Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSSRGGKKKSTKTSRSAKAGVIFPVGRMLRYIKKGHPKYRIGVGAPVYMAAVLEYLTAEILELAGNAARDNKKGRVTPRHILLAVANDEELNQLLKGVTIASGGVLPNIHPELLAKKRGSKGKLEAIITPPPAKKAKSPSQKKPVSKKAGGKKGARKSKKKQGEVSKAASADSTTEGTPADGFTVLSTKSLFLGQKLNLIHSEISNLAGFEVEAIINPTNADIDLKDDLGNTLEKKGGKEFVEAVLELRKKNGPLEVAGAAVSAGHGLPAKFVIHCNSPVWGADKCEELLEKTVKNCLALADDKKLKSIAFPSIGSGRNGFPKQTAAQLILKAISSYFVSTMSSSIKTVYFVLFDSESIGIYVQEMAKLDAN 5FSZ Chain:A ((91-258)) -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DILRHIALYNGPVTD---LQLDAIVNAANKTCLGGKGVDGAIHAAAGPLLVRECATF----KGCDTGQCRLTKGYNLPARYVLHTVGPIGER---PEELRSCYRSILSLAHRNRLRSIGFCCVSTGVYGYPLIPATRIAVDETIEYLKQHF-SAFDLCCFACFKLEEYNAYTDCLRAWL--

General information: TITO was launched using: RESULT: Template: 5FSZ.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 : 935 -148325 -158.64 -882.89 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -158.64 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.568

(partial model without unconserved sides chains): PDB file : Tito_5FSZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5FSZ-query.scw PDB file : Tito_Scwrl_5FSZ.pdb: