Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------------------MLVYIGNGHYCYSNSTAMFLSSIGENVSPQLVEILTGVGL----------GAMIEYEKNLYFSMRDPDDGINYALNILGFT---AEEHQQASDLDDPFPLLKQQIKQNPVILGPLDMGELTYHPNHKNLNGSDHYVLGYQM------------DNENIYVQDPAGFPFVPLS------LDQFKKAWMAERIPYRK-----------GINKYWSTAKKVVTLDNNEIYERAIDYFKRTYRKFEKVDIGLIGREAICFYADQLLNAPITADTIRHTTFFLFQLSARRANDYA--MYFKDRHSHLSVLKTEQAKVFGICHSMSVNKDWKGISEKLMKLADLEDNFRLELLKVGY 4K7J Chain:A ((26-375)) GLLTDYGNASASPWMKKLQSVAQGSGETFRILQIGDSHTAGDFFTDSLRKRLQKTWGD------GGIGWVYPANVKGQRMAAVRHNGNWQSLTSRNNTGDFPLGGILAHTGSGGSMTLTASDGIAS----KQRVSLFAKPL--LAEQTLTVNGNTVSANGGGWQVLDTGAALPLTIHTEMPWDIGFINIENPAGGITVSAMGINGAQLTQWSK-WRADRMNDLAQTGADLVILSYGTNEAFNN-----NIDIADTEQKWLDTVRQIRDSLPAAGILIIG-------APESLKNTLGVCGTRPVRLTEVQQMQRRVARQGQTMFWSWQNAMGGICSMKNWLNQGWAAKDGVHFSAKGYRRAAEMLADSLEELVRSA-----

General information: TITO was launched using: RESULT: Template: 4K7J.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 : 1532 37154 24.25 134.13 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : 24.25 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.240

(partial model without unconserved sides chains): PDB file : Tito_4K7J.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4K7J-query.scw PDB file : Tito_Scwrl_4K7J.pdb: