| Shift | Slide | Rise | Tilt | Roll | Twist |
Shift |
0.881 |
0.000 |
0.000 |
-0.065 |
0.000 |
0.000 |
Slide |
0.000 |
2.444 |
1.157 |
0.000 |
-0.077 |
-0.146 |
Rise |
0.000 |
1.157 |
7.793 |
0.000 |
-0.041 |
-0.197 |
Tilt |
-0.065 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.077 |
-0.041 |
0.000 |
0.023 |
0.011 |
Twist |
0.000 |
-0.146 |
-0.197 |
0.000 |
0.011 |
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 |
1.440 |
0.000 |
0.000 |
-0.079 |
0.000 |
0.000 |
Slide |
0.000 |
3.235 |
1.163 |
0.000 |
-0.052 |
-0.212 |
Rise |
0.000 |
1.163 |
8.153 |
0.000 |
-0.050 |
-0.170 |
Tilt |
-0.079 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.052 |
-0.050 |
0.000 |
0.022 |
0.008 |
Twist |
0.000 |
-0.212 |
-0.170 |
0.000 |
0.008 |
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 |
0.964 |
0.000 |
0.000 |
-0.051 |
0.000 |
0.000 |
Slide |
0.000 |
3.525 |
2.891 |
0.000 |
0.021 |
-0.095 |
Rise |
0.000 |
2.891 |
10.134 |
0.000 |
0.067 |
-0.218 |
Tilt |
-0.051 |
0.000 |
0.000 |
0.041 |
0.000 |
0.000 |
Roll |
0.000 |
0.021 |
0.067 |
0.000 |
0.024 |
0.007 |
Twist |
0.000 |
-0.095 |
-0.218 |
0.000 |
0.007 |
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 |
1.000 |
0.000 |
0.000 |
0.018 |
0.000 |
0.000 |
Slide |
0.000 |
4.124 |
2.592 |
0.000 |
-0.025 |
-0.038 |
Rise |
0.000 |
2.592 |
11.112 |
0.000 |
0.086 |
-0.132 |
Tilt |
0.018 |
0.000 |
0.000 |
0.040 |
0.000 |
0.000 |
Roll |
0.000 |
-0.025 |
0.086 |
0.000 |
0.026 |
0.008 |
Twist |
0.000 |
-0.038 |
-0.132 |
0.000 |
0.008 |
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 |
0.914 |
0.000 |
0.000 |
0.021 |
0.000 |
0.000 |
Slide |
0.000 |
4.736 |
2.707 |
0.000 |
-0.050 |
-0.080 |
Rise |
0.000 |
2.707 |
11.230 |
0.000 |
0.062 |
-0.159 |
Tilt |
0.021 |
0.000 |
0.000 |
0.042 |
0.000 |
0.000 |
Roll |
0.000 |
-0.050 |
0.062 |
0.000 |
0.026 |
0.015 |
Twist |
0.000 |
-0.080 |
-0.159 |
0.000 |
0.015 |
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 |
1.354 |
0.000 |
0.000 |
-0.104 |
0.000 |
0.000 |
Slide |
0.000 |
1.737 |
1.728 |
0.000 |
-0.006 |
-0.117 |
Rise |
0.000 |
1.728 |
7.608 |
0.000 |
-0.015 |
-0.148 |
Tilt |
-0.104 |
0.000 |
0.000 |
0.039 |
0.000 |
0.000 |
Roll |
0.000 |
-0.006 |
-0.015 |
0.000 |
0.023 |
0.005 |
Twist |
0.000 |
-0.117 |
-0.148 |
0.000 |
0.005 |
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 |
1.573 |
0.000 |
0.000 |
-0.082 |
0.000 |
0.000 |
Slide |
0.000 |
1.942 |
1.721 |
0.000 |
-0.012 |
-0.121 |
Rise |
0.000 |
1.721 |
6.828 |
0.000 |
-0.024 |
-0.117 |
Tilt |
-0.082 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.012 |
-0.024 |
0.000 |
0.023 |
0.005 |
Twist |
0.000 |
-0.121 |
-0.117 |
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 |
0.882 |
0.000 |
0.000 |
-0.108 |
0.000 |
0.000 |
Slide |
0.000 |
2.456 |
0.989 |
0.000 |
0.017 |
-0.097 |
Rise |
0.000 |
0.989 |
6.907 |
0.000 |
-0.060 |
-0.233 |
Tilt |
-0.108 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
0.017 |
-0.060 |
0.000 |
0.015 |
0.004 |
Twist |
0.000 |
-0.097 |
-0.233 |
0.000 |
0.004 |
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 |
0.787 |
0.000 |
0.000 |
-0.088 |
0.000 |
0.000 |
Slide |
0.000 |
2.219 |
1.248 |
0.000 |
-0.053 |
-0.108 |
Rise |
0.000 |
1.248 |
8.164 |
0.000 |
-0.023 |
-0.192 |
Tilt |
-0.088 |
0.000 |
0.000 |
0.030 |
0.000 |
0.000 |
Roll |
0.000 |
-0.053 |
-0.023 |
0.000 |
0.018 |
0.005 |
Twist |
0.000 |
-0.108 |
-0.192 |
0.000 |
0.005 |
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 |
0.824 |
0.000 |
0.000 |
-0.097 |
0.000 |
0.000 |
Slide |
0.000 |
2.237 |
1.888 |
0.000 |
-0.048 |
-0.120 |
Rise |
0.000 |
1.888 |
8.023 |
0.000 |
-0.001 |
-0.193 |
Tilt |
-0.097 |
0.000 |
0.000 |
0.034 |
0.000 |
0.000 |
Roll |
0.000 |
-0.048 |
-0.001 |
0.000 |
0.019 |
0.005 |
Twist |
0.000 |
-0.120 |
-0.193 |
0.000 |
0.005 |
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 |
1.304 |
0.000 |
0.000 |
-0.133 |
0.000 |
0.000 |
Slide |
0.000 |
2.601 |
2.769 |
0.000 |
0.050 |
-0.034 |
Rise |
0.000 |
2.769 |
11.214 |
0.000 |
0.130 |
-0.217 |
Tilt |
-0.133 |
0.000 |
0.000 |
0.043 |
0.000 |
0.000 |
Roll |
0.000 |
0.050 |
0.130 |
0.000 |
0.027 |
0.007 |
Twist |
0.000 |
-0.034 |
-0.217 |
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 |
0.452 |
0.000 |
0.000 |
-0.046 |
0.000 |
0.000 |
Slide |
0.000 |
2.077 |
1.045 |
0.000 |
0.007 |
-0.134 |
Rise |
0.000 |
1.045 |
7.823 |
0.000 |
-0.075 |
-0.202 |
Tilt |
-0.046 |
0.000 |
0.000 |
0.021 |
0.000 |
0.000 |
Roll |
0.000 |
0.007 |
-0.075 |
0.000 |
0.014 |
0.009 |
Twist |
0.000 |
-0.134 |
-0.202 |
0.000 |
0.009 |
0.027 |
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 |
0.468 |
0.000 |
0.000 |
-0.047 |
0.000 |
0.000 |
Slide |
0.000 |
2.004 |
1.292 |
0.000 |
0.018 |
-0.102 |
Rise |
0.000 |
1.292 |
6.295 |
0.000 |
-0.102 |
-0.245 |
Tilt |
-0.047 |
0.000 |
0.000 |
0.020 |
0.000 |
0.000 |
Roll |
0.000 |
0.018 |
-0.102 |
0.000 |
0.013 |
0.008 |
Twist |
0.000 |
-0.102 |
-0.245 |
0.000 |
0.008 |
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 |
0.399 |
0.000 |
0.000 |
-0.044 |
0.000 |
0.000 |
Slide |
0.000 |
2.053 |
0.941 |
0.000 |
0.013 |
-0.114 |
Rise |
0.000 |
0.941 |
7.948 |
0.000 |
-0.086 |
-0.227 |
Tilt |
-0.044 |
0.000 |
0.000 |
0.025 |
0.000 |
0.000 |
Roll |
0.000 |
0.013 |
-0.086 |
0.000 |
0.016 |
0.012 |
Twist |
0.000 |
-0.114 |
-0.227 |
0.000 |
0.012 |
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 |
0.420 |
0.000 |
0.000 |
-0.041 |
0.000 |
0.000 |
Slide |
0.000 |
2.010 |
1.320 |
0.000 |
0.006 |
-0.110 |
Rise |
0.000 |
1.320 |
7.411 |
0.000 |
-0.101 |
-0.238 |
Tilt |
-0.041 |
0.000 |
0.000 |
0.021 |
0.000 |
0.000 |
Roll |
0.000 |
0.006 |
-0.101 |
0.000 |
0.016 |
0.011 |
Twist |
0.000 |
-0.110 |
-0.238 |
0.000 |
0.011 |
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)