Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGRLVFNYRKAMREPKKIQQLTENYSLPFAVELIPAINYFIFVGLCFGFWYGVRMIFPHAFDNSYVIVIFGI-PFFLTMLVTKIK---------PEGKNIYIYFFDF-AKYYFFIKLPQKKYCNDRKIDLSNEKQIEFRKLVKVVDYSNETKNAYEGNTQEFA--VNKNGRRVGVLPNKKQFDSYAK 1DD5 Chain:A ((2-185)) VNPFIKEAKEKMK--RTLEKIEDELRKMRTGKPSPAILEEIKVDY-YGVPTPVNQLATISISEERTLVIKPWDKSVLSLIEKAINASDLGLNPINDGNVIRLVFPSPTTEQREKWVKKAKEIVEEGKIAIRNIRREILKKIKEDQKEGLIPEDDAKRLENEIQKLTDEFIEKLDEVFEIKKEEIMEF

General information: TITO was launched using: RESULT: Template: 1DD5.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 : 591 -69284 -117.23 -405.17 target 2D structure prediction score : 0.43 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -117.23 2D Compatibility (Sec. Struct. Predict.) : 0.43 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.194

(partial model without unconserved sides chains): PDB file : Tito_1DD5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1DD5-query.scw PDB file : Tito_Scwrl_1DD5.pdb: