Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDMTKIALLSDIHGNTTALEAVLADARQLGVDEYWLLGDILMPGTGRRRILDLLDQL-PITARVLGNWEDSLWHGVRKELDSTRPSQRYLLRQCQYVLEEISLEEIEVLHNQPLQIHRQFGDLTVGISHHLPDKNWGRELIHTGKQEEFDRLVTHPPCDIAVYGHIHQQLLRYGTGGQLIVNPGSIGQPFFLDAQLRKDLRAQYMILEFDDKGLVDMDFRRVDYDVAAELQLAKDLRLPYFEVYYESLVNGIHHTHHQEFLRELAQKEGCDRELDDWLKSGND 2AHD Chain:D ((201-358)) ---MKIGIMSDTHDHLPNIRKAIEIFNDENVETVIHCGDFVSLFV-----IKEFENLNANIIATYGNNDGERCKLKEW-LK------------------DINE--ENIID---DFISVEIDDLKFFITHGHHQSVL-------------EMAIKSGLYDVVIYGHTHERVFEEVD-DVLVINPGECCGYLT--------GIPTIGILDTEKK-----------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2AHD.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 856 -61840 -72.24 -393.89 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain D : 0.66 3D Compatibility (PKB) : -72.24 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.450

(partial model without unconserved sides chains): PDB file : Tito_2AHD.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2AHD-query.scw PDB file : Tito_Scwrl_2AHD.pdb: