| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.083 |
0.000 |
0.000 |
-0.129 |
0.000 |
0.000 |
Slide |
0.000 |
1.583 |
1.600 |
0.000 |
-0.007 |
-0.123 |
Rise |
0.000 |
1.600 |
7.674 |
0.000 |
-0.008 |
-0.186 |
Tilt |
-0.129 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
-0.007 |
-0.008 |
0.000 |
0.022 |
0.009 |
Twist |
0.000 |
-0.123 |
-0.186 |
0.000 |
0.009 |
0.031 |
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 |
1.519 |
0.000 |
0.000 |
-0.113 |
0.000 |
0.000 |
Slide |
0.000 |
2.185 |
1.158 |
0.000 |
-0.001 |
-0.059 |
Rise |
0.000 |
1.158 |
6.721 |
0.000 |
-0.103 |
-0.251 |
Tilt |
-0.113 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
-0.001 |
-0.103 |
0.000 |
0.021 |
0.008 |
Twist |
0.000 |
-0.059 |
-0.251 |
0.000 |
0.008 |
0.019 |
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 |
1.485 |
0.000 |
0.000 |
-0.099 |
0.000 |
0.000 |
Slide |
0.000 |
2.436 |
0.733 |
0.000 |
0.008 |
-0.059 |
Rise |
0.000 |
0.733 |
7.535 |
0.000 |
-0.110 |
-0.265 |
Tilt |
-0.099 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
0.008 |
-0.110 |
0.000 |
0.022 |
0.007 |
Twist |
0.000 |
-0.059 |
-0.265 |
0.000 |
0.007 |
0.018 |
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 |
1.222 |
0.000 |
0.000 |
-0.110 |
0.000 |
0.000 |
Slide |
0.000 |
1.951 |
0.904 |
0.000 |
0.005 |
-0.063 |
Rise |
0.000 |
0.904 |
6.825 |
0.000 |
-0.079 |
-0.235 |
Tilt |
-0.110 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
0.005 |
-0.079 |
0.000 |
0.018 |
0.007 |
Twist |
0.000 |
-0.063 |
-0.235 |
0.000 |
0.007 |
0.018 |
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 |
1.271 |
0.000 |
0.000 |
-0.111 |
0.000 |
0.000 |
Slide |
0.000 |
2.279 |
0.557 |
0.000 |
0.016 |
-0.071 |
Rise |
0.000 |
0.557 |
7.265 |
0.000 |
-0.096 |
-0.254 |
Tilt |
-0.111 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
0.016 |
-0.096 |
0.000 |
0.020 |
0.007 |
Twist |
0.000 |
-0.071 |
-0.254 |
0.000 |
0.007 |
0.019 |
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 |
1.477 |
0.000 |
0.000 |
-0.102 |
0.000 |
0.000 |
Slide |
0.000 |
2.355 |
0.772 |
0.000 |
0.008 |
-0.055 |
Rise |
0.000 |
0.772 |
7.615 |
0.000 |
-0.103 |
-0.264 |
Tilt |
-0.102 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
0.008 |
-0.103 |
0.000 |
0.021 |
0.007 |
Twist |
0.000 |
-0.055 |
-0.264 |
0.000 |
0.007 |
0.018 |
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 |
1.510 |
0.000 |
0.000 |
-0.119 |
0.000 |
0.000 |
Slide |
0.000 |
2.275 |
1.080 |
0.000 |
0.005 |
-0.059 |
Rise |
0.000 |
1.080 |
7.057 |
0.000 |
-0.084 |
-0.251 |
Tilt |
-0.119 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
0.005 |
-0.084 |
0.000 |
0.021 |
0.007 |
Twist |
0.000 |
-0.059 |
-0.251 |
0.000 |
0.007 |
0.018 |
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 |
1.535 |
0.000 |
0.000 |
-0.103 |
0.000 |
0.000 |
Slide |
0.000 |
2.379 |
0.855 |
0.000 |
-0.003 |
-0.059 |
Rise |
0.000 |
0.855 |
7.327 |
0.000 |
-0.116 |
-0.265 |
Tilt |
-0.103 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.003 |
-0.116 |
0.000 |
0.022 |
0.008 |
Twist |
0.000 |
-0.059 |
-0.265 |
0.000 |
0.008 |
0.018 |
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 |
1.287 |
0.000 |
0.000 |
-0.110 |
0.000 |
0.000 |
Slide |
0.000 |
3.117 |
2.072 |
0.000 |
0.089 |
-0.166 |
Rise |
0.000 |
2.072 |
10.180 |
0.000 |
0.164 |
-0.248 |
Tilt |
-0.110 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
0.089 |
0.164 |
0.000 |
0.022 |
0.005 |
Twist |
0.000 |
-0.166 |
-0.248 |
0.000 |
0.005 |
0.036 |
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 |
1.296 |
0.000 |
0.000 |
-0.106 |
0.000 |
0.000 |
Slide |
0.000 |
3.099 |
1.949 |
0.000 |
0.091 |
-0.157 |
Rise |
0.000 |
1.949 |
10.181 |
0.000 |
0.159 |
-0.253 |
Tilt |
-0.106 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
0.091 |
0.159 |
0.000 |
0.022 |
0.005 |
Twist |
0.000 |
-0.157 |
-0.253 |
0.000 |
0.005 |
0.036 |
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 |
1.261 |
0.000 |
0.000 |
-0.111 |
0.000 |
0.000 |
Slide |
0.000 |
3.197 |
2.199 |
0.000 |
0.084 |
-0.154 |
Rise |
0.000 |
2.198 |
10.555 |
0.000 |
0.152 |
-0.270 |
Tilt |
-0.111 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
0.084 |
0.152 |
0.000 |
0.023 |
0.006 |
Twist |
0.000 |
-0.154 |
-0.270 |
0.000 |
0.006 |
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 |
1.311 |
0.000 |
0.000 |
-0.107 |
0.000 |
0.000 |
Slide |
0.000 |
3.306 |
2.166 |
0.000 |
0.087 |
-0.171 |
Rise |
0.000 |
2.166 |
10.637 |
0.000 |
0.159 |
-0.252 |
Tilt |
-0.107 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
0.087 |
0.159 |
0.000 |
0.023 |
0.006 |
Twist |
0.000 |
-0.171 |
-0.252 |
0.000 |
0.006 |
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 |
1.324 |
0.000 |
0.000 |
-0.113 |
0.000 |
0.000 |
Slide |
0.000 |
3.092 |
1.967 |
0.000 |
0.084 |
-0.151 |
Rise |
0.000 |
1.967 |
10.127 |
0.000 |
0.149 |
-0.265 |
Tilt |
-0.113 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
0.084 |
0.149 |
0.000 |
0.023 |
0.006 |
Twist |
0.000 |
-0.151 |
-0.265 |
0.000 |
0.006 |
0.036 |
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 |
1.336 |
0.000 |
0.000 |
-0.113 |
0.000 |
0.000 |
Slide |
0.000 |
3.077 |
2.131 |
0.000 |
0.084 |
-0.160 |
Rise |
0.000 |
2.131 |
10.213 |
0.000 |
0.167 |
-0.254 |
Tilt |
-0.113 |
0.000 |
0.000 |
0.045 |
0.000 |
0.000 |
Roll |
0.000 |
0.084 |
0.167 |
0.000 |
0.022 |
0.006 |
Twist |
0.000 |
-0.160 |
-0.254 |
0.000 |
0.006 |
0.036 |
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 |
0.615 |
0.000 |
0.000 |
-0.032 |
0.000 |
0.000 |
Slide |
0.000 |
0.823 |
0.615 |
0.000 |
-0.003 |
0.008 |
Rise |
0.000 |
0.614 |
6.151 |
0.000 |
-0.073 |
-0.106 |
Tilt |
-0.032 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
-0.003 |
-0.073 |
0.000 |
0.016 |
0.004 |
Twist |
0.000 |
0.008 |
-0.106 |
0.000 |
0.004 |
0.006 |
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)