| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.961 |
0.000 |
0.000 |
-0.082 |
0.000 |
0.000 |
Slide |
0.000 |
2.953 |
0.754 |
0.000 |
-0.054 |
-0.230 |
Rise |
0.000 |
0.754 |
7.968 |
0.000 |
-0.016 |
-0.155 |
Tilt |
-0.082 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.054 |
-0.016 |
0.000 |
0.020 |
0.010 |
Twist |
0.000 |
-0.230 |
-0.155 |
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 |
0.996 |
0.000 |
0.000 |
-0.079 |
0.000 |
0.000 |
Slide |
0.000 |
2.827 |
1.025 |
0.000 |
-0.059 |
-0.233 |
Rise |
0.000 |
1.025 |
8.297 |
0.000 |
-0.015 |
-0.189 |
Tilt |
-0.079 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.059 |
-0.015 |
0.000 |
0.021 |
0.010 |
Twist |
0.000 |
-0.233 |
-0.189 |
0.000 |
0.010 |
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 |
0.952 |
0.000 |
0.000 |
-0.079 |
0.000 |
0.000 |
Slide |
0.000 |
2.933 |
0.819 |
0.000 |
-0.056 |
-0.227 |
Rise |
0.000 |
0.819 |
8.368 |
0.000 |
-0.009 |
-0.169 |
Tilt |
-0.079 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.056 |
-0.009 |
0.000 |
0.021 |
0.010 |
Twist |
0.000 |
-0.227 |
-0.169 |
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 |
1.943 |
0.000 |
0.000 |
-0.004 |
0.000 |
0.000 |
Slide |
0.000 |
5.371 |
2.697 |
0.000 |
-0.022 |
-0.252 |
Rise |
0.000 |
2.697 |
9.708 |
0.000 |
0.013 |
-0.189 |
Tilt |
-0.004 |
0.000 |
0.000 |
0.046 |
0.000 |
0.000 |
Roll |
0.000 |
-0.022 |
0.013 |
0.000 |
0.035 |
0.009 |
Twist |
0.000 |
-0.252 |
-0.189 |
0.000 |
0.009 |
0.070 |
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 |
1.594 |
0.000 |
0.000 |
-0.003 |
0.000 |
0.000 |
Slide |
0.000 |
4.785 |
2.780 |
0.000 |
-0.030 |
-0.188 |
Rise |
0.000 |
2.780 |
9.547 |
0.000 |
0.045 |
-0.176 |
Tilt |
-0.003 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
-0.030 |
0.045 |
0.000 |
0.029 |
0.011 |
Twist |
0.000 |
-0.188 |
-0.176 |
0.000 |
0.011 |
0.057 |
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 |
1.500 |
0.000 |
0.000 |
0.000 |
0.000 |
0.000 |
Slide |
0.000 |
4.650 |
2.658 |
0.000 |
-0.032 |
-0.172 |
Rise |
0.000 |
2.658 |
9.570 |
0.000 |
0.031 |
-0.174 |
Tilt |
0.000 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
-0.032 |
0.031 |
0.000 |
0.029 |
0.012 |
Twist |
0.000 |
-0.172 |
-0.174 |
0.000 |
0.012 |
0.054 |
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 |
1.919 |
0.000 |
0.000 |
0.003 |
0.000 |
0.000 |
Slide |
0.000 |
4.824 |
2.432 |
0.000 |
-0.021 |
-0.217 |
Rise |
0.000 |
2.432 |
9.731 |
0.000 |
0.020 |
-0.154 |
Tilt |
0.003 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
-0.021 |
0.020 |
0.000 |
0.033 |
0.009 |
Twist |
0.000 |
-0.217 |
-0.154 |
0.000 |
0.009 |
0.067 |
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 |
0.826 |
0.000 |
0.000 |
-0.046 |
0.000 |
0.000 |
Slide |
0.000 |
1.493 |
0.958 |
0.000 |
0.021 |
-0.044 |
Rise |
0.000 |
0.958 |
5.191 |
0.000 |
-0.049 |
-0.139 |
Tilt |
-0.046 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.021 |
-0.049 |
0.000 |
0.013 |
0.004 |
Twist |
0.000 |
-0.044 |
-0.139 |
0.000 |
0.004 |
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 |
0.908 |
0.000 |
0.000 |
-0.021 |
0.000 |
0.000 |
Slide |
0.000 |
1.291 |
0.901 |
0.000 |
0.011 |
-0.020 |
Rise |
0.000 |
0.901 |
6.640 |
0.000 |
-0.116 |
-0.206 |
Tilt |
-0.021 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.011 |
-0.116 |
0.000 |
0.019 |
0.011 |
Twist |
0.000 |
-0.020 |
-0.206 |
0.000 |
0.011 |
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 |
0.903 |
0.000 |
0.000 |
-0.020 |
0.000 |
0.000 |
Slide |
0.000 |
1.268 |
0.952 |
0.000 |
0.005 |
-0.026 |
Rise |
0.000 |
0.952 |
6.446 |
0.000 |
-0.123 |
-0.208 |
Tilt |
-0.020 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.005 |
-0.123 |
0.000 |
0.020 |
0.012 |
Twist |
0.000 |
-0.026 |
-0.208 |
0.000 |
0.012 |
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 |
0.924 |
0.000 |
0.000 |
-0.018 |
0.000 |
0.000 |
Slide |
0.000 |
0.993 |
0.707 |
0.000 |
0.013 |
-0.006 |
Rise |
0.000 |
0.707 |
6.543 |
0.000 |
-0.111 |
-0.185 |
Tilt |
-0.018 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.013 |
-0.111 |
0.000 |
0.020 |
0.011 |
Twist |
0.000 |
-0.006 |
-0.185 |
0.000 |
0.011 |
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 |
1.152 |
0.000 |
0.000 |
-0.049 |
0.000 |
0.000 |
Slide |
0.000 |
2.122 |
1.396 |
0.000 |
-0.009 |
-0.092 |
Rise |
0.000 |
1.396 |
5.676 |
0.000 |
-0.074 |
-0.176 |
Tilt |
-0.049 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.009 |
-0.074 |
0.000 |
0.018 |
0.009 |
Twist |
0.000 |
-0.092 |
-0.176 |
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 |
0.989 |
0.000 |
0.000 |
-0.088 |
0.000 |
0.000 |
Slide |
0.000 |
2.927 |
1.000 |
0.000 |
-0.054 |
-0.237 |
Rise |
0.000 |
1.000 |
8.315 |
0.000 |
-0.015 |
-0.189 |
Tilt |
-0.088 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.054 |
-0.015 |
0.000 |
0.020 |
0.010 |
Twist |
0.000 |
-0.237 |
-0.189 |
0.000 |
0.010 |
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 |
1.008 |
0.000 |
0.000 |
-0.078 |
0.000 |
0.000 |
Slide |
0.000 |
2.569 |
0.951 |
0.000 |
-0.060 |
-0.197 |
Rise |
0.000 |
0.951 |
7.974 |
0.000 |
-0.017 |
-0.166 |
Tilt |
-0.078 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.060 |
-0.017 |
0.000 |
0.020 |
0.010 |
Twist |
0.000 |
-0.197 |
-0.166 |
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 |
0.958 |
0.000 |
0.000 |
-0.080 |
0.000 |
0.000 |
Slide |
0.000 |
2.825 |
0.772 |
0.000 |
-0.051 |
-0.221 |
Rise |
0.000 |
0.772 |
8.245 |
0.000 |
-0.006 |
-0.162 |
Tilt |
-0.080 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.051 |
-0.006 |
0.000 |
0.021 |
0.009 |
Twist |
0.000 |
-0.221 |
-0.162 |
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)