*HEADER    RNA                                     04-JUN-04   1WKS              
*TITLE     SOLUTION STRUCTURE OF AN RNA STEM-LOOP DERIVED FROM THE 3'            
*TITLE    2 CONSERVED REGION OF EEL LINE UNAL2                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 5'-                                                        
*COMPND   3 R(*GP*GP*CP*UP*UP*UP*GP*GP*AP*UP*AP*AP*AP*AP*GP*CP*C)-3';            
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: CHEMICAL SYNTHESIZED 17-MER RNA                       
*SOURCE   4 CORRESPONDING TO THE RT BINDING SITE OF EEL LINE RNA.                
*KEYWDS    NMR, RNA, PENTALOOP, LINE, RETROTRANSPOSITION                         
*EXPDTA    NMR, 21 STRUCTURES                                                    
*AUTHOR    S.BABA, M.KAJIKAWA, N.OKADA, G.KAWAI                                  
*REVDAT   1   22-JUN-04 1WKS    0                                                

!BIOSYM restraint 1
!
#remote_prochiral_center
!
#chiral
1:G5'_1:C1'        R
1:G5'_1:C2'        R
1:G5'_1:C3'        S
1:G5'_1:C4'        R
1:G_2:C1'          R
1:G_2:C2'          R
1:G_2:C3'          S
1:G_2:C4'          R
1:C_3:C1'          R
1:C_3:C2'          R
1:C_3:C3'          S
1:C_3:C4'          R
1:U_4:C1'          R
1:U_4:C2'          R
1:U_4:C3'          S
1:U_4:C4'          R
1:U_5:C1'          R
1:U_5:C2'          R
1:U_5:C3'          S
1:U_5:C4'          R
1:U_6:C1'          R
1:U_6:C2'          R
1:U_6:C3'          S
1:U_6:C4'          R
1:G_7:C1'          R
1:G_7:C2'          R
1:G_7:C3'          S
1:G_7:C4'          R
1:G_8:C1'          R
1:G_8:C2'          R
1:G_8:C3'          S
1:G_8:C4'          R
1:A_9:C1'          R
1:A_9:C2'          R
1:A_9:C3'          S
1:A_9:C4'          R
1:U_10:C1'         R
1:U_10:C2'         R
1:U_10:C3'         S
1:U_10:C4'         R
1:A_11:C1'         R
1:A_11:C2'         R
1:A_11:C3'         S
1:A_11:C4'         R
1:A_12:C1'         R
1:A_12:C2'         R
1:A_12:C3'         S
1:A_12:C4'         R
1:A_13:C1'         R
1:A_13:C2'         R
1:A_13:C3'         S
1:A_13:C4'         R
1:A_14:C1'         R
1:A_14:C2'         R
1:A_14:C3'         S
1:A_14:C4'         R
1:G_15:C1'         R
1:G_15:C2'         R
1:G_15:C3'         S
1:G_15:C4'         R
1:C_16:C1'         R
1:C_16:C2'         R
1:C_16:C3'         S
1:C_16:C4'         R
1:C3'_17:C1'       R
1:C3'_17:C2'       R
1:C3'_17:C3'       S
1:C3'_17:C4'       R
!
#distance
1:G5'_1:H22        1:C3'_17:O2         1.800  2.200 100.00 100.00 1000.000
1:G5'_1:H1         1:C3'_17:N3         1.800  2.200 100.00 100.00 1000.000
1:G5'_1:O6         1:C3'_17:H42        1.800  2.200 100.00 100.00 1000.000
1:G_2:H22          1:C_16:O2           1.800  2.200 100.00 100.00 1000.000
1:G_2:H1           1:C_16:N3           1.800  2.200 100.00 100.00 1000.000
1:G_2:O6           1:C_16:H42          1.800  2.200 100.00 100.00 1000.000
1:C_3:O2           1:G_15:H22          1.800  2.200 100.00 100.00 1000.000
1:C_3:N3           1:G_15:H1           1.800  2.200 100.00 100.00 1000.000
1:C_3:H42          1:G_15:O6           1.800  2.200 100.00 100.00 1000.000
1:U_4:H3           1:A_14:N1           1.800  2.200 100.00 100.00 1000.000
1:U_4:O4           1:A_14:H61          1.800  2.200 100.00 100.00 1000.000
1:U_5:H3           1:A_13:N1           1.800  2.200 100.00 100.00 1000.000
1:U_5:O4           1:A_13:H61          1.800  2.200 100.00 100.00 1000.000
1:U_6:H3           1:A_12:N1           1.800  5.000 100.00 100.00 1000.000
!
#NOE_distance
1:G_2:H1           1:G_15:H1           2.100  5.000  5.000 100.00 100.00 1000.000  0.00         
1:G_15:H1          1:U_4:H3            2.100  5.000  5.000 100.00 100.00 1000.000  0.00         
1:U_4:H3           1:U_5:H3            2.100  5.000  5.000 100.00 100.00 1000.000  0.00         
1:A_9:H1'          1:A_9:H8            1.572  4.072  4.072 100.00 100.00 1000.000  0.00 
1:G_8:H1'          1:A_9:H8            2.330  4.830  4.830 100.00 100.00 1000.000  0.00 
1:A_11:H1'         1:A_9:H2            1.538  4.038  4.038 100.00 100.00 1000.000  0.00 
1:G5'_1:H1'        1:G5'_1:H8          2.157  4.657  4.657 100.00 100.00 1000.000  0.00 
1:U_5:H1'          1:U_5:H6            1.983  4.483  4.483 100.00 100.00 1000.000  0.00 
1:U_5:H5           1:U_5:H6            0.921  3.421  3.421 100.00 100.00 1000.000  0.00 
1:U_6:H5           1:U_5:H6            2.281  4.781  4.781 100.00 100.00 1000.000  0.00 
1:A_12:H1'         1:A_11:H2           1.994  4.494  4.494 100.00 100.00 1000.000  0.00 
1:U_4:H1'          1:U_5:H6            2.019  4.519  4.519 100.00 100.00 1000.000  0.00 
1:A_9:H1'          1:A_11:H8           2.488  4.988  4.988 100.00 100.00 1000.000  0.00 
1:A_11:H1'         1:A_11:H8           1.619  4.119  4.119 100.00 100.00 1000.000  0.00 
1:U_5:H1'          1:U_6:H6            1.694  4.194  4.194 100.00 100.00 1000.000  0.00 
1:U_4:H1'          1:U_4:H6            1.890  4.390  4.390 100.00 100.00 1000.000  0.00 
1:C_3:H1'          1:U_4:H6            2.355  4.855  4.855 100.00 100.00 1000.000  0.00 
1:U_4:H5           1:U_4:H6            1.019  3.519  3.519 100.00 100.00 1000.000  0.00 
1:U_10:H1'         1:U_10:H6           1.587  4.087  4.087 100.00 100.00 1000.000  0.00 
1:U_10:H5          1:U_10:H6           0.931  3.431  3.431 100.00 100.00 1000.000  0.00 
1:A_14:H1'         1:A_14:H8           1.970  4.470  4.470 100.00 100.00 1000.000  0.00 
1:A_13:H1'         1:A_14:H8           2.234  4.734  4.734 100.00 100.00 1000.000  0.00 
1:U_6:H1'          1:G_7:H8            2.319  4.819  4.819 100.00 100.00 1000.000  0.00 
1:G_7:H1'          1:G_7:H8            1.365  3.865  3.865 100.00 100.00 1000.000  0.00 
1:G_2:H1'          1:C_3:H6            2.287  4.787  4.787 100.00 100.00 1000.000  0.00 
1:C_3:H1'          1:C_3:H6            2.197  4.697  4.697 100.00 100.00 1000.000  0.00 
1:C_3:H5           1:C_3:H6            1.068  3.568  3.568 100.00 100.00 1000.000  0.00 
1:C3'_17:H1'       1:C3'_17:H6         1.847  4.347  4.347 100.00 100.00 1000.000  0.00 
1:C3'_17:H5        1:C3'_17:H6         0.862  3.362  3.362 100.00 100.00 1000.000  0.00 
1:G_8:H1'          1:G_8:H8            1.159  3.659  3.659 100.00 100.00 1000.000  0.00 
1:U_6:H1'          1:U_6:H6            1.585  4.085  4.085 100.00 100.00 1000.000  0.00 
1:U_6:H5           1:U_6:H6            0.826  3.326  3.326 100.00 100.00 1000.000  0.00 
1:A_13:H1'         1:A_13:H8           2.223  4.723  4.723 100.00 100.00 1000.000  0.00 
1:A_12:H1'         1:A_13:H8           2.437  4.937  4.937 100.00 100.00 1000.000  0.00 
1:G_2:H1'          1:G_2:H8            1.932  4.432  4.432 100.00 100.00 1000.000  0.00 
1:G5'_1:H1'        1:G_2:H8            1.983  4.483  4.483 100.00 100.00 1000.000  0.00 
1:C_3:H5           1:G_2:H8            2.810  5.310  5.310 100.00 100.00 1000.000  0.00 
1:G_15:H1'         1:C_16:H6           2.305  4.805  4.805 100.00 100.00 1000.000  0.00 
1:C_16:H1'         1:C_16:H6           1.810  4.310  4.310 100.00 100.00 1000.000  0.00 
1:C_16:H5          1:C_16:H6           1.019  3.519  3.519 100.00 100.00 1000.000  0.00 
1:A_14:H1'         1:G_15:H8           2.197  4.697  4.697 100.00 100.00 1000.000  0.00 
1:U_5:H1'          1:A_14:H2           2.069  4.569  4.569 100.00 100.00 1000.000  0.00 
1:G_15:H1'         1:A_14:H2           1.994  4.494  4.494 100.00 100.00 1000.000  0.00 
1:A_14:H1'         1:A_14:H2           3.210  5.710  5.710 100.00 100.00 1000.000  0.00 
1:A_13:H1'         1:A_12:H2           2.609  5.109  5.109 100.00 100.00 1000.000  0.00 
1:G_7:H1'          1:A_12:H2           2.810  5.310  5.310 100.00 100.00 1000.000  0.00 
1:G_15:H1'         1:G_15:H8           1.938  4.438  4.438 100.00 100.00 1000.000  0.00 
1:C_16:H5          1:G_15:H8           2.561  5.061  5.061 100.00 100.00 1000.000  0.00 
1:A_14:H1'         1:A_13:H2           1.913  4.413  4.413 100.00 100.00 1000.000  0.00 
1:U_6:H1'          1:A_13:H2           2.124  4.624  4.624 100.00 100.00 1000.000  0.00 
1:U_5:H5           1:U_4:H6            2.534  5.034  5.034 100.00 100.00 1000.000  0.00 
1:A_11:H1'         1:A_11:H2'          1.098  3.598  3.598 100.00 100.00 1000.000  0.00 
1:G5'_1:H1'        1:G5'_1:H2'         1.155  3.655  3.655 100.00 100.00 1000.000  0.00 
1:A_9:H1'          1:A_9:H3'           1.885  4.385  4.385 100.00 100.00 1000.000  0.00 
1:A_9:H1'          1:A_9:H2'           1.208  3.708  3.708 100.00 100.00 1000.000  0.00 
1:G_7:H1'          1:G_7:H3'           1.741  4.241  4.241 100.00 100.00 1000.000  0.00 
1:A_14:H1'         1:A_14:H3'          1.910  4.410  4.410 100.00 100.00 1000.000  0.00 
1:C_3:H5           1:G_2:H3'           2.102  4.602  4.602 100.00 100.00 1000.000  0.00 
1:A_12:H1'         1:A_12:H3'          2.299  4.799  4.799 100.00 100.00 1000.000  0.00 
1:G_2:H1'          1:G_2:H2'           1.080  3.580  3.580 100.00 100.00 1000.000  0.00 
1:C_3:H1'          1:C_3:H3'           2.030  4.530  4.530 100.00 100.00 1000.000  0.00 
1:C_3:H5           1:C_3:H3'           1.913  4.413  4.413 100.00 100.00 1000.000  0.00 
1:A_11:H1'         1:A_11:H3'          1.632  4.132  4.132 100.00 100.00 1000.000  0.00 
1:G5'_1:H1'        1:G5'_1:H3'         1.874  4.374  4.374 100.00 100.00 1000.000  0.00 
1:G_2:H1'          1:G_2:H3'           2.129  4.629  4.629 100.00 100.00 1000.000  0.00 
1:U_5:H1'          1:U_5:H3'           1.533  4.033  4.033 100.00 100.00 1000.000  0.00 
1:U_6:H5           1:U_5:H3'           1.756  4.256  4.256 100.00 100.00 1000.000  0.00 
1:A_12:H1'         1:A_12:H2'          1.318  3.818  3.818 100.00 100.00 1000.000  0.00 
1:A_14:H1'         1:A_14:H2'          1.019  3.519  3.519 100.00 100.00 1000.000  0.00 
1:U_5:H5           1:U_5:H3'           1.983  4.483  4.483 100.00 100.00 1000.000  0.00 
1:G_2:H1'          1:G_2:H4'           1.803  4.303  4.303 100.00 100.00 1000.000  0.00 
1:U_4:H1'          1:U_4:H3'           2.371  4.871  4.871 100.00 100.00 1000.000  0.00 
1:G_8:H1'          1:A_9:H3'           3.472  5.972  5.972 100.00 100.00 1000.000  0.00 
1:A_13:H1'         1:A_13:H2'          1.183  3.683  3.683 100.00 100.00 1000.000  0.00 
1:U_10:H1'         1:U_10:H3'          1.709  4.209  4.209 100.00 100.00 1000.000  0.00 
1:U_10:H1'         1:U_10:H4'          1.627  4.127  4.127 100.00 100.00 1000.000  0.00 
1:A_12:H1'         1:A_12:H4'          2.573  5.073  5.073 100.00 100.00 1000.000  0.00 
1:A_13:H1'         1:A_13:H3'          2.287  4.787  4.787 100.00 100.00 1000.000  0.00 
1:U_5:H5           1:U_4:H2'           2.120  4.620  4.620 100.00 100.00 1000.000  0.00 
1:U_4:H1'          1:U_4:H2'           0.857  3.357  3.357 100.00 100.00 1000.000  0.00 
1:C_3:H1'          1:C_3:H2'           0.857  3.357  3.357 100.00 100.00 1000.000  0.00 
1:U_4:H5           1:C_3:H2'           1.502  4.002  4.002 100.00 100.00 1000.000  0.00 
1:C_3:H5           1:C_3:H2'           2.197  4.697  4.697 100.00 100.00 1000.000  0.00 
1:U_6:H1'          1:U_6:H3'           1.352  3.852  3.852 100.00 100.00 1000.000  0.00 
1:U_10:H1'         1:U_10:H2'          1.245  3.745  3.745 100.00 100.00 1000.000  0.00 
1:A_13:H1'         1:A_12:H2'          2.322  4.822  4.822 100.00 100.00 1000.000  0.00 
1:G_15:H1'         1:G_15:H2'          0.991  3.491  3.491 100.00 100.00 1000.000  0.00 
1:C_16:H5          1:G_15:H2'          1.602  4.102  4.102 100.00 100.00 1000.000  0.00 
1:G_8:H1'          1:G_8:H2'           1.138  3.638  3.638 100.00 100.00 1000.000  0.00 
1:C_16:H1'         1:C_16:H3'          1.306  3.806  3.806 100.00 100.00 1000.000  0.00 
1:U_5:H1'          1:U_5:H4'           2.089  4.589  4.589 100.00 100.00 1000.000  0.00 
1:U_6:H1'          1:U_6:H2'           0.943  3.443  3.443 100.00 100.00 1000.000  0.00 
1:G_7:H1'          1:G_7:H2'           0.853  3.353  3.353 100.00 100.00 1000.000  0.00 
1:G5'_1:H1'        1:G5'_1:H4'         1.624  4.124  4.124 100.00 100.00 1000.000  0.00 
1:U_5:H1'          1:U_5:H2'           0.940  3.440  3.440 100.00 100.00 1000.000  0.00 
1:U_6:H5           1:U_5:H2'           1.810  4.310  4.310 100.00 100.00 1000.000  0.00 
1:C_16:H1'         1:C_16:H2'          1.001  3.501  3.501 100.00 100.00 1000.000  0.00 
1:U_6:H5           1:U_6:H3'           2.263  4.763  4.763 100.00 100.00 1000.000  0.00 
1:C3'_17:H1'       1:C3'_17:H3'        1.282  3.782  3.782 100.00 100.00 1000.000  0.00 
1:G_8:H1'          1:A_9:H2'           2.490  4.990  4.990 100.00 100.00 1000.000  0.00 
1:C_16:H1'         1:G_15:H2'          1.778  4.278  4.278 100.00 100.00 1000.000  0.00 
1:G_15:H1'         1:G_15:H3'          1.758  4.258  4.258 100.00 100.00 1000.000  0.00 
1:G_8:H1'          1:G_8:H4'           1.533  4.033  4.033 100.00 100.00 1000.000  0.00 
1:C_16:H5          1:C_16:H3'          2.454  4.954  4.954 100.00 100.00 1000.000  0.00 
1:C3'_17:H1'       1:C3'_17:H2'        1.037  3.537  3.537 100.00 100.00 1000.000  0.00 
1:A_9:H1'          1:A_9:H4'           1.109  3.609  3.609 100.00 100.00 1000.000  0.00 
1:C3'_17:H1'       1:C_16:H2'          2.582  5.082  5.082 100.00 100.00 1000.000  0.00 
1:G5'_1:H8         1:G5'_1:H3'         1.052  3.552  3.552 100.00 100.00 1000.000  0.00 
1:G_2:H8           1:G5'_1:H2'         0.926  3.426  3.426 100.00 100.00 1000.000  0.00 
1:G5'_1:H8         1:G5'_1:H2'         1.723  4.223  4.223 100.00 100.00 1000.000  0.00 
1:U_10:H6          1:U_10:H3'          1.422  3.922  3.922 100.00 100.00 1000.000  0.00 
1:A_9:H8           1:A_9:H3'           1.552  4.052  4.052 100.00 100.00 1000.000  0.00 
1:A_9:H8           1:A_9:H2'           0.985  3.485  3.485 100.00 100.00 1000.000  0.00 
1:A_14:H8          1:A_14:H3'          1.200  3.700  3.700 100.00 100.00 1000.000  0.00 
1:G_15:H8          1:A_14:H3'          1.572  4.072  4.072 100.00 100.00 1000.000  0.00 
1:G_2:H8           1:G_2:H3'           1.432  3.932  3.932 100.00 100.00 1000.000  0.00 
1:A_13:H8          1:A_13:H3'          1.563  4.063  4.063 100.00 100.00 1000.000  0.00 
1:C_3:H6           1:G_2:H2'           0.873  3.373  3.373 100.00 100.00 1000.000  0.00 
1:G_2:H8           1:G_2:H2'           1.252  3.752  3.752 100.00 100.00 1000.000  0.00 
1:U_5:H6           1:U_5:H3'           0.721  3.221  3.221 100.00 100.00 1000.000  0.00 
1:A_13:H8          1:A_12:H2'          0.937  3.437  3.437 100.00 100.00 1000.000  0.00 
1:A_14:H8          1:A_14:H2'          1.922  4.422  4.422 100.00 100.00 1000.000  0.00 
1:A_14:H2          1:G_15:H3'          2.558  5.058  5.058 100.00 100.00 1000.000  0.00 
1:G_15:H8          1:A_14:H2'          0.892  3.392  3.392 100.00 100.00 1000.000  0.00 
1:G_2:H8           1:G5'_1:H3'         1.950  4.450  4.450 100.00 100.00 1000.000  0.00 
1:U_4:H6           1:U_4:H3'           1.193  3.693  3.693 100.00 100.00 1000.000  0.00 
1:A_14:H8          1:A_13:H2'          0.885  3.385  3.385 100.00 100.00 1000.000  0.00 
1:A_13:H8          1:A_13:H2'          1.195  3.695  3.695 100.00 100.00 1000.000  0.00 
1:G_8:H8           1:G_8:H2'           1.187  3.687  3.687 100.00 100.00 1000.000  0.00 
1:A_12:H8          1:A_12:H3'          1.414  3.914  3.914 100.00 100.00 1000.000  0.00 
1:U_10:H6          1:U_10:H4'          3.069  5.569  5.569 100.00 100.00 1000.000  0.00 
1:U_5:H6           1:U_4:H2'           0.800  3.300  3.300 100.00 100.00 1000.000  0.00 
1:A_14:H2          1:U_4:H2'           2.867  5.367  5.367 100.00 100.00 1000.000  0.00 
1:U_4:H6           1:C_3:H2'           0.730  3.230  3.230 100.00 100.00 1000.000  0.00 
1:U_6:H6           1:U_6:H3'           1.125  3.625  3.625 100.00 100.00 1000.000  0.00 
1:U_10:H6          1:U_10:H2'          0.918  3.418  3.418 100.00 100.00 1000.000  0.00 
1:C_16:H6          1:C_16:H3'          1.183  3.683  3.683 100.00 100.00 1000.000  0.00 
1:G_15:H8          1:G_15:H2'          1.121  3.621  3.621 100.00 100.00 1000.000  0.00 
1:C_3:H6           1:G_2:H3'           1.868  4.368  4.368 100.00 100.00 1000.000  0.00 
1:U_6:H6           1:U_6:H2'           1.448  3.948  3.948 100.00 100.00 1000.000  0.00 
1:A_9:H8           1:G_7:H2'           1.919  4.419  4.419 100.00 100.00 1000.000  0.00 
1:G_7:H8           1:U_6:H2'           0.876  3.376  3.376 100.00 100.00 1000.000  0.00 
1:U_5:H6           1:U_5:H2'           1.667  4.167  4.167 100.00 100.00 1000.000  0.00 
1:C3'_17:H6        1:C_16:H2'          0.853  3.353  3.353 100.00 100.00 1000.000  0.00 
1:C_16:H6          1:C_16:H2'          2.576  5.076  5.076 100.00 100.00 1000.000  0.00 
1:C3'_17:H6        1:C3'_17:H3'        0.895  3.395  3.395 100.00 100.00 1000.000  0.00 
1:A_9:H8           1:G_8:H4'           1.725  4.225  4.225 100.00 100.00 1000.000  0.00 
1:C3'_17:H6        1:C3'_17:H2'        1.356  3.856  3.856 100.00 100.00 1000.000  0.00 
1:U_6:H6           1:U_5:H2'           0.864  3.364  3.364 100.00 100.00 1000.000  0.00 
1:G_7:H8           1:U_6:H3'           1.224  3.724  3.724 100.00 100.00 1000.000  0.00 
1:G_8:H8           1:G_7:H3'           2.281  4.781  4.781 100.00 100.00 1000.000  0.00 
1:C_3:H6           1:C_3:H2'           0.851  3.351  3.351 100.00 100.00 1000.000  0.00 
1:C_16:H6          1:G_15:H2'          0.757  3.257  3.257 100.00 100.00 1000.000  0.00 
1:G_7:H8           1:G_7:H3'           1.012  3.512  3.512 100.00 100.00 1000.000  0.00 
1:U_6:H1'          1:U_6:H4'           1.632  4.132  4.132 100.00 100.00 1000.000  0.00 
1:A_9:H8           1:G_8:H3'           1.230  3.730  3.730 100.00 100.00 1000.000  0.00 
1:G_8:H1'          1:G_8:H3'           1.609  4.109  4.109 100.00 100.00 1000.000  0.00 
1:G_8:H1'          1:G_7:H2'           3.681  6.181  6.181 100.00 100.00 1000.000  0.00 
1:A_14:H2          1:U_5:H2'           3.681  6.181  6.181 100.00 100.00 1000.000  0.00 
1:A_14:H2          1:G_15:H2'          3.225  5.725  5.725 100.00 100.00 1000.000  0.00 
1:A_11:H8          1:A_11:H2'          1.133  3.633  3.633 100.00 100.00 1000.000  0.00 
1:A_14:H1'         1:A_14:H4'          1.565  4.065  4.065 100.00 100.00 1000.000  0.00 
1:U_10:H5          1:U_10:H2'          2.367  4.867  4.867 100.00 100.00 1000.000  0.00 
1:G_2:H1'          1:G5'_1:H2'         2.724  5.224  5.224 100.00 100.00 1000.000  0.00 
1:A_13:H2          1:U_5:H2'           3.588  6.088  6.088 100.00 100.00 1000.000  0.00 
1:A_13:H2          1:U_6:H2'           4.114  6.614  6.614 100.00 100.00 1000.000  0.00 
1:A_13:H2          1:A_13:H2'          2.964  5.464  5.464 100.00 100.00 1000.000  0.00 
1:A_14:H8          1:A_13:H3'          1.477  3.977  3.977 100.00 100.00 1000.000  0.00 
1:U_4:H5           1:U_4:H3'           2.862  5.362  5.362 100.00 100.00 1000.000  0.00 
1:U_5:H5           1:U_4:H3'           2.081  4.581  4.581 100.00 100.00 1000.000  0.00 
1:U_10:H5          1:U_10:H3'          3.681  6.181  6.181 100.00 100.00 1000.000  0.00 
1:U_4:H5           1:U_5:H5            2.639  5.139  5.139 100.00 100.00 1000.000  0.00 
1:U_6:H5           1:U_5:H5            2.639  5.139  5.139 100.00 100.00 1000.000  0.00 
1:C_16:H5          1:C3'_17:H5         2.193  4.693  4.693 100.00 100.00 1000.000  0.00 
1:U_6:H6           1:U_5:H6            3.013  5.513  5.513 100.00 100.00 1000.000  0.00 
1:G_7:H1'          1:A_9:H8            2.831  5.831  5.831 100.00 100.00 1000.000  0.00 
1:A_12:H1'         1:A_12:H8           3.085  6.085  6.085 100.00 100.00 1000.000  0.00 
1:A_9:H1'          1:A_9:H2            3.193  6.193  6.193 100.00 100.00 1000.000  0.00 
1:A_9:H8           1:G_8:H8            3.561  6.561  6.561 100.00 100.00 1000.000  0.00 
1:G_2:H8           1:G5'_1:H8          3.160  6.160  6.160 100.00 100.00 1000.000  0.00 
1:A_13:H8          1:A_12:H8           3.248  6.248  6.248 100.00 100.00 1000.000  0.00 
1:A_9:H8           1:A_11:H8           3.859  6.859  6.859 100.00 100.00 1000.000  0.00 
1:C_3:H6           1:U_4:H6            4.083  7.083  7.083 100.00 100.00 1000.000  0.00 
1:A_14:H8          1:A_13:H2           2.769  5.769  5.769 100.00 100.00 1000.000  0.00 
1:A_12:H2          1:A_13:H8           3.723  6.723  6.723 100.00 100.00 1000.000  0.00 
1:G_15:H8          1:A_14:H8           2.680  5.680  5.680 100.00 100.00 1000.000  0.00 
1:A_13:H2          1:U_6:H6            3.253  6.253  6.253 100.00 100.00 1000.000  0.00 
1:G_15:H8          1:C_16:H6           2.894  5.894  5.894 100.00 100.00 1000.000  0.00 
1:A_14:H2          1:A_13:H2           3.092  6.092  6.092 100.00 100.00 1000.000  0.00 
1:C_3:H5           1:G_2:H1'           3.431  6.431  6.431 100.00 100.00 1000.000  0.00 
1:C_3:H1'          1:G_2:H1'           3.875  6.875  6.875 100.00 100.00 1000.000  0.00 
1:C_16:H1'         1:C3'_17:H1'        3.494  6.494  6.494 100.00 100.00 1000.000  0.00 
1:A_12:H1'         1:A_11:H1'          2.902  5.902  5.902 100.00 100.00 1000.000  0.00 
1:U_6:H5           1:U_6:H1'           3.903  6.903  6.903 100.00 100.00 1000.000  0.00 
1:C_16:H5          1:G_15:H1'          4.010  7.010  7.010 100.00 100.00 1000.000  0.00 
1:C_3:H5           1:C_3:H1'           3.525  6.525  6.525 100.00 100.00 1000.000  0.00 
1:C_3:H5           1:U_4:H5            3.627  6.627  6.627 100.00 100.00 1000.000  0.00 
1:G_15:H1'         1:A_14:H1'          4.384  7.384  7.384 100.00 100.00 1000.000  0.00 
1:A_9:H8           1:A_11:H1'          4.083  7.083  7.083 100.00 100.00 1000.000  0.00 
1:A_9:H2           1:A_12:H1'          5.000 99.000 99.000 100.00 100.00 1000.000  0.00 
1:A_9:H2           1:A_12:H2           5.000 99.000 99.000 100.00 100.00 1000.000  0.00 
1:A_11:H2          1:A_12:H2           5.000 99.000 99.000 100.00 100.00 1000.000  0.00 
1:A_11:H2          1:G_7:H1'           5.000 99.000 99.000 100.00 100.00 1000.000  0.00 
1:G_7:H8           1:A_12:H2           5.000 99.000 99.000 100.00 100.00 1000.000  0.00 
!
#mixing_times
-9.990000E+02 
!
#NMR_dihedral
1:G5'_1:O4'        1:G5'_1:C1'        1:G5'_1:N9         1:G5'_1:C4         150.000 -70.000 100.00 100.00 1000.000 !anti
1:G_2:O4'          1:G_2:C1'          1:G_2:N9           1:G_2:C4           150.000 -70.000 100.00 100.00 1000.000 !anti
1:C_3:O4'          1:C_3:C1'          1:C_3:N1           1:C_3:C2           150.000 -70.000 100.00 100.00 1000.000 !anti
1:U_4:O4'          1:U_4:C1'          1:U_4:N1           1:U_4:C2           150.000 -70.000 100.00 100.00 1000.000 !anti
1:U_5:O4'          1:U_5:C1'          1:U_5:N1           1:U_5:C2           150.000 -70.000 100.00 100.00 1000.000 !anti
1:U_6:O4'          1:U_6:C1'          1:U_6:N1           1:U_6:C2           150.000 -70.000 100.00 100.00 1000.000 !anti
1:G_7:O4'          1:G_7:C1'          1:G_7:N9           1:G_7:C4           150.000 -70.000 100.00 100.00 1000.000 !anti
1:A_11:O4'         1:A_11:C1'         1:A_11:N9          1:A_11:C4          150.000 -70.000 100.00 100.00 1000.000 !anti
1:A_12:O4'         1:A_12:C1'         1:A_12:N9          1:A_12:C4          150.000 -70.000 100.00 100.00 1000.000 !anti
1:A_13:O4'         1:A_13:C1'         1:A_13:N9          1:A_13:C4          150.000 -70.000 100.00 100.00 1000.000 !anti
1:A_14:O4'         1:A_14:C1'         1:A_14:N9          1:A_14:C4          150.000 -70.000 100.00 100.00 1000.000 !anti
1:G_15:O4'         1:G_15:C1'         1:G_15:N9          1:G_15:C4          150.000 -70.000 100.00 100.00 1000.000 !anti
1:C_16:O4'         1:C_16:C1'         1:C_16:N1          1:C_16:C2          150.000 -70.000 100.00 100.00 1000.000 !anti
1:C3'_17:O4'       1:C3'_17:C1'       1:C3'_17:N1        1:C3'_17:C2        150.000 -70.000 100.00 100.00 1000.000 !anti
1:G_2:C4'          1:G_2:O4'          1:G_2:C1'          1:G_2:C2'          -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:G_2:C1'          1:G_2:C2'          1:G_2:C3'          1:G_2:C4'          30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:G_2:C5'          1:G_2:C4'          1:G_2:C3'          1:G_2:O3'          73.450 93.450 100.00 100.00 1000.000 !C3'-endo
1:C_3:C4'          1:C_3:O4'          1:C_3:C1'          1:C_3:C2'          -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:C_3:C1'          1:C_3:C2'          1:C_3:C3'          1:C_3:C4'          30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:C_3:C5'          1:C_3:C4'          1:C_3:C3'          1:C_3:O3'          73.450 93.450 100.00 100.00 1000.000 !C3'-endo
1:U_4:C4'          1:U_4:O4'          1:U_4:C1'          1:U_4:C2'          -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:U_4:C1'          1:U_4:C2'          1:U_4:C3'          1:U_4:C4'          30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:U_4:C5'          1:U_4:C4'          1:U_4:C3'          1:U_4:O3'          73.450 93.450 100.00 100.00 1000.000 !C3'-endo
1:U_5:C4'          1:U_5:O4'          1:U_5:C1'          1:U_5:C2'          -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:U_5:C1'          1:U_5:C2'          1:U_5:C3'          1:U_5:C4'          30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:U_5:C5'          1:U_5:C4'          1:U_5:C3'          1:U_5:O3'          73.450 93.450 100.00 100.00 1000.000 !C3'-endo
1:U_6:C4'          1:U_6:O4'          1:U_6:C1'          1:U_6:C2'          -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:U_6:C1'          1:U_6:C2'          1:U_6:C3'          1:U_6:C4'          30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:U_6:C5'          1:U_6:C4'          1:U_6:C3'          1:U_6:O3'          53.450 113.450 100.00 100.00 1000.000 !C3'-endo
1:G_7:C4'          1:G_7:O4'          1:G_7:C1'          1:G_7:C2'          -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:G_7:C1'          1:G_7:C2'          1:G_7:C3'          1:G_7:C4'          30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:G_7:C5'          1:G_7:C4'          1:G_7:C3'          1:G_7:O3'          73.450 93.450 100.00 100.00 1000.000 !C3'-endo
1:A_11:C4'         1:A_11:O4'         1:A_11:C1'         1:A_11:C2'         -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:A_11:C1'         1:A_11:C2'         1:A_11:C3'         1:A_11:C4'         30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:A_11:C5'         1:A_11:C4'         1:A_11:C3'         1:A_11:O3'         73.450 93.450 100.00 100.00 1000.000 !C3'-endo
1:A_12:C4'         1:A_12:O4'         1:A_12:C1'         1:A_12:C2'         -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:A_12:C1'         1:A_12:C2'         1:A_12:C3'         1:A_12:C4'         30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:A_12:C5'         1:A_12:C4'         1:A_12:C3'         1:A_12:O3'         73.450 93.450 100.00 100.00 1000.000 !C3'-endo
1:A_13:C4'         1:A_13:O4'         1:A_13:C1'         1:A_13:C2'         -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:A_13:C1'         1:A_13:C2'         1:A_13:C3'         1:A_13:C4'         30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:A_13:C5'         1:A_13:C4'         1:A_13:C3'         1:A_13:O3'         53.450 113.450 100.00 100.00 1000.000 !C3'-endo
1:A_14:C4'         1:A_14:O4'         1:A_14:C1'         1:A_14:C2'         -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:A_14:C1'         1:A_14:C2'         1:A_14:C3'         1:A_14:C4'         30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:A_14:C5'         1:A_14:C4'         1:A_14:C3'         1:A_14:O3'         73.450 93.450 100.00 100.00 1000.000 !C3'-endo
1:G_15:C4'         1:G_15:O4'         1:G_15:C1'         1:G_15:C2'         -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:G_15:C1'         1:G_15:C2'         1:G_15:C3'         1:G_15:C4'         30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:G_15:C5'         1:G_15:C4'         1:G_15:C3'         1:G_15:O3'         73.450 93.450 100.00 100.00 1000.000 !C3'-endo
1:C_16:C4'         1:C_16:O4'         1:C_16:C1'         1:C_16:C2'         -20.000 20.000 100.00 100.00 1000.000 !C3'-endo
1:C_16:C1'         1:C_16:C2'         1:C_16:C3'         1:C_16:C4'         30.000 50.000 100.00 100.00 1000.000 !C3'-endo
1:C_16:C5'         1:C_16:C4'         1:C_16:C3'         1:C_16:O3'         73.450 93.450 100.00 100.00 1000.000 !C3'-endo
1:G_2:C4'          1:G_2:C3'          1:G_2:O3'          1:C_3:P            178.300 -121.700 100.00 100.00 1000.000 !epsilon trans
1:G_2:C3'          1:G_2:O3'          1:C_3:P            1:C_3:O5'          -103.620 -43.620 100.00 100.00 1000.000 !zeta not trans
1:G_2:O3'          1:C_3:P            1:C_3:O5'          1:C_3:C5'          -92.080 -32.080 100.00 100.00 1000.000 !alpha not trans
1:C_3:P            1:C_3:O5'          1:C_3:C5'          1:C_3:C4'          150.130 -149.870 100.00 100.00 1000.000 !bata trans
1:C_3:O5'          1:C_3:C5'          1:C_3:C4'          1:C_3:C3'          17.430 77.430 100.00 100.00 1000.000 !gamma gauche+
1:C_3:C4'          1:C_3:C3'          1:C_3:O3'          1:U_4:P            178.300 -121.700 100.00 100.00 1000.000 !epsilon trans
1:C_3:C3'          1:C_3:O3'          1:U_4:P            1:U_4:O5'          -103.620 -43.620 100.00 100.00 1000.000 !zeta not trans
1:C_3:O3'          1:U_4:P            1:U_4:O5'          1:U_4:C5'          -92.080 -32.080 100.00 100.00 1000.000 !alpha not trans
1:U_4:P            1:U_4:O5'          1:U_4:C5'          1:U_4:C4'          150.130 -149.870 100.00 100.00 1000.000 !bata trans
1:U_4:O5'          1:U_4:C5'          1:U_4:C4'          1:U_4:C3'          17.430 77.430 100.00 100.00 1000.000 !gamma gauche+
1:U_4:C4'          1:U_4:C3'          1:U_4:O3'          1:U_5:P            178.300 -121.700 100.00 100.00 1000.000 !epsilon trans
1:U_4:C3'          1:U_4:O3'          1:U_5:P            1:U_5:O5'          -103.620 -43.620 100.00 100.00 1000.000 !zeta not trans
1:U_4:O3'          1:U_5:P            1:U_5:O5'          1:U_5:C5'          -92.080 -32.080 100.00 100.00 1000.000 !alpha not trans
1:U_5:P            1:U_5:O5'          1:U_5:C5'          1:U_5:C4'          150.130 -149.870 100.00 100.00 1000.000 !bata trans
1:U_5:O5'          1:U_5:C5'          1:U_5:C4'          1:U_5:C3'          17.430 77.430 100.00 100.00 1000.000 !gamma gauche+
1:A_13:C4'         1:A_13:C3'         1:A_13:O3'         1:A_14:P           178.300 -121.700 100.00 100.00 1000.000 !epsilon trans
1:A_13:C3'         1:A_13:O3'         1:A_14:P           1:A_14:O5'         -103.620 -43.620 100.00 100.00 1000.000 !zeta not trans
1:A_13:O3'         1:A_14:P           1:A_14:O5'         1:A_14:C5'         -92.080 -32.080 100.00 100.00 1000.000 !alpha not trans
1:A_14:P           1:A_14:O5'         1:A_14:C5'         1:A_14:C4'         150.130 -149.870 100.00 100.00 1000.000 !bata trans
1:A_14:O5'         1:A_14:C5'         1:A_14:C4'         1:A_14:C3'         17.430 77.430 100.00 100.00 1000.000 !gamma gauche+
1:A_14:C4'         1:A_14:C3'         1:A_14:O3'         1:G_15:P           178.300 -121.700 100.00 100.00 1000.000 !epsilon trans
1:A_14:C3'         1:A_14:O3'         1:G_15:P           1:G_15:O5'         -103.620 -43.620 100.00 100.00 1000.000 !zeta not trans
1:A_14:O3'         1:G_15:P           1:G_15:O5'         1:G_15:C5'         -92.080 -32.080 100.00 100.00 1000.000 !alpha not trans
1:G_15:P           1:G_15:O5'         1:G_15:C5'         1:G_15:C4'         150.130 -149.870 100.00 100.00 1000.000 !bata trans
1:G_15:O5'         1:G_15:C5'         1:G_15:C4'         1:G_15:C3'         17.430 77.430 100.00 100.00 1000.000 !gamma gauche+
1:G_15:C4'         1:G_15:C3'         1:G_15:O3'         1:C_16:P           178.300 -121.700 100.00 100.00 1000.000 !epsilon trans
1:G_15:C3'         1:G_15:O3'         1:C_16:P           1:C_16:O5'         -103.620 -43.620 100.00 100.00 1000.000 !zeta not trans
1:G_15:O3'         1:C_16:P           1:C_16:O5'         1:C_16:C5'         -92.080 -32.080 100.00 100.00 1000.000 !alpha not trans
1:C_16:P           1:C_16:O5'         1:C_16:C5'         1:C_16:C4'         150.130 -149.870 100.00 100.00 1000.000 !bata trans
1:C_16:O5'         1:C_16:C5'         1:C_16:C4'         1:C_16:C3'         17.430 77.430 100.00 100.00 1000.000 !gamma gauche+

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          1H5*        G   1  -5.117 -13.375   2.328
    2   2H5*    G   1          2H5*        G   1  -4.795 -12.105   3.526
    3    H4*    G   1           H4*        G   1  -7.515 -12.612   2.198
    4    H3*    G   1           H3*        G   1  -5.383 -10.496   1.711
    5    H2*    G   1           H2*        G   1  -7.159  -9.114   0.910
    6   2HO*    G   1          2HO*        G   1  -9.122  -9.889   0.319
    7    H1*    G   1           H1*        G   1  -8.985 -10.172   2.858
    8    H8     G   1           H8         G   1  -5.837  -8.915   4.548
    9    H1     G   1           H1         G   1 -10.108  -4.286   3.141
   10   1H2     G   1          1H2         G   1 -11.545  -6.738   1.093
   11   2H2     G   1          2H2         G   1 -11.601  -5.080   1.658
   12    H5T    G   1           H5T        G   1  -5.280 -14.131   4.472
   13   1H5*    G   2          1H5*        G   2  -8.065 -10.988  -1.916
   14   2H5*    G   2          2H5*        G   2  -7.119 -10.589  -3.355
   15    H4*    G   2           H4*        G   2  -9.186  -9.219  -3.158
   16    H3*    G   2           H3*        G   2  -6.563  -7.707  -2.865
   17    H2*    G   2           H2*        G   2  -7.860  -5.733  -3.003
   18   2HO*    G   2          2HO*        G   2  -9.979  -5.702  -3.712
   19    H1*    G   2           H1*        G   2 -10.027  -6.798  -1.548
   20    H8     G   2           H8         G   2  -6.722  -7.314   0.222
   21    H1     G   2           H1         G   2  -9.141  -1.380   0.912
   22   1H2     G   2          1H2         G   2 -11.246  -2.320  -1.729
   23   2H2     G   2          2H2         G   2 -10.727  -1.043  -0.645
   24   1H5*    C   3          1H5*        C   3  -8.849  -5.760  -6.201
   25   2H5*    C   3          2H5*        C   3  -7.651  -5.166  -7.358
   26    H4*    C   3           H4*        C   3  -9.062  -3.334  -6.442
   27    H3*    C   3           H3*        C   3  -6.124  -3.289  -5.657
   28    H2*    C   3           H2*        C   3  -6.508  -1.174  -4.729
   29   2HO*    C   3          2HO*        C   3  -7.733  -0.330  -6.491
   30    H1*    C   3           H1*        C   3  -9.117  -1.815  -3.792
   31   1H4     C   3          1H4         C   3  -4.018  -2.879   0.486
   32   2H4     C   3          2H4         C   3  -4.758  -1.346   0.920
   33    H5     C   3           H5         C   3  -4.754  -4.165  -1.547
   34    H6     C   3           H6         C   3  -6.370  -4.223  -3.319
   35   1H5*    U   4          1H5*        U   4  -7.218   0.709  -8.023
   36   2H5*    U   4          2H5*        U   4  -5.719   1.098  -8.873
   37    H4*    U   4           H4*        U   4  -6.600   2.959  -7.456
   38    H3*    U   4           H3*        U   4  -3.871   1.840  -6.720
   39    H2*    U   4           H2*        U   4  -3.705   3.845  -5.304
   40   2HO*    U   4          2HO*        U   4  -5.333   5.379  -5.302
   41    H1*    U   4           H1*        U   4  -6.166   3.456  -4.247
   42    H3     U   4           H3         U   4  -3.268   2.275  -0.940
   43    H5     U   4           H5         U   4  -3.684  -1.186  -3.311
   44    H6     U   4           H6         U   4  -4.818   0.141  -4.958
   45   1H5*    U   5          1H5*        U   5  -3.523   6.164  -7.233
   46   2H5*    U   5          2H5*        U   5  -1.983   6.541  -8.012
   47    H4*    U   5           H4*        U   5  -2.254   7.740  -5.899
   48    H3*    U   5           H3*        U   5  -0.073   5.607  -5.838
   49    H2*    U   5           H2*        U   5   0.617   6.801  -3.775
   50   2HO*    U   5          2HO*        U   5  -0.065   8.899  -4.678
   51    H1*    U   5           H1*        U   5  -1.876   6.748  -2.791
   52    H3     U   5           H3         U   5   0.211   3.470  -0.448
   53    H5     U   5           H5         U   5  -1.065   1.616  -4.020
   54    H6     U   5           H6         U   5  -1.668   3.756  -4.867
   55   1H5*    U   6          1H5*        U   6   1.892   9.275  -4.544
   56   2H5*    U   6          2H5*        U   6   3.473   9.353  -5.338
   57    H4*    U   6           H4*        U   6   3.684   9.428  -2.881
   58    H3*    U   6           H3*        U   6   4.721   6.883  -4.190
   59    H2*    U   6           H2*        U   6   5.714   6.407  -2.084
   60   2HO*    U   6          2HO*        U   6   5.704   7.908  -0.379
   61    H1*    U   6           H1*        U   6   3.434   7.244  -0.637
   62    H3     U   6           H3         U   6   4.434   2.704  -0.208
   63    H5     U   6           H5         U   6   1.941   3.057  -3.594
   64    H6     U   6           H6         U   6   2.112   5.441  -3.418
   65   1H5*    G   7          1H5*        G   7   8.112   7.825  -1.985
   66   2H5*    G   7          2H5*        G   7   9.545   7.595  -3.005
   67    H4*    G   7           H4*        G   7   9.573   6.079  -1.068
   68    H3*    G   7           H3*        G   7   9.162   4.714  -3.755
   69    H2*    G   7           H2*        G   7   9.432   2.620  -2.550
   70   2HO*    G   7          2HO*        G   7  11.124   3.339  -1.172
   71    H1*    G   7           H1*        G   7   7.753   3.356  -0.510
   72    H8     G   7           H8         G   7   6.230   4.829  -3.654
   73    H1     G   7           H1         G   7   5.432  -1.547  -3.188
   74   1H2     G   7          1H2         G   7   6.797  -2.367  -1.588
   75   2H2     G   7          2H2         G   7   7.770  -1.308  -0.594
   76   1H5*    G   8          1H5*        G   8  13.137   1.531  -4.481
   77   2H5*    G   8          2H5*        G   8  11.571   1.725  -5.289
   78    H4*    G   8           H4*        G   8  12.083   0.243  -2.694
   79    H3*    G   8           H3*        G   8  12.735  -0.781  -4.980
   80    H2*    G   8           H2*        G   8  10.800  -0.226  -6.262
   81   2HO*    G   8          2HO*        G   8  10.095  -2.762  -5.209
   82    H1*    G   8           H1*        G   8   8.867  -1.005  -4.063
   83    H8     G   8           H8         G   8   9.358   2.558  -4.916
   84    H1     G   8           H1         G   8   4.551  -0.241  -8.158
   85   1H2     G   8          1H2         G   8   4.600  -2.465  -7.763
   86   2H2     G   8          2H2         G   8   5.835  -3.184  -6.746
   87   1H5*    A   9          1H5*        A   9  12.595  -6.142  -3.373
   88   2H5*    A   9          2H5*        A   9  10.922  -6.474  -3.795
   89    H4*    A   9           H4*        A   9  11.189  -6.314  -1.371
   90    H3*    A   9           H3*        A   9   9.585  -4.058  -2.614
   91    H2*    A   9           H2*        A   9   9.073  -3.363  -0.436
   92   2HO*    A   9          2HO*        A   9   8.323  -5.449   0.252
   93    H1*    A   9           H1*        A   9  11.525  -4.550   0.649
   94    H8     A   9           H8         A   9  10.831  -1.457  -1.757
   95   1H6     A   9          1H6         A   9  13.532   1.843   2.731
   96   2H6     A   9          2H6         A   9  12.737   1.915   1.169
   97    H2     A   9           H2         A   9  13.446  -2.402   4.077
   98   1H5*    U  10          1H5*        U  10   7.339  -8.467  -2.189
   99   2H5*    U  10          2H5*        U  10   5.652  -8.045  -2.541
  100    H4*    U  10           H4*        U  10   5.147  -8.586  -0.061
  101    H3*    U  10           H3*        U  10   7.853  -9.962  -0.397
  102    H2*    U  10           H2*        U  10   7.015 -11.641   1.093
  103   2HO*    U  10          2HO*        U  10   6.081 -10.234   2.620
  104    H1*    U  10           H1*        U  10   4.385 -11.473  -0.032
  105    H3     U  10           H3         U  10   5.648 -15.798  -1.001
  106    H5     U  10           H5         U  10   8.345 -13.443  -3.230
  107    H6     U  10           H6         U  10   7.392 -11.474  -2.224
  108   1H5*    A  11          1H5*        A  11   7.782  -7.717   4.672
  109   2H5*    A  11          2H5*        A  11   7.290  -6.748   3.266
  110    H4*    A  11           H4*        A  11   9.712  -6.195   5.067
  111    H3*    A  11           H3*        A  11   6.998  -4.849   4.750
  112    H2*    A  11           H2*        A  11   8.021  -2.854   5.388
  113   2HO*    A  11          2HO*        A  11  10.050  -2.764   6.424
  114    H1*    A  11           H1*        A  11  10.561  -3.569   4.204
  115    H8     A  11           H8         A  11   7.589  -3.593   1.843
  116   1H6     A  11          1H6         A  11   9.010   2.365   0.809
  117   2H6     A  11          2H6         A  11   8.130   0.987   0.180
  118    H2     A  11           H2         A  11  10.953   1.137   4.614
  119   1H5*    A  12          1H5*        A  12   5.583  -2.409   8.908
  120   2H5*    A  12          2H5*        A  12   5.295  -2.371   7.164
  121    H4*    A  12           H4*        A  12   7.443  -0.831   8.689
  122    H3*    A  12           H3*        A  12   4.851  -0.135   7.279
  123    H2*    A  12           H2*        A  12   5.770   1.947   6.503
  124   2HO*    A  12          2HO*        A  12   7.969   1.350   8.205
  125    H1*    A  12           H1*        A  12   8.104   0.864   5.613
  126    H8     A  12           H8         A  12   5.840  -2.049   4.998
  127   1H6     A  12          1H6         A  12   4.269   0.748  -0.294
  128   2H6     A  12          2H6         A  12   4.244  -0.753   0.608
  129    H2     A  12           H2         A  12   6.318   3.777   2.275
  130   1H5*    A  13          1H5*        A  13   5.650   3.664   8.875
  131   2H5*    A  13          2H5*        A  13   4.218   4.192   9.779
  132    H4*    A  13           H4*        A  13   4.683   5.796   8.010
  133    H3*    A  13           H3*        A  13   2.261   4.039   7.436
  134    H2*    A  13           H2*        A  13   1.802   5.490   5.642
  135   2HO*    A  13          2HO*        A  13   2.902   7.446   5.340
  136    H1*    A  13           H1*        A  13   4.471   5.673   4.819
  137    H8     A  13           H8         A  13   3.480   2.171   5.863
  138   1H6     A  13          1H6         A  13   0.946   1.548   0.219
  139   2H6     A  13          2H6         A  13   1.545   0.674   1.616
  140    H2     A  13           H2         A  13   1.737   5.877   0.925
  141   1H5*    A  14          1H5*        A  14   0.885   8.176   7.264
  142   2H5*    A  14          2H5*        A  14  -0.765   8.290   7.896
  143    H4*    A  14           H4*        A  14  -0.499   9.090   5.526
  144    H3*    A  14           H3*        A  14  -2.315   6.693   5.981
  145    H2*    A  14           H2*        A  14  -3.001   7.006   3.675
  146   2HO*    A  14          2HO*        A  14  -2.279   8.775   2.480
  147    H1*    A  14           H1*        A  14  -0.408   7.399   2.797
  148    H8     A  14           H8         A  14  -0.023   4.485   5.139
  149   1H6     A  14          1H6         A  14  -2.371   1.107   0.485
  150   2H6     A  14          2H6         A  14  -1.426   1.050   1.959
  151    H2     A  14           H2         A  14  -3.459   5.417  -0.178
  152   1H5*    G  15          1H5*        G  15  -4.549   9.644   3.469
  153   2H5*    G  15          2H5*        G  15  -6.179   9.698   4.135
  154    H4*    G  15           H4*        G  15  -6.323   9.235   1.768
  155    H3*    G  15           H3*        G  15  -6.844   6.745   3.426
  156    H2*    G  15           H2*        G  15  -7.842   5.869   1.528
  157   2HO*    G  15          2HO*        G  15  -8.043   7.082  -0.410
  158    H1*    G  15           H1*        G  15  -5.690   6.646  -0.044
  159    H8     G  15           H8         G  15  -4.706   5.533   3.416
  160    H1     G  15           H1         G  15  -6.438   0.653  -0.422
  161   1H2     G  15          1H2         G  15  -7.781   3.223  -2.398
  162   2H2     G  15          2H2         G  15  -7.582   1.497  -2.179
  163   1H5*    C  16          1H5*        C  16 -10.393   7.555   1.052
  164   2H5*    C  16          2H5*        C  16 -11.873   7.215   1.957
  165    H4*    C  16           H4*        C  16 -11.689   5.959  -0.194
  166    H3*    C  16           H3*        C  16 -11.721   4.290   2.347
  167    H2*    C  16           H2*        C  16 -12.093   2.401   0.831
  168   2HO*    C  16          2HO*        C  16 -13.397   3.808  -0.640
  169    H1*    C  16           H1*        C  16 -10.044   3.242  -0.861
  170   1H4     C  16          1H4         C  16  -7.032   0.427   4.374
  171   2H4     C  16          2H4         C  16  -7.468  -0.887   3.296
  172    H5     C  16           H5         C  16  -7.789   2.755   3.985
  173    H6     C  16           H6         C  16  -8.974   4.189   2.474
  174   1H5*    C  17          1H5*        C  17 -15.030   2.799  -0.221
  175   2H5*    C  17          2H5*        C  17 -16.426   2.516   0.829
  176    H4*    C  17           H4*        C  17 -15.829   0.502  -0.459
  177    H3*    C  17           H3*        C  17 -15.335   0.273   2.551
  178    H2*    C  17           H2*        C  17 -15.065  -2.080   2.136
  179   2HO*    C  17          2HO*        C  17 -16.803  -2.198   0.588
  180    H1*    C  17           H1*        C  17 -13.532  -1.607  -0.193
  181   1H4     C  17          1H4         C  17  -9.488  -1.034   5.101
  182   2H4     C  17          2H4         C  17  -9.396  -2.704   4.580
  183    H5     C  17           H5         C  17 -11.087   0.579   4.106
  184    H6     C  17           H6         C  17 -12.787   0.859   2.431
  185    H3T    C  17           H3T        C  17 -17.480   0.770   1.909
  Start of MODEL    2
    1   1H5*    G   1          1H5*        G   1  -4.117 -12.762  -0.899
    2   2H5*    G   1          2H5*        G   1  -4.272 -11.812   0.592
    3    H4*    G   1           H4*        G   1  -6.626 -12.789  -1.110
    4    H3*    G   1           H3*        G   1  -5.223 -10.099  -0.944
    5    H2*    G   1           H2*        G   1  -7.363  -9.099  -1.525
    6   2HO*    G   1          2HO*        G   1  -8.249 -11.770  -1.955
    7    H1*    G   1           H1*        G   1  -8.751 -10.649   0.267
    8    H8     G   1           H8         G   1  -5.438  -9.809   1.928
    9    H1     G   1           H1         G   1  -9.847  -5.109   2.235
   10   1H2     G   1          1H2         G   1 -11.466  -6.958  -0.261
   11   2H2     G   1          2H2         G   1 -11.474  -5.517   0.736
   12    H5T    G   1           H5T        G   1  -5.357 -14.394   0.115
   13   1H5*    G   2          1H5*        G   2  -7.817 -10.114  -4.527
   14   2H5*    G   2          2H5*        G   2  -6.977  -9.270  -5.836
   15    H4*    G   2           H4*        G   2  -9.190  -8.264  -5.349
   16    H3*    G   2           H3*        G   2  -6.744  -6.569  -4.721
   17    H2*    G   2           H2*        G   2  -8.215  -4.780  -4.275
   18   2HO*    G   2          2HO*        G   2 -10.218  -6.341  -5.567
   19    H1*    G   2           H1*        G   2 -10.168  -6.312  -3.026
   20    H8     G   2           H8         G   2  -6.716  -7.200  -1.790
   21    H1     G   2           H1         G   2  -9.044  -1.768   0.775
   22   1H2     G   2          1H2         G   2 -11.372  -1.966  -1.838
   23   2H2     G   2          2H2         G   2 -10.751  -1.033  -0.489
   24   1H5*    C   3          1H5*        C   3  -9.283  -3.968  -7.248
   25   2H5*    C   3          2H5*        C   3  -8.185  -3.049  -8.289
   26    H4*    C   3           H4*        C   3  -9.523  -1.559  -6.820
   27    H3*    C   3           H3*        C   3  -6.542  -1.685  -6.234
   28    H2*    C   3           H2*        C   3  -6.847   0.068  -4.732
   29   2HO*    C   3          2HO*        C   3  -8.724   1.337  -4.657
   30    H1*    C   3           H1*        C   3  -9.395  -0.841  -3.838
   31   1H4     C   3          1H4         C   3  -3.992  -2.973  -0.418
   32   2H4     C   3          2H4         C   3  -4.674  -1.621   0.472
   33    H5     C   3           H5         C   3  -4.911  -3.680  -2.645
   34    H6     C   3           H6         C   3  -6.656  -3.259  -4.245
   35   1H5*    U   4          1H5*        U   4  -7.852   2.638  -7.079
   36   2H5*    U   4          2H5*        U   4  -6.557   3.383  -8.027
   37    H4*    U   4           H4*        U   4  -7.170   4.746  -6.071
   38    H3*    U   4           H3*        U   4  -4.381   3.534  -5.974
   39    H2*    U   4           H2*        U   4  -4.027   5.083  -4.103
   40   2HO*    U   4          2HO*        U   4  -5.616   6.541  -3.511
   41    H1*    U   4           H1*        U   4  -6.365   4.400  -2.922
   42    H3     U   4           H3         U   4  -3.207   2.398  -0.346
   43    H5     U   4           H5         U   4  -3.906  -0.307  -3.504
   44    H6     U   4           H6         U   4  -5.154   1.407  -4.628
   45   1H5*    U   5          1H5*        U   5  -3.990   7.843  -5.366
   46   2H5*    U   5          2H5*        U   5  -2.550   8.409  -6.222
   47    H4*    U   5           H4*        U   5  -2.476   9.020  -3.870
   48    H3*    U   5           H3*        U   5  -0.439   6.884  -4.632
   49    H2*    U   5           H2*        U   5   0.568   7.430  -2.465
   50   2HO*    U   5          2HO*        U   5  -1.361   9.487  -2.275
   51    H1*    U   5           H1*        U   5  -1.807   7.293  -1.187
   52    H3     U   5           H3         U   5   0.272   3.468   0.093
   53    H5     U   5           H5         U   5  -1.353   2.582  -3.702
   54    H6     U   5           H6         U   5  -1.953   4.879  -3.934
   55   1H5*    U   6          1H5*        U   6   1.848  10.064  -2.767
   56   2H5*    U   6          2H5*        U   6   3.359  10.282  -3.665
   57    H4*    U   6           H4*        U   6   3.775   9.771  -1.294
   58    H3*    U   6           H3*        U   6   4.580   7.541  -3.208
   59    H2*    U   6           H2*        U   6   5.722   6.628  -1.315
   60   2HO*    U   6          2HO*        U   6   6.477   8.728  -0.557
   61    H1*    U   6           H1*        U   6   3.595   7.222   0.451
   62    H3     U   6           H3         U   6   4.505   2.663  -0.065
   63    H5     U   6           H5         U   6   1.793   3.676  -3.132
   64    H6     U   6           H6         U   6   2.006   5.979  -2.503
   65   1H5*    G   7          1H5*        G   7   8.291   7.824  -1.214
   66   2H5*    G   7          2H5*        G   7   9.567   7.622  -2.429
   67    H4*    G   7           H4*        G   7   9.536   5.795  -0.758
   68    H3*    G   7           H3*        G   7   8.819   4.957  -3.591
   69    H2*    G   7           H2*        G   7   8.906   2.646  -2.706
   70   2HO*    G   7          2HO*        G   7  10.702   3.020  -1.298
   71    H1*    G   7           H1*        G   7   7.328   3.231  -0.587
   72    H8     G   7           H8         G   7   6.009   5.480  -3.340
   73    H1     G   7           H1         G   7   4.601  -0.729  -4.294
   74   1H2     G   7          1H2         G   7   5.720  -1.994  -2.803
   75   2H2     G   7          2H2         G   7   6.794  -1.285  -1.616
   76   1H5*    G   8          1H5*        G   8  11.754   1.262  -5.221
   77   2H5*    G   8          2H5*        G   8  10.693   2.386  -6.091
   78    H4*    G   8           H4*        G   8   9.684   0.453  -3.966
   79    H3*    G   8           H3*        G   8  10.584  -0.514  -6.328
   80    H2*    G   8           H2*        G   8   9.396   1.248  -7.608
   81   2HO*    G   8          2HO*        G   8   8.923  -0.902  -8.466
   82    H1*    G   8           H1*        G   8   6.992   0.428  -5.896
   83    H8     G   8           H8         G   8   7.918   3.989  -6.086
   84    H1     G   8           H1         G   8   3.057   2.418 -10.019
   85   1H2     G   8          1H2         G   8   2.889   0.167 -10.113
   86   2H2     G   8          2H2         G   8   3.997  -0.868  -9.231
   87   1H5*    A   9          1H5*        A   9  10.011  -5.416  -5.413
   88   2H5*    A   9          2H5*        A   9   8.251  -5.552  -5.604
   89    H4*    A   9           H4*        A   9   9.019  -6.824  -3.665
   90    H3*    A   9           H3*        A   9   6.876  -5.057  -3.637
   91    H2*    A   9           H2*        A   9   7.793  -3.278  -2.663
   92   2HO*    A   9          2HO*        A   9   6.317  -4.155  -1.053
   93    H1*    A   9           H1*        A   9   9.617  -4.835  -0.817
   94    H8     A   9           H8         A   9   9.155  -1.719  -3.073
   95   1H6     A   9          1H6         A   9  14.497   0.282  -0.653
   96   2H6     A   9          2H6         A   9  13.078   0.740  -1.576
   97    H2     A   9           H2         A   9  14.039  -4.007   0.463
   98   1H5*    U  10          1H5*        U  10   4.977  -5.857   0.891
   99   2H5*    U  10          2H5*        U  10   6.710  -6.242   0.871
  100    H4*    U  10           H4*        U  10   5.535  -6.967   2.961
  101    H3*    U  10           H3*        U  10   6.666  -9.186   1.209
  102    H2*    U  10           H2*        U  10   6.117 -10.688   2.987
  103   2HO*    U  10          2HO*        U  10   6.923  -9.354   4.678
  104    H1*    U  10           H1*        U  10   3.701  -9.309   3.634
  105    H3     U  10           H3         U  10   2.187 -13.428   2.239
  106    H5     U  10           H5         U  10   3.933 -11.777  -1.228
  107    H6     U  10           H6         U  10   4.651  -9.893   0.080
  108   1H5*    A  11          1H5*        A  11   9.795  -6.605   1.958
  109   2H5*    A  11          2H5*        A  11  11.235  -7.594   1.659
  110    H4*    A  11           H4*        A  11  12.397  -6.530   3.551
  111    H3*    A  11           H3*        A  11   9.716  -5.169   3.991
  112    H2*    A  11           H2*        A  11  10.934  -3.192   4.737
  113   2HO*    A  11          2HO*        A  11  12.508  -4.445   5.932
  114    H1*    A  11           H1*        A  11  12.790  -3.288   2.724
  115    H8     A  11           H8         A  11   9.145  -4.320   1.782
  116   1H6     A  11          1H6         A  11   7.855  -0.034  -0.197
  117   2H6     A  11          2H6         A  11   8.672   1.517  -0.272
  118    H2     A  11           H2         A  11  12.499   1.182   1.945
  119   1H5*    A  12          1H5*        A  12   9.295  -3.103   8.511
  120   2H5*    A  12          2H5*        A  12   8.071  -3.630   7.340
  121    H4*    A  12           H4*        A  12  10.152  -1.462   6.769
  122    H3*    A  12           H3*        A  12   7.173  -1.375   7.455
  123    H2*    A  12           H2*        A  12   7.017   0.547   6.080
  124   2HO*    A  12          2HO*        A  12   9.814   0.816   6.467
  125    H1*    A  12           H1*        A  12   9.197  -0.309   4.368
  126    H8     A  12           H8         A  12   6.725  -2.964   3.917
  127   1H6     A  12          1H6         A  12   4.280  -0.963   0.197
  128   2H6     A  12          2H6         A  12   4.170   0.674  -0.420
  129    H2     A  12           H2         A  12   6.762   3.237   2.160
  130   1H5*    A  13          1H5*        A  13   5.063   1.381   9.507
  131   2H5*    A  13          2H5*        A  13   5.393   0.629   7.933
  132    H4*    A  13           H4*        A  13   5.502   3.647   8.436
  133    H3*    A  13           H3*        A  13   3.258   1.861   7.437
  134    H2*    A  13           H2*        A  13   2.487   3.775   6.244
  135   2HO*    A  13          2HO*        A  13   3.102   5.267   8.045
  136    H1*    A  13           H1*        A  13   5.029   4.461   5.330
  137    H8     A  13           H8         A  13   4.465   0.730   5.377
  138   1H6     A  13          1H6         A  13   0.980   1.447   0.265
  139   2H6     A  13          2H6         A  13   1.803   0.273   1.275
  140    H2     A  13           H2         A  13   1.829   5.482   1.953
  141   1H5*    A  14          1H5*        A  14   1.462   5.719   8.933
  142   2H5*    A  14          2H5*        A  14  -0.166   5.399   9.539
  143    H4*    A  14           H4*        A  14   0.045   7.107   7.656
  144    H3*    A  14           H3*        A  14  -1.759   4.689   7.288
  145    H2*    A  14           H2*        A  14  -2.545   5.837   5.268
  146   2HO*    A  14          2HO*        A  14  -2.248   7.983   6.401
  147    H1*    A  14           H1*        A  14  -0.027   6.403   4.412
  148    H8     A  14           H8         A  14   0.557   2.971   5.791
  149   1H6     A  14          1H6         A  14  -2.179   0.951   0.596
  150   2H6     A  14          2H6         A  14  -1.130   0.511   1.928
  151    H2     A  14           H2         A  14  -3.298   5.257   1.214
  152   1H5*    G  15          1H5*        G  15  -4.144   8.208   5.946
  153   2H5*    G  15          2H5*        G  15  -5.713   8.026   6.730
  154    H4*    G  15           H4*        G  15  -6.052   8.263   4.349
  155    H3*    G  15           H3*        G  15  -6.426   5.392   5.262
  156    H2*    G  15           H2*        G  15  -7.561   5.054   3.280
  157   2HO*    G  15          2HO*        G  15  -7.928   6.759   1.779
  158    H1*    G  15           H1*        G  15  -5.557   6.305   1.823
  159    H8     G  15           H8         G  15  -4.263   4.323   4.740
  160    H1     G  15           H1         G  15  -6.371   0.609  -0.087
  161   1H2     G  15          1H2         G  15  -7.860   3.594  -1.180
  162   2H2     G  15          2H2         G  15  -7.655   1.876  -1.450
  163   1H5*    C  16          1H5*        C  16 -10.154   6.772   3.501
  164   2H5*    C  16          2H5*        C  16 -11.556   6.172   4.396
  165    H4*    C  16           H4*        C  16 -11.574   5.588   1.970
  166    H3*    C  16           H3*        C  16 -11.423   3.275   3.934
  167    H2*    C  16           H2*        C  16 -11.921   1.860   2.015
  168   2HO*    C  16          2HO*        C  16 -12.287   4.278   0.568
  169    H1*    C  16           H1*        C  16 -10.034   3.168   0.429
  170   1H4     C  16          1H4         C  16  -6.600  -0.949   4.382
  171   2H4     C  16          2H4         C  16  -7.160  -1.924   3.034
  172    H5     C  16           H5         C  16  -7.345   1.391   4.714
  173    H6     C  16           H6         C  16  -8.644   3.171   3.775
  174   1H5*    C  17          1H5*        C  17 -14.851   2.576   1.324
  175   2H5*    C  17          2H5*        C  17 -16.221   2.022   2.298
  176    H4*    C  17           H4*        C  17 -15.730   0.451   0.475
  177    H3*    C  17           H3*        C  17 -15.098  -0.628   3.266
  178    H2*    C  17           H2*        C  17 -14.859  -2.764   2.215
  179   2HO*    C  17          2HO*        C  17 -15.896  -1.554  -0.143
  180    H1*    C  17           H1*        C  17 -13.449  -1.666   0.022
  181   1H4     C  17          1H4         C  17  -9.063  -2.515   4.986
  182   2H4     C  17          2H4         C  17  -9.013  -3.974   4.017
  183    H5     C  17           H5         C  17 -10.728  -0.719   4.593
  184    H6     C  17           H6         C  17 -12.545  -0.019   3.184
  185    H3T    C  17           H3T        C  17 -17.255   0.037   2.895
  Start of MODEL    3
    1   1H5*    G   1          1H5*        G   1  -5.978 -13.913   1.738
    2   2H5*    G   1          2H5*        G   1  -5.171 -13.562   0.199
    3    H4*    G   1           H4*        G   1  -7.591 -13.018   0.121
    4    H3*    G   1           H3*        G   1  -5.742 -10.600   0.033
    5    H2*    G   1           H2*        G   1  -7.711  -9.325  -0.539
    6   2HO*    G   1          2HO*        G   1  -8.991 -11.845  -0.867
    7    H1*    G   1           H1*        G   1  -9.303 -10.666   1.322
    8    H8     G   1           H8         G   1  -5.967  -9.876   2.965
    9    H1     G   1           H1         G   1 -10.113  -4.934   2.825
   10   1H2     G   1          1H2         G   1 -11.805  -6.892   0.465
   11   2H2     G   1          2H2         G   1 -11.743  -5.375   1.340
   12    H5T    G   1           H5T        G   1  -5.196 -11.872   2.477
   13   1H5*    G   2          1H5*        G   2  -8.436 -10.548  -3.534
   14   2H5*    G   2          2H5*        G   2  -7.524  -9.885  -4.896
   15    H4*    G   2           H4*        G   2  -9.596  -8.610  -4.462
   16    H3*    G   2           H3*        G   2  -6.996  -7.133  -3.897
   17    H2*    G   2           H2*        G   2  -8.315  -5.182  -3.643
   18   2HO*    G   2          2HO*        G   2 -10.418  -6.668  -4.858
   19    H1*    G   2           H1*        G   2 -10.424  -6.480  -2.347
   20    H8     G   2           H8         G   2  -7.068  -7.455  -0.902
   21    H1     G   2           H1         G   2  -9.181  -1.714   1.126
   22   1H2     G   2          1H2         G   2 -11.489  -2.043  -1.490
   23   2H2     G   2          2H2         G   2 -10.850  -1.025  -0.213
   24   1H5*    C   3          1H5*        C   3  -9.314  -4.621  -6.773
   25   2H5*    C   3          2H5*        C   3  -8.139  -3.831  -7.835
   26    H4*    C   3           H4*        C   3  -9.519  -2.188  -6.579
   27    H3*    C   3           H3*        C   3  -6.569  -2.290  -5.841
   28    H2*    C   3           H2*        C   3  -6.933  -0.374  -4.554
   29   2HO*    C   3          2HO*        C   3  -8.791   0.902  -4.716
   30    H1*    C   3           H1*        C   3  -9.523  -1.171  -3.701
   31   1H4     C   3          1H4         C   3  -4.279  -2.885   0.165
   32   2H4     C   3          2H4         C   3  -4.991  -1.449   0.877
   33    H5     C   3           H5         C   3  -5.135  -3.873  -1.972
   34    H6     C   3           H6         C   3  -6.795  -3.628  -3.695
   35   1H5*    U   4          1H5*        U   4  -7.797   1.894  -7.154
   36   2H5*    U   4          2H5*        U   4  -6.451   2.612  -8.047
   37    H4*    U   4           H4*        U   4  -7.275   4.017  -6.145
   38    H3*    U   4           H3*        U   4  -4.404   3.022  -6.025
   39    H2*    U   4           H2*        U   4  -4.148   4.579  -4.159
   40   2HO*    U   4          2HO*        U   4  -5.590   6.168  -5.228
   41    H1*    U   4           H1*        U   4  -6.514   3.817  -2.990
   42    H3     U   4           H3         U   4  -3.264   2.163  -0.270
   43    H5     U   4           H5         U   4  -3.803  -0.763  -3.259
   44    H6     U   4           H6         U   4  -5.141   0.804  -4.485
   45   1H5*    U   5          1H5*        U   5  -3.971   7.348  -5.266
   46   2H5*    U   5          2H5*        U   5  -2.567   7.851  -6.221
   47    H4*    U   5           H4*        U   5  -2.184   8.301  -3.837
   48    H3*    U   5           H3*        U   5  -0.526   6.015  -4.987
   49    H2*    U   5           H2*        U   5   0.633   5.958  -3.048
   50   2HO*    U   5          2HO*        U   5   1.105   8.156  -2.763
   51    H1*    U   5           H1*        U   5  -1.567   6.708  -1.383
   52    H3     U   5           H3         U   5   0.555   2.863   0.072
   53    H5     U   5           H5         U   5  -1.207   1.776  -3.616
   54    H6     U   5           H6         U   5  -2.051   3.993  -3.823
   55   1H5*    U   6          1H5*        U   6   2.108   9.824  -3.300
   56   2H5*    U   6          2H5*        U   6   3.500   9.806  -4.393
   57    H4*    U   6           H4*        U   6   4.213   9.969  -2.048
   58    H3*    U   6           H3*        U   6   4.908   7.374  -3.465
   59    H2*    U   6           H2*        U   6   6.322   6.901  -1.574
   60   2HO*    U   6          2HO*        U   6   6.622   8.424   0.078
   61    H1*    U   6           H1*        U   6   4.379   7.678   0.277
   62    H3     U   6           H3         U   6   5.040   3.052   0.257
   63    H5     U   6           H5         U   6   2.045   3.841  -2.603
   64    H6     U   6           H6         U   6   2.511   6.198  -2.347
   65   1H5*    G   7          1H5*        G   7   8.648   8.024  -2.082
   66   2H5*    G   7          2H5*        G   7   9.815   7.822  -3.404
   67    H4*    G   7           H4*        G   7  10.190   6.144  -1.651
   68    H3*    G   7           H3*        G   7   9.067   5.029  -4.247
   69    H2*    G   7           H2*        G   7   9.467   2.844  -3.312
   70   2HO*    G   7          2HO*        G   7  10.543   2.554  -1.381
   71    H1*    G   7           H1*        G   7   8.388   3.480  -0.867
   72    H8     G   7           H8         G   7   6.260   5.265  -3.447
   73    H1     G   7           H1         G   7   5.188  -1.086  -3.236
   74   1H2     G   7          1H2         G   7   8.064  -1.168  -1.245
   75   2H2     G   7          2H2         G   7   6.853  -2.086  -2.119
   76   1H5*    G   8          1H5*        G   8  12.562   1.721  -6.110
   77   2H5*    G   8          2H5*        G   8  10.852   2.019  -6.486
   78    H4*    G   8           H4*        G   8  11.901   0.434  -4.119
   79    H3*    G   8           H3*        G   8  11.795  -0.499  -6.606
   80    H2*    G   8           H2*        G   8   9.624  -0.179  -7.243
   81   2HO*    G   8          2HO*        G   8   9.328  -2.519  -5.681
   82    H1*    G   8           H1*        G   8   8.316  -0.505  -4.562
   83    H8     G   8           H8         G   8   8.814   2.982  -5.622
   84    H1     G   8           H1         G   8   3.335   0.318  -7.721
   85   1H2     G   8          1H2         G   8   3.410  -1.916  -7.336
   86   2H2     G   8          2H2         G   8   4.824  -2.667  -6.620
   87   1H5*    A   9          1H5*        A   9  12.142  -5.902  -5.241
   88   2H5*    A   9          2H5*        A   9  10.446  -6.145  -5.625
   89    H4*    A   9           H4*        A   9  10.742  -6.288  -3.232
   90    H3*    A   9           H3*        A   9   9.389  -3.726  -4.064
   91    H2*    A   9           H2*        A   9   8.748  -3.540  -1.722
   92   2HO*    A   9          2HO*        A   9   9.259  -5.369  -0.333
   93    H1*    A   9           H1*        A   9  11.291  -4.562  -0.936
   94    H8     A   9           H8         A   9  10.207  -1.516  -3.286
   95   1H6     A   9          1H6         A   9  12.030   1.984  -0.471
   96   2H6     A   9          2H6         A   9  13.026   1.966   0.972
   97    H2     A   9           H2         A   9  13.722  -2.290   2.079
   98   1H5*    U  10          1H5*        U  10   4.690  -4.775  -1.930
   99   2H5*    U  10          2H5*        U  10   6.286  -5.046  -1.199
  100    H4*    U  10           H4*        U  10   4.476  -6.378  -0.113
  101    H3*    U  10           H3*        U  10   6.640  -7.952  -1.573
  102    H2*    U  10           H2*        U  10   5.699  -9.903  -0.558
  103   2HO*    U  10          2HO*        U  10   5.433  -9.006   1.533
  104    H1*    U  10           H1*        U  10   3.024  -8.957  -0.862
  105    H3     U  10           H3         U  10   3.219 -12.722  -3.518
  106    H5     U  10           H5         U  10   5.819 -10.005  -5.428
  107    H6     U  10           H6         U  10   5.466  -8.460  -3.622
  108   1H5*    A  11          1H5*        A  11  10.748  -7.783   1.944
  109   2H5*    A  11          2H5*        A  11   9.748  -8.199   3.354
  110    H4*    A  11           H4*        A  11  11.382  -6.400   3.888
  111    H3*    A  11           H3*        A  11   8.458  -5.529   3.809
  112    H2*    A  11           H2*        A  11   9.151  -3.460   4.595
  113   2HO*    A  11          2HO*        A  11  10.431  -4.219   6.336
  114    H1*    A  11           H1*        A  11  11.712  -3.554   3.279
  115    H8     A  11           H8         A  11   8.680  -3.961   1.016
  116   1H6     A  11          1H6         A  11   8.114   0.806  -0.109
  117   2H6     A  11          2H6         A  11   8.699   2.253   0.690
  118    H2     A  11           H2         A  11  11.322   1.064   4.045
  119   1H5*    A  12          1H5*        A  12   6.945  -3.811   8.249
  120   2H5*    A  12          2H5*        A  12   6.623  -3.607   6.519
  121    H4*    A  12           H4*        A  12   8.586  -1.961   8.181
  122    H3*    A  12           H3*        A  12   5.847  -1.474   6.971
  123    H2*    A  12           H2*        A  12   6.441   0.822   6.549
  124   2HO*    A  12          2HO*        A  12   8.454   1.634   7.238
  125    H1*    A  12           H1*        A  12   8.847   0.207   5.414
  126    H8     A  12           H8         A  12   6.878  -2.790   4.356
  127   1H6     A  12          1H6         A  12   4.537   0.768  -0.146
  128   2H6     A  12          2H6         A  12   4.746  -0.876   0.423
  129    H2     A  12           H2         A  12   6.508   3.459   2.811
  130   1H5*    A  13          1H5*        A  13   6.402   2.083   9.160
  131   2H5*    A  13          2H5*        A  13   4.961   2.398  10.140
  132    H4*    A  13           H4*        A  13   5.408   4.265   8.610
  133    H3*    A  13           H3*        A  13   2.939   2.615   7.945
  134    H2*    A  13           H2*        A  13   2.385   4.308   6.386
  135   2HO*    A  13          2HO*        A  13   4.452   5.858   7.591
  136    H1*    A  13           H1*        A  13   4.992   4.584   5.424
  137    H8     A  13           H8         A  13   4.015   0.973   6.085
  138   1H6     A  13          1H6         A  13   1.209   1.080   0.525
  139   2H6     A  13          2H6         A  13   1.796   0.036   1.807
  140    H2     A  13           H2         A  13   2.219   5.269   1.658
  141   1H5*    A  14          1H5*        A  14   1.602   6.732   8.414
  142   2H5*    A  14          2H5*        A  14   0.019   6.770   9.208
  143    H4*    A  14           H4*        A  14   0.058   7.868   6.950
  144    H3*    A  14           H3*        A  14  -1.699   5.402   7.243
  145    H2*    A  14           H2*        A  14  -2.600   5.999   5.086
  146   2HO*    A  14          2HO*        A  14  -2.066   7.944   4.088
  147    H1*    A  14           H1*        A  14  -0.089   6.662   4.052
  148    H8     A  14           H8         A  14   0.576   3.380   5.720
  149   1H6     A  14          1H6         A  14  -2.214   0.840   0.786
  150   2H6     A  14          2H6         A  14  -1.114   0.547   2.118
  151    H2     A  14           H2         A  14  -3.427   5.163   1.056
  152   1H5*    G  15          1H5*        G  15  -4.180   8.722   5.471
  153   2H5*    G  15          2H5*        G  15  -5.746   8.614   6.274
  154    H4*    G  15           H4*        G  15  -6.085   8.555   3.876
  155    H3*    G  15           H3*        G  15  -6.448   5.817   5.137
  156    H2*    G  15           H2*        G  15  -7.593   5.239   3.211
  157   2HO*    G  15          2HO*        G  15  -7.960   6.744   1.516
  158    H1*    G  15           H1*        G  15  -5.583   6.302   1.619
  159    H8     G  15           H8         G  15  -4.312   4.670   4.768
  160    H1     G  15           H1         G  15  -6.311   0.444   0.330
  161   1H2     G  15          1H2         G  15  -7.841   3.275  -1.067
  162   2H2     G  15          2H2         G  15  -7.601   1.542  -1.161
  163   1H5*    C  16          1H5*        C  16 -10.180   7.051   3.210
  164   2H5*    C  16          2H5*        C  16 -11.590   6.542   4.144
  165    H4*    C  16           H4*        C  16 -11.595   5.759   1.772
  166    H3*    C  16           H3*        C  16 -11.498   3.615   3.923
  167    H2*    C  16           H2*        C  16 -12.014   2.059   2.121
  168   2HO*    C  16          2HO*        C  16 -12.331   4.357   0.480
  169    H1*    C  16           H1*        C  16 -10.102   3.212   0.441
  170   1H4     C  16          1H4         C  16  -6.767  -0.686   4.693
  171   2H4     C  16          2H4         C  16  -7.326  -1.737   3.404
  172    H5     C  16           H5         C  16  -7.486   1.680   4.870
  173    H6     C  16           H6         C  16  -8.752   3.415   3.804
  174   1H5*    C  17          1H5*        C  17 -14.946   2.802   1.350
  175   2H5*    C  17          2H5*        C  17 -16.326   2.343   2.359
  176    H4*    C  17           H4*        C  17 -15.867   0.635   0.651
  177    H3*    C  17           H3*        C  17 -15.242  -0.260   3.509
  178    H2*    C  17           H2*        C  17 -15.070  -2.470   2.586
  179   2HO*    C  17          2HO*        C  17 -16.885  -2.208   1.144
  180    H1*    C  17           H1*        C  17 -13.637  -1.541   0.331
  181   1H4     C  17          1H4         C  17  -9.258  -2.179   5.332
  182   2H4     C  17          2H4         C  17  -9.242  -3.696   4.456
  183    H5     C  17           H5         C  17 -10.885  -0.376   4.834
  184    H6     C  17           H6         C  17 -12.690   0.276   3.388
  185    H3T    C  17           H3T        C  17 -17.393   0.423   3.096
  Start of MODEL    4
    1   1H5*    G   1          1H5*        G   1  -3.615 -14.125   2.127
    2   2H5*    G   1          2H5*        G   1  -3.240 -14.313   0.406
    3    H4*    G   1           H4*        G   1  -5.411 -13.170   0.736
    4    H3*    G   1           H3*        G   1  -3.212 -11.367  -0.346
    5    H2*    G   1           H2*        G   1  -4.781  -9.675  -0.557
    6   2HO*    G   1          2HO*        G   1  -6.857  -9.998  -1.063
    7    H1*    G   1           H1*        G   1  -6.507 -10.842   1.513
    8    H8     G   1           H8         G   1  -3.132  -9.470   2.658
    9    H1     G   1           H1         G   1  -8.119  -5.408   3.157
   10   1H2     G   1          1H2         G   1  -9.676  -7.618   0.937
   11   2H2     G   1          2H2         G   1  -9.790  -6.119   1.838
   12    H5T    G   1           H5T        G   1  -1.832 -12.551   0.580
   13   1H5*    G   2          1H5*        G   2  -4.275  -9.550  -4.582
   14   2H5*    G   2          2H5*        G   2  -4.142  -9.173  -2.848
   15    H4*    G   2           H4*        G   2  -6.778  -9.116  -4.394
   16    H3*    G   2           H3*        G   2  -4.750  -6.959  -3.711
   17    H2*    G   2           H2*        G   2  -6.550  -5.437  -3.550
   18   2HO*    G   2          2HO*        G   2  -8.637  -5.938  -4.261
   19    H1*    G   2           H1*        G   2  -8.267  -7.181  -2.267
   20    H8     G   2           H8         G   2  -4.796  -7.398  -0.832
   21    H1     G   2           H1         G   2  -8.065  -2.225   1.196
   22   1H2     G   2          1H2         G   2 -10.209  -2.991  -1.464
   23   2H2     G   2          2H2         G   2  -9.800  -1.870  -0.178
   24   1H5*    C   3          1H5*        C   3  -7.532  -5.112  -6.664
   25   2H5*    C   3          2H5*        C   3  -6.547  -4.113  -7.747
   26    H4*    C   3           H4*        C   3  -8.252  -2.753  -6.538
   27    H3*    C   3           H3*        C   3  -5.324  -2.262  -5.875
   28    H2*    C   3           H2*        C   3  -5.946  -0.516  -4.492
   29   2HO*    C   3          2HO*        C   3  -7.399   0.480  -5.989
   30    H1*    C   3           H1*        C   3  -8.356  -1.698  -3.583
   31   1H4     C   3          1H4         C   3  -2.879  -2.968   0.133
   32   2H4     C   3          2H4         C   3  -3.784  -1.702   0.948
   33    H5     C   3           H5         C   3  -3.575  -3.832  -2.128
   34    H6     C   3           H6         C   3  -5.277  -3.729  -3.782
   35   1H5*    U   4          1H5*        U   4  -7.200   1.899  -7.352
   36   2H5*    U   4          2H5*        U   4  -5.859   2.583  -8.286
   37    H4*    U   4           H4*        U   4  -6.667   4.133  -6.544
   38    H3*    U   4           H3*        U   4  -3.845   3.071  -6.140
   39    H2*    U   4           H2*        U   4  -3.676   4.829  -4.429
   40   2HO*    U   4          2HO*        U   4  -5.374   6.255  -4.096
   41    H1*    U   4           H1*        U   4  -6.055   4.155  -3.320
   42    H3     U   4           H3         U   4  -3.061   2.488  -0.345
   43    H5     U   4           H5         U   4  -3.300  -0.439  -3.365
   44    H6     U   4           H6         U   4  -4.544   1.114  -4.699
   45   1H5*    U   5          1H5*        U   5  -3.571   7.415  -5.938
   46   2H5*    U   5          2H5*        U   5  -2.107   7.921  -6.794
   47    H4*    U   5           H4*        U   5  -2.115   8.771  -4.525
   48    H3*    U   5           H3*        U   5  -0.048   6.573  -4.966
   49    H2*    U   5           H2*        U   5   0.860   7.341  -2.819
   50   2HO*    U   5          2HO*        U   5  -1.061   9.409  -2.947
   51    H1*    U   5           H1*        U   5  -1.567   7.336  -1.645
   52    H3     U   5           H3         U   5   0.418   3.657   0.114
   53    H5     U   5           H5         U   5  -1.036   2.393  -3.644
   54    H6     U   5           H6         U   5  -1.607   4.655  -4.136
   55   1H5*    U   6          1H5*        U   6   2.217   9.868  -3.313
   56   2H5*    U   6          2H5*        U   6   3.758   9.982  -4.180
   57    H4*    U   6           H4*        U   6   4.098   9.654  -1.761
   58    H3*    U   6           H3*        U   6   4.894   7.265  -3.472
   59    H2*    U   6           H2*        U   6   5.945   6.448  -1.491
   60   2HO*    U   6          2HO*        U   6   6.105   7.699   0.392
   61    H1*    U   6           H1*        U   6   3.793   7.237   0.161
   62    H3     U   6           H3         U   6   4.531   2.632   0.032
   63    H5     U   6           H5         U   6   1.980   3.501  -3.210
   64    H6     U   6           H6         U   6   2.247   5.835  -2.748
   65   1H5*    G   7          1H5*        G   7   8.441   7.466  -1.337
   66   2H5*    G   7          2H5*        G   7   9.786   7.199  -2.461
   67    H4*    G   7           H4*        G   7   9.629   5.403  -0.781
   68    H3*    G   7           H3*        G   7   8.978   4.549  -3.624
   69    H2*    G   7           H2*        G   7   8.927   2.268  -2.747
   70   2HO*    G   7          2HO*        G   7  10.719   2.541  -1.310
   71    H1*    G   7           H1*        G   7   7.366   2.919  -0.607
   72    H8     G   7           H8         G   7   6.185   5.134  -3.465
   73    H1     G   7           H1         G   7   4.361  -1.016  -4.070
   74   1H2     G   7          1H2         G   7   6.281  -1.507  -1.181
   75   2H2     G   7          2H2         G   7   5.221  -2.216  -2.383
   76   1H5*    G   8          1H5*        G   8  12.256   0.849  -4.941
   77   2H5*    G   8          2H5*        G   8  10.853   1.561  -5.756
   78    H4*    G   8           H4*        G   8  10.737  -0.401  -3.444
   79    H3*    G   8           H3*        G   8  11.456  -1.222  -5.803
   80    H2*    G   8           H2*        G   8   9.890   0.047  -7.119
   81   2HO*    G   8          2HO*        G   8   9.558  -2.255  -7.610
   82    H1*    G   8           H1*        G   8   7.548  -0.665  -5.325
   83    H8     G   8           H8         G   8   8.799   2.808  -5.336
   84    H1     G   8           H1         G   8   3.772   1.751  -9.219
   85   1H2     G   8          1H2         G   8   4.436  -1.621  -8.508
   86   2H2     G   8          2H2         G   8   3.401  -0.476  -9.343
   87   1H5*    A   9          1H5*        A   9  10.028  -6.637  -5.154
   88   2H5*    A   9          2H5*        A   9   8.351  -6.517  -5.668
   89    H4*    A   9           H4*        A   9   8.247  -6.756  -3.321
   90    H3*    A   9           H3*        A   9   7.979  -3.832  -4.042
   91    H2*    A   9           H2*        A   9   7.428  -3.401  -1.812
   92   2HO*    A   9          2HO*        A   9   5.843  -4.965  -1.536
   93    H1*    A   9           H1*        A   9   9.081  -5.583  -0.862
   94    H8     A   9           H8         A   9   9.516  -2.100  -2.672
   95   1H6     A   9          1H6         A   9  13.983  -1.110   1.503
   96   2H6     A   9          2H6         A   9  13.048  -0.398   0.200
   97    H2     A   9           H2         A   9  12.471  -5.253   2.122
   98   1H5*    U  10          1H5*        U  10   4.259  -5.831  -2.307
   99   2H5*    U  10          2H5*        U  10   2.842  -5.358  -3.248
  100    H4*    U  10           H4*        U  10   3.470  -3.773  -0.749
  101    H3*    U  10           H3*        U  10   2.478  -6.619  -0.835
  102    H2*    U  10           H2*        U  10   0.903  -6.034   1.005
  103   2HO*    U  10          2HO*        U  10   0.913  -3.936   1.831
  104    H1*    U  10           H1*        U  10  -0.077  -3.886  -0.311
  105    H3     U  10           H3         U  10  -2.122  -5.548  -4.215
  106    H5     U  10           H5         U  10  -0.825  -8.875  -1.989
  107    H6     U  10           H6         U  10   0.353  -7.413  -0.524
  108   1H5*    A  11          1H5*        A  11   6.620  -8.378   2.176
  109   2H5*    A  11          2H5*        A  11   5.736  -8.135   3.701
  110    H4*    A  11           H4*        A  11   8.176  -7.539   3.887
  111    H3*    A  11           H3*        A  11   6.132  -5.303   4.161
  112    H2*    A  11           H2*        A  11   7.846  -3.808   4.578
  113   2HO*    A  11          2HO*        A  11   9.947  -4.439   5.177
  114    H1*    A  11           H1*        A  11   9.750  -5.015   2.864
  115    H8     A  11           H8         A  11   6.364  -4.349   1.278
  116   1H6     A  11          1H6         A  11   7.409   0.153  -0.476
  117   2H6     A  11          2H6         A  11   8.688   1.277  -0.066
  118    H2     A  11           H2         A  11  11.217  -0.545   3.082
  119   1H5*    A  12          1H5*        A  12   6.748  -3.118   8.790
  120   2H5*    A  12          2H5*        A  12   5.857  -2.743   7.305
  121    H4*    A  12           H4*        A  12   8.761  -2.050   7.894
  122    H3*    A  12           H3*        A  12   6.137  -0.565   7.748
  123    H2*    A  12           H2*        A  12   7.013   1.243   6.509
  124   2HO*    A  12          2HO*        A  12   9.251   1.557   6.273
  125    H1*    A  12           H1*        A  12   8.679  -0.199   4.859
  126    H8     A  12           H8         A  12   5.790  -2.535   4.925
  127   1H6     A  12          1H6         A  12   4.030   0.580  -0.141
  128   2H6     A  12          2H6         A  12   3.867  -0.917   0.757
  129    H2     A  12           H2         A  12   6.857   3.178   2.140
  130   1H5*    A  13          1H5*        A  13   4.387   2.120   9.794
  131   2H5*    A  13          2H5*        A  13   4.714   1.321   8.245
  132    H4*    A  13           H4*        A  13   5.181   4.299   8.780
  133    H3*    A  13           H3*        A  13   2.815   2.764   7.661
  134    H2*    A  13           H2*        A  13   2.338   4.646   6.310
  135   2HO*    A  13          2HO*        A  13   4.303   6.038   7.843
  136    H1*    A  13           H1*        A  13   4.960   5.038   5.517
  137    H8     A  13           H8         A  13   4.106   1.382   5.883
  138   1H6     A  13          1H6         A  13   1.108   1.767   0.454
  139   2H6     A  13          2H6         A  13   1.787   0.665   1.635
  140    H2     A  13           H2         A  13   2.050   5.909   1.823
  141   1H5*    A  14          1H5*        A  14   1.286   6.716   8.602
  142   2H5*    A  14          2H5*        A  14  -0.347   6.605   9.283
  143    H4*    A  14           H4*        A  14  -0.192   8.003   7.205
  144    H3*    A  14           H3*        A  14  -1.903   5.494   7.059
  145    H2*    A  14           H2*        A  14  -2.645   6.339   4.896
  146   2HO*    A  14          2HO*        A  14  -1.938   8.358   4.155
  147    H1*    A  14           H1*        A  14  -0.110   6.921   4.074
  148    H8     A  14           H8         A  14   0.450   3.673   5.892
  149   1H6     A  14          1H6         A  14  -1.974   1.031   0.820
  150   2H6     A  14          2H6         A  14  -0.989   0.756   2.243
  151    H2     A  14           H2         A  14  -3.170   5.352   0.889
  152   1H5*    G  15          1H5*        G  15  -4.315   8.676   5.225
  153   2H5*    G  15          2H5*        G  15  -5.923   8.549   5.936
  154    H4*    G  15           H4*        G  15  -6.135   8.489   3.539
  155    H3*    G  15           H3*        G  15  -6.496   5.735   4.760
  156    H2*    G  15           H2*        G  15  -7.502   5.112   2.777
  157   2HO*    G  15          2HO*        G  15  -7.333   7.865   1.986
  158    H1*    G  15           H1*        G  15  -5.470   6.246   1.282
  159    H8     G  15           H8         G  15  -4.264   4.693   4.478
  160    H1     G  15           H1         G  15  -5.960   0.344   0.038
  161   1H2     G  15          1H2         G  15  -7.537   3.101  -1.459
  162   2H2     G  15          2H2         G  15  -7.243   1.375  -1.515
  163   1H5*    C  16          1H5*        C  16 -10.121   6.582   2.595
  164   2H5*    C  16          2H5*        C  16 -11.543   6.103   3.527
  165    H4*    C  16           H4*        C  16 -11.427   5.033   1.268
  166    H3*    C  16           H3*        C  16 -11.261   3.204   3.690
  167    H2*    C  16           H2*        C  16 -11.552   1.384   2.151
  168   2HO*    C  16          2HO*        C  16 -12.049   1.739  -0.021
  169    H1*    C  16           H1*        C  16  -9.792   2.525   0.249
  170   1H4     C  16          1H4         C  16  -6.068  -0.728   4.714
  171   2H4     C  16          2H4         C  16  -6.538  -1.917   3.513
  172    H5     C  16           H5         C  16  -6.981   1.573   4.720
  173    H6     C  16           H6         C  16  -8.372   3.122   3.523
  174   1H5*    C  17          1H5*        C  17 -15.469   0.291   3.756
  175   2H5*    C  17          2H5*        C  17 -13.780   0.113   4.269
  176    H4*    C  17           H4*        C  17 -14.930  -0.739   1.567
  177    H3*    C  17           H3*        C  17 -13.999  -2.237   4.058
  178    H2*    C  17           H2*        C  17 -13.378  -4.051   2.657
  179   2HO*    C  17          2HO*        C  17 -15.241  -3.847   1.244
  180    H1*    C  17           H1*        C  17 -12.166  -2.406   0.751
  181   1H4     C  17          1H4         C  17  -7.854  -2.898   5.811
  182   2H4     C  17          2H4         C  17  -7.552  -4.282   4.781
  183    H5     C  17           H5         C  17  -9.754  -1.349   5.434
  184    H6     C  17           H6         C  17 -11.628  -0.871   3.995
  185    H3T    C  17           H3T        C  17 -16.270  -1.914   3.711
  Start of MODEL    5
    1   1H5*    G   1          1H5*        G   1  -5.758 -13.548   1.779
    2   2H5*    G   1          2H5*        G   1  -5.180 -13.252   0.129
    3    H4*    G   1           H4*        G   1  -7.552 -12.549   0.426
    4    H3*    G   1           H3*        G   1  -5.653 -10.183   0.164
    5    H2*    G   1           H2*        G   1  -7.590  -8.876  -0.266
    6   2HO*    G   1          2HO*        G   1  -9.626  -9.755  -0.474
    7    H1*    G   1           H1*        G   1  -8.977 -10.255   1.779
    8    H8     G   1           H8         G   1  -5.601  -9.315   3.166
    9    H1     G   1           H1         G   1  -9.935  -4.530   3.139
   10   1H2     G   1          1H2         G   1 -11.659  -6.594   0.901
   11   2H2     G   1          2H2         G   1 -11.614  -5.060   1.746
   12    H5T    G   1           H5T        G   1  -4.756 -11.541   2.351
   13   1H5*    G   2          1H5*        G   2  -7.117  -9.512  -4.646
   14   2H5*    G   2          2H5*        G   2  -6.649  -8.992  -3.016
   15    H4*    G   2           H4*        G   2  -9.403  -8.525  -4.259
   16    H3*    G   2           H3*        G   2  -6.956  -6.776  -3.793
   17    H2*    G   2           H2*        G   2  -8.410  -4.943  -3.536
   18   2HO*    G   2          2HO*        G   2  -9.767  -5.778  -5.411
   19    H1*    G   2           H1*        G   2 -10.396  -6.359  -2.182
   20    H8     G   2           H8         G   2  -7.011  -7.073  -0.739
   21    H1     G   2           H1         G   2  -9.374  -1.377   1.117
   22   1H2     G   2          1H2         G   2 -11.622  -1.851  -1.528
   23   2H2     G   2          2H2         G   2 -11.032  -0.779  -0.270
   24   1H5*    C   3          1H5*        C   3  -9.383  -4.329  -6.659
   25   2H5*    C   3          2H5*        C   3  -8.193  -3.539  -7.703
   26    H4*    C   3           H4*        C   3  -9.559  -1.905  -6.403
   27    H3*    C   3           H3*        C   3  -6.596  -2.061  -5.736
   28    H2*    C   3           H2*        C   3  -6.892  -0.189  -4.379
   29   2HO*    C   3          2HO*        C   3  -8.148   1.038  -5.873
   30    H1*    C   3           H1*        C   3  -9.486  -0.948  -3.487
   31   1H4     C   3          1H4         C   3  -4.204  -2.919   0.218
   32   2H4     C   3          2H4         C   3  -4.863  -1.475   0.970
   33    H5     C   3           H5         C   3  -5.108  -3.799  -1.954
   34    H6     C   3           H6         C   3  -6.821  -3.473  -3.617
   35   1H5*    U   4          1H5*        U   4  -7.667   2.351  -7.188
   36   2H5*    U   4          2H5*        U   4  -6.199   2.868  -8.027
   37    H4*    U   4           H4*        U   4  -6.950   4.429  -6.220
   38    H3*    U   4           H3*        U   4  -4.222   3.130  -5.889
   39    H2*    U   4           H2*        U   4  -3.909   4.801  -4.112
   40   2HO*    U   4          2HO*        U   4  -5.491   6.332  -3.696
   41    H1*    U   4           H1*        U   4  -6.321   4.259  -3.005
   42    H3     U   4           H3         U   4  -3.261   2.397  -0.201
   43    H5     U   4           H5         U   4  -4.009  -0.549  -3.125
   44    H6     U   4           H6         U   4  -5.176   1.105  -4.416
   45   1H5*    U   5          1H5*        U   5  -3.754   7.454  -5.480
   46   2H5*    U   5          2H5*        U   5  -2.275   7.949  -6.307
   47    H4*    U   5           H4*        U   5  -2.284   8.708  -3.997
   48    H3*    U   5           H3*        U   5  -0.241   6.509  -4.548
   49    H2*    U   5           H2*        U   5   0.709   7.258  -2.389
   50   2HO*    U   5          2HO*        U   5   0.067   9.521  -2.831
   51    H1*    U   5           H1*        U   5  -1.689   7.150  -1.182
   52    H3     U   5           H3         U   5   0.373   3.407   0.340
   53    H5     U   5           H5         U   5  -1.299   2.298  -3.378
   54    H6     U   5           H6         U   5  -1.848   4.580  -3.766
   55   1H5*    U   6          1H5*        U   6   2.041   9.796  -2.812
   56   2H5*    U   6          2H5*        U   6   3.509   9.988  -3.781
   57    H4*    U   6           H4*        U   6   4.064   9.627  -1.428
   58    H3*    U   6           H3*        U   6   4.742   7.279  -3.250
   59    H2*    U   6           H2*        U   6   6.003   6.422  -1.424
   60   2HO*    U   6          2HO*        U   6   5.663   8.970  -0.219
   61    H1*    U   6           H1*        U   6   4.029   7.173   0.475
   62    H3     U   6           H3         U   6   4.660   2.560   0.223
   63    H5     U   6           H5         U   6   1.850   3.518  -2.774
   64    H6     U   6           H6         U   6   2.190   5.836  -2.300
   65   1H5*    G   7          1H5*        G   7   8.617   7.885  -1.902
   66   2H5*    G   7          2H5*        G   7   9.719   7.876  -3.295
   67    H4*    G   7           H4*        G   7  10.232   6.027  -1.760
   68    H3*    G   7           H3*        G   7   9.005   5.154  -4.409
   69    H2*    G   7           H2*        G   7   9.469   2.900  -3.712
   70   2HO*    G   7          2HO*        G   7  11.541   3.286  -2.853
   71    H1*    G   7           H1*        G   7   8.606   3.298  -1.112
   72    H8     G   7           H8         G   7   6.148   5.164  -3.290
   73    H1     G   7           H1         G   7   5.344  -1.226  -3.557
   74   1H2     G   7          1H2         G   7   7.183  -2.256  -2.734
   75   2H2     G   7          2H2         G   7   8.531  -1.327  -2.113
   76   1H5*    G   8          1H5*        G   8  12.634   2.023  -6.530
   77   2H5*    G   8          2H5*        G   8  10.934   2.336  -6.922
   78    H4*    G   8           H4*        G   8  11.949   0.521  -4.702
   79    H3*    G   8           H3*        G   8  11.989  -0.236  -7.210
   80    H2*    G   8           H2*        G   8   9.826   0.592  -7.862
   81   2HO*    G   8          2HO*        G   8   9.883  -1.763  -8.268
   82    H1*    G   8           H1*        G   8   8.561  -0.571  -5.356
   83    H8     G   8           H8         G   8   8.760   3.077  -5.964
   84    H1     G   8           H1         G   8   3.068   0.479  -7.484
   85   1H2     G   8          1H2         G   8   3.232  -1.770  -7.330
   86   2H2     G   8          2H2         G   8   4.745  -2.548  -6.905
   87   1H5*    A   9          1H5*        A   9  12.074  -5.622  -5.830
   88   2H5*    A   9          2H5*        A   9  10.365  -6.006  -5.843
   89    H4*    A   9           H4*        A   9  11.260  -5.950  -3.577
   90    H3*    A   9           H3*        A   9   9.260  -3.729  -4.131
   91    H2*    A   9           H2*        A   9   9.218  -3.466  -1.749
   92   2HO*    A   9          2HO*        A   9  10.401  -6.044  -1.616
   93    H1*    A   9           H1*        A   9  12.008  -4.197  -1.539
   94    H8     A   9           H8         A   9  10.666  -1.295  -3.807
   95   1H6     A   9          1H6         A   9  11.302   2.330  -0.615
   96   2H6     A   9          2H6         A   9  11.935   2.383   1.021
   97    H2     A   9           H2         A   9  12.966  -1.783   2.200
   98   1H5*    U  10          1H5*        U  10   7.371  -8.297  -3.734
   99   2H5*    U  10          2H5*        U  10   5.628  -7.983  -3.635
  100    H4*    U  10           H4*        U  10   5.760  -8.755  -1.180
  101    H3*    U  10           H3*        U  10   8.412  -9.841  -2.239
  102    H2*    U  10           H2*        U  10   8.082 -11.682  -0.732
  103   2HO*    U  10          2HO*        U  10   6.110 -10.028   0.473
  104    H1*    U  10           H1*        U  10   5.263 -11.707  -1.228
  105    H3     U  10           H3         U  10   6.637 -15.806  -2.820
  106    H5     U  10           H5         U  10   8.535 -13.048  -5.384
  107    H6     U  10           H6         U  10   7.671 -11.256  -4.029
  108   1H5*    A  11          1H5*        A  11   9.202  -8.153   2.867
  109   2H5*    A  11          2H5*        A  11   8.242  -7.174   1.736
  110    H4*    A  11           H4*        A  11  10.778  -6.265   3.199
  111    H3*    A  11           H3*        A  11   7.818  -5.562   3.447
  112    H2*    A  11           H2*        A  11   8.473  -3.462   4.190
  113   2HO*    A  11          2HO*        A  11   9.969  -4.171   5.800
  114    H1*    A  11           H1*        A  11  10.923  -3.478   2.640
  115    H8     A  11           H8         A  11   7.758  -3.812   0.621
  116   1H6     A  11          1H6         A  11   7.116   0.972  -0.300
  117   2H6     A  11          2H6         A  11   7.664   2.408   0.543
  118    H2     A  11           H2         A  11  10.423   1.114   3.780
  119   1H5*    A  12          1H5*        A  12   7.204  -4.075   8.451
  120   2H5*    A  12          2H5*        A  12   6.385  -3.731   6.918
  121    H4*    A  12           H4*        A  12   8.762  -2.212   8.080
  122    H3*    A  12           H3*        A  12   5.794  -1.699   7.780
  123    H2*    A  12           H2*        A  12   6.108   0.532   7.055
  124   2HO*    A  12          2HO*        A  12   8.764   0.261   8.035
  125    H1*    A  12           H1*        A  12   8.312   0.123   5.480
  126    H8     A  12           H8         A  12   6.177  -2.905   4.778
  127   1H6     A  12          1H6         A  12   3.838   0.564   0.204
  128   2H6     A  12          2H6         A  12   4.000  -1.063   0.835
  129    H2     A  12           H2         A  12   5.991   3.289   3.001
  130   1H5*    A  13          1H5*        A  13   3.587   1.321  10.165
  131   2H5*    A  13          2H5*        A  13   3.850   0.585   8.573
  132    H4*    A  13           H4*        A  13   4.683   3.438   9.306
  133    H3*    A  13           H3*        A  13   2.205   2.269   8.005
  134    H2*    A  13           H2*        A  13   2.035   4.215   6.690
  135   2HO*    A  13          2HO*        A  13   4.075   5.326   8.353
  136    H1*    A  13           H1*        A  13   4.710   4.321   6.023
  137    H8     A  13           H8         A  13   3.469   0.786   6.270
  138   1H6     A  13          1H6         A  13   0.935   1.519   0.640
  139   2H6     A  13          2H6         A  13   1.361   0.351   1.875
  140    H2     A  13           H2         A  13   2.244   5.523   2.111
  141   1H5*    A  14          1H5*        A  14   1.125   6.334   8.876
  142   2H5*    A  14          2H5*        A  14  -0.529   6.415   9.507
  143    H4*    A  14           H4*        A  14  -0.166   7.768   7.427
  144    H3*    A  14           H3*        A  14  -2.126   5.449   7.256
  145    H2*    A  14           H2*        A  14  -2.734   6.340   5.079
  146   2HO*    A  14          2HO*        A  14  -1.848   8.284   4.342
  147    H1*    A  14           H1*        A  14  -0.124   6.708   4.316
  148    H8     A  14           H8         A  14   0.143   3.401   6.051
  149   1H6     A  14          1H6         A  14  -2.387   1.044   0.896
  150   2H6     A  14          2H6         A  14  -1.434   0.683   2.320
  151    H2     A  14           H2         A  14  -3.308   5.443   1.064
  152   1H5*    G  15          1H5*        G  15  -4.187   8.869   5.389
  153   2H5*    G  15          2H5*        G  15  -5.800   8.902   6.104
  154    H4*    G  15           H4*        G  15  -6.051   8.849   3.712
  155    H3*    G  15           H3*        G  15  -6.596   6.119   4.926
  156    H2*    G  15           H2*        G  15  -7.678   5.608   2.949
  157   2HO*    G  15          2HO*        G  15  -7.915   7.147   1.258
  158    H1*    G  15           H1*        G  15  -5.567   6.609   1.446
  159    H8     G  15           H8         G  15  -4.476   4.884   4.607
  160    H1     G  15           H1         G  15  -6.561   0.788   0.091
  161   1H2     G  15          1H2         G  15  -7.937   3.694  -1.319
  162   2H2     G  15          2H2         G  15  -7.782   1.952  -1.416
  163   1H5*    C  16          1H5*        C  16 -10.207   7.367   2.869
  164   2H5*    C  16          2H5*        C  16 -11.649   6.941   3.798
  165    H4*    C  16           H4*        C  16 -11.654   6.020   1.487
  166    H3*    C  16           H3*        C  16 -11.554   3.975   3.737
  167    H2*    C  16           H2*        C  16 -12.098   2.356   1.985
  168   2HO*    C  16          2HO*        C  16 -13.468   3.988   0.852
  169    H1*    C  16           H1*        C  16 -10.155   3.410   0.284
  170   1H4     C  16          1H4         C  16  -6.846  -0.251   4.758
  171   2H4     C  16          2H4         C  16  -7.405  -1.370   3.527
  172    H5     C  16           H5         C  16  -7.561   2.122   4.800
  173    H6     C  16           H6         C  16  -8.808   3.799   3.628
  174   1H5*    C  17          1H5*        C  17 -15.107   2.993   1.260
  175   2H5*    C  17          2H5*        C  17 -16.416   2.532   2.358
  176    H4*    C  17           H4*        C  17 -15.921   0.777   0.680
  177    H3*    C  17           H3*        C  17 -15.279   0.029   3.573
  178    H2*    C  17           H2*        C  17 -15.039  -2.214   2.754
  179   2HO*    C  17          2HO*        C  17 -16.830  -2.201   1.342
  180    H1*    C  17           H1*        C  17 -13.658  -1.347   0.440
  181   1H4     C  17          1H4         C  17  -9.278  -1.778   5.475
  182   2H4     C  17          2H4         C  17  -9.238  -3.321   4.646
  183    H5     C  17           H5         C  17 -10.906   0.000   4.898
  184    H6     C  17           H6         C  17 -12.701   0.596   3.413
  185    H3T    C  17           H3T        C  17 -17.543  -0.393   1.900
  Start of MODEL    6
    1   1H5*    G   1          1H5*        G   1  -6.528 -13.881   2.259
    2   2H5*    G   1          2H5*        G   1  -5.951 -13.758   0.587
    3    H4*    G   1           H4*        G   1  -8.136 -12.607   0.896
    4    H3*    G   1           H3*        G   1  -5.792 -10.726   0.420
    5    H2*    G   1           H2*        G   1  -7.380  -8.998   0.211
    6   2HO*    G   1          2HO*        G   1  -8.850  -9.771  -1.189
    7    H1*    G   1           H1*        G   1  -9.210 -10.309   2.063
    8    H8     G   1           H8         G   1  -5.876  -9.503   3.665
    9    H1     G   1           H1         G   1  -9.870  -4.447   3.314
   10   1H2     G   1          1H2         G   1 -11.671  -6.478   1.107
   11   2H2     G   1          2H2         G   1 -11.541  -4.915   1.890
   12    H5T    G   1           H5T        G   1  -5.148 -12.067   2.718
   13   1H5*    G   2          1H5*        G   2  -8.972 -10.454  -3.064
   14   2H5*    G   2          2H5*        G   2  -8.051  -9.906  -4.473
   15    H4*    G   2           H4*        G   2 -10.006  -8.441  -3.959
   16    H3*    G   2           H3*        G   2  -7.261  -7.176  -3.612
   17    H2*    G   2           H2*        G   2  -8.414  -5.117  -3.399
   18   2HO*    G   2          2HO*        G   2 -10.553  -4.844  -3.975
   19    H1*    G   2           H1*        G   2 -10.583  -6.251  -1.990
   20    H8     G   2           H8         G   2  -7.231  -7.178  -0.479
   21    H1     G   2           H1         G   2  -9.322  -1.310   1.184
   22   1H2     G   2          1H2         G   2 -11.562  -1.755  -1.479
   23   2H2     G   2          2H2         G   2 -10.950  -0.679  -0.237
   24   1H5*    C   3          1H5*        C   3  -9.581  -4.662  -6.545
   25   2H5*    C   3          2H5*        C   3  -8.403  -3.970  -7.668
   26    H4*    C   3           H4*        C   3  -9.687  -2.223  -6.453
   27    H3*    C   3           H3*        C   3  -6.719  -2.401  -5.813
   28    H2*    C   3           H2*        C   3  -6.966  -0.418  -4.579
   29   2HO*    C   3          2HO*        C   3  -9.464  -0.096  -5.911
   30    H1*    C   3           H1*        C   3  -9.551  -1.077  -3.610
   31   1H4     C   3          1H4         C   3  -4.358  -2.991   0.231
   32   2H4     C   3          2H4         C   3  -5.016  -1.520   0.928
   33    H5     C   3           H5         C   3  -5.221  -3.915  -1.943
   34    H6     C   3           H6         C   3  -6.894  -3.639  -3.633
   35   1H5*    U   4          1H5*        U   4  -7.800   1.800  -7.321
   36   2H5*    U   4          2H5*        U   4  -6.444   2.357  -8.313
   37    H4*    U   4           H4*        U   4  -7.056   3.982  -6.580
   38    H3*    U   4           H3*        U   4  -4.325   2.694  -6.209
   39    H2*    U   4           H2*        U   4  -3.971   4.451  -4.529
   40   2HO*    U   4          2HO*        U   4  -6.468   5.493  -5.374
   41    H1*    U   4           H1*        U   4  -6.372   4.011  -3.363
   42    H3     U   4           H3         U   4  -3.388   2.182  -0.457
   43    H5     U   4           H5         U   4  -4.028  -0.805  -3.365
   44    H6     U   4           H6         U   4  -5.199   0.809  -4.693
   45   1H5*    U   5          1H5*        U   5  -3.778   7.032  -6.115
   46   2H5*    U   5          2H5*        U   5  -2.292   7.434  -6.984
   47    H4*    U   5           H4*        U   5  -2.258   8.341  -4.726
   48    H3*    U   5           H3*        U   5  -0.302   6.037  -5.112
   49    H2*    U   5           H2*        U   5   0.664   6.909  -3.008
   50   2HO*    U   5          2HO*        U   5  -0.222   8.701  -2.020
   51    H1*    U   5           H1*        U   5  -1.722   6.939  -1.819
   52    H3     U   5           H3         U   5   0.208   3.248  -0.032
   53    H5     U   5           H5         U   5  -1.439   1.935  -3.690
   54    H6     U   5           H6         U   5  -1.914   4.211  -4.244
   55   1H5*    U   6          1H5*        U   6   1.987   9.397  -3.722
   56   2H5*    U   6          2H5*        U   6   3.563   9.441  -4.527
   57    H4*    U   6           H4*        U   6   3.756   9.372  -2.055
   58    H3*    U   6           H3*        U   6   4.764   6.911  -3.523
   59    H2*    U   6           H2*        U   6   5.690   6.246  -1.417
   60   2HO*    U   6          2HO*        U   6   5.674   7.607   0.385
   61    H1*    U   6           H1*        U   6   3.403   6.984   0.031
   62    H3     U   6           H3         U   6   4.184   2.394   0.053
   63    H5     U   6           H5         U   6   1.813   3.173  -3.351
   64    H6     U   6           H6         U   6   2.117   5.519  -2.964
   65   1H5*    G   7          1H5*        G   7   8.224   7.739  -1.210
   66   2H5*    G   7          2H5*        G   7   9.660   7.478  -2.219
   67    H4*    G   7           H4*        G   7   9.587   5.927  -0.303
   68    H3*    G   7           H3*        G   7   9.224   4.606  -3.017
   69    H2*    G   7           H2*        G   7   9.337   2.478  -1.845
   70   2HO*    G   7          2HO*        G   7  10.943   3.010  -0.342
   71    H1*    G   7           H1*        G   7   7.542   3.243   0.068
   72    H8     G   7           H8         G   7   6.361   4.991  -3.098
   73    H1     G   7           H1         G   7   5.096  -1.316  -3.024
   74   1H2     G   7          1H2         G   7   6.196  -2.276  -1.288
   75   2H2     G   7          2H2         G   7   7.177  -1.335  -0.193
   76   1H5*    G   8          1H5*        G   8  12.327   1.924  -4.943
   77   2H5*    G   8          2H5*        G   8  11.359   2.805  -6.108
   78    H4*    G   8           H4*        G   8  10.337   1.056  -3.829
   79    H3*    G   8           H3*        G   8  11.036   0.180  -6.252
   80    H2*    G   8           H2*        G   8   9.835   2.029  -7.420
   81   2HO*    G   8          2HO*        G   8   8.018  -0.135  -7.535
   82    H1*    G   8           H1*        G   8   7.471   1.222  -5.661
   83    H8     G   8           H8         G   8   9.360   4.281  -6.677
   84    H1     G   8           H1         G   8   2.993   4.983  -7.155
   85   1H2     G   8          1H2         G   8   2.970   1.627  -6.113
   86   2H2     G   8          2H2         G   8   2.017   3.035  -6.556
   87   1H5*    A   9          1H5*        A   9  10.603  -4.582  -5.716
   88   2H5*    A   9          2H5*        A   9   8.884  -4.894  -6.056
   89    H4*    A   9           H4*        A   9   9.668  -6.215  -4.134
   90    H3*    A   9           H3*        A   9   7.325  -4.573  -4.151
   91    H2*    A   9           H2*        A   9   8.002  -2.895  -2.858
   92   2HO*    A   9          2HO*        A   9   6.538  -4.313  -1.549
   93    H1*    A   9           H1*        A   9   9.821  -4.608  -1.133
   94    H8     A   9           H8         A   9   9.441  -1.249  -3.143
   95   1H6     A   9          1H6         A   9  13.870   0.954   0.549
   96   2H6     A   9          2H6         A   9  12.658   1.354  -0.658
   97    H2     A   9           H2         A   9  13.589  -3.443   1.281
   98   1H5*    U  10          1H5*        U  10   5.183  -8.403  -1.430
   99   2H5*    U  10          2H5*        U  10   6.668  -7.727  -0.729
  100    H4*    U  10           H4*        U  10   6.021  -9.837   0.365
  101    H3*    U  10           H3*        U  10   8.612  -9.650  -1.146
  102    H2*    U  10           H2*        U  10   9.049 -12.055  -0.904
  103   2HO*    U  10          2HO*        U  10   8.224 -12.172   1.247
  104    H1*    U  10           H1*        U  10   6.648 -12.860  -1.767
  105    H3     U  10           H3         U  10   6.073 -11.091  -6.118
  106    H5     U  10           H5         U  10  10.059 -10.380  -4.953
  107    H6     U  10           H6         U  10   9.502 -11.051  -2.736
  108   1H5*    A  11          1H5*        A  11   9.726  -8.645   3.940
  109   2H5*    A  11          2H5*        A  11   8.713  -7.760   2.777
  110    H4*    A  11           H4*        A  11  11.489  -6.902   3.743
  111    H3*    A  11           H3*        A  11   8.695  -5.856   4.347
  112    H2*    A  11           H2*        A  11   9.716  -3.780   4.757
  113   2HO*    A  11          2HO*        A  11  11.958  -3.554   5.106
  114    H1*    A  11           H1*        A  11  11.801  -4.276   2.811
  115    H8     A  11           H8         A  11   8.261  -4.317   1.455
  116   1H6     A  11          1H6         A  11   8.909   1.857   0.928
  117   2H6     A  11          2H6         A  11   7.916   0.503   0.426
  118    H2     A  11           H2         A  11  12.161   0.365   3.524
  119   1H5*    A  12          1H5*        A  12   8.407  -3.582   8.827
  120   2H5*    A  12          2H5*        A  12   7.223  -3.961   7.560
  121    H4*    A  12           H4*        A  12   9.364  -1.784   7.343
  122    H3*    A  12           H3*        A  12   6.332  -1.768   7.732
  123    H2*    A  12           H2*        A  12   6.257   0.254   6.519
  124   2HO*    A  12          2HO*        A  12   8.067   1.566   6.202
  125    H1*    A  12           H1*        A  12   8.556  -0.425   4.902
  126    H8     A  12           H8         A  12   6.138  -3.140   4.277
  127   1H6     A  12          1H6         A  12   3.711   0.510  -0.100
  128   2H6     A  12          2H6         A  12   3.803  -1.123   0.527
  129    H2     A  12           H2         A  12   6.249   3.069   2.549
  130   1H5*    A  13          1H5*        A  13   4.164   1.380   9.785
  131   2H5*    A  13          2H5*        A  13   4.424   0.530   8.247
  132    H4*    A  13           H4*        A  13   4.950   3.518   8.667
  133    H3*    A  13           H3*        A  13   2.553   1.992   7.604
  134    H2*    A  13           H2*        A  13   2.102   3.872   6.245
  135   2HO*    A  13          2HO*        A  13   3.251   5.825   6.445
  136    H1*    A  13           H1*        A  13   4.744   4.199   5.442
  137    H8     A  13           H8         A  13   3.783   0.574   5.747
  138   1H6     A  13          1H6         A  13   0.641   1.189   0.414
  139   2H6     A  13          2H6         A  13   1.281   0.035   1.567
  140    H2     A  13           H2         A  13   1.827   5.254   1.807
  141   1H5*    A  14          1H5*        A  14   1.297   6.070   8.537
  142   2H5*    A  14          2H5*        A  14  -0.371   6.117   9.123
  143    H4*    A  14           H4*        A  14   0.116   7.511   7.068
  144    H3*    A  14           H3*        A  14  -1.993   5.333   6.897
  145    H2*    A  14           H2*        A  14  -2.537   6.248   4.701
  146   2HO*    A  14          2HO*        A  14  -0.690   8.320   5.348
  147    H1*    A  14           H1*        A  14   0.062   6.379   3.913
  148    H8     A  14           H8         A  14   0.143   3.131   5.779
  149   1H6     A  14          1H6         A  14  -2.583   0.759   0.732
  150   2H6     A  14          2H6         A  14  -1.655   0.385   2.170
  151    H2     A  14           H2         A  14  -3.208   5.208   0.730
  152   1H5*    G  15          1H5*        G  15  -3.787   8.833   4.952
  153   2H5*    G  15          2H5*        G  15  -5.400   9.010   5.642
  154    H4*    G  15           H4*        G  15  -5.604   8.899   3.244
  155    H3*    G  15           H3*        G  15  -6.431   6.290   4.556
  156    H2*    G  15           H2*        G  15  -7.526   5.798   2.579
  157   2HO*    G  15          2HO*        G  15  -8.072   8.196   2.202
  158    H1*    G  15           H1*        G  15  -5.323   6.514   1.071
  159    H8     G  15           H8         G  15  -4.408   4.886   4.320
  160    H1     G  15           H1         G  15  -6.736   0.727  -0.013
  161   1H2     G  15          1H2         G  15  -7.939   3.648  -1.544
  162   2H2     G  15          2H2         G  15  -7.894   1.896  -1.565
  163   1H5*    C  16          1H5*        C  16  -9.937   7.659   2.361
  164   2H5*    C  16          2H5*        C  16 -11.387   7.424   3.343
  165    H4*    C  16           H4*        C  16 -11.468   6.263   1.119
  166    H3*    C  16           H3*        C  16 -11.539   4.543   3.625
  167    H2*    C  16           H2*        C  16 -12.087   2.707   2.195
  168   2HO*    C  16          2HO*        C  16 -13.578   3.815   0.876
  169    H1*    C  16           H1*        C  16 -10.251   3.517   0.191
  170   1H4     C  16          1H4         C  16  -6.989  -0.110   4.752
  171   2H4     C  16          2H4         C  16  -7.646  -1.251   3.591
  172    H5     C  16           H5         C  16  -7.537   2.309   4.676
  173    H6     C  16           H6         C  16  -8.691   4.008   3.431
  174   1H5*    C  17          1H5*        C  17 -16.265   2.334   3.563
  175   2H5*    C  17          2H5*        C  17 -14.663   1.857   4.159
  176    H4*    C  17           H4*        C  17 -15.845   1.184   1.421
  177    H3*    C  17           H3*        C  17 -15.225  -0.400   3.954
  178    H2*    C  17           H2*        C  17 -14.814  -2.307   2.631
  179   2HO*    C  17          2HO*        C  17 -15.194  -2.251   0.348
  180    H1*    C  17           H1*        C  17 -13.332  -0.913   0.715
  181   1H4     C  17          1H4         C  17  -9.234  -1.850   5.876
  182   2H4     C  17          2H4         C  17  -9.137  -3.312   4.917
  183    H5     C  17           H5         C  17 -10.874  -0.054   5.400
  184    H6     C  17           H6         C  17 -12.643   0.631   3.911
  185    H3T    C  17           H3T        C  17 -17.250  -1.359   3.337
  Start of MODEL    7
    1   1H5*    G   1          1H5*        G   1  -5.133 -13.932  -0.126
    2   2H5*    G   1          2H5*        G   1  -4.453 -12.977   1.207
    3    H4*    G   1           H4*        G   1  -7.405 -12.951   0.362
    4    H3*    G   1           H3*        G   1  -5.138 -10.984  -0.117
    5    H2*    G   1           H2*        G   1  -6.770  -9.284  -0.178
    6   2HO*    G   1          2HO*        G   1  -8.268 -10.027  -1.574
    7    H1*    G   1           H1*        G   1  -8.504 -10.767   1.653
    8    H8     G   1           H8         G   1  -5.176  -9.858   3.208
    9    H1     G   1           H1         G   1  -9.427  -5.005   3.190
   10   1H2     G   1          1H2         G   1 -11.187  -7.027   0.941
   11   2H2     G   1          2H2         G   1 -11.114  -5.496   1.792
   12    H5T    G   1           H5T        G   1  -6.531 -14.905   1.409
   13   1H5*    G   2          1H5*        G   2  -8.484 -10.705  -3.468
   14   2H5*    G   2          2H5*        G   2  -7.643 -10.073  -4.893
   15    H4*    G   2           H4*        G   2  -9.643  -8.727  -4.292
   16    H3*    G   2           H3*        G   2  -6.962  -7.321  -3.953
   17    H2*    G   2           H2*        G   2  -8.245  -5.332  -3.662
   18   2HO*    G   2          2HO*        G   2  -9.731  -6.009  -5.452
   19    H1*    G   2           H1*        G   2 -10.284  -6.616  -2.214
   20    H8     G   2           H8         G   2  -6.833  -7.467  -0.896
   21    H1     G   2           H1         G   2  -9.091  -1.790   1.161
   22   1H2     G   2          1H2         G   2 -11.410  -2.186  -1.438
   23   2H2     G   2          2H2         G   2 -10.789  -1.148  -0.168
   24   1H5*    C   3          1H5*        C   3  -9.395  -4.729  -6.860
   25   2H5*    C   3          2H5*        C   3  -8.174  -3.986  -7.901
   26    H4*    C   3           H4*        C   3  -9.521  -2.312  -6.618
   27    H3*    C   3           H3*        C   3  -6.561  -2.493  -5.950
   28    H2*    C   3           H2*        C   3  -6.850  -0.553  -4.660
   29   2HO*    C   3          2HO*        C   3  -8.698   0.748  -4.781
   30    H1*    C   3           H1*        C   3  -9.442  -1.310  -3.747
   31   1H4     C   3          1H4         C   3  -4.186  -3.156   0.052
   32   2H4     C   3          2H4         C   3  -4.883  -1.725   0.789
   33    H5     C   3           H5         C   3  -5.044  -4.076  -2.115
   34    H6     C   3           H6         C   3  -6.726  -3.804  -3.810
   35   1H5*    U   4          1H5*        U   4  -7.725   1.727  -7.339
   36   2H5*    U   4          2H5*        U   4  -6.379   2.350  -8.305
   37    H4*    U   4           H4*        U   4  -7.072   3.920  -6.549
   38    H3*    U   4           H3*        U   4  -4.296   2.733  -6.185
   39    H2*    U   4           H2*        U   4  -4.018   4.475  -4.470
   40   2HO*    U   4          2HO*        U   4  -6.548   5.430  -5.319
   41    H1*    U   4           H1*        U   4  -6.395   3.907  -3.319
   42    H3     U   4           H3         U   4  -3.335   2.141  -0.458
   43    H5     U   4           H5         U   4  -3.973  -0.847  -3.363
   44    H6     U   4           H6         U   4  -5.146   0.766  -4.693
   45   1H5*    U   5          1H5*        U   5  -3.833   7.022  -5.986
   46   2H5*    U   5          2H5*        U   5  -2.358   7.492  -6.840
   47    H4*    U   5           H4*        U   5  -2.344   8.288  -4.540
   48    H3*    U   5           H3*        U   5  -0.316   6.065  -5.050
   49    H2*    U   5           H2*        U   5   0.612   6.840  -2.881
   50   2HO*    U   5          2HO*        U   5  -0.026   9.099  -3.361
   51    H1*    U   5           H1*        U   5  -1.776   6.732  -1.702
   52    H3     U   5           H3         U   5   0.263   2.990  -0.169
   53    H5     U   5           H5         U   5  -1.418   1.868  -3.877
   54    H6     U   5           H6         U   5  -1.955   4.153  -4.277
   55   1H5*    U   6          1H5*        U   6   1.938   9.371  -3.328
   56   2H5*    U   6          2H5*        U   6   3.488   9.494  -4.171
   57    H4*    U   6           H4*        U   6   3.762   9.155  -1.731
   58    H3*    U   6           H3*        U   6   4.686   6.858  -3.500
   59    H2*    U   6           H2*        U   6   5.714   5.983  -1.534
   60   2HO*    U   6          2HO*        U   6   5.771   7.153   0.411
   61    H1*    U   6           H1*        U   6   3.500   6.572   0.092
   62    H3     U   6           H3         U   6   4.288   2.016  -0.362
   63    H5     U   6           H5         U   6   1.749   3.100  -3.550
   64    H6     U   6           H6         U   6   2.059   5.401  -2.953
   65   1H5*    G   7          1H5*        G   7   8.100   7.538  -1.047
   66   2H5*    G   7          2H5*        G   7   9.552   7.477  -2.058
   67    H4*    G   7           H4*        G   7   9.603   5.744  -0.308
   68    H3*    G   7           H3*        G   7   9.323   4.736  -3.165
   69    H2*    G   7           H2*        G   7   9.646   2.497  -2.254
   70   2HO*    G   7          2HO*        G   7  11.289   3.145  -0.747
   71    H1*    G   7           H1*        G   7   7.929   2.867  -0.171
   72    H8     G   7           H8         G   7   6.490   4.707  -3.203
   73    H1     G   7           H1         G   7   5.285  -1.617  -3.123
   74   1H2     G   7          1H2         G   7   7.547  -1.689  -0.459
   75   2H2     G   7          2H2         G   7   6.466  -2.591  -1.497
   76   1H5*    G   8          1H5*        G   8  12.902   1.949  -4.803
   77   2H5*    G   8          2H5*        G   8  11.547   2.800  -5.579
   78    H4*    G   8           H4*        G   8  11.176   0.545  -3.596
   79    H3*    G   8           H3*        G   8  12.223   0.111  -6.049
   80    H2*    G   8           H2*        G   8  10.373   1.354  -7.148
   81   2HO*    G   8          2HO*        G   8   9.455  -1.331  -7.264
   82    H1*    G   8           H1*        G   8   8.657  -0.275  -5.206
   83    H8     G   8           H8         G   8   8.253   3.316  -6.062
   84    H1     G   8           H1         G   8   3.420  -0.510  -7.948
   85   1H2     G   8          1H2         G   8   5.545  -3.051  -6.775
   86   2H2     G   8          2H2         G   8   3.990  -2.658  -7.486
   87   1H5*    A   9          1H5*        A   9  12.547  -5.676  -5.022
   88   2H5*    A   9          2H5*        A   9  11.033  -5.352  -5.848
   89    H4*    A   9           H4*        A   9  10.696  -6.118  -3.521
   90    H3*    A   9           H3*        A   9   9.996  -3.199  -3.917
   91    H2*    A   9           H2*        A   9   9.126  -3.216  -1.694
   92   2HO*    A   9          2HO*        A   9   9.420  -6.048  -1.842
   93    H1*    A   9           H1*        A   9  11.256  -4.735  -0.706
   94    H8     A   9           H8         A   9  10.870  -1.420  -2.851
   95   1H6     A   9          1H6         A   9  13.670   1.354  -0.023
   96   2H6     A   9          2H6         A   9  14.745   1.004   1.318
   97    H2     A   9           H2         A   9  14.506  -3.372   2.118
   98   1H5*    U  10          1H5*        U  10   6.544  -6.141  -2.708
   99   2H5*    U  10          2H5*        U  10   4.981  -5.327  -2.924
  100    H4*    U  10           H4*        U  10   6.704  -5.267  -0.395
  101    H3*    U  10           H3*        U  10   4.736  -7.211  -1.313
  102    H2*    U  10           H2*        U  10   2.932  -5.984  -0.821
  103   2HO*    U  10          2HO*        U  10   3.705  -6.920   1.731
  104    H1*    U  10           H1*        U  10   4.463  -4.617   1.439
  105    H3     U  10           H3         U  10   0.703  -1.991   2.196
  106    H5     U  10           H5         U  10   0.742  -2.522  -2.000
  107    H6     U  10           H6         U  10   2.731  -3.852  -1.762
  108   1H5*    A  11          1H5*        A  11   9.792  -8.400   0.990
  109   2H5*    A  11          2H5*        A  11   8.872  -8.823   2.448
  110    H4*    A  11           H4*        A  11  10.861  -7.610   3.092
  111    H3*    A  11           H3*        A  11   8.353  -5.897   3.335
  112    H2*    A  11           H2*        A  11   9.750  -4.329   4.486
  113   2HO*    A  11          2HO*        A  11  11.876  -4.859   5.090
  114    H1*    A  11           H1*        A  11  11.898  -4.657   2.730
  115    H8     A  11           H8         A  11   8.443  -4.541   1.085
  116   1H6     A  11          1H6         A  11   9.406   1.593   0.718
  117   2H6     A  11          2H6         A  11   8.408   0.281   0.124
  118    H2     A  11           H2         A  11  12.343  -0.085   3.594
  119   1H5*    A  12          1H5*        A  12   6.745  -4.467   7.543
  120   2H5*    A  12          2H5*        A  12   6.395  -4.312   5.813
  121    H4*    A  12           H4*        A  12   8.518  -2.734   7.336
  122    H3*    A  12           H3*        A  12   5.737  -2.110   6.296
  123    H2*    A  12           H2*        A  12   6.437   0.153   5.817
  124   2HO*    A  12          2HO*        A  12   8.851  -0.552   7.149
  125    H1*    A  12           H1*        A  12   8.722  -0.620   4.523
  126    H8     A  12           H8         A  12   6.557  -3.522   3.637
  127   1H6     A  12          1H6         A  12   3.972  -1.511   0.043
  128   2H6     A  12          2H6         A  12   3.750   0.137  -0.506
  129    H2     A  12           H2         A  12   6.288   2.732   2.103
  130   1H5*    A  13          1H5*        A  13   6.544   1.410   8.518
  131   2H5*    A  13          2H5*        A  13   5.186   1.710   9.620
  132    H4*    A  13           H4*        A  13   5.523   3.639   8.168
  133    H3*    A  13           H3*        A  13   3.028   2.029   7.480
  134    H2*    A  13           H2*        A  13   2.442   3.858   6.089
  135   2HO*    A  13          2HO*        A  13   3.274   5.465   7.687
  136    H1*    A  13           H1*        A  13   5.015   4.159   5.050
  137    H8     A  13           H8         A  13   4.016   0.533   5.481
  138   1H6     A  13          1H6         A  13   0.855   1.098   0.155
  139   2H6     A  13          2H6         A  13   1.566  -0.038   1.284
  140    H2     A  13           H2         A  13   1.918   5.189   1.592
  141   1H5*    A  14          1H5*        A  14   1.638   6.190   8.427
  142   2H5*    A  14          2H5*        A  14   0.006   6.081   9.095
  143    H4*    A  14           H4*        A  14   0.276   7.451   6.971
  144    H3*    A  14           H3*        A  14  -1.664   5.110   6.954
  145    H2*    A  14           H2*        A  14  -2.399   6.019   4.797
  146   2HO*    A  14          2HO*        A  14  -1.965   8.279   5.643
  147    H1*    A  14           H1*        A  14   0.152   6.339   3.885
  148    H8     A  14           H8         A  14   0.479   3.054   5.671
  149   1H6     A  14          1H6         A  14  -2.290   0.652   0.657
  150   2H6     A  14          2H6         A  14  -1.283   0.293   2.042
  151    H2     A  14           H2         A  14  -3.175   5.050   0.803
  152   1H5*    G  15          1H5*        G  15  -3.844   8.553   5.143
  153   2H5*    G  15          2H5*        G  15  -5.430   8.558   5.912
  154    H4*    G  15           H4*        G  15  -5.706   8.511   3.513
  155    H3*    G  15           H3*        G  15  -6.299   5.821   4.784
  156    H2*    G  15           H2*        G  15  -7.419   5.281   2.840
  157   2HO*    G  15          2HO*        G  15  -6.991   7.986   1.988
  158    H1*    G  15           H1*        G  15  -5.327   6.191   1.273
  159    H8     G  15           H8         G  15  -4.191   4.554   4.454
  160    H1     G  15           H1         G  15  -6.428   0.355   0.108
  161   1H2     G  15          1H2         G  15  -7.779   3.244  -1.359
  162   2H2     G  15          2H2         G  15  -7.653   1.498  -1.413
  163   1H5*    C  16          1H5*        C  16  -9.882   7.149   2.725
  164   2H5*    C  16          2H5*        C  16 -11.332   6.813   3.677
  165    H4*    C  16           H4*        C  16 -11.377   5.826   1.375
  166    H3*    C  16           H3*        C  16 -11.443   3.918   3.739
  167    H2*    C  16           H2*        C  16 -11.962   2.184   2.154
  168   2HO*    C  16          2HO*        C  16 -12.340   4.289   0.281
  169    H1*    C  16           H1*        C  16 -10.084   3.130   0.272
  170   1H4     C  16          1H4         C  16  -6.736  -0.628   4.634
  171   2H4     C  16          2H4         C  16  -7.368  -1.730   3.423
  172    H5     C  16           H5         C  16  -7.368   1.768   4.695
  173    H6     C  16           H6         C  16  -8.593   3.489   3.557
  174   1H5*    C  17          1H5*        C  17 -15.968   1.593   3.874
  175   2H5*    C  17          2H5*        C  17 -14.307   1.205   4.364
  176    H4*    C  17           H4*        C  17 -15.607   0.482   1.692
  177    H3*    C  17           H3*        C  17 -14.834  -1.093   4.190
  178    H2*    C  17           H2*        C  17 -14.450  -2.987   2.823
  179   2HO*    C  17          2HO*        C  17 -16.259  -2.715   1.429
  180    H1*    C  17           H1*        C  17 -13.093  -1.542   0.857
  181   1H4     C  17          1H4         C  17  -8.777  -2.457   5.857
  182   2H4     C  17          2H4         C  17  -8.680  -3.900   4.868
  183    H5     C  17           H5         C  17 -10.462  -0.685   5.459
  184    H6     C  17           H6         C  17 -12.293  -0.014   4.043
  185    H3T    C  17           H3T        C  17 -17.083  -1.154   2.448
  Start of MODEL    8
    1   1H5*    G   1          1H5*        G   1  -4.838 -13.588  -0.422
    2   2H5*    G   1          2H5*        G   1  -4.241 -12.649   0.960
    3    H4*    G   1           H4*        G   1  -7.153 -12.672  -0.013
    4    H3*    G   1           H3*        G   1  -4.915 -10.644  -0.350
    5    H2*    G   1           H2*        G   1  -6.574  -8.982  -0.436
    6   2HO*    G   1          2HO*        G   1  -7.985  -9.717  -1.928
    7    H1*    G   1           H1*        G   1  -8.363 -10.556   1.263
    8    H8     G   1           H8         G   1  -5.169  -9.590   3.033
    9    H1     G   1           H1         G   1  -9.547  -4.851   2.852
   10   1H2     G   1          1H2         G   1 -11.093  -6.862   0.439
   11   2H2     G   1          2H2         G   1 -11.125  -5.354   1.332
   12    H5T    G   1           H5T        G   1  -6.277 -14.629   1.027
   13   1H5*    G   2          1H5*        G   2  -8.096 -10.290  -3.860
   14   2H5*    G   2          2H5*        G   2  -7.188  -9.589  -5.209
   15    H4*    G   2           H4*        G   2  -9.231  -8.280  -4.631
   16    H3*    G   2           H3*        G   2  -6.573  -6.886  -4.129
   17    H2*    G   2           H2*        G   2  -7.856  -4.917  -3.788
   18   2HO*    G   2          2HO*        G   2 -10.002  -4.739  -4.374
   19    H1*    G   2           H1*        G   2  -9.959  -6.275  -2.490
   20    H8     G   2           H8         G   2  -6.559  -7.154  -1.053
   21    H1     G   2           H1         G   2  -8.939  -1.561   1.089
   22   1H2     G   2          1H2         G   2 -11.187  -1.910  -1.580
   23   2H2     G   2          2H2         G   2 -10.614  -0.905  -0.261
   24   1H5*    C   3          1H5*        C   3  -8.998  -4.274  -6.868
   25   2H5*    C   3          2H5*        C   3  -7.854  -3.420  -7.913
   26    H4*    C   3           H4*        C   3  -9.245  -1.862  -6.555
   27    H3*    C   3           H3*        C   3  -6.272  -1.925  -5.917
   28    H2*    C   3           H2*        C   3  -6.637  -0.070  -4.530
   29   2HO*    C   3          2HO*        C   3  -7.961   1.106  -6.007
   30    H1*    C   3           H1*        C   3  -9.187  -0.961  -3.637
   31   1H4     C   3          1H4         C   3  -3.862  -2.811   0.058
   32   2H4     C   3          2H4         C   3  -4.595  -1.428   0.853
   33    H5     C   3           H5         C   3  -4.687  -3.642  -2.165
   34    H6     C   3           H6         C   3  -6.387  -3.349  -3.832
   35   1H5*    U   4          1H5*        U   4  -7.544   2.462  -7.289
   36   2H5*    U   4          2H5*        U   4  -6.099   3.069  -8.106
   37    H4*    U   4           H4*        U   4  -6.944   4.545  -6.271
   38    H3*    U   4           H3*        U   4  -4.143   3.398  -5.961
   39    H2*    U   4           H2*        U   4  -3.935   5.063  -4.149
   40   2HO*    U   4          2HO*        U   4  -5.334   6.601  -5.377
   41    H1*    U   4           H1*        U   4  -6.310   4.346  -3.054
   42    H3     U   4           H3         U   4  -3.193   2.549  -0.268
   43    H5     U   4           H5         U   4  -3.752  -0.329  -3.298
   44    H6     U   4           H6         U   4  -4.980   1.304  -4.553
   45   1H5*    U   5          1H5*        U   5  -3.761   7.769  -5.471
   46   2H5*    U   5          2H5*        U   5  -2.284   8.262  -6.307
   47    H4*    U   5           H4*        U   5  -2.267   8.960  -3.969
   48    H3*    U   5           H3*        U   5  -0.249   6.764  -4.602
   49    H2*    U   5           H2*        U   5   0.716   7.429  -2.435
   50   2HO*    U   5          2HO*        U   5  -0.185   9.106  -1.258
   51    H1*    U   5           H1*        U   5  -1.687   7.330  -1.219
   52    H3     U   5           H3         U   5   0.445   3.585   0.221
   53    H5     U   5           H5         U   5  -1.241   2.518  -3.502
   54    H6     U   5           H6         U   5  -1.852   4.796  -3.834
   55   1H5*    U   6          1H5*        U   6   2.023   9.981  -2.816
   56   2H5*    U   6          2H5*        U   6   3.554  10.156  -3.689
   57    H4*    U   6           H4*        U   6   3.951   9.698  -1.302
   58    H3*    U   6           H3*        U   6   4.607   7.326  -3.074
   59    H2*    U   6           H2*        U   6   5.793   6.483  -1.208
   60   2HO*    U   6          2HO*        U   6   5.915   7.571   0.761
   61    H1*    U   6           H1*        U   6   3.626   7.101   0.474
   62    H3     U   6           H3         U   6   4.545   2.569  -0.086
   63    H5     U   6           H5         U   6   1.894   3.618  -3.194
   64    H6     U   6           H6         U   6   2.100   5.924  -2.524
   65   1H5*    G   7          1H5*        G   7   9.604   7.796  -2.922
   66   2H5*    G   7          2H5*        G   7   8.049   7.059  -3.318
   67    H4*    G   7           H4*        G   7   9.817   6.369  -0.926
   68    H3*    G   7           H3*        G   7   9.072   4.974  -3.514
   69    H2*    G   7           H2*        G   7   9.313   2.817  -2.327
   70   2HO*    G   7          2HO*        G   7  10.175   4.410  -0.138
   71    H1*    G   7           H1*        G   7   7.647   3.566  -0.380
   72    H8     G   7           H8         G   7   6.320   5.629  -3.252
   73    H1     G   7           H1         G   7   5.113  -0.661  -3.906
   74   1H2     G   7          1H2         G   7   6.118  -1.793  -2.219
   75   2H2     G   7          2H2         G   7   7.091  -0.976  -1.019
   76   1H5*    G   8          1H5*        G   8  11.656   1.647  -5.441
   77   2H5*    G   8          2H5*        G   8  10.650   2.816  -6.326
   78    H4*    G   8           H4*        G   8   9.510   0.841  -4.302
   79    H3*    G   8           H3*        G   8  10.599  -0.092  -6.581
   80    H2*    G   8           H2*        G   8   9.444   1.660  -7.943
   81   2HO*    G   8          2HO*        G   8   7.677   0.446  -9.019
   82    H1*    G   8           H1*        G   8   6.970   0.738  -6.395
   83    H8     G   8           H8         G   8   7.497   4.371  -6.373
   84    H1     G   8           H1         G   8   3.833   2.556 -11.359
   85   1H2     G   8          1H2         G   8   3.973   0.313 -11.609
   86   2H2     G   8          2H2         G   8   4.960  -0.664 -10.539
   87   1H5*    A   9          1H5*        A   9  10.525  -4.798  -5.642
   88   2H5*    A   9          2H5*        A   9   8.839  -5.223  -6.013
   89    H4*    A   9           H4*        A   9   9.587  -6.313  -3.944
   90    H3*    A   9           H3*        A   9   7.176  -4.832  -4.233
   91    H2*    A   9           H2*        A   9   7.752  -2.981  -3.199
   92   2HO*    A   9          2HO*        A   9   6.149  -4.111  -1.874
   93    H1*    A   9           H1*        A   9   9.440  -4.410  -1.112
   94    H8     A   9           H8         A   9   9.005  -1.272  -3.383
   95   1H6     A   9          1H6         A   9  12.087   1.665  -1.023
   96   2H6     A   9          2H6         A   9  13.288   1.386   0.223
   97    H2     A   9           H2         A   9  13.135  -2.941   1.285
   98   1H5*    U  10          1H5*        U  10   6.473 -10.354  -2.855
   99   2H5*    U  10          2H5*        U  10   4.885  -9.580  -2.672
  100    H4*    U  10           H4*        U  10   5.081  -9.745  -0.196
  101    H3*    U  10           H3*        U  10   7.676 -11.193  -0.874
  102    H2*    U  10           H2*        U  10   7.302 -12.533   1.076
  103   2HO*    U  10          2HO*        U  10   6.700 -10.843   2.474
  104    H1*    U  10           H1*        U  10   4.486 -12.644   0.650
  105    H3     U  10           H3         U  10   5.815 -17.031   0.173
  106    H5     U  10           H5         U  10   7.666 -15.066  -3.068
  107    H6     U  10           H6         U  10   6.827 -12.975  -2.225
  108   1H5*    A  11          1H5*        A  11   8.211  -8.179   3.515
  109   2H5*    A  11          2H5*        A  11   7.605  -7.249   2.127
  110    H4*    A  11           H4*        A  11  10.176  -6.675   3.690
  111    H3*    A  11           H3*        A  11   7.470  -5.281   3.687
  112    H2*    A  11           H2*        A  11   8.657  -3.369   4.409
  113   2HO*    A  11          2HO*        A  11  10.806  -5.129   5.029
  114    H1*    A  11           H1*        A  11  10.968  -4.061   2.826
  115    H8     A  11           H8         A  11   7.686  -3.854   0.933
  116   1H6     A  11          1H6         A  11   7.996   0.912  -0.293
  117   2H6     A  11          2H6         A  11   9.037   2.188   0.304
  118    H2     A  11           H2         A  11  11.607   0.547   3.509
  119   1H5*    A  12          1H5*        A  12   9.125  -3.769   7.355
  120   2H5*    A  12          2H5*        A  12   7.784  -3.552   8.488
  121    H4*    A  12           H4*        A  12   8.915  -1.428   7.935
  122    H3*    A  12           H3*        A  12   6.054  -1.667   6.944
  123    H2*    A  12           H2*        A  12   6.215   0.711   6.427
  124   2HO*    A  12          2HO*        A  12   8.732   0.617   7.747
  125    H1*    A  12           H1*        A  12   8.679   0.424   5.204
  126    H8     A  12           H8         A  12   6.445  -2.645   4.520
  127   1H6     A  12          1H6         A  12   4.148   0.660  -0.206
  128   2H6     A  12          2H6         A  12   4.223  -0.927   0.537
  129    H2     A  12           H2         A  12   6.650   3.393   2.281
  130   1H5*    A  13          1H5*        A  13   6.373   2.043   9.257
  131   2H5*    A  13          2H5*        A  13   4.903   2.237  10.222
  132    H4*    A  13           H4*        A  13   5.299   4.186   8.780
  133    H3*    A  13           H3*        A  13   2.897   2.492   7.993
  134    H2*    A  13           H2*        A  13   2.305   4.295   6.557
  135   2HO*    A  13          2HO*        A  13   4.334   5.796   7.878
  136    H1*    A  13           H1*        A  13   4.927   4.694   5.661
  137    H8     A  13           H8         A  13   3.983   1.024   5.985
  138   1H6     A  13          1H6         A  13   1.145   1.604   0.482
  139   2H6     A  13          2H6         A  13   1.798   0.456   1.635
  140    H2     A  13           H2         A  13   2.074   5.687   2.004
  141   1H5*    A  14          1H5*        A  14   1.476   6.570   8.766
  142   2H5*    A  14          2H5*        A  14  -0.141   6.526   9.486
  143    H4*    A  14           H4*        A  14   0.012   7.827   7.337
  144    H3*    A  14           H3*        A  14  -1.788   5.376   7.349
  145    H2*    A  14           H2*        A  14  -2.588   6.180   5.204
  146   2HO*    A  14          2HO*        A  14  -1.919   8.176   4.390
  147    H1*    A  14           H1*        A  14  -0.038   6.786   4.308
  148    H8     A  14           H8         A  14   0.467   3.430   5.909
  149   1H6     A  14          1H6         A  14  -2.152   1.136   0.770
  150   2H6     A  14          2H6         A  14  -1.123   0.769   2.139
  151    H2     A  14           H2         A  14  -3.272   5.474   1.137
  152   1H5*    G  15          1H5*        G  15  -4.154   8.762   5.641
  153   2H5*    G  15          2H5*        G  15  -5.740   8.657   6.403
  154    H4*    G  15           H4*        G  15  -6.041   8.687   4.008
  155    H3*    G  15           H3*        G  15  -6.431   5.897   5.143
  156    H2*    G  15           H2*        G  15  -7.548   5.409   3.175
  157   2HO*    G  15          2HO*        G  15  -7.895   6.990   1.548
  158    H1*    G  15           H1*        G  15  -5.517   6.545   1.660
