Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKWMCSICCAAVLLAGGAAQAEAVPNEPINWGFKRSVNHQPPDAGKQLNSLIEKYDAFYLGNTKEKTIYLTFDNGYENGYTPKVLDVLKKHRVTGTFFVTGHFVKDQPQLIKRMSDEGHIIGNHSFHHPDLTTKTADQIQDELDSVNEEVYKITGKQDNLYLRPPRGVFSEYVLKETKRLGYQTVFWSVAFVDWKINNQKGKKYAYDHM----IKQA-HPGAIYLLHTVSRDNAE-ALDDAITDLKKQGYTFKSIDDLMFEKEMRLPSL 2Y8U Chain:A ((27-226)) -----------------------------------------------------------TQCTTPNTIALTFDDGPSE-YTPQLLDLLSRYSARATFFVLGDAAAQNPGLLQRMRDEGHQVGAHTYDHVSLPSLGYDGIASQMTRLEEVIRPALGV-APAYMRPPYLETNELVLQVMRDLDYRVISASVDTKDYENQD---ADAIINTSFQLFLDQLDAGGNIVLAHDIHYWTVASLAERMLQEVNARGLIATTVGDCLGDGEI-----

General information: TITO was launched using: RESULT: Template: 2Y8U.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 : 1043 -103833 -99.55 -535.22 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -99.55 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.595

(partial model without unconserved sides chains): PDB file : Tito_2Y8U.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2Y8U-query.scw PDB file : Tito_Scwrl_2Y8U.pdb: