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root/freemol/trunk/smi23d/src/mengine/pdb.h
Revision: 3
Committed: Mon Jun 9 21:38:26 2008 UTC (11 years, 4 months ago) by tjod
File size: 785 byte(s)
Log Message:
test

Line File contents
1 #define ALA 1
2 #define ARG 2
3 #define ASN 3
4 #define ASP 4
5 #define CYSH 5
6 #define CYS 6
7 #define GLN 7
8 #define GLU 8
9 #define GLY 9
10 #define HIS 10
11 #define ILE 11
12 #define LEU 12
13 #define LYS 13
14 #define MET 14
15 #define PHE 15
16 #define PRO 16
17 #define SER 17
18 #define THR 18
19 #define TRP 19
20 #define TYR 20
21 #define VAL 21
22
23 #define ASX 22
24 #define GLX 23
25 #define PCA 24
26 #define HYP 25
27 #define AMP 26
28 #define CMP 27
29 #define GMP 28
30 #define TMP 29
31 #define UMP 30
32 #define UNK 31
33 #define ACE 32
34 #define FOR 33
35 #define HOH 34
36 #define DOD 35
37 #define SO4 36
38 #define PO4 37
39 //
40 #define HISE 38
41 #define HISP 39
42 #define BALA 40
43 #define GABA 41
44 #define HPRO 42
45 //
46 #define NCAP_ACETYL 43
47 #define NCAP_FORMYL 44
48 #define CCAP_NME 45
49 #define CCAP_NH2 46