| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.543 |
0.000 |
0.000 |
-0.023 |
0.000 |
0.000 |
Slide |
0.000 |
2.243 |
1.250 |
0.000 |
-0.103 |
-0.117 |
Rise |
0.000 |
1.250 |
7.405 |
0.000 |
-0.063 |
-0.167 |
Tilt |
-0.023 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.103 |
-0.063 |
0.000 |
0.024 |
0.011 |
Twist |
0.000 |
-0.117 |
-0.167 |
0.000 |
0.011 |
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 |
1.468 |
0.000 |
0.000 |
-0.038 |
0.000 |
0.000 |
Slide |
0.000 |
2.435 |
0.947 |
0.000 |
-0.084 |
-0.166 |
Rise |
0.000 |
0.947 |
7.765 |
0.000 |
-0.053 |
-0.158 |
Tilt |
-0.038 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.084 |
-0.053 |
0.000 |
0.022 |
0.012 |
Twist |
0.000 |
-0.166 |
-0.158 |
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)
| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.975 |
0.000 |
0.000 |
-0.041 |
0.000 |
0.000 |
Slide |
0.000 |
2.557 |
0.970 |
0.000 |
-0.113 |
-0.128 |
Rise |
0.000 |
0.970 |
7.650 |
0.000 |
-0.051 |
-0.177 |
Tilt |
-0.041 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.113 |
-0.051 |
0.000 |
0.026 |
0.011 |
Twist |
0.000 |
-0.128 |
-0.177 |
0.000 |
0.011 |
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 |
2.101 |
0.000 |
0.000 |
-0.068 |
0.000 |
0.000 |
Slide |
0.000 |
3.417 |
0.625 |
0.000 |
-0.063 |
-0.238 |
Rise |
0.000 |
0.625 |
7.855 |
0.000 |
-0.023 |
-0.165 |
Tilt |
-0.068 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.063 |
-0.023 |
0.000 |
0.023 |
0.010 |
Twist |
0.000 |
-0.238 |
-0.165 |
0.000 |
0.010 |
0.046 |
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 |
0.329 |
0.000 |
0.000 |
0.021 |
0.000 |
0.000 |
Slide |
0.000 |
1.290 |
0.332 |
0.000 |
0.000 |
0.010 |
Rise |
0.000 |
0.332 |
6.042 |
0.000 |
0.045 |
-0.064 |
Tilt |
0.021 |
0.000 |
0.000 |
0.013 |
0.000 |
0.000 |
Roll |
0.000 |
0.000 |
0.045 |
0.000 |
0.014 |
-0.001 |
Twist |
0.000 |
0.010 |
-0.064 |
0.000 |
-0.001 |
0.009 |
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 |
1.734 |
0.000 |
0.000 |
-0.030 |
0.000 |
0.000 |
Slide |
0.000 |
2.302 |
1.196 |
0.000 |
-0.097 |
-0.114 |
Rise |
0.000 |
1.195 |
7.041 |
0.000 |
-0.051 |
-0.162 |
Tilt |
-0.030 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.097 |
-0.051 |
0.000 |
0.023 |
0.011 |
Twist |
0.000 |
-0.114 |
-0.162 |
0.000 |
0.011 |
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 |
1.558 |
0.000 |
0.000 |
-0.037 |
0.000 |
0.000 |
Slide |
0.000 |
2.665 |
1.050 |
0.000 |
-0.093 |
-0.189 |
Rise |
0.000 |
1.050 |
7.995 |
0.000 |
-0.069 |
-0.175 |
Tilt |
-0.037 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.093 |
-0.069 |
0.000 |
0.022 |
0.013 |
Twist |
0.000 |
-0.189 |
-0.175 |
0.000 |
0.013 |
0.039 |
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 |
1.342 |
0.000 |
0.000 |
-0.051 |
0.000 |
0.000 |
Slide |
0.000 |
1.927 |
1.478 |
0.000 |
-0.095 |
-0.061 |
Rise |
0.000 |
1.478 |
7.009 |
0.000 |
-0.058 |
-0.177 |
Tilt |
-0.051 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
-0.095 |
-0.058 |
0.000 |
0.024 |
0.007 |
Twist |
0.000 |
-0.061 |
-0.177 |
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 |
2.040 |
0.000 |
0.000 |
-0.094 |
0.000 |
0.000 |
Slide |
0.000 |
3.772 |
1.633 |
0.000 |
-0.080 |
-0.205 |
Rise |
0.000 |
1.633 |
7.704 |
0.000 |
-0.063 |
-0.136 |
Tilt |
-0.094 |
0.000 |
0.000 |
0.037 |
0.000 |
0.000 |
Roll |
0.000 |
-0.080 |
-0.063 |
0.000 |
0.027 |
0.005 |
Twist |
0.000 |
-0.205 |
-0.136 |
0.000 |
0.005 |
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 |
0.931 |
0.000 |
0.000 |
-0.007 |
0.000 |
0.000 |
Slide |
0.000 |
2.028 |
1.561 |
0.000 |
-0.072 |
-0.073 |
Rise |
0.000 |
1.561 |
6.364 |
0.000 |
-0.041 |
-0.172 |
Tilt |
-0.007 |
0.000 |
0.000 |
0.018 |
0.000 |
0.000 |
Roll |
0.000 |
-0.072 |
-0.041 |
0.000 |
0.021 |
0.006 |
Twist |
0.000 |
-0.073 |
-0.172 |
0.000 |
0.006 |
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 |
1.347 |
0.000 |
0.000 |
-0.048 |
0.000 |
0.000 |
Slide |
0.000 |
1.818 |
1.481 |
0.000 |
-0.082 |
-0.064 |
Rise |
0.000 |
1.481 |
6.519 |
0.000 |
-0.060 |
-0.167 |
Tilt |
-0.048 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.082 |
-0.060 |
0.000 |
0.022 |
0.007 |
Twist |
0.000 |
-0.064 |
-0.167 |
0.000 |
0.007 |
0.024 |
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 |
0.546 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Slide |
0.000 |
0.405 |
-0.001 |
0.000 |
-0.004 |
0.010 |
Rise |
0.000 |
-0.001 |
1.484 |
0.000 |
-0.031 |
-0.021 |
Tilt |
0.043 |
0.000 |
0.000 |
0.014 |
0.000 |
0.000 |
Roll |
0.000 |
-0.004 |
-0.031 |
0.000 |
0.007 |
-0.000 |
Twist |
0.000 |
0.010 |
-0.021 |
0.000 |
-0.000 |
0.001 |
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 |
1.370 |
0.000 |
0.000 |
-0.042 |
0.000 |
0.000 |
Slide |
0.000 |
1.717 |
1.234 |
0.000 |
-0.042 |
-0.129 |
Rise |
0.000 |
1.234 |
7.524 |
0.000 |
-0.046 |
-0.175 |
Tilt |
-0.042 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.042 |
-0.046 |
0.000 |
0.022 |
0.012 |
Twist |
0.000 |
-0.129 |
-0.175 |
0.000 |
0.012 |
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 |
1.333 |
0.000 |
0.000 |
-0.043 |
0.000 |
0.000 |
Slide |
0.000 |
1.750 |
1.269 |
0.000 |
-0.036 |
-0.125 |
Rise |
0.000 |
1.269 |
6.592 |
0.000 |
-0.046 |
-0.163 |
Tilt |
-0.043 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.036 |
-0.046 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.125 |
-0.163 |
0.000 |
0.011 |
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 |
1.309 |
0.000 |
0.000 |
-0.037 |
0.000 |
0.000 |
Slide |
0.000 |
1.661 |
1.262 |
0.000 |
-0.045 |
-0.122 |
Rise |
0.000 |
1.262 |
6.879 |
0.000 |
-0.047 |
-0.172 |
Tilt |
-0.037 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.045 |
-0.047 |
0.000 |
0.021 |
0.012 |
Twist |
0.000 |
-0.122 |
-0.172 |
0.000 |
0.012 |
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)