Reply To: Maximum Number of Constraints

[Anonymous]

OK, I *think* the issue is that the BOUNDED func type is greedy, and is arbitrarily turning every other line into a “tag” for the previous BOUNDED func. Try formatting your lines like this instead:

Dihedral N 100 CA 100 C 100 N 101 BOUNDED 2.71 3.02 0.3 0.5 TAG

adding 0.5 and TAG to the end.

By the way, 489/490 was a red herring, it’s really an evens/odds issue.