| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.390 |
0.000 |
0.000 |
-0.052 |
0.000 |
0.000 |
Slide |
0.000 |
3.197 |
1.025 |
0.000 |
-0.078 |
-0.181 |
Rise |
0.000 |
1.025 |
8.827 |
0.000 |
-0.043 |
-0.154 |
Tilt |
-0.052 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.078 |
-0.043 |
0.000 |
0.026 |
0.011 |
Twist |
0.000 |
-0.181 |
-0.154 |
0.000 |
0.011 |
0.034 |
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 |
1.677 |
0.000 |
0.000 |
-0.050 |
0.000 |
0.000 |
Slide |
0.000 |
4.547 |
3.106 |
0.000 |
0.056 |
-0.212 |
Rise |
0.000 |
3.106 |
11.075 |
0.000 |
0.087 |
-0.222 |
Tilt |
-0.050 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
0.056 |
0.087 |
0.000 |
0.028 |
0.002 |
Twist |
0.000 |
-0.212 |
-0.222 |
0.000 |
0.002 |
0.049 |
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 |
0.813 |
0.000 |
0.000 |
-0.103 |
0.000 |
0.000 |
Slide |
0.000 |
2.141 |
1.522 |
0.000 |
-0.012 |
-0.117 |
Rise |
0.000 |
1.522 |
8.960 |
0.000 |
-0.022 |
-0.191 |
Tilt |
-0.103 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
-0.012 |
-0.022 |
0.000 |
0.017 |
0.005 |
Twist |
0.000 |
-0.117 |
-0.191 |
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 |
0.887 |
0.000 |
0.000 |
-0.099 |
0.000 |
0.000 |
Slide |
0.000 |
3.247 |
0.353 |
0.000 |
0.006 |
-0.148 |
Rise |
0.000 |
0.352 |
9.671 |
0.000 |
-0.100 |
-0.283 |
Tilt |
-0.099 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
0.006 |
-0.100 |
0.000 |
0.020 |
0.008 |
Twist |
0.000 |
-0.148 |
-0.283 |
0.000 |
0.008 |
0.026 |
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 |
-0.095 |
0.000 |
0.000 |
Slide |
0.000 |
2.851 |
0.269 |
0.000 |
0.008 |
-0.107 |
Rise |
0.000 |
0.269 |
7.269 |
0.000 |
-0.149 |
-0.289 |
Tilt |
-0.095 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.008 |
-0.149 |
0.000 |
0.018 |
0.007 |
Twist |
0.000 |
-0.107 |
-0.289 |
0.000 |
0.007 |
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 |
0.702 |
0.000 |
0.000 |
-0.073 |
0.000 |
0.000 |
Slide |
0.000 |
2.920 |
0.618 |
0.000 |
-0.013 |
-0.127 |
Rise |
0.000 |
0.618 |
6.816 |
0.000 |
-0.119 |
-0.247 |
Tilt |
-0.073 |
0.000 |
0.000 |
0.021 |
0.000 |
0.000 |
Roll |
0.000 |
-0.013 |
-0.119 |
0.000 |
0.014 |
0.006 |
Twist |
0.000 |
-0.127 |
-0.247 |
0.000 |
0.006 |
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 |
1.329 |
0.000 |
0.000 |
-0.087 |
0.000 |
0.000 |
Slide |
0.000 |
2.687 |
1.907 |
0.000 |
-0.072 |
-0.123 |
Rise |
0.000 |
1.907 |
8.721 |
0.000 |
-0.039 |
-0.193 |
Tilt |
-0.087 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
-0.072 |
-0.039 |
0.000 |
0.026 |
0.007 |
Twist |
0.000 |
-0.123 |
-0.193 |
0.000 |
0.007 |
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 |
1.572 |
0.000 |
0.000 |
-0.123 |
0.000 |
0.000 |
Slide |
0.000 |
3.669 |
1.478 |
0.000 |
-0.062 |
-0.256 |
Rise |
0.000 |
1.478 |
7.682 |
0.000 |
-0.057 |
-0.155 |
Tilt |
-0.123 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.062 |
-0.057 |
0.000 |
0.026 |
0.003 |
Twist |
0.000 |
-0.256 |
-0.155 |
0.000 |
0.003 |
0.048 |
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 |
0.837 |
0.000 |
0.000 |
-0.094 |
0.000 |
0.000 |
Slide |
0.000 |
2.358 |
1.422 |
0.000 |
-0.058 |
-0.120 |
Rise |
0.000 |
1.422 |
8.389 |
0.000 |
-0.056 |
-0.179 |
Tilt |
-0.094 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.058 |
-0.056 |
0.000 |
0.024 |
0.013 |
Twist |
0.000 |
-0.120 |
-0.179 |
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)
| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
2.243 |
0.000 |
0.000 |
-0.130 |
0.000 |
0.000 |
Slide |
0.000 |
3.301 |
2.839 |
0.000 |
0.045 |
-0.138 |
Rise |
0.000 |
2.839 |
11.670 |
0.000 |
0.126 |
-0.239 |
Tilt |
-0.130 |
0.000 |
0.000 |
0.044 |
0.000 |
0.000 |
Roll |
0.000 |
0.045 |
0.126 |
0.000 |
0.029 |
0.006 |
Twist |
0.000 |
-0.138 |
-0.239 |
0.000 |
0.006 |
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 |
0.970 |
0.000 |
0.000 |
-0.122 |
0.000 |
0.000 |
Slide |
0.000 |
1.854 |
1.725 |
0.000 |
-0.021 |
-0.099 |
Rise |
0.000 |
1.725 |
9.259 |
0.000 |
-0.022 |
-0.184 |
Tilt |
-0.122 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
Roll |
0.000 |
-0.021 |
-0.022 |
0.000 |
0.023 |
0.009 |
Twist |
0.000 |
-0.099 |
-0.184 |
0.000 |
0.009 |
0.034 |
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 |
0.864 |
0.000 |
0.000 |
-0.103 |
0.000 |
0.000 |
Slide |
0.000 |
2.532 |
1.231 |
0.000 |
-0.042 |
-0.130 |
Rise |
0.000 |
1.231 |
9.408 |
0.000 |
-0.040 |
-0.205 |
Tilt |
-0.103 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.042 |
-0.040 |
0.000 |
0.022 |
0.010 |
Twist |
0.000 |
-0.130 |
-0.205 |
0.000 |
0.010 |
0.030 |
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 |
0.946 |
0.000 |
0.000 |
-0.086 |
0.000 |
0.000 |
Slide |
0.000 |
2.191 |
1.586 |
0.000 |
-0.046 |
-0.113 |
Rise |
0.000 |
1.586 |
8.565 |
0.000 |
-0.046 |
-0.164 |
Tilt |
-0.086 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
-0.046 |
-0.046 |
0.000 |
0.025 |
0.013 |
Twist |
0.000 |
-0.113 |
-0.164 |
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)
| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.468 |
0.000 |
0.000 |
-0.050 |
0.000 |
0.000 |
Slide |
0.000 |
2.920 |
0.728 |
0.000 |
-0.096 |
-0.141 |
Rise |
0.000 |
0.728 |
9.107 |
0.000 |
-0.050 |
-0.166 |
Tilt |
-0.050 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.096 |
-0.050 |
0.000 |
0.028 |
0.012 |
Twist |
0.000 |
-0.141 |
-0.166 |
0.000 |
0.012 |
0.030 |
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)