Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKSKGLGRGIDALFQDLENLETVDVKDDTVVQLPLNELRPNPYQPRKTFEEVSLQELANSIEQSGVFQPIIVRRSAVKGYEIIAGERRFRASKLAEKETIPAIVRDFDEEAM----MQVAVLENLQREDLNPLEEAEAYEMLMKNL---------------------------KLTQAEVASRLG-----KSRPYIANYLRLLSLPDLVKEMVQD--QRLSMGQARTLLGLKNKTLILKLANRAVTENLTVRQLEQLVSELNQNDGKEKKKIPRLAKEKPYYIRESEDRLMDKFGTSVAIQEKNGKGKIEIEYLSQKDLTRILDILNIQFDEE 5K5D Chain:B ((7-228)) --------------------------LTYTEEVVSIEKLKEDDEFKTMVPSNNSREDLEKSLREKSQIFPLIADRN----YVLIDGYTRLDIMKKLGFKEVKILKYDFDSQQERDKAYELIWTFNGVRRQLDKNERLALFQKIADRIAKMQASKNKTEEENEEFVTLDDGTTISALEYERILKELDKENKALSESDKRKMAILRINTPWLLKYVTDQKYKVPLDQAFRIYTRV-----------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5K5D.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 : 641 -23103 -36.04 -140.02 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain B : 0.63 3D Compatibility (PKB) : -36.04 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.388

(partial model without unconserved sides chains): PDB file : Tito_5K5D.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5K5D-query.scw PDB file : Tito_Scwrl_5K5D.pdb: