Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPKTLTEKLNAIKATGKGIFVPYIMAGDHEKGLDGLGETIHFLEDLGVSAIEVGIPFSDPVADGPVIEEAGLRSLAHGTSTQALVETLKTI-ETEIPLVIMTYFNPLFQYGVENFVKDLADTAVKGLIIPDLPHEHANFVEPFLADTDIALIPLVSLTTGIERQKELIEGAEGFVYAVAINGVTGKSGNYRADLDKHLAQLHQVADIPVLTGFGVSSQADLERFNAVSDGVIVGSKIVKA-LHQGEPIQDFIRQAVAYQK 5TCH Chain:E ((10-264)) --SRLGPVFDSCRANNRAALIGYLPTGYPD--VPASVAAMTALVESGCDIIEVGVPYSDPVMDGPTIARATEAALRGGVRVRDTLAAVEAISIAGGRAVVMTYWNPVLRYGVDAFARDLAAAGGLGLITPDLIPDEAQQWLAASEEHRLDRIFLVAPSSTPERLAATVEASRGFVYAAS-----------SQAAPELVGRVKAVSDIPVGVGLGVRSRAQAAQIAQYADGVIVGSALVTALTEGLPRLRALTGELAAGV-

General information: TITO was launched using: RESULT: Template: 5TCH.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 1381 -115158 -83.39 -475.86 target 2D structure prediction score : 0.75 Monomeric hydrophicity matching model chain E : 0.77 3D Compatibility (PKB) : -83.39 2D Compatibility (Sec. Struct. Predict.) : 0.75 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.636

(partial model without unconserved sides chains): PDB file : Tito_5TCH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5TCH-query.scw PDB file : Tito_Scwrl_5TCH.pdb: