Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSVFTPLERSTLEAFLA-PYDLGRLRDFRGIAEGSENSNFF--VSLEHGEFVLTLVERGPVQDLPFFIELLDVLHEDGLP-VPYALRTRDGEALRRLEGKPALLQPRLAGRHERQ--PNAHHCQEVGDLLGHLHAATRGRILERP--SDRGLPWMLEQGANLAP---------R----LP---EQARALLAPALAEIAAL-DAER--PALPRANLHADLFRDNVLFDGPHLAGLIDFYNACSGWMLYDLAITLNDWCSNTDGSLDPARARALLAAYANRRPFTALEAEHWPSMLRVACVRFWLSRLIAAEAFAGQDVLIHDPAEFEIRLAQRQNVEIHLPFAL 3I1A Chain:B ((4-319)) ----QPIQAQQLIELLKVHYGI-DIHTAQFIQGGADTNAFAYQADSESKSYFIKLKYGY-H--DEINLSIIRLLHDSGIKEIIFPIHTLEAKLFQQLKHFKIIAYPFIHAPNGFTQNLTGKQWKQLGKVLRQIHETSVPISIQQQLRKEIYSPKWREIVRSFYNQIEFDNSDDKLTAAFKSFFNQNSAAIHRLVD-TSEKLSKKIQPDLDKYVLCHSDIHAGNVLVGNEESIYIIDWDEPMLAPKERDLMFIGGGVGNVW---NKPHEIQYFYEGYGEINV----DKTILSYYRHERIVED-IAVYGQDLLSRN--QNNQSRLESFKYFKEMFDP--------

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 : 1260 10551 8.37 36.51 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain B : 0.63 3D Compatibility (PKB) : 8.37 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.381

(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: