GitHub - K7S3/PDB-Extractor: Extracts information from PDB file and calculates Dihedral Angle

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Extracts information from PDB file and calculates Dihedral Angle

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Name		Name	Last commit message	Last commit date
Latest commit History 1 Commit
.~lock.2wsc.pdb#		.~lock.2wsc.pdb#
2wsc.pdb		2wsc.pdb
2wsc_output.txt		2wsc_output.txt
Assignment 4.pdf		Assignment 4.pdf
Readme.txt		Readme.txt
Sample_output.txt		Sample_output.txt
pdb_reader.py		pdb_reader.py

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##### Line by line description of Sample_output file

##### Mention everythig in capital letters.

line_no		Description
1		Title or name --- (CRYSTAL STRUCTURE OF ENZYME COMPLEXED WITH LIGANDS)
2		length of protein --- (LENGTH(\t)472)
3		no of chains in protein and names arranged in order --- (CHAINS(\t)4(\t)1,A,B,C) --- Names separated by comma(',')
4-22		Aminoacid ratios --- (ALA(\t)0.125874125874)
23		unknown aminoacids count --- (UNKNOWN('\t')0)
24		ligands if any --- (LIGANDS(\t)5JN,CAC,HEM,NO,NO3,RQ3) --- Names separated by comma(',')
25		chain name --- (CHAIN-1)
26		possible phi,psi,omega angles --- (NA('\t')-21.55049('\t')-45.13716)	
27		possible phi,psi,omega angles
28		possible phi,psi,omega angles
29		possible phi,psi,omega angles
30-34		same as 25-29
35-39		same as 25-29
40-44		same as 25-29

Note: Mention 'NA' if calculation of respective torsion angle is not possible.