Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MALFLQRSNQHSNNNRLKRMKSHLRVHYFQHIAGEGFGSCYSFLKAHHATITATEFFALPVDLPLEIEALP-YIEDVDLLLIMGGTMSVNDEANYPWLKIEKRWIRRYLAAGKPAIGLCLGGQLIANALGAAVSRNRYQELGWSTVQRVPNLPKESFL--LPEKINVMQWHSETF-EIPKGAIHLAENSVCRNQMYQIG-SNVLGFQFHPEMTP-----KVLNLLLENEQELSIFKGEYVQSLDELHHCDIQKFEQGNQLLNRAIEFVVNQ 2VXO Chain:B ((27-225)) --------------------HYEGAVVILDAGA-QYGKVIDRRVRELF--VQSEIF--PLE---TP--AFAIKEQGFRAIIISGGPNSVYA-EDAPWFDPA------IFTIGKPVLGICYGMQMMNKVFGGTVHKKS---DGVFNISVDNT---CSLFRGLQKEEVVLLTHGDSVDKVADGFKVVARSGNI-VAGIANESKKLYGAQFHPEVGLTENGKVILKNFLYDIA-----------------------------------------

General information: TITO was launched using: RESULT: Template: 2VXO.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 : 961 -47504 -49.43 -269.91 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain B : 0.67 3D Compatibility (PKB) : -49.43 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.390

(partial model without unconserved sides chains): PDB file : Tito_2VXO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2VXO-query.scw PDB file : Tito_Scwrl_2VXO.pdb: