| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.787 |
0.000 |
0.000 |
-0.095 |
0.000 |
0.000 |
Slide |
0.000 |
2.496 |
1.074 |
0.000 |
-0.056 |
-0.151 |
Rise |
0.000 |
1.074 |
8.970 |
0.000 |
-0.028 |
-0.145 |
Tilt |
-0.095 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.056 |
-0.028 |
0.000 |
0.022 |
0.008 |
Twist |
0.000 |
-0.151 |
-0.145 |
0.000 |
0.008 |
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 |
0.678 |
0.000 |
0.000 |
-0.084 |
0.000 |
0.000 |
Slide |
0.000 |
2.811 |
0.883 |
0.000 |
-0.082 |
-0.167 |
Rise |
0.000 |
0.883 |
9.905 |
0.000 |
-0.035 |
-0.178 |
Tilt |
-0.084 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.082 |
-0.035 |
0.000 |
0.023 |
0.010 |
Twist |
0.000 |
-0.167 |
-0.178 |
0.000 |
0.010 |
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 |
1.560 |
0.000 |
0.000 |
-0.065 |
0.000 |
0.000 |
Slide |
0.000 |
4.362 |
3.606 |
0.000 |
0.020 |
-0.124 |
Rise |
0.000 |
3.606 |
11.490 |
0.000 |
0.106 |
-0.197 |
Tilt |
-0.065 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
0.020 |
0.106 |
0.000 |
0.030 |
0.008 |
Twist |
0.000 |
-0.124 |
-0.197 |
0.000 |
0.008 |
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 |
1.142 |
0.000 |
0.000 |
-0.103 |
0.000 |
0.000 |
Slide |
0.000 |
1.714 |
1.762 |
0.000 |
0.002 |
-0.116 |
Rise |
0.000 |
1.762 |
7.610 |
0.000 |
-0.007 |
-0.163 |
Tilt |
-0.103 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
0.002 |
-0.007 |
0.000 |
0.019 |
0.003 |
Twist |
0.000 |
-0.116 |
-0.163 |
0.000 |
0.003 |
0.031 |
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 |
1.797 |
0.000 |
0.000 |
-0.118 |
0.000 |
0.000 |
Slide |
0.000 |
2.161 |
2.071 |
0.000 |
-0.005 |
-0.150 |
Rise |
0.000 |
2.071 |
7.906 |
0.000 |
-0.051 |
-0.174 |
Tilt |
-0.118 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
-0.005 |
-0.051 |
0.000 |
0.023 |
0.005 |
Twist |
0.000 |
-0.150 |
-0.174 |
0.000 |
0.005 |
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 |
1.288 |
0.000 |
0.000 |
-0.106 |
0.000 |
0.000 |
Slide |
0.000 |
1.728 |
1.792 |
0.000 |
-0.001 |
-0.106 |
Rise |
0.000 |
1.792 |
8.171 |
0.000 |
-0.021 |
-0.177 |
Tilt |
-0.106 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
-0.001 |
-0.021 |
0.000 |
0.022 |
0.004 |
Twist |
0.000 |
-0.106 |
-0.177 |
0.000 |
0.004 |
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 |
0.753 |
0.000 |
0.000 |
-0.045 |
0.000 |
0.000 |
Slide |
0.000 |
2.334 |
1.499 |
0.000 |
-0.050 |
-0.113 |
Rise |
0.000 |
1.499 |
9.752 |
0.000 |
-0.033 |
-0.185 |
Tilt |
-0.045 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.050 |
-0.033 |
0.000 |
0.021 |
0.006 |
Twist |
0.000 |
-0.113 |
-0.185 |
0.000 |
0.006 |
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 |
0.712 |
0.000 |
0.000 |
-0.051 |
0.000 |
0.000 |
Slide |
0.000 |
2.445 |
1.649 |
0.000 |
-0.050 |
-0.118 |
Rise |
0.000 |
1.649 |
9.828 |
0.000 |
-0.038 |
-0.200 |
Tilt |
-0.051 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.050 |
-0.038 |
0.000 |
0.019 |
0.005 |
Twist |
0.000 |
-0.118 |
-0.200 |
0.000 |
0.005 |
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 |
0.417 |
0.000 |
0.000 |
-0.054 |
0.000 |
0.000 |
Slide |
0.000 |
2.924 |
0.713 |
0.000 |
0.015 |
-0.164 |
Rise |
0.000 |
0.713 |
8.710 |
0.000 |
-0.132 |
-0.254 |
Tilt |
-0.054 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.015 |
-0.132 |
0.000 |
0.020 |
0.014 |
Twist |
0.000 |
-0.164 |
-0.254 |
0.000 |
0.014 |
0.032 |
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 |
0.404 |
0.000 |
0.000 |
-0.048 |
0.000 |
0.000 |
Slide |
0.000 |
2.642 |
0.558 |
0.000 |
0.012 |
-0.149 |
Rise |
0.000 |
0.558 |
9.075 |
0.000 |
-0.117 |
-0.221 |
Tilt |
-0.048 |
0.000 |
0.000 |
0.024 |
0.000 |
0.000 |
Roll |
0.000 |
0.012 |
-0.117 |
0.000 |
0.019 |
0.013 |
Twist |
0.000 |
-0.149 |
-0.221 |
0.000 |
0.013 |
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)