Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKTATALTLACSLLSVMSISQAQAADNIDVSFQTILQQERNWAGLQSKSLKVGDITWSYSEGGSSTKPTLLLIHGLAGSRDNWNRVAHYLTTNYHVIIPDLPGSGETIVSHDFDYSVPNLAEKLRRFVEAANLKGPIHIAGHSLGGSIALLYAGQYPFETKSLFLVDSGGIFRSANT-IYLKDLTYL---KQLLVSK---KGDFNYLLKQTMFNP-PFIPREFLQAQEKLMINQAPQTQKLVDQLIALNKVYTPDSFAVLTKTIDAPTLILWGKQDKIINVEVANELKRLLKNAQPPVILENVGHMPILEAEQLVIQQYVPFLLKVETNQSSKTTTP 4PSU Chain:A ((18-291)) ----------------------------------------------ASRFIEAGGFRWHVQRMGSPAAPAILLIHGTGAASHSWRGLAPLLSRHYHVVAPDLPGHGFTQTPR---MSLPGMASDLAALLRVLQ-VAPQLVVGHSAGAAILARMCLDGSIDPKILFSLNGAFLPYGGPAASFFSPLAKMLVMNPFVPSLFAWQAGHRGAVERLIGNTGSTIDPAGIKLYGKL-VSSPNHVAAAL---RMMA-NWDLEPLLKALPNLKPLLVLVAAEGDRAIPPSVAVKVREILPK-AVIERIPALGHLAHEERPALIAALIERYAEKL-----------

General information: TITO was launched using: RESULT: Template: 4PSU.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 : 1462 -97807 -66.90 -371.89 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -66.90 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.492

(partial model without unconserved sides chains): PDB file : Tito_4PSU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4PSU-query.scw PDB file : Tito_Scwrl_4PSU.pdb: