data_26376 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 26376 _Entry.Title ; The backbone resonance assignments of human vWF A2 domain [1495-1671] ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2026-01-08 _Entry.Accession_date 2026-02-03 _Entry.Last_release_date 2026-02-03 _Entry.Original_release_date 2026-02-03 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.2.0.16 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Ryuichi Hyakumoto . . . . 26376 2 Masatomo So . . . . 26376 3 Ayako Furukawa . . . . 26376 4 Kenji Sugase . . . . 26376 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26376 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 424 26376 '15N chemical shifts' 155 26376 '1H chemical shifts' 155 26376 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2026-03-31 . original BMRB . 26376 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26352 'The backbone resonance assignments of mouse CPEB3 [294-410]' 26376 BMRB 26353 'The backbone resonance assignments of mouse CPEB3 [101-200]' 26376 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 26376 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 41870674 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; 1H, 13C, and 15N backbone resonance assignments of the A2 domain of human von Willebrand factor ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 20 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1874-270X _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 13 _Citation.Page_last 13 _Citation.Year 2026 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Ryuichi Hyakumoto R. . . . 26376 1 2 Masatomo So M. . . . 26376 1 3 Ayako Furukawa A. . . . 26376 1 4 Daichi Morimoto D. . . . 26376 1 5 Kenji Sugase K. . . . 26376 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 26376 _Assembly.ID 1 _Assembly.Name 'human vWF [1495-1671]' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 1 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _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 vWF [1495-1671]' 1 $entity_1 . . yes native no no . . . 26376 1 2 'calcium ion' 2 $entity_CA . . no native no no . . . 26376 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_asym_ID_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_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide sing . 1 'human vWF [1495-1671]' 1 CYS 175 175 SG . 1 'human vWF [1495-1671]' 1 CYS 176 176 SG . . . 1669 CYS SG . . . 1670 CYS SG 26376 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 26376 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'human vWF [1495-1671]' _Entity.Type polymer _Entity.Polymer_common_type protein _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MVLDVAFVLEGSDKIGEADF NRSKEFMEEVIQRMDVGQDS IHVTVLQYSYMVTVEYPFSE AQSKGDILQRVREIRYQGGN RTNTGLALRYLSDHSFLVSQ GDREQAPNLVYMVTGNPASD EIKRLPGDIQVVPIGVGPNA NVQELERIGWPNAPILIQDF ETLPREAPDLVLQRCCS ; _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 177 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1495 MET . 26376 1 2 1496 VAL . 26376 1 3 1497 LEU . 26376 1 4 1498 ASP . 26376 1 5 1499 VAL . 26376 1 6 1500 ALA . 26376 1 7 1501 PHE . 26376 1 8 1502 VAL . 26376 1 9 1503 LEU . 26376 1 10 1504 GLU . 26376 1 11 1505 GLY . 26376 1 12 1506 SER . 26376 1 13 1507 ASP . 26376 1 14 1508 LYS . 26376 1 15 1509 ILE . 26376 1 16 1510 GLY . 26376 1 17 1511 GLU . 26376 1 18 1512 ALA . 26376 1 19 1513 ASP . 26376 1 20 1514 PHE . 26376 1 21 1515 ASN . 26376 1 22 1516 ARG . 26376 1 23 1517 SER . 26376 1 24 1518 LYS . 26376 1 25 1519 GLU . 26376 1 26 1520 PHE . 26376 1 27 1521 MET . 26376 1 28 1522 GLU . 26376 1 29 1523 GLU . 26376 1 30 1524 VAL . 26376 1 31 1525 ILE . 26376 1 32 1526 GLN . 26376 1 33 1527 ARG . 26376 1 34 1528 MET . 26376 1 35 1529 ASP . 26376 1 36 1530 VAL . 26376 1 37 1531 GLY . 26376 1 38 1532 GLN . 26376 1 39 1533 ASP . 26376 1 40 1534 SER . 26376 1 41 1535 ILE . 26376 1 42 1536 HIS . 26376 1 43 1537 VAL . 26376 1 44 1538 THR . 26376 1 45 1539 VAL . 26376 1 46 1540 LEU . 26376 1 47 1541 GLN . 26376 1 48 1542 TYR . 26376 1 49 1543 SER . 26376 1 50 1544 TYR . 26376 1 51 1545 MET . 26376 1 52 1546 VAL . 26376 1 53 1547 THR . 26376 1 54 1548 VAL . 26376 1 55 1549 GLU . 26376 1 56 1550 TYR . 26376 1 57 1551 PRO . 26376 1 58 1552 PHE . 26376 1 59 1553 SER . 26376 1 60 1554 GLU . 26376 1 61 1555 ALA . 26376 1 62 1556 GLN . 26376 1 63 1557 SER . 26376 1 64 1558 LYS . 26376 1 65 1559 GLY . 26376 1 66 1560 ASP . 26376 1 67 1561 ILE . 26376 1 68 1562 LEU . 26376 1 69 1563 GLN . 26376 1 70 1564 ARG . 26376 1 71 1565 VAL . 26376 1 72 1566 ARG . 26376 1 73 1567 GLU . 26376 1 74 1568 ILE . 26376 1 75 1569 ARG . 26376 1 76 1570 TYR . 26376 1 77 1571 GLN . 26376 1 78 1572 GLY . 26376 1 79 1573 GLY . 26376 1 80 1574 ASN . 26376 1 81 1575 ARG . 26376 1 82 1576 THR . 26376 1 83 1577 ASN . 26376 1 84 1578 THR . 26376 1 85 1579 GLY . 26376 1 86 1580 LEU . 26376 1 87 1581 ALA . 26376 1 88 1582 LEU . 26376 1 89 1583 ARG . 26376 1 90 1584 TYR . 26376 1 91 1585 LEU . 26376 1 92 1586 SER . 26376 1 93 1587 ASP . 26376 1 94 1588 HIS . 26376 1 95 1589 SER . 26376 1 96 1590 PHE . 26376 1 97 1591 LEU . 26376 1 98 1592 VAL . 26376 1 99 1593 SER . 26376 1 100 1594 GLN . 26376 1 101 1595 GLY . 26376 1 102 1596 ASP . 26376 1 103 1597 ARG . 26376 1 104 1598 GLU . 26376 1 105 1599 GLN . 26376 1 106 1600 ALA . 26376 1 107 1601 PRO . 26376 1 108 1602 ASN . 26376 1 109 1603 LEU . 26376 1 110 1604 VAL . 26376 1 111 1605 TYR . 26376 1 112 1606 MET . 26376 1 113 1607 VAL . 26376 1 114 1608 THR . 26376 1 115 1609 GLY . 26376 1 116 1610 ASN . 26376 1 117 1611 PRO . 26376 1 118 1612 ALA . 26376 1 119 1613 SER . 26376 1 120 1614 ASP . 26376 1 121 1615 GLU . 26376 1 122 1616 ILE . 26376 1 123 1617 LYS . 26376 1 124 1618 ARG . 26376 1 125 1619 LEU . 26376 1 126 1620 PRO . 26376 1 127 1621 GLY . 26376 1 128 1622 ASP . 26376 1 129 1623 ILE . 26376 1 130 1624 GLN . 26376 1 131 1625 VAL . 26376 1 132 1626 VAL . 26376 1 133 1627 PRO . 26376 1 134 1628 ILE . 26376 1 135 1629 GLY . 26376 1 136 1630 VAL . 26376 1 137 1631 GLY . 26376 1 138 1632 PRO . 26376 1 139 1633 ASN . 26376 1 140 1634 ALA . 26376 1 141 1635 ASN . 26376 1 142 1636 VAL . 26376 1 143 1637 GLN . 26376 1 144 1638 GLU . 26376 1 145 1639 LEU . 26376 1 146 1640 GLU . 26376 1 147 1641 ARG . 26376 1 148 1642 ILE . 26376 1 149 1643 GLY . 26376 1 150 1644 TRP . 26376 1 151 1645 PRO . 26376 1 152 1646 ASN . 26376 1 153 1647 ALA . 26376 1 154 1648 PRO . 26376 1 155 1649 ILE . 26376 1 156 1650 LEU . 26376 1 157 1651 ILE . 26376 1 158 1652 GLN . 26376 1 159 1653 ASP . 26376 1 160 1654 PHE . 26376 1 161 1655 GLU . 26376 1 162 1656 THR . 26376 1 163 1657 LEU . 26376 1 164 1658 PRO . 26376 1 165 1659 ARG . 26376 1 166 1660 GLU . 26376 1 167 1661 ALA . 26376 1 168 1662 PRO . 26376 1 169 1663 ASP . 26376 1 170 1664 LEU . 26376 1 171 1665 VAL . 26376 1 172 1666 LEU . 26376 1 173 1667 GLN . 26376 1 174 1668 ARG . 26376 1 175 1669 CYS . 26376 1 176 1670 CYS . 26376 1 177 1671 SER . 26376 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 26376 1 . VAL 2 2 26376 1 . LEU 3 3 26376 1 . ASP 4 4 26376 1 . VAL 5 5 26376 1 . ALA 6 6 26376 1 . PHE 7 7 26376 1 . VAL 8 8 26376 1 . LEU 9 9 26376 1 . GLU 10 10 26376 1 . GLY 11 11 26376 1 . SER 12 12 26376 1 . ASP 13 13 26376 1 . LYS 14 14 26376 1 . ILE 15 15 26376 1 . GLY 16 16 26376 1 . GLU 17 17 26376 1 . ALA 18 18 26376 1 . ASP 19 19 26376 1 . PHE 20 20 26376 1 . ASN 21 21 26376 1 . ARG 22 22 26376 1 . SER 23 23 26376 1 . LYS 24 24 26376 1 . GLU 25 25 26376 1 . PHE 26 26 26376 1 . MET 27 27 26376 1 . GLU 28 28 26376 1 . GLU 29 29 26376 1 . VAL 30 30 26376 1 . ILE 31 31 26376 1 . GLN 32 32 26376 1 . ARG 33 33 26376 1 . MET 34 34 26376 1 . ASP 35 35 26376 1 . VAL 36 36 26376 1 . GLY 37 37 26376 1 . GLN 38 38 26376 1 . ASP 39 39 26376 1 . SER 40 40 26376 1 . ILE 41 41 26376 1 . HIS 42 42 26376 1 . VAL 43 43 26376 1 . THR 44 44 26376 1 . VAL 45 45 26376 1 . LEU 46 46 26376 1 . GLN 47 47 26376 1 . TYR 48 48 26376 1 . SER 49 49 26376 1 . TYR 50 50 26376 1 . MET 51 51 26376 1 . VAL 52 52 26376 1 . THR 53 53 26376 1 . VAL 54 54 26376 1 . GLU 55 55 26376 1 . TYR 56 56 26376 1 . PRO 57 57 26376 1 . PHE 58 58 26376 1 . SER 59 59 26376 1 . GLU 60 60 26376 1 . ALA 61 61 26376 1 . GLN 62 62 26376 1 . SER 63 63 26376 1 . LYS 64 64 26376 1 . GLY 65 65 26376 1 . ASP 66 66 26376 1 . ILE 67 67 26376 1 . LEU 68 68 26376 1 . GLN 69 69 26376 1 . ARG 70 70 26376 1 . VAL 71 71 26376 1 . ARG 72 72 26376 1 . GLU 73 73 26376 1 . ILE 74 74 26376 1 . ARG 75 75 26376 1 . TYR 76 76 26376 1 . GLN 77 77 26376 1 . GLY 78 78 26376 1 . GLY 79 79 26376 1 . ASN 80 80 26376 1 . ARG 81 81 26376 1 . THR 82 82 26376 1 . ASN 83 83 26376 1 . THR 84 84 26376 1 . GLY 85 85 26376 1 . LEU 86 86 26376 1 . ALA 87 87 26376 1 . LEU 88 88 26376 1 . ARG 89 89 26376 1 . TYR 90 90 26376 1 . LEU 91 91 26376 1 . SER 92 92 26376 1 . ASP 93 93 26376 1 . HIS 94 94 26376 1 . SER 95 95 26376 1 . PHE 96 96 26376 1 . LEU 97 97 26376 1 . VAL 98 98 26376 1 . SER 99 99 26376 1 . GLN 100 100 26376 1 . GLY 101 101 26376 1 . ASP 102 102 26376 1 . ARG 103 103 26376 1 . GLU 104 104 26376 1 . GLN 105 105 26376 1 . ALA 106 106 26376 1 . PRO 107 107 26376 1 . ASN 108 108 26376 1 . LEU 109 109 26376 1 . VAL 110 110 26376 1 . TYR 111 111 26376 1 . MET 112 112 26376 1 . VAL 113 113 26376 1 . THR 114 114 26376 1 . GLY 115 115 26376 1 . ASN 116 116 26376 1 . PRO 117 117 26376 1 . ALA 118 118 26376 1 . SER 119 119 26376 1 . ASP 120 120 26376 1 . GLU 121 121 26376 1 . ILE 122 122 26376 1 . LYS 123 123 26376 1 . ARG 124 124 26376 1 . LEU 125 125 26376 1 . PRO 126 126 26376 1 . GLY 127 127 26376 1 . ASP 128 128 26376 1 . ILE 129 129 26376 1 . GLN 130 130 26376 1 . VAL 131 131 26376 1 . VAL 132 132 26376 1 . PRO 133 133 26376 1 . ILE 134 134 26376 1 . GLY 135 135 26376 1 . VAL 136 136 26376 1 . GLY 137 137 26376 1 . PRO 138 138 26376 1 . ASN 139 139 26376 1 . ALA 140 140 26376 1 . ASN 141 141 26376 1 . VAL 142 142 26376 1 . GLN 143 143 26376 1 . GLU 144 144 26376 1 . LEU 145 145 26376 1 . GLU 146 146 26376 1 . ARG 147 147 26376 1 . ILE 148 148 26376 1 . GLY 149 149 26376 1 . TRP 150 150 26376 1 . PRO 151 151 26376 1 . ASN 152 152 26376 1 . ALA 153 153 26376 1 . PRO 154 154 26376 1 . ILE 155 155 26376 1 . LEU 156 156 26376 1 . ILE 157 157 26376 1 . GLN 158 158 26376 1 . ASP 159 159 26376 1 . PHE 160 160 26376 1 . GLU 161 161 26376 1 . THR 162 162 26376 1 . LEU 163 163 26376 1 . PRO 164 164 26376 1 . ARG 165 165 26376 1 . GLU 166 166 26376 1 . ALA 167 167 26376 1 . PRO 168 168 26376 1 . ASP 169 169 26376 1 . LEU 170 170 26376 1 . VAL 171 171 26376 1 . LEU 172 172 26376 1 . GLN 173 173 26376 1 . ARG 174 174 26376 1 . CYS 175 175 26376 1 . CYS 176 176 26376 1 . SER 177 177 26376 1 stop_ save_ save_entity_CA _Entity.Sf_category entity _Entity.Sf_framecode entity_CA _Entity.Entry_ID 26376 _Entity.ID 2 _Entity.BMRB_code CA _Entity.Name 'CALCIUM ION' _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID CA _Entity.Nonpolymer_comp_label $chem_comp_CA _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 40.078 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'CALCIUM ION' BMRB 26376 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'CALCIUM ION' BMRB 26376 2 CA 'Three letter code' 26376 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 1 CA $chem_comp_CA 26376 2 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 26376 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . . Metazoa Homo sapiens . . . . . . . . . . . . . 26376 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 26376 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' 'E. coli' . 562 Escherichia coli . . . plasmid . . pGEX6p-1 . . . 26376 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_CA _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_CA _Chem_comp.Entry_ID 26376 _Chem_comp.ID CA _Chem_comp.Provenance PDB _Chem_comp.Name 'CALCIUM ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code CA _Chem_comp.PDB_code CA _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2020-07-10 _Chem_comp.Modified_date 2020-07-10 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code CA _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Ca/q+2 _Chem_comp.Mon_nstd_flag no _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Ca _Chem_comp.Formula_weight 40.078 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID BHPQYMZQTOCNFJ-UHFFFAOYSA-N InChIKey InChI 1.03 26376 CA InChI=1S/Ca/q+2 InChI InChI 1.03 26376 CA [Ca++] SMILES CACTVS 3.341 26376 CA [Ca++] SMILES_CANONICAL CACTVS 3.341 26376 CA [Ca+2] SMILES ACDLabs 10.04 26376 CA [Ca+2] SMILES 'OpenEye OEToolkits' 1.5.0 26376 CA [Ca+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 26376 CA stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID calcium 'SYSTEMATIC NAME' ACDLabs 10.04 26376 CA 'calcium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 26376 CA stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID CA CA CA CA . CA . . N 2 . . . 0 N N . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 26376 CA stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26376 _Sample.ID 1 _Sample.Name 'human vWF A2 [1495-1671]' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _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 'human vWF [1495-1671]' '[U-100% 13C; U-100% 15N]' 1 $assembly_1 1 $entity_1 . protein 400 . . uM . . . . 26376 1 2 CaCl2 'natural abundance' 1 $assembly_1 2 $entity_2 . ligand 10 . . mM . . . . 26376 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 26376 1 4 TRIS 'natural abundance' . . . . . buffer 50 . . mM . . . . 26376 1 5 H2O 'natural abundance' . . . . . solvent 95 . . % . . . . 26376 1 6 D2O [U-2H] . . . . . solvent 5 . . % . . . . 26376 1 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 26376 _Sample_condition_list.ID 1 _Sample_condition_list.Name '50mM Tris-HCl(pH 8.0), 100mM NaCl, 10mM CaCl2' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 26376 1 pH 8.0 . pH 26376 1 pressure 1 . atm 26376 1 temperature 298 . K 26376 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 26376 _Software.ID 1 _Software.Type . _Software.Name 'CcpNmr Analysis Assign' _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 26376 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 26376 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '600 MHz AVANCE III HD spectrometer' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 26376 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no no . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26376 1 2 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26376 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26376 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26376 1 5 '3D HN(CA)CO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26376 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 26376 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'DSS-based chemical shift reference' _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methylene protons' . . . . ppm 0.00 external indirect 0.251449530 . . . . . 26376 1 H 1 DSS 'methylene protons' . . . . ppm 0.00 external direct 1.0 . . . . . 26376 1 N 15 DSS 'methylene protons' . . . . ppm 0.00 external indirect 0.101329118 . . . . . 26376 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 26376 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'human vWF A2 domain [1495-1671]' _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 26376 1 2 '3D HNCO' 1 $sample_1 isotropic 26376 1 3 '3D HNCACB' 1 $sample_1 isotropic 26376 1 4 '3D CBCA(CO)NH' 1 $sample_1 isotropic 26376 1 5 '3D HN(CA)CO' 1 $sample_1 isotropic 26376 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 1 $software_1 . . 26376 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 VAL H H 1 8.010344285 0.000677908 . 1 . . . . . 1496 VAL H . 26376 1 2 . 1 . 1 2 2 VAL C C 13 174.3722992 0.2 . 1 . . . . . 1496 VAL C . 26376 1 3 . 1 . 1 2 2 VAL CA C 13 61.573452 0.2 . 1 . . . . . 1496 VAL CA . 26376 1 4 . 1 . 1 2 2 VAL CB C 13 32.48923874 0.2 . 1 . . . . . 1496 VAL CB . 26376 1 5 . 1 . 1 2 2 VAL N N 15 118.4287582 0.006648471 . 1 . . . . . 1496 VAL N . 26376 1 6 . 1 . 1 3 3 LEU H H 1 6.435996296 0.02 . 1 . . . . . 1497 LEU H . 26376 1 7 . 1 . 1 3 3 LEU CA C 13 54.42632294 0.2 . 1 . . . . . 1497 LEU CA . 26376 1 8 . 1 . 1 3 3 LEU CB C 13 40.46341705 0.2 . 1 . . . . . 1497 LEU CB . 26376 1 9 . 1 . 1 3 3 LEU N N 15 122.8566862 0.2 . 1 . . . . . 1497 LEU N . 26376 1 10 . 1 . 1 4 4 ASP H H 1 9.21949596 0.003737118 . 1 . . . . . 1498 ASP H . 26376 1 11 . 1 . 1 4 4 ASP C C 13 173.1355701 0.2 . 1 . . . . . 1498 ASP C . 26376 1 12 . 1 . 1 4 4 ASP CB C 13 42.34162903 0.2 . 1 . . . . . 1498 ASP CB . 26376 1 13 . 1 . 1 4 4 ASP N N 15 127.9179602 0.012952948 . 1 . . . . . 1498 ASP N . 26376 1 14 . 1 . 1 5 5 VAL H H 1 9.493636233 0.00261407 . 1 . . . . . 1499 VAL H . 26376 1 15 . 1 . 1 5 5 VAL C C 13 173.8469894 0.2 . 1 . . . . . 1499 VAL C . 26376 1 16 . 1 . 1 5 5 VAL CA C 13 60.28296771 0.2 . 1 . . . . . 1499 VAL CA . 26376 1 17 . 1 . 1 5 5 VAL CB C 13 34.38370766 0.2 . 1 . . . . . 1499 VAL CB . 26376 1 18 . 1 . 1 5 5 VAL N N 15 124.2630502 0.020545385 . 1 . . . . . 1499 VAL N . 26376 1 19 . 1 . 1 6 6 ALA H H 1 9.316744959 0.00206067 . 1 . . . . . 1500 ALA H . 26376 1 20 . 1 . 1 6 6 ALA C C 13 176.0168955 0.2 . 1 . . . . . 1500 ALA C . 26376 1 21 . 1 . 1 6 6 ALA CA C 13 48.99188232 0.2 . 1 . . . . . 1500 ALA CA . 26376 1 22 . 1 . 1 6 6 ALA CB C 13 24.244 0.2 . 1 . . . . . 1500 ALA CB . 26376 1 23 . 1 . 1 6 6 ALA N N 15 126.5272397 0.022922663 . 1 . . . . . 1500 ALA N . 26376 1 24 . 1 . 1 7 7 PHE H H 1 8.988691401 0.001203489 . 1 . . . . . 1501 PHE H . 26376 1 25 . 1 . 1 7 7 PHE C C 13 174.7586823 0.2 . 1 . . . . . 1501 PHE C . 26376 1 26 . 1 . 1 7 7 PHE CA C 13 57.20475769 0.2 . 1 . . . . . 1501 PHE CA . 26376 1 27 . 1 . 1 7 7 PHE CB C 13 43.01020813 0.2 . 1 . . . . . 1501 PHE CB . 26376 1 28 . 1 . 1 7 7 PHE N N 15 119.8700818 0.003388935 . 1 . . . . . 1501 PHE N . 26376 1 29 . 1 . 1 8 8 VAL H H 1 9.081469453 0.002299185 . 1 . . . . . 1502 VAL H . 26376 1 30 . 1 . 1 8 8 VAL C C 13 174.0573128 0.2 . 1 . . . . . 1502 VAL C . 26376 1 31 . 1 . 1 8 8 VAL CA C 13 60.77758789 0.2 . 1 . . . . . 1502 VAL CA . 26376 1 32 . 1 . 1 8 8 VAL CB C 13 33.57323074 0.2 . 1 . . . . . 1502 VAL CB . 26376 1 33 . 1 . 1 8 8 VAL N N 15 122.6718869 0.026696715 . 1 . . . . . 1502 VAL N . 26376 1 34 . 1 . 1 9 9 LEU H H 1 9.26569606 0.001159218 . 1 . . . . . 1503 LEU H . 26376 1 35 . 1 . 1 9 9 LEU C C 13 175.7008908 0.2 . 1 . . . . . 1503 LEU C . 26376 1 36 . 1 . 1 9 9 LEU CA C 13 54.05027008 0.2 . 1 . . . . . 1503 LEU CA . 26376 1 37 . 1 . 1 9 9 LEU CB C 13 43.98600858 0.2 . 1 . . . . . 1503 LEU CB . 26376 1 38 . 1 . 1 9 9 LEU N N 15 126.7575027 0.02441226 . 1 . . . . . 1503 LEU N . 26376 1 39 . 1 . 1 10 10 GLU H H 1 8.431553919 0.000575316 . 1 . . . . . 1504 GLU H . 26376 1 40 . 1 . 1 10 10 GLU C C 13 175.5678406 0.2 . 1 . . . . . 1504 GLU C . 26376 1 41 . 1 . 1 10 10 GLU CA C 13 57.39533997 0.2 . 1 . . . . . 1504 GLU CA . 26376 1 42 . 1 . 1 10 10 GLU CB C 13 29.52846718 0.2 . 1 . . . . . 1504 GLU CB . 26376 1 43 . 1 . 1 10 10 GLU N N 15 126.3590706 0.003859406 . 1 . . . . . 1504 GLU N . 26376 1 44 . 1 . 1 11 11 GLY H H 1 8.989342286 0.001055449 . 1 . . . . . 1505 GLY H . 26376 1 45 . 1 . 1 11 11 GLY C C 13 173.1690216 0.2 . 1 . . . . . 1505 GLY C . 26376 1 46 . 1 . 1 11 11 GLY CA C 13 45.44972992 0.2 . 1 . . . . . 1505 GLY CA . 26376 1 47 . 1 . 1 11 11 GLY N N 15 116.8772265 0.003779769 . 1 . . . . . 1505 GLY N . 26376 1 48 . 1 . 1 12 12 SER H H 1 6.292016159 0.000690628 . 1 . . . . . 1506 SER H . 26376 1 49 . 1 . 1 12 12 SER C C 13 175.1723938 0.2 . 1 . . . . . 1506 SER C . 26376 1 50 . 1 . 1 12 12 SER CA C 13 57.31092834 0.2 . 1 . . . . . 1506 SER CA . 26376 1 51 . 1 . 1 12 12 SER CB C 13 66.25511169 0.2 . 1 . . . . . 1506 SER CB . 26376 1 52 . 1 . 1 12 12 SER N N 15 112.545045 0.005592993 . 1 . . . . . 1506 SER N . 26376 1 53 . 1 . 1 13 13 ASP H H 1 9.262752376 0.002352542 . 1 . . . . . 1507 ASP H . 26376 1 54 . 1 . 1 13 13 ASP C C 13 177.7929297 0.2 . 1 . . . . . 1507 ASP C . 26376 1 55 . 1 . 1 13 13 ASP CA C 13 56.3426611 0.2 . 1 . . . . . 1507 ASP CA . 26376 1 56 . 1 . 1 13 13 ASP CB C 13 39.67524088 0.2 . 1 . . . . . 1507 ASP CB . 26376 1 57 . 1 . 1 13 13 ASP N N 15 121.5153314 0.028649247 . 1 . . . . . 1507 ASP N . 26376 1 58 . 1 . 1 14 14 LYS H H 1 7.538247351 0.001089516 . 1 . . . . . 1508 LYS H . 26376 1 59 . 1 . 1 14 14 LYS C C 13 178.120697 0.2 . 1 . . . . . 1508 LYS C . 26376 1 60 . 1 . 1 14 14 LYS CA C 13 58.00683897 0.2 . 1 . . . . . 1508 LYS CA . 26376 1 61 . 1 . 1 14 14 LYS CB C 13 32.82433823 0.2 . 1 . . . . . 1508 LYS CB . 26376 1 62 . 1 . 1 14 14 LYS N N 15 117.4187204 0.002510884 . 1 . . . . . 1508 LYS N . 26376 1 63 . 1 . 1 15 15 ILE H H 1 7.45249958 0.000419037 . 1 . . . . . 1509 ILE H . 26376 1 64 . 1 . 1 15 15 ILE C C 13 177.2524872 0.2 . 1 . . . . . 1509 ILE C . 26376 1 65 . 1 . 1 15 15 ILE CA C 13 61.27497605 0.2 . 1 . . . . . 1509 ILE CA . 26376 1 66 . 1 . 1 15 15 ILE CB C 13 36.21281938 0.2 . 1 . . . . . 1509 ILE CB . 26376 1 67 . 1 . 1 15 15 ILE N N 15 120.2912911 0.005518945 . 1 . . . . . 1509 ILE N . 26376 1 68 . 1 . 1 16 16 GLY H H 1 7.513826812 0.002862175 . 1 . . . . . 1510 GLY H . 26376 1 69 . 1 . 1 16 16 GLY C C 13 172.5697021 0.2 . 1 . . . . . 1510 GLY C . 26376 1 70 . 1 . 1 16 16 GLY CA C 13 43.8257103 0.2 . 1 . . . . . 1510 GLY CA . 26376 1 71 . 1 . 1 16 16 GLY N N 15 104.7434821 0.00111325 . 1 . . . . . 1510 GLY N . 26376 1 72 . 1 . 1 17 17 GLU H H 1 7.997358521 0.00046589 . 1 . . . . . 1511 GLU H . 26376 1 73 . 1 . 1 17 17 GLU C C 13 177.6849976 0.2 . 1 . . . . . 1511 GLU C . 26376 1 74 . 1 . 1 17 17 GLU CA C 13 60.0484581 0.2 . 1 . . . . . 1511 GLU CA . 26376 1 75 . 1 . 1 17 17 GLU CB C 13 29.90011871 0.2 . 1 . . . . . 1511 GLU CB . 26376 1 76 . 1 . 1 17 17 GLU N N 15 120.3565253 0.001544133 . 1 . . . . . 1511 GLU N . 26376 1 77 . 1 . 1 18 18 ALA H H 1 8.090508536 0.000347463 . 1 . . . . . 1512 ALA H . 26376 1 78 . 1 . 1 18 18 ALA C C 13 181.0651093 0.2 . 1 . . . . . 1512 ALA C . 26376 1 79 . 1 . 1 18 18 ALA CA C 13 55.43030548 0.2 . 1 . . . . . 1512 ALA CA . 26376 1 80 . 1 . 1 18 18 ALA CB C 13 17.61436462 0.2 . 1 . . . . . 1512 ALA CB . 26376 1 81 . 1 . 1 18 18 ALA N N 15 120.6574936 0.003583524 . 1 . . . . . 1512 ALA N . 26376 1 82 . 1 . 1 19 19 ASP H H 1 8.448269448 0.000386204 . 1 . . . . . 1513 ASP H . 26376 1 83 . 1 . 1 19 19 ASP C C 13 178.8064575 0.2 . 1 . . . . . 1513 ASP C . 26376 1 84 . 1 . 1 19 19 ASP CA C 13 56.81378174 0.2 . 1 . . . . . 1513 ASP CA . 26376 1 85 . 1 . 1 19 19 ASP CB C 13 37.83753967 0.2 . 1 . . . . . 1513 ASP CB . 26376 1 86 . 1 . 1 19 19 ASP N N 15 120.54291 0.005130287 . 1 . . . . . 1513 ASP N . 26376 1 87 . 1 . 1 20 20 PHE H H 1 8.323493103 0.001520753 . 1 . . . . . 1514 PHE H . 26376 1 88 . 1 . 1 20 20 PHE C C 13 178.3845367 0.2 . 1 . . . . . 1514 PHE C . 26376 1 89 . 1 . 1 20 20 PHE CA C 13 62.56209564 0.2 . 1 . . . . . 1514 PHE CA . 26376 1 90 . 1 . 1 20 20 PHE CB C 13 39.2013855 0.2 . 1 . . . . . 1514 PHE CB . 26376 1 91 . 1 . 1 20 20 PHE N N 15 123.6658028 0.00297795 . 1 . . . . . 1514 PHE N . 26376 1 92 . 1 . 1 21 21 ASN H H 1 8.365787046 0.001988693 . 1 . . . . . 1515 ASN H . 26376 1 93 . 1 . 1 21 21 ASN C C 13 179.2602386 0.2 . 1 . . . . . 1515 ASN C . 26376 1 94 . 1 . 1 21 21 ASN CA C 13 56.30451965 0.2 . 1 . . . . . 1515 ASN CA . 26376 1 95 . 1 . 1 21 21 ASN CB C 13 36.97217941 0.2 . 1 . . . . . 1515 ASN CB . 26376 1 96 . 1 . 1 21 21 ASN N N 15 118.9651228 0.004504726 . 1 . . . . . 1515 ASN N . 26376 1 97 . 1 . 1 22 22 ARG H H 1 7.700920376 0.000684068 . 1 . . . . . 1516 ARG H . 26376 1 98 . 1 . 1 22 22 ARG C C 13 178.7785492 0.2 . 1 . . . . . 1516 ARG C . 26376 1 99 . 1 . 1 22 22 ARG CA C 13 58.7707124 0.2 . 1 . . . . . 1516 ARG CA . 26376 1 100 . 1 . 1 22 22 ARG CB C 13 29.99946011 0.2 . 1 . . . . . 1516 ARG CB . 26376 1 101 . 1 . 1 22 22 ARG N N 15 120.8407035 0.000271652 . 1 . . . . . 1516 ARG N . 26376 1 102 . 1 . 1 23 23 SER H H 1 7.949496539 0.001581642 . 1 . . . . . 1517 SER H . 26376 1 103 . 1 . 1 23 23 SER C C 13 176.6396179 0.2 . 1 . . . . . 1517 SER C . 26376 1 104 . 1 . 1 23 23 SER CA C 13 62.6151886 0.2 . 1 . . . . . 1517 SER CA . 26376 1 105 . 1 . 1 23 23 SER N N 15 118.9159215 0.001017894 . 1 . . . . . 1517 SER N . 26376 1 106 . 1 . 1 24 24 LYS H H 1 7.84254471 0.002482094 . 1 . . . . . 1518 LYS H . 26376 1 107 . 1 . 1 24 24 LYS C C 13 178.2763977 0.2 . 1 . . . . . 1518 LYS C . 26376 1 108 . 1 . 1 24 24 LYS CA C 13 60.98508835 0.2 . 1 . . . . . 1518 LYS CA . 26376 1 109 . 1 . 1 24 24 LYS CB C 13 31.27739334 0.2 . 1 . . . . . 1518 LYS CB . 26376 1 110 . 1 . 1 24 24 LYS N N 15 121.9336463 0.107608481 . 1 . . . . . 1518 LYS N . 26376 1 111 . 1 . 1 25 25 GLU H H 1 7.99688852 0.000686984 . 1 . . . . . 1519 GLU H . 26376 1 112 . 1 . 1 25 25 GLU C C 13 179.3019714 0.2 . 1 . . . . . 1519 GLU C . 26376 1 113 . 1 . 1 25 25 GLU CA C 13 59.57118225 0.2 . 1 . . . . . 1519 GLU CA . 26376 1 114 . 1 . 1 25 25 GLU CB C 13 29.37243652 0.2 . 1 . . . . . 1519 GLU CB . 26376 1 115 . 1 . 1 25 25 GLU N N 15 121.5918731 0.002387671 . 1 . . . . . 1519 GLU N . 26376 1 116 . 1 . 1 26 26 PHE H H 1 8.258432577 0.000581664 . 1 . . . . . 1520 PHE H . 26376 1 117 . 1 . 1 26 26 PHE C C 13 174.3970947 0.2 . 1 . . . . . 1520 PHE C . 26376 1 118 . 1 . 1 26 26 PHE CA C 13 60.06857681 0.2 . 1 . . . . . 1520 PHE CA . 26376 1 119 . 1 . 1 26 26 PHE CB C 13 37.99976632 0.2 . 1 . . . . . 1520 PHE CB . 26376 1 120 . 1 . 1 26 26 PHE N N 15 120.4367726 0.00076899 . 1 . . . . . 1520 PHE N . 26376 1 121 . 1 . 1 27 27 MET H H 1 7.671269411 0.000998454 . 1 . . . . . 1521 MET H . 26376 1 122 . 1 . 1 27 27 MET C C 13 177.291687 0.2 . 1 . . . . . 1521 MET C . 26376 1 123 . 1 . 1 27 27 MET CA C 13 56.73745728 0.2 . 1 . . . . . 1521 MET CA . 26376 1 124 . 1 . 1 27 27 MET CB C 13 31.93118095 0.2 . 1 . . . . . 1521 MET CB . 26376 1 125 . 1 . 1 27 27 MET N N 15 119.4248633 0.000627767 . 1 . . . . . 1521 MET N . 26376 1 126 . 1 . 1 28 28 GLU H H 1 8.134501785 0.000572533 . 1 . . . . . 1522 GLU H . 26376 1 127 . 1 . 1 28 28 GLU C C 13 177.7915106 0.2 . 1 . . . . . 1522 GLU C . 26376 1 128 . 1 . 1 28 28 GLU CA C 13 59.97039032 0.2 . 1 . . . . . 1522 GLU CA . 26376 1 129 . 1 . 1 28 28 GLU CB C 13 29.25562477 0.2 . 1 . . . . . 1522 GLU CB . 26376 1 130 . 1 . 1 28 28 GLU N N 15 119.0596973 0.00110359 . 1 . . . . . 1522 GLU N . 26376 1 131 . 1 . 1 29 29 GLU H H 1 7.685919194 0.02 . 1 . . . . . 1523 GLU H . 26376 1 132 . 1 . 1 29 29 GLU CA C 13 58.82928085 0.2 . 1 . . . . . 1523 GLU CA . 26376 1 133 . 1 . 1 29 29 GLU CB C 13 30.20408249 0.2 . 1 . . . . . 1523 GLU CB . 26376 1 134 . 1 . 1 29 29 GLU N N 15 116.8767424 0.2 . 1 . . . . . 1523 GLU N . 26376 1 135 . 1 . 1 30 30 VAL H H 1 7.641256648 0.000407486 . 1 . . . . . 1524 VAL H . 26376 1 136 . 1 . 1 30 30 VAL C C 13 177.1647949 0.2 . 1 . . . . . 1524 VAL C . 26376 1 137 . 1 . 1 30 30 VAL CA C 13 66.72654724 0.2 . 1 . . . . . 1524 VAL CA . 26376 1 138 . 1 . 1 30 30 VAL CB C 13 31.29647827 0.2 . 1 . . . . . 1524 VAL CB . 26376 1 139 . 1 . 1 30 30 VAL N N 15 116.537903 0.004942668 . 1 . . . . . 1524 VAL N . 26376 1 140 . 1 . 1 31 31 ILE H H 1 8.147653835 0.005802494 . 1 . . . . . 1525 ILE H . 26376 1 141 . 1 . 1 31 31 ILE C C 13 176.6856537 0.2 . 1 . . . . . 1525 ILE C . 26376 1 142 . 1 . 1 31 31 ILE CA C 13 64.36065674 0.2 . 1 . . . . . 1525 ILE CA . 26376 1 143 . 1 . 1 31 31 ILE CB C 13 36.3487854 0.2 . 1 . . . . . 1525 ILE CB . 26376 1 144 . 1 . 1 31 31 ILE N N 15 118.972493 0.043040545 . 1 . . . . . 1525 ILE N . 26376 1 145 . 1 . 1 32 32 GLN H H 1 7.973741419 0.005209477 . 1 . . . . . 1526 GLN H . 26376 1 146 . 1 . 1 32 32 GLN C C 13 178.6756744 0.2 . 1 . . . . . 1526 GLN C . 26376 1 147 . 1 . 1 32 32 GLN CA C 13 59.34281158 0.2 . 1 . . . . . 1526 GLN CA . 26376 1 148 . 1 . 1 32 32 GLN CB C 13 28.78115463 0.2 . 1 . . . . . 1526 GLN CB . 26376 1 149 . 1 . 1 32 32 GLN N N 15 114.775074 0.05531488 . 1 . . . . . 1526 GLN N . 26376 1 150 . 1 . 1 33 33 ARG H H 1 7.26550112 0.00027749 . 1 . . . . . 1527 ARG H . 26376 1 151 . 1 . 1 33 33 ARG C C 13 176.5018768 0.2 . 1 . . . . . 1527 ARG C . 26376 1 152 . 1 . 1 33 33 ARG CA C 13 56.99983978 0.2 . 1 . . . . . 1527 ARG CA . 26376 1 153 . 1 . 1 33 33 ARG CB C 13 32.29394913 0.2 . 1 . . . . . 1527 ARG CB . 26376 1 154 . 1 . 1 33 33 ARG N N 15 116.5168033 0.007883329 . 1 . . . . . 1527 ARG N . 26376 1 155 . 1 . 1 34 34 MET H H 1 7.795450211 0.02 . 1 . . . . . 1528 MET H . 26376 1 156 . 1 . 1 34 34 MET C C 13 175.7579956 0 . 1 . . . . . 1528 MET C . 26376 1 157 . 1 . 1 34 34 MET CA C 13 56.41111374 0.2 . 1 . . . . . 1528 MET CA . 26376 1 158 . 1 . 1 34 34 MET CB C 13 37.20809174 0.2 . 1 . . . . . 1528 MET CB . 26376 1 159 . 1 . 1 34 34 MET N N 15 120.5494385 0.2 . 1 . . . . . 1528 MET N . 26376 1 160 . 1 . 1 35 35 ASP H H 1 8.866024971 0.02 . 1 . . . . . 1529 ASP H . 26376 1 161 . 1 . 1 35 35 ASP C C 13 175.2509308 0 . 1 . . . . . 1529 ASP C . 26376 1 162 . 1 . 1 35 35 ASP CB C 13 39.00100327 0 . 1 . . . . . 1529 ASP CB . 26376 1 163 . 1 . 1 35 35 ASP N N 15 124.0209579 0.2 . 1 . . . . . 1529 ASP N . 26376 1 164 . 1 . 1 36 36 VAL H H 1 7.706735861 0.004077282 . 1 . . . . . 1530 VAL H . 26376 1 165 . 1 . 1 36 36 VAL C C 13 176.5435181 0.2 . 1 . . . . . 1530 VAL C . 26376 1 166 . 1 . 1 36 36 VAL CA C 13 61.49500656 0.2 . 1 . . . . . 1530 VAL CA . 26376 1 167 . 1 . 1 36 36 VAL CB C 13 33.34524918 0.2 . 1 . . . . . 1530 VAL CB . 26376 1 168 . 1 . 1 36 36 VAL N N 15 123.2660999 0.01261609 . 1 . . . . . 1530 VAL N . 26376 1 169 . 1 . 1 37 37 GLY H H 1 9.02620167 0.000878055 . 1 . . . . . 1531 GLY H . 26376 1 170 . 1 . 1 37 37 GLY C C 13 173.2095337 0 . 1 . . . . . 1531 GLY C . 26376 1 171 . 1 . 1 37 37 GLY CA C 13 45.49112701 0.2 . 1 . . . . . 1531 GLY CA . 26376 1 172 . 1 . 1 37 37 GLY N N 15 116.9703536 0.005144812 . 1 . . . . . 1531 GLY N . 26376 1 173 . 1 . 1 43 43 VAL H H 1 10.07458736 0.004156626 . 1 . . . . . 1537 VAL H . 26376 1 174 . 1 . 1 43 43 VAL C C 13 174.3172778 0.2 . 1 . . . . . 1537 VAL C . 26376 1 175 . 1 . 1 43 43 VAL CA C 13 60.40549298 0.2 . 1 . . . . . 1537 VAL CA . 26376 1 176 . 1 . 1 43 43 VAL CB C 13 36.33146337 0.2 . 1 . . . . . 1537 VAL CB . 26376 1 177 . 1 . 1 43 43 VAL N N 15 120.3431035 0.048033151 . 1 . . . . . 1537 VAL N . 26376 1 178 . 1 . 1 44 44 THR H H 1 8.493120156 0.002054698 . 1 . . . . . 1538 THR H . 26376 1 179 . 1 . 1 44 44 THR C C 13 172.286499 0.2 . 1 . . . . . 1538 THR C . 26376 1 180 . 1 . 1 44 44 THR CA C 13 57.55187988 0.2 . 1 . . . . . 1538 THR CA . 26376 1 181 . 1 . 1 44 44 THR CB C 13 70.57613373 0.2 . 1 . . . . . 1538 THR CB . 26376 1 182 . 1 . 1 44 44 THR N N 15 117.0486928 0.003758887 . 1 . . . . . 1538 THR N . 26376 1 183 . 1 . 1 45 45 VAL H H 1 8.36175443 0.002069543 . 1 . . . . . 1539 VAL H . 26376 1 184 . 1 . 1 45 45 VAL C C 13 174.2102051 0.2 . 1 . . . . . 1539 VAL C . 26376 1 185 . 1 . 1 45 45 VAL CA C 13 60.85111362 0.2 . 1 . . . . . 1539 VAL CA . 26376 1 186 . 1 . 1 45 45 VAL CB C 13 35.05787659 0.2 . 1 . . . . . 1539 VAL CB . 26376 1 187 . 1 . 1 45 45 VAL N N 15 124.8384591 0.003764035 . 1 . . . . . 1539 VAL N . 26376 1 188 . 1 . 1 46 46 LEU H H 1 9.709143989 0.004344997 . 1 . . . . . 1540 LEU H . 26376 1 189 . 1 . 1 46 46 LEU C C 13 174.7017946 0.2 . 1 . . . . . 1540 LEU C . 26376 1 190 . 1 . 1 46 46 LEU CA C 13 54.89287186 0.2 . 1 . . . . . 1540 LEU CA . 26376 1 191 . 1 . 1 46 46 LEU CB C 13 46.30525765 0.2 . 1 . . . . . 1540 LEU CB . 26376 1 192 . 1 . 1 46 46 LEU N N 15 128.7052468 0.024704529 . 1 . . . . . 1540 LEU N . 26376 1 193 . 1 . 1 47 47 GLN H H 1 9.17757667 0.002085713 . 1 . . . . . 1541 GLN H . 26376 1 194 . 1 . 1 47 47 GLN C C 13 173.8115869 0.2 . 1 . . . . . 1541 GLN C . 26376 1 195 . 1 . 1 47 47 GLN CA C 13 53.61377209 0.2 . 1 . . . . . 1541 GLN CA . 26376 1 196 . 1 . 1 47 47 GLN CB C 13 32.57785668 0.2 . 1 . . . . . 1541 GLN CB . 26376 1 197 . 1 . 1 47 47 GLN N N 15 121.0931519 0.02137357 . 1 . . . . . 1541 GLN N . 26376 1 198 . 1 . 1 48 48 TYR H H 1 8.913689788 0.001346003 . 1 . . . . . 1542 TYR H . 26376 1 199 . 1 . 1 48 48 TYR C C 13 173.2843778 0.2 . 1 . . . . . 1542 TYR C . 26376 1 200 . 1 . 1 48 48 TYR CA C 13 55.50354004 0.2 . 1 . . . . . 1542 TYR CA . 26376 1 201 . 1 . 1 48 48 TYR CB C 13 44.05628204 0.2 . 1 . . . . . 1542 TYR CB . 26376 1 202 . 1 . 1 48 48 TYR N N 15 122.2777041 0.002109141 . 1 . . . . . 1542 TYR N . 26376 1 203 . 1 . 1 49 49 SER H H 1 7.910723367 0.000390764 . 1 . . . . . 1543 SER H . 26376 1 204 . 1 . 1 49 49 SER CA C 13 59.15314484 0.2 . 1 . . . . . 1543 SER CA . 26376 1 205 . 1 . 1 49 49 SER CB C 13 61.28404999 0.2 . 1 . . . . . 1543 SER CB . 26376 1 206 . 1 . 1 49 49 SER N N 15 112.3632121 0.005707 . 1 . . . . . 1543 SER N . 26376 1 207 . 1 . 1 50 50 TYR H H 1 8.853985151 0.000362935 . 1 . . . . . 1544 TYR H . 26376 1 208 . 1 . 1 50 50 TYR CA C 13 58.09991074 0.2 . 1 . . . . . 1544 TYR CA . 26376 1 209 . 1 . 1 50 50 TYR CB C 13 38.45729446 0.2 . 1 . . . . . 1544 TYR CB . 26376 1 210 . 1 . 1 50 50 TYR N N 15 124.6508299 0.00401542 . 1 . . . . . 1544 TYR N . 26376 1 211 . 1 . 1 51 51 MET H H 1 7.507712364 0.02 . 1 . . . . . 1545 MET H . 26376 1 212 . 1 . 1 51 51 MET CA C 13 52.65361786 0 . 1 . . . . . 1545 MET CA . 26376 1 213 . 1 . 1 51 51 MET CB C 13 34.15263367 0 . 1 . . . . . 1545 MET CB . 26376 1 214 . 1 . 1 51 51 MET N N 15 116.7463608 0.2 . 1 . . . . . 1545 MET N . 26376 1 215 . 1 . 1 52 52 VAL H H 1 8.408391837 0.002291503 . 1 . . . . . 1546 VAL H . 26376 1 216 . 1 . 1 52 52 VAL CA C 13 61.60992813 0.2 . 1 . . . . . 1546 VAL CA . 26376 1 217 . 1 . 1 52 52 VAL CB C 13 33.36079407 0.2 . 1 . . . . . 1546 VAL CB . 26376 1 218 . 1 . 1 52 52 VAL N N 15 121.4918172 0.058573511 . 1 . . . . . 1546 VAL N . 26376 1 219 . 1 . 1 53 53 THR H H 1 9.120847522 0.001683945 . 1 . . . . . 1547 THR H . 26376 1 220 . 1 . 1 53 53 THR C C 13 173.8238346 0.2 . 1 . . . . . 1547 THR C . 26376 1 221 . 1 . 1 53 53 THR CB C 13 70.96961095 0.2 . 1 . . . . . 1547 THR CB . 26376 1 222 . 1 . 1 53 53 THR N N 15 122.5020055 0.023838766 . 1 . . . . . 1547 THR N . 26376 1 223 . 1 . 1 54 54 VAL H H 1 8.929497386 0.002905028 . 1 . . . . . 1548 VAL H . 26376 1 224 . 1 . 1 54 54 VAL C C 13 175.4461996 0.2 . 1 . . . . . 1548 VAL C . 26376 1 225 . 1 . 1 54 54 VAL CA C 13 63.18410447 0.2 . 1 . . . . . 1548 VAL CA . 26376 1 226 . 1 . 1 54 54 VAL CB C 13 30.81948853 0.2 . 1 . . . . . 1548 VAL CB . 26376 1 227 . 1 . 1 54 54 VAL N N 15 127.0925907 0.007988518 . 1 . . . . . 1548 VAL N . 26376 1 228 . 1 . 1 55 55 GLU H H 1 8.868916342 0.001315209 . 1 . . . . . 1549 GLU H . 26376 1 229 . 1 . 1 55 55 GLU C C 13 177.560257 0.2 . 1 . . . . . 1549 GLU C . 26376 1 230 . 1 . 1 55 55 GLU CA C 13 55.9157486 0.2 . 1 . . . . . 1549 GLU CA . 26376 1 231 . 1 . 1 55 55 GLU CB C 13 29.0092926 0.2 . 1 . . . . . 1549 GLU CB . 26376 1 232 . 1 . 1 55 55 GLU N N 15 128.9982208 0.087485453 . 1 . . . . . 1549 GLU N . 26376 1 233 . 1 . 1 56 56 TYR H H 1 7.772605482 0.001682476 . 1 . . . . . 1550 TYR H . 26376 1 234 . 1 . 1 56 56 TYR C C 13 173.405304 0.2 . 1 . . . . . 1550 TYR C . 26376 1 235 . 1 . 1 56 56 TYR CA C 13 57.7469101 0.2 . 1 . . . . . 1550 TYR CA . 26376 1 236 . 1 . 1 56 56 TYR CB C 13 42.6989212 0.2 . 1 . . . . . 1550 TYR CB . 26376 1 237 . 1 . 1 56 56 TYR N N 15 118.0658196 0.005057956 . 1 . . . . . 1550 TYR N . 26376 1 238 . 1 . 1 58 58 PHE H H 1 8.309047487 0.001848782 . 1 . . . . . 1552 PHE H . 26376 1 239 . 1 . 1 58 58 PHE C C 13 176.9326172 0.2 . 1 . . . . . 1552 PHE C . 26376 1 240 . 1 . 1 58 58 PHE CA C 13 59.93933105 0.2 . 1 . . . . . 1552 PHE CA . 26376 1 241 . 1 . 1 58 58 PHE CB C 13 38.81628036 0.2 . 1 . . . . . 1552 PHE CB . 26376 1 242 . 1 . 1 58 58 PHE N N 15 116.9072156 0.003632652 . 1 . . . . . 1552 PHE N . 26376 1 243 . 1 . 1 59 59 SER H H 1 7.190518067 0.00096086 . 1 . . . . . 1553 SER H . 26376 1 244 . 1 . 1 59 59 SER C C 13 175.3733673 0.2 . 1 . . . . . 1553 SER C . 26376 1 245 . 1 . 1 59 59 SER CA C 13 58.49410629 0.2 . 1 . . . . . 1553 SER CA . 26376 1 246 . 1 . 1 59 59 SER CB C 13 63.12782669 0.2 . 1 . . . . . 1553 SER CB . 26376 1 247 . 1 . 1 59 59 SER N N 15 105.2964792 0.004736422 . 1 . . . . . 1553 SER N . 26376 1 248 . 1 . 1 60 60 GLU H H 1 6.803872592 0.000915365 . 1 . . . . . 1554 GLU H . 26376 1 249 . 1 . 1 60 60 GLU C C 13 175.0820007 0.2 . 1 . . . . . 1554 GLU C . 26376 1 250 . 1 . 1 60 60 GLU CA C 13 56.0060789 0.2 . 1 . . . . . 1554 GLU CA . 26376 1 251 . 1 . 1 60 60 GLU CB C 13 30.30905983 0.2 . 1 . . . . . 1554 GLU CB . 26376 1 252 . 1 . 1 60 60 GLU N N 15 122.7836457 0.002428337 . 1 . . . . . 1554 GLU N . 26376 1 253 . 1 . 1 61 61 ALA H H 1 8.197348321 0.001222189 . 1 . . . . . 1555 ALA H . 26376 1 254 . 1 . 1 61 61 ALA C C 13 179.2274323 0.2 . 1 . . . . . 1555 ALA C . 26376 1 255 . 1 . 1 61 61 ALA CA C 13 53.70965195 0.2 . 1 . . . . . 1555 ALA CA . 26376 1 256 . 1 . 1 61 61 ALA CB C 13 19.11958313 0.2 . 1 . . . . . 1555 ALA CB . 26376 1 257 . 1 . 1 61 61 ALA N N 15 119.4767319 0.004715839 . 1 . . . . . 1555 ALA N . 26376 1 258 . 1 . 1 62 62 GLN H H 1 8.588222163 0.00230672 . 1 . . . . . 1556 GLN H . 26376 1 259 . 1 . 1 62 62 GLN C C 13 173.7879028 0.2 . 1 . . . . . 1556 GLN C . 26376 1 260 . 1 . 1 62 62 GLN CB C 13 25.61342621 0.2 . 1 . . . . . 1556 GLN CB . 26376 1 261 . 1 . 1 62 62 GLN N N 15 124.7801258 0.001124933 . 1 . . . . . 1556 GLN N . 26376 1 262 . 1 . 1 63 63 SER H H 1 6.754762485 0.000489638 . 1 . . . . . 1557 SER H . 26376 1 263 . 1 . 1 63 63 SER C C 13 175.4014435 0.2 . 1 . . . . . 1557 SER C . 26376 1 264 . 1 . 1 63 63 SER CA C 13 55.6078949 0.2 . 1 . . . . . 1557 SER CA . 26376 1 265 . 1 . 1 63 63 SER CB C 13 64.43718719 0.2 . 1 . . . . . 1557 SER CB . 26376 1 266 . 1 . 1 63 63 SER N N 15 111.5675456 0.002820995 . 1 . . . . . 1557 SER N . 26376 1 267 . 1 . 1 65 65 GLY H H 1 8.820349693 0.02 . 1 . . . . . 1559 GLY H . 26376 1 268 . 1 . 1 65 65 GLY CA C 13 47.31639481 0.2 . 1 . . . . . 1559 GLY CA . 26376 1 269 . 1 . 1 65 65 GLY N N 15 103.9827236 0.2 . 1 . . . . . 1559 GLY N . 26376 1 270 . 1 . 1 66 66 ASP H H 1 7.331138305 0.00202703 . 1 . . . . . 1560 ASP H . 26376 1 271 . 1 . 1 66 66 ASP C C 13 178.5292969 0.2 . 1 . . . . . 1560 ASP C . 26376 1 272 . 1 . 1 66 66 ASP CA C 13 57.43040466 0.2 . 1 . . . . . 1560 ASP CA . 26376 1 273 . 1 . 1 66 66 ASP CB C 13 41.25179536 0.2 . 1 . . . . . 1560 ASP CB . 26376 1 274 . 1 . 1 66 66 ASP N N 15 121.2831004 0.008575574 . 1 . . . . . 1560 ASP N . 26376 1 275 . 1 . 1 67 67 ILE H H 1 7.827848395 0.02 . 1 . . . . . 1561 ILE H . 26376 1 276 . 1 . 1 67 67 ILE C C 13 177.9995422 0 . 1 . . . . . 1561 ILE C . 26376 1 277 . 1 . 1 67 67 ILE CA C 13 65.12379456 0.2 . 1 . . . . . 1561 ILE CA . 26376 1 278 . 1 . 1 67 67 ILE CB C 13 38.16487503 0.2 . 1 . . . . . 1561 ILE CB . 26376 1 279 . 1 . 1 67 67 ILE N N 15 120.5653095 0.2 . 1 . . . . . 1561 ILE N . 26376 1 280 . 1 . 1 68 68 LEU H H 1 8.548519847 0.00027882 . 1 . . . . . 1562 LEU H . 26376 1 281 . 1 . 1 68 68 LEU C C 13 178.7718353 0.2 . 1 . . . . . 1562 LEU C . 26376 1 282 . 1 . 1 68 68 LEU CA C 13 58.28100586 0.2 . 1 . . . . . 1562 LEU CA . 26376 1 283 . 1 . 1 68 68 LEU CB C 13 41.3221283 0.2 . 1 . . . . . 1562 LEU CB . 26376 1 284 . 1 . 1 68 68 LEU N N 15 118.2119556 0.004084043 . 1 . . . . . 1562 LEU N . 26376 1 285 . 1 . 1 69 69 GLN H H 1 7.498558044 0.02 . 1 . . . . . 1563 GLN H . 26376 1 286 . 1 . 1 69 69 GLN C C 13 177.7174988 0.2 . 1 . . . . . 1563 GLN C . 26376 1 287 . 1 . 1 69 69 GLN CA C 13 58.79101181 0.2 . 1 . . . . . 1563 GLN CA . 26376 1 288 . 1 . 1 69 69 GLN CB C 13 27.90826416 0.2 . 1 . . . . . 1563 GLN CB . 26376 1 289 . 1 . 1 69 69 GLN N N 15 116.747757 0.2 . 1 . . . . . 1563 GLN N . 26376 1 290 . 1 . 1 70 70 ARG H H 1 7.369757722 0.000436694 . 1 . . . . . 1564 ARG H . 26376 1 291 . 1 . 1 70 70 ARG C C 13 179.8630676 0.2 . 1 . . . . . 1564 ARG C . 26376 1 292 . 1 . 1 70 70 ARG CA C 13 57.59308624 0.2 . 1 . . . . . 1564 ARG CA . 26376 1 293 . 1 . 1 70 70 ARG CB C 13 29.1819288 0.2 . 1 . . . . . 1564 ARG CB . 26376 1 294 . 1 . 1 70 70 ARG N N 15 117.3621006 0.004786296 . 1 . . . . . 1564 ARG N . 26376 1 295 . 1 . 1 71 71 VAL H H 1 8.783833371 0.000845775 . 1 . . . . . 1565 VAL H . 26376 1 296 . 1 . 1 71 71 VAL C C 13 177.7417908 0.2 . 1 . . . . . 1565 VAL C . 26376 1 297 . 1 . 1 71 71 VAL CA C 13 65.89370728 0.2 . 1 . . . . . 1565 VAL CA . 26376 1 298 . 1 . 1 71 71 VAL CB C 13 30.94664383 0.2 . 1 . . . . . 1565 VAL CB . 26376 1 299 . 1 . 1 71 71 VAL N N 15 119.0617207 0.001006212 . 1 . . . . . 1565 VAL N . 26376 1 300 . 1 . 1 72 72 ARG H H 1 7.685584554 0.000809314 . 1 . . . . . 1566 ARG H . 26376 1 301 . 1 . 1 72 72 ARG C C 13 178.7188212 0.212569373 . 1 . . . . . 1566 ARG C . 26376 1 302 . 1 . 1 72 72 ARG CA C 13 58.82928085 0.2 . 1 . . . . . 1566 ARG CA . 26376 1 303 . 1 . 1 72 72 ARG CB C 13 29.32204247 0.2 . 1 . . . . . 1566 ARG CB . 26376 1 304 . 1 . 1 72 72 ARG N N 15 116.9290605 0.018905549 . 1 . . . . . 1566 ARG N . 26376 1 305 . 1 . 1 73 73 GLU H H 1 7.336171442 0.000529644 . 1 . . . . . 1567 GLU H . 26376 1 306 . 1 . 1 73 73 GLU C C 13 177.0657806 0.2 . 1 . . . . . 1567 GLU C . 26376 1 307 . 1 . 1 73 73 GLU CA C 13 55.84566879 0.2 . 1 . . . . . 1567 GLU CA . 26376 1 308 . 1 . 1 73 73 GLU CB C 13 29.50485611 0.2 . 1 . . . . . 1567 GLU CB . 26376 1 309 . 1 . 1 73 73 GLU N N 15 116.5643286 0.006805753 . 1 . . . . . 1567 GLU N . 26376 1 310 . 1 . 1 74 74 ILE H H 1 7.423745456 0.000428327 . 1 . . . . . 1568 ILE H . 26376 1 311 . 1 . 1 74 74 ILE C C 13 175.8650208 0.2 . 1 . . . . . 1568 ILE C . 26376 1 312 . 1 . 1 74 74 ILE CA C 13 64.00659943 0.2 . 1 . . . . . 1568 ILE CA . 26376 1 313 . 1 . 1 74 74 ILE CB C 13 38.4750824 0.2 . 1 . . . . . 1568 ILE CB . 26376 1 314 . 1 . 1 74 74 ILE N N 15 120.9121401 0.001946737 . 1 . . . . . 1568 ILE N . 26376 1 315 . 1 . 1 75 75 ARG H H 1 9.12934024 0.00072871 . 1 . . . . . 1569 ARG H . 26376 1 316 . 1 . 1 75 75 ARG C C 13 176.0750204 0.2 . 1 . . . . . 1569 ARG C . 26376 1 317 . 1 . 1 75 75 ARG CA C 13 54.29048288 0.2 . 1 . . . . . 1569 ARG CA . 26376 1 318 . 1 . 1 75 75 ARG CB C 13 31.22513864 0.2 . 1 . . . . . 1569 ARG CB . 26376 1 319 . 1 . 1 75 75 ARG N N 15 129.2262126 0.003059488 . 1 . . . . . 1569 ARG N . 26376 1 320 . 1 . 1 76 76 TYR H H 1 8.765007395 0.00160924 . 1 . . . . . 1570 TYR H . 26376 1 321 . 1 . 1 76 76 TYR C C 13 175.5178833 0.2 . 1 . . . . . 1570 TYR C . 26376 1 322 . 1 . 1 76 76 TYR CA C 13 56.97527695 0.2 . 1 . . . . . 1570 TYR CA . 26376 1 323 . 1 . 1 76 76 TYR CB C 13 38.81892395 0.2 . 1 . . . . . 1570 TYR CB . 26376 1 324 . 1 . 1 76 76 TYR N N 15 129.191607 0.004380731 . 1 . . . . . 1570 TYR N . 26376 1 325 . 1 . 1 77 77 GLN H H 1 8.956191425 0.000664636 . 1 . . . . . 1571 GLN H . 26376 1 326 . 1 . 1 77 77 GLN C C 13 177.3026276 0.2 . 1 . . . . . 1571 GLN C . 26376 1 327 . 1 . 1 77 77 GLN CB C 13 29.17634392 0.2 . 1 . . . . . 1571 GLN CB . 26376 1 328 . 1 . 1 77 77 GLN N N 15 128.770686 0.004200992 . 1 . . . . . 1571 GLN N . 26376 1 329 . 1 . 1 78 78 GLY H H 1 6.286904987 0.000650712 . 1 . . . . . 1572 GLY H . 26376 1 330 . 1 . 1 78 78 GLY C C 13 174.3592377 0.2 . 1 . . . . . 1572 GLY C . 26376 1 331 . 1 . 1 78 78 GLY CA C 13 45.81703568 0.2 . 1 . . . . . 1572 GLY CA . 26376 1 332 . 1 . 1 78 78 GLY N N 15 107.0965754 0.005385381 . 1 . . . . . 1572 GLY N . 26376 1 333 . 1 . 1 79 79 GLY H H 1 7.818317424 0.000941002 . 1 . . . . . 1573 GLY H . 26376 1 334 . 1 . 1 79 79 GLY C C 13 175.5485992 0.2 . 1 . . . . . 1573 GLY C . 26376 1 335 . 1 . 1 79 79 GLY N N 15 105.1611103 0.000320028 . 1 . . . . . 1573 GLY N . 26376 1 336 . 1 . 1 81 81 ARG H H 1 7.101819329 0.000352707 . 1 . . . . . 1575 ARG H . 26376 1 337 . 1 . 1 81 81 ARG C C 13 172.9730835 0.2 . 1 . . . . . 1575 ARG C . 26376 1 338 . 1 . 1 81 81 ARG CA C 13 53.93003464 0.2 . 1 . . . . . 1575 ARG CA . 26376 1 339 . 1 . 1 81 81 ARG CB C 13 35.24007416 0.2 . 1 . . . . . 1575 ARG CB . 26376 1 340 . 1 . 1 81 81 ARG N N 15 116.2424433 0.003146303 . 1 . . . . . 1575 ARG N . 26376 1 341 . 1 . 1 82 82 THR H H 1 8.540663364 0.00070052 . 1 . . . . . 1576 THR H . 26376 1 342 . 1 . 1 82 82 THR C C 13 175.5961914 0.2 . 1 . . . . . 1576 THR C . 26376 1 343 . 1 . 1 82 82 THR CA C 13 61.04008102 0.2 . 1 . . . . . 1576 THR CA . 26376 1 344 . 1 . 1 82 82 THR CB C 13 69.4263382 0.2 . 1 . . . . . 1576 THR CB . 26376 1 345 . 1 . 1 82 82 THR N N 15 117.6562505 0.003067194 . 1 . . . . . 1576 THR N . 26376 1 346 . 1 . 1 83 83 ASN H H 1 8.886141135 0.004160804 . 1 . . . . . 1577 ASN H . 26376 1 347 . 1 . 1 83 83 ASN C C 13 174.2944361 0.2 . 1 . . . . . 1577 ASN C . 26376 1 348 . 1 . 1 83 83 ASN CA C 13 52.49886322 0.2 . 1 . . . . . 1577 ASN CA . 26376 1 349 . 1 . 1 83 83 ASN CB C 13 35.80851746 0.2 . 1 . . . . . 1577 ASN CB . 26376 1 350 . 1 . 1 83 83 ASN N N 15 128.7080415 0.033763125 . 1 . . . . . 1577 ASN N . 26376 1 351 . 1 . 1 84 84 THR H H 1 8.379859112 0.000736659 . 1 . . . . . 1578 THR H . 26376 1 352 . 1 . 1 84 84 THR C C 13 175.3107758 0.2 . 1 . . . . . 1578 THR C . 26376 1 353 . 1 . 1 84 84 THR CA C 13 65.39577484 0.2 . 1 . . . . . 1578 THR CA . 26376 1 354 . 1 . 1 84 84 THR CB C 13 70.09860229 0.2 . 1 . . . . . 1578 THR CB . 26376 1 355 . 1 . 1 84 84 THR N N 15 121.9105096 0.016764818 . 1 . . . . . 1578 THR N . 26376 1 356 . 1 . 1 85 85 GLY H H 1 11.34210848 0.000176085 . 1 . . . . . 1579 GLY H . 26376 1 357 . 1 . 1 85 85 GLY C C 13 177.6955191 0.2 . 1 . . . . . 1579 GLY C . 26376 1 358 . 1 . 1 85 85 GLY CA C 13 47.65576935 0.2 . 1 . . . . . 1579 GLY CA . 26376 1 359 . 1 . 1 85 85 GLY N N 15 116.1986352 0.016390835 . 1 . . . . . 1579 GLY N . 26376 1 360 . 1 . 1 86 86 LEU H H 1 8.900094509 0.000496674 . 1 . . . . . 1580 LEU H . 26376 1 361 . 1 . 1 86 86 LEU C C 13 179.0248871 0.2 . 1 . . . . . 1580 LEU C . 26376 1 362 . 1 . 1 86 86 LEU CA C 13 57.75349045 0.2 . 1 . . . . . 1580 LEU CA . 26376 1 363 . 1 . 1 86 86 LEU CB C 13 42.22927856 0.2 . 1 . . . . . 1580 LEU CB . 26376 1 364 . 1 . 1 86 86 LEU N N 15 127.7365824 0.0025027 . 1 . . . . . 1580 LEU N . 26376 1 365 . 1 . 1 87 87 ALA H H 1 7.729311049 0.001902529 . 1 . . . . . 1581 ALA H . 26376 1 366 . 1 . 1 87 87 ALA C C 13 178.1913757 0.2 . 1 . . . . . 1581 ALA C . 26376 1 367 . 1 . 1 87 87 ALA CA C 13 55.36607361 0.2 . 1 . . . . . 1581 ALA CA . 26376 1 368 . 1 . 1 87 87 ALA N N 15 121.465888 0.005063572 . 1 . . . . . 1581 ALA N . 26376 1 369 . 1 . 1 88 88 LEU H H 1 7.962857813 0.001505219 . 1 . . . . . 1582 LEU H . 26376 1 370 . 1 . 1 88 88 LEU C C 13 179.146347 0.2 . 1 . . . . . 1582 LEU C . 26376 1 371 . 1 . 1 88 88 LEU CA C 13 58.1597242 0.2 . 1 . . . . . 1582 LEU CA . 26376 1 372 . 1 . 1 88 88 LEU CB C 13 41.25294305 0.2 . 1 . . . . . 1582 LEU CB . 26376 1 373 . 1 . 1 88 88 LEU N N 15 115.5207618 0.107014058 . 1 . . . . . 1582 LEU N . 26376 1 374 . 1 . 1 89 89 ARG H H 1 7.975495486 0.00040928 . 1 . . . . . 1583 ARG H . 26376 1 375 . 1 . 1 89 89 ARG C C 13 178.0820007 0.2 . 1 . . . . . 1583 ARG C . 26376 1 376 . 1 . 1 89 89 ARG CB C 13 29.72242355 0.2 . 1 . . . . . 1583 ARG CB . 26376 1 377 . 1 . 1 89 89 ARG N N 15 118.0551898 0.002105321 . 1 . . . . . 1583 ARG N . 26376 1 378 . 1 . 1 90 90 TYR H H 1 8.47558451 0.001186918 . 1 . . . . . 1584 TYR H . 26376 1 379 . 1 . 1 90 90 TYR C C 13 178.5908966 0.2 . 1 . . . . . 1584 TYR C . 26376 1 380 . 1 . 1 90 90 TYR CA C 13 62.02770233 0.2 . 1 . . . . . 1584 TYR CA . 26376 1 381 . 1 . 1 90 90 TYR CB C 13 39.27281952 0.2 . 1 . . . . . 1584 TYR CB . 26376 1 382 . 1 . 1 90 90 TYR N N 15 121.19742 0.001328486 . 1 . . . . . 1584 TYR N . 26376 1 383 . 1 . 1 91 91 LEU H H 1 7.792641906 0.001379642 . 1 . . . . . 1585 LEU H . 26376 1 384 . 1 . 1 91 91 LEU C C 13 178.1316376 0.2 . 1 . . . . . 1585 LEU C . 26376 1 385 . 1 . 1 91 91 LEU CA C 13 57.77314758 0.2 . 1 . . . . . 1585 LEU CA . 26376 1 386 . 1 . 1 91 91 LEU CB C 13 41.95437622 0.2 . 1 . . . . . 1585 LEU CB . 26376 1 387 . 1 . 1 91 91 LEU N N 15 117.0526184 0.002538969 . 1 . . . . . 1585 LEU N . 26376 1 388 . 1 . 1 92 92 SER H H 1 7.336997365 0.002098637 . 1 . . . . . 1586 SER H . 26376 1 389 . 1 . 1 92 92 SER C C 13 175.9053802 0.2 . 1 . . . . . 1586 SER C . 26376 1 390 . 1 . 1 92 92 SER CA C 13 60.25366974 0.2 . 1 . . . . . 1586 SER CA . 26376 1 391 . 1 . 1 92 92 SER CB C 13 63.60560608 0.2 . 1 . . . . . 1586 SER CB . 26376 1 392 . 1 . 1 92 92 SER N N 15 109.947313 0.004256575 . 1 . . . . . 1586 SER N . 26376 1 393 . 1 . 1 93 93 ASP H H 1 8.38656044 0.02 . 1 . . . . . 1587 ASP H . 26376 1 394 . 1 . 1 93 93 ASP CA C 13 55.35145569 0 . 1 . . . . . 1587 ASP CA . 26376 1 395 . 1 . 1 93 93 ASP CB C 13 40.88166428 0 . 1 . . . . . 1587 ASP CB . 26376 1 396 . 1 . 1 93 93 ASP N N 15 118.9818954 0.2 . 1 . . . . . 1587 ASP N . 26376 1 397 . 1 . 1 94 94 HIS H H 1 7.978471121 0.001526696 . 1 . . . . . 1588 HIS H . 26376 1 398 . 1 . 1 94 94 HIS C C 13 174.9809265 0.2 . 1 . . . . . 1588 HIS C . 26376 1 399 . 1 . 1 94 94 HIS CA C 13 58.39530563 0.2 . 1 . . . . . 1588 HIS CA . 26376 1 400 . 1 . 1 94 94 HIS CB C 13 32.14352036 0.2 . 1 . . . . . 1588 HIS CB . 26376 1 401 . 1 . 1 94 94 HIS N N 15 116.0151763 0.003011982 . 1 . . . . . 1588 HIS N . 26376 1 402 . 1 . 1 95 95 SER H H 1 7.538193718 0.000974072 . 1 . . . . . 1589 SER H . 26376 1 403 . 1 . 1 95 95 SER CA C 13 63.86139297 0.2 . 1 . . . . . 1589 SER CA . 26376 1 404 . 1 . 1 95 95 SER CB C 13 62.69171524 0 . 1 . . . . . 1589 SER CB . 26376 1 405 . 1 . 1 95 95 SER N N 15 113.1562015 0.002278915 . 1 . . . . . 1589 SER N . 26376 1 406 . 1 . 1 96 96 PHE H H 1 7.987439926 0.02 . 1 . . . . . 1590 PHE H . 26376 1 407 . 1 . 1 96 96 PHE C C 13 174.7394867 0.2 . 1 . . . . . 1590 PHE C . 26376 1 408 . 1 . 1 96 96 PHE CA C 13 58.26107407 0 . 1 . . . . . 1590 PHE CA . 26376 1 409 . 1 . 1 96 96 PHE CB C 13 36.29393387 0.2 . 1 . . . . . 1590 PHE CB . 26376 1 410 . 1 . 1 96 96 PHE N N 15 114.9282281 0.2 . 1 . . . . . 1590 PHE N . 26376 1 411 . 1 . 1 97 97 LEU H H 1 7.221095468 0.001054508 . 1 . . . . . 1591 LEU H . 26376 1 412 . 1 . 1 97 97 LEU C C 13 180.1186523 0.2 . 1 . . . . . 1591 LEU C . 26376 1 413 . 1 . 1 97 97 LEU CA C 13 53.51747894 0.2 . 1 . . . . . 1591 LEU CA . 26376 1 414 . 1 . 1 97 97 LEU CB C 13 44.09063339 0.2 . 1 . . . . . 1591 LEU CB . 26376 1 415 . 1 . 1 97 97 LEU N N 15 118.3767602 0.001369452 . 1 . . . . . 1591 LEU N . 26376 1 416 . 1 . 1 100 100 GLN H H 1 7.408663767 0.000733247 . 1 . . . . . 1594 GLN H . 26376 1 417 . 1 . 1 100 100 GLN C C 13 176.1767273 0.2 . 1 . . . . . 1594 GLN C . 26376 1 418 . 1 . 1 100 100 GLN CA C 13 54.43305969 0.2 . 1 . . . . . 1594 GLN CA . 26376 1 419 . 1 . 1 100 100 GLN CB C 13 28.40941238 0.2 . 1 . . . . . 1594 GLN CB . 26376 1 420 . 1 . 1 100 100 GLN N N 15 118.4279739 0.000198749 . 1 . . . . . 1594 GLN N . 26376 1 421 . 1 . 1 101 101 GLY H H 1 7.869262063 0.001945265 . 1 . . . . . 1595 GLY H . 26376 1 422 . 1 . 1 101 101 GLY C C 13 174.590683 0.2 . 1 . . . . . 1595 GLY C . 26376 1 423 . 1 . 1 101 101 GLY CA C 13 45.17189789 0.2 . 1 . . . . . 1595 GLY CA . 26376 1 424 . 1 . 1 101 101 GLY N N 15 105.5359283 0.0041958 . 1 . . . . . 1595 GLY N . 26376 1 425 . 1 . 1 102 102 ASP H H 1 7.73814909 0.003256389 . 1 . . . . . 1596 ASP H . 26376 1 426 . 1 . 1 102 102 ASP C C 13 175.65802 0.2 . 1 . . . . . 1596 ASP C . 26376 1 427 . 1 . 1 102 102 ASP CA C 13 55.97052765 0.2 . 1 . . . . . 1596 ASP CA . 26376 1 428 . 1 . 1 102 102 ASP CB C 13 41.85298538 0.2 . 1 . . . . . 1596 ASP CB . 26376 1 429 . 1 . 1 102 102 ASP N N 15 122.0366128 0.008788996 . 1 . . . . . 1596 ASP N . 26376 1 430 . 1 . 1 103 103 ARG H H 1 7.746820632 0.002577721 . 1 . . . . . 1597 ARG H . 26376 1 431 . 1 . 1 103 103 ARG C C 13 178.6507111 0.2 . 1 . . . . . 1597 ARG C . 26376 1 432 . 1 . 1 103 103 ARG CA C 13 54.88433838 0.2 . 1 . . . . . 1597 ARG CA . 26376 1 433 . 1 . 1 103 103 ARG CB C 13 30.64523315 0.2 . 1 . . . . . 1597 ARG CB . 26376 1 434 . 1 . 1 103 103 ARG N N 15 123.1541124 0.003321375 . 1 . . . . . 1597 ARG N . 26376 1 435 . 1 . 1 106 106 ALA H H 1 6.926854146 0.000485273 . 1 . . . . . 1600 ALA H . 26376 1 436 . 1 . 1 106 106 ALA C C 13 173.671051 0.2 . 1 . . . . . 1600 ALA C . 26376 1 437 . 1 . 1 106 106 ALA CA C 13 48.44796371 0.2 . 1 . . . . . 1600 ALA CA . 26376 1 438 . 1 . 1 106 106 ALA CB C 13 21.00253677 0.2 . 1 . . . . . 1600 ALA CB . 26376 1 439 . 1 . 1 106 106 ALA N N 15 122.7821218 0.011883076 . 1 . . . . . 1600 ALA N . 26376 1 440 . 1 . 1 108 108 ASN H H 1 8.234414388 0.001174051 . 1 . . . . . 1602 ASN H . 26376 1 441 . 1 . 1 108 108 ASN C C 13 174.3382874 0.2 . 1 . . . . . 1602 ASN C . 26376 1 442 . 1 . 1 108 108 ASN CA C 13 51.55459976 0.2 . 1 . . . . . 1602 ASN CA . 26376 1 443 . 1 . 1 108 108 ASN CB C 13 39.87047958 0.2 . 1 . . . . . 1602 ASN CB . 26376 1 444 . 1 . 1 108 108 ASN N N 15 117.7994152 0.009880865 . 1 . . . . . 1602 ASN N . 26376 1 445 . 1 . 1 109 109 LEU H H 1 9.078156935 0.004702882 . 1 . . . . . 1603 LEU H . 26376 1 446 . 1 . 1 109 109 LEU C C 13 173.544655 0.2 . 1 . . . . . 1603 LEU C . 26376 1 447 . 1 . 1 109 109 LEU CA C 13 53.66374588 0.2 . 1 . . . . . 1603 LEU CA . 26376 1 448 . 1 . 1 109 109 LEU CB C 13 46.97454071 0.2 . 1 . . . . . 1603 LEU CB . 26376 1 449 . 1 . 1 109 109 LEU N N 15 128.1624436 0.027187846 . 1 . . . . . 1603 LEU N . 26376 1 450 . 1 . 1 110 110 VAL H H 1 8.624959588 0.000812658 . 1 . . . . . 1604 VAL H . 26376 1 451 . 1 . 1 110 110 VAL C C 13 174.0486908 0.2 . 1 . . . . . 1604 VAL C . 26376 1 452 . 1 . 1 110 110 VAL CA C 13 59.5493927 0.2 . 1 . . . . . 1604 VAL CA . 26376 1 453 . 1 . 1 110 110 VAL CB C 13 35.131073 0.2 . 1 . . . . . 1604 VAL CB . 26376 1 454 . 1 . 1 110 110 VAL N N 15 123.4311846 0.008293769 . 1 . . . . . 1604 VAL N . 26376 1 455 . 1 . 1 111 111 TYR H H 1 9.023019213 0.000988621 . 1 . . . . . 1605 TYR H . 26376 1 456 . 1 . 1 111 111 TYR C C 13 174.5942862 0.2 . 1 . . . . . 1605 TYR C . 26376 1 457 . 1 . 1 111 111 TYR CA C 13 56.68323517 0.2 . 1 . . . . . 1605 TYR CA . 26376 1 458 . 1 . 1 111 111 TYR CB C 13 40.08283698 0.2 . 1 . . . . . 1605 TYR CB . 26376 1 459 . 1 . 1 111 111 TYR N N 15 124.0710163 0.015835189 . 1 . . . . . 1605 TYR N . 26376 1 460 . 1 . 1 112 112 MET H H 1 7.484793121 0.001130684 . 1 . . . . . 1606 MET H . 26376 1 461 . 1 . 1 112 112 MET C C 13 173.2611084 0.2 . 1 . . . . . 1606 MET C . 26376 1 462 . 1 . 1 112 112 MET CA C 13 53.07275772 0.2 . 1 . . . . . 1606 MET CA . 26376 1 463 . 1 . 1 112 112 MET CB C 13 37.2474556 0.2 . 1 . . . . . 1606 MET CB . 26376 1 464 . 1 . 1 112 112 MET N N 15 123.4814212 0.003554951 . 1 . . . . . 1606 MET N . 26376 1 465 . 1 . 1 113 113 VAL H H 1 9.432994871 0.001615613 . 1 . . . . . 1607 VAL H . 26376 1 466 . 1 . 1 113 113 VAL C C 13 174.3151686 0.2 . 1 . . . . . 1607 VAL C . 26376 1 467 . 1 . 1 113 113 VAL CA C 13 62.03008898 0.2 . 1 . . . . . 1607 VAL CA . 26376 1 468 . 1 . 1 113 113 VAL CB C 13 32.55686188 0.2 . 1 . . . . . 1607 VAL CB . 26376 1 469 . 1 . 1 113 113 VAL N N 15 128.1300704 0.023667387 . 1 . . . . . 1607 VAL N . 26376 1 470 . 1 . 1 114 114 THR H H 1 8.751001008 0.000766783 . 1 . . . . . 1608 THR H . 26376 1 471 . 1 . 1 114 114 THR C C 13 171.111496 0.2 . 1 . . . . . 1608 THR C . 26376 1 472 . 1 . 1 114 114 THR CA C 13 58.84758759 0.2 . 1 . . . . . 1608 THR CA . 26376 1 473 . 1 . 1 114 114 THR CB C 13 70.40570068 0.2 . 1 . . . . . 1608 THR CB . 26376 1 474 . 1 . 1 114 114 THR N N 15 120.2897486 0.003568465 . 1 . . . . . 1608 THR N . 26376 1 475 . 1 . 1 115 115 GLY H H 1 8.90907968 0.00107983 . 1 . . . . . 1609 GLY H . 26376 1 476 . 1 . 1 115 115 GLY C C 13 172.4777069 0.2 . 1 . . . . . 1609 GLY C . 26376 1 477 . 1 . 1 115 115 GLY CA C 13 44.52186584 0.2 . 1 . . . . . 1609 GLY CA . 26376 1 478 . 1 . 1 115 115 GLY N N 15 111.7394572 0.003529725 . 1 . . . . . 1609 GLY N . 26376 1 479 . 1 . 1 116 116 ASN H H 1 7.656947284 0.006258415 . 1 . . . . . 1610 ASN H . 26376 1 480 . 1 . 1 116 116 ASN C C 13 171.7207489 0.2 . 1 . . . . . 1610 ASN C . 26376 1 481 . 1 . 1 116 116 ASN CA C 13 52.53601456 0.2 . 1 . . . . . 1610 ASN CA . 26376 1 482 . 1 . 1 116 116 ASN CB C 13 41.94934464 0.2 . 1 . . . . . 1610 ASN CB . 26376 1 483 . 1 . 1 116 116 ASN N N 15 116.3087379 0.00386008 . 1 . . . . . 1610 ASN N . 26376 1 484 . 1 . 1 118 118 ALA H H 1 10.33170511 0.000888718 . 1 . . . . . 1612 ALA H . 26376 1 485 . 1 . 1 118 118 ALA C C 13 180.040671 0.2 . 1 . . . . . 1612 ALA C . 26376 1 486 . 1 . 1 118 118 ALA CA C 13 53.29722214 0.2 . 1 . . . . . 1612 ALA CA . 26376 1 487 . 1 . 1 118 118 ALA CB C 13 20.03007698 0.2 . 1 . . . . . 1612 ALA CB . 26376 1 488 . 1 . 1 118 118 ALA N N 15 126.255087 0.01765487 . 1 . . . . . 1612 ALA N . 26376 1 489 . 1 . 1 119 119 SER H H 1 9.355890057 0.001004985 . 1 . . . . . 1613 SER H . 26376 1 490 . 1 . 1 119 119 SER C C 13 172.4981842 0.2 . 1 . . . . . 1613 SER C . 26376 1 491 . 1 . 1 119 119 SER CA C 13 59.54621124 0.2 . 1 . . . . . 1613 SER CA . 26376 1 492 . 1 . 1 119 119 SER CB C 13 63.31015778 0.2 . 1 . . . . . 1613 SER CB . 26376 1 493 . 1 . 1 119 119 SER N N 15 117.2442226 0.003453767 . 1 . . . . . 1613 SER N . 26376 1 494 . 1 . 1 120 120 ASP H H 1 8.689498883 0.003405643 . 1 . . . . . 1614 ASP H . 26376 1 495 . 1 . 1 120 120 ASP C C 13 173.870224 0.2 . 1 . . . . . 1614 ASP C . 26376 1 496 . 1 . 1 120 120 ASP CA C 13 51.18084335 0.2 . 1 . . . . . 1614 ASP CA . 26376 1 497 . 1 . 1 120 120 ASP CB C 13 41.44976807 0.2 . 1 . . . . . 1614 ASP CB . 26376 1 498 . 1 . 1 120 120 ASP N N 15 121.8100999 0.005780967 . 1 . . . . . 1614 ASP N . 26376 1 499 . 1 . 1 121 121 GLU H H 1 7.738400581 0.000293236 . 1 . . . . . 1615 GLU H . 26376 1 500 . 1 . 1 121 121 GLU C C 13 176.2898102 0.2 . 1 . . . . . 1615 GLU C . 26376 1 501 . 1 . 1 121 121 GLU CA C 13 56.11711884 0.2 . 1 . . . . . 1615 GLU CA . 26376 1 502 . 1 . 1 121 121 GLU CB C 13 30.66307068 0.2 . 1 . . . . . 1615 GLU CB . 26376 1 503 . 1 . 1 121 121 GLU N N 15 117.3291291 0.004558103 . 1 . . . . . 1615 GLU N . 26376 1 504 . 1 . 1 122 122 ILE H H 1 8.554872039 0.001268785 . 1 . . . . . 1616 ILE H . 26376 1 505 . 1 . 1 122 122 ILE C C 13 175.185257 0.2 . 1 . . . . . 1616 ILE C . 26376 1 506 . 1 . 1 122 122 ILE CA C 13 60.42296219 0.2 . 1 . . . . . 1616 ILE CA . 26376 1 507 . 1 . 1 122 122 ILE CB C 13 39.33252335 0.2 . 1 . . . . . 1616 ILE CB . 26376 1 508 . 1 . 1 122 122 ILE N N 15 123.6005325 0.004616038 . 1 . . . . . 1616 ILE N . 26376 1 509 . 1 . 1 123 123 LYS H H 1 7.876160828 0.000383065 . 1 . . . . . 1617 LYS H . 26376 1 510 . 1 . 1 123 123 LYS C C 13 174.8602905 0.2 . 1 . . . . . 1617 LYS C . 26376 1 511 . 1 . 1 123 123 LYS CA C 13 54.62173138 0.2 . 1 . . . . . 1617 LYS CA . 26376 1 512 . 1 . 1 123 123 LYS CB C 13 34.56220662 0.2 . 1 . . . . . 1617 LYS CB . 26376 1 513 . 1 . 1 123 123 LYS N N 15 126.1330061 0.001028969 . 1 . . . . . 1617 LYS N . 26376 1 514 . 1 . 1 124 124 ARG H H 1 8.319913405 0.02 . 1 . . . . . 1618 ARG H . 26376 1 515 . 1 . 1 124 124 ARG C C 13 176.6078796 0 . 1 . . . . . 1618 ARG C . 26376 1 516 . 1 . 1 124 124 ARG CA C 13 56.60877991 0.2 . 1 . . . . . 1618 ARG CA . 26376 1 517 . 1 . 1 124 124 ARG CB C 13 30.43799973 0.2 . 1 . . . . . 1618 ARG CB . 26376 1 518 . 1 . 1 124 124 ARG N N 15 121.9537599 0.2 . 1 . . . . . 1618 ARG N . 26376 1 519 . 1 . 1 125 125 LEU H H 1 8.704352694 0.02 . 1 . . . . . 1619 LEU H . 26376 1 520 . 1 . 1 125 125 LEU C C 13 175.3642883 0.2 . 1 . . . . . 1619 LEU C . 26376 1 521 . 1 . 1 125 125 LEU CA C 13 53.0873642 0.2 . 1 . . . . . 1619 LEU CA . 26376 1 522 . 1 . 1 125 125 LEU CB C 13 41.41898727 0.2 . 1 . . . . . 1619 LEU CB . 26376 1 523 . 1 . 1 125 125 LEU N N 15 125.0656867 0.2 . 1 . . . . . 1619 LEU N . 26376 1 524 . 1 . 1 127 127 GLY H H 1 8.496141434 0.02 . 1 . . . . . 1621 GLY H . 26376 1 525 . 1 . 1 127 127 GLY CA C 13 46.34707642 0 . 1 . . . . . 1621 GLY CA . 26376 1 526 . 1 . 1 127 127 GLY N N 15 106.3049011 0.2 . 1 . . . . . 1621 GLY N . 26376 1 527 . 1 . 1 128 128 ASP H H 1 8.047681646 0.001942771 . 1 . . . . . 1622 ASP H . 26376 1 528 . 1 . 1 128 128 ASP C C 13 176.0534973 0.2 . 1 . . . . . 1622 ASP C . 26376 1 529 . 1 . 1 128 128 ASP CA C 13 54.02848053 0.2 . 1 . . . . . 1622 ASP CA . 26376 1 530 . 1 . 1 128 128 ASP CB C 13 39.75628662 0.2 . 1 . . . . . 1622 ASP CB . 26376 1 531 . 1 . 1 128 128 ASP N N 15 116.4867289 0.005342827 . 1 . . . . . 1622 ASP N . 26376 1 532 . 1 . 1 129 129 ILE H H 1 7.956421812 0.02 . 1 . . . . . 1623 ILE H . 26376 1 533 . 1 . 1 129 129 ILE C C 13 173.6392822 0.2 . 1 . . . . . 1623 ILE C . 26376 1 534 . 1 . 1 129 129 ILE CA C 13 61.88391495 0.2 . 1 . . . . . 1623 ILE CA . 26376 1 535 . 1 . 1 129 129 ILE CB C 13 38.79850006 0.2 . 1 . . . . . 1623 ILE CB . 26376 1 536 . 1 . 1 129 129 ILE N N 15 121.9696064 0.2 . 1 . . . . . 1623 ILE N . 26376 1 537 . 1 . 1 130 130 GLN H H 1 7.265000948 0.001113571 . 1 . . . . . 1624 GLN H . 26376 1 538 . 1 . 1 130 130 GLN C C 13 174.3288574 0.2 . 1 . . . . . 1624 GLN C . 26376 1 539 . 1 . 1 130 130 GLN CA C 13 54.95586846 0.2 . 1 . . . . . 1624 GLN CA . 26376 1 540 . 1 . 1 130 130 GLN CB C 13 30.04574105 0.2 . 1 . . . . . 1624 GLN CB . 26376 1 541 . 1 . 1 130 130 GLN N N 15 125.0882631 0.006092436 . 1 . . . . . 1624 GLN N . 26376 1 542 . 1 . 1 131 131 VAL H H 1 9.029731822 0.001426447 . 1 . . . . . 1625 VAL H . 26376 1 543 . 1 . 1 131 131 VAL C C 13 174.0684354 0.2 . 1 . . . . . 1625 VAL C . 26376 1 544 . 1 . 1 131 131 VAL CA C 13 60.89611798 0.2 . 1 . . . . . 1625 VAL CA . 26376 1 545 . 1 . 1 131 131 VAL CB C 13 33.52701187 0.2 . 1 . . . . . 1625 VAL CB . 26376 1 546 . 1 . 1 131 131 VAL N N 15 124.2742177 0.026134157 . 1 . . . . . 1625 VAL N . 26376 1 547 . 1 . 1 132 132 VAL H H 1 9.126187767 0.002694156 . 1 . . . . . 1626 VAL H . 26376 1 548 . 1 . 1 132 132 VAL C C 13 173.2946131 0.2 . 1 . . . . . 1626 VAL C . 26376 1 549 . 1 . 1 132 132 VAL CA C 13 58.99935839 0.2 . 1 . . . . . 1626 VAL CA . 26376 1 550 . 1 . 1 132 132 VAL CB C 13 31.71063042 0.2 . 1 . . . . . 1626 VAL CB . 26376 1 551 . 1 . 1 132 132 VAL N N 15 126.9062156 0.013722269 . 1 . . . . . 1626 VAL N . 26376 1 552 . 1 . 1 134 134 ILE H H 1 9.541395733 0.001220996 . 1 . . . . . 1628 ILE H . 26376 1 553 . 1 . 1 134 134 ILE C C 13 175.2808003 0.2 . 1 . . . . . 1628 ILE C . 26376 1 554 . 1 . 1 134 134 ILE CA C 13 60.00670624 0.2 . 1 . . . . . 1628 ILE CA . 26376 1 555 . 1 . 1 134 134 ILE CB C 13 37.97794342 0.2 . 1 . . . . . 1628 ILE CB . 26376 1 556 . 1 . 1 134 134 ILE N N 15 125.5112516 0.023675006 . 1 . . . . . 1628 ILE N . 26376 1 557 . 1 . 1 135 135 GLY H H 1 8.933997189 0.001553268 . 1 . . . . . 1629 GLY H . 26376 1 558 . 1 . 1 135 135 GLY C C 13 172.9976501 0.2 . 1 . . . . . 1629 GLY C . 26376 1 559 . 1 . 1 135 135 GLY CA C 13 45.1240654 0.2 . 1 . . . . . 1629 GLY CA . 26376 1 560 . 1 . 1 135 135 GLY N N 15 111.4457008 0.005375868 . 1 . . . . . 1629 GLY N . 26376 1 561 . 1 . 1 136 136 VAL H H 1 8.612080541 0.000351506 . 1 . . . . . 1630 VAL H . 26376 1 562 . 1 . 1 136 136 VAL C C 13 176.310791 0.2 . 1 . . . . . 1630 VAL C . 26376 1 563 . 1 . 1 136 136 VAL CA C 13 60.39188385 0.2 . 1 . . . . . 1630 VAL CA . 26376 1 564 . 1 . 1 136 136 VAL CB C 13 33.12284088 0.2 . 1 . . . . . 1630 VAL CB . 26376 1 565 . 1 . 1 136 136 VAL N N 15 127.236564 0.001620937 . 1 . . . . . 1630 VAL N . 26376 1 566 . 1 . 1 137 137 GLY H H 1 8.104630839 0.000986485 . 1 . . . . . 1631 GLY H . 26376 1 567 . 1 . 1 137 137 GLY C C 13 173.5042572 0.2 . 1 . . . . . 1631 GLY C . 26376 1 568 . 1 . 1 137 137 GLY CA C 13 44.936409 0.2 . 1 . . . . . 1631 GLY CA . 26376 1 569 . 1 . 1 137 137 GLY N N 15 110.607537 0.00083888 . 1 . . . . . 1631 GLY N . 26376 1 570 . 1 . 1 139 139 ASN H H 1 8.786096965 0.02 . 1 . . . . . 1633 ASN H . 26376 1 571 . 1 . 1 139 139 ASN C C 13 175.3323517 0.2 . 1 . . . . . 1633 ASN C . 26376 1 572 . 1 . 1 139 139 ASN CA C 13 52.44189072 0.2 . 1 . . . . . 1633 ASN CA . 26376 1 573 . 1 . 1 139 139 ASN CB C 13 38.72396851 0.2 . 1 . . . . . 1633 ASN CB . 26376 1 574 . 1 . 1 139 139 ASN N N 15 116.9699706 0.2 . 1 . . . . . 1633 ASN N . 26376 1 575 . 1 . 1 140 140 ALA H H 1 6.597586125 0.000690909 . 1 . . . . . 1634 ALA H . 26376 1 576 . 1 . 1 140 140 ALA C C 13 176.0604553 0.2 . 1 . . . . . 1634 ALA C . 26376 1 577 . 1 . 1 140 140 ALA CB C 13 17.20429611 0.2 . 1 . . . . . 1634 ALA CB . 26376 1 578 . 1 . 1 140 140 ALA N N 15 122.5311472 0.005851072 . 1 . . . . . 1634 ALA N . 26376 1 579 . 1 . 1 141 141 ASN H H 1 9.351620876 0.001198052 . 1 . . . . . 1635 ASN H . 26376 1 580 . 1 . 1 141 141 ASN C C 13 174.5703464 0.2 . 1 . . . . . 1635 ASN C . 26376 1 581 . 1 . 1 141 141 ASN CB C 13 38.41066239 0.2 . 1 . . . . . 1635 ASN CB . 26376 1 582 . 1 . 1 141 141 ASN N N 15 123.3214604 0.013174964 . 1 . . . . . 1635 ASN N . 26376 1 583 . 1 . 1 142 142 VAL H H 1 8.506455875 0.000733528 . 1 . . . . . 1636 VAL H . 26376 1 584 . 1 . 1 142 142 VAL C C 13 176.8152618 0.2 . 1 . . . . . 1636 VAL C . 26376 1 585 . 1 . 1 142 142 VAL CA C 13 67.65687561 0.2 . 1 . . . . . 1636 VAL CA . 26376 1 586 . 1 . 1 142 142 VAL CB C 13 31.47949219 0.2 . 1 . . . . . 1636 VAL CB . 26376 1 587 . 1 . 1 142 142 VAL N N 15 126.0393498 0.007298633 . 1 . . . . . 1636 VAL N . 26376 1 588 . 1 . 1 143 143 GLN H H 1 8.072108274 6.72E-05 . 1 . . . . . 1637 GLN H . 26376 1 589 . 1 . 1 143 143 GLN C C 13 179.4636688 0.2 . 1 . . . . . 1637 GLN C . 26376 1 590 . 1 . 1 143 143 GLN CA C 13 60.01004791 0.2 . 1 . . . . . 1637 GLN CA . 26376 1 591 . 1 . 1 143 143 GLN CB C 13 27.83255859 0.2 . 1 . . . . . 1637 GLN CB . 26376 1 592 . 1 . 1 143 143 GLN N N 15 118.3636406 0.001561477 . 1 . . . . . 1637 GLN N . 26376 1 593 . 1 . 1 144 144 GLU H H 1 7.879791101 0.000937812 . 1 . . . . . 1638 GLU H . 26376 1 594 . 1 . 1 144 144 GLU C C 13 178.4413452 0.2 . 1 . . . . . 1638 GLU C . 26376 1 595 . 1 . 1 144 144 GLU CB C 13 30.64610446 0.2 . 1 . . . . . 1638 GLU CB . 26376 1 596 . 1 . 1 144 144 GLU N N 15 121.214416 0.00882571 . 1 . . . . . 1638 GLU N . 26376 1 597 . 1 . 1 145 145 LEU H H 1 8.12273655 0.000521417 . 1 . . . . . 1639 LEU H . 26376 1 598 . 1 . 1 145 145 LEU C C 13 179.9985199 0.2 . 1 . . . . . 1639 LEU C . 26376 1 599 . 1 . 1 145 145 LEU CA C 13 57.90893936 0.2 . 1 . . . . . 1639 LEU CA . 26376 1 600 . 1 . 1 145 145 LEU CB C 13 40.46034622 0.2 . 1 . . . . . 1639 LEU CB . 26376 1 601 . 1 . 1 145 145 LEU N N 15 117.4631392 0.001629478 . 1 . . . . . 1639 LEU N . 26376 1 602 . 1 . 1 146 146 GLU H H 1 8.959230802 0.000325111 . 1 . . . . . 1640 GLU H . 26376 1 603 . 1 . 1 146 146 GLU C C 13 179.6723633 0.2 . 1 . . . . . 1640 GLU C . 26376 1 604 . 1 . 1 146 146 GLU CA C 13 59.56519318 0.2 . 1 . . . . . 1640 GLU CA . 26376 1 605 . 1 . 1 146 146 GLU CB C 13 29.59596062 0.2 . 1 . . . . . 1640 GLU CB . 26376 1 606 . 1 . 1 146 146 GLU N N 15 119.588254 0.005212048 . 1 . . . . . 1640 GLU N . 26376 1 607 . 1 . 1 147 147 ARG H H 1 7.662538272 0.02 . 1 . . . . . 1641 ARG H . 26376 1 608 . 1 . 1 147 147 ARG C C 13 178.821167 0.2 . 1 . . . . . 1641 ARG C . 26376 1 609 . 1 . 1 147 147 ARG CA C 13 56.96427155 0.2 . 1 . . . . . 1641 ARG CA . 26376 1 610 . 1 . 1 147 147 ARG CB C 13 30.16283798 0.2 . 1 . . . . . 1641 ARG CB . 26376 1 611 . 1 . 1 147 147 ARG N N 15 119.5789894 0.2 . 1 . . . . . 1641 ARG N . 26376 1 612 . 1 . 1 148 148 ILE H H 1 8.159650761 0.000889132 . 1 . . . . . 1642 ILE H . 26376 1 613 . 1 . 1 148 148 ILE C C 13 176.9677429 0.2 . 1 . . . . . 1642 ILE C . 26376 1 614 . 1 . 1 148 148 ILE CA C 13 64.8633728 0.2 . 1 . . . . . 1642 ILE CA . 26376 1 615 . 1 . 1 148 148 ILE CB C 13 38.85269165 0.2 . 1 . . . . . 1642 ILE CB . 26376 1 616 . 1 . 1 148 148 ILE N N 15 117.3188259 0.000481331 . 1 . . . . . 1642 ILE N . 26376 1 617 . 1 . 1 149 149 GLY H H 1 8.192244969 0.001072031 . 1 . . . . . 1643 GLY H . 26376 1 618 . 1 . 1 149 149 GLY C C 13 174.6257324 0.2 . 1 . . . . . 1643 GLY C . 26376 1 619 . 1 . 1 149 149 GLY CA C 13 45.57808754 0.2 . 1 . . . . . 1643 GLY CA . 26376 1 620 . 1 . 1 149 149 GLY N N 15 102.1521904 0.003784396 . 1 . . . . . 1643 GLY N . 26376 1 621 . 1 . 1 150 150 TRP H H 1 7.44238938 0.00071576 . 1 . . . . . 1644 TRP H . 26376 1 622 . 1 . 1 150 150 TRP C C 13 175.0138245 0.2 . 1 . . . . . 1644 TRP C . 26376 1 623 . 1 . 1 150 150 TRP CA C 13 57.92667389 0.2 . 1 . . . . . 1644 TRP CA . 26376 1 624 . 1 . 1 150 150 TRP CB C 13 29.14716339 0.2 . 1 . . . . . 1644 TRP CB . 26376 1 625 . 1 . 1 150 150 TRP N N 15 121.6096533 0.000825392 . 1 . . . . . 1644 TRP N . 26376 1 626 . 1 . 1 152 152 ASN H H 1 9.060695964 0.001714365 . 1 . . . . . 1646 ASN H . 26376 1 627 . 1 . 1 152 152 ASN C C 13 174.6635305 0.2 . 1 . . . . . 1646 ASN C . 26376 1 628 . 1 . 1 152 152 ASN CA C 13 53.60014569 0.2 . 1 . . . . . 1646 ASN CA . 26376 1 629 . 1 . 1 152 152 ASN CB C 13 39.6041563 0.2 . 1 . . . . . 1646 ASN CB . 26376 1 630 . 1 . 1 152 152 ASN N N 15 126.5577462 0.005451582 . 1 . . . . . 1646 ASN N . 26376 1 631 . 1 . 1 153 153 ALA H H 1 8.840187259 0.000809358 . 1 . . . . . 1647 ALA H . 26376 1 632 . 1 . 1 153 153 ALA C C 13 175.9627686 0.2 . 1 . . . . . 1647 ALA C . 26376 1 633 . 1 . 1 153 153 ALA CA C 13 49.96866608 0.2 . 1 . . . . . 1647 ALA CA . 26376 1 634 . 1 . 1 153 153 ALA CB C 13 18.00407028 0.2 . 1 . . . . . 1647 ALA CB . 26376 1 635 . 1 . 1 153 153 ALA N N 15 127.997797 0.151762336 . 1 . . . . . 1647 ALA N . 26376 1 636 . 1 . 1 155 155 ILE H H 1 8.812775419 0.000918751 . 1 . . . . . 1649 ILE H . 26376 1 637 . 1 . 1 155 155 ILE C C 13 174.08815 0.2 . 1 . . . . . 1649 ILE C . 26376 1 638 . 1 . 1 155 155 ILE CB C 13 39.09575653 0.2 . 1 . . . . . 1649 ILE CB . 26376 1 639 . 1 . 1 155 155 ILE N N 15 123.8005654 0.006790978 . 1 . . . . . 1649 ILE N . 26376 1 640 . 1 . 1 156 156 LEU H H 1 8.439037933 0.00107815 . 1 . . . . . 1650 LEU H . 26376 1 641 . 1 . 1 156 156 LEU C C 13 175.8708191 0.2 . 1 . . . . . 1650 LEU C . 26376 1 642 . 1 . 1 156 156 LEU CA C 13 53.03276825 0.2 . 1 . . . . . 1650 LEU CA . 26376 1 643 . 1 . 1 156 156 LEU CB C 13 41.62174988 0.2 . 1 . . . . . 1650 LEU CB . 26376 1 644 . 1 . 1 156 156 LEU N N 15 127.5719751 0.007175145 . 1 . . . . . 1650 LEU N . 26376 1 645 . 1 . 1 157 157 ILE H H 1 8.477375584 0.002702105 . 1 . . . . . 1651 ILE H . 26376 1 646 . 1 . 1 157 157 ILE C C 13 176.5762787 0.2 . 1 . . . . . 1651 ILE C . 26376 1 647 . 1 . 1 157 157 ILE CA C 13 56.23696899 0.2 . 1 . . . . . 1651 ILE CA . 26376 1 648 . 1 . 1 157 157 ILE CB C 13 38.26334 0.2 . 1 . . . . . 1651 ILE CB . 26376 1 649 . 1 . 1 157 157 ILE N N 15 124.2051934 0.00664117 . 1 . . . . . 1651 ILE N . 26376 1 650 . 1 . 1 158 158 GLN H H 1 9.118631877 0.003382479 . 1 . . . . . 1652 GLN H . 26376 1 651 . 1 . 1 158 158 GLN C C 13 174.7658535 0.2 . 1 . . . . . 1652 GLN C . 26376 1 652 . 1 . 1 158 158 GLN CA C 13 59.84290695 0.2 . 1 . . . . . 1652 GLN CA . 26376 1 653 . 1 . 1 158 158 GLN CB C 13 29.53335381 0.2 . 1 . . . . . 1652 GLN CB . 26376 1 654 . 1 . 1 158 158 GLN N N 15 126.2098743 0.068938596 . 1 . . . . . 1652 GLN N . 26376 1 655 . 1 . 1 159 159 ASP H H 1 6.984501419 0.002248421 . 1 . . . . . 1653 ASP H . 26376 1 656 . 1 . 1 159 159 ASP C C 13 175.39534 0.2 . 1 . . . . . 1653 ASP C . 26376 1 657 . 1 . 1 159 159 ASP CA C 13 53.29242706 0.2 . 1 . . . . . 1653 ASP CA . 26376 1 658 . 1 . 1 159 159 ASP CB C 13 41.73162842 0.2 . 1 . . . . . 1653 ASP CB . 26376 1 659 . 1 . 1 159 159 ASP N N 15 110.4065388 0.002834025 . 1 . . . . . 1653 ASP N . 26376 1 660 . 1 . 1 160 160 PHE H H 1 8.476024007 0.00047759 . 1 . . . . . 1654 PHE H . 26376 1 661 . 1 . 1 160 160 PHE C C 13 177.0618591 0.2 . 1 . . . . . 1654 PHE C . 26376 1 662 . 1 . 1 160 160 PHE CA C 13 63.40335464 0.2 . 1 . . . . . 1654 PHE CA . 26376 1 663 . 1 . 1 160 160 PHE CB C 13 38.64918518 0.2 . 1 . . . . . 1654 PHE CB . 26376 1 664 . 1 . 1 160 160 PHE N N 15 116.5889237 0.003334691 . 1 . . . . . 1654 PHE N . 26376 1 665 . 1 . 1 161 161 GLU H H 1 8.344726065 0.000561109 . 1 . . . . . 1655 GLU H . 26376 1 666 . 1 . 1 161 161 GLU C C 13 177.0235291 0.2 . 1 . . . . . 1655 GLU C . 26376 1 667 . 1 . 1 161 161 GLU CA C 13 60.04767609 0.2 . 1 . . . . . 1655 GLU CA . 26376 1 668 . 1 . 1 161 161 GLU CB C 13 28.87206841 0.2 . 1 . . . . . 1655 GLU CB . 26376 1 669 . 1 . 1 161 161 GLU N N 15 119.2857222 0.003052476 . 1 . . . . . 1655 GLU N . 26376 1 670 . 1 . 1 162 162 THR H H 1 8.155084061 0.001769861 . 1 . . . . . 1656 THR H . 26376 1 671 . 1 . 1 162 162 THR C C 13 176.0522461 0.2 . 1 . . . . . 1656 THR C . 26376 1 672 . 1 . 1 162 162 THR CA C 13 65.08901215 0.2 . 1 . . . . . 1656 THR CA . 26376 1 673 . 1 . 1 162 162 THR CB C 13 68.59613037 0.2 . 1 . . . . . 1656 THR CB . 26376 1 674 . 1 . 1 162 162 THR N N 15 112.973626 0.004226016 . 1 . . . . . 1656 THR N . 26376 1 675 . 1 . 1 163 163 LEU H H 1 7.269459113 0.000672864 . 1 . . . . . 1657 LEU H . 26376 1 676 . 1 . 1 163 163 LEU C C 13 174.0434418 0.2 . 1 . . . . . 1657 LEU C . 26376 1 677 . 1 . 1 163 163 LEU CA C 13 61.29035978 0.2 . 1 . . . . . 1657 LEU CA . 26376 1 678 . 1 . 1 163 163 LEU CB C 13 38.84927155 0.2 . 1 . . . . . 1657 LEU CB . 26376 1 679 . 1 . 1 163 163 LEU N N 15 122.9095475 0.003148796 . 1 . . . . . 1657 LEU N . 26376 1 680 . 1 . 1 165 165 ARG H H 1 6.932275459 0.000891409 . 1 . . . . . 1659 ARG H . 26376 1 681 . 1 . 1 165 165 ARG C C 13 177.5889435 0.2 . 1 . . . . . 1659 ARG C . 26376 1 682 . 1 . 1 165 165 ARG CA C 13 57.67846419 0.2 . 1 . . . . . 1659 ARG CA . 26376 1 683 . 1 . 1 165 165 ARG CB C 13 31.34962273 0.2 . 1 . . . . . 1659 ARG CB . 26376 1 684 . 1 . 1 165 165 ARG N N 15 114.31524 0.003033934 . 1 . . . . . 1659 ARG N . 26376 1 685 . 1 . 1 166 166 GLU H H 1 7.968743245 0.02 . 1 . . . . . 1660 GLU H . 26376 1 686 . 1 . 1 166 166 GLU C C 13 177.0150757 0.2 . 1 . . . . . 1660 GLU C . 26376 1 687 . 1 . 1 166 166 GLU CA C 13 57.20374298 0.2 . 1 . . . . . 1660 GLU CA . 26376 1 688 . 1 . 1 166 166 GLU CB C 13 33.04720688 0.2 . 1 . . . . . 1660 GLU CB . 26376 1 689 . 1 . 1 166 166 GLU N N 15 114.962339 0.2 . 1 . . . . . 1660 GLU N . 26376 1 690 . 1 . 1 167 167 ALA H H 1 7.930787208 0.001399996 . 1 . . . . . 1661 ALA H . 26376 1 691 . 1 . 1 167 167 ALA C C 13 175.8167114 0.2 . 1 . . . . . 1661 ALA C . 26376 1 692 . 1 . 1 167 167 ALA CA C 13 55.90110016 0.2 . 1 . . . . . 1661 ALA CA . 26376 1 693 . 1 . 1 167 167 ALA CB C 13 19.52365494 0.2 . 1 . . . . . 1661 ALA CB . 26376 1 694 . 1 . 1 167 167 ALA N N 15 117.7317713 0.006920369 . 1 . . . . . 1661 ALA N . 26376 1 695 . 1 . 1 169 169 ASP H H 1 8.680173249 0.000639789 . 1 . . . . . 1663 ASP H . 26376 1 696 . 1 . 1 169 169 ASP C C 13 178.798645 0.2 . 1 . . . . . 1663 ASP C . 26376 1 697 . 1 . 1 169 169 ASP CA C 13 58.01326752 0.2 . 1 . . . . . 1663 ASP CA . 26376 1 698 . 1 . 1 169 169 ASP CB C 13 40.67456436 0.2 . 1 . . . . . 1663 ASP CB . 26376 1 699 . 1 . 1 169 169 ASP N N 15 114.9199794 0.003164851 . 1 . . . . . 1663 ASP N . 26376 1 700 . 1 . 1 170 170 LEU H H 1 7.003513933 0.001206105 . 1 . . . . . 1664 LEU H . 26376 1 701 . 1 . 1 170 170 LEU C C 13 180.1138153 0.2 . 1 . . . . . 1664 LEU C . 26376 1 702 . 1 . 1 170 170 LEU CB C 13 41.80937958 0.2 . 1 . . . . . 1664 LEU CB . 26376 1 703 . 1 . 1 170 170 LEU N N 15 117.8071044 0.003852807 . 1 . . . . . 1664 LEU N . 26376 1 704 . 1 . 1 171 171 VAL H H 1 8.333690897 0.00062867 . 1 . . . . . 1665 VAL H . 26376 1 705 . 1 . 1 171 171 VAL C C 13 179.0117188 0.2 . 1 . . . . . 1665 VAL C . 26376 1 706 . 1 . 1 171 171 VAL CA C 13 66.25118256 0.2 . 1 . . . . . 1665 VAL CA . 26376 1 707 . 1 . 1 171 171 VAL CB C 13 31.0387001 0.2 . 1 . . . . . 1665 VAL CB . 26376 1 708 . 1 . 1 171 171 VAL N N 15 119.8185656 0.010399579 . 1 . . . . . 1665 VAL N . 26376 1 709 . 1 . 1 172 172 LEU H H 1 8.279768894 0.000717831 . 1 . . . . . 1666 LEU H . 26376 1 710 . 1 . 1 172 172 LEU C C 13 179.8409576 0.2 . 1 . . . . . 1666 LEU C . 26376 1 711 . 1 . 1 172 172 LEU CA C 13 56.18763733 0.2 . 1 . . . . . 1666 LEU CA . 26376 1 712 . 1 . 1 172 172 LEU CB C 13 40.46648407 0.2 . 1 . . . . . 1666 LEU CB . 26376 1 713 . 1 . 1 172 172 LEU N N 15 123.1369802 0.001475639 . 1 . . . . . 1666 LEU N . 26376 1 714 . 1 . 1 173 173 GLN H H 1 7.935972691 0.02 . 1 . . . . . 1667 GLN H . 26376 1 715 . 1 . 1 173 173 GLN CB C 13 28.3806572 0.2 . 1 . . . . . 1667 GLN CB . 26376 1 716 . 1 . 1 173 173 GLN N N 15 118.979744 0.2 . 1 . . . . . 1667 GLN N . 26376 1 717 . 1 . 1 174 174 ARG H H 1 7.416061604 0.000526257 . 1 . . . . . 1668 ARG H . 26376 1 718 . 1 . 1 174 174 ARG C C 13 177.7654572 0.2 . 1 . . . . . 1668 ARG C . 26376 1 719 . 1 . 1 174 174 ARG CA C 13 56.57984161 0.2 . 1 . . . . . 1668 ARG CA . 26376 1 720 . 1 . 1 174 174 ARG CB C 13 29.53118515 0.2 . 1 . . . . . 1668 ARG CB . 26376 1 721 . 1 . 1 174 174 ARG N N 15 114.6093679 0.002158427 . 1 . . . . . 1668 ARG N . 26376 1 722 . 1 . 1 175 175 CYS H H 1 7.945236314 0.001228728 . 1 . . . . . 1669 CYS H . 26376 1 723 . 1 . 1 175 175 CYS C C 13 180.3849182 0.2 . 1 . . . . . 1669 CYS C . 26376 1 724 . 1 . 1 175 175 CYS CB C 13 49.65869141 0.2 . 1 . . . . . 1669 CYS CB . 26376 1 725 . 1 . 1 175 175 CYS N N 15 110.9293141 0.000241624 . 1 . . . . . 1669 CYS N . 26376 1 726 . 1 . 1 176 176 CYS H H 1 8.038646278 0.002553209 . 1 . . . . . 1670 CYS H . 26376 1 727 . 1 . 1 176 176 CYS C C 13 174.7117004 0.2 . 1 . . . . . 1670 CYS C . 26376 1 728 . 1 . 1 176 176 CYS CA C 13 59.85902786 0.2 . 1 . . . . . 1670 CYS CA . 26376 1 729 . 1 . 1 176 176 CYS CB C 13 47.68910217 0.2 . 1 . . . . . 1670 CYS CB . 26376 1 730 . 1 . 1 176 176 CYS N N 15 114.2974792 0.003976508 . 1 . . . . . 1670 CYS N . 26376 1 731 . 1 . 1 177 177 SER H H 1 8.175057411 0.02 . 1 . . . . . 1671 SER H . 26376 1 732 . 1 . 1 177 177 SER C C 13 175.9000549 0 . 1 . . . . . 1671 SER C . 26376 1 733 . 1 . 1 177 177 SER CB C 13 63.86677048 0.0068997 . 1 . . . . . 1671 SER CB . 26376 1 734 . 1 . 1 177 177 SER N N 15 116.1079865 0.2 . 1 . . . . . 1671 SER N . 26376 1 stop_ save_