| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.634 |
0.000 |
0.000 |
-0.028 |
0.000 |
0.000 |
Slide |
0.000 |
3.775 |
2.748 |
0.000 |
0.034 |
-0.107 |
Rise |
0.000 |
2.748 |
10.199 |
0.000 |
0.100 |
-0.219 |
Tilt |
-0.028 |
0.000 |
0.000 |
0.037 |
0.000 |
0.000 |
Roll |
0.000 |
0.034 |
0.100 |
0.000 |
0.020 |
0.004 |
Twist |
0.000 |
-0.107 |
-0.219 |
0.000 |
0.004 |
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 |
1.349 |
0.000 |
0.000 |
-0.004 |
0.000 |
0.000 |
Slide |
0.000 |
4.750 |
3.240 |
0.000 |
-0.069 |
-0.090 |
Rise |
0.000 |
3.240 |
10.921 |
0.000 |
0.044 |
-0.162 |
Tilt |
-0.004 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
-0.069 |
0.044 |
0.000 |
0.028 |
0.014 |
Twist |
0.000 |
-0.090 |
-0.162 |
0.000 |
0.014 |
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 |
0.670 |
0.000 |
0.000 |
-0.077 |
0.000 |
0.000 |
Slide |
0.000 |
2.336 |
1.117 |
0.000 |
0.016 |
-0.091 |
Rise |
0.000 |
1.117 |
7.049 |
0.000 |
-0.070 |
-0.186 |
Tilt |
-0.077 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
0.016 |
-0.070 |
0.000 |
0.016 |
0.008 |
Twist |
0.000 |
-0.091 |
-0.186 |
0.000 |
0.008 |
0.026 |
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 |
1.045 |
0.000 |
0.000 |
-0.116 |
0.000 |
0.000 |
Slide |
0.000 |
2.083 |
1.024 |
0.000 |
0.011 |
-0.080 |
Rise |
0.000 |
1.024 |
6.620 |
0.000 |
-0.047 |
-0.197 |
Tilt |
-0.116 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
0.011 |
-0.047 |
0.000 |
0.015 |
0.005 |
Twist |
0.000 |
-0.080 |
-0.197 |
0.000 |
0.005 |
0.023 |
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 |
1.069 |
0.000 |
0.000 |
-0.125 |
0.000 |
0.000 |
Slide |
0.000 |
2.402 |
0.905 |
0.000 |
0.021 |
-0.089 |
Rise |
0.000 |
0.905 |
6.813 |
0.000 |
-0.036 |
-0.193 |
Tilt |
-0.125 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
0.021 |
-0.036 |
0.000 |
0.015 |
0.004 |
Twist |
0.000 |
-0.089 |
-0.193 |
0.000 |
0.004 |
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 |
0.818 |
0.000 |
0.000 |
-0.101 |
0.000 |
0.000 |
Slide |
0.000 |
2.359 |
1.918 |
0.000 |
-0.047 |
-0.144 |
Rise |
0.000 |
1.918 |
7.783 |
0.000 |
-0.033 |
-0.182 |
Tilt |
-0.101 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.047 |
-0.033 |
0.000 |
0.019 |
0.002 |
Twist |
0.000 |
-0.144 |
-0.182 |
0.000 |
0.002 |
0.026 |
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 |
1.096 |
0.000 |
0.000 |
-0.122 |
0.000 |
0.000 |
Slide |
0.000 |
2.751 |
2.222 |
0.000 |
0.069 |
-0.056 |
Rise |
0.000 |
2.222 |
10.373 |
0.000 |
0.131 |
-0.196 |
Tilt |
-0.122 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
0.069 |
0.131 |
0.000 |
0.023 |
0.005 |
Twist |
0.000 |
-0.056 |
-0.196 |
0.000 |
0.005 |
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 |
1.158 |
0.000 |
0.000 |
-0.138 |
0.000 |
0.000 |
Slide |
0.000 |
2.894 |
2.468 |
0.000 |
0.065 |
-0.077 |
Rise |
0.000 |
2.468 |
10.469 |
0.000 |
0.129 |
-0.222 |
Tilt |
-0.138 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
Roll |
0.000 |
0.065 |
0.129 |
0.000 |
0.025 |
0.006 |
Twist |
0.000 |
-0.077 |
-0.222 |
0.000 |
0.006 |
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 |
1.488 |
0.000 |
0.000 |
-0.140 |
0.000 |
0.000 |
Slide |
0.000 |
2.325 |
2.411 |
0.000 |
0.025 |
-0.045 |
Rise |
0.000 |
2.411 |
10.690 |
0.000 |
0.098 |
-0.186 |
Tilt |
-0.140 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
0.025 |
0.098 |
0.000 |
0.025 |
0.007 |
Twist |
0.000 |
-0.045 |
-0.186 |
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 |
0.398 |
0.000 |
0.000 |
-0.045 |
0.000 |
0.000 |
Slide |
0.000 |
2.593 |
0.693 |
0.000 |
0.022 |
-0.132 |
Rise |
0.000 |
0.692 |
8.058 |
0.000 |
-0.124 |
-0.224 |
Tilt |
-0.045 |
0.000 |
0.000 |
0.024 |
0.000 |
0.000 |
Roll |
0.000 |
0.022 |
-0.124 |
0.000 |
0.018 |
0.013 |
Twist |
0.000 |
-0.132 |
-0.224 |
0.000 |
0.013 |
0.030 |
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 |
0.672 |
0.000 |
0.000 |
-0.077 |
0.000 |
0.000 |
Slide |
0.000 |
2.332 |
1.209 |
0.000 |
0.008 |
-0.096 |
Rise |
0.000 |
1.209 |
6.399 |
0.000 |
-0.067 |
-0.181 |
Tilt |
-0.077 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
0.008 |
-0.067 |
0.000 |
0.015 |
0.008 |
Twist |
0.000 |
-0.096 |
-0.181 |
0.000 |
0.008 |
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)