|
Last change
on this file since 812 was
812,
checked in by vondreele, 10 years ago
|
|
add restraint macro files
fix a triclinic error in genHlaue
continue development of restraints
|
|
File size:
430 bytes
|
| Line | |
|---|
| 1 | !standard plane restraints for amino acids using flexible rigid bodies |
|---|
| 2 | F 0.5 |
|---|
| 3 | S ARG .01 NE CZ NH1 NH2 |
|---|
| 4 | |
|---|
| 5 | S ARG .01 CD NE CZ NH1 NH2 |
|---|
| 6 | |
|---|
| 7 | S ASN .01 CB CG OD1 ND2 |
|---|
| 8 | |
|---|
| 9 | S ASP .01 CB CG OD1 OD2 |
|---|
| 10 | |
|---|
| 11 | S GLN .01 CG CD OE1 NE2 |
|---|
| 12 | |
|---|
| 13 | S GLU .01 CG CD OE1 OE2 |
|---|
| 14 | |
|---|
| 15 | S HIS .01 CB CG ND1 CD2 CE1 NE2 |
|---|
| 16 | |
|---|
| 17 | S PHE .01 CB CG CD1 CD2 CE1 CE2 CZ |
|---|
| 18 | |
|---|
| 19 | S TRP .01 CB CG CD1 NE1 CD2 CE2 CE3 CZ2 CZ3 CH2 |
|---|
| 20 | |
|---|
| 21 | S TYR .01 CB CG CD1 CD2 CE1 CE2 CZ OH |
|---|
| 22 | |
|---|
| 23 | S * .01 CA C O N+ |
|---|
| 24 | |
|---|
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