| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.065 |
0.000 |
0.000 |
-0.027 |
0.000 |
0.000 |
Slide |
0.000 |
1.628 |
0.653 |
0.000 |
-0.063 |
-0.016 |
Rise |
0.000 |
0.653 |
3.735 |
0.000 |
-0.028 |
-0.087 |
Tilt |
-0.027 |
0.000 |
0.000 |
0.018 |
0.000 |
0.000 |
Roll |
0.000 |
-0.063 |
-0.028 |
0.000 |
0.020 |
0.004 |
Twist |
0.000 |
-0.016 |
-0.087 |
0.000 |
0.004 |
0.014 |
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 |
1.293 |
0.000 |
0.000 |
0.022 |
0.000 |
0.000 |
Slide |
0.000 |
4.000 |
2.762 |
0.000 |
-0.025 |
-0.124 |
Rise |
0.000 |
2.762 |
10.241 |
0.000 |
0.074 |
-0.179 |
Tilt |
0.022 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
-0.025 |
0.073 |
0.000 |
0.026 |
0.013 |
Twist |
0.000 |
-0.124 |
-0.179 |
0.000 |
0.013 |
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 |
1.102 |
0.000 |
0.000 |
-0.016 |
0.000 |
0.000 |
Slide |
0.000 |
4.577 |
2.408 |
0.000 |
-0.034 |
-0.112 |
Rise |
0.000 |
2.408 |
9.938 |
0.000 |
0.053 |
-0.157 |
Tilt |
-0.016 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
-0.034 |
0.053 |
0.000 |
0.027 |
0.012 |
Twist |
0.000 |
-0.112 |
-0.157 |
0.000 |
0.012 |
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 |
1.264 |
0.000 |
0.000 |
0.024 |
0.000 |
0.000 |
Slide |
0.000 |
4.232 |
2.867 |
0.000 |
-0.040 |
-0.110 |
Rise |
0.000 |
2.867 |
10.460 |
0.000 |
0.075 |
-0.161 |
Tilt |
0.024 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
-0.040 |
0.075 |
0.000 |
0.027 |
0.014 |
Twist |
0.000 |
-0.110 |
-0.161 |
0.000 |
0.014 |
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 |
0.944 |
0.000 |
0.000 |
-0.008 |
0.000 |
0.000 |
Slide |
0.000 |
1.080 |
-0.400 |
0.000 |
0.033 |
0.046 |
Rise |
0.000 |
-0.401 |
4.566 |
0.000 |
0.008 |
-0.020 |
Tilt |
-0.008 |
0.000 |
0.000 |
0.016 |
0.000 |
0.000 |
Roll |
0.000 |
0.033 |
0.008 |
0.000 |
0.017 |
-0.001 |
Twist |
0.000 |
0.046 |
-0.020 |
0.000 |
-0.001 |
0.003 |
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 |
-0.047 |
0.000 |
0.000 |
Slide |
0.000 |
2.313 |
1.515 |
0.000 |
-0.032 |
-0.186 |
Rise |
0.000 |
1.515 |
6.932 |
0.000 |
-0.033 |
-0.169 |
Tilt |
-0.047 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.032 |
-0.033 |
0.000 |
0.020 |
0.011 |
Twist |
0.000 |
-0.186 |
-0.169 |
0.000 |
0.011 |
0.038 |
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 |
1.251 |
0.000 |
0.000 |
-0.058 |
0.000 |
0.000 |
Slide |
0.000 |
1.923 |
1.174 |
0.000 |
-0.036 |
-0.127 |
Rise |
0.000 |
1.174 |
7.251 |
0.000 |
-0.035 |
-0.154 |
Tilt |
-0.058 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.036 |
-0.035 |
0.000 |
0.022 |
0.011 |
Twist |
0.000 |
-0.127 |
-0.154 |
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 |
1.144 |
0.000 |
0.000 |
-0.135 |
0.000 |
0.000 |
Slide |
0.000 |
0.734 |
0.885 |
0.000 |
-0.007 |
0.000 |
Rise |
0.000 |
0.885 |
6.621 |
0.000 |
-0.039 |
-0.151 |
Tilt |
-0.135 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
-0.007 |
-0.039 |
0.000 |
0.022 |
0.007 |
Twist |
0.000 |
0.000 |
-0.151 |
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 |
1.322 |
0.000 |
0.000 |
-0.046 |
0.000 |
0.000 |
Slide |
0.000 |
2.192 |
1.563 |
0.000 |
-0.041 |
-0.180 |
Rise |
0.000 |
1.563 |
7.244 |
0.000 |
-0.042 |
-0.183 |
Tilt |
-0.046 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.041 |
-0.042 |
0.000 |
0.020 |
0.011 |
Twist |
0.000 |
-0.180 |
-0.183 |
0.000 |
0.011 |
0.037 |
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 |
1.078 |
0.000 |
0.000 |
-0.078 |
0.000 |
0.000 |
Slide |
0.000 |
1.455 |
1.609 |
0.000 |
-0.023 |
-0.098 |
Rise |
0.000 |
1.609 |
7.074 |
0.000 |
-0.043 |
-0.166 |
Tilt |
-0.078 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.023 |
-0.043 |
0.000 |
0.022 |
0.009 |
Twist |
0.000 |
-0.098 |
-0.166 |
0.000 |
0.009 |
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 |
0.907 |
0.000 |
0.000 |
-0.079 |
0.000 |
0.000 |
Slide |
0.000 |
1.399 |
1.571 |
0.000 |
-0.019 |
-0.087 |
Rise |
0.000 |
1.572 |
7.618 |
0.000 |
-0.045 |
-0.196 |
Tilt |
-0.079 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
-0.019 |
-0.045 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.087 |
-0.196 |
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 |
1.268 |
0.000 |
0.000 |
-0.083 |
0.000 |
0.000 |
Slide |
0.000 |
1.426 |
1.629 |
0.000 |
-0.021 |
-0.092 |
Rise |
0.000 |
1.629 |
6.631 |
0.000 |
-0.048 |
-0.172 |
Tilt |
-0.083 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.021 |
-0.048 |
0.000 |
0.023 |
0.008 |
Twist |
0.000 |
-0.092 |
-0.172 |
0.000 |
0.008 |
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 |
0.901 |
0.000 |
0.000 |
-0.037 |
0.000 |
0.000 |
Slide |
0.000 |
1.850 |
0.846 |
0.000 |
0.008 |
-0.065 |
Rise |
0.000 |
0.845 |
7.288 |
0.000 |
-0.113 |
-0.222 |
Tilt |
-0.037 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.008 |
-0.113 |
0.000 |
0.019 |
0.009 |
Twist |
0.000 |
-0.065 |
-0.222 |
0.000 |
0.009 |
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 |
0.982 |
0.000 |
0.000 |
-0.054 |
0.000 |
0.000 |
Slide |
0.000 |
1.805 |
1.148 |
0.000 |
-0.003 |
-0.074 |
Rise |
0.000 |
1.148 |
6.491 |
0.000 |
-0.072 |
-0.193 |
Tilt |
-0.054 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.003 |
-0.072 |
0.000 |
0.018 |
0.009 |
Twist |
0.000 |
-0.074 |
-0.193 |
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 |
0.947 |
0.000 |
0.000 |
-0.042 |
0.000 |
0.000 |
Slide |
0.000 |
1.984 |
0.996 |
0.000 |
0.006 |
-0.071 |
Rise |
0.000 |
0.996 |
6.849 |
0.000 |
-0.102 |
-0.208 |
Tilt |
-0.042 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.006 |
-0.102 |
0.000 |
0.019 |
0.009 |
Twist |
0.000 |
-0.071 |
-0.208 |
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)