Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLLELVNLHKTFEKGTVNENHVLRGLDLTIEDGDFISVIGGNGAGKSTLLNCIAGLIPIDQGAITLDNQSITKDSVEKR----SKDISRVFQDPRMGTATNLTIEENMAIAHKRGNKRHIFRQSVTDDDRQLFKKSLSQLGLGLENRMKTDAAFLSGGQRQALTLAMATLVRPKLLLLDEHTAALDPKTSDMVMELTQKVIEEQRLTALMITHNMEHAIAYGNRLVMLYHGKIVVDVKGEAKRNLTVAELMELFHKNSGQQLIDDALVLG 2PCJ Chain:A ((2-222)) AEILRAENIKKVIRG-----YEILKGISLSVKKGEFVSIIGASGSGKSTLLYILGLLDAPTEGKVFLEGKEVDYTNEKELSLLRNRKLGFVFQFHYL--IPELTALENVIVPMLKMGKP-------KKEAKERGEYLLSELGL--GDKLSRKPYELSGGEQQRVAIARALANEPILLFADEPTGNLDSANTKRVMDIFLKIN-EGGTSIVMVTHEREL-AELTHRTLEMKDGKVVGEITRV------------------------------

General information: TITO was launched using: RESULT: Template: 2PCJ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output 3D Compatibility (PKB) -119023 for 1736 contacts (-68.6/contact) + 2D Compatibility (PS) -23455 + (NN) -6841 + (LL) 3424 1D Compatibility (HY) -11600 + (ID) 3050 Total energy: -160545.0 ( -92.48 by residue) QMean score : 0.570

(partial model without unconserved sides chains): PDB file : Tito_2PCJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2PCJ-query.scw PDB file : Tito_Scwrl_2PCJ.pdb: