Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence LSKIPVIVIVGPTAVGKTSLSIELAKKLDGEIISGDSMQVYRGLDIGTAKITPEEMDEIKHYLIDVTDPSEPFTAAKFQTETRKWIETIHQAGKLPIIVGGTGLYIQSVFYDYDFGNVSEDKAYRAELEQLNKTLLWQMLEQQDPESAAQIHENNKRRVIRALEVMHLTGKPFSEYQVHNVLNDTYKPLFLGLDLDRALLYERINQRVNLMFEEGLVTEAKKLY---DQHLVDVPAVCGIGYKELFPYFEGKSSLEEAKELIQKNSRHFAKRQLTWFRNRMEIDWIQAGVSTTEAEALNKAETFLSVK 3CRR Chain:A ((6-318)) ----PAIFLMGPTAAGKTDLAMALADALPCELISVDSALIYRGMDIGTAKPSRELLARYPHRLIDIRDPAESYSAAEFRADALAAMAKATARGRIPLLVGGTMLYYKALLEG---------------------------------------------------------------------LPYTVAQLAIAPE-QRQVLHARIAQRFRQMLEQGFIAEVEALHARSDLH-AGLPSIRAVGYRQVWDYLDGKLSYAEMTERGIIATRQLAKRQFTWLRSWSHLHWMDSLAGDNLPRALRYLKT-----

General information: TITO was launched using: RESULT: Template: 3CRR.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output 3D Compatibility (PKB) -100239 for 1825 contacts (-54.9/contact) + 2D Compatibility (PS) -25077 + (NN) -13250 + (LL) 6844 1D Compatibility (HY) -16800 + (ID) 4150 Total energy: -152672.0 ( -83.66 by residue) QMean score : 0.484

(partial model without unconserved sides chains): PDB file : Tito_3CRR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3CRR-query.scw PDB file : Tito_Scwrl_3CRR.pdb: