Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKLISWNIDSLNAALTSDSARAKLSQEVLQTLVAENADIIAIQETKLSAKGPTKKHVEILEELFPGYENTWRSSQEPARKGYAGTMFLYKKELTPTISFPEIGAPSTMDLEGRIITLEFDAFFVTQVYTPNAGDGLKRLEERQVWDAKYAEYLAELDKEKPVLATGDYNVAHNEIDLANPASNRRSPGFTDEERAGFTNLLATGFTDTFRHVHGDVPERYTWWAQRSKTSKINNTGWRIDYWLTSNRIADKVTKSDMIDSGARQDHTPIVLEIDL 5CFE Chain:A ((1-252)) MKLISWNVNGLRAVMRK--------MDFLSYLKEEDADIICLQETKIQ-----DGQVDLQPEDYHVYWNY------AVKKGYSGTAVFSKQE--PLQVIYGIGVEEH-DQEGRVITLEFENVFVMTVYTPNSRRGLERIDYRMQWEEALLSYILELDQKKPVILCGDLNVAHQEIDLKNPKANRNNAGFSDQEREAFTRFLEAGFVDSFRHVYPDLEGAYSWWSYRA-GARDRNIGWRIDYFVVSESLKEQIEDASISADVMGSDHCPVELIINI

General information: TITO was launched using: RESULT: Template: 5CFE.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 : 1430 -125856 -88.01 -499.43 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.81 3D Compatibility (PKB) : -88.01 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.81 QMean score : 0.484

(partial model without unconserved sides chains): PDB file : Tito_5CFE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5CFE-query.scw PDB file : Tito_Scwrl_5CFE.pdb: