Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------------------------------------------------MAYDIISDIHGCYDEMTALIQKLGYTIKNGVPVHEEGRVLVFAGDLTDRGPKSIEVIRFVAGAYEK--GAVRYVPGNHCNKLYRYLKGNPVKVMHGLETTAAELEELSKDEKKSVSEQFMKLYETAPLYDILHNGELVVAHAGI-----RADDIGKYTRR-------VKDFVLYGD------------------VTGETYPDGRPIRRDWAAAYNGKAWVVYGHTPVKEPRKVNRTINIDTGCVFGNQLTGFRFP--------EIETVSVPSSLPYDESRFRPI- 1TCO Chain:A ((4-321)) VPFPPSHRLTAKEVFDNDGKPRVDILKAHLMKEGRLEETVALRIITEGASILRQEKNLLDIDAPVTVCGDIHGQFFDLMKLFEVGGSPANTR---------YLFLGDYVDRGYFSIECVLYLWALKILYPKTLFLLRGNH--------------ECRHLTEYFTFKQECKIKYSERVYDACMDAFDCLPLAALM-NQQFLCVHGGLSPEINTLDDIRKLDRFKEPPAYGPMCDILWSDPLEDFGNEKTQEHFTHNTVRGCSYFYSYPAVCEFLQHNNLL-SILRAHEAQDAGYRMYRK---SQTTGFPSLITIFSAPNYLDVYNNKAAVLKYENN-VMNIRQFNCSP

General information: TITO was launched using: RESULT: Template: 1TCO.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 : 1181 -130689 -110.66 -607.86 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -110.66 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.380

(partial model without unconserved sides chains): PDB file : Tito_1TCO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1TCO-query.scw PDB file : Tito_Scwrl_1TCO.pdb: