| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.193 |
0.000 |
0.000 |
-0.110 |
0.000 |
0.000 |
Slide |
0.000 |
3.790 |
0.922 |
0.000 |
-0.053 |
-0.235 |
Rise |
0.000 |
0.922 |
9.463 |
0.000 |
0.010 |
-0.195 |
Tilt |
-0.110 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.053 |
0.010 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.235 |
-0.195 |
0.000 |
0.011 |
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 |
1.175 |
0.000 |
0.000 |
-0.095 |
0.000 |
0.000 |
Slide |
0.000 |
3.095 |
0.585 |
0.000 |
-0.058 |
-0.180 |
Rise |
0.000 |
0.585 |
9.747 |
0.000 |
0.016 |
-0.172 |
Tilt |
-0.095 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.058 |
0.016 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.180 |
-0.172 |
0.000 |
0.011 |
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 |
1.250 |
0.000 |
0.000 |
-0.104 |
0.000 |
0.000 |
Slide |
0.000 |
3.424 |
0.906 |
0.000 |
-0.056 |
-0.230 |
Rise |
0.000 |
0.906 |
9.330 |
0.000 |
0.013 |
-0.191 |
Tilt |
-0.104 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.056 |
0.013 |
0.000 |
0.021 |
0.010 |
Twist |
0.000 |
-0.230 |
-0.191 |
0.000 |
0.010 |
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 |
1.941 |
0.000 |
0.000 |
-0.118 |
0.000 |
0.000 |
Slide |
0.000 |
3.493 |
1.809 |
0.000 |
-0.090 |
-0.158 |
Rise |
0.000 |
1.809 |
7.507 |
0.000 |
-0.062 |
-0.148 |
Tilt |
-0.118 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.090 |
-0.062 |
0.000 |
0.026 |
0.005 |
Twist |
0.000 |
-0.158 |
-0.148 |
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 |
1.618 |
0.000 |
0.000 |
-0.049 |
0.000 |
0.000 |
Slide |
0.000 |
2.852 |
1.655 |
0.000 |
-0.066 |
-0.154 |
Rise |
0.000 |
1.655 |
6.702 |
0.000 |
-0.050 |
-0.148 |
Tilt |
-0.049 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.066 |
-0.050 |
0.000 |
0.025 |
0.007 |
Twist |
0.000 |
-0.154 |
-0.148 |
0.000 |
0.007 |
0.039 |
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 |
1.210 |
0.000 |
0.000 |
-0.123 |
0.000 |
0.000 |
Slide |
0.000 |
2.127 |
1.430 |
0.000 |
-0.049 |
-0.107 |
Rise |
0.000 |
1.430 |
7.133 |
0.000 |
-0.034 |
-0.191 |
Tilt |
-0.123 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.049 |
-0.034 |
0.000 |
0.020 |
0.006 |
Twist |
0.000 |
-0.107 |
-0.191 |
0.000 |
0.006 |
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 |
1.954 |
0.000 |
0.000 |
-0.122 |
0.000 |
0.000 |
Slide |
0.000 |
3.342 |
1.812 |
0.000 |
-0.079 |
-0.157 |
Rise |
0.000 |
1.812 |
7.334 |
0.000 |
-0.059 |
-0.149 |
Tilt |
-0.122 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.079 |
-0.059 |
0.000 |
0.025 |
0.005 |
Twist |
0.000 |
-0.157 |
-0.149 |
0.000 |
0.005 |
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 |
1.613 |
0.000 |
0.000 |
-0.002 |
0.000 |
0.000 |
Slide |
0.000 |
2.682 |
0.582 |
0.000 |
0.020 |
-0.036 |
Rise |
0.000 |
0.582 |
8.650 |
0.000 |
-0.183 |
-0.276 |
Tilt |
-0.002 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
0.020 |
-0.183 |
0.000 |
0.026 |
0.012 |
Twist |
0.000 |
-0.036 |
-0.276 |
0.000 |
0.012 |
0.022 |
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 |
1.122 |
0.000 |
0.000 |
-0.059 |
0.000 |
0.000 |
Slide |
0.000 |
1.714 |
0.912 |
0.000 |
0.007 |
-0.063 |
Rise |
0.000 |
0.912 |
5.870 |
0.000 |
-0.065 |
-0.175 |
Tilt |
-0.059 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
0.007 |
-0.065 |
0.000 |
0.020 |
0.008 |
Twist |
0.000 |
-0.063 |
-0.175 |
0.000 |
0.008 |
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 |
1.614 |
0.000 |
0.000 |
-0.011 |
0.000 |
0.000 |
Slide |
0.000 |
2.249 |
0.844 |
0.000 |
0.009 |
-0.026 |
Rise |
0.000 |
0.844 |
7.914 |
0.000 |
-0.156 |
-0.254 |
Tilt |
-0.011 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.009 |
-0.156 |
0.000 |
0.027 |
0.011 |
Twist |
0.000 |
-0.026 |
-0.254 |
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 |
1.721 |
0.000 |
0.000 |
-0.001 |
0.000 |
0.000 |
Slide |
0.000 |
2.722 |
0.282 |
0.000 |
0.021 |
-0.022 |
Rise |
0.000 |
0.282 |
8.883 |
0.000 |
-0.186 |
-0.279 |
Tilt |
-0.001 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.021 |
-0.186 |
0.000 |
0.027 |
0.012 |
Twist |
0.000 |
-0.022 |
-0.279 |
0.000 |
0.012 |
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 |
1.303 |
0.000 |
0.000 |
-0.119 |
0.000 |
0.000 |
Slide |
0.000 |
3.489 |
2.503 |
0.000 |
0.069 |
-0.178 |
Rise |
0.000 |
2.503 |
11.709 |
0.000 |
0.148 |
-0.238 |
Tilt |
-0.119 |
0.000 |
0.000 |
0.046 |
0.000 |
0.000 |
Roll |
0.000 |
0.069 |
0.148 |
0.000 |
0.025 |
0.003 |
Twist |
0.000 |
-0.178 |
-0.238 |
0.000 |
0.003 |
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 |
1.401 |
0.000 |
0.000 |
-0.123 |
0.000 |
0.000 |
Slide |
0.000 |
3.417 |
2.625 |
0.000 |
0.080 |
-0.186 |
Rise |
0.000 |
2.625 |
11.343 |
0.000 |
0.155 |
-0.240 |
Tilt |
-0.123 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
0.080 |
0.155 |
0.000 |
0.024 |
0.004 |
Twist |
0.000 |
-0.186 |
-0.240 |
0.000 |
0.004 |
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 |
1.281 |
0.000 |
0.000 |
-0.109 |
0.000 |
0.000 |
Slide |
0.000 |
3.743 |
2.564 |
0.000 |
0.077 |
-0.198 |
Rise |
0.000 |
2.564 |
11.736 |
0.000 |
0.171 |
-0.218 |
Tilt |
-0.109 |
0.000 |
0.000 |
0.046 |
0.000 |
0.000 |
Roll |
0.000 |
0.077 |
0.171 |
0.000 |
0.025 |
0.003 |
Twist |
0.000 |
-0.198 |
-0.218 |
0.000 |
0.003 |
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 |
1.853 |
0.000 |
0.000 |
-0.089 |
0.000 |
0.000 |
Slide |
0.000 |
2.207 |
1.674 |
0.000 |
-0.014 |
-0.155 |
Rise |
0.000 |
1.674 |
7.123 |
0.000 |
-0.039 |
-0.158 |
Tilt |
-0.089 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.014 |
-0.039 |
0.000 |
0.022 |
0.006 |
Twist |
0.000 |
-0.155 |
-0.158 |
0.000 |
0.006 |
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)