Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTPGDRMMASALGSWTRLAPFAGLDPAAFEAEELWRREDPGQVRIVLRMRGGAGQDLVFKRVFQPQD--RGRWAEALDGQRRAVRALMRDPVHVPPAILAEDAETLSTVQDFVPGR-TLQDHMLLRFDKPGARAQVLQRAGRFLAAFHGATAEGDKPFNPATMLDYIRALGRRALSGDLTLADPDLFAVLAEGLEAAAQTAAGQPVRVAAQHGDLHARNLIVSG-KRATLIDFAQDRSAPVQYDMARLIVDLGARFSGDAAPEATCGLPAADLAALSDGYGRDLSQDA--CLAFLCRC--RVLQDWAALPAVA-SQRSAFQQERLLQLQKTATRLAAA 4R7B Chain:A ((18-304)) ---GSHMEKIIKEKISSLLSQEE-E-V-LSVEQ-----LGGMTNQNYLAKTTN-KQYIVK-FFGKGTEKLINRQDEKYNLELLK-----DLGLDVKNYLFDI-EAGIKVNEYIESAITLDSTS---------IKTKFDKIAPILQTIHTSAKELRGEFAPFEEIKKYESLIEEQI----PYANYESVRNAVFSLEK---RLADLGVDRKSCHIDLVPENFIESPQGRLYLIDWEYSSMNDPMWDLAALFLESEFT--------------SQEEETFLSHYESDQTPVSHEKIAIYKILQDTIWSLWTVYKEEQGEDFGDYGVNRYQRAVKGLASYG--

General information: TITO was launched using: RESULT: Template: 4R7B.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1311 12397 9.46 44.59 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : 9.46 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.281

(partial model without unconserved sides chains): PDB file : Tito_4R7B.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4r7b-query.scw PDB file : Tito_Scwrl_4R7B.pdb: