Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGLRKTYAKPYSRGISSPLEALRISPVVLSALKGLLSPDTLSRLTPL-GGFEARVYTD-GERVYKVYQPGEA-HLAALEAERM---AR-AGLG-SFVLGVAQ-VEGQGILVIRHFPGKPFSPESF-------TPKALAALSHLFLSLHRLPEPGYVER----EELSERLERFAESLGSVPE---AL---SLIKALMREV-TW--VAGVEKRFCHRDAWAGNLLLKTQE-NPSHDDPEVLLVDWVRSGGDDPARDLALLKTGSLDLLGEKRAREALFRLVQFYPK-----EVRERLAFYVPLTYLHDLHWFRTKKPEGFLEALADKLPRALSFFQDCFPLRNRAC 3TDW Chain:A ((7-280)) --------------------------HYTTMIMTQFPDISIQSVESLGEGFRNYAILVNGDWVFRFPKSQQGADELNKEIQLLPLLVGCVKVNIPQYVYIGKRSDGNPFVGYRKVQGQILGEDGMAVLPDDAKDRLALQLAEFMNELSAFPVETAISAGVPVTNLKNKILLLSEAVEDQVFPLLDESLRDYLTLRFQSYMTHPVYTRYTPRLIHGDLSPDHFLTNLNSRQT----PLTGIIDFGDAAISDPDYDYVYLLEDC-GEL-F-------TRQVMAYRGEVDLDTHIRKVSLFVTFDQVSYLLEGLRA-------------------------------

General information: TITO was launched using: RESULT: Template: 3TDW.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 : 1002 -15050 -15.02 -62.97 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -15.02 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.316

(partial model without unconserved sides chains): PDB file : Tito_3TDW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3tdw-query.scw PDB file : Tito_Scwrl_3TDW.pdb: