Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLVEKLRRKIMQSKTLFLLGLCTIFSTTVSALPLDSKGAKQRLSQAAKQKVFQGKIDLDALVSNDSNDLIVEYNIPSSSVSSGLERRSYIATNKKNLQTRFSRAGGVQVLRDYNNLPLAFYRISNREALIALLNDPNVKAVYPNRINRTTTTESLPLINQPQANTNGFTGEGSSVAVLDTGVNYLHSDFGCTAVNTPSSTCRVVYSFDSAPDDGTLDDDGHGSNVSAIVSK----VATKTKIIGIDVFRKVRSQGKWVSTAYDSDILAGINWAVNNAQTYNIKAVNLSLGVPGVKYTSECSDSSYGTAFANARAAGVVPVVASGNDAFPDGISSPACVAGAVRVGAVYDSNIGGVSWGNPVKCSDPTTAADKVACFSNGGSLVTLLAPGAMITAGGYT-------MGGTSQATPHVAGAIAL-LRAN-SVSPTESIDQTISRLKATGKPITDSRTGLVFPRIDLLAATNGLTVN 2B6N Chain:A ((16-268)) --------------------------------------------------------------------------------------------------------------------------------------------------------RNLPLDNNYHTD---YDGSGVTAFVIDTGVLNTHNEFGGRASSG--------YDFIDNDYDAT-DCNGHGTHVAGTIGGSTYGVAKNVNVVGVRVLNCSGS-------GSNSGVIAGINWVKNNASGPAV--ANMSLGGGASQATDD--------AVNAAVAAGITFVVAAGNDNSNACNYSPARAADAITVGS--------------------TTSNDSRSSFSNYGTCLDIYAPGSSITSSWYTSNSATNTISGTSMASPHVAGVAALYLDENPNLSPAQVTN--LLKTRATADKVTDAKTG------------------

General information: TITO was launched using: RESULT: Template: 2B6N.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 : 1623 859 0.53 3.58 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 0.53 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.513

(partial model without unconserved sides chains): PDB file : Tito_2B6N.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2B6N-query.scw PDB file : Tito_Scwrl_2B6N.pdb: