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85037498824
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note
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3-NH- group acts as a C terminal.
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18
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85037505163
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note
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A linear least-squares tit to all α-carbon atoms in the pore helices shows that the pore helix dipole makes an angle of ∼41° with the z axis, and is directed toward the origin in the hydrophobic chamber.
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20
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85037494486
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note
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2, is turned on at radius 7.3 Å to mimic an 8 Å pore in the reservoirs.
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21
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84986512474
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32
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85037496094
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note
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2.
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35
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85037491941
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note
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All ion potential energies are calculated with the 12 Å switched force cutoff.
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-
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37
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85037493113
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note
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The artificial shift involves simply adding 0.1 Å to every ion-atom distance during the averaging of ion potential energies over time.
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42
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0242339189
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edited by F. Franks Plenum, New York
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