Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFNTAVKILYRSLIELTNHRLSSYLIKGFCESKISKPVIPLFSKHFRLNWDDVDGTAADYGSLSELFIRQINLERRPVSKEAHAVVSPVDGVVQTVGIINPNQTFTVKGKDYSFAELTGCKSADHQYNGGYFVVLYLSPRHYHRFHSPISCRYQKLAELGNRSYPVNQLGLKYGKDVLSKNYRFVYELNSGSRNVLMIPVGAMNI---NS-IVQTNT-RTELEIGEELGYFSF------G--STVILVFEKDA-FQPSAHLAEGQEVQVGELIGYEE 2GPR Chain:A ((12-157)) ---------------------------------------------------------------------------------NLKVLAPCDGTIITLDEVEDE-VFKE-----------------RMLGDGFA----INPKS-NDFHAPVSGKLVTAF-----------------------PTKHAFGIQTKSGVEILLHIGLDTVSLDGNGFESFVTQDQEVNAGDKLVTVDLKSVAKKVPSIKSPIIFTNNGGKTLE--IVKMGEVKQGDVVAI--

General information: TITO was launched using: RESULT: Template: 2GPR.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 : 739 -84974 -114.98 -643.74 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -114.98 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.387

(partial model without unconserved sides chains): PDB file : Tito_2GPR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2GPR-query.scw PDB file : Tito_Scwrl_2GPR.pdb: