Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MELYIITGASKGLGQAIALQALEKGHEVHALSRTKTD--VSHK--KLTQHQIDLINLEEAEQQFETLLSSIDSDRYSGITLINNAGMVTPIK---RAGEASLDELQRHYQLNLTAPVLLSQLFTKRFASYS-----GKKTVVNITSGAAKNPYKGWSAYCSSKAGLDMFTRTFGFEQEDEELPVNMISFSPGVMDTEMQAVIRSSSKKDFHHIERFRKLNET-GSLRSPDFIAGTLLSLLEKGTENGRIYDIKEFL 4XGN Chain:A ((13-252)) DNVFLITGGASGLGAGTARLLTEAGGKVVLADLNQDAGEALARELGGVFVRCDVAREEDAQAAVAAAT-K----LGTLRGLVNCAGIAPAAKTVGKDGPHPLELFAKTITVNLIGTFNMIRVAAAAMAANEPAPTGERGVIVSTASVAAFDGQIGQAAYAASKAGVAGMTLPIARDLS--RNAIRVMTIAPGIFETPMLLGMPQE------VQDALGAMVPFPPRLGKPAEYAMLVRQIFENPMLNGEVIRLD---

General information: TITO was launched using: RESULT: Template: 4XGN.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 : 1242 -18420 -14.83 -81.15 target 2D structure prediction score : 0.72 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -14.83 2D Compatibility (Sec. Struct. Predict.) : 0.72 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.441

(partial model without unconserved sides chains): PDB file : Tito_4XGN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4XGN-query.scw PDB file : Tito_Scwrl_4XGN.pdb: