Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLTDLTFIHAADLHLDSPFYGISHLPEPIFARIKESTFASVRHMIDAAVREHVDFILLAGDLFDEA-NRSLKAQLFLKKQFERLRECGISVYVIFGNHDHLGGEWTP---IEWPENVHIFSSAVPEEKSFFKEGRRIASIYGFSYQARAL------------MENQAARYR-R-STDAPFHIGMLHGTLSGSEGHDPY---CPFTH-DDLVKSGMDYWALGHIHKRQVLSAEHPAVIYPGNTQARHIKETG-DKGYYLVHVTNGD-ISYEFQRAHDVLWEKAAVDVTEAKNMTALFQMVEDTFSKLRKKGSPVCVRLVLQGTAPEWLLEAPKGTLDEFLEALQEQEAEEERFVWPLRLDDETENEANLTNLDPFFGGLFEDIDRSDLSDVLEGLERHPVYRRHADRFSQEEVKEIKEQAQIILKRQLKVLDT 4NZV Chain:A ((16-324)) -LKELKILHTSDWHLGVTSWTSS---R--PVDRREELKKALDKVVEEAEKREVDLILLTGDLLHSRNNPSVVALHDLLDYLKRMMR-TAPVVVLPGNHDWKGLKLFGNFVTSISSDITFVMSFEP--VDVEAKRGQKVRILPFPYPDESEALRKNEGDFRFFLESRLNKLYEEALKKEDFAIFMGHFTVEGLAGYAGIEQGREIIINRALIPSVVDYAALGHIHSFREIQ-KQPLTIYPGSLIRIDFGEEADEKGAVFVELKRGEPPRYERIDASPLPLKTLYYKKIDTSALKSI----RDFCR----NFP-GYVRVVYEEDSGILPD--------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4NZV.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 : 1494 -163181 -109.22 -572.56 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -109.22 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.452

(partial model without unconserved sides chains): PDB file : Tito_4NZV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NZV-query.scw PDB file : Tito_Scwrl_4NZV.pdb: