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awsem_heme.xml
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<ForceField>
<!-- Specify atom types -->
<AtomTypes>
<Type name="N" class="N" element="N" mass="0"/>
<Type name="H" class="H" element="H" mass="0"/>
<Type name="CA" class="CA" element="C" mass="12"/>
<Type name="C" class="C" element="C" mass="0"/>
<Type name="O" class="O" element="O" mass="16"/>
<Type name="CB" class="CB" element="B" mass="12"/>
<Type name="Ni" class="Ni" element="Ni" mass="58.6934"/>
<Type name="Fe" class="Fe" element="Fe" mass="55.845"/>
</AtomTypes>
<!-- Setup residue templates -->
<Residues>
<Residue name="NGP">
<Atom name="N" type="N"/>
<Atom name="H" type="H"/>
<Atom name="CA" type="CA"/>
<Atom name="C" type="C"/>
<Atom name="O" type="O"/>
<Atom name="CB" type="CB"/>
</Residue>
<Residue name="IGL">
<Atom name="N" type="N"/>
<Atom name="H" type="H"/>
<Atom name="CA" type="CA"/>
<Atom name="C" type="C"/>
<Atom name="O" type="O"/>
</Residue>
<Residue name="IPR">
<Atom name="N" type="N"/>
<Atom name="CA" type="CA"/>
<Atom name="C" type="C"/>
<Atom name="O" type="O"/>
<Atom name="CB" type="CB"/>
</Residue>
<Residue name="NTER">
<AllowPatch name="GLY"/>
<Atom name="CA" type="CA"/>
<Atom name="C" type="C"/>
<Atom name="O" type="O"/>
<Atom name="CB" type="CB"/>
</Residue>
<Residue name="CTER">
<AllowPatch name="GLY"/>
<AllowPatch name="PRO"/>
<Atom name="N" type="N"/>
<Atom name="H" type="H"/>
<Atom name="CA" type="CA"/>
<Atom name="O" type="O"/>
<Atom name="CB" type="CB"/>
</Residue>
<Residue name="IGL_NTER">
<Atom name="CA" type="CA"/>
<Atom name="C" type="C"/>
<Atom name="O" type="O"/>
</Residue>
<Residue name="IGL_CTER">
<Atom name="N" type="N"/>
<Atom name="H" type="H"/>
<Atom name="CA" type="CA"/>
<Atom name="O" type="O"/>
</Residue>
<Residue name="IPR_CTER">
<Atom name="N" type="N"/>
<Atom name="CA" type="CA"/>
<Atom name="O" type="O"/>
<Atom name="CB" type="CB"/>
</Residue>
</Residues>
<!-- Setup Patches-->
<Patches>
<Patch name="GLY">
<RemoveAtom name="CB"/>
</Patch>
<Patch name="PRO">
<RemoveAtom name="H"/>
</Patch>
</Patches>
</ForceField>