Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIISYKCPNCGSDMAFDSETGSLSCSSCGRQDNIESLPKENIAARFSDDEAKEYQCKNCGAVLITEAETTATTCSFCGGAAILADRLSGHLAPAKVIPFTISKQEAEQAFRKWCKKGLLTPRGFMSADRIKSITGMYIPFWMFDLNSEVQVRANCTRVHQYEEGDYICTETEHFEAFRDINLDYLKIPVDASEKMKDELMDKLEPYSYEELKDFQTAYLAGYIAEKYNYTDEELFPRAKEKISSYIDSYIHSTFSGYTSVNVRDKHIHTKNVNSFYVLLPVWMVSYDYERAEHIFAMNGQTGKVVGKPPISRGKVAAWFSGIAGGTFLALKLVSLMMGGGF 3V5X Chain:A ((101-159)) --------------------------------------------------------------------------------------------------------------------------------------------------------------NEYEQLNYAKQLKERLEAFTRDFLPHMK---EEEEVFQPMLM---EYFTYEELKDIKKKVIAQHC----------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3V5X.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 : 28 -4027 -143.80 -68.25 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.53 3D Compatibility (PKB) : -143.80 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.53 QMean score : 0.353

(partial model without unconserved sides chains): PDB file : Tito_3V5X.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3V5X-query.scw PDB file : Tito_Scwrl_3V5X.pdb: