . 1 . . . . 7 Thr CB . 17127 1 1733 . 2 2 7 7 THR CG2 C 13 22.024 0.20 . 1 . . . . 7 Thr CG2 . 17127 1 1734 . 2 2 7 7 THR N N 15 114.323 0.05 . 1 . . . . 7 Thr N . 17127 1 1735 . 2 2 8 8 LEU H H 1 8.609 0.05 . 1 . . . . 8 Leu H . 17127 1 1736 . 2 2 8 8 LEU HA H 1 4.665 0.05 . 1 . . . . 8 Leu HA . 17127 1 1737 . 2 2 8 8 LEU C C 13 175.631 0.20 . 1 . . . . 8 Leu C . 17127 1 1738 . 2 2 8 8 LEU CA C 13 54.029 0.20 . 1 . . . . 8 Leu CA . 17127 1 1739 . 2 2 8 8 LEU N N 15 124.855 0.05 . 1 . . . . 8 Leu N . 17127 1 1740 . 2 2 9 9 CYS H H 1 8.571 0.05 . 1 . . . . 9 Cys H . 17127 1 1741 . 2 2 9 9 CYS C C 13 175.789 0.20 . 1 . . . . 9 Cys C . 17127 1 1742 . 2 2 10 10 GLY H H 1 8.974 0.05 . 1 . . . . 10 Gly H . 17127 1 1743 . 2 2 10 10 GLY HA2 H 1 3.919 0.05 . 2 . . . . 10 Gly HA2 . 17127 1 1744 . 2 2 10 10 GLY HA3 H 1 3.821 0.05 . 2 . . . . 10 Gly HA3 . 17127 1 1745 . 2 2 10 10 GLY C C 13 176.327 0.20 . 1 . . . . 10 Gly C . 17127 1 1746 . 2 2 10 10 GLY CA C 13 46.463 0.20 . 1 . . . . 10 Gly CA . 17127 1 1747 . 2 2 10 10 GLY N N 15 110.312 0.05 . 1 . . . . 10 Gly N . 17127 1 1748 . 2 2 11 11 GLY H H 1 8.946 0.05 . 1 . . . . 11 Gly H . 17127 1 1749 . 2 2 11 11 GLY HA2 H 1 3.792 0.05 . 2 . . . . 11 Gly HA2 . 17127 1 1750 . 2 2 11 11 GLY HA3 H 1 3.895 0.05 . 2 . . . . 11 Gly HA3 . 17127 1 1751 . 2 2 11 11 GLY C C 13 175.970 0.20 . 1 . . . . 11 Gly C . 17127 1 1752 . 2 2 11 11 GLY CA C 13 46.875 0.20 . 1 . . . . 11 Gly CA . 17127 1 1753 . 2 2 11 11 GLY N N 15 113.451 0.05 . 1 . . . . 11 Gly N . 17127 1 1754 . 2 2 12 12 GLU H H 1 8.647 0.05 . 1 . . . . 12 Glu H . 17127 1 1755 . 2 2 12 12 GLU HA H 1 4.087 0.05 . 1 . . . . 12 Glu HA . 17127 1 1756 . 2 2 12 12 GLU HG2 H 1 2.625 0.05 . 2 . . . . 12 Glu HG2 . 17127 1 1757 . 2 2 12 12 GLU HG3 H 1 2.515 0.05 . 2 . . . . 12 Glu HG3 . 17127 1 1758 . 2 2 12 12 GLU C C 13 179.901 0.20 . 1 . . . . 12 Glu C . 17127 1 1759 . 2 2 12 12 GLU CA C 13 59.448 0.20 . 1 . . . . 12 Glu CA . 17127 1 1760 . 2 2 12 12 GLU CG C 13 35.124 0.20 . 1 . . . . 12 Glu CG . 17127 1 1761 . 2 2 12 12 GLU N N 15 121.253 0.05 . 1 . . . . 12 Glu N . 17127 1 1762 . 2 2 13 13 LEU H H 1 7.121 0.05 . 1 . . . . 13 Leu H . 17127 1 1763 . 2 2 13 13 LEU HA H 1 3.790 0.05 . 1 . . . . 13 Leu HA . 17127 1 1764 . 2 2 13 13 LEU C C 13 177.725 0.20 . 1 . . . . 13 Leu C . 17127 1 1765 . 2 2 13 13 LEU CA C 13 57.928 0.20 . 1 . . . . 13 Leu CA . 17127 1 1766 . 2 2 13 13 LEU N N 15 123.948 0.05 . 1 . . . . 13 Leu N . 17127 1 1767 . 2 2 14 14 VAL H H 1 7.447 0.05 . 1 . . . . 14 Val H . 17127 1 1768 . 2 2 14 14 VAL HA H 1 3.349 0.05 . 1 . . . . 14 Val HA . 17127 1 1769 . 2 2 14 14 VAL HB H 1 2.150 0.05 . 1 . . . . 14 Val HB . 17127 1 1770 . 2 2 14 14 VAL HG11 H 1 1.118 0.05 . 1 . . . . 14 Val HG11 . 17127 1 1771 . 2 2 14 14 VAL HG12 H 1 1.118 0.05 . 1 . . . . 14 Val HG12 . 17127 1 1772 . 2 2 14 14 VAL HG13 H 1 1.118 0.05 . 1 . . . . 14 Val HG13 . 17127 1 1773 . 2 2 14 14 VAL HG21 H 1 1.118 0.05 . 1 . . . . 14 Val HG21 . 17127 1 1774 . 2 2 14 14 VAL HG22 H 1 1.118 0.05 . 1 . . . . 14 Val HG22 . 17127 1 1775 . 2 2 14 14 VAL HG23 H 1 1.118 0.05 . 1 . . . . 14 Val HG23 . 17127 1 1776 . 2 2 14 14 VAL C C 13 178.231 0.20 . 1 . . . . 14 Val C . 17127 1 1777 . 2 2 14 14 VAL CA C 13 66.991 0.20 . 1 . . . . 14 Val CA . 17127 1 1778 . 2 2 14 14 VAL CB C 13 30.954 0.20 . 1 . . . . 14 Val CB . 17127 1 1779 . 2 2 14 14 VAL N N 15 118.791 0.05 . 1 . . . . 14 Val N . 17127 1 1780 . 2 2 15 15 ASP H H 1 8.628 0.05 . 1 . . . . 15 Asp H . 17127 1 1781 . 2 2 15 15 ASP CA C 13 56.870 0.20 . 1 . . . . 15 Asp CA . 17127 1 1782 . 2 2 15 15 ASP CB C 13 41.334 0.20 . 1 . . . . 15 Asp CB . 17127 1 1783 . 2 2 15 15 ASP N N 15 118.158 0.05 . 1 . . . . 15 Asp N . 17127 1 1784 . 2 2 17 17 LEU H H 1 8.206 0.05 . 1 . . . . 17 Leu H . 17127 1 1785 . 2 2 17 17 LEU HA H 1 3.651 0.05 . 1 . . . . 17 Leu HA . 17127 1 1786 . 2 2 17 17 LEU HB2 H 1 1.156 0.05 . 2 . . . . 17 Leu HB2 . 17127 1 1787 . 2 2 17 17 LEU HB3 H 1 1.035 0.05 . 2 . . . . 17 Leu HB3 . 17127 1 1788 . 2 2 17 17 LEU HD11 H 1 0.325 0.05 . 2 . . . . 17 Leu HD11 . 17127 1 1789 . 2 2 17 17 LEU HD12 H 1 0.325 0.05 . 2 . . . . 17 Leu HD12 . 17127 1 1790 . 2 2 17 17 LEU HD13 H 1 0.325 0.05 . 2 . . . . 17 Leu HD13 . 17127 1 1791 . 2 2 17 17 LEU HD21 H 1 0.477 0.05 . 2 . . . . 17 Leu HD21 . 17127 1 1792 . 2 2 17 17 LEU HD22 H 1 0.477 0.05 . 2 . . . . 17 Leu HD22 . 17127 1 1793 . 2 2 17 17 LEU HD23 H 1 0.477 0.05 . 2 . . . . 17 Leu HD23 . 17127 1 1794 . 2 2 17 17 LEU HG H 1 1.029 0.05 . 1 . . . . 17 Leu HG . 17127 1 1795 . 2 2 17 17 LEU CA C 13 58.133 0.20 . 1 . . . . 17 Leu CA . 17127 1 1796 . 2 2 17 17 LEU CB C 13 40.930 0.20 . 1 . . . . 17 Leu CB . 17127 1 1797 . 2 2 17 17 LEU CD1 C 13 24.992 0.20 . 2 . . . . 17 Leu CD1 . 17127 1 1798 . 2 2 17 17 LEU CD2 C 13 23.435 0.20 . 2 . . . . 17 Leu CD2 . 17127 1 1799 . 2 2 17 17 LEU CG C 13 27.004 0.20 . 1 . . . . 17 Leu CG . 17127 1 1800 . 2 2 17 17 LEU N N 15 124.617 0.05 . 1 . . . . 17 Leu N . 17127 1 1801 . 2 2 18 18 GLN H H 1 8.206 0.05 . 1 . . . . 18 Gln H . 17127 1 1802 . 2 2 18 18 GLN HA H 1 4.215 0.05 . 1 . . . . 18 Gln HA . 17127 1 1803 . 2 2 18 18 GLN HB2 H 1 2.410 0.05 . 2 . . . . 18 Gln HB2 . 17127 1 1804 . 2 2 18 18 GLN HB3 H 1 2.361 0.05 . 2 . . . . 18 Gln HB3 . 17127 1 1805 . 2 2 18 18 GLN HE21 H 1 7.327 0.05 . 1 . . . . 18 Gln HE21 . 17127 1 1806 . 2 2 18 18 GLN HE22 H 1 6.969 0.05 . 1 . . . . 18 Gln HE22 . 17127 1 1807 . 2 2 18 18 GLN HG2 H 1 2.786 0.05 . 2 . . . . 18 Gln HG2 . 17127 1 1808 . 2 2 18 18 GLN HG3 H 1 2.606 0.05 . 2 . . . . 18 Gln HG3 . 17127 1 1809 . 2 2 18 18 GLN C C 13 178.961 0.20 . 1 . . . . 18 Gln C . 17127 1 1810 . 2 2 18 18 GLN CA C 13 58.660 0.20 . 1 . . . . 18 Gln CA . 17127 1 1811 . 2 2 18 18 GLN CB C 13 28.279 0.20 . 1 . . . . 18 Gln CB . 17127 1 1812 . 2 2 18 18 GLN CG C 13 34.475 0.20 . 1 . . . . 18 Gln CG . 17127 1 1813 . 2 2 18 18 GLN N N 15 116.592 0.05 . 1 . . . . 18 Gln N . 17127 1 1814 . 2 2 18 18 GLN NE2 N 15 111.110 0.05 . 1 . . . . 18 Gln NE2 . 17127 1 1815 . 2 2 19 19 PHE H H 1 7.668 0.05 . 1 . . . . 19 Phe H . 17127 1 1816 . 2 2 19 19 PHE HD1 H 1 5.617 0.05 . 3 . . . . 19 Phe HD1 . 17127 1 1817 . 2 2 19 19 PHE HD2 H 1 5.617 0.05 . 3 . . . . 19 Phe HD2 . 17127 1 1818 . 2 2 19 19 PHE HE1 H 1 6.411 0.05 . 3 . . . . 19 Phe HE1 . 17127 1 1819 . 2 2 19 19 PHE HE2 H 1 6.411 0.05 . 3 . . . . 19 Phe HE2 . 17127 1 1820 . 2 2 19 19 PHE HZ H 1 6.535 0.05 . 1 . . . . 19 Phe HZ . 17127 1 1821 . 2 2 19 19 PHE CA C 13 59.024 0.20 . 1 . . . . 19 Phe CA . 17127 1 1822 . 2 2 19 19 PHE CB C 13 39.162 0.20 . 1 . . . . 19 Phe CB . 17127 1 1823 . 2 2 19 19 PHE N N 15 119.736 0.05 . 1 . . . . 19 Phe N . 17127 1 1824 . 2 2 20 20 VAL H H 1 8.539 0.05 . 1 . . . . 20 Val H . 17127 1 1825 . 2 2 20 20 VAL HA H 1 3.176 0.05 . 1 . . . . 20 Val HA . 17127 1 1826 . 2 2 20 20 VAL HB H 1 1.891 0.05 . 1 . . . . 20 Val HB . 17127 1 1827 . 2 2 20 20 VAL HG11 H 1 0.798 0.05 . 2 . . . . 20 Val HG11 . 17127 1 1828 . 2 2 20 20 VAL HG12 H 1 0.798 0.05 . 2 . . . . 20 Val HG12 . 17127 1 1829 . 2 2 20 20 VAL HG13 H 1 0.798 0.05 . 2 . . . . 20 Val HG13 . 17127 1 1830 . 2 2 20 20 VAL HG21 H 1 0.974 0.05 . 2 . . . . 20 Val HG21 . 17127 1 1831 . 2 2 20 20 VAL HG22 H 1 0.974 0.05 . 2 . . . . 20 Val HG22 . 17127 1 1832 . 2 2 20 20 VAL HG23 H 1 0.974 0.05 . 2 . . . . 20 Val HG23 . 17127 1 1833 . 2 2 20 20 VAL C C 13 178.477 0.20 . 1 . . . . 20 Val C . 17127 1 1834 . 2 2 20 20 VAL CA C 13 65.047 0.20 . 1 . . . . 20 Val CA . 17127 1 1835 . 2 2 20 20 VAL CB C 13 32.047 0.20 . 1 . . . . 20 Val CB . 17127 1 1836 . 2 2 20 20 VAL CG1 C 13 20.697 0.20 . 2 . . . . 20 Val CG1 . 17127 1 1837 . 2 2 20 20 VAL CG2 C 13 23.313 0.20 . 2 . . . . 20 Val CG2 . 17127 1 1838 . 2 2 20 20 VAL N N 15 117.673 0.05 . 1 . . . . 20 Val N . 17127 1 1839 . 2 2 21 21 CYS H H 1 8.439 0.05 . 1 . . . . 21 Cys H . 17127 1 1840 . 2 2 21 21 CYS HA H 1 4.779 0.05 . 1 . . . . 21 Cys HA . 17127 1 1841 . 2 2 21 21 CYS HB2 H 1 2.884 0.05 . 2 . . . . 21 Cys HB2 . 17127 1 1842 . 2 2 21 21 CYS HB3 H 1 3.348 0.05 . 2 . . . . 21 Cys HB3 . 17127 1 1843 . 2 2 21 21 CYS C C 13 177.684 0.20 . 1 . . . . 21 Cys C . 17127 1 1844 . 2 2 21 21 CYS CA C 13 53.385 0.20 . 1 . . . . 21 Cys CA . 17127 1 1845 . 2 2 21 21 CYS CB C 13 35.843 0.20 . 1 . . . . 21 Cys CB . 17127 1 1846 . 2 2 21 21 CYS N N 15 114.608 0.05 . 1 . . . . 21 Cys N . 17127 1 1847 . 2 2 22 22 GLY H H 1 7.838 0.05 . 1 . . . . 22 Gly H . 17127 1 1848 . 2 2 22 22 GLY C C 13 176.221 0.20 . 1 . . . . 22 Gly C . 17127 1 1849 . 2 2 22 22 GLY CA C 13 46.665 0.20 . 1 . . . . 22 Gly CA . 17127 1 1850 . 2 2 22 22 GLY N N 15 110.285 0.05 . 1 . . . . 22 Gly N . 17127 1 1851 . 2 2 23 23 ASP H H 1 9.287 0.05 . 1 . . . . 23 Asp H . 17127 1 1852 . 2 2 23 23 ASP HA H 1 4.681 0.05 . 1 . . . . 23 Asp HA . 17127 1 1853 . 2 2 23 23 ASP HB2 H 1 2.533 0.05 . 2 . . . . 23 Asp HB2 . 17127 1 1854 . 2 2 23 23 ASP HB3 H 1 2.943 0.05 . 2 . . . . 23 Asp HB3 . 17127 1 1855 . 2 2 23 23 ASP CA C 13 55.753 0.20 . 1 . . . . 23 Asp CA . 17127 1 1856 . 2 2 23 23 ASP CB C 13 40.775 0.20 . 1 . . . . 23 Asp CB . 17127 1 1857 . 2 2 23 23 ASP N N 15 126.341 0.05 . 1 . . . . 23 Asp N . 17127 1 1858 . 2 2 24 24 ARG H H 1 8.203 0.05 . 1 . . . . 24 Arg H . 17127 1 1859 . 2 2 24 24 ARG HA H 1 4.048 0.05 . 1 . . . . 24 Arg HA . 17127 1 1860 . 2 2 24 24 ARG HB2 H 1 2.163 0.05 . 1 . . . . 24 Arg HB2 . 17127 1 1861 . 2 2 24 24 ARG HB3 H 1 2.163 0.05 . 1 . . . . 24 Arg HB3 . 17127 1 1862 . 2 2 24 24 ARG HD2 H 1 3.368 0.05 . 2 . . . . 24 Arg HD2 . 17127 1 1863 . 2 2 24 24 ARG HD3 H 1 3.370 0.05 . 2 . . . . 24 Arg HD3 . 17127 1 1864 . 2 2 24 24 ARG HE H 1 6.944 0.05 . 1 . . . . 24 Arg HE . 17127 1 1865 . 2 2 24 24 ARG HG2 H 1 1.939 0.05 . 2 . . . . 24 Arg HG2 . 17127 1 1866 . 2 2 24 24 ARG HG3 H 1 1.731 0.05 . 2 . . . . 24 Arg HG3 . 17127 1 1867 . 2 2 24 24 ARG C C 13 178.412 0.20 . 1 . . . . 24 Arg C . 17127 1 1868 . 2 2 24 24 ARG CA C 13 58.065 0.20 . 1 . . . . 24 Arg CA . 17127 1 1869 . 2 2 24 24 ARG CB C 13 30.932 0.20 . 1 . . . . 24 Arg CB . 17127 1 1870 . 2 2 24 24 ARG CD C 13 44.571 0.20 . 1 . . . . 24 Arg CD . 17127 1 1871 . 2 2 24 24 ARG N N 15 118.199 0.05 . 1 . . . . 24 Arg N . 17127 1 1872 . 2 2 24 24 ARG NE N 15 83.887 0.05 . 1 . . . . 24 Arg NE . 17127 1 1873 . 2 2 25 25 GLY H H 1 7.179 0.05 . 1 . . . . 25 Gly H . 17127 1 1874 . 2 2 25 25 GLY HA2 H 1 3.727 0.05 . 2 . . . . 25 Gly HA2 . 17127 1 1875 . 2 2 25 25 GLY HA3 H 1 4.051 0.05 . 2 . . . . 25 Gly HA3 . 17127 1 1876 . 2 2 25 25 GLY C C 13 172.688 0.20 . 1 . . . . 25 Gly C . 17127 1 1877 . 2 2 25 25 GLY CA C 13 43.794 0.20 . 1 . . . . 25 Gly CA . 17127 1 1878 . 2 2 25 25 GLY N N 15 102.139 0.05 . 1 . . . . 25 Gly N . 17127 1 1879 . 2 2 26 26 PHE H H 1 7.493 0.05 . 1 . . . . 26 Phe H . 17127 1 1880 . 2 2 26 26 PHE HA H 1 5.242 0.05 . 1 . . . . 26 Phe HA . 17127 1 1881 . 2 2 26 26 PHE HB2 H 1 2.863 0.05 . 2 . . . . 26 Phe HB2 . 17127 1 1882 . 2 2 26 26 PHE HB3 H 1 3.336 0.05 . 2 . . . . 26 Phe HB3 . 17127 1 1883 . 2 2 26 26 PHE HD1 H 1 6.636 0.05 . 3 . . . . 26 Phe HD1 . 17127 1 1884 . 2 2 26 26 PHE HD2 H 1 6.636 0.05 . 3 . . . . 26 Phe HD2 . 17127 1 1885 . 2 2 26 26 PHE HE1 H 1 6.987 0.05 . 3 . . . . 26 Phe HE1 . 17127 1 1886 . 2 2 26 26 PHE HE2 H 1 6.987 0.05 . 3 . . . . 26 Phe HE2 . 17127 1 1887 . 2 2 26 26 PHE HZ H 1 7.228 0.05 . 1 . . . . 26 Phe HZ . 17127 1 1888 . 2 2 26 26 PHE C C 13 176.775 0.20 . 1 . . . . 26 Phe C . 17127 1 1889 . 2 2 26 26 PHE CA C 13 55.660 0.20 . 1 . . . . 26 Phe CA . 17127 1 1890 . 2 2 26 26 PHE CB C 13 41.969 0.20 . 1 . . . . 26 Phe CB . 17127 1 1891 . 2 2 26 26 PHE N N 15 112.531 0.05 . 1 . . . . 26 Phe N . 17127 1 1892 . 2 2 27 27 TYR H H 1 8.709 0.05 . 1 . . . . 27 Tyr H . 17127 1 1893 . 2 2 27 27 TYR HA H 1 4.951 0.05 . 1 . . . . 27 Tyr HA . 17127 1 1894 . 2 2 27 27 TYR HB2 H 1 3.464 0.05 . 2 . . . . 27 Tyr HB2 . 17127 1 1895 . 2 2 27 27 TYR HB3 H 1 2.978 0.05 . 2 . . . . 27 Tyr HB3 . 17127 1 1896 . 2 2 27 27 TYR HD1 H 1 7.134 0.05 . 3 . . . . 27 Tyr HD1 . 17127 1 1897 . 2 2 27 27 TYR HD2 H 1 7.134 0.05 . 3 . . . . 27 Tyr HD2 . 17127 1 1898 . 2 2 27 27 TYR HE1 H 1 6.805 0.05 . 3 . . . . 27 Tyr HE1 . 17127 1 1899 . 2 2 27 27 TYR HE2 H 1 6.805 0.05 . 3 . . . . 27 Tyr HE2 . 17127 1 1900 . 2 2 27 27 TYR C C 13 174.819 0.20 . 1 . . . . 27 Tyr C . 17127 1 1901 . 2 2 27 27 TYR CA C 13 55.095 0.20 . 1 . . . . 27 Tyr CA . 17127 1 1902 . 2 2 27 27 TYR CB C 13 41.061 0.20 . 1 . . . . 27 Tyr CB . 17127 1 1903 . 2 2 27 27 TYR N N 15 118.464 0.05 . 1 . . . . 27 Tyr N . 17127 1 1904 . 2 2 28 28 PHE H H 1 8.800 0.05 . 1 . . . . 28 Phe H . 17127 1 1905 . 2 2 28 28 PHE HA H 1 4.845 0.05 . 1 . . . . 28 Phe HA . 17127 1 1906 . 2 2 28 28 PHE HB2 H 1 3.338 0.05 . 2 . . . . 28 Phe HB2 . 17127 1 1907 . 2 2 28 28 PHE HB3 H 1 3.107 0.05 . 2 . . . . 28 Phe HB3 . 17127 1 1908 . 2 2 28 28 PHE HD1 H 1 7.295 0.05 . 3 . . . . 28 Phe HD1 . 17127 1 1909 . 2 2 28 28 PHE HD2 H 1 7.295 0.05 . 3 . . . . 28 Phe HD2 . 17127 1 1910 . 2 2 28 28 PHE HE1 H 1 6.981 0.05 . 3 . . . . 28 Phe HE1 . 17127 1 1911 . 2 2 28 28 PHE HE2 H 1 6.981 0.05 . 3 . . . . 28 Phe HE2 . 17127 1 1912 . 2 2 28 28 PHE C C 13 177.586 0.20 . 1 . . . . 28 Phe C . 17127 1 1913 . 2 2 28 28 PHE CA C 13 58.374 0.20 . 1 . . . . 28 Phe CA . 17127 1 1914 . 2 2 28 28 PHE CB C 13 39.767 0.20 . 1 . . . . 28 Phe CB . 17127 1 1915 . 2 2 28 28 PHE N N 15 115.456 0.05 . 1 . . . . 28 Phe N . 17127 1 1916 . 2 2 29 29 SER H H 1 8.046 0.05 . 1 . . . . 29 Ser H . 17127 1 1917 . 2 2 29 29 SER HA H 1 5.087 0.05 . 1 . . . . 29 Ser HA . 17127 1 1918 . 2 2 29 29 SER HB2 H 1 3.892 0.05 . 1 . . . . 29 Ser HB2 . 17127 1 1919 . 2 2 29 29 SER HB3 H 1 3.892 0.05 . 1 . . . . 29 Ser HB3 . 17127 1 1920 . 2 2 29 29 SER C C 13 178.151 0.20 . 1 . . . . 29 Ser C . 17127 1 1921 . 2 2 29 29 SER CA C 13 57.506 0.20 . 1 . . . . 29 Ser CA . 17127 1 1922 . 2 2 29 29 SER CB C 13 63.601 0.20 . 1 . . . . 29 Ser CB . 17127 1 1923 . 2 2 29 29 SER N N 15 113.540 0.05 . 1 . . . . 29 Ser N . 17127 1 1924 . 2 2 30 30 ARG H H 1 8.606 0.05 . 1 . . . . 30 Arg H . 17127 1 1925 . 2 2 30 30 ARG HA H 1 4.348 0.05 . 1 . . . . 30 Arg HA . 17127 1 1926 . 2 2 30 30 ARG HB2 H 1 1.740 0.05 . 2 . . . . 30 Arg HB2 . 17127 1 1927 . 2 2 30 30 ARG HB3 H 1 1.573 0.05 . 2 . . . . 30 Arg HB3 . 17127 1 1928 . 2 2 30 30 ARG HD2 H 1 2.868 0.05 . 2 . . . . 30 Arg HD2 . 17127 1 1929 . 2 2 30 30 ARG HD3 H 1 2.863 0.05 . 2 . . . . 30 Arg HD3 . 17127 1 1930 . 2 2 30 30 ARG HE H 1 6.785 0.05 . 1 . . . . 30 Arg HE . 17127 1 1931 . 2 2 30 30 ARG HG2 H 1 1.386 0.05 . 2 . . . . 30 Arg HG2 . 17127 1 1932 . 2 2 30 30 ARG HG3 H 1 1.396 0.05 . 2 . . . . 30 Arg HG3 . 17127 1 1933 . 2 2 30 30 ARG CA C 13 57.083 0.20 . 1 . . . . 30 Arg CA . 17127 1 1934 . 2 2 30 30 ARG CB C 13 30.087 0.20 . 1 . . . . 30 Arg CB . 17127 1 1935 . 2 2 30 30 ARG CD C 13 43.315 0.20 . 1 . . . . 30 Arg CD . 17127 1 1936 . 2 2 30 30 ARG CG C 13 26.026 0.20 . 1 . . . . 30 Arg CG . 17127 1 1937 . 2 2 30 30 ARG N N 15 122.310 0.05 . 1 . . . . 30 Arg N . 17127 1 1938 . 2 2 30 30 ARG NE N 15 84.269 0.05 . 1 . . . . 30 Arg NE . 17127 1 1939 . 2 2 31 31 PRO HB2 H 1 1.914 0.05 . 2 . . . . 31 Pro HB2 . 17127 1 1940 . 2 2 31 31 PRO HB3 H 1 2.122 0.05 . 2 . . . . 31 Pro HB3 . 17127 1 1941 . 2 2 31 31 PRO HD2 H 1 3.437 0.05 . 2 . . . . 31 Pro HD2 . 17127 1 1942 . 2 2 31 31 PRO HD3 H 1 3.500 0.05 . 2 . . . . 31 Pro HD3 . 17127 1 1943 . 2 2 31 31 PRO HG2 H 1 1.799 0.05 . 1 . . . . 31 Pro HG2 . 17127 1 1944 . 2 2 31 31 PRO HG3 H 1 1.799 0.05 . 1 . . . . 31 Pro HG3 . 17127 1 1945 . 2 2 31 31 PRO C C 13 174.822 0.20 . 1 . . . . 31 Pro C . 17127 1 1946 . 2 2 31 31 PRO CA C 13 62.626 0.20 . 1 . . . . 31 Pro CA . 17127 1 1947 . 2 2 31 31 PRO CB C 13 31.658 0.20 . 1 . . . . 31 Pro CB . 17127 1 1948 . 2 2 31 31 PRO CD C 13 49.880 0.20 . 1 . . . . 31 Pro CD . 17127 1 1949 . 2 2 31 31 PRO CG C 13 26.881 0.20 . 1 . . . . 31 Pro CG . 17127 1 1950 . 2 2 32 32 ALA H H 1 8.350 0.05 . 1 . . . . 32 Ala H . 17127 1 1951 . 2 2 32 32 ALA HA H 1 4.194 0.05 . 1 . . . . 32 Ala HA . 17127 1 1952 . 2 2 32 32 ALA HB1 H 1 1.362 0.05 . 1 . . . . 32 Ala HB1 . 17127 1 1953 . 2 2 32 32 ALA HB2 H 1 1.362 0.05 . 1 . . . . 32 Ala HB2 . 17127 1 1954 . 2 2 32 32 ALA HB3 H 1 1.362 0.05 . 1 . . . . 32 Ala HB3 . 17127 1 1955 . 2 2 32 32 ALA C C 13 177.921 0.20 . 1 . . . . 32 Ala C . 17127 1 1956 . 2 2 32 32 ALA CA C 13 52.466 0.20 . 1 . . . . 32 Ala CA . 17127 1 1957 . 2 2 32 32 ALA CB C 13 19.112 0.20 . 1 . . . . 32 Ala CB . 17127 1 1958 . 2 2 32 32 ALA N N 15 123.674 0.05 . 1 . . . . 32 Ala N . 17127 1 1959 . 2 2 33 33 SER H H 1 8.184 0.05 . 1 . . . . 33 Ser H . 17127 1 1960 . 2 2 33 33 SER HA H 1 4.522 0.05 . 1 . . . . 33 Ser HA . 17127 1 1961 . 2 2 33 33 SER HB2 H 1 3.836 0.05 . 2 . . . . 33 Ser HB2 . 17127 1 1962 . 2 2 33 33 SER HB3 H 1 4.005 0.05 . 2 . . . . 33 Ser HB3 . 17127 1 1963 . 2 2 33 33 SER C C 13 175.040 0.20 . 1 . . . . 33 Ser C . 17127 1 1964 . 2 2 33 33 SER CA C 13 57.382 0.20 . 1 . . . . 33 Ser CA . 17127 1 1965 . 2 2 33 33 SER CB C 13 64.035 0.20 . 1 . . . . 33 Ser CB . 17127 1 1966 . 2 2 33 33 SER N N 15 113.859 0.05 . 1 . . . . 33 Ser N . 17127 1 1967 . 2 2 34 34 ARG H H 1 8.365 0.05 . 1 . . . . 34 Arg H . 17127 1 1968 . 2 2 34 34 ARG HA H 1 4.260 0.05 . 1 . . . . 34 Arg HA . 17127 1 1969 . 2 2 34 34 ARG HB2 H 1 1.853 0.05 . 1 . . . . 34 Arg HB2 . 17127 1 1970 . 2 2 34 34 ARG HB3 H 1 1.853 0.05 . 1 . . . . 34 Arg HB3 . 17127 1 1971 . 2 2 34 34 ARG HD2 H 1 3.195 0.05 . 1 . . . . 34 Arg HD2 . 17127 1 1972 . 2 2 34 34 ARG HD3 H 1 3.195 0.05 . 1 . . . . 34 Arg HD3 . 17127 1 1973 . 2 2 34 34 ARG HE H 1 7.217 0.05 . 1 . . . . 34 Arg HE . 17127 1 1974 . 2 2 34 34 ARG HG2 H 1 1.648 0.05 . 1 . . . . 34 Arg HG2 . 17127 1 1975 . 2 2 34 34 ARG HG3 H 1 1.648 0.05 . 1 . . . . 34 Arg HG3 . 17127 1 1976 . 2 2 34 34 ARG C C 13 177.106 0.20 . 1 . . . . 34 Arg C . 17127 1 1977 . 2 2 34 34 ARG CA C 13 56.836 0.20 . 1 . . . . 34 Arg CA . 17127 1 1978 . 2 2 34 34 ARG CB C 13 29.939 0.20 . 1 . . . . 34 Arg CB . 17127 1 1979 . 2 2 34 34 ARG CD C 13 42.905 0.20 . 1 . . . . 34 Arg CD . 17127 1 1980 . 2 2 34 34 ARG CG C 13 26.921 0.20 . 1 . . . . 34 Arg CG . 17127 1 1981 . 2 2 34 34 ARG N N 15 120.616 0.05 . 1 . . . . 34 Arg N . 17127 1 1982 . 2 2 34 34 ARG NE N 15 84.838 0.05 . 1 . . . . 34 Arg NE . 17127 1 1983 . 2 2 35 35 VAL H H 1 7.806 0.05 . 1 . . . . 35 Val H . 17127 1 1984 . 2 2 35 35 VAL HA H 1 4.179 0.05 . 1 . . . . 35 Val HA . 17127 1 1985 . 2 2 35 35 VAL HB H 1 2.149 0.05 . 1 . . . . 35 Val HB . 17127 1 1986 . 2 2 35 35 VAL HG11 H 1 0.893 0.05 . 2 . . . . 35 Val HG11 . 17127 1 1987 . 2 2 35 35 VAL HG12 H 1 0.893 0.05 . 2 . . . . 35 Val HG12 . 17127 1 1988 . 2 2 35 35 VAL HG13 H 1 0.893 0.05 . 2 . . . . 35 Val HG13 . 17127 1 1989 . 2 2 35 35 VAL HG21 H 1 0.888 0.05 . 2 . . . . 35 Val HG21 . 17127 1 1990 . 2 2 35 35 VAL HG22 H 1 0.888 0.05 . 2 . . . . 35 Val HG22 . 17127 1 1991 . 2 2 35 35 VAL HG23 H 1 0.888 0.05 . 2 . . . . 35 Val HG23 . 17127 1 1992 . 2 2 35 35 VAL C C 13 176.450 0.20 . 1 . . . . 35 Val C . 17127 1 1993 . 2 2 35 35 VAL CA C 13 61.842 0.20 . 1 . . . . 35 Val CA . 17127 1 1994 . 2 2 35 35 VAL CB C 13 32.020 0.20 . 1 . . . . 35 Val CB . 17127 1 1995 . 2 2 35 35 VAL CG1 C 13 20.729 0.20 . 2 . . . . 35 Val CG1 . 17127 1 1996 . 2 2 35 35 VAL CG2 C 13 19.692 0.20 . 2 . . . . 35 Val CG2 . 17127 1 1997 . 2 2 35 35 VAL N N 15 115.603 0.05 . 1 . . . . 35 Val N . 17127 1 1998 . 2 2 36 36 SER H H 1 7.869 0.05 . 1 . . . . 36 Ser H . 17127 1 1999 . 2 2 36 36 SER HA H 1 4.489 0.05 . 1 . . . . 36 Ser HA . 17127 1 2000 . 2 2 36 36 SER HB2 H 1 3.871 0.05 . 2 . . . . 36 Ser HB2 . 17127 1 2001 . 2 2 36 36 SER HB3 H 1 3.835 0.05 . 2 . . . . 36 Ser HB3 . 17127 1 2002 . 2 2 36 36 SER C C 13 174.933 0.20 . 1 . . . . 36 Ser C . 17127 1 2003 . 2 2 36 36 SER CA C 13 57.602 0.20 . 1 . . . . 36 Ser CA . 17127 1 2004 . 2 2 36 36 SER CB C 13 63.635 0.20 . 1 . . . . 36 Ser CB . 17127 1 2005 . 2 2 36 36 SER N N 15 117.127 0.05 . 1 . . . . 36 Ser N . 17127 1 2006 . 2 2 37 37 ARG H H 1 8.307 0.05 . 1 . . . . 37 Arg H . 17127 1 2007 . 2 2 37 37 ARG HA H 1 4.320 0.05 . 1 . . . . 37 Arg HA . 17127 1 2008 . 2 2 37 37 ARG HB2 H 1 1.895 0.05 . 1 . . . . 37 Arg HB2 . 17127 1 2009 . 2 2 37 37 ARG HB3 H 1 1.895 0.05 . 1 . . . . 37 Arg HB3 . 17127 1 2010 . 2 2 37 37 ARG HD2 H 1 3.195 0.05 . 1 . . . . 37 Arg HD2 . 17127 1 2011 . 2 2 37 37 ARG HD3 H 1 3.195 0.05 . 1 . . . . 37 Arg HD3 . 17127 1 2012 . 2 2 37 37 ARG HE H 1 7.180 0.05 . 1 . . . . 37 Arg HE . 17127 1 2013 . 2 2 37 37 ARG HG2 H 1 1.631 0.05 . 2 . . . . 37 Arg HG2 . 17127 1 2014 . 2 2 37 37 ARG HG3 H 1 1.633 0.05 . 2 . . . . 37 Arg HG3 . 17127 1 2015 . 2 2 37 37 ARG C C 13 176.505 0.20 . 1 . . . . 37 Arg C . 17127 1 2016 . 2 2 37 37 ARG CA C 13 56.152 0.20 . 1 . . . . 37 Arg CA . 17127 1 2017 . 2 2 37 37 ARG CB C 13 29.971 0.20 . 1 . . . . 37 Arg CB . 17127 1 2018 . 2 2 37 37 ARG CD C 13 42.885 0.20 . 1 . . . . 37 Arg CD . 17127 1 2019 . 2 2 37 37 ARG CG C 13 26.779 0.20 . 1 . . . . 37 Arg CG . 17127 1 2020 . 2 2 37 37 ARG N N 15 122.005 0.05 . 1 . . . . 37 Arg N . 17127 1 2021 . 2 2 37 37 ARG NE N 15 84.852 0.05 . 1 . . . . 37 Arg NE . 17127 1 2022 . 2 2 38 38 ARG H H 1 8.130 0.05 . 1 . . . . 38 Arg H . 17127 1 2023 . 2 2 38 38 ARG HA H 1 4.390 0.05 . 1 . . . . 38 Arg HA . 17127 1 2024 . 2 2 38 38 ARG HB2 H 1 1.743 0.05 . 2 . . . . 38 Arg HB2 . 17127 1 2025 . 2 2 38 38 ARG HB3 H 1 1.847 0.05 . 2 . . . . 38 Arg HB3 . 17127 1 2026 . 2 2 38 38 ARG HD2 H 1 3.187 0.05 . 1 . . . . 38 Arg HD2 . 17127 1 2027 . 2 2 38 38 ARG HD3 H 1 3.187 0.05 . 1 . . . . 38 Arg HD3 . 17127 1 2028 . 2 2 38 38 ARG HE H 1 7.170 0.05 . 1 . . . . 38 Arg HE . 17127 1 2029 . 2 2 38 38 ARG HG2 H 1 1.628 0.05 . 1 . . . . 38 Arg HG2 . 17127 1 2030 . 2 2 38 38 ARG HG3 H 1 1.628 0.05 . 1 . . . . 38 Arg HG3 . 17127 1 2031 . 2 2 38 38 ARG CA C 13 55.553 0.20 . 1 . . . . 38 Arg CA . 17127 1 2032 . 2 2 38 38 ARG CB C 13 30.511 0.20 . 1 . . . . 38 Arg CB . 17127 1 2033 . 2 2 38 38 ARG CD C 13 43.322 0.20 . 1 . . . . 38 Arg CD . 17127 1 2034 . 2 2 38 38 ARG CG C 13 26.947 0.20 . 1 . . . . 38 Arg CG . 17127 1 2035 . 2 2 38 38 ARG N N 15 119.930 0.05 . 1 . . . . 38 Arg N . 17127 1 2036 . 2 2 38 38 ARG NE N 15 84.659 0.05 . 1 . . . . 38 Arg NE . 17127 1 2037 . 2 2 39 39 SER H H 1 8.344 0.05 . 1 . . . . 39 Ser H . 17127 1 2038 . 2 2 39 39 SER HA H 1 4.537 0.05 . 1 . . . . 39 Ser HA . 17127 1 2039 . 2 2 39 39 SER HB2 H 1 3.857 0.05 . 1 . . . . 39 Ser HB2 . 17127 1 2040 . 2 2 39 39 SER HB3 H 1 3.857 0.05 . 1 . . . . 39 Ser HB3 . 17127 1 2041 . 2 2 39 39 SER C C 13 174.531 0.20 . 1 . . . . 39 Ser C . 17127 1 2042 . 2 2 39 39 SER CA C 13 57.813 0.20 . 1 . . . . 39 Ser CA . 17127 1 2043 . 2 2 39 39 SER CB C 13 63.871 0.20 . 1 . . . . 39 Ser CB . 17127 1 2044 . 2 2 39 39 SER N N 15 119.264 0.05 . 1 . . . . 39 Ser N . 17127 1 2045 . 2 2 40 40 ARG H H 1 8.598 0.05 . 1 . . . . 40 Arg H . 17127 1 2046 . 2 2 40 40 ARG HA H 1 4.585 0.05 . 1 . . . . 40 Arg HA . 17127 1 2047 . 2 2 40 40 ARG HB2 H 1 1.903 0.05 . 2 . . . . 40 Arg HB2 . 17127 1 2048 . 2 2 40 40 ARG HB3 H 1 1.722 0.05 . 2 . . . . 40 Arg HB3 . 17127 1 2049 . 2 2 40 40 ARG HD2 H 1 3.147 0.05 . 1 . . . . 40 Arg HD2 . 17127 1 2050 . 2 2 40 40 ARG HD3 H 1 3.147 0.05 . 1 . . . . 40 Arg HD3 . 17127 1 2051 . 2 2 40 40 ARG HE H 1 7.415 0.05 . 1 . . . . 40 Arg HE . 17127 1 2052 . 2 2 40 40 ARG HG2 H 1 1.662 0.05 . 1 . . . . 40 Arg HG2 . 17127 1 2053 . 2 2 40 40 ARG HG3 H 1 1.662 0.05 . 1 . . . . 40 Arg HG3 . 17127 1 2054 . 2 2 40 40 ARG C C 13 176.774 0.20 . 1 . . . . 40 Arg C . 17127 1 2055 . 2 2 40 40 ARG CA C 13 55.238 0.20 . 1 . . . . 40 Arg CA . 17127 1 2056 . 2 2 40 40 ARG CB C 13 31.606 0.20 . 1 . . . . 40 Arg CB . 17127 1 2057 . 2 2 40 40 ARG CD C 13 43.021 0.20 . 1 . . . . 40 Arg CD . 17127 1 2058 . 2 2 40 40 ARG CG C 13 26.791 0.20 . 1 . . . . 40 Arg CG . 17127 1 2059 . 2 2 40 40 ARG N N 15 122.442 0.05 . 1 . . . . 40 Arg N . 17127 1 2060 . 2 2 40 40 ARG NE N 15 84.880 0.05 . 1 . . . . 40 Arg NE . 17127 1 2061 . 2 2 41 41 GLY H H 1 8.543 0.05 . 1 . . . . 41 Gly H . 17127 1 2062 . 2 2 41 41 GLY HA2 H 1 4.191 0.05 . 1 . . . . 41 Gly HA2 . 17127 1 2063 . 2 2 41 41 GLY HA3 H 1 4.191 0.05 . 1 . . . . 41 Gly HA3 . 17127 1 2064 . 2 2 41 41 GLY C C 13 174.229 0.20 . 1 . . . . 41 Gly C . 17127 1 2065 . 2 2 41 41 GLY CA C 13 44.839 0.20 . 1 . . . . 41 Gly CA . 17127 1 2066 . 2 2 41 41 GLY N N 15 111.116 0.05 . 1 . . . . 41 Gly N . 17127 1 2067 . 2 2 42 42 ILE H H 1 7.898 0.05 . 1 . . . . 42 Ile H . 17127 1 2068 . 2 2 42 42 ILE HA H 1 3.579 0.05 . 1 . . . . 42 Ile HA . 17127 1 2069 . 2 2 42 42 ILE HG12 H 1 0.790 0.05 . 2 . . . . 42 Ile HG12 . 17127 1 2070 . 2 2 42 42 ILE HG13 H 1 0.941 0.05 . 2 . . . . 42 Ile HG13 . 17127 1 2071 . 2 2 42 42 ILE CB C 13 38.528 0.20 . 1 . . . . 42 Ile CB . 17127 1 2072 . 2 2 42 42 ILE CG1 C 13 29.448 0.20 . 1 . . . . 42 Ile CG1 . 17127 1 2073 . 2 2 42 42 ILE N N 15 119.947 0.05 . 1 . . . . 42 Ile N . 17127 1 2074 . 2 2 43 43 VAL H H 1 8.197 0.05 . 1 . . . . 43 Val H . 17127 1 2075 . 2 2 43 43 VAL HA H 1 3.378 0.05 . 1 . . . . 43 Val HA . 17127 1 2076 . 2 2 43 43 VAL HB H 1 1.857 0.05 . 1 . . . . 43 Val HB . 17127 1 2077 . 2 2 43 43 VAL HG11 H 1 0.916 0.05 . 2 . . . . 43 Val HG11 . 17127 1 2078 . 2 2 43 43 VAL HG12 H 1 0.916 0.05 . 2 . . . . 43 Val HG12 . 17127 1 2079 . 2 2 43 43 VAL HG13 H 1 0.916 0.05 . 2 . . . . 43 Val HG13 . 17127 1 2080 . 2 2 43 43 VAL HG21 H 1 0.557 0.05 . 2 . . . . 43 Val HG21 . 17127 1 2081 . 2 2 43 43 VAL HG22 H 1 0.557 0.05 . 2 . . . . 43 Val HG22 . 17127 1 2082 . 2 2 43 43 VAL HG23 H 1 0.557 0.05 . 2 . . . . 43 Val HG23 . 17127 1 2083 . 2 2 43 43 VAL CA C 13 66.140 0.20 . 1 . . . . 43 Val CA . 17127 1 2084 . 2 2 43 43 VAL CB C 13 30.820 0.20 . 1 . . . . 43 Val CB . 17127 1 2085 . 2 2 43 43 VAL CG1 C 13 22.495 0.20 . 2 . . . . 43 Val CG1 . 17127 1 2086 . 2 2 43 43 VAL CG2 C 13 20.993 0.20 . 2 . . . . 43 Val CG2 . 17127 1 2087 . 2 2 43 43 VAL N N 15 123.833 0.05 . 1 . . . . 43 Val N . 17127 1 2088 . 2 2 44 44 GLU H H 1 8.016 0.05 . 1 . . . . 44 Glu H . 17127 1 2089 . 2 2 44 44 GLU HA H 1 3.876 0.05 . 1 . . . . 44 Glu HA . 17127 1 2090 . 2 2 44 44 GLU HB2 H 1 2.256 0.05 . 2 . . . . 44 Glu HB2 . 17127 1 2091 . 2 2 44 44 GLU HB3 H 1 2.054 0.05 . 2 . . . . 44 Glu HB3 . 17127 1 2092 . 2 2 44 44 GLU HG2 H 1 2.319 0.05 . 2 . . . . 44 Glu HG2 . 17127 1 2093 . 2 2 44 44 GLU HG3 H 1 2.435 0.05 . 2 . . . . 44 Glu HG3 . 17127 1 2094 . 2 2 44 44 GLU CA C 13 59.590 0.20 . 1 . . . . 44 Glu CA . 17127 1 2095 . 2 2 44 44 GLU CB C 13 28.503 0.20 . 1 . . . . 44 Glu CB . 17127 1 2096 . 2 2 44 44 GLU CG C 13 36.159 0.20 . 1 . . . . 44 Glu CG . 17127 1 2097 . 2 2 44 44 GLU N N 15 121.254 0.05 . 1 . . . . 44 Glu N . 17127 1 2098 . 2 2 45 45 GLU H H 1 7.461 0.05 . 1 . . . . 45 Glu H . 17127 1 2099 . 2 2 45 45 GLU CA C 13 58.116 0.20 . 1 . . . . 45 Glu CA . 17127 1 2100 . 2 2 45 45 GLU N N 15 113.236 0.05 . 1 . . . . 45 Glu N . 17127 1 2101 . 2 2 46 46 CYS H H 1 8.068 0.05 . 1 . . . . 46 Cys H . 17127 1 2102 . 2 2 46 46 CYS N N 15 109.649 0.05 . 1 . . . . 46 Cys N . 17127 1 2103 . 2 2 47 47 CYS H H 1 8.155 0.05 . 1 . . . . 47 Cys H . 17127 1 2104 . 2 2 47 47 CYS C C 13 175.466 0.20 . 1 . . . . 47 Cys C . 17127 1 2105 . 2 2 47 47 CYS N N 15 117.177 0.05 . 1 . . . . 47 Cys N . 17127 1 2106 . 2 2 48 48 PHE H H 1 7.758 0.05 . 1 . . . . 48 Phe H . 17127 1 2107 . 2 2 48 48 PHE HA H 1 4.659 0.05 . 1 . . . . 48 Phe HA . 17127 1 2108 . 2 2 48 48 PHE HB2 H 1 3.234 0.05 . 2 . . . . 48 Phe HB2 . 17127 1 2109 . 2 2 48 48 PHE HB3 H 1 3.468 0.05 . 2 . . . . 48 Phe HB3 . 17127 1 2110 . 2 2 48 48 PHE HD1 H 1 7.191 0.05 . 3 . . . . 48 Phe HD1 . 17127 1 2111 . 2 2 48 48 PHE HD2 H 1 7.191 0.05 . 3 . . . . 48 Phe HD2 . 17127 1 2112 . 2 2 48 48 PHE HE1 H 1 7.322 0.05 . 3 . . . . 48 Phe HE1 . 17127 1 2113 . 2 2 48 48 PHE HE2 H 1 7.322 0.05 . 3 . . . . 48 Phe HE2 . 17127 1 2114 . 2 2 48 48 PHE C C 13 176.249 0.20 . 1 . . . . 48 Phe C . 17127 1 2115 . 2 2 48 48 PHE CA C 13 56.683 0.20 . 1 . . . . 48 Phe CA . 17127 1 2116 . 2 2 48 48 PHE CB C 13 37.445 0.20 . 1 . . . . 48 Phe CB . 17127 1 2117 . 2 2 48 48 PHE N N 15 116.622 0.05 . 1 . . . . 48 Phe N . 17127 1 2118 . 2 2 49 49 ARG H H 1 7.427 0.05 . 1 . . . . 49 Arg H . 17127 1 2119 . 2 2 49 49 ARG HA H 1 4.388 0.05 . 1 . . . . 49 Arg HA . 17127 1 2120 . 2 2 49 49 ARG HB2 H 1 1.820 0.05 . 2 . . . . 49 Arg HB2 . 17127 1 2121 . 2 2 49 49 ARG HB3 H 1 1.936 0.05 . 2 . . . . 49 Arg HB3 . 17127 1 2122 . 2 2 49 49 ARG HD2 H 1 3.238 0.05 . 1 . . . . 49 Arg HD2 . 17127 1 2123 . 2 2 49 49 ARG HD3 H 1 3.238 0.05 . 1 . . . . 49 Arg HD3 . 17127 1 2124 . 2 2 49 49 ARG HE H 1 7.278 0.05 . 1 . . . . 49 Arg HE . 17127 1 2125 . 2 2 49 49 ARG HG2 H 1 1.656 0.05 . 1 . . . . 49 Arg HG2 . 17127 1 2126 . 2 2 49 49 ARG HG3 H 1 1.656 0.05 . 1 . . . . 49 Arg HG3 . 17127 1 2127 . 2 2 49 49 ARG C C 13 172.934 0.20 . 1 . . . . 49 Arg C . 17127 1 2128 . 2 2 49 49 ARG CA C 13 53.943 0.20 . 1 . . . . 49 Arg CA . 17127 1 2129 . 2 2 49 49 ARG CB C 13 32.227 0.20 . 1 . . . . 49 Arg CB . 17127 1 2130 . 2 2 49 49 ARG CD C 13 43.445 0.20 . 1 . . . . 49 Arg CD . 17127 1 2131 . 2 2 49 49 ARG CG C 13 26.479 0.20 . 1 . . . . 49 Arg CG . 17127 1 2132 . 2 2 49 49 ARG N N 15 117.774 0.05 . 1 . . . . 49 Arg N . 17127 1 2133 . 2 2 49 49 ARG NE N 15 85.698 0.05 . 1 . . . . 49 Arg NE . 17127 1 2134 . 2 2 50 50 SER H H 1 7.679 0.05 . 1 . . . . 50 Ser H . 17127 1 2135 . 2 2 50 50 SER HA H 1 4.426 0.05 . 1 . . . . 50 Ser HA . 17127 1 2136 . 2 2 50 50 SER HB2 H 1 3.820 0.05 . 1 . . . . 50 Ser HB2 . 17127 1 2137 . 2 2 50 50 SER HB3 H 1 3.820 0.05 . 1 . . . . 50 Ser HB3 . 17127 1 2138 . 2 2 50 50 SER C C 13 174.973 0.20 . 1 . . . . 50 Ser C . 17127 1 2139 . 2 2 50 50 SER CA C 13 57.699 0.20 . 1 . . . . 50 Ser CA . 17127 1 2140 . 2 2 50 50 SER CB C 13 64.160 0.20 . 1 . . . . 50 Ser CB . 17127 1 2141 . 2 2 50 50 SER N N 15 110.671 0.05 . 1 . . . . 50 Ser N . 17127 1 2142 . 2 2 51 51 CYS H H 1 9.560 0.05 . 1 . . . . 51 Cys H . 17127 1 2143 . 2 2 51 51 CYS HA H 1 5.213 0.05 . 1 . . . . 51 Cys HA . 17127 1 2144 . 2 2 51 51 CYS HB2 H 1 3.331 0.05 . 2 . . . . 51 Cys HB2 . 17127 1 2145 . 2 2 51 51 CYS HB3 H 1 3.668 0.05 . 2 . . . . 51 Cys HB3 . 17127 1 2146 . 2 2 51 51 CYS C C 13 171.677 0.20 . 1 . . . . 51 Cys C . 17127 1 2147 . 2 2 51 51 CYS CA C 13 52.749 0.20 . 1 . . . . 51 Cys CA . 17127 1 2148 . 2 2 51 51 CYS CB C 13 47.081 0.20 . 1 . . . . 51 Cys CB . 17127 1 2149 . 2 2 51 51 CYS N N 15 120.399 0.05 . 1 . . . . 51 Cys N . 17127 1 2150 . 2 2 52 52 ASP H H 1 7.401 0.05 . 1 . . . . 52 Asp H . 17127 1 2151 . 2 2 52 52 ASP HA H 1 4.795 0.05 . 1 . . . . 52 Asp HA . 17127 1 2152 . 2 2 52 52 ASP HB2 H 1 3.158 0.05 . 1 . . . . 52 Asp HB2 . 17127 1 2153 . 2 2 52 52 ASP HB3 H 1 3.158 0.05 . 1 . . . . 52 Asp HB3 . 17127 1 2154 . 2 2 52 52 ASP CA C 13 50.834 0.20 . 1 . . . . 52 Asp CA . 17127 1 2155 . 2 2 52 52 ASP CB C 13 42.321 0.20 . 1 . . . . 52 Asp CB . 17127 1 2156 . 2 2 52 52 ASP N N 15 115.644 0.05 . 1 . . . . 52 Asp N . 17127 1 2157 . 2 2 54 54 ALA H H 1 8.361 0.05 . 1 . . . . 54 Ala H . 17127 1 2158 . 2 2 54 54 ALA HA H 1 3.950 0.05 . 1 . . . . 54 Ala HA . 17127 1 2159 . 2 2 54 54 ALA HB1 H 1 1.398 0.05 . 1 . . . . 54 Ala HB1 . 17127 1 2160 . 2 2 54 54 ALA HB2 H 1 1.398 0.05 . 1 . . . . 54 Ala HB2 . 17127 1 2161 . 2 2 54 54 ALA HB3 H 1 1.398 0.05 . 1 . . . . 54 Ala HB3 . 17127 1 2162 . 2 2 54 54 ALA CA C 13 54.758 0.20 . 1 . . . . 54 Ala CA . 17127 1 2163 . 2 2 54 54 ALA CB C 13 17.082 0.20 . 1 . . . . 54 Ala CB . 17127 1 2164 . 2 2 54 54 ALA N N 15 120.271 0.05 . 1 . . . . 54 Ala N . 17127 1 2165 . 2 2 55 55 LEU H H 1 7.885 0.05 . 1 . . . . 55 Leu H . 17127 1 2166 . 2 2 55 55 LEU C C 13 180.407 0.20 . 1 . . . . 55 Leu C . 17127 1 2167 . 2 2 55 55 LEU CA C 13 57.519 0.20 . 1 . . . . 55 Leu CA . 17127 1 2168 . 2 2 55 55 LEU N N 15 120.414 0.05 . 1 . . . . 55 Leu N . 17127 1 2169 . 2 2 57 57 GLU C C 13 179.275 0.20 . 1 . . . . 57 Glu C . 17127 1 2170 . 2 2 58 58 THR H H 1 7.935 0.05 . 1 . . . . 58 Thr H . 17127 1 2171 . 2 2 58 58 THR HA H 1 4.296 0.05 . 1 . . . . 58 Thr HA . 17127 1 2172 . 2 2 58 58 THR HB H 1 4.073 0.05 . 1 . . . . 58 Thr HB . 17127 1 2173 . 2 2 58 58 THR HG21 H 1 1.489 0.05 . 1 . . . . 58 Thr HG21 . 17127 1 2174 . 2 2 58 58 THR HG22 H 1 1.489 0.05 . 1 . . . . 58 Thr HG22 . 17127 1 2175 . 2 2 58 58 THR HG23 H 1 1.489 0.05 . 1 . . . . 58 Thr HG23 . 17127 1 2176 . 2 2 58 58 THR CA C 13 63.784 0.20 . 1 . . . . 58 Thr CA . 17127 1 2177 . 2 2 58 58 THR CB C 13 70.595 0.20 . 1 . . . . 58 Thr CB . 17127 1 2178 . 2 2 58 58 THR CG2 C 13 21.174 0.20 . 1 . . . . 58 Thr CG2 . 17127 1 2179 . 2 2 58 58 THR N N 15 110.523 0.05 . 1 . . . . 58 Thr N . 17127 1 2180 . 2 2 59 59 TYR H H 1 8.190 0.05 . 1 . . . . 59 Tyr H . 17127 1 2181 . 2 2 59 59 TYR HA H 1 4.276 0.05 . 1 . . . . 59 Tyr HA . 17127 1 2182 . 2 2 59 59 TYR HB2 H 1 3.030 0.05 . 2 . . . . 59 Tyr HB2 . 17127 1 2183 . 2 2 59 59 TYR HB3 H 1 3.875 0.05 . 2 . . . . 59 Tyr HB3 . 17127 1 2184 . 2 2 59 59 TYR HD1 H 1 6.530 0.05 . 3 . . . . 59 Tyr HD1 . 17127 1 2185 . 2 2 59 59 TYR HD2 H 1 6.530 0.05 . 3 . . . . 59 Tyr HD2 . 17127 1 2186 . 2 2 59 59 TYR HE1 H 1 7.258 0.05 . 3 . . . . 59 Tyr HE1 . 17127 1 2187 . 2 2 59 59 TYR HE2 H 1 7.258 0.05 . 3 . . . . 59 Tyr HE2 . 17127 1 2188 . 2 2 59 59 TYR N N 15 120.883 0.05 . 1 . . . . 59 Tyr N . 17127 1 2189 . 2 2 60 60 CYS H H 1 7.487 0.05 . 1 . . . . 60 Cys H . 17127 1 2190 . 2 2 60 60 CYS HA H 1 5.220 0.05 . 1 . . . . 60 Cys HA . 17127 1 2191 . 2 2 60 60 CYS N N 15 116.467 0.05 . 1 . . . . 60 Cys N . 17127 1 2192 . 2 2 61 61 ALA HA H 1 4.182 0.05 . 1 . . . . 61 Ala HA . 17127 1 2193 . 2 2 61 61 ALA HB1 H 1 1.109 0.05 . 1 . . . . 61 Ala HB1 . 17127 1 2194 . 2 2 61 61 ALA HB2 H 1 1.109 0.05 . 1 . . . . 61 Ala HB2 . 17127 1 2195 . 2 2 61 61 ALA HB3 H 1 1.109 0.05 . 1 . . . . 61 Ala HB3 . 17127 1 2196 . 2 2 61 61 ALA C C 13 177.187 0.20 . 1 . . . . 61 Ala C . 17127 1 2197 . 2 2 61 61 ALA CA C 13 52.520 0.20 . 1 . . . . 61 Ala CA . 17127 1 2198 . 2 2 61 61 ALA CB C 13 18.191 0.20 . 1 . . . . 61 Ala CB . 17127 1 2199 . 2 2 62 62 THR H H 1 7.694 0.05 . 