Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNPKYKPLFEPFTFKSGVTINNRIAVAPMTHYASNEDGTISEAELDYIIPRSKEMGMVITACANVTPDGKAFPGQPAIHDDSNIPGLKKLAQAIQAQGAKAVVQIHHGGIECPSELVPQ-QDVVGPSD------VFDNGKQIA-----RALTEEEVENIVKAFGEATRRAIEAGFDGVEIHGANGYLIQQFYSPKTNQRTDRWGGSDEKRLAFPLAIVDEVKKAASEHAKGAFLVGYRLSP---------EEPETPGLTMTETYTLVDALGDKELDYLHISLMDVNSKARRGADPTRTRMDLLNERVGNKVPLIAVGSIHSADDALAVIENGIPLVAMGREILVDPNWTVKVKEGREKQIETVIKGTDKEKYHLPEPLWQAIVNTQGWVPYKD 1ICQ Chain:B ((15-338)) ------PLMSPCKMGK-FELCHRVVLAPLTRQRSYGYIPQPHAILHYS-QRSTNGGLLIGEATVISETGIGYKDVPGIWTKEQVEAWKPIVDAVHAKGGIFFCQIWHVGRVSNKDFQPNGEDPISCTDRGLTPQIMSNGIDIAHFTRPRRLTTDEIPQIVNEFRVAARNAIEAGFDGVEIHGAHGYLIDQFMKDQVNDRSDKYGGSLENRCRFALEIVEAVANEI-----GSDRVGIRISPFAHYNEAGDTNPTALGLYM------VESLNKYDLAYCHV----VEPR-----------ESLVPMRKAYKGTFIVAGGYDREDGNRALIEDRADLVAYGRLFISNPD----------------------------------------------

General information: TITO was launched using: RESULT: Template: 1ICQ.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 : 1716 -44521 -25.94 -152.47 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain B : 0.74 3D Compatibility (PKB) : -25.94 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.561

(partial model without unconserved sides chains): PDB file : Tito_1ICQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1ICQ-query.scw PDB file : Tito_Scwrl_1ICQ.pdb: