Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNTPKKHKKFKAKMILQIIMVIIGG--IIAAYGLETVLIPNSVSDGGVTGLSIVG------SQL-FN-LPL-------------------------------GILI----AVINIP----FVWL-----GYKQIGKSFALLSIIGIVSL-AAGTSFFHHTPAIIEGDTLLITVVGGIILGF----------GMGLALRN--------GGALDGIDMLAVLLSRKLPFGTSDLILFLNLFVFIFVSTVFGL------------------------QGALLSVIAYYIASKVIHVVEEGLSGSKTFQIITTQPELMVETIRDQLGRSAT-YKEAYGGFSHEKFKEITCVINR------------LEETKLKEIINDIDKTAFVTVYDV-----AEVKGSNFRNLNHH-------------- 3Q5D Chain:A ((29-438)) ---------VKKAGPVQVLIVKDDHSFELDETALNRILLSEAVRDKEVVAVSVAGAFRKGKSFLMDFMLRYMYNQESVDWVGDYNEPLTGFSWRGGSERETTGIQIWSEIFLINKPDGKKVAVLLMDTQGTFDSQSTLRDSATVFALSTMISSIQVYNLSQNVQEDDLQHLQLFTEYGRLAMEETFLKPFQSLIFLVRDWSFPYEFSYGADGGAKFLEKRLKVSGNQHEELQNVRKHIHSCFTNISCFLLPHPGLKVATNPNFDGKLKEIDDEFIKNLKILIPWLLSPESLDIKEINGNKITCRGLVEYFKAYIKIYQGEELPHPKSMLQATAEANNLAAVATAKDTYNKKMEEICGGDKPFLAPNDLQTKHLQLKEESVKLFRGVKKMGGEEFSRRYLQQLESEIDELYIQYIKHNDS

General information: TITO was launched using: RESULT: Template: 3Q5D.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 : 1058 -202205 -191.12 -719.59 target 2D structure prediction score : 0.43 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -191.12 2D Compatibility (Sec. Struct. Predict.) : 0.43 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.218

(partial model without unconserved sides chains): PDB file : Tito_3Q5D.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3Q5D-query.scw PDB file : Tito_Scwrl_3Q5D.pdb: