Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTEKGVETMKIAVDAMGGDHAPQAIVEGVALAQQDFPEVEFLLYGKEAEIKKYLTNEKNITIIHTDEKINSDDEPVKAIRRKKTASMVLAAQAVKNGEADAVFSAGNTGA-LLAAGLFIVGRIKNIER---PGLMSTL--PVVGKEGAGFDMLDLGANAENKPEHLLQYGILGSFYARKVRGIGRPRVALLNNGTEATKGSEVTKKAYELLQNETSL-NFIGNVEAR--------------ELLNGVADVVVT-DGFTGNAVLKSIEGTAMNMMNLLKSAILNEGIKGKMGAMLLKDGLRSLKAEMDYSKHGGAVLFGLKAPVIKTHGATGPDAVRYTIRQIHTMLETDVVGQLVEQFEKSEE 3U9E Chain:B ((17-290)) ------SSFVFAVAGADD----EVVLETIRLALKQK-LGKFLLFGKKEDKTLTA--NESVTWIQTDT-------AEAAA-Q-------GAILAVKNKEADILVKGFIPTATLM---HHVLKKENGLRTDQLLSQIAIFDIPTY-H--KPLLITDCAMNVAPKTKEKIAITENALAVAHQ-IGITNPKIALLSAVEEVTAKMPSTLEAQEVVQHFGNQISVSGPLALDVAISKEAALHKGITDSSAGEADILIAPNIETGNALYKSLV------------YFA-------------------------GAK-VGSAVVGAKVPIVISSRNDSPENKLASFILTVRLVE----------------

General information: TITO was launched using: RESULT: Template: 3U9E.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1352 -61545 -45.52 -244.22 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain B : 0.68 3D Compatibility (PKB) : -45.52 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.504

(partial model without unconserved sides chains): PDB file : Tito_3U9E.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3U9E-query.scw PDB file : Tito_Scwrl_3U9E.pdb: