Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSQKQPYTPGEFQWSFLLPKYWGVWIAITFLMLLAILPWAIQWRLAHGLANLAWKYLKSRRKTTIRNLEVCFPEWSPEKVQQQAKQVFVDMMLGIFETLNAWYKPYWFKNRVTIEGLEHITNAQAQGKGVLLLGTHSTLLDAGGYVCAQY-------FEPDVVYRPQ--NNPL---LDMLIYR--C--RGTIYKAQ-IDH-------DDMRGLIRHLK-EGDAIWYSPDQDFGLKQGVMAPFFGVPAATVTAHR----RLLKISKAV--AVPLYFYRHG--N-V----------QNPKYHILIEPAVDNLPSEDEVDDATRVNKIIENQLRIAPTQYMWFHRRFKTRPEGYEEIY 1K30 Chain:A ((128-313)) ----------------------------------------------------------------------------------------------------------------------------QQGHNVVLISNHQTEADPAIISLLLEKTNPYIAENTIFVAGDRVLADPLCKPFSIGRNLICVYSKKHMFDIPELTETKRKANTRSLKEMALLLRGGSQLIWIAPSGGRDRPDPSTGEW--YPAPFDASSVDNMRRLIQHSDVPGHLFPLALLCHDIMPPPSQVEIEIRVIAFNGAGLSVAPEISF----------------------------------------------

General information: TITO was launched using: RESULT: Template: 1K30.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 : 468 565 1.21 4.06 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.56 3D Compatibility (PKB) : 1.21 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.286

(partial model without unconserved sides chains): PDB file : Tito_1K30.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1K30-query.scw PDB file : Tito_Scwrl_1K30.pdb: