Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSRPCLLLLGIDVVFAHISGSCINHVGRADLVMLRRGFCRSIPLLGPTFTELVERLDSFEKEFIEWKAFRKAVESTSPKVTEAAKEIIAESMKEVKTSKVNLENPLTPEEFTELNQFYAKQKVKDIFFENLLYINTPNDLMQHSETVFRQYL-VRIARRVRHLNHAPYGLSQMPGIQMLKKWYQWSFHDVRS--TPVPTTRDECYRCDRMVRRVFLRHYNVSSLITDGMVEFASREGWTHVDEEVMRTYDELQNFFEAFCLGRVRLRFLVGNYMYLSTKILGVSKEEYAVNDPDGLTVPIFFDHNAEDFVGQICKKCSLLVLTKCAIKEAQ--------ASYDAEI-ELKLAGDPNLV-FVGIPYITYDIICAMLEDAVSANVDRQERTG-KACTKIEVTLAQWPTNKRFVLRISDTAGGMTLRQASKQLSCWSLYRNIQGHNQDTISTWTSSPIRLPYAYNAARVIGGNITLASIEGYGTDRQLYLPSTGLAGVSL 4MP2 Chain:A ((14-353)) -------------------------------------------------------------------------------------------------------------------EHFSKFSPSPLSMKQFLDFGSSNACEKTSFTFLRQELPVRLANIMKEINLLPDRVLSTPSVQLVQSWYVQSLLDIMEFLDKDPEDHRTLSQFTDALVTIRNRHNDVVPTMAQGVLEYKD----TYGDDPV--SNQNIQYFLDRFYLSRISIRMLINQHTLIF----------------D----PAHPKH-----IGSIDPNCNVSEVVKDAYDMAKLLCDKYYMASPDLEIQEINAANSKQPIHMVYVPSHLYHMLFELFKNAMRATVESHESSLILPPIKVMVALGE----EDLSIKMSDRGGGVPLRKIERLFSY--MYS----------------GYGLPISRLYAKYFQGDLQLFSMEGFGTDAVIYL----------

General information: TITO was launched using: RESULT: Template: 4MP2.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 : 1267 -44466 -35.10 -145.79 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -35.10 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.439

(partial model without unconserved sides chains): PDB file : Tito_4MP2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4MP2-query.scw PDB file : Tito_Scwrl_4MP2.pdb: