| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.115 |
0.000 |
0.000 |
-0.147 |
0.000 |
0.000 |
Slide |
0.000 |
2.390 |
1.304 |
0.000 |
0.024 |
-0.070 |
Rise |
0.000 |
1.304 |
7.742 |
0.000 |
-0.051 |
-0.204 |
Tilt |
-0.147 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
0.024 |
-0.051 |
0.000 |
0.016 |
0.004 |
Twist |
0.000 |
-0.070 |
-0.204 |
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 |
1.209 |
0.000 |
0.000 |
-0.144 |
0.000 |
0.000 |
Slide |
0.000 |
2.610 |
1.465 |
0.000 |
0.018 |
-0.085 |
Rise |
0.000 |
1.465 |
7.875 |
0.000 |
-0.060 |
-0.215 |
Tilt |
-0.144 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
0.018 |
-0.060 |
0.000 |
0.016 |
0.005 |
Twist |
0.000 |
-0.085 |
-0.215 |
0.000 |
0.005 |
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 |
1.205 |
0.000 |
0.000 |
-0.141 |
0.000 |
0.000 |
Slide |
0.000 |
2.598 |
1.430 |
0.000 |
0.026 |
-0.085 |
Rise |
0.000 |
1.430 |
7.273 |
0.000 |
-0.057 |
-0.212 |
Tilt |
-0.141 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
0.026 |
-0.057 |
0.000 |
0.016 |
0.005 |
Twist |
0.000 |
-0.085 |
-0.212 |
0.000 |
0.005 |
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 |
1.014 |
0.000 |
0.000 |
-0.098 |
0.000 |
0.000 |
Slide |
0.000 |
2.496 |
1.745 |
0.000 |
-0.046 |
-0.137 |
Rise |
0.000 |
1.745 |
8.429 |
0.000 |
-0.011 |
-0.167 |
Tilt |
-0.098 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.046 |
-0.011 |
0.000 |
0.020 |
0.005 |
Twist |
0.000 |
-0.137 |
-0.167 |
0.000 |
0.005 |
0.027 |
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 |
1.384 |
0.000 |
0.000 |
-0.166 |
0.000 |
0.000 |
Slide |
0.000 |
2.780 |
2.740 |
0.000 |
0.049 |
-0.054 |
Rise |
0.000 |
2.740 |
11.144 |
0.000 |
0.105 |
-0.245 |
Tilt |
-0.166 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
0.049 |
0.105 |
0.000 |
0.026 |
0.008 |
Twist |
0.000 |
-0.054 |
-0.245 |
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)
| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.308 |
0.000 |
0.000 |
-0.140 |
0.000 |
0.000 |
Slide |
0.000 |
2.984 |
2.926 |
0.000 |
0.059 |
-0.078 |
Rise |
0.000 |
2.926 |
11.639 |
0.000 |
0.134 |
-0.249 |
Tilt |
-0.140 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
Roll |
0.000 |
0.059 |
0.134 |
0.000 |
0.025 |
0.006 |
Twist |
0.000 |
-0.078 |
-0.249 |
0.000 |
0.006 |
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 |
1.359 |
0.000 |
0.000 |
-0.152 |
0.000 |
0.000 |
Slide |
0.000 |
2.985 |
2.853 |
0.000 |
0.050 |
-0.059 |
Rise |
0.000 |
2.853 |
11.427 |
0.000 |
0.136 |
-0.240 |
Tilt |
-0.152 |
0.000 |
0.000 |
0.044 |
0.000 |
0.000 |
Roll |
0.000 |
0.050 |
0.136 |
0.000 |
0.026 |
0.008 |
Twist |
0.000 |
-0.059 |
-0.240 |
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 |
0.890 |
0.000 |
0.000 |
-0.137 |
0.000 |
0.000 |
Slide |
0.000 |
2.081 |
2.033 |
0.000 |
-0.013 |
-0.089 |
Rise |
0.000 |
2.033 |
9.259 |
0.000 |
-0.014 |
-0.151 |
Tilt |
-0.137 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
-0.013 |
-0.014 |
0.000 |
0.024 |
0.008 |
Twist |
0.000 |
-0.089 |
-0.151 |
0.000 |
0.008 |
0.040 |
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 |
0.857 |
0.000 |
0.000 |
-0.046 |
0.000 |
0.000 |
Slide |
0.000 |
4.235 |
3.136 |
0.000 |
0.034 |
-0.084 |
Rise |
0.000 |
3.136 |
11.142 |
0.000 |
0.082 |
-0.239 |
Tilt |
-0.046 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
0.034 |
0.082 |
0.000 |
0.026 |
0.013 |
Twist |
0.000 |
-0.084 |
-0.239 |
0.000 |
0.013 |
0.033 |
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 |
0.711 |
0.000 |
0.000 |
-0.043 |
0.000 |
0.000 |
Slide |
0.000 |
4.652 |
3.172 |
0.000 |
0.032 |
-0.113 |
Rise |
0.000 |
3.172 |
11.769 |
0.000 |
0.101 |
-0.240 |
Tilt |
-0.043 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
0.032 |
0.101 |
0.000 |
0.026 |
0.011 |
Twist |
0.000 |
-0.113 |
-0.240 |
0.000 |
0.011 |
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 |
0.904 |
0.000 |
0.000 |
-0.050 |
0.000 |
0.000 |
Slide |
0.000 |
3.871 |
2.909 |
0.000 |
0.024 |
-0.080 |
Rise |
0.000 |
2.909 |
10.964 |
0.000 |
0.074 |
-0.248 |
Tilt |
-0.050 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
0.024 |
0.074 |
0.000 |
0.026 |
0.013 |
Twist |
0.000 |
-0.080 |
-0.248 |
0.000 |
0.013 |
0.033 |
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 |
0.665 |
0.000 |
0.000 |
-0.087 |
0.000 |
0.000 |
Slide |
0.000 |
2.867 |
0.717 |
0.000 |
0.036 |
-0.101 |
Rise |
0.000 |
0.717 |
8.174 |
0.000 |
-0.082 |
-0.215 |
Tilt |
-0.087 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
0.036 |
-0.082 |
0.000 |
0.018 |
0.008 |
Twist |
0.000 |
-0.101 |
-0.215 |
0.000 |
0.008 |
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 |
0.576 |
0.000 |
0.000 |
-0.090 |
0.000 |
0.000 |
Slide |
0.000 |
3.143 |
0.523 |
0.000 |
0.032 |
-0.121 |
Rise |
0.000 |
0.523 |
8.719 |
0.000 |
-0.099 |
-0.257 |
Tilt |
-0.090 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
0.032 |
-0.099 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.121 |
-0.257 |
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 |
0.749 |
0.000 |
0.000 |
-0.085 |
0.000 |
0.000 |
Slide |
0.000 |
2.773 |
0.833 |
0.000 |
0.020 |
-0.111 |
Rise |
0.000 |
0.833 |
7.746 |
0.000 |
-0.099 |
-0.233 |
Tilt |
-0.085 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
0.020 |
-0.100 |
0.000 |
0.020 |
0.010 |
Twist |
0.000 |
-0.111 |
-0.234 |
0.000 |
0.010 |
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 |
0.674 |
0.000 |
0.000 |
-0.080 |
0.000 |
0.000 |
Slide |
0.000 |
2.754 |
0.773 |
0.000 |
0.039 |
-0.087 |
Rise |
0.000 |
0.773 |
8.251 |
0.000 |
-0.076 |
-0.224 |
Tilt |
-0.080 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
0.039 |
-0.076 |
0.000 |
0.018 |
0.007 |
Twist |
0.000 |
-0.087 |
-0.224 |
0.000 |
0.007 |
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)