Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MREKMRFPTLVFDIETLTDLKAGAHLYHLDLPEADVEQALTKIRRQESGMDFQRLP--LHEIVCISGLWIDES-GFRLF--------------SFSREHYSEAEILQKFLSIFDKRHPTLVSWNGSQFDLPVILFRAMYHGLSAPGLFDQGELDSQKRFNNYQNRY-HHRHIDLMDVMAM-----F----NGRNFQKLDDVACILGLPGKRGESGYHVPEYVRTEQWLKLTSYCEGDVLNTWFIYLRWLLLKGQMNVDEHNHWISSSIEYLQTMPQQADFLEVWQRTSKHTEFTSHYFNPLNF 1S5J Chain:A ((187-485)) ---IPKIKRVAIDIEVYTPVK----------------------------GRIPDSQKAEFPIISIALAGSDGLKKVLVLNRNDVNEGSVKLDGISVERFNTEYELLGRFFDILLEY-PIVLTFNGDDFDLPYIYFRALKLGYFPEEI-PIDV------AGKDEAKYLAGLHIDLYKFFFNKAVRNYAFEGKYNE-YNLDAVAKALLGTS--KVDTL-----ISFLDVEKLIEYNFRDAEITLQLTTFN-------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1S5J.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 -23279 -32.11 -133.78 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -32.11 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.294

(partial model without unconserved sides chains): PDB file : Tito_1S5J.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1S5J-query.scw PDB file : Tito_Scwrl_1S5J.pdb: