Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MYKDIKVDPAQLEAALDARLKIRAGFDK-PTAGMAAGMTQVNMISVPRDWAYDFL-----LYAHRNPQSCPVLD-----VLEEGIYATKLAA--DSDIRTDFPRYRIWKDGEM-VDEVTDAREIYNAHPDLVTFLIGCSFSFETALQEAGIEVRHIHDDTNVPMYLSNIKCEPAGRI-SGNMVVSMRPIPSHQISEAVKITARMPSVHGAPVHIGHPESLGIKDVNK--PDFGDASR----------IEAGEIPVFWACGVTPQAAVINSKIPFAISHAPGYM----FITDIPDRAWMG 4NSD Chain:A ((15-349)) -----DRKVMEYENRIRAYSTPDKIFRYFATLKVISEPGEAEVFMTPEDFVRSITPNHLGLDQYIIKSIFYTLGECGLISFSDYIFLTTVLSTPQRNFEIAFKMFDLNGDGEVDMEEFEQVQSIIRSCSALTTYFFGADLKGKLTIKNFLEFQRKLQHDVLKLEFERHDP--VDGRITERQFGGMLLAYSGVQSKKLTAMQRQLKKHFKEGKGLTFQEVENFFTFLKNINDVDTALSFYHMAGASLDKVTMQQVARTVAKVELSDHVCDVVFALFDCDGNGELSNKEFVSIMKQRLM--

General information: TITO was launched using: RESULT: Template: 4NSD.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 : 904 -3679 -4.07 -14.20 target 2D structure prediction score : 0.42 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -4.07 2D Compatibility (Sec. Struct. Predict.) : 0.42 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.105

(partial model without unconserved sides chains): PDB file : Tito_4NSD.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NSD-query.scw PDB file : Tito_Scwrl_4NSD.pdb: