Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQQMWTDIDEYIDSHLIPEDPRLDFALKNTDEHGFSNHLAVAPNQGMFLQMLIQMNKCKRVLEIGTFAAYSTIWLGRALPEDGYLLTIEGRDTHAEMAQKNIDHANLPVKVDLKLGRAADVLSAIDPQSIEPFDFIFIDADKQGYPEYLELSLKFSKSGTIIVLDNVIRAGAILNPENKKPSIEGIRETFKALENHPQILSCTALQTVGSKGHDGFAIAIVK 3TFW Chain:A ((7-222)) -QQQWSAVDNYLIKALIPGDPVLDRVLENNHRAGLPAH-DVAANQGQFLALLVRLTQAKRILEIGTLGGYSTIWMARELPADGQLLTLEADAHHAQVARENLQLAGVDQRVTLREGPALQSLESLG--ECPAFDLIFIDADKPNNPHYLRWALRYSRPGTLIIGDNVVRDGEVVNPQSADERVQGVRQFIEMMGAEPR-LTATALQTVGTKGWDGFTLAWV-

General information: TITO was launched using: RESULT: Template: 3TFW.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 : 1105 -117683 -106.50 -544.83 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.85 3D Compatibility (PKB) : -106.50 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.85 QMean score : 0.584

(partial model without unconserved sides chains): PDB file : Tito_3TFW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3TFW-query.scw PDB file : Tito_Scwrl_3TFW.pdb: