| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.857 |
0.000 |
0.000 |
-0.080 |
0.000 |
0.000 |
Slide |
0.000 |
2.539 |
1.003 |
0.000 |
-0.063 |
-0.158 |
Rise |
0.000 |
1.003 |
9.919 |
0.000 |
-0.040 |
-0.188 |
Tilt |
-0.080 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.063 |
-0.040 |
0.000 |
0.024 |
0.011 |
Twist |
0.000 |
-0.158 |
-0.188 |
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 |
1.239 |
0.000 |
0.000 |
-0.044 |
0.000 |
0.000 |
Slide |
0.000 |
2.423 |
1.261 |
0.000 |
-0.095 |
-0.139 |
Rise |
0.000 |
1.261 |
7.479 |
0.000 |
-0.083 |
-0.201 |
Tilt |
-0.044 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.095 |
-0.083 |
0.000 |
0.024 |
0.013 |
Twist |
0.000 |
-0.139 |
-0.201 |
0.000 |
0.013 |
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 |
1.295 |
0.000 |
0.000 |
-0.105 |
0.000 |
0.000 |
Slide |
0.000 |
2.875 |
0.772 |
0.000 |
-0.030 |
-0.189 |
Rise |
0.000 |
0.772 |
8.546 |
0.000 |
-0.061 |
-0.153 |
Tilt |
-0.105 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.030 |
-0.061 |
0.000 |
0.021 |
0.005 |
Twist |
0.000 |
-0.189 |
-0.153 |
0.000 |
0.005 |
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 |
0.881 |
0.000 |
0.000 |
-0.052 |
0.000 |
0.000 |
Slide |
0.000 |
3.399 |
2.648 |
0.000 |
0.022 |
-0.038 |
Rise |
0.000 |
2.648 |
10.839 |
0.000 |
0.068 |
-0.201 |
Tilt |
-0.052 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
0.022 |
0.068 |
0.000 |
0.025 |
0.009 |
Twist |
0.000 |
-0.038 |
-0.201 |
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 |
0.760 |
0.000 |
0.000 |
-0.047 |
0.000 |
0.000 |
Slide |
0.000 |
1.863 |
1.652 |
0.000 |
-0.028 |
-0.076 |
Rise |
0.000 |
1.652 |
7.135 |
0.000 |
-0.027 |
-0.162 |
Tilt |
-0.047 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.028 |
-0.027 |
0.000 |
0.016 |
0.004 |
Twist |
0.000 |
-0.076 |
-0.162 |
0.000 |
0.004 |
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 |
0.705 |
0.000 |
0.000 |
-0.076 |
0.000 |
0.000 |
Slide |
0.000 |
3.016 |
1.028 |
0.000 |
0.014 |
-0.140 |
Rise |
0.000 |
1.028 |
7.751 |
0.000 |
-0.077 |
-0.211 |
Tilt |
-0.076 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
0.014 |
-0.077 |
0.000 |
0.017 |
0.009 |
Twist |
0.000 |
-0.140 |
-0.211 |
0.000 |
0.009 |
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 |
1.054 |
0.000 |
0.000 |
-0.137 |
0.000 |
0.000 |
Slide |
0.000 |
3.031 |
0.858 |
0.000 |
-0.007 |
-0.116 |
Rise |
0.000 |
0.858 |
7.468 |
0.000 |
-0.080 |
-0.201 |
Tilt |
-0.137 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.007 |
-0.080 |
0.000 |
0.015 |
0.004 |
Twist |
0.000 |
-0.116 |
-0.201 |
0.000 |
0.004 |
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 |
0.930 |
0.000 |
0.000 |
-0.062 |
0.000 |
0.000 |
Slide |
0.000 |
1.949 |
1.158 |
0.000 |
-0.016 |
-0.105 |
Rise |
0.000 |
1.158 |
7.119 |
0.000 |
-0.038 |
-0.172 |
Tilt |
-0.062 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.016 |
-0.038 |
0.000 |
0.020 |
0.006 |
Twist |
0.000 |
-0.105 |
-0.172 |
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 |
1.381 |
0.000 |
0.000 |
-0.120 |
0.000 |
0.000 |
Slide |
0.000 |
3.104 |
3.066 |
0.000 |
0.057 |
-0.039 |
Rise |
0.000 |
3.066 |
11.198 |
0.000 |
0.130 |
-0.189 |
Tilt |
-0.120 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
0.057 |
0.130 |
0.000 |
0.027 |
0.008 |
Twist |
0.000 |
-0.039 |
-0.189 |
0.000 |
0.008 |
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)