Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSQLFKSFDASEKTQLICFPFAGGYSASFRPLHAFLQGECEMLAAEPPGHGTNQ-TSAIEDLEELTDLYKQELNLRPDRPFVLFGHSMGGMITFRLAQKLEREGIFPQAVIISAIQPPHIQ-R---KKV----SHL--PD---------DQFLDHIIQLGGMPAELVENKEVMSFFLPSF---------RSDYRAL---------EQF--E-LYDLAQIQSPVHVFNGLDDKK-CIRDAEGWKKWAKDITFHQFDG-GHMFLLSQTEEVAERIFAILNQHPIIQP 3WI7 Chain:A ((34-302)) ----TVEHG--SGAPIVFLHGNPTSSYLWRHIFRRLHGHGRLLAVDLIGYGQSSKPDIEYTLENQQRYVDAWFDALDLRNVTLVLQDYGAAFGLNWASRNPD---RVRAVAFFEPVLRNIDSVDLSPEFVTRRAKLRQPGEGEIFVQQENRFLTELFPWFFL--TPLA-PEDLRQYQTPFPTPHSRKAILAGPRNLPVDGEPASTVAFLEQAVNWLNTSDTPKLLLTFKPGFLLTDAILKWSQVTIRNLEIEAAGAGIHFVQEEQPETIARLLDAWLTRIA----

General information: TITO was launched using: RESULT: Template: 3WI7.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 : 1124 -140695 -125.17 -622.54 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -125.17 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.489

(partial model without unconserved sides chains): PDB file : Tito_3WI7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3WI7-query.scw PDB file : Tito_Scwrl_3WI7.pdb: