Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MKTRGVNMANLVYSPKDILQQEFKTKMRGYDPVEVDEFLDN---------IIKDYETYSKELLALQEENDRLSAK--VAQLS------KTQGAAQTRVQQTEAPKSAAVTNFDILKR---LSNLEREVFGKKLDQQASAVKPAQPNPNNYTNADTSLDDNEKTRQF---------------------------------- 4R33 Chain:A ((35-418)) GDFVLPELEDVRAEAATVDTRAVLALAEGEEPAESRAAVALALWEDRSIGTAELQAAAEARCGARRPRLHTFVPLYTTNYCDSECKMCSMRKGNHRLDRKFSGRKEITEQLEILYHHEGVRGVGFLTGEYEDKHTRLASAFRIGWAIRTALDLGFERVYFNIGSMEQDEIDVLGEWIGREDPVTMCVFQESYDRETYRRFMGKTSVGVPKAD------------FDRRV-----VSFDRWLDAGYRYVNPGVLVGLHDDLSAELVSLVAHGDHLRSRGATADLSVPRMRPAMKSRDTTRVGDDDYLRLMSVVAFTCPEQRLVLTTREPQEFQDVALGLAGVISPGSPDVAPY-RAGCEARNDEKSSQFLVADLRRPRHILGRIEASGTPVDHFVNPAGEASR

General information: TITO was launched using: RESULT: Template: 4R33.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 : 301 15747 52.31 123.02 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : 52.31 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.363

(partial model without unconserved sides chains): PDB file : Tito_4R33.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4R33-query.scw PDB file : Tito_Scwrl_4R33.pdb: