Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNYYSKNKENFYQKLT-DDPLFSSLTDYLYEHREQETILRELKKEFSQNKFSHFLDLLIDAGLIKREERRYHLNFPIFDPKDYLQQATSAAETIAEQLKRLSVDEQKLAMGEVIWAYCFEDERKEAYFYGVRNSRETELLRTTAGNEKYRFITLSSIEHFPLTLANYFFVQKNQLPVTKAFKELAELIGDVNESYFFDQIEVIVDRIRKNKYKNRRPSIFHQSLLVTNTIKEEESFTLELPIVEKNNFEIELPTLDPSLTMEEMAFLKRQIFSELSKKFIPHAFSYIKEYGTVLVSKT 4FRF Chain:A ((30-266)) -----EIEVKFYESFSSNTEVPEHIHRYFPVYHGTMMVLENLLAEYTK---PSVMDVKMG-------SRTWYPDAS---EEYIQKCLKKDTGTTTVSSG--------------------------FRISGFEVYDHKESSFWKPERKLLRGLD---VDGARLTLRKFVSSNSL--------------PDSAFASSVYGGSHGILTQLLELKTWFENQTLYHF-------------NSCSILMVYENE-----SDARPQVKLVDFAHVLDG-NGVIDHNFLGGLCSFINFIREIL----

General information: TITO was launched using: RESULT: Template: 4FRF.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 : 1017 -17106 -16.82 -80.31 target 2D structure prediction score : 0.42 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -16.82 2D Compatibility (Sec. Struct. Predict.) : 0.42 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.197

(partial model without unconserved sides chains): PDB file : Tito_4FRF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4FRF-query.scw PDB file : Tito_Scwrl_4FRF.pdb: