Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRIMGLDVGSKTVGVAISDPLGFTAQGLEIIQINEEQGQFGFDRVKELVDT-YKVERFVVGLPKNMNNTSGPR-------VEASQAYGAKLEEFFGLPVDYQDERLTTVAAERMLIEQADISRNKRKKVIDKLAAQLILQNYLDRKF 4HTL Chain:A ((5-115)) -KIAAFDIGGTALKMGVVLPHGEIILTK-SAEISGSDGDQILAEMKVFLAENTDVTGIAVSAPGYVNPKTGLITMGGAIRRFDNFNLKEWLEAETGLPVAIENDANCALLAEK----------------------------------

General information: TITO was launched using: RESULT: Template: 4HTL.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 : 489 -24342 -49.78 -236.33 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -49.78 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.430

(partial model without unconserved sides chains): PDB file : Tito_4HTL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4HTL-query.scw PDB file : Tito_Scwrl_4HTL.pdb: