Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNATLNYQPHWVREDFVDFVLQKINATWAWKRVLAEVTAVQSLHTDMVLIKLKPNRNFNFDQVRAGESILLTLLIDGVYQQRSYSIIEVT-TQGEIALGIKVQGLVSRAAQ-LLHVGECVEISQPQGDFTLHQG-QQPAILIASGSGVTAIYSLLQQALKQQL-EQIHVIYFNRA---EIFHAELKALAEQYPQLQYHFFNTTEQK------QHLTESLLQKLVPDFEQTATYVCGHHGMMQQANEIYT-QKGAQ-SQLHQEYFQPLQVTGTHAAQPVIFRRAQQEFLAETNLLGSAEQAGLRPQHGCRMGVCNKCSCTKVSGVTQNLLTGEIEDQPNRPIKLCVSQALSPVTIDL 1QFJ Chain:D ((2-231)) -------------------------------TLSCKVTSVEAITDTVYRVRIVPDA---AFSFRAGQYLMVVMDE---RDKRPFSMASTPDEKGFIELHIG----YAKAVMDRILKDHQIVVDIPHGEAWLRDDEERPMILIAGGTGFSYARSILLTALARNPNRDITIYWGGREEQHLYDLCELEALSLKHPGLQVVPVVEQPEAGWRGRTGTVLTAVLQDH-GTLAEHDIYIAGRFEMAKIARDLFCSERNAREDRLFGDAFAF------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1QFJ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 1059 -56148 -53.02 -268.65 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain D : 0.66 3D Compatibility (PKB) : -53.02 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.476

(partial model without unconserved sides chains): PDB file : Tito_1QFJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1QFJ-query.scw PDB file : Tito_Scwrl_1QFJ.pdb: