Table 1. Number of Contacts between NP Beads and Water Beads and between the Charged Beads of the Zwitterionic Groups and Water Beadsa.
NP | NP–water no NP–protein contact | NP–water during NP–protein contact | zwitterionic group–water no NP–protein contact | zwitterionic group–water during NP–protein contact |
---|---|---|---|---|
Z | 4909 ± 1 | 4889 ± 5 (−20) | 1542 ± 1 | 1533 ± 2 (−9) |
ZH | 3950 ± 1 | 3821 ± 14 (−129) | 1015 ± 1 | 985 ± 4 (−30) |
In parentheses, the difference between the number of contacts in the bound and unbound state.