Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAIKSDRWIR-EMSEKHGMIEPYAENQVRFDKNGEKLISYGVSSYGYDVRCAREFKVFTNVHSAIVDP-KNFDEKSFI--DIESDVCIIPPNSFALARTIEYFRIPRNVLTVCLGKSTYARCGIIVNVTP--LEPEWEGHVTLEFSNTTNLPARIYAGEGVAQMLFFESDEVCETSYKDR--GGKYQGQTGVTLPKT 4A6A Chain:A ((2-178)) --LLSDRDLRAEISSGRLGIDPFDDTLVQ--------------PSSIDVRLDCLFRVFNNTRYTHIDPAKQQDELTSLVQPVDGEPFVLHPGEFVLGSTLELFTLPDNLAGRLEGKSSLGRLGLLTHSTVGFIDPGFSGHITLELSNVANLPITLWPGMKIGQLCMLRLTSPSEHPYGSSRAGSKYQGQRGPT----

General information: TITO was launched using: RESULT: Template: 4A6A.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 : 725 7432 10.25 43.98 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain A : 0.76 3D Compatibility (PKB) : 10.25 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.372

(partial model without unconserved sides chains): PDB file : Tito_4A6A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4A6A-query.scw PDB file : Tito_Scwrl_4A6A.pdb: