Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSTASQHRKSDSAERDEVNVKNAPKVASEAEINRRNVVFAEALRCAC-IAMRVGDDPGYIWTPQRLGAGSFGTVTLAY-RHEGDAVWRKTAVKRISLRKEMRLSAVLEKVRCAGREVALCRRAGVSPHVVPMYEPWFDCREGVIALPMDAGDFSLEQYAVHCGFRFPPLVLLSMCAQCARAVAHLHRRGVVHRDVKPDNFVVNVFDTAGGAGAGGDGGRRDARAPLVRILDFGLACGVEEVGQELKRCVGTPHYMAPETFSHLCDCDVPAACDVWSLGVTLFRLATGVFPVFEMDKTWQQPPFTALHSGKLWLPSRNLFHEPLSAESLAVLSVAASMLVLDPRYRPTADAAVLQLQGFQEAFSHQIQSWPPGSGPQPCRVWKRTRK 2F57 Chain:A ((25-289)) -------------------------------------VSHEQFRAALQLVVSPGDPREYLANFIKIGEGSTGIVCIATEKHTG----KQVAVKKMDLRKQQRRELLFNEV--------VIMRDYHHDNVVDMYSSYLVGDELWVVMEFLEGG-ALTDIVTHT--RMNEEQIATVCLSVLRALSYLHNQGVIHRDIKSDSILLT----------------SDGR---IKLSDFGFCAQVSKEVPKRKSLVGTPYWMAPEVISRL---PYGTEVDIWSLGIMVIEMIDGEPPYF------NEPPLQAMRRIRDSLPPRV---KDLHKVSSVLRGFLDLMLVREPSQRATA--------------------------------------

General information: TITO was launched using: RESULT: Template: 2F57.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 : 1261 -34652 -27.48 -131.75 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : -27.48 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.390

(partial model without unconserved sides chains): PDB file : Tito_2F57.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2F57-query.scw PDB file : Tito_Scwrl_2F57.pdb: