Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSSLSQVNADVLKQAQQRIQQDLLTTLAAFSIPEPLKSAVHHAVMLGGKRVRPALCYATASLQDNPNFAAARRAAVAVELIHCYSLAHDDLPCMDNDLLRRGQPTCHVAFGEDTALLAGDILQSMAFEVLGSRLFDEQGQGTDAAIVLKQIQILATASSKMVCGQVLDLQAEAKQISQDELENIHRNKTGALIQAAIMMGAVTIFPGTDQAIPKLRQYGQAIGLAFQVQDDILDITSSTETLGKTAGKDEQVQKSTYPALMGLEQAQIYAKELHDQAFEALAHFGENAKELVEISQFLLARTN 3Q2Q Chain:A ((66-285)) ---------------------------------------VMHLTRAGGKRFRPMFALLASEFGEKPLSENVIKAAVVVEITHLATLYHDD--VMDEA-------SANARWDNSVAILAGDILLAHA-----SGLMSQLGTDT--------VAHFAETFGELVTGQMRETVGPRDTDPIEHYTNVIREKTGVLIASAGYLGAMHAGAAPEH-IDALKNFGAAVGMIFQIVDDIIDIFSETH----TPGTDLREGVFTLPVLYALREDTPVGAELRD----------------------------

General information: TITO was launched using: RESULT: Template: 3Q2Q.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 : 780 -64598 -82.82 -309.08 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -82.82 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.268

(partial model without unconserved sides chains): PDB file : Tito_3Q2Q.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3Q2Q-query.scw PDB file : Tito_Scwrl_3Q2Q.pdb: