| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.537 |
0.000 |
0.000 |
-0.022 |
0.000 |
0.000 |
Slide |
0.000 |
2.548 |
1.518 |
0.000 |
-0.098 |
-0.118 |
Rise |
0.000 |
1.518 |
6.307 |
0.000 |
-0.071 |
-0.155 |
Tilt |
-0.022 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.098 |
-0.071 |
0.000 |
0.024 |
0.011 |
Twist |
0.000 |
-0.118 |
-0.155 |
0.000 |
0.011 |
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 |
1.266 |
0.000 |
0.000 |
-0.062 |
0.000 |
0.000 |
Slide |
0.000 |
2.252 |
1.357 |
0.000 |
-0.045 |
-0.128 |
Rise |
0.000 |
1.357 |
7.114 |
0.000 |
-0.051 |
-0.173 |
Tilt |
-0.062 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.045 |
-0.051 |
0.000 |
0.019 |
0.005 |
Twist |
0.000 |
-0.128 |
-0.173 |
0.000 |
0.005 |
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 |
1.160 |
0.000 |
0.000 |
-0.028 |
0.000 |
0.000 |
Slide |
0.000 |
2.334 |
1.354 |
0.000 |
-0.088 |
-0.136 |
Rise |
0.000 |
1.354 |
6.675 |
0.000 |
-0.052 |
-0.152 |
Tilt |
-0.028 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.088 |
-0.052 |
0.000 |
0.022 |
0.008 |
Twist |
0.000 |
-0.136 |
-0.152 |
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)
| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.214 |
0.000 |
0.000 |
-0.055 |
0.000 |
0.000 |
Slide |
0.000 |
2.533 |
1.305 |
0.000 |
-0.072 |
-0.160 |
Rise |
0.000 |
1.305 |
6.858 |
0.000 |
-0.056 |
-0.177 |
Tilt |
-0.055 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.072 |
-0.056 |
0.000 |
0.021 |
0.008 |
Twist |
0.000 |
-0.160 |
-0.176 |
0.000 |
0.008 |
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 |
1.431 |
0.000 |
0.000 |
-0.059 |
0.000 |
0.000 |
Slide |
0.000 |
2.872 |
1.280 |
0.000 |
-0.058 |
-0.189 |
Rise |
0.000 |
1.280 |
8.093 |
0.000 |
-0.041 |
-0.181 |
Tilt |
-0.059 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.058 |
-0.041 |
0.000 |
0.023 |
0.008 |
Twist |
0.000 |
-0.189 |
-0.181 |
0.000 |
0.008 |
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 |
1.245 |
0.000 |
0.000 |
-0.053 |
0.000 |
0.000 |
Slide |
0.000 |
3.270 |
2.727 |
0.000 |
0.014 |
-0.116 |
Rise |
0.000 |
2.727 |
10.567 |
0.000 |
0.066 |
-0.199 |
Tilt |
-0.053 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
0.014 |
0.066 |
0.000 |
0.025 |
0.010 |
Twist |
0.000 |
-0.116 |
-0.199 |
0.000 |
0.010 |
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 |
1.013 |
0.000 |
0.000 |
-0.111 |
0.000 |
0.000 |
Slide |
0.000 |
2.563 |
0.540 |
0.000 |
0.007 |
-0.123 |
Rise |
0.000 |
0.540 |
7.605 |
0.000 |
-0.073 |
-0.221 |
Tilt |
-0.111 |
0.000 |
0.000 |
0.024 |
0.000 |
0.000 |
Roll |
0.000 |
0.007 |
-0.073 |
0.000 |
0.016 |
0.007 |
Twist |
0.000 |
-0.123 |
-0.221 |
0.000 |
0.007 |
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 |
0.781 |
0.000 |
0.000 |
-0.088 |
0.000 |
0.000 |
Slide |
0.000 |
2.186 |
1.238 |
0.000 |
-0.055 |
-0.131 |
Rise |
0.000 |
1.238 |
7.252 |
0.000 |
-0.059 |
-0.154 |
Tilt |
-0.088 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.055 |
-0.059 |
0.000 |
0.022 |
0.011 |
Twist |
0.000 |
-0.131 |
-0.154 |
0.000 |
0.011 |
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 |
1.249 |
0.000 |
0.000 |
-0.105 |
0.000 |
0.000 |
Slide |
0.000 |
3.157 |
2.111 |
0.000 |
0.052 |
-0.056 |
Rise |
0.000 |
2.111 |
10.184 |
0.000 |
0.123 |
-0.137 |
Tilt |
-0.105 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
0.052 |
0.123 |
0.000 |
0.024 |
0.005 |
Twist |
0.000 |
-0.056 |
-0.137 |
0.000 |
0.005 |
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)