| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.140 |
0.000 |
0.000 |
0.013 |
0.000 |
0.000 |
Slide |
0.000 |
0.608 |
0.085 |
0.000 |
-0.010 |
-0.019 |
Rise |
0.000 |
0.084 |
2.189 |
0.000 |
-0.026 |
-0.091 |
Tilt |
0.013 |
0.000 |
0.000 |
0.007 |
0.000 |
0.000 |
Roll |
0.000 |
-0.010 |
-0.026 |
0.000 |
0.003 |
-0.000 |
Twist |
0.000 |
-0.019 |
-0.091 |
0.000 |
-0.000 |
0.009 |
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 |
0.163 |
0.000 |
0.000 |
0.015 |
0.000 |
0.000 |
Slide |
0.000 |
0.610 |
-0.184 |
0.000 |
-0.009 |
0.004 |
Rise |
0.000 |
-0.184 |
1.645 |
0.000 |
-0.031 |
-0.024 |
Tilt |
0.015 |
0.000 |
0.000 |
0.007 |
0.000 |
0.000 |
Roll |
0.000 |
-0.009 |
-0.031 |
0.000 |
0.003 |
0.000 |
Twist |
0.000 |
0.004 |
-0.024 |
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 |
1.081 |
0.000 |
0.000 |
-0.112 |
0.000 |
0.000 |
Slide |
0.000 |
2.726 |
1.438 |
0.000 |
-0.033 |
-0.165 |
Rise |
0.000 |
1.438 |
8.255 |
0.000 |
-0.004 |
-0.186 |
Tilt |
-0.112 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.034 |
-0.004 |
0.000 |
0.019 |
0.008 |
Twist |
0.000 |
-0.165 |
-0.186 |
0.000 |
0.008 |
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 |
1.045 |
0.000 |
0.000 |
-0.113 |
0.000 |
0.000 |
Slide |
0.000 |
2.523 |
1.540 |
0.000 |
-0.037 |
-0.138 |
Rise |
0.000 |
1.540 |
8.971 |
0.000 |
-0.008 |
-0.210 |
Tilt |
-0.113 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.037 |
-0.008 |
0.000 |
0.019 |
0.008 |
Twist |
0.000 |
-0.138 |
-0.210 |
0.000 |
0.008 |
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 |
1.056 |
0.000 |
0.000 |
-0.110 |
0.000 |
0.000 |
Slide |
0.000 |
2.896 |
1.463 |
0.000 |
-0.035 |
-0.190 |
Rise |
0.000 |
1.463 |
8.712 |
0.000 |
0.020 |
-0.180 |
Tilt |
-0.110 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.035 |
0.020 |
0.000 |
0.020 |
0.007 |
Twist |
0.000 |
-0.190 |
-0.180 |
0.000 |
0.007 |
0.033 |
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 |
2.322 |
0.000 |
0.000 |
-0.116 |
0.000 |
0.000 |
Slide |
0.000 |
3.894 |
2.902 |
0.000 |
0.034 |
-0.173 |
Rise |
0.000 |
2.902 |
11.003 |
0.000 |
0.114 |
-0.203 |
Tilt |
-0.116 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
0.034 |
0.114 |
0.000 |
0.030 |
0.008 |
Twist |
0.000 |
-0.173 |
-0.203 |
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 |
1.615 |
0.000 |
0.000 |
-0.118 |
0.000 |
0.000 |
Slide |
0.000 |
3.275 |
2.675 |
0.000 |
0.053 |
-0.121 |
Rise |
0.000 |
2.675 |
10.571 |
0.000 |
0.123 |
-0.211 |
Tilt |
-0.118 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
0.053 |
0.123 |
0.000 |
0.026 |
0.006 |
Twist |
0.000 |
-0.121 |
-0.211 |
0.000 |
0.006 |
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 |
1.754 |
0.000 |
0.000 |
-0.120 |
0.000 |
0.000 |
Slide |
0.000 |
2.439 |
1.988 |
0.000 |
0.046 |
-0.101 |
Rise |
0.000 |
1.988 |
10.364 |
0.000 |
0.126 |
-0.188 |
Tilt |
-0.120 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
0.046 |
0.126 |
0.000 |
0.026 |
0.007 |
Twist |
0.000 |
-0.101 |
-0.188 |
0.000 |
0.007 |
0.035 |
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 |
2.236 |
0.000 |
0.000 |
-0.110 |
0.000 |
0.000 |
Slide |
0.000 |
3.926 |
2.937 |
0.000 |
0.025 |
-0.173 |
Rise |
0.000 |
2.937 |
10.592 |
0.000 |
0.116 |
-0.209 |
Tilt |
-0.110 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
0.025 |
0.116 |
0.000 |
0.029 |
0.007 |
Twist |
0.000 |
-0.173 |
-0.209 |
0.000 |
0.007 |
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 |
0.974 |
0.000 |
0.000 |
-0.106 |
0.000 |
0.000 |
Slide |
0.000 |
2.266 |
1.645 |
0.000 |
0.004 |
-0.181 |
Rise |
0.000 |
1.645 |
8.615 |
0.000 |
-0.010 |
-0.169 |
Tilt |
-0.106 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
Roll |
0.000 |
0.004 |
-0.010 |
0.000 |
0.023 |
0.007 |
Twist |
0.000 |
-0.181 |
-0.169 |
0.000 |
0.007 |
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 |
0.982 |
0.000 |
0.000 |
-0.119 |
0.000 |
0.000 |
Slide |
0.000 |
1.782 |
1.640 |
0.000 |
-0.027 |
-0.126 |
Rise |
0.000 |
1.640 |
8.382 |
0.000 |
-0.029 |
-0.203 |
Tilt |
-0.119 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
-0.027 |
-0.029 |
0.000 |
0.022 |
0.011 |
Twist |
0.000 |
-0.126 |
-0.203 |
0.000 |
0.011 |
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 |
1.018 |
0.000 |
0.000 |
-0.110 |
0.000 |
0.000 |
Slide |
0.000 |
2.067 |
1.741 |
0.000 |
0.004 |
-0.174 |
Rise |
0.000 |
1.742 |
8.618 |
0.000 |
-0.012 |
-0.184 |
Tilt |
-0.110 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
0.004 |
-0.012 |
0.000 |
0.022 |
0.007 |
Twist |
0.000 |
-0.174 |
-0.184 |
0.000 |
0.007 |
0.036 |
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 |
1.172 |
0.000 |
0.000 |
-0.029 |
0.000 |
0.000 |
Slide |
0.000 |
2.122 |
0.579 |
0.000 |
0.020 |
-0.058 |
Rise |
0.000 |
0.579 |
8.645 |
0.000 |
-0.172 |
-0.277 |
Tilt |
-0.029 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
0.020 |
-0.172 |
0.000 |
0.025 |
0.011 |
Twist |
0.000 |
-0.058 |
-0.277 |
0.000 |
0.011 |
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 |
1.186 |
0.000 |
0.000 |
-0.032 |
0.000 |
0.000 |
Slide |
0.000 |
2.247 |
0.477 |
0.000 |
0.023 |
-0.043 |
Rise |
0.000 |
0.477 |
8.394 |
0.000 |
-0.155 |
-0.256 |
Tilt |
-0.032 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
0.023 |
-0.155 |
0.000 |
0.024 |
0.009 |
Twist |
0.000 |
-0.043 |
-0.256 |
0.000 |
0.009 |
0.018 |
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 |
1.342 |
0.000 |
0.000 |
-0.014 |
0.000 |
0.000 |
Slide |
0.000 |
2.516 |
0.191 |
0.000 |
0.020 |
-0.039 |
Rise |
0.000 |
0.191 |
9.231 |
0.000 |
-0.193 |
-0.268 |
Tilt |
-0.014 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
0.020 |
-0.193 |
0.000 |
0.026 |
0.011 |
Twist |
0.000 |
-0.039 |
-0.268 |
0.000 |
0.011 |
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)