Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRLTDFSAIHLPAVEKEILSFLDEHTTDRGLYDAMSYSVKAGGKRIRPLLLLTAVASFDEPIDVP-----VYQVAAALEMVHTYSLIHDDLPAMDNDDLRRGKPTNHKVFGEALAILAGDGLLTGAFQLISMAHLGNSPKLLLLQQLAVCAGSQGMVAGQAADIEGESKKLSLEELAFIHERKTGHLIRYALLAGGILAK-QPEEILLLLQRLAEHLGLAFQIRDDLLDVIGTTKTLGKTAGKDERMEKNTYPRLLGLEKTR---EALEIELLSANKIIDKLEEDVFSFDGGLMRQMIKQFDVEK 3Q1O Chain:C ((51-284)) --------------------------------------VLNGGKRFRPKLFLAVLCALVGQKDYSNQQTEYFKIALSIECLHTYSLIHDDLPCMDNAALRRNHPTLHAKYDETTAVLIGDALNTYSFELLSNALLESHIIVELIKILSANGGIKGMILGQALDCYFENTPLNLEQLTFLHEHKTAKLISASLIMGLVASGIKDEELFKWLQAFGLKMGLCFQVLDDIIDVTQDEEESGKTTHLDSA--KNSFVNLLGLERANNYAQTLKTEVLN-------------------------------

General information: TITO was launched using: RESULT: Template: 3Q1O.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 992 -4055 -4.09 -18.02 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain C : 0.74 3D Compatibility (PKB) : -4.09 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.409

(partial model without unconserved sides chains): PDB file : Tito_3Q1O.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3Q1O-query.scw PDB file : Tito_Scwrl_3Q1O.pdb: