Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAQHVFIVGLGLIGASMALCIRQTNPE--LIVVGWDSQSKTREQAVEQQIVDYVASDFETGAEQADVILLAVPVRTTLAYLDVLERINLSDHVIITDVSSTKQQVVTSAEQ---KNLRFVGGHPMAGSHKSGIQAADAKLFENAYYIFTPLEK-TKKDVEKLQELFCGTKAKYVTLTAREHDRITGMLSHFPHILAAGLVNQAEQF-NQEYPRAKQLAAGGFRDITRIASSDPVMWTDILLSNKQILLERLADWQQEMTQIAEWIMTENQSEIFSFFNRAKESRDQLPVHKQGAIPAFFDLFIDVPDEPGVIAEVTGLIGKAGVSLINLKIQETREDILGILQISFKNQQDLLQAKRIIMSNTSYHCWIK 4WJI Chain:A ((3-289)) QFQTIALIGIGLIGSSIARDIREK--QLAGTIVVTTRSEATLKRAGELGLGDRYTLSAAEAVEGADLVVVSVPVGASGAVAAEIAAHL-KPGAIVTDVGSTKGSVIAQMAPHLPKDVHFVPGHPIAGTEHSGPDAGFAGLFRGRWCILTPPAGTDEEAVARLRLFWETLGSMVDEMDPKHHDKVLAIVSHLPHIIAYNIVGTADDLETVTESEVIKYSASGFRDFTRLAASDPTMWRDVCLHNKDAILEMLARFSEDLASLQRAIRWGDGDKLFDLFTRTRAIRRSIVQA--------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4WJI.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 : 1357 -11282 -8.31 -40.29 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -8.31 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.506

(partial model without unconserved sides chains): PDB file : Tito_4WJI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WJI-query.scw PDB file : Tito_Scwrl_4WJI.pdb: