1
1 MET HA H 3.86
. 1
2
1 MET C C 173.73
. 1
3
1 MET CA C 55.1
. 1
4
1 MET CB C 35.03
. 1
5
3 GLU HA H 4.04
. 1
6
3 GLU HB2 H 2.08
. 1
7
3 GLU HB3 H 2.08
. 1
8
3 GLU HG2 H 2.46
. 1
9
3 GLU HG3 H 2.46
. 1
10
3 GLU H H 8.93
. 1
11
3 GLU C C 179.68
. 1
12
3 GLU CA C 59.79
. 1
13
3 GLU CB C 29.04
. 1
14
3 GLU CG C 36.31
. 1
15
3 GLU N N 120.4
. 1
16
8 MET HA H 4.8
. 1
Default is reduced cysteines; remove the '-o' flag if this is the case.
Residues/shifts missing from the BMRB file are acceptable.
Output filename is an argument for this program (contrary to the original version, which will output to screen unless you redirect with a ">").
The program will only analyse the first shift dataset in a BMRB file.
Please e-mail Kyoko if you have problems.