Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRISDQVVMKLQALIEERHMKKGDRLPAERQLATSLGVSRPSLREAIQQLNSQGVLISRRGDGTYIQQLPEQWPQQLIVNPISNLIEEDPLYRFDVQEARLVLEGGTAWYAALRSTPEDRAKIHHYFNEISRHQNAGDSAQAAVADAEFHLAIAEASHNVVLIQMMRSLFD-LLQYNVLLGRKKV-YNDPVNGDLLSEQHFQVMDAIDRKDPEAARQAVCGHIEFVINHVRSLDEDEARQKRANRLNRVDSK 2HS5 Chain:A ((27-233)) TSRTTRVAGILRDAIIDGTFRPGARLS-EPDICAALDVSRNTVREAFQILIEDRLVAHELNRGVFVRVP-------------------TAEDITELYICRRVVECAGVNGFD--PATGDLSRVAEALDLADERYAVEDWTGVGTADIHFHSALASLNNSNRIDEL------MRSVWNEARLVFHVMDDAHRFHGPYLTRNHEIYDALAAGNTEAAGQLLKTYLEDAEAQILGAYR-----------------

General information: TITO was launched using: RESULT: Template: 2HS5.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 : 836 -42501 -50.84 -207.32 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -50.84 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.444

(partial model without unconserved sides chains): PDB file : Tito_2HS5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2HS5-query.scw PDB file : Tito_Scwrl_2HS5.pdb: