Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTTTERAEFDADAAEAILRRACAVADLDPDGIEILRLG-DHA--VFRIDG--GRVISRVGRGADRLASVRREVAVARWLADKEYP-AARLVT-DAEQPIV-IEDHPVTFWEGLADGDT------YASTAEMGVLLRRLHELEAPPFSLPR---LQPFDKVASRLER--AVI---------P---ESTRAFLRSMARDLEAEYG----RLE-FSLPSGHLHGDFNVGNVLRDAAGHPRVIDLDGFATGPREWDLMQTAMYYDSFGWHTEAEYADFVVGYGFDVREWAGYAVLRSVRELLMVTWLSQNAGANPRAADEVQKRVATLRSGGSRRDWAPF 3I1A Chain:B ((7-291)) ------------QAQQLIELLKVHYGIDIHTAQFIQGGADTNAFAYQADSESKSYFIKLKYGYH----DEINLSIIRLLHDSGIKEIIFPIHTLEAKLFQQLKHFKIIAYPFIHAPNGFTQNLTGKQWKQLGKVLRQIHETSVPISIQQQLRKEIYSPKWREIVRSFYNQIEFDNSDDKLTAAFKSFFNQNSAAIHRLVDTSEKLSKKIQPDLDKYVLCHSDIHAGNVLVGNEESIYIIDWDEPMLAPKERDLMFIGGGVGNVW-NKPHEIQYFYEGYGEINVDKTILSYYRHERIVEDIAV----------------------------------

General information: TITO was launched using: RESULT: Template: 3I1A.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 940 -5002 -5.32 -20.09 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain B : 0.64 3D Compatibility (PKB) : -5.32 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.296

(partial model without unconserved sides chains): PDB file : Tito_3I1A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3i1a-query.scw PDB file : Tito_Scwrl_3I1A.pdb: