| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.267 |
0.000 |
0.000 |
-0.092 |
0.000 |
0.000 |
Slide |
0.000 |
2.495 |
1.930 |
0.000 |
-0.054 |
-0.121 |
Rise |
0.000 |
1.930 |
7.722 |
0.000 |
-0.027 |
-0.174 |
Tilt |
-0.092 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.054 |
-0.027 |
0.000 |
0.024 |
0.005 |
Twist |
0.000 |
-0.121 |
-0.174 |
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 |
2.312 |
0.000 |
0.000 |
-0.032 |
0.000 |
0.000 |
Slide |
0.000 |
5.547 |
3.041 |
0.000 |
-0.091 |
-0.120 |
Rise |
0.000 |
3.041 |
10.902 |
0.000 |
0.023 |
-0.177 |
Tilt |
-0.032 |
0.000 |
0.000 |
0.046 |
0.000 |
0.000 |
Roll |
0.000 |
-0.091 |
0.023 |
0.000 |
0.033 |
0.016 |
Twist |
0.000 |
-0.120 |
-0.177 |
0.000 |
0.016 |
0.057 |
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 |
2.136 |
0.000 |
0.000 |
-0.026 |
0.000 |
0.000 |
Slide |
0.000 |
5.728 |
3.325 |
0.000 |
-0.068 |
-0.117 |
Rise |
0.000 |
3.325 |
11.177 |
0.000 |
0.041 |
-0.171 |
Tilt |
-0.026 |
0.000 |
0.000 |
0.044 |
0.000 |
0.000 |
Roll |
0.000 |
-0.068 |
0.041 |
0.000 |
0.031 |
0.014 |
Twist |
0.000 |
-0.117 |
-0.171 |
0.000 |
0.014 |
0.056 |
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 |
1.948 |
0.000 |
0.000 |
-0.012 |
0.000 |
0.000 |
Slide |
0.000 |
5.716 |
3.211 |
0.000 |
-0.088 |
-0.113 |
Rise |
0.000 |
3.211 |
11.158 |
0.000 |
0.045 |
-0.164 |
Tilt |
-0.012 |
0.000 |
0.000 |
0.047 |
0.000 |
0.000 |
Roll |
0.000 |
-0.088 |
0.045 |
0.000 |
0.033 |
0.014 |
Twist |
0.000 |
-0.113 |
-0.164 |
0.000 |
0.014 |
0.049 |
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 |
1.112 |
0.000 |
0.000 |
-0.117 |
0.000 |
0.000 |
Slide |
0.000 |
3.418 |
0.418 |
0.000 |
0.007 |
-0.138 |
Rise |
0.000 |
0.418 |
8.338 |
0.000 |
-0.128 |
-0.270 |
Tilt |
-0.117 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
0.007 |
-0.128 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.138 |
-0.270 |
0.000 |
0.009 |
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 |
1.104 |
0.000 |
0.000 |
-0.111 |
0.000 |
0.000 |
Slide |
0.000 |
3.032 |
0.596 |
0.000 |
-0.003 |
-0.133 |
Rise |
0.000 |
0.596 |
8.824 |
0.000 |
-0.142 |
-0.275 |
Tilt |
-0.111 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.003 |
-0.142 |
0.000 |
0.022 |
0.009 |
Twist |
0.000 |
-0.133 |
-0.275 |
0.000 |
0.009 |
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 |
1.094 |
0.000 |
0.000 |
-0.141 |
0.000 |
0.000 |
Slide |
0.000 |
3.037 |
0.813 |
0.000 |
0.021 |
-0.130 |
Rise |
0.000 |
0.813 |
8.094 |
0.000 |
-0.077 |
-0.243 |
Tilt |
-0.141 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
0.021 |
-0.077 |
0.000 |
0.018 |
0.007 |
Twist |
0.000 |
-0.130 |
-0.243 |
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 |
1.124 |
0.000 |
0.000 |
-0.116 |
0.000 |
0.000 |
Slide |
0.000 |
3.250 |
0.604 |
0.000 |
0.000 |
-0.135 |
Rise |
0.000 |
0.604 |
8.440 |
0.000 |
-0.128 |
-0.279 |
Tilt |
-0.116 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
0.000 |
-0.128 |
0.000 |
0.020 |
0.009 |
Twist |
0.000 |
-0.135 |
-0.279 |
0.000 |
0.009 |
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 |
0.877 |
0.000 |
0.000 |
-0.108 |
0.000 |
0.000 |
Slide |
0.000 |
2.299 |
1.509 |
0.000 |
-0.037 |
-0.096 |
Rise |
0.000 |
1.509 |
8.738 |
0.000 |
-0.039 |
-0.179 |
Tilt |
-0.108 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
-0.037 |
-0.039 |
0.000 |
0.022 |
0.010 |
Twist |
0.000 |
-0.096 |
-0.179 |
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 |
0.916 |
0.000 |
0.000 |
-0.097 |
0.000 |
0.000 |
Slide |
0.000 |
2.257 |
1.028 |
0.000 |
-0.030 |
-0.131 |
Rise |
0.000 |
1.028 |
8.306 |
0.000 |
-0.025 |
-0.168 |
Tilt |
-0.097 |
0.000 |
0.000 |
0.037 |
0.000 |
0.000 |
Roll |
0.000 |
-0.030 |
-0.025 |
0.000 |
0.023 |
0.010 |
Twist |
0.000 |
-0.131 |
-0.168 |
0.000 |
0.010 |
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 |
0.933 |
0.000 |
0.000 |
-0.127 |
0.000 |
0.000 |
Slide |
0.000 |
2.127 |
1.782 |
0.000 |
-0.040 |
-0.086 |
Rise |
0.000 |
1.782 |
8.992 |
0.000 |
-0.035 |
-0.206 |
Tilt |
-0.127 |
0.000 |
0.000 |
0.037 |
0.000 |
0.000 |
Roll |
0.000 |
-0.040 |
-0.035 |
0.000 |
0.025 |
0.013 |
Twist |
0.000 |
-0.086 |
-0.206 |
0.000 |
0.013 |
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 |
0.938 |
0.000 |
0.000 |
-0.100 |
0.000 |
0.000 |
Slide |
0.000 |
2.138 |
1.634 |
0.000 |
-0.042 |
-0.116 |
Rise |
0.000 |
1.634 |
8.486 |
0.000 |
-0.037 |
-0.180 |
Tilt |
-0.100 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
-0.042 |
-0.037 |
0.000 |
0.022 |
0.011 |
Twist |
0.000 |
-0.116 |
-0.180 |
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 |
0.844 |
0.000 |
0.000 |
-0.105 |
0.000 |
0.000 |
Slide |
0.000 |
2.349 |
1.682 |
0.000 |
-0.029 |
-0.108 |
Rise |
0.000 |
1.682 |
8.471 |
0.000 |
-0.043 |
-0.159 |
Tilt |
-0.105 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.029 |
-0.043 |
0.000 |
0.022 |
0.008 |
Twist |
0.000 |
-0.108 |
-0.159 |
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)
| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.942 |
0.000 |
0.000 |
-0.108 |
0.000 |
0.000 |
Slide |
0.000 |
2.183 |
1.742 |
0.000 |
-0.048 |
-0.118 |
Rise |
0.000 |
1.742 |
8.705 |
0.000 |
-0.030 |
-0.193 |
Tilt |
-0.108 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.048 |
-0.030 |
0.000 |
0.022 |
0.010 |
Twist |
0.000 |
-0.118 |
-0.193 |
0.000 |
0.010 |
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)
| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.924 |
0.000 |
0.000 |
-0.094 |
0.000 |
0.000 |
Slide |
0.000 |
2.121 |
1.590 |
0.000 |
-0.048 |
-0.113 |
Rise |
0.000 |
1.590 |
8.132 |
0.000 |
-0.035 |
-0.178 |
Tilt |
-0.094 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.048 |
-0.035 |
0.000 |
0.022 |
0.011 |
Twist |
0.000 |
-0.113 |
-0.178 |
0.000 |
0.011 |
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)