Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRMHLPTLLKNKEKSQRSRQMSSSKTIGIIGGGQLGQMMAISAIYMGHKVIALDPAADCPASRVA-EIIVAPYNDVDALRQLADRCDVLTYEFENVDADGLDAVIKDGQLPQGTDLLRISQNRIFEKDFLSNKSQVTVAPYKVVTSSLDLAD---I--DLSKNYVLKTA-TGGYDGHGQKVIRSEADLEAAYALADSADCVLEEFVNFDLEISVIVSGN---GKEVTFFPVQENIHRNNILSKTIVPARIS-ESLVDKAKAMAVRIAEQLNLSGTLCVEMFATDD-DVIVNEIAPRPHNSGHYSIEACDFSQFDTHILGVLGAPLPVIKLHAPAVMLNVLGQ----HVEA----A--EQYVTENSSAHLHMYGKIEAKHNRKMGHVTLFSDVPDSVDELGEGIDF 4E4T Chain:B ((30-410)) ------------------SPILPGAWLGMVGGGQLGRMFCFAAQSMGYRVAVLDPDPASPAGAVADRHLRAAYDDEAALAELAGLCEAVSTEFENVPAASLDFLARTTFVAPAGRCVAVAQDRIAEKRFIE-ASGVPVAPHVVIESAAALAALDDAALDAVLPGILKTAR------KGQVRVSTAREARDAHAALGGVPCVLEKRLP-L-KYEVSALIARGADGRSAAFPLAQNVHHNGILALTIVPAPAADTARVEEAQQAAVRIADTLGYVGVLCVEFFVLEDGSFVANEMAPRPHNSGHYTVDACATSQFEQQVRAMTRMPLGNPRQHSPAAMLNILGDVWFPNGAAAGAVTPPWDTVAAMPAAHLHLYGKEEARVGRKMGHVNFTAEMRDDAVAAATAC--

General information: TITO was launched using: RESULT: Template: 4E4T.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 : 2012 -32772 -16.29 -92.58 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain B : 0.76 3D Compatibility (PKB) : -16.29 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.466

(partial model without unconserved sides chains): PDB file : Tito_4E4T.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4E4T-query.scw PDB file : Tito_Scwrl_4E4T.pdb: