Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQDIIAYFIQNLTALYIAVALVSLCIGSFLNVVIYRTPKMMEQDWQQECQMLLNPEQPIIDHEKLTLSKPASSCPACQQPIRWYQNIPVISWLTLRGKCGHCQHPISIRYPAVELLTMLCSLVVVMVFGPTIQMLFGLVLTWVLIALTFIDFDTQLLPDRFTLTLAALGLGINTFNIYTSPNSAIWGYLIGFLCLWIVYYLFKVITGKEGMGYGDFKLLAALGAWMGPLMLPLIVLLSSLLGAIIGIILLKLRNDNQPFAFGPYIAIAGWVAFLWGDQIMKIYLGG 5K2M Chain:F ((3-35)) ------------------------------------------------------------------------ECPVCGSEIEIGEVEL-----HQIVECPVCGAELEVVS--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5K2M.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain F - contact count / total energy / energy per contact / energy per residue : 85 -16424 -193.22 -497.70 target 2D structure prediction score : 0.48 Monomeric hydrophicity matching model chain F : 0.37 3D Compatibility (PKB) : -193.22 2D Compatibility (Sec. Struct. Predict.) : 0.48 1D Compatibility (Hydrophobicity) : 0.37 QMean score : 0.755

(partial model without unconserved sides chains): PDB file : Tito_5K2M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5K2M-query.scw PDB file : Tito_Scwrl_5K2M.pdb: