Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKKLTSLALVGAFLGLSWYGNVQAQESSGNKIHFINVQEGGSDAIILESNGHFAMVDTGEDYDFPDGSDSRYPWREGIETSYKHVLTDRVFRRLKELSVQKLDFILVTHTHSDHIGNVDELLSTYPVDRVYLKKYSDSRITNSERLWDNLYGYDKVLQTATETGVSVIQNITQGDAHFQFGDMDIQLYNYENETDSSGELKKIWDDNSNSLISVVKVNGKKIYLGGDLDNVHGAEDKYGPLIGKVDLMKFNHHHDTNKSNTKDFIKNLSPSLIVQTSDSLPWKNGVDSEYVNWLKERGIERINAASKDYDATVFDIRKDGFVNISTSYKPIPSFQAGWHKSAYGNWWYQAPDSTGEYAVGWNEIE--GEWYYFNQTGILLQNQWKKWNNHWFYLTDSGASAKN-WKKID--GIWYYFNKENQME-IGWVQDKEQWYYLDVDGSMKTGWLQYMGQWYYFAPSGEMKMG-WVKDK--ETWYYMDSTGVMK-TGEIEVAGQHYYLEDSGAMKQGWHKKANDWYFYKTDGSRAVGWIKDKDKWYFLKENGQLLVN------GKTPEG--YTVDSSGAWLVDVSIEKSATIKTTSHSEIKESKEVVKKDLENKETSQHESVTNFSTSQDLTSSTSQSSETSVNKSESEQ 2WW5 Chain:A ((44-263)) ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GDYYVKD-DGSKAQSEWIFDNYYKAWFYINSDGRYSQNEWH----GNYYLKSGGYMAQNEWIYDSNYKSWFYLKSDGAYAHQEWQLIGNKWYYFKKWGYMAKSQWQ---GSYFLNGQGAMIQNEWLYDPAYSAYFYLKSDGTYANQEWQKVGGKWYYFKKWGYMARNEWQ---GNYYLTGSGAMATDEVIMDGARYIFAASGELKEKKDLNVGWVHRDGKRYFFNNREEQV---------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2WW5.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 : 820 28026 34.18 138.74 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : 34.18 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.387

(partial model without unconserved sides chains): PDB file : Tito_2WW5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2WW5-query.scw PDB file : Tito_Scwrl_2WW5.pdb: