Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKFEEIDVISPALFPTEQWNEAEVFGAITWLWLASEHLKRSTLSEMAHRVIPVIKSRQFAIFSQGSQPLGYICWANLDPNSEANYVHSEPWIYTHPDWNCGDRMWILTWLSLPNHSHKIKTIIENHLFPNQCFRALYHKGDVQGLKILNFKGKLLSTEQMKQWMVERPILAKQI------------- 4WHN Chain:A ((13-182)) ---------------SKKINGFEVLGEVAWLWASSPLHRKWPLSLLAINVLPAIESNQYVLLKRDGFPIAFCSWANLNLENEIKYLDDVASL-VADDWTSGDRRWFIDWIAPFGDSAALYKHMRDN-FPNELFRAIRVDPDSRVGKISEFHGGKIDKKLASKIFQQYHFELMSELKNKQNFKFSLVN

General information: TITO was launched using: RESULT: Template: 4WHN.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 : 590 -84536 -143.28 -538.45 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -143.28 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.495

(partial model without unconserved sides chains): PDB file : Tito_4WHN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WHN-query.scw PDB file : Tito_Scwrl_4WHN.pdb: