Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLLLKVRQNVPQVQSIKTSLKKRAGQKIPHMLSNASDLFFRGSEIALSGKTPFDVIYKHEIISLRHYRIETEASAHKHRVPLVIVPPLAVNMLIYDLFPTRSLIRYFLDQGFEVYLIDWGVPTRNQAKY---NFGTYVKVFMPEMLKQVRIHSGQQQLSLHGWSLGGALSLCYTALFKDKDIKNLMILASPIDTHKAGYMGKLYGSLTKPAQWVRKHTPFRIRQHVPSEVFHIHGWQNTLGFKLTAPIGNLKTYWQLLKNLDNREFIVDHATSSSFIDNMLAYPGGVMRDIILRFWIDNELSTGVIKFGELTAYLKDIDCSVLAVGGDTDIIVTADAVKPLMDLISSQDKTFKTVPS-GHMGVVSGSQAPTSVWPEMSNWLAMRSD 4Q3L Chain:B ((22-292)) ------------------------------------------------------VSIFTYQEKDIYYEIDGT---LDINSDVIVILNGIMMSTKSW-----DAFVENFSK-NHVLLRYDMFDQGQSSKIEESYTQTIQV-----ELLKNLLEHLGIAQANIVGISYGASIALQFAAKYP-TMIKRMVVANVVAKTSPWLK--DI----------GDGWNE-VA-----KTGNGLAY--YHITIPYIYS----PQFYTL-----HNDWMEKRK---ELLVPL--FST---RTFLDRMIRLTK----SAETHDVIKDLPNIKTPTLIISSEEDYLTPPFEQKYLQEHLQ--NAELVSIPNCGHASMYE---VPKTFTALVLGFFGQTK-

General information: TITO was launched using: RESULT: Template: 4Q3L.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1450 -107450 -74.10 -402.43 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain B : 0.61 3D Compatibility (PKB) : -74.10 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.324

(partial model without unconserved sides chains): PDB file : Tito_4Q3L.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4Q3L-query.scw PDB file : Tito_Scwrl_4Q3L.pdb: