Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------------MIQWWQILLLTLYSAYQICDELTIVSSAG-----SPVFAGFITGLIMGDVTTGLLIGGNLQLFVLGVGTFGGASRIDATSGAVLATAFSVSQGIDAPLAIT-TIAVPVAALLTYFDVLGRMTTTFFAHRVDAAIERFDYK---GIERNYLLGAIPWALSRALPVFFALAFGGAFVQ-SVVDFVEAYKWVAD----GLTLAGRMLPGL----GFAILLRYLPVKRNLHYLAMGFGLTA-----MLTVLYSYVTGLGGAV--------------AGIVGTLPAEVAQKIGFVNN-FKGLSMIGISIVGIFLAVLHFKNSQ---KVAVAAPSTPSESGEIEDDEF------------ 1DIK Chain:? ((2-380)) AKWVYKFEEGNASMRNLLGGKGCNLAEMTILGMPIPQGFTVTTEACTEYYNSGKQITQEIQDQIFEAITWLEELNGKKFGDTEDPLLVSVRS-AARASMPGMMDTILNLGLN-DVAVEGFAKKTGNPRFAYDSYRRFIQMYSDVVMEVPKSHFEKIIDAMKEEKGVHFDTDLTADDLKELAEKFKAVYKEAMNGEEFPQEPKDQLMGAVKAVFRSWDNPRAIVYRRMNDIPGDWGTAVNVQTMVFGNKGETSGTGVAFTRNPSTGEKGIYGEYLINAQGEDVVAGVRTPQPITQLENDMPDCYKQFMDLAMKLEKHFRDMQDMEFTIEEGKLYFLQTRNGKRTAPAALQIACDLVDEGMITEEEAVVRIEAKSLDQL

General information: TITO was launched using: RESULT: Template: 1DIK.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 : 1572 -49718 -31.63 -166.28 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -31.63 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.177

(partial model without unconserved sides chains): PDB file : Tito_1DIK.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1DIK-query.scw PDB file : Tito_Scwrl_1DIK.pdb: