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[gromacs/adressmacs.git]
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vdwradii.dat
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a070069dbea1e2f42778e391d69026f71ae5f6c7
1
;
Very approximate VanderWaals radii
2
;
only used for drawing atoms as balls
or
for calculating atomic overlap.
3
;
longest matches are used
4
;
'???'
or
'*'
matches any residue name
5
;
'AAA'
matches any protein residue name
6
??? C
0.15
7
??? F
0.12
8
??? H
0.04
9
??? N
0.110
10
??? O
0.105
11
??? S
0.16
12
GLY MN1
0
13
GLY MN2
0
14
ALA MCB1
0
15
ALA MCB2
0
16
VAL MCG1
0
17
VAL MCG2
0
18
ILE MCG1
0
19
ILE MCG2
0
20
ILE MCD1
0
21
ILE MCD2
0
22
LEU MCD1
0
23
LEU MCD2
0
24
MET MCE1
0
25
MET MCE2
0
26
TRP MTRP1
0
27
TRP MTRP2
0
28
THR MCG1
0
29
THR MCG2
0
30
LYSH MNZ1
0
31
LYSH MNZ2
0