Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequenceMTLKIDIKGRGKYKPASDYSIDDVKNVLMEKIFEESSRIINSDDDLEIIEKVDFRTDKINVLSLFSGCGGLDLGFELAGLAAVIGEQAAMEAFKDKDRFNELRNKSIFHTIYTNDLFKEANQTYKTNFPGHVIQHEKDIRQVKY-----------------FPKCNLILGGFPCPGFSEAGPR-L--IDDDRNFLYLHFIRSLIQAQPEIFVAENVKGMMTLGKGEVLNQIIEDFASAGYRVQFKLLNARDYGVPQLRERVIIEGVRKDISFNYKYPSPTHGEET-----------------------GLKPFKTLRDSIGDLVTDP-G-------------PYF----TGSY------------SS--I----------------------------------------------------------------------------------------YMSRNRKKSWDEQSFTIQASGRQAPLHPGGLSMKKIGKDKWVFPDGEENHRRLSVKEIARVQTFPDWFQFSQGTNSQTSINNRLDKQYKQIGNAVPVLLAKAVASPIANWAINYLESSPNNKIKNRERKLSIRTFLRIKTS
3SWR Chain:A ((536-1000))-----------------------------------------------------IKLPKLRTLDVFSGCGGLSEGFHQAGIS---------------------------DTLWAIEMWDPAAQAFRLNNPGST-VFTEDCNILLKLVMAGETTNSRGQRLPQKGDVEMLCGGPPCQGFSGMNRFNSRTYSKFKNSLVVSFLSYCDYYRPRFFLLENVRNFVSFKRSMVLKLTLRCLVRMGYQCTFGVLQAGQYGVAQTRRRAIILAAAPGEKL-PLFPEPLHVFAPRACQLSVVVDDKKFVSNITRLSSGPFRTITVRDTMSDLPEVRNGASALEISYNGEPQSWFQRQLRGAQYQPILRDHICKDMSALVAARMRHIPLAPGSDWRDLPNIEVRLSDGTMARKLRYTHHDRKNGRSSSGALRGVCSCVEAGKACDPAARQFNTLIPWCLPHTGNRHNHWAGLYGRLEWDGFFSTTVTNPE--------------PMGKQGRVLHPEQHRVVSVRECARSQGFPDTYRLF-GNIL---------DKHRQVGNAVPPPLAKAIGLEIKLCMLA----------------------------


General information:
TITO was launched using:
RESULT:

Template: 3SWR.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 : 1300 -14033 -10.79 -46.47
target 2D structure prediction score : 0.60
Monomeric hydrophicity matching model chain A : 0.65

3D Compatibility (PKB) : -10.79
2D Compatibility (Sec. Struct. Predict.) : 0.60
1D Compatibility (Hydrophobicity) : 0.65
QMean score : 0.415

(partial model without unconserved sides chains):
PDB file : Tito_3SWR.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3SWR-query.scw
PDB file : Tito_Scwrl_3SWR.pdb: