Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKLVLIGGGYGNMRVLHRLLPNQLPDDVSITLIDRNPYHCLKTEYYALAAGTISDHHIRVSFPEHPRLDVQYGDITSIDIVQKQVLFQDREPISYDDAIIGLGCEDKYHNVPGA--PEFTYSIQTIDQSRETYQKLNNLSANATVAIVGAGLSGVELASELRESRDDLNIILFDRGNLILSSFPERLSKYVQKWFEEHGVRIINRANITKVE------EGVVYNHDDPISADAIVWTAGIQPNKVVRDLDVEKDAQGRIVLTPHHNLPGDEHLYVVGDCA---SLPHAPSAQLAEAQ-AEQIVQILQKRWNGEALP-ESMPQFKLKGVLGSLGKKAGFGLVADRPLIGRVPRMLKSGLLWMYKHHNG 3FG2 Chain:P ((79-320)) ---------------------------------------------------------------------------MVSIDREGRKLLLASGTAIEYGHLVLATGARNRMLDVPNASLPDVLY-LRTLDESEVLRQRMPD---KKHVVVIGAGFIGLEFAATARAKGLEVDVVELAPRVMARVVTPE-ISSYFHDRHSGAGIRMHYGVRATEIAAEGDRVTGVVLSDGNTLPCDLVVVGVGVIPNVEIAAAAGLPTAAGIIV--DQQLLTSDPHISAIGDCALFESVRFGETMRVESVQNATDQARCVAARLTGDAKPYDGYPWF--------------------------------------------

General information: TITO was launched using: RESULT: Template: 3FG2.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain P - contact count / total energy / energy per contact / energy per residue : 1105 -30674 -27.76 -133.95 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain P : 0.65 3D Compatibility (PKB) : -27.76 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.456

(partial model without unconserved sides chains): PDB file : Tito_3FG2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3FG2-query.scw PDB file : Tito_Scwrl_3FG2.pdb: