| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.307 |
0.000 |
0.000 |
-0.132 |
0.000 |
0.000 |
Slide |
0.000 |
1.206 |
-0.477 |
0.000 |
0.044 |
0.028 |
Rise |
0.000 |
-0.477 |
5.432 |
0.000 |
-0.046 |
-0.107 |
Tilt |
-0.132 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
0.044 |
-0.046 |
0.000 |
0.017 |
0.003 |
Twist |
0.000 |
0.028 |
-0.107 |
0.000 |
0.003 |
0.007 |
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 |
0.996 |
0.000 |
0.000 |
-0.069 |
0.000 |
0.000 |
Slide |
0.000 |
1.748 |
1.304 |
0.000 |
-0.061 |
-0.060 |
Rise |
0.000 |
1.304 |
7.369 |
0.000 |
-0.047 |
-0.205 |
Tilt |
-0.069 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.061 |
-0.047 |
0.000 |
0.021 |
0.008 |
Twist |
0.000 |
-0.060 |
-0.205 |
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 |
1.557 |
0.000 |
0.000 |
-0.087 |
0.000 |
0.000 |
Slide |
0.000 |
2.693 |
1.564 |
0.000 |
-0.084 |
-0.128 |
Rise |
0.000 |
1.564 |
6.811 |
0.000 |
-0.044 |
-0.167 |
Tilt |
-0.087 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.084 |
-0.044 |
0.000 |
0.024 |
0.007 |
Twist |
0.000 |
-0.128 |
-0.167 |
0.000 |
0.007 |
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 |
0.906 |
0.000 |
0.000 |
-0.062 |
0.000 |
0.000 |
Slide |
0.000 |
1.859 |
1.514 |
0.000 |
-0.063 |
-0.074 |
Rise |
0.000 |
1.514 |
7.766 |
0.000 |
-0.046 |
-0.206 |
Tilt |
-0.062 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.063 |
-0.046 |
0.000 |
0.022 |
0.009 |
Twist |
0.000 |
-0.074 |
-0.206 |
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 |
1.010 |
0.000 |
0.000 |
-0.062 |
0.000 |
0.000 |
Slide |
0.000 |
1.774 |
1.465 |
0.000 |
-0.066 |
-0.065 |
Rise |
0.000 |
1.465 |
7.396 |
0.000 |
-0.044 |
-0.199 |
Tilt |
-0.062 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.066 |
-0.044 |
0.000 |
0.021 |
0.007 |
Twist |
0.000 |
-0.065 |
-0.199 |
0.000 |
0.007 |
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 |
0.953 |
0.000 |
0.000 |
-0.033 |
0.000 |
0.000 |
Slide |
0.000 |
3.129 |
2.553 |
0.000 |
0.024 |
-0.105 |
Rise |
0.000 |
2.553 |
9.650 |
0.000 |
0.065 |
-0.207 |
Tilt |
-0.033 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
0.024 |
0.065 |
0.000 |
0.023 |
0.011 |
Twist |
0.000 |
-0.105 |
-0.207 |
0.000 |
0.011 |
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 |
0.755 |
0.000 |
0.000 |
-0.029 |
0.000 |
0.000 |
Slide |
0.000 |
3.286 |
2.530 |
0.000 |
0.044 |
-0.092 |
Rise |
0.000 |
2.530 |
9.824 |
0.000 |
0.086 |
-0.214 |
Tilt |
-0.029 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
0.044 |
0.086 |
0.000 |
0.023 |
0.010 |
Twist |
0.000 |
-0.092 |
-0.214 |
0.000 |
0.010 |
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 |
0.882 |
0.000 |
0.000 |
-0.029 |
0.000 |
0.000 |
Slide |
0.000 |
3.229 |
2.570 |
0.000 |
0.029 |
-0.105 |
Rise |
0.000 |
2.570 |
9.670 |
0.000 |
0.076 |
-0.195 |
Tilt |
-0.029 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
0.029 |
0.076 |
0.000 |
0.023 |
0.011 |
Twist |
0.000 |
-0.105 |
-0.195 |
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 |
1.136 |
0.000 |
0.000 |
-0.070 |
0.000 |
0.000 |
Slide |
0.000 |
2.177 |
1.161 |
0.000 |
-0.039 |
-0.192 |
Rise |
0.000 |
1.161 |
7.558 |
0.000 |
-0.048 |
-0.173 |
Tilt |
-0.070 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.039 |
-0.048 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.192 |
-0.173 |
0.000 |
0.011 |
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 |
1.004 |
0.000 |
0.000 |
-0.114 |
0.000 |
0.000 |
Slide |
0.000 |
1.720 |
1.144 |
0.000 |
-0.031 |
-0.115 |
Rise |
0.000 |
1.144 |
7.876 |
0.000 |
-0.030 |
-0.192 |
Tilt |
-0.114 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.031 |
-0.030 |
0.000 |
0.023 |
0.012 |
Twist |
0.000 |
-0.115 |
-0.192 |
0.000 |
0.012 |
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 |
1.218 |
0.000 |
0.000 |
-0.065 |
0.000 |
0.000 |
Slide |
0.000 |
2.010 |
1.209 |
0.000 |
-0.026 |
-0.169 |
Rise |
0.000 |
1.209 |
7.291 |
0.000 |
-0.037 |
-0.169 |
Tilt |
-0.065 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.026 |
-0.037 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.169 |
-0.169 |
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 |
1.144 |
0.000 |
0.000 |
-0.072 |
0.000 |
0.000 |
Slide |
0.000 |
2.165 |
1.295 |
0.000 |
-0.037 |
-0.188 |
Rise |
0.000 |
1.295 |
7.530 |
0.000 |
-0.027 |
-0.182 |
Tilt |
-0.072 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.037 |
-0.027 |
0.000 |
0.021 |
0.012 |
Twist |
0.000 |
-0.188 |
-0.182 |
0.000 |
0.012 |
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 |
0.970 |
0.000 |
0.000 |
-0.050 |
0.000 |
0.000 |
Slide |
0.000 |
1.582 |
0.932 |
0.000 |
0.014 |
-0.054 |
Rise |
0.000 |
0.932 |
6.758 |
0.000 |
-0.109 |
-0.232 |
Tilt |
-0.050 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.014 |
-0.109 |
0.000 |
0.019 |
0.009 |
Twist |
0.000 |
-0.054 |
-0.232 |
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 |
0.962 |
0.000 |
0.000 |
-0.040 |
0.000 |
0.000 |
Slide |
0.000 |
1.664 |
1.147 |
0.000 |
0.003 |
-0.064 |
Rise |
0.000 |
1.146 |
6.613 |
0.000 |
-0.110 |
-0.228 |
Tilt |
-0.040 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.003 |
-0.110 |
0.000 |
0.018 |
0.009 |
Twist |
0.000 |
-0.064 |
-0.228 |
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 |
0.968 |
0.000 |
0.000 |
-0.048 |
0.000 |
0.000 |
Slide |
0.000 |
1.561 |
1.089 |
0.000 |
-0.001 |
-0.063 |
Rise |
0.000 |
1.089 |
6.741 |
0.000 |
-0.118 |
-0.229 |
Tilt |
-0.048 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
-0.001 |
-0.118 |
0.000 |
0.018 |
0.009 |
Twist |
0.000 |
-0.063 |
-0.229 |
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)