| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.342 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Slide |
0.000 |
5.117 |
0.990 |
0.000 |
0.025 |
-0.262 |
Rise |
0.000 |
0.990 |
7.705 |
0.000 |
-0.166 |
-0.169 |
Tilt |
0.041 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.025 |
-0.166 |
0.000 |
0.021 |
0.003 |
Twist |
0.000 |
-0.262 |
-0.169 |
0.000 |
0.003 |
0.067 |
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 |
1.182 |
0.000 |
0.000 |
-0.009 |
0.000 |
0.000 |
Slide |
0.000 |
3.552 |
2.505 |
0.000 |
-0.064 |
-0.241 |
Rise |
0.000 |
2.505 |
12.831 |
0.000 |
-0.205 |
-0.239 |
Tilt |
-0.009 |
0.000 |
0.000 |
0.037 |
0.000 |
0.000 |
Roll |
0.000 |
-0.064 |
-0.205 |
0.000 |
0.026 |
0.005 |
Twist |
0.000 |
-0.241 |
-0.239 |
0.000 |
0.005 |
0.063 |
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 |
1.168 |
0.000 |
0.000 |
-0.021 |
0.000 |
0.000 |
Slide |
0.000 |
3.853 |
2.392 |
0.000 |
-0.019 |
-0.255 |
Rise |
0.000 |
2.392 |
13.910 |
0.000 |
-0.171 |
-0.278 |
Tilt |
-0.021 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
-0.019 |
-0.171 |
0.000 |
0.028 |
0.001 |
Twist |
0.000 |
-0.255 |
-0.278 |
0.000 |
0.001 |
0.061 |
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 |
2.029 |
0.000 |
0.000 |
-0.045 |
0.000 |
0.000 |
Slide |
0.000 |
6.449 |
1.277 |
0.000 |
-0.021 |
-0.232 |
Rise |
0.000 |
1.277 |
8.792 |
0.000 |
-0.147 |
-0.239 |
Tilt |
-0.045 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
Roll |
0.000 |
-0.021 |
-0.147 |
0.000 |
0.025 |
0.002 |
Twist |
0.000 |
-0.232 |
-0.239 |
0.000 |
0.002 |
0.070 |
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 |
1.937 |
0.000 |
0.000 |
-0.054 |
0.000 |
0.000 |
Slide |
0.000 |
6.383 |
1.427 |
0.000 |
-0.025 |
-0.250 |
Rise |
0.000 |
1.427 |
8.221 |
0.000 |
-0.125 |
-0.200 |
Tilt |
-0.054 |
0.000 |
0.000 |
0.044 |
0.000 |
0.000 |
Roll |
0.000 |
-0.025 |
-0.125 |
0.000 |
0.025 |
-0.001 |
Twist |
0.000 |
-0.250 |
-0.200 |
0.000 |
-0.001 |
0.067 |
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 |
0.934 |
0.000 |
0.000 |
-0.064 |
0.000 |
0.000 |
Slide |
0.000 |
5.053 |
1.600 |
0.000 |
-0.034 |
-0.287 |
Rise |
0.000 |
1.600 |
4.117 |
0.000 |
-0.028 |
-0.073 |
Tilt |
-0.064 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.034 |
-0.028 |
0.000 |
0.015 |
-0.007 |
Twist |
0.000 |
-0.287 |
-0.073 |
0.000 |
-0.007 |
0.065 |
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 |
1.088 |
0.000 |
0.000 |
-0.076 |
0.000 |
0.000 |
Slide |
0.000 |
5.282 |
1.563 |
0.000 |
-0.040 |
-0.298 |
Rise |
0.000 |
1.563 |
4.364 |
0.000 |
-0.039 |
-0.067 |
Tilt |
-0.076 |
0.000 |
0.000 |
0.037 |
0.000 |
0.000 |
Roll |
0.000 |
-0.040 |
-0.039 |
0.000 |
0.015 |
-0.007 |
Twist |
0.000 |
-0.298 |
-0.067 |
0.000 |
-0.007 |
0.064 |
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 |
0.894 |
0.000 |
0.000 |
-0.073 |
0.000 |
0.000 |
Slide |
0.000 |
5.308 |
1.474 |
0.000 |
-0.031 |
-0.315 |
Rise |
0.000 |
1.474 |
4.555 |
0.000 |
-0.013 |
-0.057 |
Tilt |
-0.073 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
-0.031 |
-0.013 |
0.000 |
0.016 |
-0.008 |
Twist |
0.000 |
-0.315 |
-0.057 |
0.000 |
-0.008 |
0.067 |
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 |
1.331 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
Slide |
0.000 |
5.580 |
1.509 |
0.000 |
0.027 |
-0.278 |
Rise |
0.000 |
1.509 |
8.467 |
0.000 |
-0.198 |
-0.221 |
Tilt |
0.042 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
0.027 |
-0.198 |
0.000 |
0.023 |
0.004 |
Twist |
0.000 |
-0.278 |
-0.221 |
0.000 |
0.004 |
0.072 |
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 |
1.848 |
0.000 |
0.000 |
-0.051 |
0.000 |
0.000 |
Slide |
0.000 |
6.410 |
1.451 |
0.000 |
-0.030 |
-0.261 |
Rise |
0.000 |
1.451 |
8.148 |
0.000 |
-0.103 |
-0.210 |
Tilt |
-0.051 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
-0.030 |
-0.103 |
0.000 |
0.023 |
0.000 |
Twist |
0.000 |
-0.261 |
-0.210 |
0.000 |
0.000 |
0.067 |
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 |
1.783 |
0.000 |
0.000 |
-0.041 |
0.000 |
0.000 |
Slide |
0.000 |
6.377 |
1.515 |
0.000 |
-0.019 |
-0.251 |
Rise |
0.000 |
1.515 |
8.591 |
0.000 |
-0.143 |
-0.233 |
Tilt |
-0.041 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
Roll |
0.000 |
-0.019 |
-0.143 |
0.000 |
0.024 |
0.001 |
Twist |
0.000 |
-0.251 |
-0.233 |
0.000 |
0.001 |
0.069 |
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 |
1.159 |
0.000 |
0.000 |
-0.024 |
0.000 |
0.000 |
Slide |
0.000 |
3.824 |
2.481 |
0.000 |
-0.029 |
-0.260 |
Rise |
0.000 |
2.481 |
13.830 |
0.000 |
-0.164 |
-0.287 |
Tilt |
-0.024 |
0.000 |
0.000 |
0.037 |
0.000 |
0.000 |
Roll |
0.000 |
-0.029 |
-0.164 |
0.000 |
0.025 |
0.003 |
Twist |
0.000 |
-0.260 |
-0.287 |
0.000 |
0.003 |
0.064 |
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 |
1.009 |
0.000 |
0.000 |
-0.013 |
0.000 |
0.000 |
Slide |
0.000 |
3.474 |
2.557 |
0.000 |
-0.049 |
-0.254 |
Rise |
0.000 |
2.557 |
13.269 |
0.000 |
-0.198 |
-0.287 |
Tilt |
-0.013 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
-0.049 |
-0.198 |
0.000 |
0.025 |
0.004 |
Twist |
0.000 |
-0.254 |
-0.287 |
0.000 |
0.004 |
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 |
1.390 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Slide |
0.000 |
5.329 |
1.193 |
0.000 |
0.033 |
-0.252 |
Rise |
0.000 |
1.193 |
8.281 |
0.000 |
-0.193 |
-0.213 |
Tilt |
0.040 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
0.033 |
-0.193 |
0.000 |
0.022 |
0.003 |
Twist |
0.000 |
-0.252 |
-0.213 |
0.000 |
0.003 |
0.071 |
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 |
1.351 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Slide |
0.000 |
5.150 |
1.276 |
0.000 |
0.015 |
-0.267 |
Rise |
0.000 |
1.276 |
7.937 |
0.000 |
-0.162 |
-0.200 |
Tilt |
0.040 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
0.015 |
-0.162 |
0.000 |
0.020 |
0.004 |
Twist |
0.000 |
-0.267 |
-0.200 |
0.000 |
0.004 |
0.069 |
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)