Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MASILLIGFMGAGKTTIGKGLAQCLQKEYVDLDTKIEEHI-QLSIAEYFHYYGEKSFRKVESDILRKLSN--EDKIIATGGGIVQSAENRRFLKTQPIVLYLEAEADCLVDRIQQDETSIRPLALGK----TREEIKALLAQRLSWYEESATHRIN------------TTNQTPEKIIDTIIERIKSI 3NWJ Chain:B ((98-286)) GRSMYLVGMMGSGKTTVGKIMARSLGYTFFDCDTLIEQAMKGTSVAEIFEHFGESVFREKETEALKKLSLMYHQVVVSTGGGAVIRPINWKYMH-KGISIWLDVPLEALAHRI--------------TYTAALNRLSTIWDARGEAYTK-ASARVSLENITLKLGYRSVSDLTPAEIAIEAFEQVQS-

General information: TITO was launched using: RESULT: Template: 3NWJ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 631 -14852 -23.54 -97.71 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain B : 0.75 3D Compatibility (PKB) : -23.54 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.667

(partial model without unconserved sides chains): PDB file : Tito_3NWJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3NWJ-query.scw PDB file : Tito_Scwrl_3NWJ.pdb: