| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.131 |
0.000 |
0.000 |
-0.086 |
0.000 |
0.000 |
Slide |
0.000 |
2.669 |
0.673 |
0.000 |
-0.051 |
-0.157 |
Rise |
0.000 |
0.673 |
8.618 |
0.000 |
0.002 |
-0.173 |
Tilt |
-0.086 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.051 |
0.002 |
0.000 |
0.020 |
0.011 |
Twist |
0.000 |
-0.157 |
-0.173 |
0.000 |
0.011 |
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 |
1.019 |
0.000 |
0.000 |
-0.073 |
0.000 |
0.000 |
Slide |
0.000 |
2.351 |
0.638 |
0.000 |
-0.059 |
-0.121 |
Rise |
0.000 |
0.638 |
8.736 |
0.000 |
-0.006 |
-0.171 |
Tilt |
-0.073 |
0.000 |
0.000 |
0.026 |
0.000 |
0.000 |
Roll |
0.000 |
-0.059 |
-0.006 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.121 |
-0.171 |
0.000 |
0.011 |
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 |
1.163 |
0.000 |
0.000 |
-0.075 |
0.000 |
0.000 |
Slide |
0.000 |
2.718 |
0.690 |
0.000 |
-0.062 |
-0.179 |
Rise |
0.000 |
0.690 |
8.022 |
0.000 |
-0.001 |
-0.163 |
Tilt |
-0.075 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
Roll |
0.000 |
-0.062 |
-0.001 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.179 |
-0.163 |
0.000 |
0.011 |
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 |
1.824 |
0.000 |
0.000 |
-0.097 |
0.000 |
0.000 |
Slide |
0.000 |
3.559 |
1.580 |
0.000 |
-0.065 |
-0.246 |
Rise |
0.000 |
1.580 |
6.726 |
0.000 |
-0.067 |
-0.140 |
Tilt |
-0.097 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.065 |
-0.067 |
0.000 |
0.023 |
0.005 |
Twist |
0.000 |
-0.246 |
-0.140 |
0.000 |
0.005 |
0.048 |
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 |
1.521 |
0.000 |
0.000 |
-0.059 |
0.000 |
0.000 |
Slide |
0.000 |
2.587 |
1.644 |
0.000 |
-0.059 |
-0.135 |
Rise |
0.000 |
1.644 |
7.045 |
0.000 |
-0.042 |
-0.159 |
Tilt |
-0.059 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.059 |
-0.042 |
0.000 |
0.023 |
0.005 |
Twist |
0.000 |
-0.135 |
-0.159 |
0.000 |
0.005 |
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 |
1.113 |
0.000 |
0.000 |
-0.101 |
0.000 |
0.000 |
Slide |
0.000 |
2.417 |
1.708 |
0.000 |
-0.053 |
-0.175 |
Rise |
0.000 |
1.708 |
7.189 |
0.000 |
-0.048 |
-0.207 |
Tilt |
-0.101 |
0.000 |
0.000 |
0.027 |
0.000 |
0.000 |
Roll |
0.000 |
-0.053 |
-0.048 |
0.000 |
0.021 |
0.007 |
Twist |
0.000 |
-0.175 |
-0.207 |
0.000 |
0.007 |
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 |
1.680 |
0.000 |
0.000 |
-0.086 |
0.000 |
0.000 |
Slide |
0.000 |
3.422 |
1.574 |
0.000 |
-0.061 |
-0.226 |
Rise |
0.000 |
1.574 |
6.633 |
0.000 |
-0.048 |
-0.164 |
Tilt |
-0.086 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.061 |
-0.048 |
0.000 |
0.022 |
0.005 |
Twist |
0.000 |
-0.226 |
-0.164 |
0.000 |
0.005 |
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 |
1.109 |
0.000 |
0.000 |
-0.051 |
0.000 |
0.000 |
Slide |
0.000 |
1.848 |
1.103 |
0.000 |
-0.005 |
-0.063 |
Rise |
0.000 |
1.103 |
6.470 |
0.000 |
-0.103 |
-0.200 |
