Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKSYQAVYQILSK-ETDYISGEKIAEKLSLSRTSIWKAIKRLEQEGIEINSIKNRGYKLMN-GDLILPEILEENLPIKVSFK-----PETKSTQLDAKEAIDLGHEANTLYLASYQTAGRGRFQRSFYSPQG-GIYMTLHLKPNLPYDKLPSYTLLVAGAVYKAIKNLTLIDVDIKWVNDIYLNNHKIGGILTEAMTSVETGLVTDIIIGVGINFT--IKDFPQELKEKAASL-FKATAPITR----NELIIEI---WRAFFETPAEELLYLYKKQSFILGKEVTFTLEQKDYKGLAKDISENGKLLVQCDNGKEIWLNSGEISLNSWK 4DQ2 Chain:A ((2-322)) -KYSQDVLQLLYKNKPNYISGQSIAESLNISRTAVKKVIDQLKLEGCKIDSVNHKGHLLQQLPDIWYQGIIDQYTKSSALFDFSEVYDSIDSTQLAAKKSL-VGNQSSFFILSDEQTKGRGRFNRHWSSSKGQGLWMSVVLRPNVAFSMISKFNLFIALGIRDAIQHFSQDEVKVKWPNDIYIDNGKVCGFLTE-MVANNDG-IEAIICGIGINLTQQLENFDESIRHRATSIQLHDKNKLDRYQFLERLLQEIEKRYNQFLTLPFSEIREEYIAASNIWNRTLLFTENDKQFKGQAIDLDYDGYLIVRDEAGESHRLISADIDF----

General information: TITO was launched using: RESULT: Template: 4DQ2.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 : 1503 55883 37.18 184.43 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.79 3D Compatibility (PKB) : 37.18 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.79 QMean score : 0.539

(partial model without unconserved sides chains): PDB file : Tito_4DQ2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4DQ2-query.scw PDB file : Tito_Scwrl_4DQ2.pdb: