Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTTAQIELDELSVGADYEKVANRFRPIFE-KIAQGAIQREKERILPFEPIQWLKEAKLGAVRIPRKYGGDGVSLPQLFQLLAELAEADSNIVQALRGHFAF-VEDRLVAHKEHSQEVWFQRFVQGDLVGN-AWTEVGNV-QIGDVVTRVTKD-ASGNLVVNGEKYYSTGSIFADWIDLFAYDEVNDRHVIAAIYRHETGVSVIDDWDGFGQKTTGSGTLKVHQVHLPASHLIPFDQRFKY---QTAFYQVVHLATLTGIARAAVETFSQEIRERKRIFSHGNGDLVRHAPQVLQVVGKASAQAYASEVITLKTAEALQKAYESHFAESEVKEHQFNVDAELESAQGQVVISNLVLDLTSQLFNALGASASSQVKQLDRFWRNARTVSSHNP-LIYKEKVIGDWEVNRTDLPFVWQIGASPRAKSA 1SIQ Chain:A ((12-387)) ----------EQLTTDEILIRDTFRTYCQERLMPRILLANRNEVFHREIISEMGELGVLGPTIK-GYGCAGVSSVAYGLLARELERVDSGYRSAMSVQSSLVMHPIYAYGSEEQRQKYLPQLAKGELLGCFGLTEPNSGSDPSSMETRAHYNSSNKSYTLNGTKTWITNSPMADLFVVWARCED-GCIRGFLLEKGMRGLSAPRIQGKFSLRASATGMIIMDGVEVPEENVLPGASSLGGPFGCLNNARYGIAWGVLGASEFCLHTARQYALDRMQF-----GVPLARNQLIQKKLADMLTEITLGLHACLQLGRLKDQDK----------------AAPEMVSLLKRNNCGKALDIARQARDMLGGNGISDEYHVIRHAMNLEAVNTYEGTHDIHALILGRAITGIQA----------------

General information: TITO was launched using: RESULT: Template: 1SIQ.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 : 2098 -1570 -0.75 -4.28 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -0.75 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.418

(partial model without unconserved sides chains): PDB file : Tito_1SIQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1SIQ-query.scw PDB file : Tito_Scwrl_1SIQ.pdb: