Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFSIFYGKEKLAPSPNKIDILRSLVGGTVSIFILLWLSKLTHNIFIMAPFGATCVLLYTVSQSPLAQPRNIIFGHLISAFVGLFFLKFIGVSIFTIAFSVGCAIALMQVFKCVHPPAGANPLVILLTASSIHYEWNFLIFPVLVGAVSLVLVAMLINNIKASTKWP---MYGLGILNTKK 5KNW Chain:A ((1-125)) MHHHHHHSNATGPQFV------------------------------------SGVIVKIISTEPLPG-RKQVRDTLAAISEVLYVDLLEGDTECHARFK---------------TPEDAQAVINAYTEINKKHCWKLEILS---GDHEQRYWQKILVDRQAKLNQPREKKRGTEKLITKA

General information: TITO was launched using: RESULT: Template: 5KNW.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 380 -75181 -197.84 -616.24 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.53 3D Compatibility (PKB) : -197.84 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.53 QMean score : 0.260

(partial model without unconserved sides chains): PDB file : Tito_5KNW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5KNW-query.scw PDB file : Tito_Scwrl_5KNW.pdb: