Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSTPADGPGPAATHIDIRTARDSARLALARHCPAGRFGLGSLR--NAAADRRAHVFCAATP--------DARLVVKVFAPSG------GDKGRAQFARQDLVATALPGRAPEVLFYDD-----ELRVLGMRYVDGPSLAEIWP---------TLTPPEQLAKLERAGDWLAAFHALTVAPHPFR---PRGPLDWLIALAESHRQRRREIPDFAVFEQHVAELQGAFPRVRG---TPSQRAILHRDLHLSNLMQTR-DGLVGLDFENNRPDEPLRDLVWLLVDAMARGDPEQP----P---HPAASALAAGYRQIAARADAMIFIQRLVALGIWANTTTRPSQHNVARFVAARQIAGVKEPLFQV 3ATT Chain:A ((7-301)) ------------------------SRWLSSVLPGGAAPEVTVESGVDSTGMSSETIILTARWQQDGRSIQQKLVARVAPAAEDVPVFPTYRLDHQFEVIRLVGELTDVPVPRVRWIETTGDVLGTPFFLMDYVEGVVPPDVMPYTFGDNWFADAPAERQRQLQDATVAALATLHSIPNAQNTFSFLT----DTTLHRHFNWVRSWYDFAVEGIGRSPLLERTFEWLQSHWPDDAAAREPVLLWGDARVGNVLYRDFQPVAVLDWEMVALGPRELDVAWMIFAHRVFQELAGLATLPGLPEVMREDDVRATYQALTGVE----------------------------------------------

General information: TITO was launched using: RESULT: Template: 3ATT.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 : 1012 -2325 -2.30 -9.45 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -2.30 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.298

(partial model without unconserved sides chains): PDB file : Tito_3ATT.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3att-query.scw PDB file : Tito_Scwrl_3ATT.pdb: