Fix aminoacids - error

From: Villalain Boullon, Jose (jvillalain_at_umh.es)
Date: Sun Nov 04 2018 - 03:18:23 CST

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Dear all,

I want to fix some amino acids (all the atoms in the residue) of a protein and for that I use the following script,

constraints on
consexp 2
consref 5iz.pdb
conskfile 5iz.fix
conskcol B

but, after some ns, I see that they are not fixed (they move).

Could you tell me what I am doing wrong.

Thanks a lot for your help ¡!.
José.

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José Villalaín
Instituto de Biología Molecular y Celular - IBMC
Universidad "Miguel Hernández" - Campus de Elche
E-03202 Elche-Alicante (España-Spain)
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