Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGNYLSVAVELVCGLGILFIILKLLGKTQFSQITPFDFISALILGELVGNAVYDHEIKIKEIIFASLLWGVLIYIIEFITQKMKS-----SRKF--LEGEPNIVIRKGELQYKVMKKNKIDINQLQSLLRQAGSFSIQEVEYAILETNGMVSVLPKSDFDKPTNKDLQIPSKSVSLPITLIIDGEIVRDNLKEAGVDEQWLKQELKKKNIDKTEDVLFAEWHKNKPLYTVTYEQSRST 4M75 Chain:B ((4-88)) -----------------------------------FSFFKTLVDQEVVVELKNDIEIK-----------GTLQSVDQFLNLKLDNISSTDEKKYPHLGSVRNIFIRGSTVRYVYLNKNMVDTNLLQDATRR-----------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4M75.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 : 245 -35804 -146.14 -459.03 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain B : 0.56 3D Compatibility (PKB) : -146.14 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.275

(partial model without unconserved sides chains): PDB file : Tito_4M75.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4M75-query.scw PDB file : Tito_Scwrl_4M75.pdb: