Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNHVMCVMSYSLKMVLNHEEDTQRLAQALAQHVQAGVIYLIGDLGAGKTTLTRYFLQALGHKGSVKSPTYTLVEPYKINNKEIFHFDLYRLNDPYELELMGIRDYLDIQDALFLFEWPSKGGDEIPEADIVIDIQKSDDELNRFVTLTLPTEHLYQTLQEQLHD 1HTW Chain:B ((32-139)) ---------------------------------KAIMVYLNGDLGAGKTTLTRGMLQGIGHQGNVKSPTYTLVEEYNIAGKMIYHFDLYRLADPEELEFMGIRDYFN-TDSICLIEWSEKGQGILPEADILVNIDYYDDARN----------------------

General information: TITO was launched using: RESULT: Template: 1HTW.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 : 469 -68775 -146.64 -636.81 target 2D structure prediction score : 0.75 Monomeric hydrophicity matching model chain B : 0.75 3D Compatibility (PKB) : -146.64 2D Compatibility (Sec. Struct. Predict.) : 0.75 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.505

(partial model without unconserved sides chains): PDB file : Tito_1HTW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1HTW-query.scw PDB file : Tito_Scwrl_1HTW.pdb: