| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
0.939 |
0.000 |
0.000 |
-0.100 |
0.000 |
0.000 |
| Slide |
0.000 |
2.246 |
1.742 |
0.000 |
-0.015 |
-0.172 |
| Rise |
0.000 |
1.742 |
8.681 |
0.000 |
-0.018 |
-0.197 |
| Tilt |
-0.100 |
0.000 |
0.000 |
0.044 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.015 |
-0.018 |
0.000 |
0.023 |
0.009 |
| Twist |
0.000 |
-0.172 |
-0.197 |
0.000 |
0.009 |
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 |
0.962 |
0.000 |
0.000 |
-0.114 |
0.000 |
0.000 |
| Slide |
0.000 |
1.972 |
1.419 |
0.000 |
-0.011 |
-0.140 |
| Rise |
0.000 |
1.419 |
8.450 |
0.000 |
-0.008 |
-0.176 |
| Tilt |
-0.114 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.011 |
-0.008 |
0.000 |
0.022 |
0.010 |
| Twist |
0.000 |
-0.140 |
-0.176 |
0.000 |
0.010 |
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 |
0.943 |
0.000 |
0.000 |
-0.101 |
0.000 |
0.000 |
| Slide |
0.000 |
2.294 |
1.600 |
0.000 |
-0.014 |
-0.181 |
| Rise |
0.000 |
1.600 |
8.480 |
0.000 |
-0.014 |
-0.173 |
| Tilt |
-0.101 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.014 |
-0.014 |
0.000 |
0.022 |
0.007 |
| Twist |
0.000 |
-0.181 |
-0.173 |
0.000 |
0.007 |
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 |
1.514 |
0.000 |
0.000 |
-0.066 |
0.000 |
0.000 |
| Slide |
0.000 |
2.823 |
-0.114 |
0.000 |
0.018 |
-0.064 |
| Rise |
0.000 |
-0.114 |
9.296 |
0.000 |
-0.154 |
-0.276 |
| Tilt |
-0.066 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
| Roll |
0.000 |
0.018 |
-0.154 |
0.000 |
0.025 |
0.008 |
| Twist |
0.000 |
-0.064 |
-0.276 |
0.000 |
0.008 |
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)
| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
0.367 |
0.000 |
0.000 |
0.005 |
0.000 |
0.000 |
| Slide |
0.000 |
0.856 |
-0.487 |
0.000 |
-0.001 |
0.021 |
| Rise |
0.000 |
-0.487 |
3.240 |
0.000 |
-0.070 |
-0.086 |
| Tilt |
0.005 |
0.000 |
0.000 |
0.012 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.001 |
-0.070 |
0.000 |
0.007 |
0.001 |
| Twist |
0.000 |
0.021 |
-0.086 |
0.000 |
0.001 |
0.006 |
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 |
1.441 |
0.000 |
0.000 |
-0.137 |
0.000 |
0.000 |
| Slide |
0.000 |
2.341 |
1.108 |
0.000 |
0.006 |
-0.077 |
| Rise |
0.000 |
1.108 |
6.961 |
0.000 |
-0.076 |
-0.233 |
| Tilt |
-0.137 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
| Roll |
0.000 |
0.006 |
-0.076 |
0.000 |
0.018 |
0.007 |
| Twist |
0.000 |
-0.077 |
-0.233 |
0.000 |
0.007 |
0.020 |
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 |
1.464 |
0.000 |
0.000 |
-0.060 |
0.000 |
0.000 |
| Slide |
0.000 |
2.704 |
0.008 |
0.000 |
0.009 |
-0.060 |
| Rise |
0.000 |
0.008 |
9.340 |
0.000 |
-0.145 |
-0.259 |
| Tilt |
-0.060 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
| Roll |
0.000 |
0.009 |
-0.145 |
0.000 |
0.025 |
0.008 |
| Twist |
0.000 |
-0.060 |
-0.259 |
0.000 |
0.008 |
0.018 |
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 |
1.660 |
0.000 |
0.000 |
-0.067 |
0.000 |
0.000 |
| Slide |
0.000 |
2.976 |
-0.166 |
0.000 |
0.013 |
-0.060 |
| Rise |
0.000 |
-0.166 |
9.857 |
0.000 |
-0.157 |
-0.268 |
| Tilt |
-0.067 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
| Roll |
0.000 |
0.013 |
-0.157 |
0.000 |
0.025 |
0.007 |
| Twist |
0.000 |
-0.060 |
-0.268 |
0.000 |
0.007 |
0.018 |
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 |
2.174 |
0.000 |
0.000 |
-0.134 |
0.000 |
0.000 |
| Slide |
0.000 |
4.045 |
2.968 |
0.000 |
0.012 |
-0.171 |
| Rise |
0.000 |
2.968 |
10.352 |
0.000 |
0.097 |
-0.202 |
| Tilt |
-0.134 |
0.000 |
0.000 |
0.046 |
0.000 |
0.000 |
| Roll |
0.000 |
0.012 |
0.097 |
0.000 |
0.029 |
0.009 |
| Twist |
0.000 |
-0.171 |
-0.202 |
0.000 |
0.009 |
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 |
1.450 |
0.000 |
0.000 |
-0.134 |
0.000 |
0.000 |
| Slide |
0.000 |
2.689 |
2.363 |
0.000 |
0.059 |
-0.107 |
| Rise |
0.000 |
2.363 |
10.599 |
0.000 |
0.109 |
-0.221 |
| Tilt |
-0.134 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
| Roll |
0.000 |
0.059 |
0.109 |
0.000 |
0.024 |
0.007 |
| Twist |
0.000 |
-0.107 |
-0.221 |
0.000 |
0.007 |
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 |
1.554 |
0.000 |
0.000 |
-0.142 |
0.000 |
0.000 |
| Slide |
0.000 |
2.829 |
2.524 |
0.000 |
0.055 |
-0.116 |
| Rise |
0.000 |
2.525 |
10.467 |
0.000 |
0.120 |
-0.220 |
| Tilt |
-0.142 |
0.000 |
0.000 |
0.044 |
0.000 |
0.000 |
| Roll |
0.000 |
0.055 |
0.120 |
0.000 |
0.026 |
0.008 |
| Twist |
0.000 |
-0.116 |
-0.220 |
0.000 |
0.008 |
0.034 |
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 |
2.118 |
0.000 |
0.000 |
-0.111 |
0.000 |
0.000 |
| Slide |
0.000 |
3.996 |
2.975 |
0.000 |
0.010 |
-0.154 |
| Rise |
0.000 |
2.975 |
10.595 |
0.000 |
0.105 |
-0.192 |
| Tilt |
-0.111 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
| Roll |
0.000 |
0.010 |
0.105 |
0.000 |
0.031 |
0.010 |
| Twist |
0.000 |
-0.154 |
-0.192 |
0.000 |
0.010 |
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 |
0.960 |
0.000 |
0.000 |
-0.105 |
0.000 |
0.000 |
| Slide |
0.000 |
2.275 |
1.757 |
0.000 |
-0.008 |
-0.172 |
| Rise |
0.000 |
1.757 |
8.777 |
0.000 |
-0.009 |
-0.187 |
| Tilt |
-0.105 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.008 |
-0.009 |
0.000 |
0.022 |
0.008 |
| Twist |
0.000 |
-0.172 |
-0.187 |
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 |
0.993 |
0.000 |
0.000 |
-0.124 |
0.000 |
0.000 |
| Slide |
0.000 |
2.075 |
1.547 |
0.000 |
-0.013 |
-0.153 |
| Rise |
0.000 |
1.548 |
8.553 |
0.000 |
-0.023 |
-0.206 |
| Tilt |
-0.124 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.013 |
-0.023 |
0.000 |
0.022 |
0.010 |
| Twist |
0.000 |
-0.153 |
-0.206 |
0.000 |
0.010 |
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 |
0.952 |
0.000 |
0.000 |
-0.100 |
0.000 |
0.000 |
| Slide |
0.000 |
2.255 |
1.705 |
0.000 |
-0.008 |
-0.188 |
| Rise |
0.000 |
1.705 |
8.542 |
0.000 |
-0.011 |
-0.178 |
| Tilt |
-0.100 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.008 |
-0.011 |
0.000 |
0.022 |
0.008 |
| Twist |
0.000 |
-0.188 |
-0.178 |
0.000 |
0.008 |
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)