Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRKRKLGTSDLDISEVGLGCMSLGTE--KNKALSILDEAIELGINYLDTADLYDR-------GRNEEIVGDAIQNR--RHDIILATKAGNRWDDGS--EGWYWDPSKAYIKEAVKKSLTRLKTDYIDLYQLHGGTIED-----------------NIDETIEAFEELKQEGVIRYYGISSIRPNVIKEYVKK------SNIVSIMMQFSLFDRRPEE-WLPLLEEHQISVVARGPVAKGLLTEKPLDQASESMKQN----GYLSYSFEELTNARKAMEEVA--PDLSMTEKSLQYLLAQPAVASVITGASKIEQLRENIQAANARRLTEEEIKALQSHTKQDIYKAHRS 1LQA Chain:A ((1-345)) MQYHRIPHSSLEVSTLGLGTMTFGEQNSEADAHAQLDYAVAQGINLIDVAEMYPVPPRPETQGLTETYVGNWLAKHGSREKLIIASKVSGPSRNNDKGIRPDQALDRKNIREALHDSLKRLQTDYLDLYQVHWPQRPTNCFGKLGYSWTDSAPAVSLLDTLDALAEYQRAGKIRYIGVSNETAFGVMRYLHLADKHDLPRIVTIQNPYSLLNRSFEVGLAEVSQYEGVELLAYSCLGFGTLTGKYLNGAKPAGARNTLFSRFTRYSGEQTQKAVAAYVDIARRHGLDPAQMALAFVRRQPFVASTLLGATTMDQLKTNIESLH-LELSEDVLAEIEAVHQVYTYPA---

General information: TITO was launched using: RESULT: Template: 1LQA.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 : 1557 91634 58.85 303.42 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : 58.85 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.508

(partial model without unconserved sides chains): PDB file : Tito_1LQA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1LQA-query.scw PDB file : Tito_Scwrl_1LQA.pdb: