Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVMSDNTKYIFLSPHLDDAIFSCGDYISKLTSEGEIVLVITIFSGYPLSQQLQPSAKQFHKLCNLGKYPIEERKKEDRLACERLQCD-FRHLSYYECLYRKDRNGNFLYRHIYSELKNEDTLKNDIIKELLMHLDDKCVVYCPLSLGDHVDHVFVNSIGRALEFM-RYKVIYYEDFPYVSDSSMVSYMGKTKELKMYQEELDEKHYIDRISSILCYKSQILIIWKS-----VE---KLLNNIKELYLRN-GAAYSIRFWIKK 2IXD Chain:A ((2-221)) ----SGLHILAFGAHADDVEIGMAGTIAKYTKQGYEVGICDLTEADLSSNG-----------------TIELRKEEAKVAARIMGVKTRLNLAMPDRGLYM-----------------KEEYIREIVK--VIRTYKPKLVFAPYYEDRHPDHANCAKLVEEAIFSAGIRKYMPELSPHRVESFYNYMINGF-HKPNFCIDIS-EYLSIKVEALEAYESQFSTGSDGVKTPLTEGYVETVIAREKMFGKEVGVLYAEGFMSKK

General information: TITO was launched using: RESULT: Template: 2IXD.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 : 1160 -66734 -57.53 -319.30 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -57.53 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.386

(partial model without unconserved sides chains): PDB file : Tito_2IXD.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2IXD-query.scw PDB file : Tito_Scwrl_2IXD.pdb: