Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFIHIVGPGDSLFSIGRRYGASVDQIRGVNGLDETNIVPGQALLIPLYVYTVQPRDTLTAIAAKAFVPLERLRAANPGISPNALQAGAKITIPSISNYIAGTLSFYVLRNPDL----DRELINDYAPYSSSISIFEYHIAPNGD-IA-NQLN-------DAAAIE-TTWQRRVTPLATITNLTSGGFSTEIVHQVLNNPTARTNLVNNIYDLVSTRGYGGVTIDFEQVSA-------ADRDLFTGFLRQLRDRLQAG--GYVLTIAVPAKTSDNIPWLRGYDYGGIGAVVNYMFIMAYDWHHAGS-EPGPVAPIT------------EIRRTIEFTIA-QVPSRKIIIGVPLYGYDWIIPYQP---------------G------TVASAISNQNAIERAMR--YQAPIQYSAEYQSPFFRYSDQQGRTHEVWFEDVRSMSRKMQIVREYRLQAIGAWQLTLGFTPG-----PWLLRKFFTIRKV 3W4R Chain:A ((24-394)) --------------------------------------------------------------------------------------------------RARVVCYFSNWAVYRPGVGRYGIEDIPVDMCTHIIYSFIGVTEDTQQVLIIDPELDVDKNGFKNFTSLRSKHPGVKFTVAVGGWAE---GGSKYSKMVAAKSTRMAFVRSVVDFLNKYNFDGLDLDWEYPGAADRGGSFSDKDKFLYLVQELRRAFIREGKGWELTAAVPLANFR---LMEGYHVPELCQELDAIHVMSYDLRGNWAGFADVHSPLYKRPHDQWAYEKLNVNDGLQLWEDKGCPTNKLVVGIPFYGRSFTLSSGNNNYNLGTYINKEAGGGDPAPYTNATGFWAYYEICTEVDTADSKWTKKWDEHGKCPYAYKG-----TQWVGYEDPRSVEIKMNWIKEKGYLGAMTWAIDMDDFQGLCGEKNILIKLLH-----

General information: TITO was launched using: RESULT: Template: 3W4R.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 : 1759 -219204 -124.62 -716.35 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -124.62 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.442

(partial model without unconserved sides chains): PDB file : Tito_3W4R.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3W4R-query.scw PDB file : Tito_Scwrl_3W4R.pdb: