| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.995 |
0.000 |
0.000 |
-0.081 |
0.000 |
0.000 |
Slide |
0.000 |
2.962 |
0.971 |
0.000 |
-0.056 |
-0.218 |
Rise |
0.000 |
0.971 |
8.827 |
0.000 |
0.008 |
-0.180 |
Tilt |
-0.081 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.056 |
0.008 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.218 |
-0.180 |
0.000 |
0.009 |
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 |
0.866 |
0.000 |
0.000 |
-0.090 |
0.000 |
0.000 |
Slide |
0.000 |
2.537 |
0.802 |
0.000 |
-0.053 |
-0.171 |
Rise |
0.000 |
0.802 |
8.717 |
0.000 |
-0.009 |
-0.176 |
Tilt |
-0.090 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.053 |
-0.009 |
0.000 |
0.020 |
0.011 |
Twist |
0.000 |
-0.171 |
-0.176 |
0.000 |
0.011 |
0.036 |
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 |
0.983 |
0.000 |
0.000 |
-0.085 |
0.000 |
0.000 |
Slide |
0.000 |
2.874 |
0.806 |
0.000 |
-0.057 |
-0.213 |
Rise |
0.000 |
0.806 |
8.490 |
0.000 |
-0.007 |
-0.200 |
Tilt |
-0.085 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.057 |
-0.007 |
0.000 |
0.020 |
0.011 |
Twist |
0.000 |
-0.213 |
-0.200 |
0.000 |
0.011 |
0.041 |
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 |
1.714 |
0.000 |
0.000 |
-0.026 |
0.000 |
0.000 |
Slide |
0.000 |
4.145 |
2.531 |
0.000 |
0.028 |
-0.219 |
Rise |
0.000 |
2.531 |
9.994 |
0.000 |
0.049 |
-0.205 |
Tilt |
-0.026 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
0.028 |
0.049 |
0.000 |
0.027 |
0.006 |
Twist |
0.000 |
-0.219 |
-0.205 |
0.000 |
0.006 |
0.056 |
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 |
1.011 |
0.000 |
0.000 |
-0.067 |
0.000 |
0.000 |
Slide |
0.000 |
2.173 |
1.659 |
0.000 |
0.022 |
-0.063 |
Rise |
0.000 |
1.659 |
8.923 |
0.000 |
0.033 |
-0.196 |
Tilt |
-0.067 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
0.022 |
0.033 |
0.000 |
0.024 |
0.011 |
Twist |
0.000 |
-0.063 |
-0.196 |
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 |
1.282 |
0.000 |
0.000 |
-0.039 |
0.000 |
0.000 |
Slide |
0.000 |
3.385 |
2.636 |
0.000 |
0.029 |
-0.177 |
Rise |
0.000 |
2.636 |
9.831 |
0.000 |
0.079 |
-0.207 |
Tilt |
-0.039 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
0.029 |
0.079 |
0.000 |
0.024 |
0.009 |
Twist |
0.000 |
-0.177 |
-0.207 |
0.000 |
0.009 |
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 |
1.671 |
0.000 |
0.000 |
-0.029 |
0.000 |
0.000 |
Slide |
0.000 |
4.346 |
2.879 |
0.000 |
0.027 |
-0.227 |
Rise |
0.000 |
2.879 |
9.928 |
0.000 |
0.050 |
-0.219 |
Tilt |
-0.029 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
0.027 |
0.050 |
0.000 |
0.027 |
0.006 |
Twist |
0.000 |
-0.227 |
-0.219 |
0.000 |
0.006 |
0.055 |
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 |
1.081 |
0.000 |
0.000 |
-0.041 |
0.000 |
0.000 |
Slide |
0.000 |
1.990 |
1.162 |
0.000 |
-0.003 |
-0.070 |
Rise |
0.000 |
1.162 |
6.339 |
0.000 |
-0.085 |
-0.201 |
Tilt |
-0.041 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.003 |
-0.085 |
0.000 |
0.018 |
0.009 |
Twist |
0.000 |
-0.070 |
-0.201 |
0.000 |
0.009 |
0.021 |
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 |
1.189 |
0.000 |
0.000 |
-0.090 |
0.000 |
0.000 |
Slide |
0.000 |
0.840 |
0.023 |
0.000 |
0.021 |
0.036 |
Rise |
0.000 |
0.023 |
4.130 |
0.000 |
-0.038 |
-0.063 |
Tilt |
-0.090 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.021 |
-0.038 |
0.000 |
0.015 |
0.002 |
Twist |
0.000 |
0.036 |
-0.063 |
0.000 |
0.002 |
0.005 |
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 |
0.736 |
0.000 |
0.000 |
-0.088 |
0.000 |
0.000 |
Slide |
0.000 |
2.692 |
1.448 |
0.000 |
-0.029 |
-0.197 |
Rise |
0.000 |
1.448 |
7.760 |
0.000 |
-0.016 |
-0.187 |
Tilt |
-0.088 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.029 |
-0.016 |
0.000 |
0.018 |
0.006 |
Twist |
0.000 |
-0.197 |
-0.187 |
0.000 |
0.006 |
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 |
0.767 |
0.000 |
0.000 |
-0.075 |
0.000 |
0.000 |
Slide |
0.000 |
2.401 |
1.471 |
0.000 |
-0.040 |
-0.180 |
Rise |
0.000 |
1.471 |
7.884 |
0.000 |
-0.020 |
-0.189 |
Tilt |
-0.075 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.040 |
-0.020 |
0.000 |
0.019 |
0.007 |
Twist |
0.000 |
-0.180 |
-0.189 |
0.000 |
0.007 |
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 |
0.732 |
0.000 |
0.000 |
-0.086 |
0.000 |
0.000 |
Slide |
0.000 |
2.686 |
1.398 |
0.000 |
-0.027 |
-0.199 |
Rise |
0.000 |
1.398 |
7.689 |
0.000 |
-0.013 |
-0.192 |
Tilt |
-0.086 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.027 |
-0.013 |
0.000 |
0.019 |
0.007 |
Twist |
0.000 |
-0.199 |
-0.192 |
0.000 |
0.007 |
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 |
0.754 |
0.000 |
0.000 |
-0.001 |
0.000 |
0.000 |
Slide |
0.000 |
1.298 |
0.568 |
0.000 |
0.028 |
-0.013 |
Rise |
0.000 |
0.568 |
7.255 |
0.000 |
-0.124 |
-0.218 |
Tilt |
-0.001 |
0.000 |
0.000 |
0.021 |
0.000 |
0.000 |
Roll |
0.000 |
0.028 |
-0.124 |
0.000 |
0.021 |
0.012 |
Twist |
0.000 |
-0.013 |
-0.218 |
0.000 |
0.012 |
0.019 |
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 |
0.784 |
0.000 |
0.000 |
-0.001 |
0.000 |
0.000 |
Slide |
0.000 |
1.262 |
0.657 |
0.000 |
0.018 |
-0.020 |
Rise |
0.000 |
0.657 |
7.428 |
0.000 |
-0.139 |
-0.226 |
Tilt |
-0.001 |
0.000 |
0.000 |
0.023 |
0.000 |
0.000 |
Roll |
0.000 |
0.018 |
-0.139 |
0.000 |
0.021 |
0.012 |
Twist |
0.000 |
-0.020 |
-0.226 |
0.000 |
0.012 |
0.020 |
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 |
0.762 |
0.000 |
0.000 |
0.007 |
0.000 |
0.000 |
Slide |
0.000 |
1.325 |
0.644 |
0.000 |
0.015 |
-0.021 |
Rise |
0.000 |
0.645 |
7.507 |
0.000 |
-0.136 |
-0.213 |
Tilt |
0.007 |
0.000 |
0.000 |
0.022 |
0.000 |
0.000 |
Roll |
0.000 |
0.015 |
-0.136 |
0.000 |
0.021 |
0.012 |
Twist |
0.000 |
-0.021 |
-0.213 |
0.000 |
0.012 |
0.019 |
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)