Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------------------------------------------------------------------------------------------------------------------------------------------MSGYSNGGGYG-GISSFALIVVLFI------LLIIVGTAFVGGF------------------------------------------------------------ 4PX7 Chain:A ((1-258)) GRSIARRTAVGAALLLVMPVAVWISGWRWQPGSWLLKAAFWVTETVTQPWGVITHLILFGWFLWCLRFRIKAAFVLFAILAAAILVGQGVKSWIKDKVQEPRPFVIWLEKTHHMPVDKFYTLKRAERGNLVKEQLAEPQYLRSHWQKETGFAFPSGHTMFAASWALLAVGLLWPRRRTLTIAILLVWATGVMGSRLLLGMHWPRDLVVATLISWALVAVATWLAQRICGPLTPPEENREIAQREQESLEHH

General information: TITO was launched using: RESULT: Template: 4PX7.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 : 59 -17145 -290.59 -463.38 target 2D structure prediction score : 0.86 Monomeric hydrophicity matching model chain A : 0.49 3D Compatibility (PKB) : -290.59 2D Compatibility (Sec. Struct. Predict.) : 0.86 1D Compatibility (Hydrophobicity) : 0.49 QMean score : 0.730

(partial model without unconserved sides chains): PDB file : Tito_4PX7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4PX7-query.scw PDB file : Tito_Scwrl_4PX7.pdb: