Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIAGYIMAAENQTLNQWTINQLGITRGDSILEVGFGPGYCMQQMLKREKDVHLHGIDVSEAMLKLAARRV-KPKGVRLIQGSIET--FPLPASFYDKVISVNNYTIWNDQTKGIKQIYRALKPGGKAAITMQPREADASPEKTKSFGRQ---------MIADF-KAAGFEDIDIQFKNIKPELSVCATAKKPAT 4KRI Chain:B ((223-376)) --------------------------GQRMLDIGVGIGGGARQA-ASEFGLQVHGVDLSTNMLAVALERVHKEKDARVTYAVCDACEYEFEPNSFDYVFSRDCIQHIKDTDKLFSRIYRALKPGGKVLITMYGVGHGTLSESFKEYVSQRQYYLKNLEQIEEIAKKTGF--IDIEVENMTPRF-----------

General information: TITO was launched using: RESULT: Template: 4KRI.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 : 588 -68696 -116.83 -487.20 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain B : 0.72 3D Compatibility (PKB) : -116.83 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.509

(partial model without unconserved sides chains): PDB file : Tito_4KRI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4KRI-query.scw PDB file : Tito_Scwrl_4KRI.pdb: