Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNIANYTLKVKG-KTLLQDTDLHFSSGKINHVVGKNGVGKSQLAKDFL---LNNSKRIG--R---------DIRQNVSLISSSSNIPNDVSKDFLLHFLSKKFDAKMIDKIAYLLNLDNI-----------D--GKVLIKNLSDGQKQKLKLLSFLLEDKNIIVLDEITNSLDKKTVIEIHGFLNKYIQENPEKIIINITHDLSDLKAIEGDYYIFNHQEIQQYHSVDKLIEVYINE 4RY2 Chain:A ((486-709)) IEFRNVDFRYGLRKPVLKNINLTIPKGKTVAIVGESGSGKTTLAKLLMNFYSPEKGDILINGHSIKNISLELIRKKIAFVSQDVFIFSG-TVKENLCLGNENVDM---DEIIKAAKMANAHDFIEKLPLKYDTFLNESGANLSEGQKQRLAIARALLKKPDILILDEATSNLDSITENHIKDAIYGLED--D-VTVIIIAHRLSTIV-NCDKIYLLKDGEIVESGSHTELIA-----

General information: TITO was launched using: RESULT: Template: 4RY2.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 : 855 16600 19.42 84.69 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : 19.42 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.372

(partial model without unconserved sides chains): PDB file : Tito_4RY2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4RY2-query.scw PDB file : Tito_Scwrl_4RY2.pdb: