Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKAVAYQKAGPITLPEALVDIELDTPVAKGHDLLIRVQAVSVNPVDTKIRKNV----------------SA--EQSGWKVLGWDAVGTVEAIGDKVTQFKIGDVVWYAGAL------------------------NRQGSNSELQLVDERIVGHKPKTLEATEAAALPLTAITAWEMLFD--RLQVPKTAPANTTILVIGGAGGVGSITIQLLKQLTNLTIIATASRPETKEWVEQLGADYVLDHRQ-SL------------------AAQIKLLGLSAPLYVFSTTETDQHLSDIVELIAPQGHFGLIDDPDQLD--I--KPFKSKSVSVHWEFMFTRSMFQTEDMEKQSALLNEVSKLVDEGKIKTTVTQVLSPINAENLTRVHEQIESGSTKGKIVLHGF 4A0S Chain:B ((49-413)) ----------------SLRLGEVPMPELAPDEVLVAVMASSINYNTVWSAMFEPIPTFHFLKQNARQGGWATRHDQPYHVLGSDCSGVVVRTGIGVRRWKPGDHVIVHPAHVDEQEPATHGDGMLGTEQRAWGFETNFGGLAEYGVVRASQLLPKPAHLTWEEAAVSPLCAGTAYRMLVSDRGAQMK---Q-GDIVLIWGASGGLGSYAIQFVKNGG-GIPVAVVSSAQKEAAVRALGCDLVINRAELGITDDIADDPRRVVETGRKLAKLVVEKAGREPDIVFEHTGR-VTFGLSVIVARRGGTVVTCGSSSGYLHTFDNRYLWMKLKKIVGS------------HGANHEEQQATNRLFESGAVVPAMSAVY-PL--AEAAEACRVVQTSRQVGKVAVLC-

General information: TITO was launched using: RESULT: Template: 4A0S.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 : 1776 -17681 -9.96 -59.33 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain B : 0.68 3D Compatibility (PKB) : -9.96 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.496

(partial model without unconserved sides chains): PDB file : Tito_4A0S.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4A0S-query.scw PDB file : Tito_Scwrl_4A0S.pdb: