| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.956 |
0.000 |
0.000 |
-0.075 |
0.000 |
0.000 |
Slide |
0.000 |
2.817 |
0.721 |
0.000 |
-0.073 |
-0.138 |
Rise |
0.000 |
0.721 |
8.972 |
0.000 |
-0.016 |
-0.198 |
Tilt |
-0.075 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.073 |
-0.016 |
0.000 |
0.023 |
0.012 |
Twist |
0.000 |
-0.138 |
-0.198 |
0.000 |
0.012 |
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 |
1.129 |
0.000 |
0.000 |
-0.097 |
0.000 |
0.000 |
Slide |
0.000 |
3.153 |
1.226 |
0.000 |
-0.072 |
-0.192 |
Rise |
0.000 |
1.226 |
8.910 |
0.000 |
-0.043 |
-0.188 |
Tilt |
-0.097 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
-0.072 |
-0.043 |
0.000 |
0.026 |
0.012 |
Twist |
0.000 |
-0.192 |
-0.188 |
0.000 |
0.012 |
0.032 |
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 |
1.900 |
0.000 |
0.000 |
-0.110 |
0.000 |
0.000 |
Slide |
0.000 |
4.378 |
1.294 |
0.000 |
-0.021 |
-0.343 |
Rise |
0.000 |
1.294 |
8.425 |
0.000 |
-0.046 |
-0.145 |
Tilt |
-0.110 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.021 |
-0.046 |
0.000 |
0.026 |
0.004 |
Twist |
0.000 |
-0.343 |
-0.145 |
0.000 |
0.004 |
0.062 |
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 |
0.799 |
0.000 |
0.000 |
-0.045 |
0.000 |
0.000 |
Slide |
0.000 |
2.494 |
0.967 |
0.000 |
-0.082 |
-0.140 |
Rise |
0.000 |
0.967 |
9.063 |
0.000 |
-0.023 |
-0.159 |
Tilt |
-0.045 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.082 |
-0.023 |
0.000 |
0.023 |
0.012 |
Twist |
0.000 |
-0.140 |
-0.159 |
0.000 |
0.012 |
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 |
1.418 |
0.000 |
0.000 |
-0.083 |
0.000 |
0.000 |
Slide |
0.000 |
3.166 |
0.792 |
0.000 |
-0.053 |
-0.177 |
Rise |
0.000 |
0.792 |
8.724 |
0.000 |
-0.027 |
-0.157 |
Tilt |
-0.083 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.053 |
-0.027 |
0.000 |
0.025 |
0.010 |
Twist |
0.000 |
-0.177 |
-0.157 |
0.000 |
0.010 |
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 |
2.076 |
0.000 |
0.000 |
-0.133 |
0.000 |
0.000 |
Slide |
0.000 |
3.515 |
1.710 |
0.000 |
-0.069 |
-0.183 |
Rise |
0.000 |
1.710 |
8.414 |
0.000 |
-0.064 |
-0.164 |
Tilt |
-0.133 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
-0.069 |
-0.064 |
0.000 |
0.026 |
0.004 |
Twist |
0.000 |
-0.183 |
-0.164 |
0.000 |
0.004 |
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 |
0.962 |
0.000 |
0.000 |
-0.058 |
0.000 |
0.000 |
Slide |
0.000 |
2.230 |
1.799 |
0.000 |
-0.027 |
-0.102 |
Rise |
0.000 |
1.799 |
6.028 |
0.000 |
-0.060 |
-0.181 |
Tilt |
-0.058 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.027 |
-0.060 |
0.000 |
0.018 |
0.002 |
Twist |
0.000 |
-0.102 |
-0.181 |
0.000 |
0.002 |
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 |
2.943 |
0.000 |
0.000 |
-0.017 |
0.000 |
0.000 |
Slide |
0.000 |
5.861 |
2.706 |
0.000 |
-0.000 |
-0.217 |
Rise |
0.000 |
2.706 |
11.203 |
0.000 |
0.057 |
-0.166 |
Tilt |
-0.017 |
0.000 |
0.000 |
0.049 |
0.000 |
0.000 |
Roll |
0.000 |
-0.000 |
0.057 |
0.000 |
0.037 |
0.004 |
Twist |
0.000 |
-0.217 |
-0.166 |
0.000 |
0.004 |
0.076 |
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 |
0.742 |
0.000 |
0.000 |
-0.065 |
0.000 |
0.000 |
Slide |
0.000 |
2.528 |
0.933 |
0.000 |
0.017 |
-0.103 |
Rise |
0.000 |
0.933 |
7.657 |
0.000 |
-0.097 |
-0.216 |
Tilt |
-0.065 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
0.017 |
-0.097 |
0.000 |
0.020 |
0.011 |
Twist |
0.000 |
-0.103 |
-0.216 |
0.000 |
0.011 |
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 |
0.754 |
0.000 |
0.000 |
-0.058 |
0.000 |
0.000 |
Slide |
0.000 |
2.542 |
1.131 |
0.000 |
0.015 |
-0.101 |
Rise |
0.000 |
1.131 |
7.300 |
0.000 |
-0.087 |
-0.226 |
Tilt |
-0.058 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
0.015 |
-0.087 |
0.000 |
0.019 |
0.009 |
Twist |
0.000 |
-0.101 |
-0.226 |
0.000 |
0.009 |
0.022 |
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 |
1.137 |
0.000 |
0.000 |
-0.115 |
0.000 |
0.000 |
Slide |
0.000 |
3.437 |
0.475 |
0.000 |
0.007 |
-0.119 |
Rise |
0.000 |
0.475 |
8.866 |
0.000 |
-0.079 |
-0.267 |
Tilt |
-0.115 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
0.007 |
-0.079 |
0.000 |
0.021 |
0.007 |
Twist |
0.000 |
-0.119 |
-0.267 |
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 |
1.396 |
0.000 |
0.000 |
-0.139 |
0.000 |
0.000 |
Slide |
0.000 |
2.948 |
2.663 |
0.000 |
0.064 |
-0.092 |
Rise |
0.000 |
2.663 |
12.364 |
0.000 |
0.143 |
-0.271 |
Tilt |
-0.139 |
0.000 |
0.000 |
0.048 |
0.000 |
0.000 |
Roll |
0.000 |
0.064 |
0.143 |
0.000 |
0.027 |
0.004 |
Twist |
0.000 |
-0.092 |
-0.271 |
0.000 |
0.004 |
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 |
1.334 |
0.000 |
0.000 |
-0.132 |
0.000 |
0.000 |
Slide |
0.000 |
3.344 |
2.666 |
0.000 |
0.068 |
-0.127 |
Rise |
0.000 |
2.666 |
11.264 |
0.000 |
0.132 |
-0.246 |
Tilt |
-0.132 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
0.068 |
0.132 |
0.000 |
0.024 |
0.006 |
Twist |
0.000 |
-0.127 |
-0.246 |
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 |
0.423 |
0.000 |
0.000 |
-0.045 |
0.000 |
0.000 |
Slide |
0.000 |
2.505 |
1.080 |
0.000 |
-0.007 |
-0.153 |
Rise |
0.000 |
1.080 |
8.068 |
0.000 |
-0.101 |
-0.220 |
Tilt |
-0.045 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
-0.007 |
-0.101 |
0.000 |
0.018 |
0.013 |
Twist |
0.000 |
-0.153 |
-0.220 |
0.000 |
0.013 |
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 |
0.732 |
0.000 |
0.000 |
-0.096 |
0.000 |
0.000 |
Slide |
0.000 |
2.855 |
1.042 |
0.000 |
-0.052 |
-0.154 |
Rise |
0.000 |
1.042 |
9.617 |
0.000 |
-0.016 |
-0.154 |
Tilt |
-0.096 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
-0.052 |
-0.016 |
0.000 |
0.023 |
0.008 |
Twist |
0.000 |
-0.154 |
-0.154 |
0.000 |
0.008 |
0.048 |
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)