| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
1.022 |
0.000 |
0.000 |
-0.035 |
0.000 |
0.000 |
Slide |
0.000 |
2.000 |
1.599 |
0.000 |
-0.069 |
-0.057 |
Rise |
0.000 |
1.599 |
6.952 |
0.000 |
-0.039 |
-0.169 |
Tilt |
-0.035 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.069 |
-0.039 |
0.000 |
0.020 |
0.005 |
Twist |
0.000 |
-0.057 |
-0.169 |
0.000 |
0.005 |
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 |
1.200 |
0.000 |
0.000 |
-0.044 |
0.000 |
0.000 |
Slide |
0.000 |
2.161 |
1.721 |
0.000 |
-0.078 |
-0.096 |
Rise |
0.000 |
1.721 |
7.132 |
0.000 |
-0.020 |
-0.161 |
Tilt |
-0.044 |
0.000 |
0.000 |
0.031 |
0.000 |
0.000 |
Roll |
0.000 |
-0.078 |
-0.020 |
0.000 |
0.023 |
0.003 |
Twist |
0.000 |
-0.096 |
-0.161 |
0.000 |
0.003 |
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 |
0.619 |
0.000 |
0.000 |
-0.057 |
0.000 |
0.000 |
Slide |
0.000 |
2.196 |
1.643 |
0.000 |
-0.073 |
-0.104 |
Rise |
0.000 |
1.643 |
8.518 |
0.000 |
-0.062 |
-0.193 |
Tilt |
-0.057 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.073 |
-0.062 |
0.000 |
0.020 |
0.007 |
Twist |
0.000 |
-0.104 |
-0.193 |
0.000 |
0.007 |
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 |
1.353 |
0.000 |
0.000 |
-0.054 |
0.000 |
0.000 |
Slide |
0.000 |
2.295 |
1.682 |
0.000 |
-0.082 |
-0.068 |
Rise |
0.000 |
1.682 |
8.189 |
0.000 |
-0.073 |
-0.199 |
Tilt |
-0.054 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.082 |
-0.073 |
0.000 |
0.024 |
0.006 |
Twist |
0.000 |
-0.068 |
-0.199 |
0.000 |
0.006 |
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 |
0.926 |
0.000 |
0.000 |
-0.034 |
0.000 |
0.000 |
Slide |
0.000 |
1.984 |
1.817 |
0.000 |
-0.062 |
-0.057 |
Rise |
0.000 |
1.817 |
7.474 |
0.000 |
-0.066 |
-0.196 |
Tilt |
-0.034 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.062 |
-0.066 |
0.000 |
0.020 |
0.006 |
Twist |
0.000 |
-0.057 |
-0.196 |
0.000 |
0.006 |
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 |
0.659 |
0.000 |
0.000 |
-0.059 |
0.000 |
0.000 |
Slide |
0.000 |
2.170 |
1.609 |
0.000 |
-0.063 |
-0.115 |
Rise |
0.000 |
1.609 |
8.193 |
0.000 |
-0.040 |
-0.182 |
Tilt |
-0.059 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.063 |
-0.040 |
0.000 |
0.019 |
0.005 |
Twist |
0.000 |
-0.115 |
-0.182 |
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 |
0.904 |
0.000 |
0.000 |
-0.073 |
0.000 |
0.000 |
Slide |
0.000 |
2.089 |
1.044 |
0.000 |
-0.037 |
-0.140 |
Rise |
0.000 |
1.044 |
8.205 |
0.000 |
-0.049 |
-0.165 |
Tilt |
-0.073 |
0.000 |
0.000 |
0.035 |
0.000 |
0.000 |
Roll |
0.000 |
-0.037 |
-0.049 |
0.000 |
0.020 |
0.011 |
Twist |
0.000 |
-0.140 |
-0.165 |
0.000 |
0.011 |
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 |
0.921 |
0.000 |
0.000 |
-0.080 |
0.000 |
0.000 |
Slide |
0.000 |
1.998 |
0.876 |
0.000 |
-0.024 |
-0.110 |
Rise |
0.000 |
0.876 |
8.066 |
0.000 |
-0.032 |
-0.159 |
Tilt |
-0.080 |
0.000 |
0.000 |
0.032 |
0.000 |
0.000 |
Roll |
0.000 |
-0.024 |
-0.032 |
0.000 |
0.019 |
0.006 |
Twist |
0.000 |
-0.110 |
-0.159 |
0.000 |
0.006 |
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 |
1.234 |
0.000 |
0.000 |
-0.107 |
0.000 |
0.000 |
Slide |
0.000 |
2.236 |
1.700 |
0.000 |
0.050 |
-0.067 |
Rise |
0.000 |
1.700 |
10.044 |
0.000 |
0.134 |
-0.174 |
Tilt |
-0.107 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
Roll |
0.000 |
0.050 |
0.134 |
0.000 |
0.025 |
0.006 |
Twist |
0.000 |
-0.067 |
-0.174 |
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 |
1.261 |
0.000 |
0.000 |
-0.083 |
0.000 |
0.000 |
Slide |
0.000 |
1.471 |
1.455 |
0.000 |
-0.006 |
-0.083 |
Rise |
0.000 |
1.455 |
6.308 |
0.000 |
-0.043 |
-0.139 |
Tilt |
-0.083 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
Roll |
0.000 |
-0.006 |
-0.043 |
0.000 |
0.017 |
0.004 |
Twist |
0.000 |
-0.083 |
-0.139 |
0.000 |
0.004 |
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 |
0.383 |
0.000 |
0.000 |
-0.044 |
0.000 |
0.000 |
Slide |
0.000 |
2.202 |
0.697 |
0.000 |
0.014 |
-0.119 |
Rise |
0.000 |
0.697 |
8.645 |
0.000 |
-0.111 |
-0.244 |
Tilt |
-0.044 |
0.000 |
0.000 |
0.024 |
0.000 |
0.000 |
Roll |
0.000 |
0.014 |
-0.111 |
0.000 |
0.017 |
0.012 |
Twist |
0.000 |
-0.119 |
-0.244 |
0.000 |
0.012 |
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 |
0.904 |
0.000 |
0.000 |
-0.074 |
0.000 |
0.000 |
Slide |
0.000 |
1.853 |
0.897 |
0.000 |
-0.033 |
-0.120 |
Rise |
0.000 |
0.897 |
7.883 |
0.000 |
-0.044 |
-0.164 |
Tilt |
-0.074 |
0.000 |
0.000 |
0.037 |
0.000 |
0.000 |
Roll |
0.000 |
-0.033 |
-0.044 |
0.000 |
0.021 |
0.011 |
Twist |
0.000 |
-0.120 |
-0.164 |
0.000 |
0.011 |
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 |
0.867 |
0.000 |
0.000 |
-0.068 |
0.000 |
0.000 |
Slide |
0.000 |
2.024 |
1.224 |
0.000 |
-0.030 |
-0.123 |
Rise |
0.000 |
1.224 |
8.326 |
0.000 |
-0.039 |
-0.176 |
Tilt |
-0.068 |
0.000 |
0.000 |
0.033 |
0.000 |
0.000 |
Roll |
0.000 |
-0.030 |
-0.039 |
0.000 |
0.020 |
0.011 |
Twist |
0.000 |
-0.123 |
-0.176 |
0.000 |
0.011 |
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)