| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.995 |
0.000 |
0.000 |
-0.100 |
0.000 |
0.000 |
Slide |
0.000 |
3.620 |
0.899 |
0.000 |
-0.048 |
-0.275 |
Rise |
0.000 |
0.899 |
8.422 |
0.000 |
0.010 |
-0.174 |
Tilt |
-0.100 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.048 |
0.010 |
0.000 |
0.022 |
0.009 |
Twist |
0.000 |
-0.275 |
-0.174 |
0.000 |
0.009 |
0.051 |
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 |
1.063 |
0.000 |
0.000 |
-0.094 |
0.000 |
0.000 |
Slide |
0.000 |
3.400 |
1.118 |
0.000 |
-0.058 |
-0.275 |
Rise |
0.000 |
1.118 |
8.251 |
0.000 |
-0.013 |
-0.183 |
Tilt |
-0.094 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.058 |
-0.013 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.275 |
-0.183 |
0.000 |
0.011 |
0.050 |
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 |
0.951 |
0.000 |
0.000 |
-0.098 |
0.000 |
0.000 |
Slide |
0.000 |
3.686 |
1.013 |
0.000 |
-0.033 |
-0.285 |
Rise |
0.000 |
1.013 |
8.040 |
0.000 |
0.012 |
-0.164 |
Tilt |
-0.098 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.033 |
0.012 |
0.000 |
0.020 |
0.008 |
Twist |
0.000 |
-0.285 |
-0.164 |
0.000 |
0.008 |
0.053 |
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 |
2.043 |
0.000 |
0.000 |
-0.001 |
0.000 |
0.000 |
Slide |
0.000 |
5.139 |
2.403 |
0.000 |
-0.047 |
-0.200 |
Rise |
0.000 |
2.403 |
9.129 |
0.000 |
0.020 |
-0.158 |
Tilt |
-0.001 |
0.000 |
0.000 |
0.046 |
0.000 |
0.000 |
Roll |
0.000 |
-0.047 |
0.020 |
0.000 |
0.033 |
0.009 |
Twist |
0.000 |
-0.200 |
-0.158 |
0.000 |
0.009 |
0.061 |
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 |
1.474 |
0.000 |
0.000 |
-0.017 |
0.000 |
0.000 |
Slide |
0.000 |
4.669 |
2.543 |
0.000 |
-0.017 |
-0.206 |
Rise |
0.000 |
2.543 |
9.387 |
0.000 |
0.044 |
-0.193 |
Tilt |
-0.017 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
-0.017 |
0.044 |
0.000 |
0.030 |
0.011 |
Twist |
0.000 |
-0.206 |
-0.193 |
0.000 |
0.011 |
0.056 |
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 |
1.562 |
0.000 |
0.000 |
-0.003 |
0.000 |
0.000 |
Slide |
0.000 |
4.680 |
2.780 |
0.000 |
-0.057 |
-0.135 |
Rise |
0.000 |
2.780 |
9.532 |
0.000 |
0.042 |
-0.166 |
Tilt |
-0.003 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
-0.057 |
0.042 |
0.000 |
0.032 |
0.013 |
Twist |
0.000 |
-0.135 |
-0.166 |
0.000 |
0.013 |
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 |
2.006 |
0.000 |
0.000 |
-0.011 |
0.000 |
0.000 |
Slide |
0.000 |
5.244 |
2.105 |
0.000 |
-0.050 |
-0.213 |
Rise |
0.000 |
2.105 |
9.054 |
0.000 |
0.011 |
-0.162 |
Tilt |
-0.011 |
0.000 |
0.000 |
0.047 |
0.000 |
0.000 |
Roll |
0.000 |
-0.050 |
0.011 |
0.000 |
0.034 |
0.011 |
Twist |
0.000 |
-0.213 |
-0.162 |
0.000 |
0.011 |
0.064 |
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 |
1.498 |
0.000 |
0.000 |
-0.027 |
0.000 |
0.000 |
Slide |
0.000 |
2.049 |
0.863 |
0.000 |
0.010 |
-0.021 |
Rise |
0.000 |
0.863 |
7.195 |
0.000 |
-0.171 |
-0.237 |
Tilt |
-0.027 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
0.010 |
-0.171 |
0.000 |
0.025 |
0.010 |
Twist |
0.000 |
-0.021 |
-0.237 |
0.000 |
0.010 |
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 |
0.418 |
0.000 |
0.000 |
0.012 |
0.000 |
0.000 |
Slide |
0.000 |
1.442 |
0.616 |
0.000 |
-0.005 |
-0.051 |
Rise |
0.000 |
0.616 |
3.711 |
0.000 |
-0.050 |
-0.094 |
Tilt |
0.012 |
0.000 |
0.000 |
0.015 |
0.000 |
0.000 |
Roll |
0.000 |
-0.005 |
-0.050 |
0.000 |
0.006 |
0.000 |
Twist |
0.000 |
-0.051 |
-0.094 |
0.000 |
0.000 |
0.015 |
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 |
1.639 |
0.000 |
0.000 |
-0.031 |
0.000 |
0.000 |
Slide |
0.000 |
1.924 |
0.749 |
0.000 |
0.006 |
-0.016 |
Rise |
0.000 |
0.749 |
7.100 |
0.000 |
-0.162 |
-0.229 |
Tilt |
-0.031 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
0.006 |
-0.162 |
0.000 |
0.025 |
0.010 |
Twist |
0.000 |
-0.016 |
-0.229 |
0.000 |
0.010 |
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 |
1.651 |
0.000 |
0.000 |
-0.031 |
0.000 |
0.000 |
Slide |
0.000 |
2.068 |
0.916 |
0.000 |
-0.000 |
-0.029 |
Rise |
0.000 |
0.916 |
7.526 |
0.000 |
-0.169 |
-0.247 |
Tilt |
-0.031 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.000 |
-0.169 |
0.000 |
0.026 |
0.011 |
Twist |
0.000 |
-0.029 |
-0.247 |
0.000 |
0.011 |
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 |
0.986 |
0.000 |
0.000 |
-0.084 |
0.000 |
0.000 |
Slide |
0.000 |
2.341 |
1.149 |
0.000 |
-0.037 |
-0.191 |
Rise |
0.000 |
1.149 |
7.748 |
0.000 |
-0.032 |
-0.148 |
Tilt |
-0.084 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.037 |
-0.032 |
0.000 |
0.022 |
0.011 |
Twist |
0.000 |
-0.191 |
-0.148 |
0.000 |
0.011 |
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 |
1.086 |
0.000 |
0.000 |
-0.088 |
0.000 |
0.000 |
Slide |
0.000 |
2.443 |
1.352 |
0.000 |
-0.043 |
-0.218 |
Rise |
0.000 |
1.352 |
7.705 |
0.000 |
-0.041 |
-0.173 |
Tilt |
-0.088 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.043 |
-0.041 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.218 |
-0.173 |
0.000 |
0.011 |
0.046 |
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 |
-0.084 |
0.000 |
0.000 |
Slide |
0.000 |
2.643 |
1.093 |
0.000 |
-0.041 |
-0.226 |
Rise |
0.000 |
1.093 |
7.872 |
0.000 |
-0.029 |
-0.139 |
Tilt |
-0.084 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.041 |
-0.029 |
0.000 |
0.022 |
0.011 |
Twist |
0.000 |
-0.226 |
-0.139 |
0.000 |
0.011 |
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 |
0.614 |
0.000 |
0.000 |
-0.004 |
0.000 |
0.000 |
Slide |
0.000 |
1.343 |
0.720 |
0.000 |
0.004 |
-0.054 |
Rise |
0.000 |
0.720 |
3.831 |
0.000 |
-0.044 |
-0.124 |
Tilt |
-0.004 |
0.000 |
0.000 |
0.018 |
0.000 |
0.000 |
Roll |
0.000 |
0.004 |
-0.044 |
0.000 |
0.009 |
0.001 |
Twist |
0.000 |
-0.054 |
-0.124 |
0.000 |
0.001 |
0.012 |
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)