Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSTFTLFFGVP-SGCSFGSIVALEWSGLPYQLCRIEMPAQCNTEEYRQINPVGETPALLYDN---GKVLTESMAILNHIMAKSLNAAFHYEQGTEQFNLFNQKLAFLNTTLFNAFSPHWYSL-EHS---SSEGNKQALREYGAVQVKKAFTALENSLTNQTWLMGDQLSFVDGYYAGIARWLKYHNVIDIDQFPNCKRLYEQLQNEAAVKFAHAIEQE 5NR1 Chain:A ((3-212)) --VERTLHHFPLDPASRQVRLALGEKRLPFVEMQVRYW--EMPPEFTSLNPSGMPPVLVETKHQRNLVICETRAILEHIEETETEPPLLGR-DPAERAEARRLLQWFDRKFDNEVNGFLLHEKMEKRLLRMGAPDLAALRQGREALRMHLGYIESLLQTRDWLAGRRMSLADFAAAAHLSVIDYFGDVPWKDFQAAKTWYMKLKSRPCFRPILAD---

General information: TITO was launched using: RESULT: Template: 5NR1.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 : 927 -25055 -27.03 -124.03 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -27.03 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.606

(partial model without unconserved sides chains): PDB file : Tito_5NR1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5NR1-query.scw PDB file : Tito_Scwrl_5NR1.pdb: