| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
1.232 |
0.000 |
0.000 |
-0.092 |
0.000 |
0.000 |
| Slide |
0.000 |
2.864 |
1.107 |
0.000 |
-0.052 |
-0.177 |
| Rise |
0.000 |
1.107 |
8.519 |
0.000 |
-0.040 |
-0.157 |
| Tilt |
-0.092 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.052 |
-0.040 |
0.000 |
0.025 |
0.007 |
| Twist |
0.000 |
-0.177 |
-0.157 |
0.000 |
0.007 |
0.042 |
Units:
Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
2.564 |
0.000 |
0.000 |
-0.002 |
0.000 |
0.000 |
| Slide |
0.000 |
5.501 |
2.272 |
0.000 |
-0.014 |
-0.170 |
| Rise |
0.000 |
2.272 |
11.627 |
0.000 |
0.066 |
-0.102 |
| Tilt |
-0.002 |
0.000 |
0.000 |
0.049 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.014 |
0.066 |
0.000 |
0.038 |
0.006 |
| Twist |
0.000 |
-0.170 |
-0.102 |
0.000 |
0.006 |
0.063 |
Units:
Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
0.953 |
0.000 |
0.000 |
-0.118 |
0.000 |
0.000 |
| Slide |
0.000 |
3.164 |
0.539 |
0.000 |
0.008 |
-0.138 |
| Rise |
0.000 |
0.539 |
8.426 |
0.000 |
-0.082 |
-0.231 |
| Tilt |
-0.118 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
| Roll |
0.000 |
0.008 |
-0.082 |
0.000 |
0.017 |
0.007 |
| Twist |
0.000 |
-0.138 |
-0.231 |
0.000 |
0.007 |
0.025 |
Units:
Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
0.987 |
0.000 |
0.000 |
-0.122 |
0.000 |
0.000 |
| Slide |
0.000 |
2.932 |
0.318 |
0.000 |
0.008 |
-0.128 |
| Rise |
0.000 |
0.318 |
8.820 |
0.000 |
-0.108 |
-0.236 |
| Tilt |
-0.122 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
| Roll |
0.000 |
0.008 |
-0.108 |
0.000 |
0.018 |
0.007 |
| Twist |
0.000 |
-0.128 |
-0.236 |
0.000 |
0.007 |
0.025 |
Units:
Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
0.836 |
0.000 |
0.000 |
-0.083 |
0.000 |
0.000 |
| Slide |
0.000 |
2.172 |
1.235 |
0.000 |
-0.029 |
-0.130 |
| Rise |
0.000 |
1.235 |
7.888 |
0.000 |
-0.052 |
-0.187 |
| Tilt |
-0.083 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.029 |
-0.052 |
0.000 |
0.023 |
0.010 |
| Twist |
0.000 |
-0.130 |
-0.187 |
0.000 |
0.010 |
0.027 |
Units:
Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
1.156 |
0.000 |
0.000 |
-0.127 |
0.000 |
0.000 |
| Slide |
0.000 |
3.173 |
2.536 |
0.000 |
0.073 |
-0.084 |
| Rise |
0.000 |
2.536 |
10.852 |
0.000 |
0.138 |
-0.227 |
| Tilt |
-0.127 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
| Roll |
0.000 |
0.073 |
0.138 |
0.000 |
0.027 |
0.007 |
| Twist |
0.000 |
-0.084 |
-0.227 |
0.000 |
0.007 |
0.031 |
Units:
Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
1.157 |
0.000 |
0.000 |
-0.132 |
0.000 |
0.000 |
| Slide |
0.000 |
3.152 |
2.492 |
0.000 |
0.075 |
-0.090 |
| Rise |
0.000 |
2.492 |
10.810 |
0.000 |
0.148 |
-0.233 |
| Tilt |
-0.132 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
| Roll |
0.000 |
0.075 |
0.148 |
0.000 |
0.026 |
0.006 |
| Twist |
0.000 |
-0.090 |
-0.233 |
0.000 |
0.006 |
0.033 |
Units:
Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
0.864 |
0.000 |
0.000 |
-0.084 |
0.000 |
0.000 |
| Slide |
0.000 |
2.286 |
1.555 |
0.000 |
-0.035 |
-0.147 |
| Rise |
0.000 |
1.555 |
8.410 |
0.000 |
-0.055 |
-0.180 |
| Tilt |
-0.084 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.035 |
-0.055 |
0.000 |
0.023 |
0.009 |
| Twist |
0.000 |
-0.147 |
-0.180 |
0.000 |
0.009 |
0.027 |
Units:
Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
1.227 |
0.000 |
0.000 |
-0.087 |
0.000 |
0.000 |
| Slide |
0.000 |
2.959 |
1.200 |
0.000 |
-0.035 |
-0.175 |
| Rise |
0.000 |
1.200 |
8.523 |
0.000 |
-0.045 |
-0.155 |
| Tilt |
-0.087 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.035 |
-0.045 |
0.000 |
0.024 |
0.005 |
| Twist |
0.000 |
-0.175 |
-0.155 |
0.000 |
0.005 |
0.042 |
Units:
Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)