Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------MAEFIAVILI-----------------------TILAVISPGADFAIV---TKNSYLYG--RKIGVFTSLGISLGVLVHVTYTLVAVAF----VMTYTPQILNIVKYIGA--LYLIYIGYKTFTQKPVLETTALTAIGTFQAIKYGFFTNALNPKTTLFVISTYT-------QIVSLTTPKSI-------LLAYGF-----FMSFAHFVWFSLVAVLFSSMLLRQKMLAKQVQINR---VIGSILCVLG---------VILLFTKFQ- 5L45 Chain:B ((19-299)) SHMKILVTGARGSIGSRVAGKLVERGLPVRGGVRDLAAPGLPEGVEAVQADLTRPETLARALEGVDKVFLYTVPEGIAGFVDEARAAGVRHVVLLSSIAVTWPDADRDPIGRMHLAVERPIEESGLGWTFVRPEALATNALGWAPEIRGGDMVRCAYPGAYTTPVHEEDIADVVVAALTTPGHRSAAYALTGPETLTQAEQVALIGEALGRAVRCERMPEQEARAVLEGLYPAEVVDAILAGQAARDGRPAEVLDTIRAVTGRPARTFREWAGDHVAAFRP

General information: TITO was launched using: RESULT: Template: 5L45.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 : 993 -114430 -115.24 -566.49 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain B : 0.67 3D Compatibility (PKB) : -115.24 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.120

(partial model without unconserved sides chains): PDB file : Tito_5L45.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5L45-query.scw PDB file : Tito_Scwrl_5L45.pdb: