Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MHLTHREVRDKLLSYSEGLQVYYE-LYQLLLF---HFQEKNADHFFGLIEQELPTVHPLFQTVFWTFLRDRDKIINALKLPYSNAKLEATNNLIKVIKRKAFGFRNFNNFKKRILMTLNIKKESTNFVLSRL--------------------------------------------------------------------------------------------------------------------------------------- 4TQT Chain:A ((14-490)) ASKVIKGGTVITADRTFRADILIEDGKIAAIGDSLEGDEVIDASGCYVMPGGIDPHTHLQMPFMGTYSSDDFDTGTAAALAGGTTMVVDFVLPDSEGNLLDALQEWFQKAGKARTDYSFHMAITGWNERTFNEMAEVVKRGINTFHFMAYKGALMVNDDEMFASFQRCAELGAMPLVHAENGDIVAQLQAKLMAEGNDGPEAHAYSRPPEVEGEATNRAIMIADQAGVPLYVVHVSCEQSHEAIRRARQK------GMRVFGEPLIQHLTLDESEYHNRDWDYAARRV------MSPPFRDKL-----NQDSLWAGLAA--GSLQCVATDHCAFTTEQKRYGIGNFTKIPN-----------GTGGLEERMPVLWTRGVRTGRLTPNEFVAVTSTNIAKILNIYPQKGAVVPGADADLVIWDPETTKKISAKTQHSSIDYNVFEGFELKGLPIMTLSRGRIAFDKGQVTAKPGDGRFIEREPNGAVNRALSQWKEIVAPRKVERSA

General information: TITO was launched using: RESULT: Template: 4TQT.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 : 292 6209 21.26 63.35 target 2D structure prediction score : 0.43 Monomeric hydrophicity matching model chain A : 0.55 3D Compatibility (PKB) : 21.26 2D Compatibility (Sec. Struct. Predict.) : 0.43 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.145

(partial model without unconserved sides chains): PDB file : Tito_4TQT.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4TQT-query.scw PDB file : Tito_Scwrl_4TQT.pdb: