| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.323 |
0.000 |
0.000 |
-0.124 |
0.000 |
0.000 |
Slide |
0.000 |
2.103 |
1.409 |
0.000 |
0.003 |
-0.078 |
Rise |
0.000 |
1.409 |
5.907 |
0.000 |
-0.062 |
-0.214 |
Tilt |
-0.124 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
0.003 |
-0.062 |
0.000 |
0.016 |
0.006 |
Twist |
0.000 |
-0.078 |
-0.214 |
0.000 |
0.006 |
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 |
1.308 |
0.000 |
0.000 |
-0.119 |
0.000 |
0.000 |
Slide |
0.000 |
2.063 |
1.478 |
0.000 |
0.003 |
-0.073 |
Rise |
0.000 |
1.478 |
5.961 |
0.000 |
-0.071 |
-0.215 |
Tilt |
-0.119 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
0.003 |
-0.071 |
0.000 |
0.017 |
0.006 |
Twist |
0.000 |
-0.073 |
-0.215 |
0.000 |
0.006 |
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 |
1.294 |
0.000 |
0.000 |
-0.118 |
0.000 |
0.000 |
Slide |
0.000 |
2.033 |
1.408 |
0.000 |
-0.001 |
-0.076 |
Rise |
0.000 |
1.408 |
5.808 |
0.000 |
-0.074 |
-0.212 |
Tilt |
-0.118 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.001 |
-0.074 |
0.000 |
0.017 |
0.006 |
Twist |
0.000 |
-0.076 |
-0.212 |
0.000 |
0.006 |
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 |
0.411 |
0.000 |
0.000 |
-0.007 |
0.000 |
0.000 |
Slide |
0.000 |
1.664 |
0.552 |
0.000 |
-0.033 |
-0.082 |
Rise |
0.000 |
0.552 |
4.877 |
0.000 |
-0.055 |
-0.107 |
Tilt |
-0.007 |
0.000 |
0.000 |
0.014 |
0.000 |
0.000 |
Roll |
0.000 |
-0.033 |
-0.055 |
0.000 |
0.011 |
0.002 |
Twist |
0.000 |
-0.082 |
-0.107 |
0.000 |
0.002 |
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 |
1.369 |
0.000 |
0.000 |
-0.105 |
0.000 |
0.000 |
Slide |
0.000 |
2.762 |
2.454 |
0.000 |
0.070 |
-0.122 |
Rise |
0.000 |
2.454 |
10.546 |
0.000 |
0.146 |
-0.244 |
Tilt |
-0.105 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
Roll |
0.000 |
0.070 |
0.146 |
0.000 |
0.023 |
0.006 |
Twist |
0.000 |
-0.122 |
-0.244 |
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 |
1.408 |
0.000 |
0.000 |
-0.108 |
0.000 |
0.000 |
Slide |
0.000 |
2.894 |
2.490 |
0.000 |
0.078 |
-0.130 |
Rise |
0.000 |
2.490 |
10.646 |
0.000 |
0.157 |
-0.241 |
Tilt |
-0.108 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
0.078 |
0.157 |
0.000 |
0.023 |
0.006 |
Twist |
0.000 |
-0.130 |
-0.241 |
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 |
1.386 |
0.000 |
0.000 |
-0.108 |
0.000 |
0.000 |
Slide |
0.000 |
2.683 |
2.336 |
0.000 |
0.069 |
-0.115 |
Rise |
0.000 |
2.336 |
10.288 |
0.000 |
0.136 |
-0.222 |
Tilt |
-0.108 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
0.069 |
0.136 |
0.000 |
0.023 |
0.006 |
Twist |
0.000 |
-0.115 |
-0.222 |
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 |
1.047 |
0.000 |
0.000 |
-0.119 |
0.000 |
0.000 |
Slide |
0.000 |
1.470 |
1.681 |
0.000 |
-0.003 |
-0.123 |
Rise |
0.000 |
1.681 |
7.692 |
0.000 |
-0.020 |
-0.181 |
Tilt |
-0.119 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
-0.003 |
-0.020 |
0.000 |
0.021 |
0.008 |
Twist |
0.000 |
-0.123 |
-0.181 |
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 |
0.976 |
0.000 |
0.000 |
-0.039 |
0.000 |
0.000 |
Slide |
0.000 |
3.378 |
2.466 |
0.000 |
0.049 |
-0.095 |
Rise |
0.000 |
2.466 |
9.263 |
0.000 |
0.082 |
-0.229 |
Tilt |
-0.039 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
0.049 |
0.082 |
0.000 |
0.021 |
0.010 |
Twist |
0.000 |
-0.095 |
-0.229 |
0.000 |
0.010 |
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 |
0.997 |
0.000 |
0.000 |
-0.038 |
0.000 |
0.000 |
Slide |
0.000 |
3.438 |
2.549 |
0.000 |
0.041 |
-0.100 |
Rise |
0.000 |
2.549 |
9.681 |
0.000 |
0.099 |
-0.230 |
Tilt |
-0.038 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
0.041 |
0.099 |
0.000 |
0.021 |
0.009 |
Twist |
0.000 |
-0.100 |
-0.230 |
0.000 |
0.009 |
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 |
0.974 |
0.000 |
0.000 |
-0.038 |
0.000 |
0.000 |
Slide |
0.000 |
3.494 |
2.653 |
0.000 |
0.033 |
-0.116 |
Rise |
0.000 |
2.653 |
9.569 |
0.000 |
0.079 |
-0.245 |
Tilt |
-0.038 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
0.033 |
0.079 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.116 |
-0.245 |
0.000 |
0.009 |
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 |
0.989 |
0.000 |
0.000 |
-0.037 |
0.000 |
0.000 |
Slide |
0.000 |
2.116 |
0.994 |
0.000 |
0.011 |
-0.060 |
Rise |
0.000 |
0.994 |
7.162 |
0.000 |
-0.122 |
-0.244 |
Tilt |
-0.037 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
0.011 |
-0.122 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.060 |
-0.244 |
0.000 |
0.009 |
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 |
0.828 |
0.000 |
0.000 |
-0.050 |
0.000 |
0.000 |
Slide |
0.000 |
1.940 |
0.784 |
0.000 |
0.025 |
-0.066 |
Rise |
0.000 |
0.784 |
7.089 |
0.000 |
-0.111 |
-0.243 |
Tilt |
-0.050 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
0.025 |
-0.111 |
0.000 |
0.019 |
0.008 |
Twist |
0.000 |
-0.066 |
-0.243 |
0.000 |
0.008 |
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 |
1.052 |
0.000 |
0.000 |
-0.051 |
0.000 |
0.000 |
Slide |
0.000 |
1.932 |
0.890 |
0.000 |
0.015 |
-0.061 |
Rise |
0.000 |
0.890 |
7.074 |
0.000 |
-0.119 |
-0.233 |
Tilt |
-0.051 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
0.015 |
-0.119 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.061 |
-0.233 |
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 |
0.969 |
0.000 |
0.000 |
-0.038 |
0.000 |
0.000 |
Slide |
0.000 |
2.055 |
1.099 |
0.000 |
0.004 |
-0.060 |
Rise |
0.000 |
1.099 |
7.118 |
0.000 |
-0.111 |
-0.237 |
Tilt |
-0.038 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
0.004 |
-0.111 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.060 |
-0.237 |
0.000 |
0.009 |
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)