Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----------------MPSPKLKLNLYQKLLGLDHAQFSLIQHED---AIVAIVYEVIEPSGKKLILKICEQERHFLREVYFLEALKDK--IPVPQILQAIEPNSKR-HGAILMEYLPGQVLN---------------KETLTCELAEKAGYQLARLHLNSEKGYGDLISKDSLTQDPKADLIQRFEEGLDECEAHL-PSSLLNECRHYFHTHLYLLELADGPCIIHRDFRPGNLLANKNKLLGIIDWASARAGFAQEDFSSLEMGEWSTQASIQAAFLSGYETI----RPIPRYQEL----------MPLLKLSRSAAILGYLYRKGIY--HKSSAKLHQSHLNFLKTFIEA----- 3ATS Chain:A ((1-357)) TLPAVISRWLSSVLPGGAAPEVTVESGVDSTGMSSETIILTARWQQDGRSIQQKLVARVAPAAEDVPVF--PTYRLDHQFEVIRLVGELTDVPVPRVRWIETTGDVLGTPFFLMDYVEGVVPPDVMPYTFGDNWFADAPAERQRQLQDATVAALATLHSIP----NAQNTFSFLTDTTLHRHFNWVRSWYDFAVEGIGRSPLLERTFEWLQSHWPDDAAAREPVLLWGDARVGNVLYRDFQPVAVLDWEMVALGPRELDVAWMIFAHRVFQELAGLATLPGLPEVMREDDVRATYQALTGVELGDLHWFYVYSGVMWACVFMRTGARRVHFGEIEKPDDVESLFYHAGLMKHLLGEEH

General information: TITO was launched using: RESULT: Template: 3ATS.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 : 1310 -1504 -1.15 -5.13 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -1.15 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.346

(partial model without unconserved sides chains): PDB file : Tito_3ATS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ats-query.scw PDB file : Tito_Scwrl_3ATS.pdb: