Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------------------------------------------RICKVGIYRAAKDNNWRLRAARKIRISMDNTPMQFQWDYKDGASKEATYKVELHYEGCEAKVVGDQKLPAYLTIKGEI------------------------------------------------------------------------------------------- 5FQ3 Chain:A ((15-213)) FVTLEREGDEKIVLEKGQPFVEPGYYAEMNGEDITESVQIKGSVDVNTPGIYNL-VYAAYNEDGFAKTFTRTVYVA-DNTASPL----KSG-----IYTVA---EGSKRTAPSVVAFSGY-----EIVIFQMEPGIFYISDFLGGWYDQRAGYGPDYAMVGKFELNDDNTITPLESYVAGWGDSMDQMTNTLLDPATGTLKWTVAYAGQLSFDIIVKQ

General information: TITO was launched using: RESULT: Template: 5FQ3.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 : 158 7014 44.39 118.88 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.55 3D Compatibility (PKB) : 44.39 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.308

(partial model without unconserved sides chains): PDB file : Tito_5FQ3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5fq3-query.scw PDB file : Tito_Scwrl_5FQ3.pdb: