Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIQWWQILLLTLYSAYQICDELTIVSSAGSPVFAGFITGLI-MGDVTTGLLIGGNL-QLFVL-GVGTFGGASRIDATS-GAVLATAFSVSQGIDAPLAITTIAVPVAALLTYFDVLGRMTTTFFAHRVDAAIERFDYKGIERNYLLGAIPWALSRALPVFFALAFGGAFVQSVVDFVEA-YKWVA-DGLTLAGRMLPGLGF-AILLRYLPVKRNLHYLAMGFGLTAMLTVLYSY-VTGLGG------AVAGIVGTLPAEVAQKIGFVNNFKGLSMIG-ISIVGIFLAVLHFKNSQKVA-VAAPSTPSESGEIEDDEF 2QGN Chain:A ((2-314)) --------------------KEKLVAIVG-PTAVGKTKTSVMLAKRLNGEVISGDSMQVYRGMDIGT----AKITAEEMDGVPHH-----------------------LIDIKDPSESFSVADFQDLATPLITEIHERG--------RLPFLVGGTGLYVNAVIHQFNLGETPSPYNLVMIGL-TMERDVLYDRINRRVDQMV--EEGLIDEAKKLYDRGIRDCQSVQAIGYKEMYDYLDGNVTLEEAIDTLKRNSRRYAKRQLTWFRNKANVTWFDMTD-----------VDFDKKIMEIHNFIAGKLEEKSK---

General information: TITO was launched using: RESULT: Template: 2QGN.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 : 1094 -25504 -23.31 -111.86 target 2D structure prediction score : 0.42 Monomeric hydrophicity matching model chain A : 0.56 3D Compatibility (PKB) : -23.31 2D Compatibility (Sec. Struct. Predict.) : 0.42 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.185

(partial model without unconserved sides chains): PDB file : Tito_2QGN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2QGN-query.scw PDB file : Tito_Scwrl_2QGN.pdb: