| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.367 |
0.000 |
0.000 |
-0.069 |
0.000 |
0.000 |
Slide |
0.000 |
3.168 |
1.536 |
0.000 |
-0.068 |
-0.227 |
Rise |
0.000 |
1.536 |
7.732 |
0.000 |
-0.059 |
-0.180 |
Tilt |
-0.069 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.068 |
-0.059 |
0.000 |
0.025 |
0.007 |
Twist |
0.000 |
-0.227 |
-0.180 |
0.000 |
0.007 |
0.045 |
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 |
2.223 |
0.000 |
0.000 |
-0.011 |
0.000 |
0.000 |
Slide |
0.000 |
4.709 |
2.663 |
0.000 |
-0.026 |
-0.184 |
Rise |
0.000 |
2.663 |
9.777 |
0.000 |
0.053 |
-0.102 |
Tilt |
-0.011 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
-0.026 |
0.053 |
0.000 |
0.033 |
0.006 |
Twist |
0.000 |
-0.184 |
-0.102 |
0.000 |
0.006 |
0.067 |
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 |
0.842 |
0.000 |
0.000 |
-0.104 |
0.000 |
0.000 |
Slide |
0.000 |
2.951 |
0.445 |
0.000 |
0.004 |
-0.139 |
Rise |
0.000 |
0.445 |
8.006 |
0.000 |
-0.058 |
-0.224 |
Tilt |
-0.104 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
0.004 |
-0.058 |
0.000 |
0.016 |
0.006 |
Twist |
0.000 |
-0.139 |
-0.224 |
0.000 |
0.006 |
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 |
0.909 |
0.000 |
0.000 |
-0.125 |
0.000 |
0.000 |
Slide |
0.000 |
3.061 |
0.308 |
0.000 |
0.014 |
-0.128 |
Rise |
0.000 |
0.308 |
8.190 |
0.000 |
-0.083 |
-0.226 |
Tilt |
-0.125 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
0.014 |
-0.083 |
0.000 |
0.017 |
0.006 |
Twist |
0.000 |
-0.128 |
-0.226 |
0.000 |
0.006 |
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 |
0.848 |
0.000 |
0.000 |
-0.073 |
0.000 |
0.000 |
Slide |
0.000 |
1.921 |
1.544 |
0.000 |
-0.040 |
-0.111 |
Rise |
0.000 |
1.544 |
7.809 |
0.000 |
-0.062 |
-0.187 |
Tilt |
-0.073 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.040 |
-0.062 |
0.000 |
0.022 |
0.011 |
Twist |
0.000 |
-0.111 |
-0.187 |
0.000 |
0.011 |
0.028 |
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 |
1.199 |
0.000 |
0.000 |
-0.129 |
0.000 |
0.000 |
Slide |
0.000 |
3.184 |
2.730 |
0.000 |
0.071 |
-0.088 |
Rise |
0.000 |
2.730 |
11.028 |
0.000 |
0.138 |
-0.245 |
Tilt |
-0.129 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
0.071 |
0.138 |
0.000 |
0.026 |
0.006 |
Twist |
0.000 |
-0.088 |
-0.245 |
0.000 |
0.006 |
0.037 |
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 |
1.241 |
0.000 |
0.000 |
-0.134 |
0.000 |
0.000 |
Slide |
0.000 |
2.734 |
2.201 |
0.000 |
0.068 |
-0.082 |
Rise |
0.000 |
2.201 |
10.913 |
0.000 |
0.132 |
-0.242 |
Tilt |
-0.134 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
0.068 |
0.132 |
0.000 |
0.025 |
0.007 |
Twist |
0.000 |
-0.082 |
-0.242 |
0.000 |
0.007 |
0.037 |
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 |
0.851 |
0.000 |
0.000 |
-0.083 |
0.000 |
0.000 |
Slide |
0.000 |
1.965 |
1.267 |
0.000 |
-0.036 |
-0.117 |
Rise |
0.000 |
1.267 |
7.746 |
0.000 |
-0.058 |
-0.162 |
Tilt |
-0.083 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.036 |
-0.058 |
0.000 |
0.023 |
0.012 |
Twist |
0.000 |
-0.117 |
-0.162 |
0.000 |
0.012 |
0.029 |
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 |
1.325 |
0.000 |
0.000 |
-0.077 |
0.000 |
0.000 |
Slide |
0.000 |
3.249 |
1.456 |
0.000 |
-0.062 |
-0.226 |
Rise |
0.000 |
1.456 |
7.376 |
0.000 |
-0.035 |
-0.144 |
Tilt |
-0.077 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.062 |
-0.035 |
0.000 |
0.023 |
0.004 |
Twist |
0.000 |
-0.226 |
-0.144 |
0.000 |
0.004 |
0.038 |
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)