Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLTDQSTRIRAGEELDAAVIDPYLKAHIPG-LEGTPKIS--QFPGGASNLTYLIEYP--------RQEFVLRRPPFGHK--AKSAHDMGREYRILNQLN--AGFPYCPKAYLYCTDESVIGAEFYVMERVKGIILRAELPPE------LNLDEQQTRSLCKSFIDKFVELHNVDYAACGLADLGRPDGYVQRQ---IAGWTDRYEKALTPDAPLWEPVKAWLKDKQPA---DHHKPGIVHNDYRFDNVILDPENPMQIIGVLDWELATLGDPLMDLGNTLAYWVEAGDPAPVQLTRRQPSHLPGM---LTRREFADYYAERAGIPPIDNLDFYYTYGLFRLAGIVQQIYYRYYH-GQTQDKRFAQFVQMNKLLEQMSLQAIERSRL 3ATS Chain:A ((4-336)) ------------------AVISRWLSSVLPGGAAPEVTVESGVDSTGMSSETIILTARWQQDGRSIQQKLVARVAPAAEDVPVFPTYRLDHQFEVIRLVGELTDVP-VPRVRWIETTGDVLGTPFFLMDYVEGVVPPDVMPYTFGDNWFADAPAERQRQLQDATVAALATLHSIPNAQNTFSFLT--DTTLHRHFNWVRSWYDFAVEG-IGRSPLLERTFEWLQSHWPDDAAAR-EPVLLWGDARVGNVLYRDF---QPVAVLDWEMVALGPRELDVAWMIFAHRVFQELAG-------LATLPGLPEVMREDDVRATYQALTGVEL-GDLHWFYVYSGVMWACVFMRTGARRVHFGEIEKP-------------------------

General information: TITO was launched using: RESULT: Template: 3ATS.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 : 1345 -13573 -10.09 -45.70 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -10.09 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.453

(partial model without unconserved sides chains): PDB file : Tito_3ATS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ats-query.scw PDB file : Tito_Scwrl_3ATS.pdb: