Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MWNPNSIIFCFYFIFSILALWGIIEAWVHQSRTETIHPFKAFVHLLAFYLSYLLIPLWFFNLYAGWIGYYSIHETIFIFLLSGILIYARFIEPHMVRVDVHQYRLNPDRHFVKPVKVALIADLHIGLFSGH-------ERQLKIIVKKLNEQQPDLVVVAGDWTYEPED---KLVQELSVLKD-----------------------------IKAPVYSVPGNHDEQYPGPPIQQLLKDALYYNDVM-DIEG---------KIVEF----DEFRLIGIGDLWAG-------KTDMRSMPDL--PQDKPWLILSHNPDTVDM-------VPKLPNRPLMLSGHTHGGQVELPLVTNYIMKKVSILGHKRGFYSHEHADVFVTVGTGMVGIPLRFRVPPTIDIIELA 3T1I Chain:D ((28-273)) -------------------------------------------------------------------------------------------------------------DDENTFKILVATDIHLGFMEKDAVRGNDTFVTLDEILRLAQENEVDFILLGGDLFHENKPSRKTLHTCLELLRKYCMGDRPVQFEILSDQSVNFGFSKFPNLNISIPVFSIHGNHDDPTGADALC--ALDILSCAGFVNHFGRSMSVEKIDISPVLLQKGSTKIALYGLGSIPDERLYRMFVNKKVTMLRPKEDENSWFNLFVIHQNRSKHGSTNFIPEQFLDDFIDLVIWGHEHECKIAP-------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3T1I.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 797 -12990 -16.30 -76.41 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain D : 0.54 3D Compatibility (PKB) : -16.30 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.481

(partial model without unconserved sides chains): PDB file : Tito_3T1I.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3T1I-query.scw PDB file : Tito_Scwrl_3T1I.pdb: