| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
1.393 |
0.000 |
0.000 |
-0.028 |
0.000 |
0.000 |
| Slide |
0.000 |
2.261 |
1.064 |
0.000 |
-0.096 |
-0.132 |
| Rise |
0.000 |
1.064 |
8.150 |
0.000 |
-0.060 |
-0.181 |
| Tilt |
-0.028 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.096 |
-0.059 |
0.000 |
0.023 |
0.012 |
| Twist |
0.000 |
-0.132 |
-0.181 |
0.000 |
0.012 |
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 |
1.538 |
0.000 |
0.000 |
-0.002 |
0.000 |
0.000 |
| Slide |
0.000 |
2.394 |
1.179 |
0.000 |
-0.104 |
-0.106 |
| Rise |
0.000 |
1.179 |
7.835 |
0.000 |
-0.066 |
-0.135 |
| Tilt |
-0.002 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.104 |
-0.066 |
0.000 |
0.024 |
0.012 |
| Twist |
0.000 |
-0.106 |
-0.135 |
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)
| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
1.408 |
0.000 |
0.000 |
-0.027 |
0.000 |
0.000 |
| Slide |
0.000 |
2.361 |
1.083 |
0.000 |
-0.098 |
-0.133 |
| Rise |
0.000 |
1.083 |
7.708 |
0.000 |
-0.060 |
-0.164 |
| Tilt |
-0.027 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.098 |
-0.060 |
0.000 |
0.023 |
0.012 |
| Twist |
0.000 |
-0.133 |
-0.164 |
0.000 |
0.012 |
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 |
1.250 |
0.000 |
0.000 |
-0.061 |
0.000 |
0.000 |
| Slide |
0.000 |
2.208 |
1.529 |
0.000 |
-0.073 |
-0.113 |
| Rise |
0.000 |
1.529 |
7.305 |
0.000 |
-0.049 |
-0.176 |
| Tilt |
-0.061 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.073 |
-0.049 |
0.000 |
0.020 |
0.007 |
| Twist |
0.000 |
-0.113 |
-0.176 |
0.000 |
0.007 |
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 |
0.658 |
0.000 |
0.000 |
0.019 |
0.000 |
0.000 |
| Slide |
0.000 |
1.826 |
0.740 |
0.000 |
-0.058 |
-0.068 |
| Rise |
0.000 |
0.740 |
4.156 |
0.000 |
-0.090 |
-0.171 |
| Tilt |
0.019 |
0.000 |
0.000 |
0.015 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.058 |
-0.090 |
0.000 |
0.014 |
0.001 |
| Twist |
0.000 |
-0.068 |
-0.171 |
0.000 |
0.001 |
0.020 |
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 |
1.328 |
0.000 |
0.000 |
-0.077 |
0.000 |
0.000 |
| Slide |
0.000 |
2.527 |
1.640 |
0.000 |
-0.087 |
-0.160 |
| Rise |
0.000 |
1.640 |
6.951 |
0.000 |
-0.048 |
-0.170 |
| Tilt |
-0.077 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.087 |
-0.048 |
0.000 |
0.021 |
0.006 |
| Twist |
0.000 |
-0.160 |
-0.170 |
0.000 |
0.006 |
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 |
1.290 |
0.000 |
0.000 |
-0.067 |
0.000 |
0.000 |
| Slide |
0.000 |
2.450 |
1.807 |
0.000 |
-0.078 |
-0.150 |
| Rise |
0.000 |
1.807 |
7.385 |
0.000 |
-0.050 |
-0.188 |
| Tilt |
-0.067 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.078 |
-0.050 |
0.000 |
0.020 |
0.007 |
| Twist |
0.000 |
-0.150 |
-0.188 |
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 |
1.180 |
0.000 |
0.000 |
-0.112 |
0.000 |
0.000 |
| Slide |
0.000 |
2.148 |
0.577 |
0.000 |
0.021 |
-0.057 |
| Rise |
0.000 |
0.577 |
6.738 |
0.000 |
-0.084 |
-0.227 |
| Tilt |
-0.112 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
| Roll |
0.000 |
0.021 |
-0.084 |
0.000 |
0.017 |
0.006 |
| Twist |
0.000 |
-0.057 |
-0.227 |
0.000 |
0.006 |
0.017 |
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 |
1.214 |
0.000 |
0.000 |
-0.052 |
0.000 |
0.000 |
| Slide |
0.000 |
1.654 |
1.471 |
0.000 |
-0.042 |
-0.105 |
| Rise |
0.000 |
1.471 |
7.355 |
0.000 |
-0.048 |
-0.166 |
| Tilt |
-0.052 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.042 |
-0.048 |
0.000 |
0.021 |
0.012 |
| Twist |
0.000 |
-0.105 |
-0.166 |
0.000 |
0.012 |
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 |
1.238 |
0.000 |
0.000 |
-0.067 |
0.000 |
0.000 |
| Slide |
0.000 |
1.698 |
1.055 |
0.000 |
-0.032 |
-0.121 |
| Rise |
0.000 |
1.055 |
7.205 |
0.000 |
-0.025 |
-0.159 |
| Tilt |
-0.067 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.032 |
-0.025 |
0.000 |
0.022 |
0.011 |
| Twist |
0.000 |
-0.121 |
-0.159 |
0.000 |
0.011 |
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 |
0.930 |
0.000 |
0.000 |
-0.075 |
0.000 |
0.000 |
| Slide |
0.000 |
1.864 |
1.288 |
0.000 |
-0.044 |
-0.112 |
| Rise |
0.000 |
1.288 |
7.323 |
0.000 |
-0.040 |
-0.173 |
| Tilt |
-0.075 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.044 |
-0.040 |
0.000 |
0.021 |
0.012 |
| Twist |
0.000 |
-0.112 |
-0.173 |
0.000 |
0.012 |
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 |
1.199 |
0.000 |
0.000 |
-0.053 |
0.000 |
0.000 |
| Slide |
0.000 |
1.717 |
1.505 |
0.000 |
-0.047 |
-0.112 |
| Rise |
0.000 |
1.505 |
7.317 |
0.000 |
-0.052 |
-0.173 |
| Tilt |
-0.053 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.047 |
-0.052 |
0.000 |
0.021 |
0.012 |
| Twist |
0.000 |
-0.112 |
-0.173 |
0.000 |
0.012 |
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 |
1.300 |
0.000 |
0.000 |
-0.077 |
0.000 |
0.000 |
| Slide |
0.000 |
1.494 |
1.727 |
0.000 |
-0.022 |
-0.089 |
| Rise |
0.000 |
1.727 |
6.880 |
0.000 |
-0.044 |
-0.179 |
| Tilt |
-0.077 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.022 |
-0.044 |
0.000 |
0.019 |
0.008 |
| Twist |
0.000 |
-0.089 |
-0.179 |
0.000 |
0.008 |
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 |
1.341 |
0.000 |
0.000 |
-0.085 |
0.000 |
0.000 |
| Slide |
0.000 |
1.437 |
1.706 |
0.000 |
-0.017 |
-0.079 |
| Rise |
0.000 |
1.706 |
6.755 |
0.000 |
-0.036 |
-0.171 |
| Tilt |
-0.085 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.017 |
-0.036 |
0.000 |
0.020 |
0.007 |
| Twist |
0.000 |
-0.079 |
-0.171 |
0.000 |
0.007 |
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 |
1.406 |
0.000 |
0.000 |
-0.081 |
0.000 |
0.000 |
| Slide |
0.000 |
1.452 |
1.736 |
0.000 |
-0.029 |
-0.085 |
| Rise |
0.000 |
1.736 |
6.978 |
0.000 |
-0.048 |
-0.194 |
| Tilt |
-0.081 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.029 |
-0.048 |
0.000 |
0.021 |
0.009 |
| Twist |
0.000 |
-0.085 |
-0.194 |
0.000 |
0.009 |
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)