Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKIVILNKPYDVLSQFRKDEAHMTVSDFVDDPTLRIA-----GRLDMDSEGLVFLTDHGGLNQFITNPANKKYKTYLVQVDGDVTEEALEQLRKGVELNDGMTLPA--KAIKVSEPEWLWDRDPPVRYRASIPTSWIEISICEGRNRQVRRMTSAVGFPTLRLIRTKIGTIDLVQLGLQPGETKEIEPLLYPDFKDVPAEQPYRSRSYVRKPGGTGGKPMVRKNKDGSAKKSGTKRIWQMDESEKPRRKTNGTTRPNTKAPRGRSRNSR 4LAB Chain:A ((71-224)) CRVLAYYKPEGELCTRNDPEGRPTVFDRL--PKLRGARWIAVGRLDVNTCGLLLFTTDGELANRLMHPSREVEREYAVRVFGQVDDAKLRDLSRGVQLEDG---PAAFKTIKFSGGEGI--------------NQWYNVTLTEGRNREVRRLWEAVGVQVSRLIRVRYGDIPL------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4LAB.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 : 604 34439 57.02 234.28 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : 57.02 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.498

(partial model without unconserved sides chains): PDB file : Tito_4LAB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4LAB-query.scw PDB file : Tito_Scwrl_4LAB.pdb: