| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
0.888 |
0.000 |
0.000 |
-0.090 |
0.000 |
0.000 |
| Slide |
0.000 |
3.292 |
0.983 |
0.000 |
-0.062 |
-0.226 |
| Rise |
0.000 |
0.983 |
9.622 |
0.000 |
0.000 |
-0.186 |
| Tilt |
-0.090 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.062 |
0.000 |
0.000 |
0.023 |
0.011 |
| Twist |
0.000 |
-0.226 |
-0.186 |
0.000 |
0.011 |
0.040 |
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 |
0.877 |
0.000 |
0.000 |
-0.063 |
0.000 |
0.000 |
| Slide |
0.000 |
2.843 |
0.712 |
0.000 |
-0.071 |
-0.165 |
| Rise |
0.000 |
0.712 |
9.699 |
0.000 |
-0.005 |
-0.162 |
| Tilt |
-0.063 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.071 |
-0.005 |
0.000 |
0.024 |
0.010 |
| Twist |
0.000 |
-0.165 |
-0.162 |
0.000 |
0.010 |
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 |
1.732 |
0.000 |
0.000 |
-0.071 |
0.000 |
0.000 |
| Slide |
0.000 |
4.353 |
3.433 |
0.000 |
0.048 |
-0.170 |
| Rise |
0.000 |
3.433 |
10.889 |
0.000 |
0.087 |
-0.229 |
| Tilt |
-0.071 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
| Roll |
0.000 |
0.048 |
0.087 |
0.000 |
0.031 |
0.005 |
| Twist |
0.000 |
-0.170 |
-0.229 |
0.000 |
0.005 |
0.046 |
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 |
1.689 |
0.000 |
0.000 |
-0.040 |
0.000 |
0.000 |
| Slide |
0.000 |
4.516 |
3.264 |
0.000 |
0.021 |
-0.133 |
| Rise |
0.000 |
3.264 |
10.232 |
0.000 |
0.054 |
-0.225 |
| Tilt |
-0.040 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
| Roll |
0.000 |
0.021 |
0.054 |
0.000 |
0.029 |
0.006 |
| Twist |
0.000 |
-0.133 |
-0.225 |
0.000 |
0.006 |
0.046 |
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 |
1.486 |
0.000 |
0.000 |
-0.123 |
0.000 |
0.000 |
| Slide |
0.000 |
3.349 |
1.760 |
0.000 |
-0.054 |
-0.219 |
| Rise |
0.000 |
1.760 |
7.850 |
0.000 |
-0.055 |
-0.170 |
| Tilt |
-0.123 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.054 |
-0.055 |
0.000 |
0.025 |
0.004 |
| Twist |
0.000 |
-0.219 |
-0.170 |
0.000 |
0.004 |
0.046 |
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 |
0.881 |
0.000 |
0.000 |
-0.059 |
0.000 |
0.000 |
| Slide |
0.000 |
2.838 |
0.715 |
0.000 |
0.006 |
-0.109 |
| Rise |
0.000 |
0.715 |
9.025 |
0.000 |
-0.153 |
-0.276 |
| Tilt |
-0.059 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
| Roll |
0.000 |
0.006 |
-0.153 |
0.000 |
0.022 |
0.012 |
| Twist |
0.000 |
-0.109 |
-0.276 |
0.000 |
0.012 |
0.024 |
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 |
0.738 |
0.000 |
0.000 |
-0.106 |
0.000 |
0.000 |
| Slide |
0.000 |
2.516 |
1.749 |
0.000 |
-0.029 |
-0.125 |
| Rise |
0.000 |
1.749 |
9.007 |
0.000 |
-0.026 |
-0.188 |
| Tilt |
-0.106 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.029 |
-0.026 |
0.000 |
0.020 |
0.005 |
| Twist |
0.000 |
-0.125 |
-0.188 |
0.000 |
0.005 |
0.039 |
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 |
1.716 |
0.000 |
0.000 |
-0.034 |
0.000 |
0.000 |
| Slide |
0.000 |
4.714 |
3.429 |
0.000 |
0.019 |
-0.156 |
| Rise |
0.000 |
3.429 |
11.915 |
0.000 |
0.092 |
-0.211 |
| Tilt |
-0.034 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
| Roll |
0.000 |
0.019 |
0.092 |
0.000 |
0.030 |
0.004 |
| Twist |
0.000 |
-0.156 |
-0.211 |
0.000 |
0.004 |
0.049 |
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 |
0.407 |
0.000 |
0.000 |
-0.029 |
0.000 |
0.000 |
| Slide |
0.000 |
2.670 |
0.695 |
0.000 |
0.004 |
-0.157 |
| Rise |
0.000 |
0.695 |
8.474 |
0.000 |
-0.112 |
-0.224 |
| Tilt |
-0.029 |
0.000 |
0.000 |
0.024 |
0.000 |
0.000 |
| Roll |
0.000 |
0.004 |
-0.112 |
0.000 |
0.019 |
0.014 |
| Twist |
0.000 |
-0.157 |
-0.224 |
0.000 |
0.014 |
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 |
0.888 |
0.000 |
0.000 |
-0.106 |
0.000 |
0.000 |
| Slide |
0.000 |
2.850 |
1.355 |
0.000 |
-0.049 |
-0.132 |
| Rise |
0.000 |
1.355 |
9.447 |
0.000 |
-0.034 |
-0.167 |
| Tilt |
-0.106 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.049 |
-0.034 |
0.000 |
0.024 |
0.011 |
| Twist |
0.000 |
-0.132 |
-0.167 |
0.000 |
0.011 |
0.034 |
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)