| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.691 |
0.000 |
0.000 |
-0.024 |
0.000 |
0.000 |
Slide |
0.000 |
3.405 |
1.569 |
0.000 |
-0.090 |
-0.243 |
Rise |
0.000 |
1.569 |
7.025 |
0.000 |
-0.065 |
-0.183 |
Tilt |
-0.024 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
-0.090 |
-0.065 |
0.000 |
0.022 |
0.010 |
Twist |
0.000 |
-0.243 |
-0.183 |
0.000 |
0.010 |
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 |
1.819 |
0.000 |
0.000 |
-0.045 |
0.000 |
0.000 |
Slide |
0.000 |
3.277 |
1.117 |
0.000 |
-0.071 |
-0.241 |
Rise |
0.000 |
1.117 |
7.530 |
0.000 |
-0.045 |
-0.150 |
Tilt |
-0.045 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
-0.071 |
-0.045 |
0.000 |
0.023 |
0.009 |
Twist |
0.000 |
-0.241 |
-0.150 |
0.000 |
0.009 |
0.047 |
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 |
1.716 |
0.000 |
0.000 |
-0.031 |
0.000 |
0.000 |
Slide |
0.000 |
3.393 |
1.616 |
0.000 |
-0.084 |
-0.249 |
Rise |
0.000 |
1.616 |
7.355 |
0.000 |
-0.070 |
-0.185 |
Tilt |
-0.031 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
-0.084 |
-0.070 |
0.000 |
0.023 |
0.010 |
Twist |
0.000 |
-0.249 |
-0.185 |
0.000 |
0.010 |
0.044 |
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 |
1.222 |
0.000 |
0.000 |
-0.000 |
0.000 |
0.000 |
Slide |
0.000 |
4.129 |
2.721 |
0.000 |
-0.018 |
-0.177 |
Rise |
0.000 |
2.721 |
10.291 |
0.000 |
0.059 |
-0.194 |
Tilt |
-0.000 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
-0.018 |
0.059 |
0.000 |
0.024 |
0.012 |
Twist |
0.000 |
-0.177 |
-0.194 |
0.000 |
0.012 |
0.047 |
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 |
1.239 |
0.000 |
0.000 |
-0.008 |
0.000 |
0.000 |
Slide |
0.000 |
2.695 |
1.466 |
0.000 |
-0.013 |
-0.023 |
Rise |
0.000 |
1.466 |
9.272 |
0.000 |
0.051 |
-0.085 |
Tilt |
-0.008 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
-0.013 |
0.051 |
0.000 |
0.024 |
0.009 |
Twist |
0.000 |
-0.023 |
-0.085 |
0.000 |
0.009 |
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 |
1.194 |
0.000 |
0.000 |
0.014 |
0.000 |
0.000 |
Slide |
0.000 |
4.186 |
2.804 |
0.000 |
-0.042 |
-0.123 |
Rise |
0.000 |
2.804 |
9.932 |
0.000 |
0.062 |
-0.188 |
Tilt |
0.014 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
-0.042 |
0.062 |
0.000 |
0.026 |
0.012 |
Twist |
0.000 |
-0.123 |
-0.188 |
0.000 |
0.012 |
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 |
1.266 |
0.000 |
0.000 |
-0.000 |
0.000 |
0.000 |
Slide |
0.000 |
4.295 |
2.661 |
0.000 |
-0.016 |
-0.182 |
Rise |
0.000 |
2.661 |
10.211 |
0.000 |
0.084 |
-0.177 |
Tilt |
-0.000 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
-0.016 |
0.084 |
0.000 |
0.026 |
0.014 |
Twist |
0.000 |
-0.182 |
-0.177 |
0.000 |
0.014 |
0.052 |
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 |
0.413 |
0.000 |
0.000 |
0.011 |
0.000 |
0.000 |
Slide |
0.000 |
1.023 |
-0.241 |
0.000 |
0.002 |
-0.038 |
Rise |
0.000 |
-0.241 |
1.568 |
0.000 |
-0.051 |
-0.018 |
Tilt |
0.011 |
0.000 |
0.000 |
0.006 |
0.000 |
0.000 |
Roll |
0.000 |
0.002 |
-0.051 |
0.000 |
0.008 |
0.000 |
Twist |
0.000 |
-0.038 |
-0.018 |
0.000 |
0.000 |
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 |
0.990 |
0.000 |
0.000 |
-0.057 |
0.000 |
0.000 |
Slide |
0.000 |
1.766 |
1.204 |
0.000 |
-0.027 |
-0.114 |
Rise |
0.000 |
1.204 |
6.800 |
0.000 |
-0.039 |
-0.171 |
Tilt |
-0.057 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.027 |
-0.039 |
0.000 |
0.022 |
0.011 |
Twist |
0.000 |
-0.114 |
-0.171 |
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 |
1.021 |
0.000 |
0.000 |
-0.064 |
0.000 |
0.000 |
Slide |
0.000 |
1.666 |
1.171 |
0.000 |
-0.029 |
-0.103 |
Rise |
0.000 |
1.171 |
6.860 |
0.000 |
-0.048 |
-0.166 |
Tilt |
-0.064 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.029 |
-0.048 |
0.000 |
0.022 |
0.012 |
Twist |
0.000 |
-0.103 |
-0.166 |
0.000 |
0.012 |
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 |
1.013 |
0.000 |
0.000 |
-0.061 |
0.000 |
0.000 |
Slide |
0.000 |
1.666 |
1.174 |
0.000 |
-0.027 |
-0.116 |
Rise |
0.000 |
1.174 |
6.911 |
0.000 |
-0.025 |
-0.164 |
Tilt |
-0.061 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.027 |
-0.025 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.116 |
-0.164 |
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 |
0.991 |
0.000 |
0.000 |
-0.050 |
0.000 |
0.000 |
Slide |
0.000 |
1.691 |
1.061 |
0.000 |
-0.006 |
-0.043 |
Rise |
0.000 |
1.061 |
6.827 |
0.000 |
-0.120 |
-0.210 |
Tilt |
-0.050 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
-0.006 |
-0.120 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.043 |
-0.210 |
0.000 |
0.009 |
0.016 |
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 |
1.177 |
0.000 |
0.000 |
-0.019 |
0.000 |
0.000 |
Slide |
0.000 |
0.648 |
-0.096 |
0.000 |
0.002 |
0.038 |
Rise |
0.000 |
-0.096 |
5.121 |
0.000 |
-0.078 |
-0.079 |
Tilt |
-0.019 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.002 |
-0.078 |
0.000 |
0.015 |
0.002 |
Twist |
0.000 |
0.038 |
-0.079 |
0.000 |
0.002 |
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 |
0.883 |
0.000 |
0.000 |
-0.055 |
0.000 |
0.000 |
Slide |
0.000 |
1.704 |
1.086 |
0.000 |
0.002 |
-0.055 |
Rise |
0.000 |
1.086 |
6.249 |
0.000 |
-0.091 |
-0.195 |
Tilt |
-0.055 |
0.000 |
0.000 |
0.024 |
0.000 |
0.000 |
Roll |
0.000 |
0.002 |
-0.091 |
0.000 |
0.018 |
0.008 |
Twist |
0.000 |
-0.055 |
-0.195 |
0.000 |
0.008 |
0.017 |
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 |
0.925 |
0.000 |
0.000 |
-0.060 |
0.000 |
0.000 |
Slide |
0.000 |
1.712 |
1.123 |
0.000 |
-0.002 |
-0.044 |
Rise |
0.000 |
1.123 |
6.154 |
0.000 |
-0.082 |
-0.191 |
Tilt |
-0.060 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
-0.002 |
-0.082 |
0.000 |
0.018 |
0.008 |
Twist |
0.000 |
-0.044 |
-0.191 |
0.000 |
0.008 |
0.016 |
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)