Tilt |
-0.051 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.005 |
-0.103 |
0.000 |
0.020 |
0.010 |
Twist |
0.000 |
-0.063 |
-0.200 |
0.000 |
0.010 |
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 |
1.781 |
0.000 |
0.000 |
-0.092 |
0.000 |
0.000 |
Slide |
0.000 |
2.284 |
1.691 |
0.000 |
-0.022 |
-0.164 |
Rise |
0.000 |
1.691 |
7.401 |
0.000 |
-0.029 |
-0.151 |
Tilt |
-0.092 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
Roll |
0.000 |
-0.022 |
-0.029 |
0.000 |
0.024 |
0.008 |
Twist |
0.000 |
-0.164 |
-0.151 |
0.000 |
0.008 |
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 |
1.037 |
0.000 |
0.000 |
-0.039 |
0.000 |
0.000 |
Slide |
0.000 |
3.574 |
2.465 |
0.000 |
0.042 |
-0.162 |
Rise |
0.000 |
2.465 |
10.314 |
0.000 |
0.125 |
-0.200 |
Tilt |
-0.039 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
0.042 |
0.125 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.162 |
-0.200 |
0.000 |
0.009 |
0.045 |
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 |
0.965 |
0.000 |
0.000 |
-0.036 |
0.000 |
0.000 |
Slide |
0.000 |
3.427 |
2.348 |
0.000 |
0.029 |
-0.147 |
Rise |
0.000 |
2.348 |
9.984 |
0.000 |
0.100 |
-0.204 |
Tilt |
-0.036 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
0.029 |
0.100 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.147 |
-0.204 |
0.000 |
0.009 |
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 |
1.037 |
0.000 |
0.000 |
-0.033 |
0.000 |
0.000 |
Slide |
0.000 |
3.476 |
2.310 |
0.000 |
0.039 |
-0.143 |
Rise |
0.000 |
2.310 |
10.517 |
0.000 |
0.127 |
-0.198 |
Tilt |
-0.033 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
0.039 |
0.127 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.143 |
-0.198 |
0.000 |
0.009 |
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 |
0.658 |
0.000 |
0.000 |
-0.010 |
0.000 |
0.000 |
Slide |
0.000 |
1.492 |
0.749 |
0.000 |
0.013 |
-0.043 |
Rise |
0.000 |
0.749 |
7.729 |
0.000 |
-0.130 |
-0.221 |
Tilt |
-0.010 |
0.000 |
0.000 |
0.023 |
0.000 |
0.000 |
Roll |
0.000 |
0.013 |
-0.130 |
0.000 |
0.019 |
0.012 |
Twist |
0.000 |
-0.043 |
-0.221 |
0.000 |
0.012 |
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 |
0.693 |
0.000 |
0.000 |
-0.009 |
0.000 |
0.000 |
Slide |
0.000 |
1.349 |
0.910 |
0.000 |
0.005 |
-0.042 |
Rise |
0.000 |
0.910 |
7.301 |
0.000 |
-0.142 |
-0.226 |
Tilt |
-0.009 |
0.000 |
0.000 |
0.022 |
0.000 |
0.000 |
Roll |
0.000 |
0.005 |
-0.142 |
0.000 |
0.021 |
0.013 |
Twist |
0.000 |
-0.042 |
-0.226 |
0.000 |
0.013 |
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 |
0.689 |
0.000 |
0.000 |
-0.008 |
0.000 |
0.000 |
Slide |
0.000 |
1.434 |
0.846 |
0.000 |
0.006 |
-0.044 |
Rise |
0.000 |
0.846 |
7.392 |
0.000 |
-0.132 |
-0.220 |
Tilt |
-0.008 |
0.000 |
0.000 |
0.021 |
0.000 |
0.000 |
Roll |
0.000 |
0.006 |
-0.132 |
0.000 |
0.021 |
0.013 |
Twist |
0.000 |
-0.044 |
-0.220 |
0.000 |
0.013 |
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)