| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
0.865 |
0.000 |
0.000 |
-0.030 |
0.000 |
0.000 |
| Slide |
0.000 |
4.278 |
3.342 |
0.000 |
-0.016 |
-0.144 |
| Rise |
0.000 |
3.342 |
11.733 |
0.000 |
0.122 |
-0.150 |
| Tilt |
-0.030 |
0.000 |
0.000 |
0.049 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.016 |
0.122 |
0.000 |
0.034 |
0.010 |
| Twist |
0.000 |
-0.144 |
-0.150 |
0.000 |
0.010 |
0.057 |
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 |
1.064 |
0.000 |
0.000 |
-0.142 |
0.000 |
0.000 |
| Slide |
0.000 |
2.970 |
0.613 |
0.000 |
0.001 |
-0.157 |
| Rise |
0.000 |
0.613 |
8.506 |
0.000 |
-0.091 |
-0.253 |
| Tilt |
-0.142 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
| Roll |
0.000 |
0.001 |
-0.091 |
0.000 |
0.017 |
0.007 |
| Twist |
0.000 |
-0.157 |
-0.253 |
0.000 |
0.007 |
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 |
1.083 |
0.000 |
0.000 |
-0.105 |
0.000 |
0.000 |
| Slide |
0.000 |
2.908 |
0.167 |
0.000 |
0.018 |
-0.154 |
| Rise |
0.000 |
0.167 |
8.543 |
0.000 |
-0.105 |
-0.238 |
| Tilt |
-0.105 |
0.000 |
0.000 |
0.024 |
0.000 |
0.000 |
| Roll |
0.000 |
0.018 |
-0.105 |
0.000 |
0.019 |
0.008 |
| Twist |
0.000 |
-0.154 |
-0.238 |
0.000 |
0.008 |
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 |
0.854 |
0.000 |
0.000 |
-0.125 |
0.000 |
0.000 |
| Slide |
0.000 |
2.513 |
1.356 |
0.000 |
-0.040 |
-0.116 |
| Rise |
0.000 |
1.356 |
8.976 |
0.000 |
-0.031 |
-0.149 |
| Tilt |
-0.125 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.040 |
-0.031 |
0.000 |
0.026 |
0.011 |
| Twist |
0.000 |
-0.116 |
-0.149 |
0.000 |
0.011 |
0.043 |
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 |
0.852 |
0.000 |
0.000 |
-0.122 |
0.000 |
0.000 |
| Slide |
0.000 |
3.867 |
2.567 |
0.000 |
0.091 |
-0.115 |
| Rise |
0.000 |
2.567 |
11.805 |
0.000 |
0.158 |
-0.230 |
| Tilt |
-0.122 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
| Roll |
0.000 |
0.091 |
0.158 |
0.000 |
0.022 |
0.001 |
| Twist |
0.000 |
-0.115 |
-0.230 |
0.000 |
0.001 |
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 |
1.170 |
0.000 |
0.000 |
-0.124 |
0.000 |
0.000 |
| Slide |
0.000 |
2.722 |
2.022 |
0.000 |
0.065 |
-0.067 |
| Rise |
0.000 |
2.022 |
10.651 |
0.000 |
0.136 |
-0.186 |
| Tilt |
-0.124 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
| Roll |
0.000 |
0.065 |
0.136 |
0.000 |
0.026 |
0.007 |
| Twist |
0.000 |
-0.067 |
-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 |
0.867 |
0.000 |
0.000 |
-0.036 |
0.000 |
0.000 |
| Slide |
0.000 |
4.775 |
3.386 |
0.000 |
-0.039 |
-0.164 |
| Rise |
0.000 |
3.386 |
11.723 |
0.000 |
0.115 |
-0.171 |
| Tilt |
-0.036 |
0.000 |
0.000 |
0.052 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.039 |
0.115 |
0.000 |
0.035 |
0.012 |
| Twist |
0.000 |
-0.164 |
-0.171 |
0.000 |
0.012 |
0.060 |
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 |
1.027 |
0.000 |
0.000 |
-0.144 |
0.000 |
0.000 |
| Slide |
0.000 |
2.566 |
1.176 |
0.000 |
-0.032 |
-0.089 |
| Rise |
0.000 |
1.176 |
8.904 |
0.000 |
-0.028 |
-0.165 |
| Tilt |
-0.144 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.032 |
-0.028 |
0.000 |
0.023 |
0.010 |
| Twist |
0.000 |
-0.089 |
-0.165 |
0.000 |
0.010 |
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 |
1.923 |
0.000 |
0.000 |
-0.090 |
0.000 |
0.000 |
| Slide |
0.000 |
2.686 |
1.184 |
0.000 |
-0.020 |
-0.091 |
| Rise |
0.000 |
1.184 |
7.212 |
0.000 |
-0.131 |
-0.207 |
| Tilt |
-0.090 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.020 |
-0.131 |
0.000 |
0.021 |
0.012 |
| Twist |
0.000 |
-0.091 |
-0.207 |
0.000 |
0.012 |
0.035 |
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)