| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.659 |
0.000 |
0.000 |
-0.060 |
0.000 |
0.000 |
Slide |
0.000 |
3.326 |
1.226 |
0.000 |
-0.063 |
-0.218 |
Rise |
0.000 |
1.226 |
7.576 |
0.000 |
-0.058 |
-0.173 |
Tilt |
-0.060 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.063 |
-0.058 |
0.000 |
0.022 |
0.010 |
Twist |
0.000 |
-0.218 |
-0.173 |
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 |
1.106 |
0.000 |
0.000 |
-0.082 |
0.000 |
0.000 |
Slide |
0.000 |
2.525 |
0.823 |
0.000 |
-0.081 |
-0.146 |
Rise |
0.000 |
0.823 |
8.295 |
0.000 |
-0.008 |
-0.198 |
Tilt |
-0.082 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.081 |
-0.008 |
0.000 |
0.022 |
0.012 |
Twist |
0.000 |
-0.146 |
-0.198 |
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)
| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.638 |
0.000 |
0.000 |
-0.057 |
0.000 |
0.000 |
Slide |
0.000 |
3.465 |
1.053 |
0.000 |
-0.065 |
-0.219 |
Rise |
0.000 |
1.053 |
7.940 |
0.000 |
-0.052 |
-0.176 |
Tilt |
-0.057 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
-0.065 |
-0.052 |
0.000 |
0.022 |
0.010 |
Twist |
0.000 |
-0.219 |
-0.176 |
0.000 |
0.010 |
0.041 |
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 |
1.259 |
0.000 |
0.000 |
-0.085 |
0.000 |
0.000 |
Slide |
0.000 |
2.463 |
0.954 |
0.000 |
-0.076 |
-0.149 |
Rise |
0.000 |
0.954 |
7.644 |
0.000 |
-0.003 |
-0.186 |
Tilt |
-0.085 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.076 |
-0.003 |
0.000 |
0.022 |
0.012 |
Twist |
0.000 |
-0.149 |
-0.186 |
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 |
1.690 |
0.000 |
0.000 |
-0.066 |
0.000 |
0.000 |
Slide |
0.000 |
3.486 |
1.236 |
0.000 |
-0.072 |
-0.231 |
Rise |
0.000 |
1.236 |
7.629 |
0.000 |
-0.067 |
-0.181 |
Tilt |
-0.066 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.072 |
-0.067 |
0.000 |
0.022 |
0.010 |
Twist |
0.000 |
-0.231 |
-0.181 |
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 |
1.118 |
0.000 |
0.000 |
-0.084 |
0.000 |
0.000 |
Slide |
0.000 |
2.533 |
0.775 |
0.000 |
-0.080 |
-0.156 |
Rise |
0.000 |
0.775 |
7.709 |
0.000 |
-0.008 |
-0.192 |
Tilt |
-0.084 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.080 |
-0.008 |
0.000 |
0.021 |
0.012 |
Twist |
0.000 |
-0.156 |
-0.192 |
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 |
0.903 |
0.000 |
0.000 |
-0.036 |
0.000 |
0.000 |
Slide |
0.000 |
3.388 |
2.559 |
0.000 |
0.047 |
-0.146 |
Rise |
0.000 |
2.559 |
9.696 |
0.000 |
0.084 |
-0.207 |
Tilt |
-0.036 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
0.047 |
0.084 |
0.000 |
0.023 |
0.009 |
Twist |
0.000 |
-0.146 |
-0.207 |
0.000 |
0.009 |
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 |
1.421 |
0.000 |
0.000 |
-0.060 |
0.000 |
0.000 |
Slide |
0.000 |
3.238 |
2.195 |
0.000 |
0.028 |
-0.131 |
Rise |
0.000 |
2.195 |
9.358 |
0.000 |
0.058 |
-0.211 |
Tilt |
-0.060 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
0.028 |
0.058 |
0.000 |
0.025 |
0.010 |
Twist |
0.000 |
-0.131 |
-0.211 |
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 |
0.825 |
0.000 |
0.000 |
-0.023 |
0.000 |
0.000 |
Slide |
0.000 |
2.792 |
2.241 |
0.000 |
0.035 |
-0.064 |
Rise |
0.000 |
2.241 |
9.190 |
0.000 |
0.082 |
-0.180 |
Tilt |
-0.023 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
0.035 |
0.082 |
0.000 |
0.021 |
0.008 |
Twist |
0.000 |
-0.064 |
-0.180 |
0.000 |
0.008 |
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 |
0.902 |
0.000 |
0.000 |
-0.031 |
0.000 |
0.000 |
Slide |
0.000 |
3.262 |
2.308 |
0.000 |
0.043 |
-0.151 |
Rise |
0.000 |
2.308 |
9.556 |
0.000 |
0.080 |
-0.185 |
Tilt |
-0.031 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
0.043 |
0.080 |
0.000 |
0.023 |
0.010 |
Twist |
0.000 |
-0.151 |
-0.185 |
0.000 |
0.010 |
0.045 |
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 |
1.279 |
0.000 |
0.000 |
-0.018 |
0.000 |
0.000 |
Slide |
0.000 |
1.747 |
1.212 |
0.000 |
-0.006 |
-0.038 |
Rise |
0.000 |
1.212 |
6.388 |
0.000 |
-0.122 |
-0.230 |
Tilt |
-0.018 |
0.000 |
0.000 |
0.023 |
0.000 |
0.000 |
Roll |
0.000 |
-0.006 |
-0.122 |
0.000 |
0.021 |
0.009 |
Twist |
0.000 |
-0.038 |
-0.230 |
0.000 |
0.009 |
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 |
0.260 |
0.000 |
0.000 |
0.009 |
0.000 |
0.000 |
Slide |
0.000 |
0.594 |
-0.125 |
0.000 |
-0.000 |
0.012 |
Rise |
0.000 |
-0.125 |
1.787 |
0.000 |
-0.028 |
-0.036 |
Tilt |
0.009 |
0.000 |
0.000 |
0.009 |
0.000 |
0.000 |
Roll |
0.000 |
-0.000 |
-0.028 |
0.000 |
0.004 |
0.000 |
Twist |
0.000 |
0.012 |
-0.036 |
0.000 |
0.000 |
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 |
1.174 |
0.000 |
0.000 |
-0.026 |
0.000 |
0.000 |
Slide |
0.000 |
1.650 |
1.163 |
0.000 |
-0.003 |
-0.047 |
Rise |
0.000 |
1.163 |
5.968 |
0.000 |
-0.112 |
-0.215 |
Tilt |
-0.026 |
0.000 |
0.000 |
0.022 |
0.000 |
0.000 |
Roll |
0.000 |
-0.003 |
-0.112 |
0.000 |
0.019 |
0.009 |
Twist |
0.000 |
-0.047 |
-0.215 |
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 |
1.257 |
0.000 |
0.000 |
-0.012 |
0.000 |
0.000 |
Slide |
0.000 |
1.787 |
1.285 |
0.000 |
-0.004 |
-0.039 |
Rise |
0.000 |
1.285 |
6.680 |
0.000 |
-0.132 |
-0.240 |
Tilt |
-0.012 |
0.000 |
0.000 |
0.023 |
0.000 |
0.000 |
Roll |
0.000 |
-0.004 |
-0.132 |
0.000 |
0.022 |
0.010 |
Twist |
0.000 |
-0.039 |
-0.240 |
0.000 |
0.010 |
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 |
0.476 |
0.000 |
0.000 |
-0.018 |
0.000 |
0.000 |
Slide |
0.000 |
1.001 |
0.161 |
0.000 |
-0.002 |
0.006 |
Rise |
0.000 |
0.161 |
3.749 |
0.000 |
-0.054 |
-0.082 |
Tilt |
-0.018 |
0.000 |
0.000 |
0.016 |
0.000 |
0.000 |
Roll |
0.000 |
-0.002 |
-0.054 |
0.000 |
0.008 |
0.001 |
Twist |
0.000 |
0.006 |
-0.082 |
0.000 |
0.001 |
0.007 |
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)