Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------------------------------------------------------------------------------------------------------------------------------------------------------MSVMEHLFKFLLLAPYFYFDNWIEKANRNSKFFPIFYYFYWFYIPFYSLFSLAWTVVSVLFFNTVLRNVTDIKL-WGIWFLFILLAIGMNWLTYSCFKEMFRLRQELGKSKGGRH------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ 4WIS Chain:A ((19-719)) GVDFVIHYKVPAAERDEAEAGFVQLIRALTTVGLATEVRHGENESLLVFVKVASPDLFAKQVYRARLGDWLHGVRVSAPHNDIAQALQDEPVVEAERLRLIYLMITKPHNEWKHVESIFPLHSHSFNKEWIKKWSSKYTLEQTDIDNIRDKFGESVAFYFAFLRSYFRFLVIPSAFGFGAWLLLGQFSY------------------LYALLCGLWSVVFFEYWKKQEVDLAVQWGVR--------GVSSIQQS--RPEFEWEHEAEDPITGEPVKVYPPMKRVKTQLLQIPFALACVVALGALIVTCNSLEVFINEVYSGPGKQYLGFLPTIFLVIGTPTISGVLMGAAEKLNAMENYATVDAHDAALIQKQFVLNFMTSYMALFFTAFVYIPFGHILHPFLNFWRATAQTLTFSEKELPTREFQINPARISNQMFYFTVTAQIVNFATEVVVPYIKQQAFQAEFLQRVREECTLEEYDVSGDYREMVMQFGYVAMFSVAWPLAACCFLVNNWVELRSDALKIAISSRRPIPWRTDSIGPWLTALSFLSWLGSITSSAIVYLCSNASPLKAWGLLLSILFAEHFYLVVQLAVRFVLSKLDSPGLQKERKERFQTKKRLLQENLGQDAAAAPGIEHSEKITREALEEEARQASIEMFWQRQRGMQETIEIGRRMIEQQLAAG

General information: TITO was launched using: RESULT: Template: 4WIS.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 : 195 -9438 -48.40 -109.74 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.49 3D Compatibility (PKB) : -48.40 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.49 QMean score : 0.140

(partial model without unconserved sides chains): PDB file : Tito_4WIS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WIS-query.scw PDB file : Tito_Scwrl_4WIS.pdb: