Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAKKTMGIHHITAIVGHPQENTDFYAGVLGLRLVKQTVNFDDPGTYHLYFGNEGGKPGTIITFFPWAGARQGVIGDGQVGVTSYVVP-KGAMAFWEKRLEKFNVPYTK-IE----RFGEQYVEFDDPHGLHLEIVEREEGEANTWTFGEVTPDVAIKGFGGATLLSEQPDKTADLLENIMGLERVGKEGD-FVRYRSAGDIGNVIDLKLTPIGRGQMGAGTVHHIAWRANDDEDQLDWQRYIASHGYGVT-PVRDRN--YFNAIYFREHGEILFEIATDPPGFAHDETQETMGEKLMLPVQYEPHRTQIEQGLLPFEVRELD 3B59 Chain:A ((3-259)) -LSRVTEIRYVGYGVKDFDAEKAFYADVWGLEPVGEDAN-------NAWFKAQ-G--ADEHHVVQLRR-----ADENRIDVIALAADSRSDVDALRASVEAAGCKVASEPAVLATPGGGYGFRFFSPDGLLFEVSSDVAKGAKR---DLARWEGVPVKISHIVLHSPNHQDMVKFFTDVLGFKVSDWLGDFMCFLRCNS-AHHRIAILP--------GPPCLNHVAYDMLSVDDMMRGAHRLKVKGIDIGWGPGRHTAGNNTFSYFVTPGGFVTEYTSELEEVDF-------------------------------------

General information: TITO was launched using: RESULT: Template: 3B59.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 : 1438 -129610 -90.13 -524.74 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -90.13 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.457

(partial model without unconserved sides chains): PDB file : Tito_3B59.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3B59-query.scw PDB file : Tito_Scwrl_3B59.pdb: