Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSARRSRLRRVRWLPHQRIVVLKEVDLWAEDCVTEGVDVVAERLWRMRMDASRNGRAQYLAEYLALHVDSSRHYQWLLSNY-GPSLRDVLLTSSLTPFTEERCKGVLRRVLLALDQLHRVSMYVHADVSLGNVLTSPS-SCDDVVLGDLESVSPIGAVP--RGCLGSYLFMAPERLVDGALPLAPHDDIWAFGIVCYNLLTWDVTHPWCALGTESDHSENYWAFLDLMSKAKDVPPCQLLLQSPLSRCSKEALTFVAVCLSWDPACRPSAAELLQHSWMLSP 5IG1 Chain:A ((26-278)) GKGAFSTVHRCVNKRTGEVCAVKVIALKSLR--SSEINKIKREIGICSSL--Q---HEHIVSMRRAFRDESHFY-LVFEYVSGGELFDEIVTR--KFYNEKDASACMHQILSALQHCHSK-NIIHRDLKPENLLLASKDPNAPVKITDFGLAVIMEQGPTYFGFAGTPGYLSPEVIR--RVPYDTAVDVWACGVILYILLVGY--PPFWEEDH--------QKLYAQIKNCQYDFP-----SPEWDSVTTAAKELIKAMLEPNPKRRPTVQELLQHPWIAR-

General information: TITO was launched using: RESULT: Template: 5IG1.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 : 1182 -83768 -70.87 -336.42 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -70.87 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.432

(partial model without unconserved sides chains): PDB file : Tito_5IG1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5IG1-query.scw PDB file : Tito_Scwrl_5IG1.pdb: