| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.826 |
0.000 |
0.000 |
-0.054 |
0.000 |
0.000 |
Slide |
0.000 |
1.197 |
0.637 |
0.000 |
-0.027 |
0.036 |
Rise |
0.000 |
0.637 |
5.830 |
0.000 |
-0.016 |
-0.036 |
Tilt |
-0.054 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
-0.027 |
-0.016 |
0.000 |
0.017 |
0.003 |
Twist |
0.000 |
0.036 |
-0.036 |
0.000 |
0.003 |
0.005 |
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 |
1.075 |
0.000 |
0.000 |
-0.128 |
0.000 |
0.000 |
Slide |
0.000 |
1.554 |
1.598 |
0.000 |
-0.001 |
-0.134 |
Rise |
0.000 |
1.598 |
7.565 |
0.000 |
-0.003 |
-0.163 |
Tilt |
-0.128 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
-0.001 |
-0.003 |
0.000 |
0.021 |
0.007 |
Twist |
0.000 |
-0.134 |
-0.163 |
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 |
1.072 |
0.000 |
0.000 |
-0.028 |
0.000 |
0.000 |
Slide |
0.000 |
3.051 |
2.751 |
0.000 |
0.019 |
-0.086 |
Rise |
0.000 |
2.751 |
9.476 |
0.000 |
0.081 |
-0.210 |
Tilt |
-0.028 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
0.019 |
0.081 |
0.000 |
0.022 |
0.010 |
Twist |
0.000 |
-0.086 |
-0.210 |
0.000 |
0.010 |
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 |
1.029 |
0.000 |
0.000 |
-0.028 |
0.000 |
0.000 |
Slide |
0.000 |
3.010 |
2.690 |
0.000 |
0.021 |
-0.090 |
Rise |
0.000 |
2.690 |
9.247 |
0.000 |
0.077 |
-0.208 |
Tilt |
-0.028 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
0.021 |
0.077 |
0.000 |
0.023 |
0.011 |
Twist |
0.000 |
-0.090 |
-0.208 |
0.000 |
0.011 |
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 |
0.932 |
0.000 |
0.000 |
-0.021 |
0.000 |
0.000 |
Slide |
0.000 |
3.176 |
2.744 |
0.000 |
0.037 |
-0.094 |
Rise |
0.000 |
2.744 |
9.977 |
0.000 |
0.103 |
-0.230 |
Tilt |
-0.021 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
0.037 |
0.103 |
0.000 |
0.022 |
0.011 |
Twist |
0.000 |
-0.094 |
-0.230 |
0.000 |
0.011 |
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 |
1.053 |
0.000 |
0.000 |
-0.042 |
0.000 |
0.000 |
Slide |
0.000 |
3.111 |
2.464 |
0.000 |
0.018 |
-0.093 |
Rise |
0.000 |
2.464 |
9.176 |
0.000 |
0.079 |
-0.215 |
Tilt |
-0.042 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
0.018 |
0.079 |
0.000 |
0.022 |
0.010 |
Twist |
0.000 |
-0.093 |
-0.215 |
0.000 |
0.010 |
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 |
1.043 |
0.000 |
0.000 |
-0.022 |
0.000 |
0.000 |
Slide |
0.000 |
3.135 |
2.862 |
0.000 |
0.023 |
-0.090 |
Rise |
0.000 |
2.862 |
9.569 |
0.000 |
0.091 |
-0.213 |
Tilt |
-0.022 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
0.023 |
0.091 |
0.000 |
0.022 |
0.009 |
Twist |
0.000 |
-0.090 |
-0.213 |
0.000 |
0.009 |
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 |
1.024 |
0.000 |
0.000 |
-0.025 |
0.000 |
0.000 |
Slide |
0.000 |
2.990 |
2.746 |
0.000 |
0.016 |
-0.095 |
Rise |
0.000 |
2.746 |
9.613 |
0.000 |
0.084 |
-0.214 |
Tilt |
-0.025 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
0.016 |
0.084 |
0.000 |
0.022 |
0.009 |
Twist |
0.000 |
-0.095 |
-0.214 |
0.000 |
0.009 |
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 |
0.901 |
0.000 |
0.000 |
-0.049 |
0.000 |
0.000 |
Slide |
0.000 |
1.940 |
1.276 |
0.000 |
0.005 |
-0.079 |
Rise |
0.000 |
1.276 |
6.104 |
0.000 |
-0.084 |
-0.207 |
Tilt |
-0.049 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.005 |
-0.084 |
0.000 |
0.016 |
0.008 |
Twist |
0.000 |
-0.079 |
-0.207 |
0.000 |
0.008 |
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 |
0.903 |
0.000 |
0.000 |
-0.050 |
0.000 |
0.000 |
Slide |
0.000 |
1.801 |
1.203 |
0.000 |
0.005 |
-0.080 |
Rise |
0.000 |
1.204 |
6.238 |
0.000 |
-0.075 |
-0.209 |
Tilt |
-0.050 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.005 |
-0.075 |
0.000 |
0.017 |
0.009 |
Twist |
0.000 |
-0.080 |
-0.209 |
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 |
0.806 |
0.000 |
0.000 |
-0.049 |
0.000 |
0.000 |
Slide |
0.000 |
1.875 |
0.696 |
0.000 |
0.018 |
-0.053 |
Rise |
0.000 |
0.696 |
7.197 |
0.000 |
-0.111 |
-0.230 |
Tilt |
-0.049 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
0.018 |
-0.111 |
0.000 |
0.019 |
0.009 |
Twist |
0.000 |
-0.053 |
-0.230 |
0.000 |
0.009 |
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 |
0.776 |
0.000 |
0.000 |
-0.050 |
0.000 |
0.000 |
Slide |
0.000 |
1.257 |
0.991 |
0.000 |
0.014 |
-0.067 |
Rise |
0.000 |
0.991 |
6.229 |
0.000 |
-0.085 |
-0.185 |
Tilt |
-0.050 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.014 |
-0.085 |
0.000 |
0.014 |
0.007 |
Twist |
0.000 |
-0.067 |
-0.185 |
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 |
0.911 |
0.000 |
0.000 |
-0.054 |
0.000 |
0.000 |
Slide |
0.000 |
1.833 |
1.196 |
0.000 |
0.005 |
-0.072 |
Rise |
0.000 |
1.196 |
5.813 |
0.000 |
-0.083 |
-0.204 |
Tilt |
-0.054 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.005 |
-0.083 |
0.000 |
0.016 |
0.008 |
Twist |
0.000 |
-0.072 |
-0.204 |
0.000 |
0.008 |
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 |
0.890 |
0.000 |
0.000 |
-0.048 |
0.000 |
0.000 |
Slide |
0.000 |
1.711 |
1.203 |
0.000 |
0.003 |
-0.071 |
Rise |
0.000 |
1.203 |
5.928 |
0.000 |
-0.088 |
-0.201 |
Tilt |
-0.048 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.003 |
-0.088 |
0.000 |
0.017 |
0.009 |
Twist |
0.000 |
-0.071 |
-0.201 |
0.000 |
0.009 |
0.021 |
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 |
0.865 |
0.000 |
0.000 |
-0.043 |
0.000 |
0.000 |
Slide |
0.000 |
1.842 |
1.193 |
0.000 |
0.006 |
-0.073 |
Rise |
0.000 |
1.193 |
6.140 |
0.000 |
-0.089 |
-0.209 |
Tilt |
-0.043 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.006 |
-0.089 |
0.000 |
0.016 |
0.008 |
Twist |
0.000 |
-0.073 |
-0.209 |
0.000 |
0.008 |
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)