1 . . . . 62 Thr H . 17127 1 2200 . 2 2 62 62 THR HA H 1 4.674 0.05 . 1 . . . . 62 Thr HA . 17127 1 2201 . 2 2 62 62 THR HB H 1 4.185 0.05 . 1 . . . . 62 Thr HB . 17127 1 2202 . 2 2 62 62 THR HG21 H 1 1.275 0.05 . 1 . . . . 62 Thr HG21 . 17127 1 2203 . 2 2 62 62 THR HG22 H 1 1.275 0.05 . 1 . . . . 62 Thr HG22 . 17127 1 2204 . 2 2 62 62 THR HG23 H 1 1.275 0.05 . 1 . . . . 62 Thr HG23 . 17127 1 2205 . 2 2 62 62 THR C C 13 173.187 0.20 . 1 . . . . 62 Thr C . 17127 1 2206 . 2 2 62 62 THR CA C 13 58.916 0.20 . 1 . . . . 62 Thr CA . 17127 1 2207 . 2 2 62 62 THR CB C 13 69.633 0.20 . 1 . . . . 62 Thr CB . 17127 1 2208 . 2 2 62 62 THR CG2 C 13 21.252 0.20 . 1 . . . . 62 Thr CG2 . 17127 1 2209 . 2 2 62 62 THR N N 15 112.552 0.05 . 1 . . . . 62 Thr N . 17127 1 2210 . 2 2 63 63 PRO HA H 1 4.432 0.05 . 1 . . . . 63 Pro HA . 17127 1 2211 . 2 2 63 63 PRO HB2 H 1 2.311 0.05 . 2 . . . . 63 Pro HB2 . 17127 1 2212 . 2 2 63 63 PRO HB3 H 1 1.944 0.05 . 2 . . . . 63 Pro HB3 . 17127 1 2213 . 2 2 63 63 PRO HD2 H 1 3.739 0.05 . 2 . . . . 63 Pro HD2 . 17127 1 2214 . 2 2 63 63 PRO HD3 H 1 3.811 0.05 . 2 . . . . 63 Pro HD3 . 17127 1 2215 . 2 2 63 63 PRO HG2 H 1 1.969 0.05 . 1 . . . . 63 Pro HG2 . 17127 1 2216 . 2 2 63 63 PRO HG3 H 1 1.969 0.05 . 1 . . . . 63 Pro HG3 . 17127 1 2217 . 2 2 63 63 PRO C C 13 176.779 0.20 . 1 . . . . 63 Pro C . 17127 1 2218 . 2 2 63 63 PRO CA C 13 62.570 0.20 . 1 . . . . 63 Pro CA . 17127 1 2219 . 2 2 63 63 PRO CB C 13 31.777 0.20 . 1 . . . . 63 Pro CB . 17127 1 2220 . 2 2 63 63 PRO CD C 13 50.617 0.20 . 1 . . . . 63 Pro CD . 17127 1 2221 . 2 2 63 63 PRO CG C 13 27.029 0.20 . 1 . . . . 63 Pro CG . 17127 1 2222 . 2 2 64 64 ALA H H 1 8.375 0.05 . 1 . . . . 64 Ala H . 17127 1 2223 . 2 2 64 64 ALA HA H 1 4.252 0.05 . 1 . . . . 64 Ala HA . 17127 1 2224 . 2 2 64 64 ALA HB1 H 1 1.379 0.05 . 1 . . . . 64 Ala HB1 . 17127 1 2225 . 2 2 64 64 ALA HB2 H 1 1.379 0.05 . 1 . . . . 64 Ala HB2 . 17127 1 2226 . 2 2 64 64 ALA HB3 H 1 1.379 0.05 . 1 . . . . 64 Ala HB3 . 17127 1 2227 . 2 2 64 64 ALA C C 13 177.988 0.20 . 1 . . . . 64 Ala C . 17127 1 2228 . 2 2 64 64 ALA CA C 13 51.984 0.20 . 1 . . . . 64 Ala CA . 17127 1 2229 . 2 2 64 64 ALA CB C 13 18.902 0.20 . 1 . . . . 64 Ala CB . 17127 1 2230 . 2 2 64 64 ALA N N 15 124.235 0.05 . 1 . . . . 64 Ala N . 17127 1 2231 . 2 2 65 65 LYS H H 1 8.237 0.05 . 1 . . . . 65 Lys H . 17127 1 2232 . 2 2 65 65 LYS HA H 1 4.354 0.05 . 1 . . . . 65 Lys HA . 17127 1 2233 . 2 2 65 65 LYS HB2 H 1 1.857 0.05 . 2 . . . . 65 Lys HB2 . 17127 1 2234 . 2 2 65 65 LYS HB3 H 1 1.771 0.05 . 2 . . . . 65 Lys HB3 . 17127 1 2235 . 2 2 65 65 LYS HD2 H 1 1.687 0.05 . 1 . . . . 65 Lys HD2 . 17127 1 2236 . 2 2 65 65 LYS HD3 H 1 1.687 0.05 . 1 . . . . 65 Lys HD3 . 17127 1 2237 . 2 2 65 65 LYS HE2 H 1 2.998 0.05 . 1 . . . . 65 Lys HE2 . 17127 1 2238 . 2 2 65 65 LYS HE3 H 1 2.998 0.05 . 1 . . . . 65 Lys HE3 . 17127 1 2239 . 2 2 65 65 LYS HG2 H 1 1.437 0.05 . 1 . . . . 65 Lys HG2 . 17127 1 2240 . 2 2 65 65 LYS HG3 H 1 1.437 0.05 . 1 . . . . 65 Lys HG3 . 17127 1 2241 . 2 2 65 65 LYS C C 13 176.784 0.20 . 1 . . . . 65 Lys C . 17127 1 2242 . 2 2 65 65 LYS CA C 13 55.722 0.20 . 1 . . . . 65 Lys CA . 17127 1 2243 . 2 2 65 65 LYS CB C 13 32.926 0.20 . 1 . . . . 65 Lys CB . 17127 1 2244 . 2 2 65 65 LYS CD C 13 28.717 0.20 . 1 . . . . 65 Lys CD . 17127 1 2245 . 2 2 65 65 LYS CE C 13 41.739 0.20 . 1 . . . . 65 Lys CE . 17127 1 2246 . 2 2 65 65 LYS CG C 13 24.192 0.20 . 1 . . . . 65 Lys CG . 17127 1 2247 . 2 2 65 65 LYS N N 15 120.573 0.05 . 1 . . . . 65 Lys N . 17127 1 2248 . 2 2 66 66 SER H H 1 8.321 0.05 . 1 . . . . 66 Ser H . 17127 1 2249 . 2 2 66 66 SER HA H 1 4.460 0.05 . 1 . . . . 66 Ser HA . 17127 1 2250 . 2 2 66 66 SER HB2 H 1 3.869 0.05 . 2 . . . . 66 Ser HB2 . 17127 1 2251 . 2 2 66 66 SER HB3 H 1 3.865 0.05 . 2 . . . . 66 Ser HB3 . 17127 1 2252 . 2 2 66 66 SER C C 13 173.948 0.20 . 1 . . . . 66 Ser C . 17127 1 2253 . 2 2 66 66 SER CA C 13 57.928 0.20 . 1 . . . . 66 Ser CA . 17127 1 2254 . 2 2 66 66 SER CB C 13 63.622 0.20 . 1 . . . . 66 Ser CB . 17127 1 2255 . 2 2 66 66 SER N N 15 117.796 0.05 . 1 . . . . 66 Ser N . 17127 1 2256 . 2 2 67 67 GLU H H 1 7.954 0.05 . 1 . . . . 67 Glu H . 17127 1 2257 . 2 2 67 67 GLU HA H 1 4.199 0.05 . 1 . . . . 67 Glu HA . 17127 1 2258 . 2 2 67 67 GLU HB2 H 1 2.105 0.05 . 2 . . . . 67 Glu HB2 . 17127 1 2259 . 2 2 67 67 GLU HB3 H 1 1.915 0.05 . 2 . . . . 67 Glu HB3 . 17127 1 2260 . 2 2 67 67 GLU HG2 H 1 2.324 0.05 . 1 . . . . 67 Glu HG2 . 17127 1 2261 . 2 2 67 67 GLU HG3 H 1 2.324 0.05 . 1 . . . . 67 Glu HG3 . 17127 1 2262 . 2 2 67 67 GLU C C 13 180.823 0.20 . 1 . . . . 67 Glu C . 17127 1 2263 . 2 2 67 67 GLU CA C 13 57.019 0.20 . 1 . . . . 67 Glu CA . 17127 1 2264 . 2 2 67 67 GLU CB C 13 30.013 0.20 . 1 . . . . 67 Glu CB . 17127 1 2265 . 2 2 67 67 GLU N N 15 126.766 0.05 . 1 . . . . 67 Glu N . 17127 1 stop_ save_