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Edited README for sequence
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jdickerson95 authored Aug 14, 2018
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Expand Up @@ -47,6 +47,9 @@ NumResidues 51 # number of residues per monomer
ProteinHeavyAtoms Zn 0.333 S 6 # heavy atoms added to protein part of the
# monomer, i.e. S, coordinated metals,
# Se in Se-Met
# Note: If a sequence file is used S does not
# need to be added
SolventHeavyConc P 425 # concentration of elements in the solvent
# in mmol/l. Oxygen and lighter elements
# should not be specified
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