Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPSHLTHIWRLLKWGRTLARHGALTGIERDPLTPTPVRRLVRVARLGARVPRQPRYADAFQSIGPAAIKLGQTLATRPDLVGEDAANDLLRLQDALPPVPFATIRAQMEQSFGRPLETLYSRFDEAPVGAASIAQVHRAVTTD-GRDVAVKVIRPGVIDQFNRDIQTYEWAAAHVEMLGGEVARLRPRLVIANMKRWTARELDLRREAASASELGEAMEAMPGYRVPAIDWDRTTGKVMTMEWIDGVKISDRDALIAAG---HDVKEIAARLVNAFLRQAIAEGFFHADMHQGNLFVTANGDIVAIDFGIMGRIDRRARMWLAEILYGLITGNYRRVAEIHFEAQYVPGHHNVEEFATALRAVGEPMRGKPVRELSVGGMLDGLFAITRDFDMQTQPHLLLLQKTMVMVEGVATALDPDINLWETSGPYVKEWLRAELGPEAKAADAL-IENVRILQRLPGLVKRIEEAFPEKGGAPPPPPLTEVRLIRVGSGWRYMLVALLAGLAGAGAMAAATTFL 3COM Chain:B ((16-282)) ---------------------------------------------------------------------------------------------------------KLDEDSLTKQPEEVFDVL--EKLG----GSVYKAIHKETGQIVAIKQVPVESDL----------------Q--------------------------EIIKEISIMQQCDS-----PHVVKYYGSYFKNTDLWIVMEYCGAGSVSDIIRLRNKTLTEDEIATILQSTLKG-LEYLHFMRKIHRDIKAGNILLNTEGHAKLADFGVAGQLTDTMAK------RNTVIGTPFWMAPEVIQEIGYNCVADIWSLGITAIEMAEGK--PPYADIHPMRAIFMI-----------P-------------TNPPPTFRKPELWSDNFTDFVKQCLVKSPEQRATATQLLQHPFVR----------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3COM.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 -26271 -20.85 -101.82 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain B : 0.57 3D Compatibility (PKB) : -20.85 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.57 QMean score : 0.163

(partial model without unconserved sides chains): PDB file : Tito_3COM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3com-query.scw PDB file : Tito_Scwrl_3COM.pdb: