Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPLISIDSRKHLFYEEYGQGIPIIFIHPPGMGRKVFYYQ-RLLS-KHFRVIFPDLSGHGDSDHIDQPASISYY--ANEIAQFMDALHIDKAVLFGYSAGGLIAQHIGFTRPDKVSHLILSGAYPAVHN---VIG---QKLHK-LG-MY--LL-EKNP---GLLMK-ILAG---SHTKDRQLRSILTDHMK-KADQ---AHWHQYYL-----DSL---GYNCIEQLPRLEMPMLFMYGGLRDWTFTNA-GYYRRSCRHAEFFRLEYQGHQLPTKQWKTCNELVTGFVLTHHS 3U1T Chain:A ((13-296)) ---TVEVEGATIAYVDEGSGQPVLFLHGNPTSSYLWRNIIPYVVAAGYRAVAPDLIGMGDSAKPDIE--YRLQDHVAYMDGFIDALGLDDMVLVIHDWGSVIGMRHARLNPDRVAAVAFMEALVPPALPMPSYEAMGPQLGPLFRDLRTADVGEKMVLDGNFFVETILPEMGVVRSLSEAEMAAYRAPFPTRQSRLPTLQWPREVPIGGEPAFAEAEVLKNGEWLMASPIPKLLFHAEPGALAPKPVVDYLSENVPNLEVRFVGAGTHFLQEDHPHLIGQGIADWLRRN--

General information: TITO was launched using: RESULT: Template: 3U1T.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 : 1282 -39510 -30.82 -158.67 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -30.82 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.318

(partial model without unconserved sides chains): PDB file : Tito_3U1T.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3U1T-query.scw PDB file : Tito_Scwrl_3U1T.pdb: