|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 1.636 | 0.488 | 0.209 | -0.020 | 0.005 | 0.041 | 
| Slide | 0.488 | 2.617 | -0.593 | 0.068 | -0.033 | -0.129 | 
| Rise | 0.209 | -0.593 | 7.418 | -0.230 | 0.124 | -0.031 | 
| Tilt | -0.020 | 0.068 | -0.230 | 0.044 | -0.008 | -0.003 | 
| Roll | 0.005 | -0.033 | 0.124 | -0.008 | 0.020 | 0.004 | 
| Twist | 0.041 | -0.129 | -0.031 | -0.003 | 0.004 | 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 | 2.282 | 0.480 | 0.862 | -0.046 | 0.039 | -0.038 | 
| Slide | 0.480 | 5.043 | 1.592 | -0.083 | -0.018 | -0.303 | 
| Rise | 0.862 | 1.592 | 8.150 | -0.278 | 0.063 | -0.209 | 
| Tilt | -0.046 | -0.083 | -0.278 | 0.047 | -0.006 | 0.012 | 
| Roll | 0.039 | -0.018 | 0.063 | -0.006 | 0.019 | 0.001 | 
| Twist | -0.038 | -0.303 | -0.209 | 0.012 | 0.001 | 0.070 | 
                        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 | 3.269 | 1.025 | 0.610 | -0.000 | 0.027 | -0.052 | 
| Slide | 1.025 | 4.813 | 0.591 | -0.013 | -0.003 | -0.236 | 
| Rise | 0.610 | 0.591 | 10.109 | -0.380 | 0.185 | -0.068 | 
| Tilt | -0.000 | -0.013 | -0.380 | 0.056 | -0.010 | 0.004 | 
| Roll | 0.027 | -0.003 | 0.185 | -0.010 | 0.025 | -0.001 | 
| Twist | -0.052 | -0.236 | -0.068 | 0.004 | -0.001 | 0.068 | 
                        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 | 2.884 | 0.088 | 0.252 | -0.039 | 0.021 | 0.059 | 
| Slide | 0.088 | 4.965 | 1.892 | -0.054 | 0.005 | -0.310 | 
| Rise | 0.252 | 1.892 | 4.376 | -0.112 | -0.028 | -0.027 | 
| Tilt | -0.039 | -0.054 | -0.112 | 0.032 | 0.002 | 0.004 | 
| Roll | 0.021 | 0.005 | -0.028 | 0.002 | 0.028 | 0.003 | 
| Twist | 0.059 | -0.310 | -0.027 | 0.004 | 0.003 | 0.071 | 
                        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 | 3.260 | -0.110 | 0.879 | -0.014 | 0.006 | 0.000 | 
| Slide | -0.111 | 5.972 | -0.045 | -0.071 | -0.096 | -0.395 | 
| Rise | 0.879 | -0.045 | 10.928 | -0.283 | 0.012 | -0.079 | 
| Tilt | -0.014 | -0.071 | -0.283 | 0.040 | 0.000 | 0.004 | 
| Roll | 0.006 | -0.096 | 0.012 | 0.000 | 0.033 | 0.009 | 
| Twist | 0.000 | -0.395 | -0.079 | 0.004 | 0.009 | 0.076 | 
                        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 | 2.214 | 0.319 | 0.334 | 0.010 | -0.009 | 0.067 | 
| Slide | 0.319 | 4.362 | 0.902 | 0.023 | -0.083 | -0.267 | 
| Rise | 0.334 | 0.902 | 8.246 | -0.143 | 0.016 | -0.184 | 
| Tilt | 0.010 | 0.023 | -0.143 | 0.038 | -0.002 | 0.006 | 
| Roll | -0.009 | -0.083 | 0.016 | -0.002 | 0.021 | 0.005 | 
| Twist | 0.067 | -0.267 | -0.184 | 0.006 | 0.005 | 0.054 | 
                        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 | 2.765 | -0.161 | 0.183 | -0.029 | -0.016 | 0.015 | 
| Slide | -0.161 | 4.558 | 1.905 | -0.089 | -0.177 | -0.117 | 
| Rise | 0.183 | 1.905 | 12.500 | -0.480 | -0.196 | -0.095 | 
| Tilt | -0.029 | -0.089 | -0.480 | 0.066 | 0.008 | -0.000 | 
| Roll | -0.016 | -0.177 | -0.196 | 0.008 | 0.039 | 0.016 | 
| Twist | 0.015 | -0.117 | -0.095 | -0.000 | 0.016 | 0.061 | 
                        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 | 3.060 | 0.042 | 0.960 | -0.081 | 0.001 | 0.050 | 
| Slide | 0.042 | 5.873 | 1.066 | -0.032 | -0.053 | -0.188 | 
| Rise | 0.960 | 1.066 | 9.880 | -0.249 | -0.188 | -0.218 | 
| Tilt | -0.081 | -0.032 | -0.249 | 0.049 | 0.008 | 0.006 | 
| Roll | 0.001 | -0.053 | -0.188 | 0.008 | 0.033 | 0.011 | 
| Twist | 0.050 | -0.188 | -0.218 | 0.006 | 0.011 | 0.082 | 
                        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 | 1.895 | 0.171 | 0.505 | -0.014 | 0.002 | 0.089 | 
| Slide | 0.171 | 3.009 | 1.492 | -0.077 | -0.128 | -0.124 | 
| Rise | 0.505 | 1.492 | 9.170 | -0.147 | -0.127 | -0.203 | 
| Tilt | -0.014 | -0.077 | -0.148 | 0.034 | 0.002 | 0.007 | 
| Roll | 0.002 | -0.128 | -0.127 | 0.002 | 0.020 | 0.013 | 
| Twist | 0.089 | -0.124 | -0.203 | 0.007 | 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 | 1.856 | 0.358 | 0.574 | -0.023 | -0.032 | 0.078 | 
| Slide | 0.358 | 3.045 | 1.286 | -0.060 | -0.118 | -0.087 | 
| Rise | 0.574 | 1.286 | 9.527 | -0.174 | -0.124 | -0.253 | 
| Tilt | -0.023 | -0.060 | -0.174 | 0.034 | 0.002 | 0.009 | 
| Roll | -0.032 | -0.118 | -0.124 | 0.002 | 0.024 | 0.015 | 
| Twist | 0.078 | -0.087 | -0.253 | 0.009 | 0.015 | 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 | 2.364 | 0.982 | 0.066 | -0.059 | -0.042 | 0.029 | 
| Slide | 0.982 | 3.703 | -0.128 | -0.085 | -0.051 | -0.209 | 
| Rise | 0.066 | -0.128 | 10.066 | -0.131 | -0.077 | -0.194 | 
| Tilt | -0.059 | -0.085 | -0.131 | 0.041 | -0.001 | 0.021 | 
| Roll | -0.042 | -0.051 | -0.077 | -0.001 | 0.025 | 0.012 | 
| Twist | 0.029 | -0.209 | -0.194 | 0.021 | 0.012 | 0.067 | 
                        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 | 2.065 | 0.684 | 0.546 | -0.049 | 0.001 | 0.067 | 
| Slide | 0.684 | 3.930 | 2.072 | -0.053 | -0.101 | -0.171 | 
| Rise | 0.546 | 2.072 | 8.847 | -0.216 | -0.102 | -0.208 | 
| Tilt | -0.049 | -0.053 | -0.216 | 0.043 | 0.002 | 0.006 | 
| Roll | 0.001 | -0.101 | -0.102 | 0.002 | 0.030 | 0.009 | 
| Twist | 0.067 | -0.171 | -0.208 | 0.006 | 0.009 | 0.048 | 
                        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 | 2.502 | 0.555 | 0.522 | -0.043 | 0.030 | 0.020 | 
| Slide | 0.555 | 4.603 | 2.268 | 0.003 | -0.160 | -0.211 | 
| Rise | 0.522 | 2.268 | 12.182 | -0.271 | -0.243 | -0.203 | 
| Tilt | -0.043 | 0.003 | -0.271 | 0.048 | 0.009 | 0.006 | 
| Roll | 0.030 | -0.160 | -0.243 | 0.009 | 0.041 | 0.008 | 
| Twist | 0.020 | -0.211 | -0.203 | 0.006 | 0.008 | 0.053 | 
                        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 | 1.396 | 0.432 | 0.549 | -0.026 | 0.005 | 0.073 | 
| Slide | 0.432 | 5.249 | 2.917 | 0.002 | -0.054 | -0.098 | 
| Rise | 0.550 | 2.917 | 10.895 | 0.056 | -0.027 | -0.198 | 
| Tilt | -0.026 | 0.002 | 0.056 | 0.042 | 0.006 | 0.006 | 
| Roll | 0.005 | -0.054 | -0.027 | 0.006 | 0.027 | 0.014 | 
| Twist | 0.073 | -0.098 | -0.198 | 0.006 | 0.014 | 0.045 | 
                        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 | 1.220 | 0.358 | 0.208 | -0.016 | 0.029 | 0.079 | 
| Slide | 0.358 | 4.831 | 2.041 | -0.012 | -0.037 | -0.100 | 
| Rise | 0.208 | 2.041 | 8.780 | 0.073 | -0.073 | -0.180 | 
| Tilt | -0.016 | -0.012 | 0.073 | 0.041 | 0.006 | 0.008 | 
| Roll | 0.029 | -0.037 | -0.073 | 0.006 | 0.023 | 0.012 | 
| Twist | 0.079 | -0.100 | -0.180 | 0.008 | 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 | 1.153 | 0.575 | -0.702 | -0.060 | 0.000 | -0.041 | 
| Slide | 0.575 | 4.612 | 1.125 | 0.042 | 0.017 | -0.277 | 
| Rise | -0.702 | 1.125 | 7.029 | 0.110 | 0.044 | -0.138 | 
| Tilt | -0.060 | 0.042 | 0.110 | 0.036 | 0.008 | -0.001 | 
| Roll | 0.000 | 0.017 | 0.044 | 0.008 | 0.024 | 0.008 | 
| Twist | -0.041 | -0.277 | -0.138 | -0.001 | 0.008 | 0.046 | 
                        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 | 2.032 | 0.849 | 0.408 | -0.044 | -0.008 | 0.031 | 
| Slide | 0.849 | 5.212 | 3.459 | 0.008 | -0.004 | -0.173 | 
| Rise | 0.408 | 3.459 | 11.576 | 0.078 | 0.031 | -0.198 | 
| Tilt | -0.044 | 0.008 | 0.078 | 0.046 | 0.007 | 0.007 | 
| Roll | -0.008 | -0.004 | 0.031 | 0.007 | 0.032 | 0.009 | 
| Twist | 0.031 | -0.173 | -0.198 | 0.007 | 0.009 | 0.054 | 
                        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 | 4.279 | 0.641 | 0.295 | -0.003 | 0.002 | 0.026 | 
| Slide | 0.641 | 7.892 | 4.871 | 0.019 | -0.051 | -0.170 | 
| Rise | 0.295 | 4.871 | 14.495 | 0.067 | 0.018 | -0.167 | 
| Tilt | -0.003 | 0.019 | 0.067 | 0.049 | 0.008 | 0.002 | 
| Roll | 0.002 | -0.051 | 0.018 | 0.008 | 0.042 | 0.001 | 
| Twist | 0.026 | -0.170 | -0.167 | 0.002 | 0.001 | 0.064 | 
                        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 | 2.806 | 0.504 | 0.428 | -0.058 | -0.009 | 0.025 | 
| Slide | 0.504 | 7.861 | 3.826 | 0.049 | -0.024 | -0.351 | 
| Rise | 0.428 | 3.826 | 11.415 | 0.112 | -0.052 | -0.268 | 
| Tilt | -0.058 | 0.049 | 0.112 | 0.046 | 0.008 | 0.001 | 
| Roll | -0.009 | -0.024 | -0.052 | 0.008 | 0.036 | 0.004 | 
| Twist | 0.025 | -0.351 | -0.268 | 0.001 | 0.004 | 0.088 | 
                        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 | 1.438 | -0.815 | 0.502 | -0.027 | 0.001 | -0.015 | 
| Slide | -0.815 | 5.623 | 3.040 | -0.011 | -0.007 | -0.193 | 
| Rise | 0.502 | 3.040 | 11.122 | 0.102 | 0.031 | -0.193 | 
| Tilt | -0.027 | -0.011 | 0.102 | 0.044 | 0.008 | 0.003 | 
| Roll | 0.001 | -0.007 | 0.031 | 0.008 | 0.030 | 0.009 | 
| Twist | -0.015 | -0.193 | -0.193 | 0.003 | 0.009 | 0.059 | 
                        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 | 3.077 | -0.789 | 0.161 | -0.024 | 0.114 | 0.043 | 
| Slide | -0.789 | 3.870 | 0.929 | 0.022 | -0.009 | -0.145 | 
| Rise | 0.161 | 0.929 | 10.474 | -0.408 | 0.071 | -0.169 | 
| Tilt | -0.024 | 0.022 | -0.408 | 0.061 | 0.001 | -0.006 | 
| Roll | 0.114 | -0.009 | 0.071 | 0.001 | 0.017 | 0.008 | 
| Twist | 0.043 | -0.145 | -0.169 | -0.006 | 0.008 | 0.051 | 
                        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 | 3.753 | 1.244 | 0.583 | -0.081 | 0.094 | -0.011 | 
| Slide | 1.244 | 6.534 | 1.915 | -0.092 | -0.026 | -0.308 | 
| Rise | 0.583 | 1.915 | 10.490 | -0.273 | -0.157 | -0.257 | 
| Tilt | -0.081 | -0.092 | -0.273 | 0.050 | 0.008 | 0.014 | 
| Roll | 0.094 | -0.026 | -0.157 | 0.008 | 0.033 | 0.007 | 
| Twist | -0.011 | -0.308 | -0.257 | 0.014 | 0.007 | 0.076 | 
                        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 | 1.780 | 0.022 | 0.407 | -0.048 | 0.062 | 0.086 | 
| Slide | 0.022 | 3.935 | 1.709 | -0.036 | -0.049 | -0.057 | 
| Rise | 0.407 | 1.709 | 9.150 | -0.202 | -0.153 | -0.195 | 
| Tilt | -0.048 | -0.036 | -0.202 | 0.043 | 0.010 | 0.012 | 
| Roll | 0.062 | -0.049 | -0.152 | 0.010 | 0.024 | 0.008 | 
| Twist | 0.086 | -0.057 | -0.195 | 0.012 | 0.008 | 0.051 | 
                        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 | 0.319 | 0.695 | -0.072 | 0.015 | 0.065 | 
| Slide | 0.319 | 3.198 | 1.855 | -0.048 | -0.061 | -0.061 | 
| Rise | 0.695 | 1.855 | 10.869 | -0.322 | -0.077 | -0.255 | 
| Tilt | -0.072 | -0.048 | -0.322 | 0.052 | 0.002 | 0.008 | 
| Roll | 0.015 | -0.061 | -0.077 | 0.002 | 0.026 | 0.009 | 
| Twist | 0.065 | -0.061 | -0.255 | 0.008 | 0.009 | 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 | 1.633 | 0.167 | 0.110 | -0.027 | 0.054 | -0.008 | 
| Slide | 0.167 | 2.656 | 1.070 | 0.020 | -0.034 | -0.189 | 
| Rise | 0.110 | 1.070 | 9.486 | -0.349 | -0.008 | -0.197 | 
| Tilt | -0.027 | 0.020 | -0.349 | 0.052 | 0.001 | 0.006 | 
| Roll | 0.054 | -0.034 | -0.008 | 0.001 | 0.022 | 0.009 | 
| Twist | -0.008 | -0.189 | -0.197 | 0.006 | 0.009 | 0.046 | 
                        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 | 2.511 | -0.495 | 1.189 | -0.111 | 0.061 | -0.026 | 
| Slide | -0.495 | 5.492 | 2.164 | -0.065 | -0.049 | -0.292 | 
| Rise | 1.189 | 2.164 | 8.315 | -0.208 | -0.067 | -0.085 | 
| Tilt | -0.111 | -0.065 | -0.208 | 0.046 | 0.007 | 0.007 | 
| Roll | 0.061 | -0.049 | -0.067 | 0.007 | 0.022 | -0.002 | 
| Twist | -0.026 | -0.292 | -0.085 | 0.007 | -0.002 | 0.093 | 
                        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 | 3.567 | -0.053 | -0.143 | -0.057 | 0.028 | 0.033 | 
| Slide | -0.053 | 6.210 | -0.545 | 0.008 | -0.010 | -0.399 | 
| Rise | -0.143 | -0.545 | 11.452 | -0.383 | 0.046 | -0.109 | 
| Tilt | -0.057 | 0.008 | -0.383 | 0.059 | -0.004 | 0.005 | 
| Roll | 0.028 | -0.010 | 0.046 | -0.004 | 0.024 | -0.007 | 
| Twist | 0.033 | -0.399 | -0.109 | 0.005 | -0.007 | 0.080 | 
                        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 | 1.929 | 1.321 | 0.439 | -0.044 | 0.054 | 0.138 | 
| Slide | 1.321 | 4.338 | 0.779 | 0.038 | -0.016 | -0.173 | 
| Rise | 0.439 | 0.779 | 10.400 | -0.175 | 0.031 | -0.249 | 
| Tilt | -0.044 | 0.038 | -0.175 | 0.038 | 0.003 | 0.013 | 
| Roll | 0.054 | -0.016 | 0.031 | 0.003 | 0.019 | 0.009 | 
| Twist | 0.138 | -0.173 | -0.249 | 0.013 | 0.009 | 0.067 | 
                        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 | 2.925 | 0.817 | 0.744 | -0.046 | -0.048 | 0.136 | 
| Slide | 0.817 | 3.329 | 0.709 | 0.050 | -0.002 | -0.140 | 
| Rise | 0.744 | 0.709 | 8.839 | -0.190 | 0.059 | -0.186 | 
| Tilt | -0.046 | 0.050 | -0.190 | 0.047 | -0.002 | 0.011 | 
| Roll | -0.048 | -0.002 | 0.059 | -0.002 | 0.019 | -0.002 | 
| Twist | 0.136 | -0.140 | -0.186 | 0.011 | -0.002 | 0.075 | 
                        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 | 2.431 | -0.573 | 0.195 | -0.015 | 0.043 | -0.059 | 
| Slide | -0.573 | 4.044 | 1.792 | -0.059 | 0.036 | -0.146 | 
| Rise | 0.195 | 1.792 | 9.269 | -0.079 | 0.122 | -0.143 | 
| Tilt | -0.015 | -0.059 | -0.079 | 0.041 | 0.000 | 0.007 | 
| Roll | 0.043 | 0.036 | 0.122 | 0.000 | 0.025 | 0.006 | 
| Twist | -0.059 | -0.146 | -0.143 | 0.007 | 0.006 | 0.059 | 
                        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 | 2.096 | 0.433 | -0.110 | -0.031 | -0.039 | 0.023 | 
| Slide | 0.433 | 4.390 | 2.733 | 0.037 | -0.032 | -0.094 | 
| Rise | -0.110 | 2.733 | 10.611 | 0.059 | 0.079 | -0.175 | 
| Tilt | -0.031 | 0.037 | 0.059 | 0.046 | 0.002 | 0.001 | 
| Roll | -0.039 | -0.032 | 0.079 | 0.002 | 0.033 | 0.010 | 
| Twist | 0.023 | -0.094 | -0.175 | 0.001 | 0.010 | 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 | 0.707 | -0.503 | -0.259 | 0.014 | -0.057 | -0.083 | 
| Slide | -0.504 | 4.336 | 1.553 | 0.080 | -0.000 | -0.084 | 
| Rise | -0.259 | 1.553 | 8.375 | 0.102 | 0.080 | -0.104 | 
| Tilt | 0.014 | 0.080 | 0.102 | 0.037 | 0.004 | 0.001 | 
| Roll | -0.057 | -0.000 | 0.080 | 0.004 | 0.025 | 0.008 | 
| Twist | -0.083 | -0.084 | -0.104 | 0.001 | 0.008 | 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 | 1.572 | 0.164 | -0.010 | 0.014 | -0.068 | 0.117 | 
| Slide | 0.164 | 5.327 | 3.242 | 0.068 | -0.021 | -0.292 | 
| Rise | -0.010 | 3.242 | 10.858 | 0.002 | 0.140 | -0.184 | 
| Tilt | 0.014 | 0.068 | 0.002 | 0.045 | -0.001 | -0.006 | 
| Roll | -0.068 | -0.021 | 0.140 | -0.001 | 0.029 | 0.009 | 
| Twist | 0.117 | -0.292 | -0.184 | -0.006 | 0.009 | 0.075 | 
                        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 | 2.182 | -0.585 | -0.081 | 0.001 | 0.026 | -0.011 | 
| Slide | -0.585 | 5.274 | 3.253 | -0.068 | -0.066 | -0.118 | 
| Rise | -0.081 | 3.253 | 11.687 | -0.090 | 0.055 | -0.179 | 
| Tilt | 0.001 | -0.068 | -0.090 | 0.045 | -0.002 | -0.001 | 
| Roll | 0.026 | -0.066 | 0.055 | -0.002 | 0.035 | 0.013 | 
| Twist | -0.011 | -0.118 | -0.179 | -0.001 | 0.013 | 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 | 2.689 | 0.535 | 0.062 | -0.034 | -0.049 | 0.054 | 
| Slide | 0.535 | 4.813 | 2.192 | 0.060 | 0.004 | -0.278 | 
| Rise | 0.062 | 2.192 | 8.742 | 0.042 | 0.074 | -0.190 | 
| Tilt | -0.034 | 0.060 | 0.042 | 0.048 | 0.003 | -0.001 | 
| Roll | -0.049 | 0.004 | 0.074 | 0.003 | 0.031 | 0.009 | 
| Twist | 0.054 | -0.278 | -0.190 | -0.001 | 0.009 | 0.071 | 
                        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 | 1.988 | -0.150 | -0.122 | 0.047 | -0.007 | -0.051 | 
| Slide | -0.150 | 5.512 | 2.839 | -0.023 | -0.102 | -0.106 | 
| Rise | -0.122 | 2.839 | 10.658 | 0.049 | 0.072 | -0.121 | 
| Tilt | 0.047 | -0.023 | 0.049 | 0.040 | -0.002 | 0.002 | 
| Roll | -0.007 | -0.102 | 0.072 | -0.002 | 0.032 | 0.011 | 
| Twist | -0.051 | -0.106 | -0.121 | 0.002 | 0.011 | 0.052 | 
                        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 | 1.347 | 0.374 | 0.169 | 0.051 | 0.022 | -0.041 | 
| Slide | 0.374 | 5.940 | 3.246 | -0.016 | -0.102 | -0.097 | 
| Rise | 0.169 | 3.246 | 10.845 | -0.019 | -0.006 | -0.194 | 
| Tilt | 0.051 | -0.016 | -0.019 | 0.039 | -0.001 | 0.003 | 
| Roll | 0.022 | -0.102 | -0.006 | -0.001 | 0.029 | 0.014 | 
| Twist | -0.041 | -0.097 | -0.194 | 0.003 | 0.014 | 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 | 2.458 | 0.247 | 0.116 | -0.010 | -0.003 | -0.037 | 
| Slide | 0.247 | 7.463 | 2.872 | -0.019 | -0.054 | -0.220 | 
| Rise | 0.116 | 2.872 | 13.400 | -0.082 | 0.088 | -0.117 | 
| Tilt | -0.010 | -0.019 | -0.082 | 0.048 | 0.001 | 0.000 | 
| Roll | -0.003 | -0.054 | 0.088 | 0.001 | 0.045 | 0.005 | 
| Twist | -0.037 | -0.220 | -0.117 | 0.000 | 0.005 | 0.085 | 
                        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 | 1.878 | 0.052 | 0.106 | 0.028 | 0.012 | -0.006 | 
| Slide | 0.052 | 5.711 | 3.198 | 0.008 | -0.058 | -0.142 | 
| Rise | 0.106 | 3.198 | 12.214 | 0.017 | 0.098 | -0.155 | 
| Tilt | 0.028 | 0.008 | 0.017 | 0.048 | -0.003 | 0.001 | 
| Roll | 0.012 | -0.058 | 0.098 | -0.003 | 0.032 | 0.012 | 
| Twist | -0.006 | -0.142 | -0.155 | 0.001 | 0.012 | 0.053 | 
                        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 | 2.082 | 0.006 | 0.282 | -0.011 | -0.009 | 0.023 | 
| Slide | 0.006 | 6.293 | 2.975 | 0.010 | -0.115 | -0.137 | 
| Rise | 0.282 | 2.975 | 10.144 | 0.016 | -0.044 | -0.183 | 
| Tilt | -0.011 | 0.010 | 0.016 | 0.046 | 0.002 | 0.001 | 
| Roll | -0.009 | -0.115 | -0.044 | 0.002 | 0.038 | 0.012 | 
| Twist | 0.023 | -0.137 | -0.183 | 0.001 | 0.012 | 0.063 | 
                        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 | 1.833 | 0.109 | -0.336 | -0.011 | 0.007 | -0.044 | 
| Slide | 0.109 | 6.241 | 1.866 | -0.058 | -0.059 | -0.142 | 
| Rise | -0.336 | 1.866 | 10.242 | 0.091 | 0.087 | -0.123 | 
| Tilt | -0.011 | -0.058 | 0.091 | 0.043 | 0.000 | 0.004 | 
| Roll | 0.007 | -0.059 | 0.087 | 0.000 | 0.024 | 0.012 | 
| Twist | -0.044 | -0.142 | -0.123 | 0.004 | 0.012 | 0.052 | 
                        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 | 2.503 | -0.510 | -0.698 | 0.004 | -0.021 | 0.059 | 
| Slide | -0.510 | 7.548 | 3.923 | 0.015 | -0.107 | -0.118 | 
| Rise | -0.698 | 3.923 | 14.174 | 0.060 | 0.084 | -0.171 | 
| Tilt | 0.004 | 0.015 | 0.060 | 0.046 | -0.001 | -0.007 | 
| Roll | -0.021 | -0.107 | 0.084 | -0.001 | 0.043 | 0.014 | 
| Twist | 0.059 | -0.118 | -0.171 | -0.007 | 0.014 | 0.046 | 
                        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 | 0.943 | 0.260 | -0.256 | -0.067 | 0.006 | 0.003 | 
| Slide | 0.260 | 3.271 | 0.455 | 0.025 | 0.008 | -0.079 | 
| Rise | -0.256 | 0.455 | 9.251 | 0.066 | -0.173 | -0.254 | 
| Tilt | -0.067 | 0.025 | 0.066 | 0.029 | -0.000 | 0.004 | 
| Roll | 0.006 | 0.008 | -0.173 | -0.000 | 0.025 | 0.011 | 
| Twist | 0.003 | -0.079 | -0.254 | 0.004 | 0.011 | 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 | 2.704 | 0.179 | -0.466 | -0.075 | 0.014 | 0.076 | 
| Slide | 0.179 | 4.792 | -0.122 | -0.105 | -0.023 | -0.226 | 
| Rise | -0.466 | -0.122 | 10.220 | -0.036 | -0.195 | -0.155 | 
| Tilt | -0.075 | -0.105 | -0.036 | 0.033 | -0.004 | 0.005 | 
| Roll | 0.014 | -0.023 | -0.195 | -0.004 | 0.032 | 0.014 | 
| Twist | 0.076 | -0.226 | -0.155 | 0.005 | 0.014 | 0.052 | 
                        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 | 1.405 | -0.087 | 0.340 | -0.059 | -0.006 | 0.057 | 
| Slide | -0.087 | 2.321 | 1.136 | 0.047 | 0.018 | -0.153 | 
| Rise | 0.340 | 1.136 | 4.089 | -0.008 | 0.077 | -0.047 | 
| Tilt | -0.059 | 0.047 | -0.008 | 0.025 | -0.001 | -0.005 | 
| Roll | -0.006 | 0.018 | 0.077 | -0.001 | 0.011 | -0.002 | 
| Twist | 0.057 | -0.153 | -0.047 | -0.005 | -0.002 | 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 | 1.024 | 0.006 | 0.281 | -0.080 | -0.021 | -0.004 | 
| Slide | 0.006 | 2.520 | 1.190 | -0.033 | -0.047 | -0.104 | 
| Rise | 0.281 | 1.190 | 6.642 | -0.034 | -0.108 | -0.142 | 
| Tilt | -0.080 | -0.033 | -0.034 | 0.026 | 0.001 | -0.000 | 
| Roll | -0.021 | -0.047 | -0.108 | 0.001 | 0.015 | 0.005 | 
| Twist | -0.004 | -0.104 | -0.142 | -0.000 | 0.005 | 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 | 0.962 | 0.063 | 0.779 | -0.078 | -0.007 | -0.027 | 
| Slide | 0.063 | 3.216 | 0.524 | -0.049 | 0.010 | -0.142 | 
| Rise | 0.779 | 0.524 | 8.491 | 0.014 | -0.053 | -0.242 | 
| Tilt | -0.078 | -0.049 | 0.014 | 0.028 | -0.003 | 0.003 | 
| Roll | -0.007 | 0.010 | -0.053 | -0.003 | 0.020 | 0.009 | 
| Twist | -0.027 | -0.142 | -0.242 | 0.003 | 0.009 | 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 | 1.209 | 0.157 | 0.411 | -0.072 | 0.009 | 0.007 | 
| Slide | 0.157 | 2.636 | 0.445 | -0.042 | 0.027 | -0.135 | 
| Rise | 0.411 | 0.445 | 8.380 | -0.065 | -0.029 | -0.171 | 
| Tilt | -0.072 | -0.042 | -0.065 | 0.029 | -0.003 | -0.000 | 
| Roll | 0.009 | 0.027 | -0.029 | -0.003 | 0.017 | 0.003 | 
| Twist | 0.007 | -0.135 | -0.171 | -0.000 | 0.003 | 0.043 | 
                        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 | 2.854 | -1.000 | 0.422 | -0.039 | 0.006 | 0.083 | 
| Slide | -1.000 | 3.935 | 1.025 | 0.030 | 0.030 | -0.207 | 
| Rise | 0.422 | 1.025 | 7.042 | -0.081 | -0.015 | -0.123 | 
| Tilt | -0.039 | 0.030 | -0.081 | 0.035 | 0.001 | -0.001 | 
| Roll | 0.006 | 0.030 | -0.015 | 0.001 | 0.023 | 0.002 | 
| Twist | 0.083 | -0.207 | -0.123 | -0.001 | 0.002 | 0.062 | 
                        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 | 1.500 | 0.761 | -0.097 | -0.028 | -0.008 | 0.075 | 
| Slide | 0.761 | 3.000 | 0.464 | 0.001 | 0.014 | -0.101 | 
| Rise | -0.097 | 0.464 | 7.813 | 0.093 | -0.128 | -0.141 | 
| Tilt | -0.028 | 0.001 | 0.093 | 0.031 | -0.005 | 0.006 | 
| Roll | -0.008 | 0.014 | -0.128 | -0.005 | 0.018 | 0.003 | 
| Twist | 0.075 | -0.101 | -0.141 | 0.006 | 0.003 | 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 | 0.806 | -0.127 | 0.253 | -0.067 | 0.018 | -0.054 | 
| Slide | -0.127 | 2.769 | 1.322 | -0.034 | 0.018 | -0.108 | 
| Rise | 0.253 | 1.322 | 6.945 | -0.020 | -0.064 | -0.203 | 
| Tilt | -0.067 | -0.034 | -0.020 | 0.028 | -0.002 | 0.001 | 
| Roll | 0.018 | 0.018 | -0.064 | -0.002 | 0.017 | 0.008 | 
| Twist | -0.054 | -0.108 | -0.203 | 0.001 | 0.008 | 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 | 1.821 | 0.155 | 0.133 | -0.059 | 0.004 | -0.009 | 
| Slide | 0.155 | 2.799 | 0.175 | -0.014 | 0.021 | 0.005 | 
| Rise | 0.133 | 0.175 | 6.573 | -0.032 | -0.159 | -0.187 | 
| Tilt | -0.059 | -0.014 | -0.032 | 0.031 | 0.002 | 0.003 | 
| Roll | 0.004 | 0.021 | -0.159 | 0.002 | 0.018 | 0.008 | 
| Twist | -0.009 | 0.005 | -0.187 | 0.003 | 0.008 | 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 | 3.281 | -0.030 | 0.531 | -0.029 | 0.013 | 0.028 | 
| Slide | -0.030 | 5.677 | -0.137 | 0.038 | -0.009 | -0.220 | 
| Rise | 0.531 | -0.137 | 7.540 | 0.075 | -0.091 | -0.099 | 
| Tilt | -0.029 | 0.038 | 0.075 | 0.035 | -0.003 | 0.002 | 
| Roll | 0.013 | -0.009 | -0.091 | -0.003 | 0.020 | 0.007 | 
| Twist | 0.028 | -0.220 | -0.099 | 0.002 | 0.007 | 0.071 | 
                        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 | 1.706 | -0.113 | -0.259 | -0.063 | 0.037 | 0.116 | 
| Slide | -0.113 | 3.043 | 1.533 | 0.042 | -0.021 | -0.144 | 
| Rise | -0.259 | 1.533 | 8.649 | 0.019 | -0.193 | -0.284 | 
| Tilt | -0.063 | 0.042 | 0.019 | 0.030 | -0.003 | -0.002 | 
| Roll | 0.037 | -0.021 | -0.193 | -0.003 | 0.030 | 0.006 | 
| Twist | 0.116 | -0.144 | -0.284 | -0.002 | 0.006 | 0.055 | 
                        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 | 2.277 | -0.023 | -0.070 | -0.079 | -0.065 | 0.086 | 
| Slide | -0.023 | 3.908 | 0.227 | 0.012 | -0.003 | -0.233 | 
| Rise | -0.070 | 0.227 | 9.281 | -0.002 | -0.070 | -0.263 | 
| Tilt | -0.079 | 0.012 | -0.002 | 0.030 | -0.002 | -0.003 | 
| Roll | -0.065 | -0.003 | -0.070 | -0.002 | 0.022 | 0.008 | 
| Twist | 0.086 | -0.233 | -0.263 | -0.003 | 0.008 | 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 | 1.389 | -0.115 | 0.023 | -0.070 | 0.013 | -0.080 | 
| Slide | -0.115 | 2.255 | 0.739 | 0.004 | -0.033 | -0.024 | 
| Rise | 0.023 | 0.739 | 8.327 | 0.052 | -0.172 | -0.205 | 
| Tilt | -0.070 | 0.004 | 0.052 | 0.033 | 0.003 | 0.004 | 
| Roll | 0.013 | -0.033 | -0.172 | 0.003 | 0.025 | 0.016 | 
| Twist | -0.080 | -0.024 | -0.205 | 0.004 | 0.016 | 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 | 2.091 | 0.712 | -0.616 | -0.117 | -0.055 | 0.032 | 
| Slide | 0.712 | 2.362 | 1.675 | 0.033 | 0.011 | -0.075 | 
| Rise | -0.616 | 1.675 | 10.232 | 0.394 | 0.076 | -0.154 | 
| Tilt | -0.117 | 0.033 | 0.394 | 0.050 | 0.005 | 0.005 | 
| Roll | -0.055 | 0.011 | 0.076 | 0.005 | 0.014 | 0.003 | 
| Twist | 0.032 | -0.075 | -0.154 | 0.005 | 0.003 | 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 | 1.567 | -0.494 | -0.567 | -0.144 | -0.048 | -0.006 | 
| Slide | -0.494 | 2.462 | 1.830 | 0.013 | -0.030 | -0.106 | 
| Rise | -0.567 | 1.830 | 10.061 | 0.268 | -0.090 | -0.219 | 
| Tilt | -0.144 | 0.013 | 0.268 | 0.049 | 0.001 | -0.003 | 
| Roll | -0.048 | -0.030 | -0.090 | 0.001 | 0.022 | 0.009 | 
| Twist | -0.006 | -0.106 | -0.219 | -0.003 | 0.009 | 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 | 3.012 | -0.385 | -0.634 | -0.074 | 0.001 | -0.008 | 
| Slide | -0.385 | 4.184 | 1.123 | -0.089 | -0.071 | -0.306 | 
| Rise | -0.634 | 1.123 | 8.956 | 0.248 | -0.049 | -0.086 | 
| Tilt | -0.074 | -0.089 | 0.248 | 0.047 | 0.003 | 0.003 | 
| Roll | 0.001 | -0.071 | -0.049 | 0.003 | 0.028 | 0.009 | 
| Twist | -0.008 | -0.306 | -0.086 | 0.003 | 0.009 | 0.070 | 
                        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 | 2.306 | -0.473 | -0.951 | -0.204 | -0.074 | -0.031 | 
| Slide | -0.473 | 4.475 | 0.888 | -0.062 | 0.005 | -0.230 | 
| Rise | -0.951 | 0.888 | 10.671 | 0.320 | 0.041 | -0.123 | 
| Tilt | -0.204 | -0.062 | 0.319 | 0.053 | 0.002 | 0.008 | 
| Roll | -0.074 | 0.005 | 0.041 | 0.002 | 0.018 | 0.009 | 
| Twist | -0.031 | -0.230 | -0.123 | 0.008 | 0.009 | 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 | 1.598 | 0.382 | -0.780 | -0.115 | -0.047 | 0.018 | 
| Slide | 0.382 | 2.307 | 2.076 | 0.049 | -0.022 | -0.102 | 
| Rise | -0.780 | 2.076 | 11.848 | 0.433 | -0.077 | -0.237 | 
| Tilt | -0.115 | 0.049 | 0.433 | 0.054 | 0.002 | -0.001 | 
| Roll | -0.047 | -0.022 | -0.077 | 0.002 | 0.023 | 0.009 | 
| Twist | 0.018 | -0.102 | -0.237 | -0.001 | 0.009 | 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 | 2.267 | -0.711 | -1.230 | -0.151 | -0.078 | -0.029 | 
| Slide | -0.711 | 3.293 | 1.309 | 0.005 | 0.001 | -0.286 | 
| Rise | -1.230 | 1.309 | 7.272 | 0.260 | 0.200 | -0.147 | 
| Tilt | -0.151 | 0.005 | 0.260 | 0.045 | 0.008 | -0.004 | 
| Roll | -0.078 | 0.001 | 0.201 | 0.008 | 0.018 | 0.005 | 
| Twist | -0.029 | -0.286 | -0.147 | -0.004 | 0.005 | 0.046 | 
                        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 | 1.545 | -0.642 | -0.183 | -0.115 | -0.009 | -0.060 | 
| Slide | -0.641 | 2.604 | 2.117 | 0.004 | -0.032 | -0.103 | 
| Rise | -0.183 | 2.117 | 11.700 | 0.314 | -0.091 | -0.265 | 
| Tilt | -0.115 | 0.004 | 0.314 | 0.052 | -0.001 | -0.003 | 
| Roll | -0.009 | -0.032 | -0.091 | -0.001 | 0.026 | 0.011 | 
| Twist | -0.060 | -0.103 | -0.265 | -0.003 | 0.011 | 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 | 2.400 | 0.100 | -0.427 | -0.064 | -0.078 | -0.053 | 
| Slide | 0.100 | 3.892 | 1.980 | 0.061 | -0.087 | -0.065 | 
| Rise | -0.427 | 1.980 | 8.126 | 0.203 | -0.083 | -0.193 | 
| Tilt | -0.064 | 0.061 | 0.203 | 0.044 | -0.005 | -0.005 | 
| Roll | -0.078 | -0.087 | -0.083 | -0.005 | 0.017 | 0.013 | 
| Twist | -0.053 | -0.065 | -0.193 | -0.005 | 0.013 | 0.052 | 
                        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 | 1.410 | -0.167 | -0.784 | -0.086 | -0.032 | -0.089 | 
| Slide | -0.167 | 3.175 | 1.848 | 0.047 | -0.077 | -0.071 | 
| Rise | -0.784 | 1.848 | 10.379 | 0.319 | -0.092 | -0.222 | 
| Tilt | -0.086 | 0.047 | 0.319 | 0.053 | -0.002 | -0.006 | 
| Roll | -0.032 | -0.077 | -0.092 | -0.002 | 0.030 | 0.013 | 
| Twist | -0.089 | -0.071 | -0.222 | -0.006 | 0.013 | 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 | 1.056 | -0.189 | -0.316 | -0.056 | -0.060 | 0.010 | 
| Slide | -0.189 | 2.625 | 1.057 | 0.004 | -0.031 | -0.189 | 
| Rise | -0.316 | 1.057 | 10.071 | 0.339 | -0.002 | -0.228 | 
| Tilt | -0.056 | 0.004 | 0.339 | 0.049 | 0.002 | -0.007 | 
| Roll | -0.060 | -0.031 | -0.002 | 0.002 | 0.022 | 0.012 | 
| Twist | 0.010 | -0.189 | -0.228 | -0.007 | 0.012 | 0.043 | 
                        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 | 3.047 | -0.498 | -0.340 | -0.075 | -0.094 | -0.022 | 
| Slide | -0.498 | 6.440 | 2.199 | 0.116 | -0.003 | -0.161 | 
| Rise | -0.340 | 2.199 | 10.887 | 0.269 | -0.136 | -0.199 | 
| Tilt | -0.075 | 0.116 | 0.269 | 0.052 | -0.008 | -0.009 | 
| Roll | -0.094 | -0.003 | -0.136 | -0.008 | 0.027 | 0.002 | 
| Twist | -0.022 | -0.161 | -0.199 | -0.009 | 0.002 | 0.084 | 
                        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 | 3.327 | -0.223 | -0.112 | -0.037 | -0.030 | -0.072 | 
| Slide | -0.223 | 3.906 | 1.322 | 0.064 | -0.026 | 0.034 | 
| Rise | -0.111 | 1.322 | 9.391 | 0.289 | -0.130 | -0.270 | 
| Tilt | -0.037 | 0.064 | 0.289 | 0.047 | -0.005 | -0.012 | 
| Roll | -0.030 | -0.026 | -0.130 | -0.005 | 0.027 | 0.010 | 
| Twist | -0.072 | 0.034 | -0.270 | -0.012 | 0.010 | 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 | 3.519 | 1.229 | -0.466 | -0.078 | -0.058 | -0.089 | 
| Slide | 1.229 | 3.475 | 1.087 | -0.063 | -0.068 | -0.156 | 
| Rise | -0.466 | 1.087 | 8.117 | 0.340 | 0.039 | -0.110 | 
| Tilt | -0.078 | -0.063 | 0.340 | 0.058 | 0.001 | 0.005 | 
| Roll | -0.058 | -0.068 | 0.039 | 0.001 | 0.020 | 0.009 | 
| Twist | -0.089 | -0.156 | -0.110 | 0.005 | 0.009 | 0.060 | 
                        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 | 0.826 | -0.386 | -0.286 | -0.039 | -0.024 | -0.090 | 
| Slide | -0.386 | 3.028 | 1.037 | -0.048 | 0.004 | -0.152 | 
| Rise | -0.286 | 1.037 | 7.624 | 0.116 | 0.047 | -0.260 | 
| Tilt | -0.039 | -0.048 | 0.116 | 0.037 | -0.002 | -0.010 | 
| Roll | -0.024 | 0.004 | 0.047 | -0.002 | 0.014 | 0.001 | 
| Twist | -0.090 | -0.152 | -0.260 | -0.010 | 0.001 | 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 | 3.252 | -1.510 | -0.290 | -0.001 | -0.046 | 0.070 | 
| Slide | -1.510 | 6.360 | 1.909 | -0.036 | -0.006 | -0.289 | 
| Rise | -0.290 | 1.909 | 9.652 | 0.234 | 0.066 | -0.166 | 
| Tilt | -0.001 | -0.036 | 0.234 | 0.046 | -0.000 | -0.007 | 
| Roll | -0.046 | -0.006 | 0.066 | -0.000 | 0.024 | 0.000 | 
| Twist | 0.070 | -0.289 | -0.166 | -0.007 | 0.000 | 0.067 | 
                        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 | 2.006 | 0.486 | -0.723 | -0.077 | -0.063 | -0.121 | 
| Slide | 0.486 | 2.891 | 0.357 | 0.007 | -0.007 | -0.167 | 
| Rise | -0.723 | 0.357 | 8.503 | 0.225 | 0.073 | -0.105 | 
| Tilt | -0.077 | 0.007 | 0.225 | 0.044 | 0.001 | -0.000 | 
| Roll | -0.063 | -0.007 | 0.073 | 0.001 | 0.015 | 0.006 | 
| Twist | -0.121 | -0.167 | -0.105 | -0.000 | 0.006 | 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 | 1.569 | -0.334 | 0.627 | -0.040 | -0.054 | -0.074 | 
| Slide | -0.333 | 3.708 | 1.647 | 0.098 | -0.074 | -0.241 | 
| Rise | 0.627 | 1.648 | 9.134 | -0.169 | -0.015 | -0.113 | 
| Tilt | -0.040 | 0.098 | -0.169 | 0.035 | 0.004 | -0.001 | 
| Roll | -0.054 | -0.074 | -0.015 | 0.004 | 0.018 | 0.007 | 
| Twist | -0.074 | -0.241 | -0.113 | -0.001 | 0.007 | 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 | 2.024 | 0.920 | 0.422 | -0.069 | 0.037 | -0.109 | 
| Slide | 0.920 | 3.216 | 1.500 | 0.032 | -0.042 | -0.176 | 
| Rise | 0.422 | 1.500 | 11.086 | -0.294 | -0.067 | -0.207 | 
| Tilt | -0.069 | 0.032 | -0.294 | 0.040 | -0.001 | -0.000 | 
| Roll | 0.037 | -0.042 | -0.067 | -0.001 | 0.024 | 0.014 | 
| Twist | -0.109 | -0.176 | -0.207 | -0.000 | 0.014 | 0.044 | 
                        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 | 2.804 | 0.506 | 0.550 | -0.108 | 0.086 | -0.154 | 
| Slide | 0.506 | 3.689 | 1.378 | -0.020 | 0.018 | -0.104 | 
| Rise | 0.550 | 1.378 | 11.246 | -0.405 | 0.059 | -0.080 | 
| Tilt | -0.108 | -0.020 | -0.405 | 0.053 | -0.009 | -0.005 | 
| Roll | 0.086 | 0.018 | 0.059 | -0.009 | 0.022 | -0.000 | 
| Twist | -0.154 | -0.104 | -0.080 | -0.005 | -0.000 | 0.048 | 
                        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 | 3.750 | -0.309 | 1.353 | -0.108 | 0.018 | -0.024 | 
| Slide | -0.309 | 6.449 | 1.931 | -0.037 | -0.073 | -0.266 | 
| Rise | 1.353 | 1.931 | 10.868 | -0.459 | -0.005 | -0.015 | 
| Tilt | -0.108 | -0.037 | -0.459 | 0.058 | -0.008 | -0.005 | 
| Roll | 0.018 | -0.073 | -0.005 | -0.008 | 0.033 | 0.007 | 
| Twist | -0.024 | -0.266 | -0.015 | -0.005 | 0.007 | 0.076 | 
                        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 | 1.498 | 0.542 | 1.065 | -0.097 | 0.008 | 0.016 | 
| Slide | 0.542 | 3.029 | 1.549 | -0.003 | -0.057 | -0.131 | 
| Rise | 1.065 | 1.549 | 10.037 | -0.326 | -0.034 | -0.183 | 
| Tilt | -0.097 | -0.003 | -0.326 | 0.046 | -0.005 | 0.003 | 
| Roll | 0.008 | -0.057 | -0.034 | -0.005 | 0.029 | 0.012 | 
| Twist | 0.016 | -0.131 | -0.183 | 0.003 | 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 | 3.219 | 0.333 | 1.892 | -0.150 | 0.005 | -0.030 | 
| Slide | 0.333 | 4.241 | 2.681 | -0.056 | -0.059 | -0.220 | 
| Rise | 1.892 | 2.681 | 13.286 | -0.427 | -0.111 | -0.252 | 
| Tilt | -0.150 | -0.056 | -0.427 | 0.048 | -0.000 | 0.002 | 
| Roll | 0.005 | -0.059 | -0.111 | -0.000 | 0.029 | 0.012 | 
| Twist | -0.030 | -0.220 | -0.252 | 0.002 | 0.012 | 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 | 1.660 | 0.459 | 0.022 | -0.110 | 0.059 | 0.069 | 
| Slide | 0.459 | 3.290 | 1.210 | 0.026 | 0.008 | -0.191 | 
| Rise | 0.022 | 1.210 | 11.273 | -0.281 | -0.030 | -0.134 | 
| Tilt | -0.110 | 0.026 | -0.281 | 0.050 | -0.003 | 0.000 | 
| Roll | 0.059 | 0.008 | -0.030 | -0.003 | 0.026 | 0.004 | 
| Twist | 0.069 | -0.191 | -0.134 | 0.000 | 0.004 | 0.043 | 
                        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 | 3.226 | -0.229 | 0.294 | -0.040 | 0.005 | -0.019 | 
| Slide | -0.229 | 4.097 | 0.821 | 0.025 | 0.009 | -0.191 | 
| Rise | 0.294 | 0.821 | 11.429 | -0.381 | 0.120 | -0.016 | 
| Tilt | -0.040 | 0.025 | -0.381 | 0.059 | -0.010 | -0.000 | 
| Roll | 0.005 | 0.009 | 0.120 | -0.010 | 0.037 | -0.006 | 
| Twist | -0.019 | -0.191 | -0.016 | -0.000 | -0.006 | 0.073 | 
                        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 | 2.700 | 0.645 | 0.212 | -0.136 | 0.012 | -0.017 | 
| Slide | 0.645 | 6.424 | 2.748 | -0.125 | 0.092 | -0.231 | 
| Rise | 0.212 | 2.748 | 12.502 | -0.013 | 0.278 | -0.153 | 
| Tilt | -0.136 | -0.125 | -0.013 | 0.053 | -0.002 | -0.000 | 
| Roll | 0.012 | 0.092 | 0.278 | -0.002 | 0.032 | 0.005 | 
| Twist | -0.017 | -0.231 | -0.153 | -0.000 | 0.005 | 0.067 | 
                        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 | 2.221 | -0.499 | 0.055 | -0.130 | 0.028 | -0.040 | 
| Slide | -0.499 | 4.729 | 2.775 | -0.023 | 0.055 | -0.134 | 
| Rise | 0.055 | 2.775 | 11.263 | -0.009 | 0.165 | -0.231 | 
| Tilt | -0.130 | -0.023 | -0.009 | 0.042 | -0.002 | 0.000 | 
| Roll | 0.028 | 0.055 | 0.165 | -0.002 | 0.026 | 0.009 | 
| Twist | -0.040 | -0.134 | -0.231 | 0.000 | 0.009 | 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 | 2.308 | 0.594 | 0.135 | -0.144 | -0.028 | 0.021 | 
| Slide | 0.594 | 5.292 | 3.126 | 0.011 | 0.061 | -0.144 | 
| Rise | 0.135 | 3.126 | 11.555 | 0.002 | 0.182 | -0.220 | 
| Tilt | -0.144 | 0.011 | 0.002 | 0.045 | 0.000 | 0.000 | 
| Roll | -0.028 | 0.061 | 0.182 | 0.000 | 0.027 | 0.008 | 
| Twist | 0.021 | -0.144 | -0.220 | 0.000 | 0.008 | 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 | 2.840 | 0.263 | 0.050 | -0.146 | 0.013 | 0.079 | 
| Slide | 0.263 | 6.481 | 2.800 | -0.020 | 0.082 | -0.341 | 
| Rise | 0.050 | 2.800 | 10.023 | 0.019 | 0.165 | -0.190 | 
| Tilt | -0.146 | -0.020 | 0.019 | 0.045 | 0.003 | 0.000 | 
| Roll | 0.013 | 0.082 | 0.165 | 0.003 | 0.027 | 0.004 | 
| Twist | 0.079 | -0.341 | -0.190 | 0.000 | 0.004 | 0.070 | 
                        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 | 6.062 | 0.519 | 0.292 | -0.213 | 0.053 | 0.062 | 
| Slide | 0.519 | 11.281 | 3.713 | -0.066 | 0.161 | -0.742 | 
| Rise | 0.292 | 3.713 | 7.842 | -0.011 | 0.198 | -0.197 | 
| Tilt | -0.213 | -0.066 | -0.011 | 0.036 | -0.002 | 0.004 | 
| Roll | 0.053 | 0.161 | 0.198 | -0.002 | 0.035 | 0.002 | 
| Twist | 0.062 | -0.741 | -0.197 | 0.004 | 0.002 | 0.092 | 
                        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 | 0.598 | 0.107 | -0.445 | -0.078 | -0.011 | 0.013 | 
| Slide | 0.107 | 4.000 | 2.919 | 0.019 | 0.105 | -0.052 | 
| Rise | -0.445 | 2.919 | 9.901 | 0.023 | 0.247 | -0.125 | 
| Tilt | -0.078 | 0.019 | 0.023 | 0.036 | 0.002 | -0.005 | 
| Roll | -0.011 | 0.105 | 0.247 | 0.002 | 0.023 | -0.001 | 
| Twist | 0.013 | -0.052 | -0.125 | -0.005 | -0.001 | 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 | 4.638 | -0.523 | 0.857 | -0.064 | -0.003 | 0.090 | 
| Slide | -0.523 | 6.137 | 3.419 | 0.027 | 0.134 | -0.188 | 
| Rise | 0.857 | 3.419 | 10.235 | 0.053 | 0.264 | -0.126 | 
| Tilt | -0.064 | 0.027 | 0.053 | 0.044 | 0.002 | -0.001 | 
| Roll | -0.003 | 0.134 | 0.264 | 0.002 | 0.033 | -0.004 | 
| Twist | 0.090 | -0.188 | -0.126 | -0.001 | -0.004 | 0.055 | 
                        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 | 1.539 | 0.315 | 0.161 | -0.146 | 0.030 | 0.023 | 
| Slide | 0.315 | 2.081 | 1.480 | -0.014 | 0.082 | 0.013 | 
| Rise | 0.161 | 1.480 | 9.357 | -0.027 | 0.233 | -0.144 | 
| Tilt | -0.146 | -0.014 | -0.027 | 0.039 | 0.002 | 0.003 | 
| Roll | 0.030 | 0.082 | 0.233 | 0.002 | 0.027 | 0.004 | 
| Twist | 0.023 | 0.013 | -0.144 | 0.003 | 0.004 | 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 | 3.638 | -0.198 | 0.972 | -0.056 | -0.057 | 0.094 | 
| Slide | -0.198 | 6.020 | 0.768 | 0.068 | 0.023 | -0.363 | 
| Rise | 0.972 | 0.768 | 7.603 | -0.267 | 0.067 | -0.004 | 
| Tilt | -0.056 | 0.068 | -0.267 | 0.047 | -0.003 | 0.000 | 
| Roll | -0.057 | 0.023 | 0.067 | -0.003 | 0.024 | -0.005 | 
| Twist | 0.094 | -0.363 | -0.004 | 0.000 | -0.005 | 0.089 | 
                        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 | 1.665 | 0.592 | 0.695 | -0.147 | 0.060 | -0.006 | 
| Slide | 0.592 | 2.273 | 1.731 | -0.018 | 0.016 | -0.108 | 
| Rise | 0.695 | 1.731 | 9.959 | -0.284 | -0.031 | -0.179 | 
| Tilt | -0.147 | -0.018 | -0.284 | 0.051 | -0.003 | 0.003 | 
| Roll | 0.060 | 0.016 | -0.031 | -0.003 | 0.022 | 0.007 | 
| Twist | -0.006 | -0.108 | -0.179 | 0.003 | 0.007 | 0.042 | 
                        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 | 2.233 | 0.734 | 0.246 | -0.132 | -0.024 | 0.008 | 
| Slide | 0.734 | 3.141 | 1.838 | 0.110 | -0.076 | -0.127 | 
| Rise | 0.246 | 1.838 | 8.702 | -0.223 | -0.057 | -0.169 | 
| Tilt | -0.132 | 0.110 | -0.223 | 0.048 | -0.001 | -0.007 | 
| Roll | -0.024 | -0.076 | -0.057 | -0.001 | 0.031 | 0.011 | 
| Twist | 0.008 | -0.127 | -0.169 | -0.007 | 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 | 4.234 | -0.897 | 0.614 | -0.088 | 0.067 | 0.152 | 
| Slide | -0.897 | 5.147 | 1.389 | -0.056 | 0.010 | -0.319 | 
| Rise | 0.614 | 1.389 | 11.388 | -0.488 | 0.092 | -0.019 | 
| Tilt | -0.088 | -0.056 | -0.488 | 0.059 | -0.008 | -0.007 | 
| Roll | 0.067 | 0.010 | 0.092 | -0.008 | 0.021 | -0.002 | 
| Twist | 0.152 | -0.319 | -0.019 | -0.007 | -0.002 | 0.100 | 
                        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 | 4.981 | -0.120 | 0.577 | -0.115 | 0.068 | -0.048 | 
| Slide | -0.120 | 4.871 | 1.323 | -0.054 | -0.062 | -0.268 | 
| Rise | 0.577 | 1.323 | 9.728 | -0.453 | 0.217 | 0.033 | 
| Tilt | -0.115 | -0.054 | -0.453 | 0.067 | -0.019 | -0.006 | 
| Roll | 0.068 | -0.062 | 0.217 | -0.019 | 0.031 | 0.001 | 
| Twist | -0.048 | -0.268 | 0.033 | -0.006 | 0.001 | 0.081 | 
                        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 | 1.142 | -0.007 | 0.711 | -0.103 | 0.015 | -0.012 | 
| Slide | -0.007 | 2.430 | 1.730 | -0.044 | -0.019 | -0.135 | 
| Rise | 0.711 | 1.730 | 11.356 | -0.380 | -0.074 | -0.264 | 
| Tilt | -0.103 | -0.044 | -0.380 | 0.048 | -0.002 | 0.005 | 
| Roll | 0.015 | -0.019 | -0.074 | -0.002 | 0.019 | 0.004 | 
| Twist | -0.012 | -0.135 | -0.264 | 0.005 | 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 | 4.325 | 0.585 | 1.319 | -0.180 | 0.013 | 0.088 | 
| Slide | 0.584 | 5.030 | 1.234 | 0.043 | 0.005 | -0.237 | 
| Rise | 1.319 | 1.234 | 12.115 | -0.417 | 0.051 | -0.134 | 
| Tilt | -0.180 | 0.043 | -0.417 | 0.058 | -0.004 | 0.002 | 
| Roll | 0.013 | 0.005 | 0.051 | -0.004 | 0.027 | -0.007 | 
| Twist | 0.088 | -0.237 | -0.134 | 0.002 | -0.007 | 0.073 | 
                        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 | 2.380 | -0.225 | -0.298 | -0.070 | -0.004 | -0.058 | 
| Slide | -0.225 | 6.689 | 3.077 | 0.045 | 0.016 | -0.265 | 
| Rise | -0.298 | 3.077 | 12.105 | -0.077 | 0.005 | -0.239 | 
| Tilt | -0.070 | 0.045 | -0.077 | 0.048 | -0.005 | -0.006 | 
| Roll | -0.004 | 0.016 | 0.005 | -0.005 | 0.040 | 0.006 | 
| Twist | -0.058 | -0.265 | -0.239 | -0.006 | 0.006 | 0.070 | 
                        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 | 2.471 | -0.131 | 0.086 | -0.025 | 0.038 | -0.035 | 
| Slide | -0.131 | 6.767 | 3.168 | -0.051 | 0.005 | -0.181 | 
| Rise | 0.086 | 3.168 | 9.942 | -0.014 | -0.067 | -0.286 | 
| Tilt | -0.025 | -0.051 | -0.014 | 0.043 | -0.001 | -0.003 | 
| Roll | 0.038 | 0.005 | -0.067 | -0.001 | 0.024 | 0.005 | 
| Twist | -0.035 | -0.181 | -0.286 | -0.003 | 0.005 | 0.048 | 
                        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 | 1.557 | -0.400 | -0.431 | -0.039 | -0.018 | -0.078 | 
| Slide | -0.400 | 3.894 | 3.519 | -0.017 | -0.003 | -0.056 | 
| Rise | -0.431 | 3.519 | 10.889 | -0.077 | 0.022 | -0.200 | 
| Tilt | -0.039 | -0.017 | -0.077 | 0.043 | -0.007 | -0.004 | 
| Roll | -0.018 | -0.003 | 0.022 | -0.007 | 0.029 | 0.007 | 
| Twist | -0.078 | -0.056 | -0.200 | -0.004 | 0.007 | 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 | 1.793 | -0.720 | -0.699 | -0.052 | 0.025 | -0.079 | 
| Slide | -0.720 | 4.490 | 2.019 | -0.021 | 0.005 | -0.047 | 
| Rise | -0.699 | 2.019 | 10.879 | -0.048 | 0.045 | -0.172 | 
| Tilt | -0.052 | -0.021 | -0.048 | 0.043 | -0.004 | -0.004 | 
| Roll | 0.025 | 0.005 | 0.045 | -0.004 | 0.027 | 0.010 | 
| Twist | -0.079 | -0.047 | -0.172 | -0.004 | 0.010 | 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 | 2.427 | -0.510 | 0.138 | -0.042 | 0.055 | -0.073 | 
| Slide | -0.510 | 4.097 | 2.332 | -0.045 | 0.002 | -0.248 | 
| Rise | 0.138 | 2.332 | 8.982 | -0.055 | 0.073 | -0.108 | 
| Tilt | -0.042 | -0.045 | -0.055 | 0.046 | -0.005 | -0.005 | 
| Roll | 0.055 | 0.002 | 0.073 | -0.005 | 0.026 | 0.004 | 
| Twist | -0.073 | -0.248 | -0.108 | -0.005 | 0.004 | 0.066 | 
                        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 | 1.552 | -0.114 | -0.366 | -0.047 | 0.005 | 0.006 | 
| Slide | -0.114 | 4.771 | 3.005 | -0.008 | -0.069 | -0.127 | 
| Rise | -0.366 | 3.005 | 9.622 | -0.078 | -0.081 | -0.190 | 
| Tilt | -0.047 | -0.008 | -0.078 | 0.031 | -0.003 | -0.002 | 
| Roll | 0.005 | -0.069 | -0.081 | -0.003 | 0.022 | 0.010 | 
| Twist | 0.006 | -0.127 | -0.190 | -0.002 | 0.010 | 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 | 1.637 | 0.449 | -0.091 | -0.060 | 0.011 | -0.027 | 
| Slide | 0.449 | 5.037 | 2.766 | 0.028 | -0.018 | -0.136 | 
| Rise | -0.091 | 2.766 | 11.423 | -0.086 | -0.025 | -0.141 | 
| Tilt | -0.060 | 0.028 | -0.086 | 0.048 | -0.009 | -0.003 | 
| Roll | 0.011 | -0.018 | -0.025 | -0.009 | 0.044 | 0.010 | 
| Twist | -0.027 | -0.136 | -0.141 | -0.003 | 0.010 | 0.044 | 
                        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 | 0.053 | 0.166 | -0.047 | 0.001 | -0.021 | 
| Slide | 0.053 | 1.851 | 1.046 | -0.013 | -0.025 | -0.085 | 
| Rise | 0.166 | 1.046 | 6.939 | -0.003 | -0.049 | -0.131 | 
| Tilt | -0.047 | -0.013 | -0.003 | 0.024 | 0.001 | 0.003 | 
| Roll | 0.001 | -0.025 | -0.049 | 0.001 | 0.012 | 0.006 | 
| Twist | -0.021 | -0.085 | -0.131 | 0.003 | 0.006 | 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 | 1.560 | -0.347 | 0.347 | -0.052 | -0.010 | -0.020 | 
| Slide | -0.347 | 1.483 | -0.116 | 0.001 | 0.044 | -0.052 | 
| Rise | 0.347 | -0.116 | 9.314 | -0.028 | -0.238 | -0.178 | 
| Tilt | -0.052 | 0.001 | -0.028 | 0.026 | -0.005 | 0.003 | 
| Roll | -0.010 | 0.044 | -0.238 | -0.005 | 0.030 | 0.015 | 
| Twist | -0.020 | -0.052 | -0.178 | 0.003 | 0.015 | 0.043 | 
                        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 | 0.664 | 0.106 | -0.106 | -0.049 | -0.009 | -0.002 | 
| Slide | 0.106 | 1.920 | 1.372 | 0.019 | 0.020 | -0.109 | 
| Rise | -0.106 | 1.371 | 7.115 | 0.032 | -0.081 | -0.190 | 
| Tilt | -0.049 | 0.019 | 0.032 | 0.026 | 0.000 | 0.001 | 
| Roll | -0.009 | 0.020 | -0.081 | 0.000 | 0.021 | 0.013 | 
| Twist | -0.002 | -0.109 | -0.190 | 0.001 | 0.013 | 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 | 0.648 | -0.018 | -0.059 | -0.017 | -0.010 | 0.043 | 
| Slide | -0.018 | 1.991 | 1.538 | 0.046 | -0.003 | -0.078 | 
| Rise | -0.059 | 1.538 | 6.464 | -0.002 | -0.049 | -0.168 | 
| Tilt | -0.017 | 0.046 | -0.002 | 0.025 | 0.002 | -0.004 | 
| Roll | -0.010 | -0.003 | -0.049 | 0.002 | 0.021 | 0.011 | 
| Twist | 0.043 | -0.078 | -0.168 | -0.004 | 0.011 | 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 | 0.895 | 0.137 | 0.093 | -0.033 | 0.003 | 0.013 | 
| Slide | 0.137 | 2.523 | 1.228 | -0.016 | 0.028 | -0.093 | 
| Rise | 0.093 | 1.228 | 6.704 | -0.027 | -0.089 | -0.183 | 
| Tilt | -0.033 | -0.016 | -0.027 | 0.026 | -0.001 | 0.001 | 
| Roll | 0.003 | 0.028 | -0.089 | -0.001 | 0.023 | 0.012 | 
| Twist | 0.013 | -0.093 | -0.183 | 0.001 | 0.012 | 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 | 3.682 | 2.244 | -1.176 | -0.008 | 0.005 | 0.035 | 
| Slide | 2.244 | 5.468 | -0.901 | 0.008 | 0.025 | -0.105 | 
| Rise | -1.176 | -0.901 | 11.439 | 0.114 | -0.275 | -0.118 | 
| Tilt | -0.008 | 0.008 | 0.114 | 0.036 | 0.004 | 0.000 | 
| Roll | 0.005 | 0.025 | -0.275 | 0.004 | 0.040 | 0.016 | 
| Twist | 0.035 | -0.105 | -0.118 | 0.000 | 0.016 | 0.067 | 
                        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 | 2.115 | -0.024 | 0.179 | -0.024 | -0.044 | 0.004 | 
| Slide | -0.024 | 1.769 | 0.784 | -0.023 | -0.007 | -0.070 | 
| Rise | 0.179 | 0.784 | 4.794 | 0.068 | -0.054 | -0.131 | 
| Tilt | -0.024 | -0.023 | 0.068 | 0.023 | 0.000 | -0.002 | 
| Roll | -0.044 | -0.007 | -0.054 | 0.000 | 0.019 | 0.009 | 
| Twist | 0.004 | -0.070 | -0.131 | -0.002 | 0.009 | 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 | 1.052 | 0.370 | -0.211 | -0.048 | 0.024 | -0.029 | 
| Slide | 0.370 | 2.154 | 1.282 | -0.011 | -0.007 | -0.147 | 
| Rise | -0.211 | 1.282 | 5.736 | 0.020 | -0.032 | -0.152 | 
| Tilt | -0.048 | -0.011 | 0.020 | 0.025 | -0.001 | 0.001 | 
| Roll | 0.024 | -0.007 | -0.032 | -0.001 | 0.017 | 0.008 | 
| Twist | -0.029 | -0.147 | -0.152 | 0.001 | 0.008 | 0.043 | 
                        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 | 1.830 | -0.422 | -1.034 | -0.112 | -0.054 | 0.011 | 
| Slide | -0.422 | 4.011 | 1.438 | -0.007 | -0.067 | -0.174 | 
| Rise | -1.034 | 1.438 | 9.764 | 0.345 | 0.020 | -0.175 | 
| Tilt | -0.112 | -0.007 | 0.345 | 0.048 | 0.008 | -0.001 | 
| Roll | -0.054 | -0.067 | 0.020 | 0.008 | 0.024 | 0.007 | 
| Twist | 0.011 | -0.174 | -0.175 | -0.001 | 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 | 2.620 | -0.625 | -0.753 | -0.100 | -0.099 | 0.117 | 
| Slide | -0.625 | 3.116 | 0.967 | -0.003 | 0.014 | -0.132 | 
| Rise | -0.753 | 0.967 | 9.913 | 0.363 | 0.047 | -0.087 | 
| Tilt | -0.100 | -0.003 | 0.363 | 0.050 | 0.006 | 0.001 | 
| Roll | -0.099 | 0.014 | 0.047 | 0.006 | 0.022 | 0.004 | 
| Twist | 0.117 | -0.132 | -0.087 | 0.001 | 0.004 | 0.048 | 
                        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 | 1.639 | -0.239 | -0.413 | -0.056 | -0.054 | 0.048 | 
| Slide | -0.239 | 3.530 | 1.737 | 0.032 | -0.026 | -0.146 | 
| Rise | -0.413 | 1.738 | 8.637 | 0.290 | -0.095 | -0.245 | 
| Tilt | -0.056 | 0.032 | 0.290 | 0.041 | 0.004 | 0.001 | 
| Roll | -0.054 | -0.026 | -0.095 | 0.004 | 0.015 | 0.000 | 
| Twist | 0.048 | -0.146 | -0.245 | 0.001 | 0.000 | 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 | 2.675 | -1.158 | -1.029 | -0.111 | -0.041 | 0.083 | 
| Slide | -1.158 | 3.757 | 0.882 | -0.076 | -0.044 | -0.118 | 
| Rise | -1.029 | 0.882 | 9.999 | 0.321 | 0.121 | -0.098 | 
| Tilt | -0.111 | -0.076 | 0.321 | 0.052 | 0.007 | 0.002 | 
| Roll | -0.041 | -0.044 | 0.121 | 0.007 | 0.023 | 0.005 | 
| Twist | 0.083 | -0.118 | -0.098 | 0.002 | 0.005 | 0.054 | 
                        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 | 1.130 | -0.277 | 0.127 | -0.040 | -0.025 | -0.038 | 
| Slide | -0.276 | 2.492 | 1.100 | -0.073 | -0.048 | -0.147 | 
| Rise | 0.127 | 1.100 | 10.402 | 0.218 | -0.131 | -0.190 | 
| Tilt | -0.040 | -0.073 | 0.218 | 0.035 | -0.001 | 0.004 | 
| Roll | -0.025 | -0.048 | -0.131 | -0.001 | 0.022 | 0.012 | 
| Twist | -0.038 | -0.147 | -0.190 | 0.004 | 0.012 | 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 | 2.736 | -0.065 | -1.000 | -0.103 | 0.005 | 0.047 | 
| Slide | -0.065 | 3.837 | 2.480 | 0.054 | -0.126 | -0.076 | 
| Rise | -1.000 | 2.480 | 13.888 | 0.498 | -0.154 | -0.173 | 
| Tilt | -0.103 | 0.054 | 0.498 | 0.057 | 0.003 | 0.001 | 
| Roll | 0.005 | -0.126 | -0.154 | 0.003 | 0.036 | 0.016 | 
| Twist | 0.047 | -0.076 | -0.173 | 0.001 | 0.016 | 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 | 1.927 | -0.741 | -0.882 | -0.087 | -0.011 | 0.078 | 
| Slide | -0.741 | 3.270 | 1.667 | -0.016 | -0.050 | -0.113 | 
| Rise | -0.882 | 1.667 | 10.458 | 0.310 | -0.042 | -0.156 | 
| Tilt | -0.087 | -0.016 | 0.310 | 0.046 | 0.004 | -0.001 | 
| Roll | -0.011 | -0.050 | -0.042 | 0.004 | 0.029 | 0.010 | 
| Twist | 0.078 | -0.113 | -0.156 | -0.001 | 0.010 | 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 | 1.867 | -0.736 | -0.435 | -0.095 | -0.015 | 0.014 | 
| Slide | -0.736 | 3.482 | 2.050 | 0.002 | -0.051 | -0.167 | 
| Rise | -0.435 | 2.050 | 10.958 | 0.293 | -0.058 | -0.195 | 
| Tilt | -0.095 | 0.002 | 0.293 | 0.045 | 0.003 | 0.000 | 
| Roll | -0.015 | -0.051 | -0.058 | 0.003 | 0.027 | 0.011 | 
| Twist | 0.014 | -0.167 | -0.195 | 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)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 3.668 | 0.646 | -0.285 | -0.003 | -0.074 | 0.030 | 
| Slide | 0.646 | 4.160 | 0.740 | -0.046 | 0.055 | -0.127 | 
| Rise | -0.285 | 0.740 | 7.742 | 0.088 | -0.009 | -0.131 | 
| Tilt | -0.003 | -0.046 | 0.088 | 0.034 | -0.003 | 0.010 | 
| Roll | -0.074 | 0.055 | -0.009 | -0.003 | 0.016 | -0.001 | 
| Twist | 0.030 | -0.127 | -0.131 | 0.010 | -0.001 | 0.051 | 
                        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 | 0.808 | -0.008 | -0.407 | -0.070 | -0.013 | 0.003 | 
| Slide | -0.008 | 2.520 | 0.754 | 0.017 | 0.031 | -0.118 | 
| Rise | -0.407 | 0.754 | 8.193 | 0.017 | -0.013 | -0.190 | 
| Tilt | -0.070 | 0.017 | 0.017 | 0.031 | 0.003 | 0.001 | 
| Roll | -0.013 | 0.031 | -0.013 | 0.003 | 0.016 | 0.004 | 
| Twist | 0.003 | -0.118 | -0.190 | 0.001 | 0.004 | 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 | 1.575 | -0.520 | 0.242 | -0.082 | -0.034 | -0.017 | 
| Slide | -0.520 | 4.057 | 1.038 | -0.004 | -0.042 | -0.150 | 
| Rise | 0.242 | 1.038 | 7.989 | -0.065 | -0.066 | -0.182 | 
| Tilt | -0.082 | -0.004 | -0.065 | 0.032 | 0.001 | -0.007 | 
| Roll | -0.034 | -0.042 | -0.066 | 0.001 | 0.021 | 0.007 | 
| Twist | -0.017 | -0.150 | -0.182 | -0.007 | 0.007 | 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 | 1.034 | -0.126 | -0.742 | -0.090 | 0.001 | 0.039 | 
| Slide | -0.126 | 3.753 | 0.670 | 0.065 | 0.010 | -0.186 | 
| Rise | -0.742 | 0.670 | 8.788 | -0.026 | -0.052 | -0.249 | 
| Tilt | -0.090 | 0.065 | -0.026 | 0.032 | 0.005 | -0.003 | 
| Roll | 0.001 | 0.010 | -0.052 | 0.005 | 0.020 | 0.008 | 
| Twist | 0.039 | -0.186 | -0.249 | -0.003 | 0.008 | 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 | 1.849 | -0.011 | -0.288 | -0.095 | 0.042 | -0.046 | 
| Slide | -0.011 | 3.750 | 0.268 | -0.044 | 0.014 | -0.148 | 
| Rise | -0.289 | 0.268 | 7.502 | -0.071 | -0.116 | -0.137 | 
| Tilt | -0.095 | -0.044 | -0.071 | 0.034 | 0.001 | -0.011 | 
| Roll | 0.042 | 0.014 | -0.116 | 0.001 | 0.020 | 0.010 | 
| Twist | -0.046 | -0.148 | -0.137 | -0.011 | 0.010 | 0.048 | 
                        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 | 1.841 | 0.006 | 0.128 | -0.084 | 0.014 | -0.055 | 
| Slide | 0.006 | 3.233 | -0.460 | 0.005 | 0.038 | -0.158 | 
| Rise | 0.128 | -0.460 | 8.830 | -0.048 | -0.165 | -0.141 | 
| Tilt | -0.084 | 0.005 | -0.048 | 0.025 | -0.001 | -0.006 | 
| Roll | 0.014 | 0.038 | -0.165 | -0.001 | 0.023 | 0.009 | 
| Twist | -0.055 | -0.158 | -0.141 | -0.006 | 0.009 | 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 | 3.130 | 0.600 | -0.229 | -0.024 | -0.026 | -0.048 | 
| Slide | 0.600 | 3.543 | 1.587 | -0.034 | -0.011 | -0.136 | 
| Rise | -0.229 | 1.587 | 5.379 | 0.073 | 0.011 | -0.099 | 
| Tilt | -0.024 | -0.034 | 0.073 | 0.031 | -0.000 | 0.004 | 
| Roll | -0.026 | -0.011 | 0.011 | -0.000 | 0.018 | 0.001 | 
| Twist | -0.048 | -0.136 | -0.099 | 0.004 | 0.001 | 0.048 | 
                        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 | 2.104 | 0.661 | -0.264 | -0.014 | 0.019 | 0.095 | 
| Slide | 0.661 | 3.094 | -0.111 | 0.041 | -0.022 | -0.044 | 
| Rise | -0.264 | -0.111 | 10.275 | 0.048 | -0.163 | -0.214 | 
| Tilt | -0.014 | 0.041 | 0.048 | 0.034 | 0.003 | 0.007 | 
| Roll | 0.019 | -0.022 | -0.163 | 0.003 | 0.026 | 0.013 | 
| Twist | 0.095 | -0.044 | -0.214 | 0.007 | 0.013 | 0.043 | 
                        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 | 2.530 | -1.347 | 0.034 | -0.075 | -0.015 | 0.063 | 
| Slide | -1.347 | 3.094 | 0.965 | -0.057 | 0.040 | -0.196 | 
| Rise | 0.034 | 0.965 | 8.427 | -0.100 | -0.149 | -0.164 | 
| Tilt | -0.075 | -0.057 | -0.100 | 0.038 | -0.004 | -0.003 | 
| Roll | -0.015 | 0.040 | -0.149 | -0.004 | 0.026 | 0.006 | 
| Twist | 0.063 | -0.196 | -0.164 | -0.003 | 0.006 | 0.071 | 
                        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 | 1.137 | 0.352 | -0.431 | -0.076 | 0.017 | -0.017 | 
| Slide | 0.352 | 2.750 | 0.660 | -0.001 | 0.017 | -0.186 | 
| Rise | -0.431 | 0.660 | 8.288 | -0.002 | -0.036 | -0.216 | 
| Tilt | -0.076 | -0.001 | -0.002 | 0.027 | 0.003 | 0.003 | 
| Roll | 0.017 | 0.017 | -0.036 | 0.003 | 0.018 | 0.005 | 
| Twist | -0.017 | -0.186 | -0.216 | 0.003 | 0.005 | 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 | 0.915 | -0.321 | 0.252 | -0.056 | -0.014 | 0.055 | 
| Slide | -0.321 | 5.320 | 1.025 | -0.073 | -0.005 | -0.218 | 
| Rise | 0.252 | 1.025 | 7.280 | -0.094 | -0.139 | -0.127 | 
| Tilt | -0.056 | -0.073 | -0.094 | 0.033 | 0.001 | -0.009 | 
| Roll | -0.014 | -0.005 | -0.139 | 0.001 | 0.024 | 0.008 | 
| Twist | 0.055 | -0.218 | -0.127 | -0.009 | 0.008 | 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 | 1.448 | 0.292 | -0.337 | -0.119 | -0.027 | 0.038 | 
| Slide | 0.292 | 2.889 | 0.131 | -0.003 | 0.011 | -0.063 | 
| Rise | -0.337 | 0.131 | 7.267 | 0.005 | -0.045 | -0.240 | 
| Tilt | -0.119 | -0.003 | 0.005 | 0.030 | 0.002 | -0.006 | 
| Roll | -0.027 | 0.011 | -0.045 | 0.002 | 0.018 | 0.007 | 
| Twist | 0.038 | -0.063 | -0.240 | -0.006 | 0.007 | 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 | 1.764 | 0.157 | -0.335 | -0.026 | -0.020 | 0.027 | 
| Slide | 0.157 | 3.661 | 0.969 | -0.009 | -0.015 | -0.027 | 
| Rise | -0.335 | 0.969 | 7.594 | 0.034 | -0.209 | -0.242 | 
| Tilt | -0.026 | -0.009 | 0.034 | 0.035 | -0.002 | -0.003 | 
| Roll | -0.020 | -0.015 | -0.209 | -0.002 | 0.028 | 0.011 | 
| Twist | 0.027 | -0.027 | -0.242 | -0.003 | 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 | 1.779 | 0.490 | 0.007 | -0.067 | -0.081 | 0.029 | 
| Slide | 0.490 | 4.525 | 0.939 | 0.035 | -0.004 | -0.296 | 
| Rise | 0.007 | 0.939 | 8.128 | 0.012 | -0.170 | -0.092 | 
| Tilt | -0.067 | 0.035 | 0.012 | 0.034 | -0.000 | -0.003 | 
| Roll | -0.081 | -0.004 | -0.170 | -0.000 | 0.029 | 0.005 | 
| Twist | 0.029 | -0.296 | -0.092 | -0.003 | 0.005 | 0.065 | 
                        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 | 2.062 | -1.260 | -0.913 | -0.053 | -0.025 | -0.035 | 
| Slide | -1.260 | 4.915 | 1.726 | 0.067 | -0.036 | -0.237 | 
| Rise | -0.913 | 1.726 | 9.892 | 0.227 | -0.074 | -0.253 | 
| Tilt | -0.053 | 0.067 | 0.227 | 0.047 | -0.003 | -0.013 | 
| Roll | -0.025 | -0.036 | -0.074 | -0.003 | 0.029 | 0.008 | 
| Twist | -0.035 | -0.237 | -0.253 | -0.013 | 0.008 | 0.055 | 
                        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 | 1.765 | -0.017 | -0.657 | -0.043 | 0.016 | -0.075 | 
| Slide | -0.017 | 3.252 | 1.710 | 0.053 | -0.098 | -0.110 | 
| Rise | -0.657 | 1.710 | 10.074 | 0.373 | -0.086 | -0.206 | 
| Tilt | -0.043 | 0.053 | 0.373 | 0.053 | -0.002 | -0.008 | 
| Roll | 0.016 | -0.098 | -0.086 | -0.002 | 0.031 | 0.012 | 
| Twist | -0.075 | -0.110 | -0.206 | -0.008 | 0.012 | 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 | 3.052 | 0.360 | -0.257 | -0.101 | -0.005 | 0.000 | 
| Slide | 0.360 | 2.902 | -1.045 | 0.035 | -0.078 | -0.209 | 
| Rise | -0.257 | -1.045 | 8.223 | 0.288 | 0.025 | -0.040 | 
| Tilt | -0.101 | 0.035 | 0.288 | 0.045 | -0.001 | -0.001 | 
| Roll | -0.005 | -0.078 | 0.025 | -0.001 | 0.017 | 0.020 | 
| Twist | 0.000 | -0.209 | -0.040 | -0.001 | 0.020 | 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 | 2.431 | 0.819 | -0.581 | -0.080 | -0.046 | -0.110 | 
| Slide | 0.819 | 2.413 | 1.105 | -0.006 | 0.041 | -0.226 | 
| Rise | -0.581 | 1.105 | 6.859 | 0.284 | 0.063 | -0.083 | 
| Tilt | -0.080 | -0.006 | 0.284 | 0.045 | -0.002 | -0.002 | 
| Roll | -0.046 | 0.041 | 0.063 | -0.002 | 0.013 | 0.007 | 
| Twist | -0.110 | -0.226 | -0.083 | -0.002 | 0.007 | 0.048 | 
                        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 | 2.697 | -1.479 | -0.016 | 0.015 | 0.007 | -0.049 | 
| Slide | -1.479 | 3.954 | 0.748 | 0.038 | -0.079 | -0.228 | 
| Rise | -0.016 | 0.748 | 9.875 | 0.326 | 0.151 | -0.220 | 
| Tilt | 0.015 | 0.038 | 0.326 | 0.052 | 0.011 | -0.012 | 
| Roll | 0.007 | -0.079 | 0.151 | 0.011 | 0.028 | 0.010 | 
| Twist | -0.049 | -0.228 | -0.220 | -0.012 | 0.010 | 0.044 | 
                        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 | 2.764 | -0.880 | -0.690 | -0.011 | -0.023 | -0.058 | 
| Slide | -0.880 | 4.072 | 1.579 | 0.032 | -0.024 | -0.243 | 
| Rise | -0.690 | 1.579 | 8.578 | 0.145 | 0.057 | -0.216 | 
| Tilt | -0.011 | 0.032 | 0.145 | 0.043 | 0.003 | -0.009 | 
| Roll | -0.023 | -0.024 | 0.057 | 0.003 | 0.026 | 0.005 | 
| Twist | -0.058 | -0.243 | -0.216 | -0.009 | 0.005 | 0.070 | 
                        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 | 2.270 | -0.590 | -0.916 | -0.030 | -0.064 | 0.038 | 
| Slide | -0.590 | 5.297 | 1.897 | 0.063 | 0.011 | -0.307 | 
| Rise | -0.916 | 1.896 | 7.944 | 0.245 | 0.076 | -0.167 | 
| Tilt | -0.030 | 0.063 | 0.245 | 0.045 | 0.005 | -0.005 | 
| Roll | -0.064 | 0.011 | 0.076 | 0.005 | 0.020 | -0.005 | 
| Twist | 0.038 | -0.307 | -0.167 | -0.005 | -0.005 | 0.074 | 
                        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 | 2.899 | -0.975 | -0.489 | 0.014 | -0.003 | -0.049 | 
| Slide | -0.975 | 3.458 | 0.407 | -0.055 | -0.039 | -0.256 | 
| Rise | -0.489 | 0.407 | 8.910 | 0.274 | 0.097 | -0.208 | 
| Tilt | 0.014 | -0.055 | 0.274 | 0.043 | 0.004 | -0.008 | 
| Roll | -0.003 | -0.039 | 0.097 | 0.004 | 0.024 | 0.009 | 
| Twist | -0.049 | -0.256 | -0.208 | -0.008 | 0.009 | 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 | 2.158 | -0.316 | -0.741 | -0.032 | -0.006 | -0.058 | 
| Slide | -0.316 | 5.044 | 2.485 | 0.064 | -0.177 | -0.158 | 
| Rise | -0.741 | 2.485 | 12.640 | 0.327 | -0.222 | -0.209 | 
| Tilt | -0.032 | 0.064 | 0.327 | 0.054 | -0.009 | -0.008 | 
| Roll | -0.006 | -0.177 | -0.222 | -0.009 | 0.037 | 0.007 | 
| Twist | -0.058 | -0.158 | -0.209 | -0.008 | 0.007 | 0.054 | 
                        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 | 2.661 | -0.315 | -0.430 | -0.047 | 0.025 | -0.115 | 
| Slide | -0.315 | 3.903 | 0.556 | -0.023 | -0.033 | -0.178 | 
| Rise | -0.430 | 0.556 | 10.534 | 0.217 | 0.039 | -0.136 | 
| Tilt | -0.047 | -0.023 | 0.217 | 0.046 | 0.001 | -0.004 | 
| Roll | 0.025 | -0.033 | 0.039 | 0.001 | 0.028 | -0.001 | 
| Twist | -0.115 | -0.178 | -0.136 | -0.004 | -0.001 | 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 | 2.610 | -0.375 | -0.443 | -0.006 | 0.036 | -0.057 | 
| Slide | -0.375 | 2.923 | 1.089 | -0.002 | -0.090 | -0.087 | 
| Rise | -0.443 | 1.089 | 10.184 | 0.191 | -0.064 | -0.188 | 
| Tilt | -0.006 | -0.002 | 0.191 | 0.041 | -0.002 | -0.002 | 
| Roll | 0.036 | -0.090 | -0.064 | -0.002 | 0.027 | 0.012 | 
| Twist | -0.057 | -0.087 | -0.188 | -0.002 | 0.012 | 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 | 1.911 | 0.180 | 0.007 | 0.006 | -0.009 | -0.124 | 
| Slide | 0.180 | 3.781 | 0.938 | -0.043 | -0.122 | -0.216 | 
| Rise | 0.007 | 0.938 | 10.041 | 0.270 | -0.058 | -0.144 | 
| Tilt | 0.006 | -0.043 | 0.270 | 0.045 | -0.002 | -0.002 | 
| Roll | -0.009 | -0.122 | -0.058 | -0.002 | 0.024 | 0.007 | 
| Twist | -0.124 | -0.216 | -0.144 | -0.002 | 0.007 | 0.044 | 
                        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)