|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 1.330 | 0.676 | 0.808 | -0.047 | 0.003 | -0.000 | 
| Slide | 0.676 | 2.944 | 0.236 | 0.032 | -0.082 | -0.214 | 
| Rise | 0.808 | 0.236 | 10.242 | -0.364 | 0.073 | -0.162 | 
| Tilt | -0.047 | 0.032 | -0.364 | 0.051 | -0.006 | 0.003 | 
| Roll | 0.003 | -0.082 | 0.073 | -0.006 | 0.026 | 0.016 | 
| Twist | -0.000 | -0.214 | -0.162 | 0.003 | 0.016 | 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 | 2.061 | 0.444 | 0.709 | -0.035 | 0.060 | -0.031 | 
| Slide | 0.444 | 4.947 | 1.907 | -0.091 | 0.005 | -0.250 | 
| Rise | 0.709 | 1.907 | 7.819 | -0.288 | 0.067 | -0.308 | 
| Tilt | -0.035 | -0.091 | -0.288 | 0.049 | -0.007 | 0.014 | 
| Roll | 0.060 | 0.005 | 0.067 | -0.007 | 0.019 | 0.004 | 
| Twist | -0.031 | -0.250 | -0.308 | 0.014 | 0.004 | 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 | 2.204 | 1.030 | 0.482 | -0.001 | 0.053 | -0.030 | 
| Slide | 1.030 | 4.498 | 1.476 | -0.071 | -0.042 | -0.172 | 
| Rise | 0.482 | 1.476 | 8.778 | -0.436 | 0.120 | -0.153 | 
| Tilt | -0.001 | -0.071 | -0.436 | 0.056 | -0.009 | 0.005 | 
| Roll | 0.053 | -0.042 | 0.120 | -0.009 | 0.018 | 0.003 | 
| Twist | -0.030 | -0.172 | -0.153 | 0.005 | 0.003 | 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 | 0.714 | -0.223 | 0.053 | -0.039 | 0.068 | 0.067 | 
| Slide | -0.223 | 1.723 | 0.487 | -0.071 | 0.016 | -0.105 | 
| Rise | 0.053 | 0.487 | 1.125 | -0.105 | 0.048 | -0.007 | 
| Tilt | -0.039 | -0.071 | -0.105 | 0.021 | -0.006 | -0.001 | 
| Roll | 0.068 | 0.016 | 0.048 | -0.006 | 0.017 | 0.002 | 
| Twist | 0.067 | -0.105 | -0.007 | -0.001 | 0.002 | 0.018 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 0.493 | -0.185 | 0.405 | -0.054 | -0.017 | -0.005 | 
| Slide | -0.185 | 1.558 | -0.036 | -0.021 | 0.015 | -0.082 | 
| Rise | 0.405 | -0.036 | 1.093 | -0.040 | 0.020 | -0.018 | 
| Tilt | -0.054 | -0.021 | -0.040 | 0.013 | 0.002 | -0.000 | 
| Roll | -0.017 | 0.015 | 0.020 | 0.002 | 0.010 | 0.001 | 
| Twist | -0.005 | -0.082 | -0.018 | -0.000 | 0.001 | 0.011 | 
                        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 | 1.693 | 0.912 | 0.740 | -0.004 | 0.009 | -0.001 | 
| Slide | 0.912 | 5.181 | 1.297 | -0.041 | -0.045 | -0.275 | 
| Rise | 0.740 | 1.297 | 11.486 | -0.279 | -0.054 | -0.207 | 
| Tilt | -0.004 | -0.041 | -0.279 | 0.047 | 0.000 | 0.008 | 
| Roll | 0.009 | -0.045 | -0.054 | 0.000 | 0.027 | 0.002 | 
| Twist | -0.001 | -0.275 | -0.207 | 0.008 | 0.002 | 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 | 2.686 | 0.171 | 0.855 | -0.102 | 0.045 | -0.010 | 
| Slide | 0.171 | 3.287 | 1.527 | -0.033 | -0.057 | -0.194 | 
| Rise | 0.855 | 1.527 | 10.203 | -0.351 | -0.123 | -0.253 | 
| Tilt | -0.102 | -0.033 | -0.351 | 0.054 | 0.004 | 0.007 | 
| Roll | 0.045 | -0.057 | -0.123 | 0.004 | 0.034 | 0.012 | 
| Twist | -0.010 | -0.194 | -0.253 | 0.007 | 0.012 | 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 | 2.114 | 0.467 | 0.271 | -0.039 | 0.028 | 0.098 | 
| Slide | 0.467 | 4.925 | 0.736 | -0.020 | -0.079 | -0.166 | 
| Rise | 0.271 | 0.736 | 9.956 | -0.199 | 0.013 | -0.150 | 
| Tilt | -0.039 | -0.020 | -0.199 | 0.047 | -0.001 | 0.010 | 
| Roll | 0.028 | -0.079 | 0.013 | -0.001 | 0.024 | 0.013 | 
| Twist | 0.098 | -0.166 | -0.150 | 0.010 | 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 | 1.836 | 0.300 | 0.529 | -0.026 | -0.007 | 0.106 | 
| Slide | 0.300 | 2.808 | 1.564 | -0.046 | -0.141 | -0.088 | 
| Rise | 0.529 | 1.564 | 9.287 | -0.211 | -0.191 | -0.210 | 
| Tilt | -0.026 | -0.046 | -0.211 | 0.039 | 0.005 | 0.009 | 
| Roll | -0.007 | -0.141 | -0.191 | 0.005 | 0.024 | 0.014 | 
| Twist | 0.106 | -0.088 | -0.210 | 0.009 | 0.014 | 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 | 1.124 | 0.228 | 0.012 | -0.005 | -0.030 | 0.042 | 
| Slide | 0.228 | 2.720 | 0.591 | 0.007 | -0.113 | -0.097 | 
| Rise | 0.012 | 0.591 | 5.273 | 0.001 | -0.099 | -0.171 | 
| Tilt | -0.005 | 0.007 | 0.001 | 0.028 | 0.002 | 0.004 | 
| Roll | -0.030 | -0.113 | -0.099 | 0.002 | 0.021 | 0.010 | 
| Twist | 0.042 | -0.097 | -0.171 | 0.004 | 0.010 | 0.026 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 0.904 | 0.760 | -0.305 | 0.019 | -0.031 | -0.015 | 
| Slide | 0.760 | 3.232 | 0.531 | -0.016 | -0.067 | -0.160 | 
| Rise | -0.305 | 0.531 | 5.844 | -0.010 | -0.086 | -0.190 | 
| Tilt | 0.019 | -0.016 | -0.010 | 0.031 | 0.004 | 0.010 | 
| Roll | -0.031 | -0.067 | -0.086 | 0.004 | 0.020 | 0.010 | 
| Twist | -0.015 | -0.160 | -0.190 | 0.010 | 0.010 | 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 | 1.861 | 0.521 | 0.406 | -0.039 | -0.003 | 0.066 | 
| Slide | 0.521 | 3.450 | 1.802 | -0.030 | -0.105 | -0.147 | 
| Rise | 0.406 | 1.802 | 8.461 | -0.189 | -0.116 | -0.190 | 
| Tilt | -0.039 | -0.030 | -0.189 | 0.040 | 0.002 | 0.006 | 
| Roll | -0.003 | -0.105 | -0.116 | 0.002 | 0.027 | 0.010 | 
| Twist | 0.066 | -0.147 | -0.190 | 0.006 | 0.010 | 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 | 2.114 | -0.227 | 0.386 | -0.015 | 0.017 | 0.055 | 
| Slide | -0.227 | 4.222 | 1.592 | -0.008 | -0.181 | -0.168 | 
| Rise | 0.386 | 1.592 | 9.697 | -0.192 | -0.206 | -0.138 | 
| Tilt | -0.015 | -0.008 | -0.192 | 0.043 | 0.007 | 0.007 | 
| Roll | 0.017 | -0.181 | -0.206 | 0.007 | 0.030 | 0.011 | 
| Twist | 0.055 | -0.168 | -0.138 | 0.007 | 0.011 | 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 | 1.304 | 0.443 | 0.396 | -0.049 | 0.001 | 0.067 | 
| Slide | 0.443 | 4.453 | 2.766 | -0.007 | -0.036 | -0.099 | 
| Rise | 0.396 | 2.766 | 10.347 | 0.068 | -0.003 | -0.182 | 
| Tilt | -0.049 | -0.007 | 0.068 | 0.041 | 0.005 | 0.004 | 
| Roll | 0.001 | -0.036 | -0.003 | 0.005 | 0.026 | 0.011 | 
| Twist | 0.067 | -0.099 | -0.182 | 0.004 | 0.011 | 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 | 1.641 | -0.061 | 0.235 | -0.025 | 0.016 | 0.107 | 
| Slide | -0.061 | 4.292 | 1.433 | -0.052 | -0.075 | -0.010 | 
| Rise | 0.235 | 1.433 | 9.059 | 0.012 | -0.113 | -0.171 | 
| Tilt | -0.025 | -0.052 | 0.012 | 0.039 | 0.005 | 0.009 | 
| Roll | 0.016 | -0.075 | -0.113 | 0.005 | 0.030 | 0.016 | 
| Twist | 0.107 | -0.010 | -0.171 | 0.009 | 0.016 | 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 | 2.442 | 1.251 | 0.400 | -0.085 | -0.010 | -0.011 | 
| Slide | 1.251 | 6.163 | 3.438 | -0.024 | -0.071 | -0.302 | 
| Rise | 0.400 | 3.438 | 9.371 | 0.049 | 0.031 | -0.217 | 
| Tilt | -0.085 | -0.024 | 0.049 | 0.041 | 0.006 | 0.010 | 
| Roll | -0.010 | -0.071 | 0.031 | 0.006 | 0.026 | 0.014 | 
| Twist | -0.011 | -0.302 | -0.217 | 0.010 | 0.014 | 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 | 1.054 | 0.426 | 0.279 | -0.030 | 0.027 | 0.023 | 
| Slide | 0.426 | 3.899 | 3.093 | 0.011 | -0.022 | -0.111 | 
| Rise | 0.279 | 3.093 | 10.250 | 0.074 | 0.028 | -0.199 | 
| Tilt | -0.030 | 0.011 | 0.074 | 0.041 | 0.005 | 0.007 | 
| Roll | 0.027 | -0.022 | 0.028 | 0.005 | 0.024 | 0.012 | 
| Twist | 0.023 | -0.111 | -0.199 | 0.007 | 0.012 | 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 | 2.813 | -0.810 | -0.236 | -0.040 | -0.003 | 0.149 | 
| Slide | -0.810 | 3.487 | 2.654 | 0.007 | -0.045 | -0.024 | 
| Rise | -0.236 | 2.654 | 10.918 | 0.097 | -0.002 | -0.134 | 
| Tilt | -0.040 | 0.007 | 0.097 | 0.043 | 0.005 | 0.005 | 
| Roll | -0.003 | -0.045 | -0.002 | 0.005 | 0.028 | 0.002 | 
| Twist | 0.149 | -0.024 | -0.134 | 0.005 | 0.002 | 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 | 2.869 | 0.704 | 0.516 | -0.077 | -0.032 | 0.027 | 
| Slide | 0.704 | 5.576 | 3.177 | -0.057 | 0.015 | -0.239 | 
| Rise | 0.516 | 3.177 | 11.565 | 0.099 | 0.072 | -0.314 | 
| Tilt | -0.077 | -0.057 | 0.099 | 0.043 | 0.000 | 0.010 | 
| Roll | -0.032 | 0.015 | 0.072 | 0.000 | 0.027 | 0.008 | 
| Twist | 0.027 | -0.239 | -0.314 | 0.010 | 0.008 | 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 | 1.402 | -0.300 | 0.305 | -0.021 | -0.025 | -0.046 | 
| Slide | -0.300 | 5.223 | 2.764 | -0.050 | -0.026 | -0.142 | 
| Rise | 0.305 | 2.764 | 10.164 | 0.077 | 0.027 | -0.181 | 
| Tilt | -0.021 | -0.050 | 0.077 | 0.041 | 0.004 | 0.007 | 
| Roll | -0.025 | -0.026 | 0.027 | 0.004 | 0.023 | 0.014 | 
| Twist | -0.046 | -0.142 | -0.181 | 0.007 | 0.014 | 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 | 3.113 | -0.585 | -0.132 | -0.003 | 0.044 | 0.001 | 
| Slide | -0.585 | 3.246 | 1.335 | -0.037 | -0.079 | -0.176 | 
| Rise | -0.132 | 1.335 | 10.133 | -0.361 | -0.012 | -0.064 | 
| Tilt | -0.003 | -0.037 | -0.361 | 0.056 | 0.003 | -0.001 | 
| Roll | 0.044 | -0.079 | -0.012 | 0.003 | 0.026 | 0.010 | 
| Twist | 0.001 | -0.176 | -0.064 | -0.001 | 0.010 | 0.058 | 
                        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 | 3.446 | 1.298 | 0.657 | -0.091 | 0.080 | -0.007 | 
| Slide | 1.298 | 6.010 | 1.453 | -0.039 | -0.023 | -0.242 | 
| Rise | 0.657 | 1.453 | 10.571 | -0.257 | -0.098 | -0.253 | 
| Tilt | -0.091 | -0.039 | -0.257 | 0.049 | 0.004 | 0.014 | 
| Roll | 0.080 | -0.023 | -0.098 | 0.004 | 0.031 | 0.006 | 
| Twist | -0.007 | -0.242 | -0.253 | 0.014 | 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 | 1.273 | 0.117 | -0.345 | -0.010 | 0.063 | 0.118 | 
| Slide | 0.117 | 2.783 | 1.013 | 0.049 | -0.046 | -0.142 | 
| Rise | -0.345 | 1.013 | 7.575 | -0.110 | -0.054 | -0.144 | 
| Tilt | -0.010 | 0.049 | -0.110 | 0.036 | 0.001 | 0.002 | 
| Roll | 0.063 | -0.046 | -0.055 | 0.001 | 0.021 | 0.006 | 
| Twist | 0.118 | -0.142 | -0.144 | 0.002 | 0.006 | 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 | 1.551 | 0.630 | 0.598 | -0.076 | 0.018 | 0.081 | 
| Slide | 0.630 | 3.027 | 1.929 | -0.056 | -0.038 | -0.088 | 
| Rise | 0.598 | 1.929 | 10.051 | -0.323 | -0.018 | -0.195 | 
| Tilt | -0.076 | -0.056 | -0.323 | 0.052 | 0.000 | 0.009 | 
| Roll | 0.018 | -0.038 | -0.018 | 0.000 | 0.025 | 0.006 | 
| Twist | 0.081 | -0.088 | -0.195 | 0.009 | 0.006 | 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 | 1.248 | 0.183 | 0.284 | -0.045 | 0.053 | -0.006 | 
| Slide | 0.183 | 2.588 | 1.126 | 0.017 | -0.027 | -0.189 | 
| Rise | 0.284 | 1.126 | 9.197 | -0.311 | 0.007 | -0.218 | 
| Tilt | -0.045 | 0.017 | -0.311 | 0.049 | -0.000 | 0.008 | 
| Roll | 0.053 | -0.027 | 0.007 | -0.000 | 0.022 | 0.011 | 
| Twist | -0.006 | -0.189 | -0.218 | 0.008 | 0.011 | 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 | 1.539 | 0.959 | 1.149 | -0.049 | 0.013 | -0.062 | 
| Slide | 0.959 | 2.557 | 0.411 | 0.018 | 0.002 | 0.001 | 
| Rise | 1.149 | 0.411 | 4.769 | -0.099 | -0.044 | -0.008 | 
| Tilt | -0.049 | 0.018 | -0.099 | 0.025 | 0.005 | 0.006 | 
| Roll | 0.013 | 0.002 | -0.044 | 0.005 | 0.008 | 0.004 | 
| Twist | -0.062 | 0.001 | -0.008 | 0.006 | 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 | 1.126 | -0.146 | 0.242 | -0.048 | 0.038 | 0.089 | 
| Slide | -0.145 | 1.564 | 0.999 | 0.001 | 0.002 | -0.088 | 
| Rise | 0.242 | 0.999 | 8.532 | -0.221 | 0.055 | -0.178 | 
| Tilt | -0.048 | 0.001 | -0.221 | 0.042 | 0.001 | 0.008 | 
| Roll | 0.038 | 0.002 | 0.055 | 0.001 | 0.019 | 0.003 | 
| Twist | 0.089 | -0.088 | -0.178 | 0.008 | 0.003 | 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 | 2.491 | 0.870 | 1.216 | -0.108 | 0.070 | 0.110 | 
| Slide | 0.870 | 4.995 | 0.788 | 0.084 | 0.006 | -0.160 | 
| Rise | 1.216 | 0.788 | 12.633 | -0.401 | 0.070 | -0.152 | 
| Tilt | -0.108 | 0.084 | -0.401 | 0.053 | 0.000 | -0.009 | 
| Roll | 0.070 | 0.006 | 0.070 | 0.000 | 0.021 | 0.008 | 
| Twist | 0.110 | -0.160 | -0.152 | -0.009 | 0.008 | 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 | 3.206 | 1.133 | 0.797 | -0.046 | -0.048 | 0.034 | 
| Slide | 1.133 | 3.839 | 0.361 | 0.068 | -0.011 | -0.198 | 
| Rise | 0.797 | 0.361 | 7.556 | -0.146 | 0.039 | -0.110 | 
| Tilt | -0.046 | 0.068 | -0.146 | 0.045 | -0.001 | 0.009 | 
| Roll | -0.048 | -0.011 | 0.039 | -0.001 | 0.018 | -0.000 | 
| Twist | 0.034 | -0.198 | -0.110 | 0.009 | -0.000 | 0.079 | 
                        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 | 1.446 | -0.577 | -0.374 | -0.009 | 0.060 | -0.024 | 
| Slide | -0.577 | 4.609 | 2.043 | -0.038 | 0.043 | -0.165 | 
| Rise | -0.374 | 2.043 | 9.273 | -0.015 | 0.109 | -0.165 | 
| Tilt | -0.009 | -0.038 | -0.015 | 0.042 | -0.003 | 0.004 | 
| Roll | 0.060 | 0.043 | 0.109 | -0.003 | 0.022 | 0.010 | 
| Twist | -0.024 | -0.165 | -0.165 | 0.004 | 0.010 | 0.058 | 
                        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 | 1.935 | 0.062 | -0.188 | -0.015 | -0.017 | 0.069 | 
| Slide | 0.062 | 3.393 | 2.386 | 0.060 | -0.012 | -0.045 | 
| Rise | -0.188 | 2.386 | 10.795 | 0.095 | 0.081 | -0.127 | 
| Tilt | -0.015 | 0.060 | 0.095 | 0.042 | 0.002 | -0.001 | 
| Roll | -0.017 | -0.012 | 0.081 | 0.002 | 0.031 | 0.005 | 
| Twist | 0.069 | -0.045 | -0.127 | -0.001 | 0.005 | 0.035 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 1.611 | 0.464 | -0.026 | -0.009 | -0.021 | -0.007 | 
| Slide | 0.464 | 5.210 | 2.808 | 0.051 | -0.120 | -0.186 | 
| Rise | -0.026 | 2.808 | 10.134 | 0.001 | 0.000 | -0.222 | 
| Tilt | -0.009 | 0.051 | 0.001 | 0.044 | -0.001 | -0.004 | 
| Roll | -0.021 | -0.120 | 0.000 | -0.001 | 0.032 | -0.003 | 
| Twist | -0.007 | -0.186 | -0.222 | -0.004 | -0.003 | 0.022 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 1.877 | -0.648 | -0.053 | 0.020 | -0.025 | 0.093 | 
| Slide | -0.648 | 4.656 | 3.330 | 0.028 | -0.119 | -0.114 | 
| Rise | -0.053 | 3.330 | 8.413 | -0.080 | 0.025 | -0.136 | 
| Tilt | 0.020 | 0.028 | -0.080 | 0.044 | -0.002 | -0.003 | 
| Roll | -0.025 | -0.119 | 0.025 | -0.002 | 0.026 | 0.008 | 
| Twist | 0.093 | -0.114 | -0.136 | -0.003 | 0.008 | 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 | 1.830 | -0.506 | -0.143 | -0.010 | 0.043 | -0.008 | 
| Slide | -0.506 | 4.415 | 2.943 | -0.041 | -0.054 | -0.115 | 
| Rise | -0.143 | 2.943 | 10.386 | -0.062 | 0.067 | -0.155 | 
| Tilt | -0.010 | -0.041 | -0.062 | 0.044 | -0.001 | -0.001 | 
| Roll | 0.043 | -0.054 | 0.067 | -0.001 | 0.033 | 0.014 | 
| Twist | -0.008 | -0.115 | -0.155 | -0.001 | 0.014 | 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 | 2.202 | 0.232 | -0.319 | -0.016 | -0.036 | 0.068 | 
| Slide | 0.232 | 3.920 | 1.962 | 0.038 | -0.019 | -0.157 | 
| Rise | -0.319 | 1.962 | 8.995 | 0.019 | 0.014 | -0.133 | 
| Tilt | -0.016 | 0.038 | 0.019 | 0.042 | 0.005 | 0.003 | 
| Roll | -0.036 | -0.019 | 0.014 | 0.005 | 0.026 | 0.006 | 
| Twist | 0.068 | -0.157 | -0.133 | 0.003 | 0.006 | 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 | 2.330 | 0.087 | 0.433 | 0.015 | 0.022 | -0.087 | 
| Slide | 0.087 | 6.378 | 2.605 | 0.021 | -0.152 | -0.106 | 
| Rise | 0.433 | 2.605 | 9.640 | -0.004 | -0.142 | -0.173 | 
| Tilt | 0.015 | 0.021 | -0.004 | 0.049 | 0.009 | -0.000 | 
| Roll | 0.022 | -0.152 | -0.142 | 0.009 | 0.038 | 0.008 | 
| Twist | -0.087 | -0.106 | -0.173 | -0.000 | 0.008 | 0.086 | 
                        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 | 2.039 | -0.288 | 0.169 | 0.013 | 0.020 | 0.050 | 
| Slide | -0.288 | 6.024 | 3.559 | -0.035 | -0.092 | -0.134 | 
| Rise | 0.169 | 3.559 | 11.468 | -0.028 | 0.046 | -0.172 | 
| Tilt | 0.013 | -0.035 | -0.028 | 0.044 | -0.000 | 0.003 | 
| Roll | 0.020 | -0.092 | 0.046 | -0.000 | 0.034 | 0.011 | 
| Twist | 0.050 | -0.134 | -0.172 | 0.003 | 0.011 | 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 | 2.219 | -0.923 | -0.196 | 0.006 | 0.013 | -0.011 | 
| Slide | -0.923 | 5.509 | 2.029 | 0.003 | 0.035 | -0.267 | 
| Rise | -0.196 | 2.029 | 12.531 | -0.091 | 0.158 | -0.213 | 
| Tilt | 0.006 | 0.003 | -0.091 | 0.047 | 0.001 | -0.002 | 
| Roll | 0.013 | 0.035 | 0.158 | 0.001 | 0.033 | 0.012 | 
| Twist | -0.011 | -0.267 | -0.213 | -0.002 | 0.012 | 0.069 | 
                        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 | 2.142 | 0.400 | 0.127 | 0.024 | 0.022 | -0.025 | 
| Slide | 0.400 | 4.779 | 3.394 | -0.003 | -0.057 | -0.126 | 
| Rise | 0.127 | 3.394 | 10.360 | 0.020 | 0.105 | -0.159 | 
| Tilt | 0.024 | -0.003 | 0.020 | 0.041 | -0.003 | 0.001 | 
| Roll | 0.022 | -0.057 | 0.105 | -0.003 | 0.031 | 0.011 | 
| Twist | -0.025 | -0.126 | -0.159 | 0.001 | 0.011 | 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 | 1.808 | 0.098 | 0.220 | -0.009 | -0.011 | 0.022 | 
| Slide | 0.098 | 5.884 | 2.756 | 0.014 | -0.114 | -0.123 | 
| Rise | 0.220 | 2.756 | 9.106 | 0.016 | -0.049 | -0.169 | 
| Tilt | -0.009 | 0.014 | 0.016 | 0.044 | -0.000 | 0.001 | 
| Roll | -0.011 | -0.114 | -0.049 | -0.000 | 0.033 | 0.013 | 
| Twist | 0.022 | -0.123 | -0.169 | 0.001 | 0.013 | 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 | 2.645 | 0.424 | -0.278 | -0.019 | 0.003 | -0.058 | 
| Slide | 0.424 | 7.147 | 3.323 | -0.023 | -0.121 | -0.225 | 
| Rise | -0.278 | 3.323 | 11.139 | 0.033 | 0.023 | -0.212 | 
| Tilt | -0.019 | -0.023 | 0.033 | 0.048 | 0.000 | -0.000 | 
| Roll | 0.003 | -0.121 | 0.023 | 0.000 | 0.033 | 0.014 | 
| Twist | -0.058 | -0.225 | -0.212 | -0.000 | 0.014 | 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 | 1.632 | 0.055 | -0.059 | 0.029 | 0.010 | 0.008 | 
| Slide | 0.055 | 5.604 | 3.069 | -0.005 | -0.054 | -0.026 | 
| Rise | -0.059 | 3.069 | 12.057 | 0.037 | 0.033 | -0.138 | 
| Tilt | 0.029 | -0.005 | 0.037 | 0.040 | 0.004 | 0.002 | 
| Roll | 0.010 | -0.054 | 0.033 | 0.004 | 0.028 | 0.005 | 
| Twist | 0.008 | -0.026 | -0.138 | 0.002 | 0.005 | 0.037 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 0.985 | 0.320 | 0.098 | -0.062 | 0.005 | 0.013 | 
| Slide | 0.320 | 3.015 | 0.545 | 0.012 | 0.005 | -0.075 | 
| Rise | 0.098 | 0.545 | 8.703 | 0.034 | -0.157 | -0.228 | 
| Tilt | -0.062 | 0.012 | 0.034 | 0.028 | -0.001 | 0.002 | 
| Roll | 0.005 | 0.005 | -0.157 | -0.001 | 0.022 | 0.010 | 
| Twist | 0.013 | -0.075 | -0.228 | 0.002 | 0.010 | 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 | 2.474 | 0.217 | -0.137 | -0.061 | -0.002 | 0.078 | 
| Slide | 0.217 | 5.150 | -0.157 | -0.095 | -0.026 | -0.254 | 
| Rise | -0.137 | -0.157 | 9.468 | -0.046 | -0.129 | -0.146 | 
| Tilt | -0.061 | -0.095 | -0.046 | 0.034 | -0.004 | 0.003 | 
| Roll | -0.002 | -0.026 | -0.129 | -0.004 | 0.030 | 0.014 | 
| Twist | 0.078 | -0.254 | -0.146 | 0.003 | 0.014 | 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 | 0.731 | -0.435 | 0.546 | -0.077 | -0.013 | -0.006 | 
| Slide | -0.435 | 2.954 | 1.391 | 0.023 | 0.007 | -0.168 | 
| Rise | 0.546 | 1.391 | 5.959 | -0.009 | 0.046 | -0.133 | 
| Tilt | -0.077 | 0.023 | -0.009 | 0.029 | -0.001 | -0.003 | 
| Roll | -0.013 | 0.007 | 0.046 | -0.001 | 0.012 | 0.002 | 
| Twist | -0.006 | -0.168 | -0.133 | -0.003 | 0.002 | 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 | 1.434 | 0.402 | -0.405 | -0.097 | 0.008 | 0.015 | 
| Slide | 0.402 | 4.040 | 0.190 | -0.024 | 0.013 | -0.174 | 
| Rise | -0.405 | 0.190 | 7.922 | -0.067 | -0.182 | -0.218 | 
| Tilt | -0.097 | -0.024 | -0.067 | 0.031 | 0.001 | 0.001 | 
| Roll | 0.008 | 0.013 | -0.182 | 0.001 | 0.025 | 0.009 | 
| Twist | 0.015 | -0.174 | -0.218 | 0.001 | 0.009 | 0.036 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 0.910 | -0.007 | 0.673 | -0.079 | 0.001 | -0.018 | 
| Slide | -0.007 | 3.601 | 0.613 | -0.062 | 0.003 | -0.192 | 
| Rise | 0.673 | 0.613 | 8.705 | 0.006 | -0.029 | -0.243 | 
| Tilt | -0.079 | -0.062 | 0.006 | 0.030 | -0.003 | 0.004 | 
| Roll | 0.001 | 0.003 | -0.029 | -0.003 | 0.020 | 0.010 | 
| Twist | -0.018 | -0.192 | -0.243 | 0.004 | 0.010 | 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 | 0.960 | -0.025 | 0.297 | -0.066 | 0.014 | 0.008 | 
| Slide | -0.025 | 2.416 | 0.730 | -0.020 | 0.029 | -0.118 | 
| Rise | 0.297 | 0.730 | 7.533 | -0.045 | 0.004 | -0.174 | 
| Tilt | -0.066 | -0.020 | -0.045 | 0.030 | -0.003 | -0.001 | 
| Roll | 0.014 | 0.029 | 0.004 | -0.003 | 0.015 | 0.003 | 
| Twist | 0.008 | -0.118 | -0.174 | -0.001 | 0.003 | 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 | 2.173 | -0.706 | 0.036 | -0.029 | 0.060 | -0.034 | 
| Slide | -0.706 | 3.299 | 0.252 | -0.017 | -0.024 | -0.157 | 
| Rise | 0.036 | 0.252 | 6.546 | -0.035 | -0.035 | -0.152 | 
| Tilt | -0.029 | -0.017 | -0.035 | 0.027 | -0.001 | -0.002 | 
| Roll | 0.060 | -0.024 | -0.035 | -0.001 | 0.019 | 0.007 | 
| Twist | -0.034 | -0.157 | -0.152 | -0.002 | 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 | 1.552 | 0.390 | 0.192 | -0.016 | -0.007 | 0.036 | 
| Slide | 0.390 | 2.843 | 0.774 | 0.015 | 0.002 | -0.088 | 
| Rise | 0.192 | 0.774 | 8.330 | 0.039 | -0.188 | -0.214 | 
| Tilt | -0.016 | 0.015 | 0.039 | 0.033 | -0.004 | 0.007 | 
| Roll | -0.007 | 0.002 | -0.188 | -0.004 | 0.024 | 0.011 | 
| Twist | 0.036 | -0.088 | -0.214 | 0.007 | 0.011 | 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 | 1.821 | 0.871 | 0.206 | -0.103 | -0.030 | -0.044 | 
| Slide | 0.871 | 4.456 | 1.134 | -0.082 | -0.023 | -0.141 | 
| Rise | 0.206 | 1.134 | 6.196 | 0.043 | -0.039 | -0.162 | 
| Tilt | -0.103 | -0.082 | 0.043 | 0.029 | -0.003 | 0.004 | 
| Roll | -0.030 | -0.023 | -0.039 | -0.003 | 0.017 | 0.006 | 
| Twist | -0.044 | -0.141 | -0.162 | 0.004 | 0.006 | 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 | 1.448 | -0.086 | 0.245 | -0.048 | 0.022 | 0.012 | 
| Slide | -0.086 | 2.346 | 0.265 | -0.020 | -0.002 | -0.043 | 
| Rise | 0.245 | 0.265 | 7.059 | -0.024 | -0.170 | -0.223 | 
| Tilt | -0.048 | -0.020 | -0.024 | 0.027 | -0.001 | 0.001 | 
| Roll | 0.022 | -0.002 | -0.170 | -0.001 | 0.020 | 0.009 | 
| Twist | 0.012 | -0.043 | -0.223 | 0.001 | 0.009 | 0.020 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 2.236 | 0.732 | -0.093 | -0.091 | -0.008 | -0.165 | 
| Slide | 0.732 | 3.310 | 0.986 | 0.014 | 0.024 | 0.001 | 
| Rise | -0.093 | 0.986 | 7.312 | 0.033 | -0.015 | -0.140 | 
| Tilt | -0.091 | 0.014 | 0.033 | 0.033 | -0.000 | -0.004 | 
| Roll | -0.008 | 0.024 | -0.015 | -0.000 | 0.013 | -0.004 | 
| Twist | -0.165 | 0.001 | -0.140 | -0.004 | -0.004 | 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 | 3.055 | 0.889 | -0.081 | 0.056 | 0.065 | 0.037 | 
| Slide | 0.889 | 8.156 | 0.054 | 0.118 | -0.046 | -0.221 | 
| Rise | -0.081 | 0.054 | 8.498 | -0.003 | -0.180 | -0.090 | 
| Tilt | 0.056 | 0.118 | -0.003 | 0.032 | -0.000 | -0.001 | 
| Roll | 0.065 | -0.046 | -0.180 | -0.000 | 0.033 | 0.005 | 
| Twist | 0.037 | -0.221 | -0.090 | -0.001 | 0.005 | 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 | 2.786 | -0.031 | 0.289 | -0.068 | -0.065 | 0.116 | 
| Slide | -0.031 | 3.972 | 0.279 | -0.004 | -0.005 | -0.269 | 
| Rise | 0.289 | 0.279 | 8.715 | 0.010 | -0.062 | -0.217 | 
| Tilt | -0.068 | -0.004 | 0.010 | 0.030 | -0.002 | -0.001 | 
| Roll | -0.065 | -0.005 | -0.062 | -0.002 | 0.021 | 0.007 | 
| Twist | 0.116 | -0.269 | -0.216 | -0.001 | 0.007 | 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 | 1.512 | 0.083 | 0.174 | -0.090 | -0.011 | -0.086 | 
| Slide | 0.083 | 2.395 | 1.417 | -0.026 | -0.016 | -0.064 | 
| Rise | 0.174 | 1.417 | 6.862 | 0.039 | -0.115 | -0.213 | 
| Tilt | -0.090 | -0.026 | 0.039 | 0.028 | 0.002 | 0.005 | 
| Roll | -0.011 | -0.016 | -0.115 | 0.002 | 0.020 | 0.014 | 
| Twist | -0.086 | -0.064 | -0.213 | 0.005 | 0.014 | 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 | 1.093 | 0.433 | -0.162 | -0.072 | -0.037 | 0.019 | 
| Slide | 0.433 | 3.676 | 0.775 | -0.024 | 0.006 | -0.244 | 
| Rise | -0.162 | 0.775 | 9.552 | 0.306 | 0.059 | -0.134 | 
| Tilt | -0.072 | -0.024 | 0.306 | 0.045 | 0.001 | 0.002 | 
| Roll | -0.037 | 0.006 | 0.059 | 0.001 | 0.017 | 0.007 | 
| Twist | 0.019 | -0.244 | -0.134 | 0.002 | 0.007 | 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 | 1.768 | -0.434 | -0.760 | -0.158 | -0.049 | -0.015 | 
| Slide | -0.434 | 2.156 | 1.846 | 0.006 | -0.028 | -0.115 | 
| Rise | -0.760 | 1.846 | 9.789 | 0.289 | -0.074 | -0.171 | 
| Tilt | -0.158 | 0.006 | 0.289 | 0.052 | 0.002 | -0.000 | 
| Roll | -0.049 | -0.028 | -0.074 | 0.002 | 0.023 | 0.008 | 
| Twist | -0.015 | -0.115 | -0.171 | -0.000 | 0.008 | 0.039 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 2.388 | -0.264 | -0.465 | -0.080 | -0.003 | 0.008 | 
| Slide | -0.263 | 1.227 | 1.616 | 0.018 | 0.003 | -0.075 | 
| Rise | -0.465 | 1.616 | 9.264 | 0.235 | -0.019 | -0.099 | 
| Tilt | -0.080 | 0.018 | 0.235 | 0.034 | -0.005 | 0.004 | 
| Roll | -0.003 | 0.003 | -0.019 | -0.005 | 0.017 | 0.005 | 
| Twist | 0.008 | -0.075 | -0.099 | 0.004 | 0.005 | 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 | 3.200 | 0.350 | -0.550 | -0.127 | -0.070 | -0.048 | 
| Slide | 0.350 | 4.544 | 1.385 | 0.018 | 0.008 | -0.194 | 
| Rise | -0.550 | 1.385 | 8.517 | 0.334 | 0.013 | -0.136 | 
| Tilt | -0.127 | 0.018 | 0.334 | 0.054 | 0.000 | 0.009 | 
| Roll | -0.070 | 0.008 | 0.013 | 0.000 | 0.017 | 0.011 | 
| Twist | -0.048 | -0.194 | -0.136 | 0.009 | 0.011 | 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 | 1.675 | 0.255 | -0.551 | -0.105 | -0.038 | 0.032 | 
| Slide | 0.255 | 2.381 | 2.208 | 0.064 | -0.012 | -0.080 | 
| Rise | -0.551 | 2.208 | 11.851 | 0.424 | -0.099 | -0.232 | 
| Tilt | -0.105 | 0.064 | 0.424 | 0.054 | 0.003 | -0.000 | 
| Roll | -0.038 | -0.012 | -0.099 | 0.003 | 0.023 | 0.008 | 
| Twist | 0.032 | -0.080 | -0.232 | -0.000 | 0.008 | 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 | 2.937 | -0.758 | -0.547 | -0.080 | 0.002 | -0.011 | 
| Slide | -0.758 | 4.002 | 1.063 | -0.002 | 0.003 | -0.209 | 
| Rise | -0.547 | 1.063 | 9.150 | 0.285 | 0.152 | -0.206 | 
| Tilt | -0.080 | -0.002 | 0.285 | 0.054 | 0.007 | -0.012 | 
| Roll | 0.002 | 0.003 | 0.152 | 0.007 | 0.025 | -0.005 | 
| Twist | -0.011 | -0.209 | -0.206 | -0.012 | -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 | 1.329 | -0.520 | -0.192 | -0.103 | -0.030 | -0.060 | 
| Slide | -0.520 | 2.141 | 1.821 | -0.011 | -0.024 | -0.096 | 
| Rise | -0.192 | 1.821 | 10.080 | 0.272 | -0.058 | -0.180 | 
| Tilt | -0.103 | -0.011 | 0.272 | 0.046 | 0.001 | 0.001 | 
| Roll | -0.030 | -0.024 | -0.058 | 0.001 | 0.022 | 0.009 | 
| Twist | -0.060 | -0.096 | -0.180 | 0.001 | 0.009 | 0.027 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 3.235 | -0.988 | -1.122 | -0.126 | -0.072 | -0.069 | 
| Slide | -0.988 | 5.565 | 1.622 | 0.036 | -0.080 | -0.280 | 
| Rise | -1.122 | 1.622 | 10.336 | 0.240 | -0.103 | -0.177 | 
| Tilt | -0.126 | 0.036 | 0.240 | 0.052 | -0.004 | -0.009 | 
| Roll | -0.072 | -0.080 | -0.103 | -0.004 | 0.031 | 0.012 | 
| Twist | -0.069 | -0.280 | -0.177 | -0.009 | 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 | 1.437 | -0.294 | -0.611 | -0.076 | -0.026 | -0.085 | 
| Slide | -0.294 | 2.896 | 1.849 | 0.051 | -0.061 | -0.060 | 
| Rise | -0.611 | 1.849 | 9.777 | 0.316 | -0.075 | -0.214 | 
| Tilt | -0.076 | 0.051 | 0.316 | 0.053 | -0.003 | -0.007 | 
| Roll | -0.026 | -0.061 | -0.075 | -0.003 | 0.027 | 0.010 | 
| Twist | -0.085 | -0.060 | -0.214 | -0.007 | 0.010 | 0.038 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 0.966 | -0.276 | -0.376 | -0.056 | -0.062 | -0.004 | 
| Slide | -0.276 | 2.814 | 0.826 | 0.016 | -0.028 | -0.188 | 
| Rise | -0.376 | 0.826 | 9.647 | 0.319 | 0.020 | -0.221 | 
| Tilt | -0.056 | 0.016 | 0.319 | 0.047 | 0.002 | -0.008 | 
| Roll | -0.062 | -0.028 | 0.020 | 0.002 | 0.024 | 0.014 | 
| Twist | -0.004 | -0.188 | -0.221 | -0.008 | 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 | 1.506 | -0.392 | -0.231 | -0.033 | -0.047 | -0.117 | 
| Slide | -0.392 | 2.868 | 1.668 | 0.014 | -0.064 | -0.114 | 
| Rise | -0.231 | 1.668 | 8.660 | 0.183 | -0.142 | -0.210 | 
| Tilt | -0.033 | 0.014 | 0.183 | 0.041 | -0.009 | -0.010 | 
| Roll | -0.047 | -0.064 | -0.142 | -0.009 | 0.024 | 0.012 | 
| Twist | -0.117 | -0.114 | -0.210 | -0.010 | 0.012 | 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 | 3.666 | -1.187 | -0.806 | -0.129 | -0.037 | -0.037 | 
| Slide | -1.187 | 5.375 | 1.288 | 0.023 | -0.076 | -0.264 | 
| Rise | -0.806 | 1.288 | 10.744 | 0.338 | -0.185 | -0.118 | 
| Tilt | -0.129 | 0.023 | 0.338 | 0.056 | -0.008 | -0.001 | 
| Roll | -0.037 | -0.076 | -0.185 | -0.008 | 0.038 | -0.004 | 
| Twist | -0.037 | -0.264 | -0.118 | -0.001 | -0.004 | 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 | 2.053 | -0.209 | -0.722 | -0.047 | -0.032 | -0.022 | 
| Slide | -0.209 | 2.906 | 0.819 | -0.045 | -0.074 | -0.123 | 
| Rise | -0.722 | 0.819 | 8.800 | 0.226 | 0.010 | -0.214 | 
| Tilt | -0.047 | -0.045 | 0.226 | 0.045 | 0.001 | -0.007 | 
| Roll | -0.032 | -0.074 | 0.010 | 0.001 | 0.030 | 0.011 | 
| Twist | -0.022 | -0.123 | -0.214 | -0.007 | 0.011 | 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 | 1.872 | -0.532 | -0.290 | -0.044 | -0.018 | -0.108 | 
| Slide | -0.532 | 3.532 | 1.466 | -0.009 | 0.015 | -0.226 | 
| Rise | -0.290 | 1.466 | 7.425 | 0.186 | 0.146 | -0.184 | 
| Tilt | -0.044 | -0.009 | 0.186 | 0.040 | 0.004 | -0.005 | 
| Roll | -0.018 | 0.015 | 0.146 | 0.004 | 0.017 | 0.001 | 
| Twist | -0.108 | -0.226 | -0.184 | -0.005 | 0.001 | 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 | 4.689 | 0.081 | -0.793 | -0.047 | -0.005 | -0.178 | 
| Slide | 0.081 | 5.910 | 1.014 | -0.094 | -0.004 | -0.376 | 
| Rise | -0.793 | 1.014 | 8.982 | 0.312 | 0.047 | -0.031 | 
| Tilt | -0.047 | -0.094 | 0.312 | 0.056 | -0.001 | 0.009 | 
| Roll | -0.005 | -0.004 | 0.047 | -0.001 | 0.022 | -0.002 | 
| Twist | -0.178 | -0.376 | -0.031 | 0.009 | -0.002 | 0.103 | 
                        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 | 2.534 | -0.171 | -0.276 | -0.050 | -0.038 | -0.084 | 
| Slide | -0.171 | 4.236 | 0.061 | -0.028 | 0.013 | -0.292 | 
| Rise | -0.276 | 0.061 | 10.292 | 0.288 | 0.083 | -0.143 | 
| Tilt | -0.050 | -0.028 | 0.288 | 0.047 | 0.003 | -0.007 | 
| Roll | -0.038 | 0.013 | 0.083 | 0.003 | 0.021 | -0.003 | 
| Twist | -0.084 | -0.292 | -0.143 | -0.007 | -0.003 | 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 | 1.793 | 0.227 | -0.638 | -0.023 | -0.051 | -0.061 | 
| Slide | 0.227 | 2.545 | 1.139 | 0.023 | -0.092 | -0.094 | 
| Rise | -0.638 | 1.139 | 9.476 | -0.194 | -0.123 | -0.178 | 
| Tilt | -0.023 | 0.023 | -0.194 | 0.031 | 0.004 | 0.003 | 
| Roll | -0.051 | -0.092 | -0.123 | 0.004 | 0.024 | 0.011 | 
| Twist | -0.061 | -0.094 | -0.178 | 0.003 | 0.011 | 0.028 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 0.964 | 0.188 | 0.363 | -0.038 | 0.022 | 0.011 | 
| Slide | 0.188 | 2.467 | 0.819 | -0.001 | -0.043 | -0.094 | 
| Rise | 0.363 | 0.819 | 6.806 | -0.266 | -0.114 | -0.166 | 
| Tilt | -0.038 | -0.001 | -0.266 | 0.031 | -0.001 | 0.001 | 
| Roll | 0.022 | -0.043 | -0.114 | -0.001 | 0.019 | 0.012 | 
| Twist | 0.011 | -0.094 | -0.166 | 0.001 | 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 | 2.374 | 0.583 | 0.654 | -0.111 | 0.084 | -0.096 | 
| Slide | 0.583 | 3.235 | 1.303 | -0.013 | 0.018 | -0.133 | 
| Rise | 0.654 | 1.303 | 10.292 | -0.377 | 0.039 | -0.081 | 
| Tilt | -0.111 | -0.013 | -0.377 | 0.051 | -0.008 | -0.004 | 
| Roll | 0.084 | 0.018 | 0.039 | -0.008 | 0.020 | -0.001 | 
| Twist | -0.096 | -0.133 | -0.081 | -0.004 | -0.001 | 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 | 1.300 | 0.580 | 1.451 | -0.118 | 0.018 | -0.056 | 
| Slide | 0.580 | 2.881 | 1.912 | -0.009 | -0.072 | -0.158 | 
| Rise | 1.451 | 1.912 | 8.759 | -0.310 | 0.004 | -0.114 | 
| Tilt | -0.118 | -0.009 | -0.310 | 0.043 | -0.005 | -0.002 | 
| Roll | 0.018 | -0.072 | 0.004 | -0.005 | 0.025 | 0.008 | 
| Twist | -0.056 | -0.158 | -0.114 | -0.002 | 0.008 | 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 | 1.443 | 0.538 | 0.963 | -0.090 | 0.005 | -0.003 | 
| Slide | 0.538 | 2.888 | 1.563 | -0.006 | -0.047 | -0.107 | 
| Rise | 0.963 | 1.563 | 8.828 | -0.278 | -0.029 | -0.180 | 
| Tilt | -0.090 | -0.006 | -0.278 | 0.044 | -0.005 | 0.003 | 
| Roll | 0.005 | -0.047 | -0.029 | -0.005 | 0.027 | 0.011 | 
| Twist | -0.003 | -0.107 | -0.180 | 0.003 | 0.011 | 0.029 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 2.583 | 0.200 | 1.030 | -0.106 | 0.022 | -0.038 | 
| Slide | 0.200 | 2.342 | 2.184 | -0.028 | -0.052 | -0.110 | 
| Rise | 1.030 | 2.184 | 10.746 | -0.316 | -0.148 | -0.233 | 
| Tilt | -0.106 | -0.028 | -0.316 | 0.039 | 0.001 | -0.000 | 
| Roll | 0.022 | -0.052 | -0.148 | 0.001 | 0.032 | 0.016 | 
| Twist | -0.038 | -0.110 | -0.233 | -0.000 | 0.016 | 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 | 1.182 | 0.444 | 0.151 | -0.034 | -0.009 | 0.030 | 
| Slide | 0.444 | 2.472 | 0.841 | 0.037 | -0.033 | -0.164 | 
| Rise | 0.151 | 0.841 | 9.105 | -0.182 | -0.109 | -0.171 | 
| Tilt | -0.034 | 0.037 | -0.182 | 0.031 | -0.000 | 0.003 | 
| Roll | -0.009 | -0.033 | -0.109 | -0.000 | 0.022 | 0.011 | 
| Twist | 0.030 | -0.164 | -0.171 | 0.003 | 0.011 | 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 | 2.269 | 0.499 | 1.016 | -0.132 | 0.059 | 0.038 | 
| Slide | 0.499 | 3.903 | 1.705 | -0.043 | -0.072 | -0.081 | 
| Rise | 1.016 | 1.705 | 11.588 | -0.368 | 0.141 | -0.193 | 
| Tilt | -0.132 | -0.043 | -0.368 | 0.051 | -0.008 | 0.009 | 
| Roll | 0.059 | -0.072 | 0.141 | -0.008 | 0.025 | 0.005 | 
| Twist | 0.038 | -0.081 | -0.193 | 0.009 | 0.005 | 0.028 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 3.239 | 0.122 | -0.001 | -0.141 | 0.011 | -0.004 | 
| Slide | 0.122 | 5.162 | 2.074 | -0.088 | 0.115 | -0.201 | 
| Rise | -0.001 | 2.074 | 12.231 | -0.033 | 0.273 | -0.152 | 
| Tilt | -0.141 | -0.088 | -0.033 | 0.053 | -0.002 | 0.000 | 
| Roll | 0.011 | 0.115 | 0.273 | -0.002 | 0.035 | 0.000 | 
| Twist | -0.004 | -0.201 | -0.152 | 0.000 | 0.000 | 0.069 | 
                        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 | 2.408 | -0.576 | -0.027 | -0.132 | 0.044 | 0.001 | 
| Slide | -0.576 | 4.852 | 2.794 | -0.018 | 0.061 | -0.132 | 
| Rise | -0.027 | 2.794 | 11.029 | 0.008 | 0.178 | -0.206 | 
| Tilt | -0.132 | -0.018 | 0.008 | 0.042 | -0.002 | 0.001 | 
| Roll | 0.044 | 0.061 | 0.178 | -0.002 | 0.026 | 0.009 | 
| Twist | 0.001 | -0.132 | -0.206 | 0.001 | 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 | 2.430 | 0.644 | 0.137 | -0.129 | -0.014 | 0.030 | 
| Slide | 0.644 | 5.109 | 2.856 | 0.030 | 0.060 | -0.145 | 
| Rise | 0.137 | 2.856 | 11.130 | -0.003 | 0.186 | -0.212 | 
| Tilt | -0.129 | 0.030 | -0.003 | 0.041 | 0.001 | 0.000 | 
| Roll | -0.014 | 0.060 | 0.186 | 0.001 | 0.025 | 0.007 | 
| Twist | 0.030 | -0.145 | -0.212 | 0.000 | 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 | 3.728 | 0.348 | 0.005 | -0.180 | -0.012 | -0.067 | 
| Slide | 0.348 | 4.108 | 2.485 | 0.134 | 0.183 | -0.250 | 
| Rise | 0.005 | 2.485 | 11.897 | 0.059 | 0.358 | -0.198 | 
| Tilt | -0.180 | 0.134 | 0.059 | 0.043 | 0.001 | -0.003 | 
| Roll | -0.012 | 0.183 | 0.358 | 0.001 | 0.036 | -0.001 | 
| Twist | -0.067 | -0.250 | -0.199 | -0.003 | -0.001 | 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 | 2.030 | 0.240 | 0.136 | -0.137 | 0.001 | -0.063 | 
| Slide | 0.240 | 3.811 | 3.413 | 0.007 | 0.160 | -0.167 | 
| Rise | 0.136 | 3.413 | 9.494 | 0.009 | 0.362 | -0.251 | 
| Tilt | -0.137 | 0.007 | 0.009 | 0.044 | -0.002 | -0.001 | 
| Roll | 0.001 | 0.160 | 0.362 | -0.002 | 0.028 | -0.004 | 
| Twist | -0.063 | -0.167 | -0.251 | -0.001 | -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 | 2.670 | 0.058 | -0.109 | -0.129 | 0.019 | -0.038 | 
| Slide | 0.058 | 2.702 | 1.979 | -0.027 | 0.135 | -0.004 | 
| Rise | -0.109 | 1.979 | 9.202 | -0.021 | 0.323 | -0.059 | 
| Tilt | -0.129 | -0.027 | -0.021 | 0.037 | 0.002 | 0.004 | 
| Roll | 0.019 | 0.135 | 0.323 | 0.002 | 0.027 | 0.000 | 
| Twist | -0.038 | -0.004 | -0.059 | 0.004 | 0.000 | 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 | 5.329 | 0.280 | 1.038 | -0.055 | 0.023 | 0.010 | 
| Slide | 0.280 | 9.512 | 4.151 | 0.037 | 0.113 | -0.484 | 
| Rise | 1.038 | 4.151 | 9.565 | 0.081 | 0.235 | -0.181 | 
| Tilt | -0.055 | 0.037 | 0.081 | 0.045 | 0.002 | -0.002 | 
| Roll | 0.023 | 0.113 | 0.235 | 0.002 | 0.030 | -0.006 | 
| Twist | 0.010 | -0.484 | -0.181 | -0.002 | -0.006 | 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 | 3.735 | 1.271 | -0.237 | -0.165 | -0.002 | -0.071 | 
| Slide | 1.271 | 5.050 | 2.685 | 0.016 | 0.142 | -0.224 | 
| Rise | -0.237 | 2.685 | 11.720 | 0.002 | 0.258 | -0.201 | 
| Tilt | -0.165 | 0.016 | 0.002 | 0.050 | 0.002 | -0.001 | 
| Roll | -0.002 | 0.142 | 0.258 | 0.002 | 0.034 | -0.006 | 
| Twist | -0.071 | -0.224 | -0.201 | -0.001 | -0.006 | 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 | 3.423 | 0.135 | 0.485 | -0.086 | 0.103 | -0.013 | 
| Slide | 0.135 | 3.168 | 1.585 | -0.088 | 0.022 | -0.114 | 
| Rise | 0.485 | 1.585 | 13.317 | -0.459 | 0.007 | -0.157 | 
| Tilt | -0.086 | -0.088 | -0.459 | 0.054 | -0.005 | -0.004 | 
| Roll | 0.103 | 0.022 | 0.007 | -0.005 | 0.022 | 0.012 | 
| Twist | -0.013 | -0.114 | -0.157 | -0.004 | 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 | 2.250 | 0.392 | 0.500 | -0.121 | 0.057 | 0.013 | 
| Slide | 0.392 | 3.243 | 1.291 | 0.023 | -0.031 | -0.200 | 
| Rise | 0.500 | 1.291 | 8.020 | -0.255 | -0.005 | -0.159 | 
| Tilt | -0.121 | 0.023 | -0.255 | 0.045 | -0.004 | 0.003 | 
| Roll | 0.057 | -0.031 | -0.005 | -0.004 | 0.024 | 0.007 | 
| Twist | 0.013 | -0.200 | -0.159 | 0.003 | 0.007 | 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 | 2.279 | 1.035 | 0.170 | -0.082 | -0.037 | -0.009 | 
| Slide | 1.035 | 2.243 | 2.366 | -0.016 | -0.064 | -0.140 | 
| Rise | 0.170 | 2.366 | 9.679 | -0.268 | -0.104 | -0.209 | 
| Tilt | -0.082 | -0.016 | -0.268 | 0.047 | -0.001 | 0.001 | 
| Roll | -0.037 | -0.064 | -0.104 | -0.001 | 0.030 | 0.009 | 
| Twist | -0.009 | -0.140 | -0.209 | 0.001 | 0.009 | 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 | 1.185 | -0.477 | 1.105 | -0.148 | 0.067 | 0.074 | 
| Slide | -0.477 | 2.055 | 1.284 | 0.004 | 0.013 | -0.131 | 
| Rise | 1.105 | 1.284 | 8.458 | -0.314 | 0.106 | -0.149 | 
| Tilt | -0.148 | 0.004 | -0.314 | 0.045 | -0.007 | -0.003 | 
| Roll | 0.067 | 0.013 | 0.106 | -0.007 | 0.019 | 0.002 | 
| Twist | 0.074 | -0.131 | -0.149 | -0.003 | 0.002 | 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 | 1.982 | -0.533 | 1.152 | -0.156 | 0.068 | 0.129 | 
| Slide | -0.533 | 1.317 | 0.359 | 0.049 | 0.038 | -0.064 | 
| Rise | 1.152 | 0.359 | 7.061 | -0.171 | 0.126 | -0.111 | 
| Tilt | -0.156 | 0.049 | -0.171 | 0.038 | -0.003 | -0.002 | 
| Roll | 0.068 | 0.038 | 0.126 | -0.003 | 0.017 | 0.002 | 
| Twist | 0.129 | -0.064 | -0.111 | -0.002 | 0.002 | 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 | 1.421 | -0.375 | 0.700 | -0.115 | 0.058 | 0.019 | 
| Slide | -0.375 | 2.133 | 1.756 | -0.048 | -0.016 | -0.101 | 
| Rise | 0.700 | 1.756 | 10.595 | -0.389 | -0.061 | -0.212 | 
| Tilt | -0.115 | -0.048 | -0.389 | 0.050 | -0.002 | -0.000 | 
| Roll | 0.058 | -0.016 | -0.061 | -0.002 | 0.023 | 0.010 | 
| Twist | 0.019 | -0.101 | -0.212 | -0.000 | 0.010 | 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 | 1.388 | -0.224 | 0.526 | -0.156 | 0.030 | 0.081 | 
| Slide | -0.224 | 4.038 | 0.423 | 0.066 | 0.001 | -0.237 | 
| Rise | 0.526 | 0.423 | 10.051 | -0.329 | 0.099 | -0.102 | 
| Tilt | -0.156 | 0.066 | -0.329 | 0.051 | -0.003 | -0.006 | 
| Roll | 0.030 | 0.001 | 0.099 | -0.003 | 0.017 | 0.010 | 
| Twist | 0.081 | -0.237 | -0.102 | -0.006 | 0.010 | 0.047 | 
                        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 | 1.625 | -0.687 | -0.503 | -0.056 | -0.000 | -0.024 | 
| Slide | -0.687 | 5.659 | 2.643 | 0.050 | 0.036 | -0.279 | 
| Rise | -0.503 | 2.643 | 10.548 | -0.030 | 0.021 | -0.273 | 
| Tilt | -0.056 | 0.050 | -0.030 | 0.047 | -0.005 | -0.007 | 
| Roll | -0.000 | 0.036 | 0.021 | -0.005 | 0.035 | 0.008 | 
| Twist | -0.024 | -0.279 | -0.273 | -0.007 | 0.008 | 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 | 2.590 | -0.346 | 0.446 | -0.056 | 0.010 | -0.090 | 
| Slide | -0.347 | 4.522 | 4.249 | -0.128 | 0.048 | -0.162 | 
| Rise | 0.445 | 4.249 | 14.471 | -0.271 | 0.033 | -0.276 | 
| Tilt | -0.056 | -0.128 | -0.271 | 0.044 | -0.003 | -0.002 | 
| Roll | 0.010 | 0.048 | 0.033 | -0.003 | 0.026 | 0.010 | 
| Twist | -0.090 | -0.162 | -0.276 | -0.002 | 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 | 0.991 | -0.274 | -0.472 | -0.007 | -0.013 | -0.015 | 
| Slide | -0.274 | 3.324 | 3.093 | 0.015 | -0.011 | -0.094 | 
| Rise | -0.472 | 3.093 | 10.539 | -0.045 | 0.040 | -0.155 | 
| Tilt | -0.007 | 0.015 | -0.045 | 0.040 | -0.005 | -0.007 | 
| Roll | -0.013 | -0.011 | 0.040 | -0.005 | 0.024 | 0.007 | 
| Twist | -0.015 | -0.094 | -0.155 | -0.007 | 0.007 | 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 | 1.274 | -0.245 | -0.257 | 0.003 | -0.023 | -0.090 | 
| Slide | -0.245 | 4.171 | 3.421 | 0.019 | -0.021 | -0.087 | 
| Rise | -0.257 | 3.421 | 12.035 | 0.020 | 0.044 | -0.227 | 
| Tilt | 0.003 | 0.019 | 0.020 | 0.039 | -0.007 | -0.003 | 
| Roll | -0.023 | -0.021 | 0.044 | -0.007 | 0.028 | 0.005 | 
| Twist | -0.090 | -0.087 | -0.227 | -0.003 | 0.005 | 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 | 2.550 | 0.185 | -0.291 | -0.063 | -0.015 | -0.054 | 
| Slide | 0.185 | 3.127 | 3.476 | 0.028 | -0.075 | -0.179 | 
| Rise | -0.291 | 3.476 | 9.236 | -0.012 | -0.023 | -0.162 | 
| Tilt | -0.063 | 0.028 | -0.012 | 0.043 | -0.007 | -0.002 | 
| Roll | -0.015 | -0.075 | -0.023 | -0.007 | 0.027 | 0.004 | 
| Twist | -0.054 | -0.179 | -0.162 | -0.002 | 0.004 | 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 | 1.515 | -0.271 | -0.422 | -0.030 | -0.027 | 0.019 | 
| Slide | -0.271 | 4.345 | 2.385 | -0.040 | -0.036 | -0.039 | 
| Rise | -0.422 | 2.385 | 9.624 | -0.056 | -0.027 | -0.193 | 
| Tilt | -0.030 | -0.040 | -0.056 | 0.040 | -0.008 | -0.004 | 
| Roll | -0.027 | -0.036 | -0.027 | -0.008 | 0.024 | 0.012 | 
| Twist | 0.019 | -0.039 | -0.193 | -0.004 | 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 | 1.727 | -0.060 | -0.658 | -0.022 | -0.020 | -0.016 | 
| Slide | -0.060 | 5.991 | 3.751 | 0.001 | -0.082 | -0.180 | 
| Rise | -0.658 | 3.751 | 12.585 | -0.093 | -0.021 | -0.203 | 
| Tilt | -0.022 | 0.001 | -0.093 | 0.045 | -0.008 | -0.008 | 
| Roll | -0.020 | -0.082 | -0.021 | -0.008 | 0.034 | 0.012 | 
| Twist | -0.016 | -0.180 | -0.203 | -0.008 | 0.012 | 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 | 0.605 | 0.384 | 0.081 | -0.035 | 0.000 | -0.023 | 
| Slide | 0.384 | 2.151 | 1.152 | -0.002 | -0.002 | -0.057 | 
| Rise | 0.081 | 1.152 | 7.190 | -0.007 | -0.141 | -0.224 | 
| Tilt | -0.035 | -0.002 | -0.007 | 0.020 | -0.002 | 0.002 | 
| Roll | 0.000 | -0.002 | -0.141 | -0.002 | 0.018 | 0.013 | 
| Twist | -0.023 | -0.057 | -0.224 | 0.002 | 0.013 | 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 | 1.398 | -0.602 | 0.760 | -0.028 | 0.020 | 0.004 | 
| Slide | -0.602 | 4.002 | 0.229 | -0.027 | 0.026 | 0.034 | 
| Rise | 0.760 | 0.229 | 7.973 | -0.054 | -0.193 | -0.214 | 
| Tilt | -0.028 | -0.027 | -0.054 | 0.030 | 0.002 | 0.001 | 
| Roll | 0.020 | 0.026 | -0.193 | 0.002 | 0.026 | 0.011 | 
| Twist | 0.004 | 0.034 | -0.214 | 0.001 | 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 | 0.764 | -0.182 | 0.135 | -0.028 | -0.029 | -0.021 | 
| Slide | -0.182 | 2.140 | 1.304 | -0.006 | 0.004 | -0.106 | 
| Rise | 0.135 | 1.304 | 6.301 | 0.038 | -0.094 | -0.197 | 
| Tilt | -0.028 | -0.006 | 0.038 | 0.024 | 0.001 | -0.000 | 
| Roll | -0.029 | 0.004 | -0.094 | 0.001 | 0.021 | 0.013 | 
| Twist | -0.021 | -0.106 | -0.197 | -0.000 | 0.013 | 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 | 1.404 | 0.632 | -0.207 | -0.060 | -0.006 | -0.025 | 
| Slide | 0.632 | 2.264 | 0.603 | 0.071 | 0.013 | -0.095 | 
| Rise | -0.207 | 0.603 | 6.790 | -0.016 | -0.108 | -0.168 | 
| Tilt | -0.060 | 0.071 | -0.016 | 0.026 | 0.002 | -0.004 | 
| Roll | -0.006 | 0.013 | -0.108 | 0.002 | 0.018 | 0.009 | 
| Twist | -0.025 | -0.095 | -0.168 | -0.004 | 0.009 | 0.020 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 0.573 | -0.023 | 0.023 | -0.036 | 0.020 | 0.016 | 
| Slide | -0.023 | 2.127 | 1.319 | -0.017 | 0.030 | -0.086 | 
| Rise | 0.023 | 1.319 | 6.412 | -0.028 | -0.069 | -0.192 | 
| Tilt | -0.036 | -0.017 | -0.028 | 0.025 | -0.000 | 0.000 | 
| Roll | 0.020 | 0.030 | -0.069 | -0.000 | 0.021 | 0.012 | 
| Twist | 0.016 | -0.086 | -0.192 | 0.000 | 0.012 | 0.028 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 1.402 | 0.844 | -0.361 | -0.012 | -0.029 | -0.056 | 
| Slide | 0.844 | 2.916 | 0.486 | 0.026 | 0.017 | -0.053 | 
| Rise | -0.361 | 0.486 | 6.765 | 0.042 | -0.156 | -0.214 | 
| Tilt | -0.012 | 0.026 | 0.042 | 0.024 | 0.002 | 0.001 | 
| Roll | -0.029 | 0.017 | -0.156 | 0.002 | 0.027 | 0.013 | 
| Twist | -0.056 | -0.053 | -0.214 | 0.001 | 0.013 | 0.031 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 0.725 | 0.174 | -0.197 | -0.028 | -0.021 | 0.019 | 
| Slide | 0.174 | 2.223 | 1.198 | 0.000 | 0.003 | -0.130 | 
| Rise | -0.197 | 1.198 | 7.533 | 0.029 | -0.110 | -0.155 | 
| Tilt | -0.028 | 0.000 | 0.029 | 0.021 | -0.002 | 0.001 | 
| Roll | -0.021 | 0.003 | -0.110 | -0.002 | 0.022 | 0.012 | 
| Twist | 0.019 | -0.130 | -0.154 | 0.001 | 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 | 1.909 | -0.373 | -0.220 | -0.014 | 0.043 | 0.021 | 
| Slide | -0.373 | 3.202 | 1.668 | -0.085 | -0.054 | -0.212 | 
| Rise | -0.220 | 1.668 | 4.662 | -0.019 | -0.033 | -0.109 | 
| Tilt | -0.014 | -0.085 | -0.019 | 0.026 | -0.001 | 0.002 | 
| Roll | 0.043 | -0.054 | -0.033 | -0.001 | 0.019 | 0.009 | 
| Twist | 0.021 | -0.212 | -0.109 | 0.002 | 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 | 2.160 | -0.360 | -1.008 | -0.112 | -0.068 | 0.043 | 
| Slide | -0.360 | 4.314 | 1.398 | -0.000 | -0.067 | -0.148 | 
| Rise | -1.008 | 1.398 | 10.519 | 0.393 | 0.061 | -0.110 | 
| Tilt | -0.112 | -0.000 | 0.393 | 0.053 | 0.009 | -0.001 | 
| Roll | -0.068 | -0.067 | 0.061 | 0.009 | 0.027 | 0.010 | 
| Twist | 0.043 | -0.148 | -0.110 | -0.001 | 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 | 2.559 | -0.707 | -0.636 | -0.095 | -0.085 | 0.100 | 
| Slide | -0.707 | 2.721 | 1.062 | 0.023 | 0.010 | -0.105 | 
| Rise | -0.636 | 1.062 | 9.591 | 0.360 | 0.048 | -0.159 | 
| Tilt | -0.095 | 0.023 | 0.360 | 0.048 | 0.007 | -0.006 | 
| Roll | -0.085 | 0.010 | 0.048 | 0.007 | 0.021 | 0.005 | 
| Twist | 0.100 | -0.105 | -0.159 | -0.006 | 0.005 | 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 | 1.383 | -0.562 | -0.126 | -0.050 | -0.016 | 0.038 | 
| Slide | -0.562 | 2.318 | 1.162 | -0.032 | -0.048 | -0.133 | 
| Rise | -0.126 | 1.162 | 9.519 | 0.253 | -0.071 | -0.165 | 
| Tilt | -0.050 | -0.032 | 0.253 | 0.037 | 0.001 | 0.000 | 
| Roll | -0.016 | -0.048 | -0.071 | 0.001 | 0.020 | 0.010 | 
| Twist | 0.038 | -0.133 | -0.165 | 0.000 | 0.010 | 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 | 2.278 | -0.246 | -1.023 | -0.094 | -0.045 | -0.000 | 
| Slide | -0.246 | 2.642 | 1.934 | 0.065 | 0.009 | -0.103 | 
| Rise | -1.023 | 1.934 | 9.117 | 0.319 | 0.124 | -0.146 | 
| Tilt | -0.094 | 0.065 | 0.319 | 0.046 | 0.007 | 0.000 | 
| Roll | -0.045 | 0.009 | 0.124 | 0.007 | 0.020 | 0.011 | 
| Twist | -0.000 | -0.103 | -0.146 | 0.000 | 0.011 | 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 | 1.342 | -0.576 | -0.124 | -0.072 | -0.016 | -0.021 | 
| Slide | -0.576 | 2.742 | 1.326 | -0.071 | -0.043 | -0.150 | 
| Rise | -0.124 | 1.327 | 10.786 | 0.274 | -0.069 | -0.173 | 
| Tilt | -0.072 | -0.071 | 0.274 | 0.041 | 0.001 | 0.003 | 
| Roll | -0.016 | -0.043 | -0.069 | 0.001 | 0.022 | 0.010 | 
| Twist | -0.021 | -0.150 | -0.173 | 0.003 | 0.010 | 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 | 4.484 | 0.492 | -2.151 | -0.175 | -0.001 | -0.021 | 
| Slide | 0.492 | 6.172 | 1.866 | 0.035 | -0.065 | -0.387 | 
| Rise | -2.152 | 1.866 | 14.581 | 0.560 | -0.133 | -0.145 | 
| Tilt | -0.175 | 0.035 | 0.560 | 0.060 | 0.005 | 0.002 | 
| Roll | -0.001 | -0.065 | -0.133 | 0.005 | 0.038 | 0.007 | 
| Twist | -0.021 | -0.387 | -0.145 | 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 | 1.586 | -0.581 | -0.726 | -0.086 | -0.006 | 0.060 | 
| Slide | -0.581 | 3.111 | 1.359 | -0.003 | -0.052 | -0.103 | 
| Rise | -0.726 | 1.359 | 9.683 | 0.293 | -0.051 | -0.136 | 
| Tilt | -0.086 | -0.003 | 0.293 | 0.044 | 0.004 | 0.000 | 
| Roll | -0.006 | -0.052 | -0.051 | 0.004 | 0.028 | 0.010 | 
| Twist | 0.060 | -0.103 | -0.136 | 0.000 | 0.010 | 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 | 1.534 | -0.475 | -0.250 | -0.073 | -0.020 | 0.005 | 
| Slide | -0.475 | 2.825 | 1.779 | -0.014 | -0.028 | -0.167 | 
| Rise | -0.251 | 1.779 | 8.508 | 0.202 | -0.045 | -0.162 | 
| Tilt | -0.073 | -0.014 | 0.202 | 0.038 | 0.003 | 0.001 | 
| Roll | -0.020 | -0.028 | -0.045 | 0.003 | 0.023 | 0.009 | 
| Twist | 0.005 | -0.167 | -0.162 | 0.001 | 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 | 3.310 | -0.010 | 0.021 | 0.006 | 0.014 | -0.087 | 
| Slide | -0.010 | 4.337 | 0.147 | -0.089 | 0.043 | -0.273 | 
| Rise | 0.021 | 0.147 | 8.927 | 0.060 | -0.056 | -0.142 | 
| Tilt | 0.006 | -0.089 | 0.060 | 0.037 | 0.001 | -0.001 | 
| Roll | 0.014 | 0.043 | -0.056 | 0.001 | 0.023 | -0.006 | 
| Twist | -0.087 | -0.273 | -0.142 | -0.001 | -0.006 | 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 | 0.796 | 0.028 | -0.325 | -0.064 | -0.018 | -0.005 | 
| Slide | 0.028 | 2.619 | 0.619 | 0.013 | 0.019 | -0.102 | 
| Rise | -0.325 | 0.619 | 8.572 | 0.061 | -0.008 | -0.197 | 
| Tilt | -0.064 | 0.013 | 0.061 | 0.031 | 0.002 | -0.000 | 
| Roll | -0.018 | 0.019 | -0.008 | 0.002 | 0.014 | 0.003 | 
| Twist | -0.005 | -0.102 | -0.197 | -0.000 | 0.003 | 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 | 1.230 | 0.000 | -0.534 | 0.012 | -0.017 | -0.033 | 
| Slide | 0.000 | 3.194 | 0.092 | 0.003 | -0.017 | -0.057 | 
| Rise | -0.534 | 0.092 | 8.640 | 0.010 | -0.111 | -0.216 | 
| Tilt | 0.012 | 0.003 | 0.010 | 0.032 | -0.000 | -0.003 | 
| Roll | -0.017 | -0.017 | -0.111 | -0.000 | 0.020 | 0.009 | 
| Twist | -0.033 | -0.057 | -0.216 | -0.003 | 0.009 | 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 | 0.992 | -0.094 | -0.768 | -0.074 | 0.003 | 0.024 | 
| Slide | -0.094 | 3.471 | 0.707 | 0.062 | 0.007 | -0.167 | 
| Rise | -0.768 | 0.707 | 8.667 | -0.017 | -0.047 | -0.244 | 
| Tilt | -0.074 | 0.062 | -0.017 | 0.029 | 0.004 | -0.004 | 
| Roll | 0.003 | 0.007 | -0.047 | 0.004 | 0.019 | 0.008 | 
| Twist | 0.024 | -0.167 | -0.244 | -0.004 | 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 | 2.677 | -0.680 | 0.441 | -0.059 | -0.050 | -0.080 | 
| Slide | -0.680 | 3.750 | 0.163 | 0.036 | -0.039 | -0.040 | 
| Rise | 0.441 | 0.163 | 7.578 | -0.032 | -0.207 | -0.140 | 
| Tilt | -0.059 | 0.036 | -0.032 | 0.032 | -0.001 | -0.009 | 
| Roll | -0.050 | -0.039 | -0.207 | -0.001 | 0.023 | 0.015 | 
| Twist | -0.080 | -0.040 | -0.140 | -0.009 | 0.015 | 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 | 1.737 | -0.736 | 0.909 | -0.112 | -0.010 | 0.172 | 
| Slide | -0.736 | 3.974 | 0.093 | -0.001 | 0.048 | -0.145 | 
| Rise | 0.909 | 0.093 | 7.367 | -0.062 | -0.148 | -0.122 | 
| Tilt | -0.112 | -0.001 | -0.062 | 0.031 | -0.004 | -0.006 | 
| Roll | -0.010 | 0.048 | -0.148 | -0.004 | 0.017 | 0.004 | 
| Twist | 0.172 | -0.145 | -0.122 | -0.006 | 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 | 0.765 | 0.260 | -0.490 | -0.052 | 0.005 | 0.032 | 
| Slide | 0.260 | 2.444 | 1.321 | -0.038 | -0.007 | -0.194 | 
| Rise | -0.490 | 1.321 | 5.063 | 0.038 | 0.033 | -0.153 | 
| Tilt | -0.052 | -0.038 | 0.038 | 0.025 | 0.001 | 0.003 | 
| Roll | 0.005 | -0.007 | 0.033 | 0.001 | 0.015 | 0.003 | 
| Twist | 0.032 | -0.194 | -0.153 | 0.003 | 0.003 | 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 | 2.271 | -0.143 | -0.379 | -0.093 | 0.015 | -0.048 | 
| Slide | -0.143 | 5.152 | 0.874 | 0.009 | -0.082 | -0.241 | 
| Rise | -0.379 | 0.874 | 8.015 | 0.044 | -0.047 | -0.171 | 
| Tilt | -0.093 | 0.009 | 0.044 | 0.029 | -0.000 | -0.004 | 
| Roll | 0.015 | -0.082 | -0.047 | -0.000 | 0.024 | 0.012 | 
| Twist | -0.048 | -0.241 | -0.171 | -0.004 | 0.012 | 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 | 1.090 | 0.234 | 0.098 | -0.070 | -0.017 | -0.007 | 
| Slide | 0.234 | 2.996 | 1.363 | -0.012 | -0.011 | -0.112 | 
| Rise | 0.098 | 1.363 | 9.254 | -0.025 | -0.176 | -0.270 | 
| Tilt | -0.070 | -0.012 | -0.025 | 0.033 | -0.000 | -0.001 | 
| Roll | -0.017 | -0.011 | -0.176 | -0.000 | 0.026 | 0.012 | 
| Twist | -0.007 | -0.112 | -0.270 | -0.001 | 0.012 | 0.029 | 
                        Units:
 Diagonal Shift/Slide/Rise in kcal/(mol*Ų), Diagonal Tilt/Roll/Twist in kcal/(mol*degree²)
                        Out of Diagonal: Shift/Slide/Rise in kcal/(mol*Å), Out of Diagonal Tilt/Roll/Twist in kcal/(mol*degree)
			
		
|  | Shift | Slide | Rise | Tilt | Roll | Twist | 
| Shift | 1.557 | 0.417 | -0.093 | -0.075 | 0.015 | -0.061 | 
| Slide | 0.417 | 2.870 | 0.723 | -0.026 | 0.022 | -0.178 | 
| Rise | -0.093 | 0.723 | 7.905 | -0.006 | -0.022 | -0.216 | 
| Tilt | -0.075 | -0.026 | -0.006 | 0.029 | 0.001 | -0.000 | 
| Roll | 0.015 | 0.022 | -0.022 | 0.001 | 0.017 | 0.006 | 
| Twist | -0.061 | -0.178 | -0.216 | -0.000 | 0.006 | 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 | 2.640 | -1.099 | 0.409 | -0.072 | 0.028 | 0.050 | 
| Slide | -1.099 | 4.556 | 0.255 | -0.086 | -0.022 | -0.244 | 
| Rise | 0.409 | 0.255 | 7.085 | -0.107 | -0.106 | -0.108 | 
| Tilt | -0.072 | -0.086 | -0.107 | 0.030 | -0.002 | -0.011 | 
| Roll | 0.028 | -0.022 | -0.106 | -0.002 | 0.021 | 0.008 | 
| Twist | 0.050 | -0.244 | -0.108 | -0.011 | 0.008 | 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 | 2.656 | 0.290 | -0.422 | -0.136 | -0.043 | 0.165 | 
| Slide | 0.290 | 5.217 | -0.176 | 0.012 | 0.003 | -0.212 | 
| Rise | -0.422 | -0.176 | 8.730 | -0.005 | -0.092 | -0.176 | 
| Tilt | -0.136 | 0.012 | -0.005 | 0.036 | 0.002 | -0.002 | 
| Roll | -0.043 | 0.003 | -0.092 | 0.002 | 0.022 | 0.007 | 
| Twist | 0.165 | -0.212 | -0.176 | -0.002 | 0.007 | 0.079 | 
                        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 | 1.286 | -0.044 | -0.418 | 0.004 | -0.023 | -0.014 | 
| Slide | -0.044 | 3.032 | 0.488 | 0.020 | -0.030 | -0.030 | 
| Rise | -0.418 | 0.488 | 5.397 | 0.062 | -0.158 | -0.195 | 
| Tilt | 0.004 | 0.020 | 0.062 | 0.027 | -0.003 | -0.001 | 
| Roll | -0.023 | -0.030 | -0.158 | -0.003 | 0.017 | 0.010 | 
| Twist | -0.014 | -0.030 | -0.195 | -0.001 | 0.010 | 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 | 0.983 | 0.404 | -0.212 | -0.071 | -0.000 | 0.044 | 
| Slide | 0.404 | 1.882 | 1.808 | -0.013 | -0.010 | -0.097 | 
| Rise | -0.212 | 1.808 | 6.674 | -0.023 | -0.052 | -0.220 | 
| Tilt | -0.071 | -0.013 | -0.023 | 0.028 | 0.002 | 0.001 | 
| Roll | -0.000 | -0.010 | -0.052 | 0.002 | 0.017 | 0.004 | 
| Twist | 0.044 | -0.097 | -0.220 | 0.001 | 0.004 | 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 | 1.594 | -0.352 | -0.728 | -0.016 | -0.008 | -0.112 | 
| Slide | -0.352 | 3.272 | 1.131 | 0.012 | -0.122 | -0.024 | 
| Rise | -0.728 | 1.130 | 9.438 | 0.229 | -0.083 | -0.200 | 
| Tilt | -0.016 | 0.012 | 0.229 | 0.043 | -0.001 | -0.006 | 
| Roll | -0.008 | -0.122 | -0.083 | -0.001 | 0.028 | 0.017 | 
| Twist | -0.112 | -0.024 | -0.200 | -0.006 | 0.017 | 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 | 2.075 | -0.221 | -0.983 | -0.058 | -0.018 | -0.084 | 
| Slide | -0.221 | 4.178 | 2.109 | 0.042 | -0.090 | -0.139 | 
| Rise | -0.983 | 2.109 | 9.390 | 0.341 | -0.054 | -0.237 | 
| Tilt | -0.058 | 0.042 | 0.341 | 0.050 | -0.000 | -0.009 | 
| Roll | -0.018 | -0.090 | -0.054 | -0.000 | 0.032 | 0.009 | 
| Twist | -0.084 | -0.139 | -0.237 | -0.009 | 0.009 | 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 | 3.952 | 1.642 | -0.617 | -0.066 | 0.029 | -0.143 | 
| Slide | 1.642 | 4.757 | 0.741 | 0.020 | -0.129 | -0.282 | 
| Rise | -0.617 | 0.741 | 11.526 | 0.426 | -0.099 | -0.075 | 
| Tilt | -0.066 | 0.020 | 0.426 | 0.061 | -0.004 | 0.002 | 
| Roll | 0.029 | -0.129 | -0.099 | -0.004 | 0.038 | 0.016 | 
| Twist | -0.143 | -0.282 | -0.075 | 0.002 | 0.016 | 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 | 3.824 | -0.183 | -0.708 | -0.051 | -0.041 | 0.076 | 
| Slide | -0.183 | 5.893 | 1.823 | 0.083 | 0.005 | -0.395 | 
| Rise | -0.708 | 1.823 | 8.982 | 0.421 | 0.012 | -0.066 | 
| Tilt | -0.051 | 0.083 | 0.421 | 0.061 | -0.001 | -0.005 | 
| Roll | -0.041 | 0.005 | 0.012 | -0.001 | 0.028 | 0.006 | 
| Twist | 0.076 | -0.395 | -0.066 | -0.005 | 0.006 | 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 | 3.337 | 0.148 | -0.425 | 0.008 | -0.044 | -0.002 | 
| Slide | 0.148 | 5.247 | 1.227 | 0.012 | -0.047 | -0.292 | 
| Rise | -0.425 | 1.227 | 8.915 | 0.387 | 0.045 | -0.130 | 
| Tilt | 0.008 | 0.012 | 0.387 | 0.049 | 0.003 | -0.005 | 
| Roll | -0.044 | -0.047 | 0.045 | 0.003 | 0.031 | 0.006 | 
| Twist | -0.002 | -0.292 | -0.130 | -0.005 | 0.006 | 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 | 2.180 | -0.238 | -0.184 | 0.004 | -0.032 | -0.095 | 
| Slide | -0.238 | 2.353 | 1.559 | 0.021 | -0.133 | -0.068 | 
| Rise | -0.184 | 1.559 | 7.081 | 0.129 | -0.126 | -0.128 | 
| Tilt | 0.004 | 0.021 | 0.129 | 0.038 | -0.007 | -0.007 | 
| Roll | -0.032 | -0.133 | -0.126 | -0.007 | 0.019 | 0.008 | 
| Twist | -0.095 | -0.068 | -0.128 | -0.007 | 0.008 | 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 | 2.265 | -1.076 | -1.052 | -0.031 | -0.038 | -0.008 | 
| Slide | -1.076 | 4.221 | 1.393 | 0.021 | 0.007 | -0.268 | 
| Rise | -1.052 | 1.393 | 8.141 | 0.253 | 0.046 | -0.169 | 
| Tilt | -0.031 | 0.021 | 0.253 | 0.042 | 0.003 | -0.004 | 
| Roll | -0.038 | 0.007 | 0.046 | 0.003 | 0.019 | -0.005 | 
| Twist | -0.008 | -0.268 | -0.169 | -0.004 | -0.005 | 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 | 1.601 | -0.930 | -0.612 | -0.017 | 0.013 | 0.003 | 
| Slide | -0.930 | 2.534 | 0.776 | -0.018 | -0.077 | -0.161 | 
| Rise | -0.612 | 0.776 | 8.365 | 0.306 | 0.107 | -0.189 | 
| Tilt | -0.017 | -0.018 | 0.306 | 0.046 | 0.005 | -0.007 | 
| Roll | 0.013 | -0.077 | 0.107 | 0.005 | 0.020 | 0.012 | 
| Twist | 0.003 | -0.161 | -0.189 | -0.007 | 0.012 | 0.047 | 
                        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 | 3.637 | 0.589 | -1.140 | -0.040 | -0.043 | -0.024 | 
| Slide | 0.589 | 5.498 | 1.911 | -0.012 | -0.123 | -0.253 | 
| Rise | -1.140 | 1.911 | 12.001 | 0.403 | -0.170 | -0.128 | 
| Tilt | -0.040 | -0.012 | 0.402 | 0.055 | -0.008 | 0.002 | 
| Roll | -0.043 | -0.123 | -0.170 | -0.008 | 0.046 | 0.006 | 
| Twist | -0.024 | -0.253 | -0.128 | 0.002 | 0.006 | 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 | 2.445 | -1.195 | -0.441 | -0.030 | 0.051 | -0.029 | 
| Slide | -1.195 | 3.908 | 0.614 | -0.014 | -0.004 | -0.226 | 
| Rise | -0.442 | 0.614 | 10.366 | 0.171 | 0.028 | -0.233 | 
| Tilt | -0.030 | -0.014 | 0.171 | 0.045 | 0.003 | -0.014 | 
| Roll | 0.051 | -0.004 | 0.028 | 0.003 | 0.024 | 0.006 | 
| Twist | -0.029 | -0.226 | -0.233 | -0.014 | 0.006 | 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 | 2.083 | -0.337 | -0.479 | -0.014 | 0.047 | -0.072 | 
| Slide | -0.337 | 2.744 | 1.410 | -0.001 | -0.066 | -0.142 | 
| Rise | -0.479 | 1.410 | 9.049 | 0.160 | -0.034 | -0.273 | 
| Tilt | -0.014 | -0.001 | 0.160 | 0.041 | 0.000 | -0.010 | 
| Roll | 0.047 | -0.066 | -0.034 | 0.000 | 0.024 | 0.013 | 
| Twist | -0.072 | -0.142 | -0.273 | -0.010 | 0.013 | 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 | 1.200 | -0.110 | 0.189 | 0.029 | -0.015 | -0.064 | 
| Slide | -0.110 | 2.864 | 1.689 | 0.020 | -0.098 | -0.160 | 
| Rise | 0.189 | 1.689 | 9.026 | 0.168 | -0.119 | -0.274 | 
| Tilt | 0.029 | 0.020 | 0.168 | 0.036 | -0.002 | -0.009 | 
| Roll | -0.015 | -0.098 | -0.119 | -0.002 | 0.023 | 0.012 | 
| Twist | -0.064 | -0.160 | -0.274 | -0.009 | 0.012 | 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)