Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MELFKYMEKYDYEQLVFCQDEQSGLKAIIAIHDTTLGPALGGTRMWTYENEEAAIEDALRLARGMTYKNAAAGLNLGGGKTVIIGDPRKD---KNEEMFRAFGRYIQGLN--GRYITAEDVGTTVEDMDIIHDETDY---------VTGISPAFGSSGNPSPVTAYGVYRGMKAAAKAAFGTDSLEGKTIAVQGVGNVAYNLCRHLHEEGAN-LIVTDINKQSVQR-------AV---EDFG-AR--AVDPDDIYSQDCDIYAPCALGATINDDTIKQLKAKVIAGAANNQLKETRHGDQIHEMGIVYAPDYVINAGGVINVADELY-G-----YNAERALK-KVEGIYGNIERVLEISQRDGIPAYLAADRLAEERIERMRRSRSQFLQNGHSVLSRR 3AOE Chain:E ((61-418)) -----------------------IFQGYRVVHDIARGPAKGGVRLDPGVTLG----QTAGLAAWMTLKAAVYDLPFGGAAGGIAVDPKGLSPQELERLVRRYTAELVGLIGPDSDILGPDLGADQQVMAWIMDTYSMTVGSTVPGVVTGKPHALGGSEGRDDAAGLGALLVLEALAKRR-G-LDLRGARVVVQGLGQVGAAVALHAERLGMRVVAVATSMGGMYAPEGLDVAEVLSAYEATGSLPRLDLAPEEVFGLEAEVLVLAAREGALDGDRARQVQAQAVVEVANFGL-NPEAEAYLLGKGALVVPDLLSGGGGLLASYLEWVQDLNMFFWSPEEVRERFETRVARVVDAVCRRAERGGLDLRMGALALALERLDEATRLRGVY-----------

General information: TITO was launched using: RESULT: Template: 3AOE.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 1862 14336 7.70 44.38 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain E : 0.68 3D Compatibility (PKB) : 7.70 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.482

(partial model without unconserved sides chains): PDB file : Tito_3AOE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3AOE-query.scw PDB file : Tito_Scwrl_3AOE.pdb: