| Shift | Slide | Rise | Tilt | Roll | Twist |
| Shift |
0.839 |
0.000 |
0.000 |
-0.006 |
0.000 |
0.000 |
| Slide |
0.000 |
3.466 |
2.562 |
0.000 |
0.031 |
-0.112 |
| Rise |
0.000 |
2.562 |
9.762 |
0.000 |
0.072 |
-0.231 |
| Tilt |
-0.006 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
| Roll |
0.000 |
0.031 |
0.072 |
0.000 |
0.023 |
0.011 |
| Twist |
0.000 |
-0.112 |
-0.231 |
0.000 |
0.011 |
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 |
0.802 |
0.000 |
0.000 |
-0.034 |
0.000 |
0.000 |
| Slide |
0.000 |
3.890 |
2.761 |
0.000 |
0.039 |
-0.103 |
| Rise |
0.000 |
2.761 |
9.960 |
0.000 |
0.084 |
-0.208 |
| Tilt |
-0.034 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
| Roll |
0.000 |
0.039 |
0.084 |
0.000 |
0.025 |
0.011 |
| Twist |
0.000 |
-0.103 |
-0.208 |
0.000 |
0.011 |
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 |
0.876 |
0.000 |
0.000 |
-0.012 |
0.000 |
0.000 |
| Slide |
0.000 |
3.343 |
2.661 |
0.000 |
0.019 |
-0.089 |
| Rise |
0.000 |
2.661 |
9.759 |
0.000 |
0.067 |
-0.235 |
| Tilt |
-0.012 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
| Roll |
0.000 |
0.019 |
0.067 |
0.000 |
0.023 |
0.011 |
| Twist |
0.000 |
-0.089 |
-0.235 |
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 |
1.400 |
0.000 |
0.000 |
-0.084 |
0.000 |
0.000 |
| Slide |
0.000 |
1.804 |
1.138 |
0.000 |
-0.064 |
-0.016 |
| Rise |
0.000 |
1.138 |
6.769 |
0.000 |
-0.044 |
-0.100 |
| Tilt |
-0.084 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.064 |
-0.044 |
0.000 |
0.022 |
0.004 |
| Twist |
0.000 |
-0.016 |
-0.100 |
0.000 |
0.004 |
0.015 |
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 |
1.359 |
0.000 |
0.000 |
-0.088 |
0.000 |
0.000 |
| Slide |
0.000 |
2.373 |
0.803 |
0.000 |
0.002 |
-0.069 |
| Rise |
0.000 |
0.803 |
7.304 |
0.000 |
-0.105 |
-0.253 |
| Tilt |
-0.088 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
| Roll |
0.000 |
0.002 |
-0.105 |
0.000 |
0.020 |
0.007 |
| Twist |
0.000 |
-0.069 |
-0.253 |
0.000 |
0.007 |
0.016 |
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 |
0.885 |
0.000 |
0.000 |
-0.026 |
0.000 |
0.000 |
| Slide |
0.000 |
1.118 |
-0.372 |
0.000 |
0.038 |
0.044 |
| Rise |
0.000 |
-0.370 |
5.033 |
0.000 |
0.012 |
-0.023 |
| Tilt |
-0.026 |
0.000 |
0.000 |
0.015 |
0.000 |
0.000 |
| Roll |
0.000 |
0.038 |
0.012 |
0.000 |
0.017 |
-0.000 |
| Twist |
0.000 |
0.044 |
-0.023 |
0.000 |
-0.000 |
0.003 |
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 |
1.329 |
0.000 |
0.000 |
-0.104 |
0.000 |
0.000 |
| Slide |
0.000 |
2.116 |
1.090 |
0.000 |
0.006 |
-0.073 |
| Rise |
0.000 |
1.090 |
6.977 |
0.000 |
-0.087 |
-0.251 |
| Tilt |
-0.104 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
| Roll |
0.000 |
0.006 |
-0.087 |
0.000 |
0.019 |
0.007 |
| Twist |
0.000 |
-0.073 |
-0.251 |
0.000 |
0.007 |
0.017 |
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 |
1.309 |
0.000 |
0.000 |
-0.100 |
0.000 |
0.000 |
| Slide |
0.000 |
2.187 |
0.894 |
0.000 |
0.005 |
-0.068 |
| Rise |
0.000 |
0.894 |
6.773 |
0.000 |
-0.080 |
-0.237 |
| Tilt |
-0.100 |
0.000 |
0.000 |
0.028 |
0.000 |
0.000 |
| Roll |
0.000 |
0.005 |
-0.080 |
0.000 |
0.017 |
0.006 |
| Twist |
0.000 |
-0.068 |
-0.237 |
0.000 |
0.006 |
0.016 |
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 |
1.231 |
0.000 |
0.000 |
-0.084 |
0.000 |
0.000 |
| Slide |
0.000 |
2.126 |
1.553 |
0.000 |
-0.037 |
-0.171 |
| Rise |
0.000 |
1.553 |
7.768 |
0.000 |
-0.034 |
-0.189 |
| Tilt |
-0.084 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.037 |
-0.034 |
0.000 |
0.023 |
0.012 |
| Twist |
0.000 |
-0.171 |
-0.189 |
0.000 |
0.012 |
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 |
1.271 |
0.000 |
0.000 |
-0.055 |
0.000 |
0.000 |
| Slide |
0.000 |
1.873 |
1.346 |
0.000 |
-0.033 |
-0.125 |
| Rise |
0.000 |
1.346 |
7.223 |
0.000 |
-0.057 |
-0.172 |
| Tilt |
-0.055 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.033 |
-0.057 |
0.000 |
0.022 |
0.013 |
| Twist |
0.000 |
-0.125 |
-0.172 |
0.000 |
0.013 |
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 |
1.107 |
0.000 |
0.000 |
-0.145 |
0.000 |
0.000 |
| Slide |
0.000 |
0.887 |
0.945 |
0.000 |
0.003 |
0.005 |
| Rise |
0.000 |
0.945 |
7.829 |
0.000 |
-0.031 |
-0.165 |
| Tilt |
-0.145 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
| Roll |
0.000 |
0.003 |
-0.031 |
0.000 |
0.025 |
0.008 |
| Twist |
0.000 |
0.005 |
-0.165 |
0.000 |
0.008 |
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 |
1.179 |
0.000 |
0.000 |
-0.077 |
0.000 |
0.000 |
| Slide |
0.000 |
2.136 |
1.467 |
0.000 |
-0.045 |
-0.166 |
| Rise |
0.000 |
1.467 |
7.721 |
0.000 |
-0.033 |
-0.182 |
| Tilt |
-0.077 |
0.000 |
0.000 |
0.029 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.045 |
-0.033 |
0.000 |
0.022 |
0.012 |
| Twist |
0.000 |
-0.166 |
-0.182 |
0.000 |
0.012 |
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 |
0.991 |
0.000 |
0.000 |
-0.078 |
0.000 |
0.000 |
| Slide |
0.000 |
1.342 |
1.500 |
0.000 |
-0.015 |
-0.069 |
| Rise |
0.000 |
1.500 |
7.181 |
0.000 |
-0.035 |
-0.194 |
| Tilt |
-0.078 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.015 |
-0.035 |
0.000 |
0.022 |
0.010 |
| Twist |
0.000 |
-0.069 |
-0.194 |
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 |
0.921 |
0.000 |
0.000 |
-0.079 |
0.000 |
0.000 |
| Slide |
0.000 |
1.526 |
1.600 |
0.000 |
-0.014 |
-0.082 |
| Rise |
0.000 |
1.600 |
7.782 |
0.000 |
-0.030 |
-0.208 |
| Tilt |
-0.079 |
0.000 |
0.000 |
0.037 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.014 |
-0.030 |
0.000 |
0.021 |
0.009 |
| Twist |
0.000 |
-0.082 |
-0.208 |
0.000 |
0.009 |
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 |
1.063 |
0.000 |
0.000 |
-0.083 |
0.000 |
0.000 |
| Slide |
0.000 |
1.335 |
1.624 |
0.000 |
-0.018 |
-0.068 |
| Rise |
0.000 |
1.624 |
7.181 |
0.000 |
-0.047 |
-0.199 |
| Tilt |
-0.083 |
0.000 |
0.000 |
0.036 |
0.000 |
0.000 |
| Roll |
0.000 |
-0.018 |
-0.047 |
0.000 |
0.021 |
0.009 |
| Twist |
0.000 |
-0.068 |
-0.199 |
0.000 |
0.009 |
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)