Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MASEREQISRKVALIALIANLILMAGKVFFGLVGDSEAVFADGIHSAADVVASIAVLAVIGISNKPPDQDHPFGHGKAEVISEAIVGIILVIVSVYILIEAILSFVKGPSVPQYSALFAALISYVAKEILYRYSIKQGKKWNSKAIIAIAYDHKGDIVASLAAFIGVLLAIIGNSRGWSYLLYADAIASAIVAYLIFKISMELIRPSVDVLMEKSVDPELIEEYKAVIFQCDQVKRIDRIRAREHGHYKLLDVRLSLDHDLTIKQGHDIAREIRNEIKRQFSDVEEVLIHVNPYFEE 1TH5 Chain:A ((189-224)) -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------IVKVRLTGPAA--VVRTVRIAVSKKLREKIPSIQIVQL--------

General information: TITO was launched using: RESULT: Template: 1TH5.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 : 67 -19007 -283.69 -527.97 target 2D structure prediction score : 0.36 Monomeric hydrophicity matching model chain A : 0.46 3D Compatibility (PKB) : -283.69 2D Compatibility (Sec. Struct. Predict.) : 0.36 1D Compatibility (Hydrophobicity) : 0.46 QMean score : 0.672

(partial model without unconserved sides chains): PDB file : Tito_1TH5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1TH5-query.scw PDB file : Tito_Scwrl_1TH5.pdb: