Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNDFTTEIMEILINKGDLDDLFRRHLELAINALLQAELTVFLDYEKYDRAGFNSGNSRNGNYSRSFKTEYGELNLVIPRDRNGDFSQQTLPAYKRTNDSLETTIIQLVQKGITMSEISDLIEKMYGHYYKPQTISNMSKIVSEDVSAFKERTLEAKYSVIFMDATHIPLKRQTVSKEAVYIVIGIRLDGTKEVLGFTI--------APTESAYVWKEILQDLKDRGLEEVLLVVTDGLSGIDDSIHSVYPNAQFQQCCVHISRNIAHKVRVSDRQEICSDFKLVYQASSKEEANNQIRFMIDKWKKQYPRVVKLLMNPAILTFYNFPPSIRRTIYSTNLIEGFNKQLKKYTKRKEQFPNEESLERFLVSQFNNYNQKFLCRV-HKGFKEIHDTLESMF- 3F8U Chain:B ((21-401)) ----GPAVIECWFVEKRPGALLLPPPRPDLDPELYLSVH--------DPAG--ALQAAFRRYPRGAPAPHCEMSRFVPLPASAKWASGLTPA-QNCPRALDGAWLMVSISSPVL-SLSSLLRPQPEPQQEPVLITMATVVLTVLTHTPAPRVRLGQDALLDLSFAYMP-PTSEPGPPPFGLEWRRQHLGKGHLLLAATPGLNGQMPAAQEGAVAFAAWDDDEPWGPWTGNGTFWLPRVQPFQEGTYLATIHLPYLQGQVTLELAVYKPPKVSLMPA-------TLARAAPGEAPPELLCLVSHF---YPS------GGLEVEWELRGGPGGRSQKAEG-----QRWLSALRHHSDGSVSLSGHLQPPPVTTEQHGARYACRIHHPSLPASGRSAEVTLE

General information: TITO was launched using: RESULT: Template: 3F8U.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1931 -39979 -20.70 -113.90 target 2D structure prediction score : 0.33 Monomeric hydrophicity matching model chain B : 0.64 3D Compatibility (PKB) : -20.70 2D Compatibility (Sec. Struct. Predict.) : 0.33 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.040

(partial model without unconserved sides chains): PDB file : Tito_3F8U.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3F8U-query.scw PDB file : Tito_Scwrl_3F8U.pdb: