Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKGVILAGGNGSRLMPLTKAVNKHLLPVGPYPMIYWSIMKLQEAGIKDILLISQKEHMPQFYKLLGNGEELGVTITYQVQPAASGISDGLSYAKRFTKKESFILLLGDNIF-EDSLKPYTERFEQQGKGAKVLLKEVDDPERFGIAEIDEKNKRIRSIIEKPEQPPTNLCVTGIYMYDAEVFSYIEQISPSKRGELEITDVNNLYIENSQLTYDVLS-GW-WVDAGTHESLYLASQLVHQALRKGQDEK 5IFY Chain:E ((12-247)) -KGIILAGGSGTRLYPITHAVSKQLLPVYDKPMIYYPLSTLMIAGIRDVLIISTPQDTPRFESMLGDGSQWGMNIQYATQPSPDGLAQAFVIGRDFVGNEPSALILGDNIFYGHDLAKQLERASAKDTGATVFAYHVQDPERYGVVEFDREFRAI-SIEEKPAKPRSSYAVTGLYFYDRQVCDIAADIKPSARGELEITDVNSRYLAAGQLDVELMGRGYAWLDTGTHDSLIEAGTFI-----------

General information: TITO was launched using: RESULT: Template: 5IFY.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 1248 -75111 -60.19 -322.36 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain E : 0.84 3D Compatibility (PKB) : -60.19 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.84 QMean score : 0.582

(partial model without unconserved sides chains): PDB file : Tito_5IFY.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5IFY-query.scw PDB file : Tito_Scwrl_5IFY.pdb: