Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKDIYVEFRGKY--KVDGESRDSEHKGWLEVNSWSHNIRQPKSATSSSVGGHTAERVEHSDMVFVKDLDATSPKLWEACSAGYTFDEVQIDFYRANGDKRIKYLQIKLKHVLVSSVTPTVNE-EGVPTEAFGLKYAAVEWTYNQQDINGTAKGAVTKKWSLSNNTASYAA 4HKH Chain:F ((2-154)) AIPVYLWLKDDGGADIKGSVDVQDREGSIEVVAQEHCLYIPTD-------GKLTGTRIHTPFLFTKEIDSSSPYLYKAVTTGQTLKSAEFKWYKI---QEVEYFNTKLENVKVVKVNPVMHDI-HNHLEQVELRYEKITWTYKDGNIIHS--------------------

General information: TITO was launched using: RESULT: Template: 4HKH.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain F - contact count / total energy / energy per contact / energy per residue : 611 19144 31.33 140.76 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain F : 0.72 3D Compatibility (PKB) : 31.33 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.478

(partial model without unconserved sides chains): PDB file : Tito_4HKH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4HKH-query.scw PDB file : Tito_Scwrl_4HKH.pdb: