| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.979 |
0.000 |
0.000 |
-0.091 |
0.000 |
0.000 |
Slide |
0.000 |
3.411 |
0.199 |
0.000 |
0.001 |
-0.140 |
Rise |
0.000 |
0.199 |
8.819 |
0.000 |
-0.096 |
-0.257 |
Tilt |
-0.091 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
0.001 |
-0.096 |
0.000 |
0.019 |
0.008 |
Twist |
0.000 |
-0.140 |
-0.257 |
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 |
1.036 |
0.000 |
0.000 |
-0.122 |
0.000 |
0.000 |
Slide |
0.000 |
2.812 |
0.825 |
0.000 |
0.009 |
-0.103 |
Rise |
0.000 |
0.825 |
7.276 |
0.000 |
-0.062 |
-0.234 |
Tilt |
-0.122 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
0.009 |
-0.062 |
0.000 |
0.015 |
0.005 |
Twist |
0.000 |
-0.103 |
-0.234 |
0.000 |
0.005 |
0.022 |
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 |
1.135 |
0.000 |
0.000 |
-0.137 |
0.000 |
0.000 |
Slide |
0.000 |
2.454 |
0.899 |
0.000 |
0.017 |
-0.086 |
Rise |
0.000 |
0.899 |
7.293 |
0.000 |
-0.060 |
-0.208 |
Tilt |
-0.137 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
0.017 |
-0.060 |
0.000 |
0.015 |
0.005 |
Twist |
0.000 |
-0.086 |
-0.208 |
0.000 |
0.005 |
0.022 |
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 |
1.000 |
0.000 |
0.000 |
-0.102 |
0.000 |
0.000 |
Slide |
0.000 |
2.431 |
0.692 |
0.000 |
-0.001 |
-0.104 |
Rise |
0.000 |
0.692 |
8.108 |
0.000 |
-0.065 |
-0.244 |
Tilt |
-0.102 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.001 |
-0.065 |
0.000 |
0.018 |
0.007 |
Twist |
0.000 |
-0.104 |
-0.244 |
0.000 |
0.007 |
0.021 |
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 |
1.125 |
0.000 |
0.000 |
-0.089 |
0.000 |
0.000 |
Slide |
0.000 |
3.692 |
0.164 |
0.000 |
0.000 |
-0.152 |
Rise |
0.000 |
0.164 |
8.979 |
0.000 |
-0.093 |
-0.265 |
Tilt |
-0.089 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
0.000 |
-0.093 |
0.000 |
0.020 |
0.007 |
Twist |
0.000 |
-0.152 |
-0.265 |
0.000 |
0.007 |
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 |
1.247 |
0.000 |
0.000 |
-0.090 |
0.000 |
0.000 |
Slide |
0.000 |
3.340 |
2.853 |
0.000 |
0.050 |
-0.080 |
Rise |
0.000 |
2.853 |
11.503 |
0.000 |
0.131 |
-0.203 |
Tilt |
-0.090 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
0.050 |
0.131 |
0.000 |
0.026 |
0.004 |
Twist |
0.000 |
-0.080 |
-0.203 |
0.000 |
0.004 |
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 |
1.413 |
0.000 |
0.000 |
-0.127 |
0.000 |
0.000 |
Slide |
0.000 |
2.245 |
2.290 |
0.000 |
0.015 |
-0.068 |
Rise |
0.000 |
2.290 |
10.838 |
0.000 |
0.096 |
-0.212 |
Tilt |
-0.127 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
0.015 |
0.096 |
0.000 |
0.025 |
0.007 |
Twist |
0.000 |
-0.068 |
-0.212 |
0.000 |
0.007 |
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 |
1.190 |
0.000 |
0.000 |
-0.126 |
0.000 |
0.000 |
Slide |
0.000 |
3.153 |
2.301 |
0.000 |
0.069 |
-0.107 |
Rise |
0.000 |
2.301 |
10.858 |
0.000 |
0.132 |
-0.259 |
Tilt |
-0.126 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
0.069 |
0.132 |
0.000 |
0.026 |
0.007 |
Twist |
0.000 |
-0.107 |
-0.259 |
0.000 |
0.007 |
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 |
1.402 |
0.000 |
0.000 |
-0.068 |
0.000 |
0.000 |
Slide |
0.000 |
3.026 |
2.530 |
0.000 |
0.054 |
-0.117 |
Rise |
0.000 |
2.530 |
11.316 |
0.000 |
0.141 |
-0.210 |
Tilt |
-0.068 |
0.000 |
0.000 |
0.038 |
0.000 |
0.000 |
Roll |
0.000 |
0.054 |
0.141 |
0.000 |
0.026 |
0.004 |
Twist |
0.000 |
-0.117 |
-0.210 |
0.000 |
0.004 |
0.044 |
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 |
1.946 |
0.000 |
0.000 |
-0.104 |
0.000 |
0.000 |
Slide |
0.000 |
2.207 |
1.848 |
0.000 |
-0.039 |
-0.118 |
Rise |
0.000 |
1.848 |
7.241 |
0.000 |
-0.019 |
-0.151 |
Tilt |
-0.104 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
-0.039 |
-0.019 |
0.000 |
0.024 |
0.008 |
Twist |
0.000 |
-0.118 |
-0.151 |
0.000 |
0.008 |
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 |
0.961 |
0.000 |
0.000 |
-0.100 |
0.000 |
0.000 |
Slide |
0.000 |
1.804 |
1.781 |
0.000 |
-0.011 |
-0.125 |
Rise |
0.000 |
1.781 |
8.257 |
0.000 |
-0.002 |
-0.165 |
Tilt |
-0.100 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
-0.011 |
-0.002 |
0.000 |
0.019 |
0.006 |
Twist |
0.000 |
-0.125 |
-0.165 |
0.000 |
0.006 |
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 |
1.372 |
0.000 |
0.000 |
-0.112 |
0.000 |
0.000 |
Slide |
0.000 |
1.769 |
1.852 |
0.000 |
-0.016 |
-0.106 |
Rise |
0.000 |
1.852 |
7.721 |
0.000 |
-0.036 |
-0.173 |
Tilt |
-0.112 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
-0.016 |
-0.036 |
0.000 |
0.021 |
0.005 |
Twist |
0.000 |
-0.106 |
-0.173 |
0.000 |
0.005 |
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 |
0.938 |
0.000 |
0.000 |
-0.104 |
0.000 |
0.000 |
Slide |
0.000 |
1.781 |
1.773 |
0.000 |
-0.026 |
-0.127 |
Rise |
0.000 |
1.773 |
7.960 |
0.000 |
0.006 |
-0.161 |
Tilt |
-0.104 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
-0.026 |
0.006 |
0.000 |
0.020 |
0.005 |
Twist |
0.000 |
-0.127 |
-0.161 |
0.000 |
0.005 |
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 |
1.648 |
0.000 |
0.000 |
-0.106 |
0.000 |
0.000 |
Slide |
0.000 |
1.940 |
1.832 |
0.000 |
-0.029 |
-0.105 |
Rise |
0.000 |
1.832 |
7.330 |
0.000 |
-0.023 |
-0.158 |
Tilt |
-0.106 |
0.000 |
0.000 |
0.037 |
0.000 |
0.000 |
Roll |
0.000 |
-0.029 |
-0.023 |
0.000 |
0.022 |
0.007 |
Twist |
0.000 |
-0.105 |
-0.158 |
0.000 |
0.007 |
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 |
0.987 |
0.000 |
0.000 |
-0.113 |
0.000 |
0.000 |
Slide |
0.000 |
1.881 |
1.821 |
0.000 |
-0.026 |
-0.113 |
Rise |
0.000 |
1.821 |
8.904 |
0.000 |
-0.021 |
-0.176 |
Tilt |
-0.113 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
-0.026 |
-0.021 |
0.000 |
0.021 |
0.008 |
Twist |
0.000 |
-0.113 |
-0.176 |
0.000 |
0.008 |
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)