  159    H8     G  15           H8         G  15  -4.285   4.758   4.738
  160    H1     G  15           H1         G  15  -6.271   0.742   0.106
  161   1H2     G  15          1H2         G  15  -7.754   3.642  -1.202
  162   2H2     G  15          2H2         G  15  -7.537   1.910  -1.358
  163   1H5*    C  16          1H5*        C  16 -10.145   7.090   3.223
  164   2H5*    C  16          2H5*        C  16 -11.551   6.549   4.148
  165    H4*    C  16           H4*        C  16 -11.531   5.741   1.784
  166    H3*    C  16           H3*        C  16 -11.336   3.610   3.941
  167    H2*    C  16           H2*        C  16 -11.804   2.040   2.135
  168   2HO*    C  16          2HO*        C  16 -12.208   2.791   0.039
  169    H1*    C  16           H1*        C  16  -9.930   3.268   0.463
  170   1H4     C  16          1H4         C  16  -6.509  -0.534   4.741
  171   2H4     C  16          2H4         C  16  -7.037  -1.599   3.449
  172    H5     C  16           H5         C  16  -7.281   1.820   4.903
  173    H6     C  16           H6         C  16  -8.577   3.523   3.819
  174   1H5*    C  17          1H5*        C  17 -14.738   2.667   1.354
  175   2H5*    C  17          2H5*        C  17 -16.101   2.137   2.352
  176    H4*    C  17           H4*        C  17 -15.558   0.482   0.616
  177    H3*    C  17           H3*        C  17 -14.948  -0.431   3.469
  178    H2*    C  17           H2*        C  17 -14.661  -2.618   2.539
  179   2HO*    C  17          2HO*        C  17 -15.686  -1.555   0.108
  180    H1*    C  17           H1*        C  17 -13.238  -1.618   0.309
  181   1H4     C  17          1H4         C  17  -8.941  -2.136   5.401
  182   2H4     C  17          2H4         C  17  -8.843  -3.641   4.510
  183    H5     C  17           H5         C  17 -10.619  -0.390   4.877
  184    H6     C  17           H6         C  17 -12.413   0.209   3.395
  185    H3T    C  17           H3T        C  17 -17.111   0.173   3.037
  Start of MODEL    9
    1   1H5*    G   1          1H5*        G   1  -5.364 -13.430   2.762
    2   2H5*    G   1          2H5*        G   1  -4.547 -13.144   1.214
    3    H4*    G   1           H4*        G   1  -6.986 -12.822   1.014
    4    H3*    G   1           H3*        G   1  -5.346 -10.268   0.791
    5    H2*    G   1           H2*        G   1  -7.395  -9.199   0.078
    6   2HO*    G   1          2HO*        G   1  -8.481 -11.827  -0.036
    7    H1*    G   1           H1*        G   1  -8.917 -10.442   2.024
    8    H8     G   1           H8         G   1  -5.620  -9.465   3.643
    9    H1     G   1           H1         G   1  -9.900  -4.662   3.163
   10   1H2     G   1          1H2         G   1 -11.504  -6.799   0.900
   11   2H2     G   1          2H2         G   1 -11.496  -5.233   1.687
   12    H5T    G   1           H5T        G   1  -3.463 -12.139   2.931
   13   1H5*    G   2          1H5*        G   2  -7.942 -10.636  -2.796
   14   2H5*    G   2          2H5*        G   2  -7.042 -10.032  -4.193
   15    H4*    G   2           H4*        G   2  -9.183  -8.830  -3.889
   16    H3*    G   2           H3*        G   2  -6.658  -7.199  -3.408
   17    H2*    G   2           H2*        G   2  -8.069  -5.298  -3.305
   18   2HO*    G   2          2HO*        G   2  -9.390  -6.200  -5.165
   19    H1*    G   2           H1*        G   2 -10.122  -6.569  -1.917
   20    H8     G   2           H8         G   2  -6.744  -7.356  -0.428
   21    H1     G   2           H1         G   2  -9.017  -1.569   1.261
   22   1H2     G   2          1H2         G   2 -11.258  -2.081  -1.383
   23   2H2     G   2          2H2         G   2 -10.658  -0.981  -0.155
   24   1H5*    C   3          1H5*        C   3  -8.985  -4.862  -6.513
   25   2H5*    C   3          2H5*        C   3  -7.749  -4.131  -7.545
   26    H4*    C   3           H4*        C   3  -9.182  -2.439  -6.398
   27    H3*    C   3           H3*        C   3  -6.244  -2.516  -5.621
   28    H2*    C   3           H2*        C   3  -6.615  -0.553  -4.402
   29   2HO*    C   3          2HO*        C   3  -9.073  -0.311  -5.827
   30    H1*    C   3           H1*        C   3  -9.216  -1.300  -3.543
   31   1H4     C   3          1H4         C   3  -4.014  -2.928   0.423
   32   2H4     C   3          2H4         C   3  -4.721  -1.460   1.074
   33    H5     C   3           H5         C   3  -4.854  -3.973  -1.692
   34    H6     C   3           H6         C   3  -6.509  -3.779  -3.432
   35   1H5*    U   4          1H5*        U   4  -7.393   1.637  -7.134
   36   2H5*    U   4          2H5*        U   4  -6.023   2.262  -8.062
   37    H4*    U   4           H4*        U   4  -6.786   3.825  -6.301
   38    H3*    U   4           H3*        U   4  -3.994   2.680  -5.914
   39    H2*    U   4           H2*        U   4  -3.781   4.433  -4.205
   40   2HO*    U   4          2HO*        U   4  -5.427   5.905  -3.863
   41    H1*    U   4           H1*        U   4  -6.167   3.818  -3.088
   42    H3     U   4           H3         U   4  -3.032   2.217  -0.195
   43    H5     U   4           H5         U   4  -3.583  -0.856  -3.030
   44    H6     U   4           H6         U   4  -4.848   0.676  -4.374
   45   1H5*    U   5          1H5*        U   5  -3.765   7.035  -5.755
   46   2H5*    U   5          2H5*        U   5  -2.269   7.582  -6.518
   47    H4*    U   5           H4*        U   5  -2.491   8.395  -4.215
   48    H3*    U   5           H3*        U   5  -0.240   6.378  -4.606
   49    H2*    U   5           H2*        U   5   0.497   7.242  -2.393
   50   2HO*    U   5          2HO*        U   5  -0.691   8.832  -1.366
   51    H1*    U   5           H1*        U   5  -1.924   6.873  -1.344
   52    H3     U   5           H3         U   5   0.436   3.360   0.268
   53    H5     U   5           H5         U   5  -0.993   2.087  -3.495
   54    H6     U   5           H6         U   5  -1.722   4.312  -3.925
   55   1H5*    U   6          1H5*        U   6   1.511   9.804  -2.740
   56   2H5*    U   6          2H5*        U   6   3.053  10.188  -3.519
   57    H4*    U   6           H4*        U   6   3.335   9.824  -1.095
   58    H3*    U   6           H3*        U   6   4.578   7.717  -2.912
   59    H2*    U   6           H2*        U   6   5.651   6.863  -0.984
   60   2HO*    U   6          2HO*        U   6   5.624   7.945   1.003
   61    H1*    U   6           H1*        U   6   3.393   7.174   0.663
   62    H3     U   6           H3         U   6   4.572   2.721   0.106
   63    H5     U   6           H5         U   6   2.017   3.686  -3.115
   64    H6     U   6           H6         U   6   2.079   5.962  -2.432
   65   1H5*    G   7          1H5*        G   7   9.306   7.438  -3.221
   66   2H5*    G   7          2H5*        G   7   7.792   6.584  -3.556
   67    H4*    G   7           H4*        G   7   9.500   6.322  -1.033
   68    H3*    G   7           H3*        G   7   8.865   4.626  -3.443
   69    H2*    G   7           H2*        G   7   9.143   2.614  -2.042
   70   2HO*    G   7          2HO*        G   7  10.828   3.588  -0.723
   71    H1*    G   7           H1*        G   7   7.354   3.534  -0.222
   72    H8     G   7           H8         G   7   5.880   5.359  -3.058
   73    H1     G   7           H1         G   7   5.376  -1.009  -3.930
   74   1H2     G   7          1H2         G   7   6.545  -2.077  -2.353
   75   2H2     G   7          2H2         G   7   7.364  -1.218  -1.063
   76   1H5*    G   8          1H5*        G   8   9.969   2.476  -5.891
   77   2H5*    G   8          2H5*        G   8   8.913   2.821  -4.523
   78    H4*    G   8           H4*        G   8   9.432   0.569  -3.591
   79    H3*    G   8           H3*        G   8  11.443   0.371  -5.391
   80    H2*    G   8           H2*        G   8   9.989   0.695  -7.333
   81   2HO*    G   8          2HO*        G   8   9.543  -1.455  -8.252
   82    H1*    G   8           H1*        G   8   8.047  -1.306  -6.082
   83    H8     G   8           H8         G   8   6.666   2.034  -6.758
   84    H1     G   8           H1         G   8   5.987  -1.905 -11.816
   85   1H2     G   8          1H2         G   8   8.253  -3.933 -10.068
   86   2H2     G   8          2H2         G   8   7.267  -3.741 -11.505
   87   1H5*    A   9          1H5*        A   9  12.619  -5.090  -4.355
   88   2H5*    A   9          2H5*        A   9  11.168  -5.757  -5.089
   89    H4*    A   9           H4*        A   9  10.763  -5.994  -2.814
   90    H3*    A   9           H3*        A   9   9.401  -3.422  -3.698
   91    H2*    A   9           H2*        A   9   8.436  -3.326  -1.531
   92   2HO*    A   9          2HO*        A   9   9.320  -6.011  -1.201
   93    H1*    A   9           H1*        A   9  10.759  -4.247  -0.225
   94    H8     A   9           H8         A   9   9.619  -1.319  -2.553
   95   1H6     A   9          1H6         A   9  13.315   2.229   0.909
   96   2H6     A   9          2H6         A   9  12.110   2.216  -0.366
   97    H2     A   9           H2         A   9  13.916  -1.995   2.204
   98   1H5*    U  10          1H5*        U  10   4.653  -5.327  -2.337
   99   2H5*    U  10          2H5*        U  10   6.189  -5.654  -1.516
  100    H4*    U  10           H4*        U  10   4.404  -7.278  -0.924
  101    H3*    U  10           H3*        U  10   6.800  -8.404  -2.430
  102    H2*    U  10           H2*        U  10   5.901 -10.573  -1.944
  103   2HO*    U  10          2HO*        U  10   4.246  -9.219  -0.072
  104    H1*    U  10           H1*        U  10   3.212  -9.713  -2.341
  105    H3     U  10           H3         U  10   3.869 -12.773  -5.720
  106    H5     U  10           H5         U  10   6.512  -9.631  -6.685
  107    H6     U  10           H6         U  10   5.897  -8.538  -4.636
  108   1H5*    A  11          1H5*        A  11   7.878  -8.318   3.011
  109   2H5*    A  11          2H5*        A  11   7.185  -7.056   1.973
  110    H4*    A  11           H4*        A  11   9.927  -6.949   3.331
  111    H3*    A  11           H3*        A  11   7.277  -5.477   3.693
  112    H2*    A  11           H2*        A  11   8.479  -3.638   4.442
  113   2HO*    A  11          2HO*        A  11   9.774  -4.776   5.972
  114    H1*    A  11           H1*        A  11  10.774  -4.191   2.781
  115    H8     A  11           H8         A  11   7.483  -3.841   0.937
  116   1H6     A  11          1H6         A  11   8.812   2.222   0.670
  117   2H6     A  11          2H6         A  11   7.821   0.955  -0.028
  118    H2     A  11           H2         A  11  11.363   0.405   3.818
  119   1H5*    A  12          1H5*        A  12   6.461  -3.800   8.266
  120   2H5*    A  12          2H5*        A  12   5.970  -3.500   6.593
  121    H4*    A  12           H4*        A  12   8.259  -2.152   8.094
  122    H3*    A  12           H3*        A  12   5.526  -1.319   7.072
  123    H2*    A  12           H2*        A  12   6.342   0.887   6.578
  124   2HO*    A  12          2HO*        A  12   8.716   0.071   7.917
  125    H1*    A  12           H1*        A  12   8.579   0.011   5.285
  126    H8     A  12           H8         A  12   6.237  -2.793   4.457
  127   1H6     A  12          1H6         A  12   4.206   0.798  -0.161
  128   2H6     A  12          2H6         A  12   4.250  -0.828   0.488
  129    H2     A  12           H2         A  12   6.473   3.399   2.677
  130   1H5*    A  13          1H5*        A  13   6.372   2.182   9.219
  131   2H5*    A  13          2H5*        A  13   5.001   2.513  10.297
  132    H4*    A  13           H4*        A  13   5.305   4.389   8.774
  133    H3*    A  13           H3*        A  13   2.874   2.682   8.093
  134    H2*    A  13           H2*        A  13   2.270   4.406   6.595
  135   2HO*    A  13          2HO*        A  13   3.334   6.400   6.541
  136    H1*    A  13           H1*        A  13   4.872   4.759   5.628
  137    H8     A  13           H8         A  13   3.958   1.114   6.177
  138   1H6     A  13          1H6         A  13   1.100   1.366   0.657
  139   2H6     A  13          2H6         A  13   1.762   0.288   1.871
  140    H2     A  13           H2         A  13   1.950   5.535   1.977
  141   1H5*    A  14          1H5*        A  14   1.464   6.787   8.671
  142   2H5*    A  14          2H5*        A  14  -0.158   6.777   9.379
  143    H4*    A  14           H4*        A  14   0.023   7.955   7.157
  144    H3*    A  14           H3*        A  14  -1.801   5.528   7.303
  145    H2*    A  14           H2*        A  14  -2.577   6.211   5.105
  146   2HO*    A  14          2HO*        A  14  -1.877   8.141   4.176
  147    H1*    A  14           H1*        A  14  -0.018   6.712   4.188
  148    H8     A  14           H8         A  14   0.415   3.469   6.040
  149   1H6     A  14          1H6         A  14  -2.145   0.865   1.015
  150   2H6     A  14          2H6         A  14  -1.148   0.576   2.426
  151    H2     A  14           H2         A  14  -3.213   5.231   1.072
  152   1H5*    G  15          1H5*        G  15  -4.091   8.859   5.381
  153   2H5*    G  15          2H5*        G  15  -5.697   8.816   6.105
  154    H4*    G  15           H4*        G  15  -5.919   8.731   3.696
  155    H3*    G  15           H3*        G  15  -6.432   6.026   4.974
  156    H2*    G  15           H2*        G  15  -7.499   5.453   3.002
  157   2HO*    G  15          2HO*        G  15  -7.738   6.942   1.272
  158    H1*    G  15           H1*        G  15  -5.383   6.422   1.494
  159    H8     G  15           H8         G  15  -4.315   4.824   4.730
  160    H1     G  15           H1         G  15  -6.210   0.547   0.299
  161   1H2     G  15          1H2         G  15  -7.621   3.371  -1.228
  162   2H2     G  15          2H2         G  15  -7.419   1.632  -1.267
  163   1H5*    C  16          1H5*        C  16 -10.030   7.247   2.854
  164   2H5*    C  16          2H5*        C  16 -11.491   6.804   3.745
  165    H4*    C  16           H4*        C  16 -11.408   5.891   1.423
  166    H3*    C  16           H3*        C  16 -11.404   3.853   3.680
  167    H2*    C  16           H2*        C  16 -11.877   2.228   1.910
  168   2HO*    C  16          2HO*        C  16 -13.201   3.847   0.718
  169    H1*    C  16           H1*        C  16  -9.865   3.273   0.288
  170   1H4     C  16          1H4         C  16  -6.729  -0.372   4.896
  171   2H4     C  16          2H4         C  16  -7.235  -1.495   3.646
  172    H5     C  16           H5         C  16  -7.453   1.998   4.907
  173    H6     C  16           H6         C  16  -8.663   3.669   3.688
  174   1H5*    C  17          1H5*        C  17 -14.870   2.877   1.066
  175   2H5*    C  17          2H5*        C  17 -16.222   2.427   2.117
  176    H4*    C  17           H4*        C  17 -15.672   0.660   0.467
  177    H3*    C  17           H3*        C  17 -15.151  -0.069   3.388
  178    H2*    C  17           H2*        C  17 -14.882  -2.321   2.596
  179   2HO*    C  17          2HO*        C  17 -15.298  -2.817   0.394
  180    H1*    C  17           H1*        C  17 -13.381  -1.477   0.352
  181   1H4     C  17          1H4         C  17  -9.228  -1.803   5.572
  182   2H4     C  17          2H4         C  17  -9.173  -3.371   4.793
  183    H5     C  17           H5         C  17 -10.822  -0.032   4.882
  184    H6     C  17           H6         C  17 -12.559   0.526   3.318
  185    H3T    C  17           H3T        C  17 -17.331  -0.618   1.650
  Start of MODEL   10
    1   1H5*    G   1          1H5*        G   1  -4.294 -13.830  -0.117
    2   2H5*    G   1          2H5*        G   1  -4.251 -12.785   1.318
    3    H4*    G   1           H4*        G   1  -6.766 -13.451  -0.302
    4    H3*    G   1           H3*        G   1  -4.979 -10.993  -0.232
    5    H2*    G   1           H2*        G   1  -6.955  -9.712  -0.833
    6   2HO*    G   1          2HO*        G   1  -8.215 -12.243  -1.187
    7    H1*    G   1           H1*        G   1  -8.541 -11.015   1.012
    8    H8     G   1           H8         G   1  -5.031 -10.489   2.458
    9    H1     G   1           H1         G   1  -8.966  -5.408   3.015
   10   1H2     G   1          1H2         G   1 -10.963  -7.150   0.732
   11   2H2     G   1          2H2         G   1 -10.749  -5.694   1.684
   12    H5T    G   1           H5T        G   1  -5.772 -14.248   2.265
   13   1H5*    G   2          1H5*        G   2  -7.577 -10.882  -3.834
   14   2H5*    G   2          2H5*        G   2  -6.684 -10.143  -5.170
   15    H4*    G   2           H4*        G   2  -8.815  -8.971  -4.691
   16    H3*    G   2           H3*        G   2  -6.274  -7.400  -4.115
   17    H2*    G   2           H2*        G   2  -7.679  -5.510  -3.807
   18   2HO*    G   2          2HO*        G   2  -9.728  -7.067  -5.024
   19    H1*    G   2           H1*        G   2  -9.709  -6.931  -2.516
   20    H8     G   2           H8         G   2  -6.280  -7.773  -1.136
   21    H1     G   2           H1         G   2  -8.695  -2.227   1.093
   22   1H2     G   2          1H2         G   2 -11.020  -2.620  -1.500
   23   2H2     G   2          2H2         G   2 -10.428  -1.606  -0.198
   24   1H5*    C   3          1H5*        C   3  -8.722  -4.911  -6.893
   25   2H5*    C   3          2H5*        C   3  -7.592  -4.048  -7.947
   26    H4*    C   3           H4*        C   3  -9.010  -2.491  -6.626
   27    H3*    C   3           H3*        C   3  -6.046  -2.515  -5.938
   28    H2*    C   3           H2*        C   3  -6.451  -0.657  -4.572
   29   2HO*    C   3          2HO*        C   3  -7.774   0.470  -6.114
   30    H1*    C   3           H1*        C   3  -9.009  -1.562  -3.717
   31   1H4     C   3          1H4         C   3  -3.663  -3.262   0.032
   32   2H4     C   3          2H4         C   3  -4.422  -1.885   0.803
   33    H5     C   3           H5         C   3  -4.499  -4.184  -2.149
   34    H6     C   3           H6         C   3  -6.191  -3.931  -3.840
   35   1H5*    U   4          1H5*        U   4  -7.323   1.854  -7.361
   36   2H5*    U   4          2H5*        U   4  -5.886   2.433  -8.209
   37    H4*    U   4           H4*        U   4  -6.697   3.972  -6.430
   38    H3*    U   4           H3*        U   4  -3.916   2.794  -6.083
   39    H2*    U   4           H2*        U   4  -3.660   4.475  -4.314
   40   2HO*    U   4          2HO*        U   4  -6.193   5.447  -5.133
   41    H1*    U   4           H1*        U   4  -6.048   3.871  -3.197
   42    H3     U   4           H3         U   4  -2.960   2.097  -0.367
   43    H5     U   4           H5         U   4  -3.594  -0.868  -3.294
   44    H6     U   4           H6         U   4  -4.814   0.742  -4.588
   45   1H5*    U   5          1H5*        U   5  -3.570   7.153  -5.755
   46   2H5*    U   5          2H5*        U   5  -2.114   7.665  -6.618
   47    H4*    U   5           H4*        U   5  -2.096   8.477  -4.331
   48    H3*    U   5           H3*        U   5  -0.031   6.286  -4.833
   49    H2*    U   5           H2*        U   5   0.911   7.103  -2.688
   50   2HO*    U   5          2HO*        U   5   0.313   9.334  -3.154
   51    H1*    U   5           H1*        U   5  -1.482   7.000  -1.484
   52    H3     U   5           H3         U   5   0.545   3.289   0.155
   53    H5     U   5           H5         U   5  -1.048   2.093  -3.567
   54    H6     U   5           H6         U   5  -1.597   4.365  -4.016
   55   1H5*    U   6          1H5*        U   6   2.320   9.657  -3.222
   56   2H5*    U   6          2H5*        U   6   3.788   9.756  -4.209
   57    H4*    U   6           H4*        U   6   4.376   9.463  -1.852
   58    H3*    U   6           H3*        U   6   4.828   6.936  -3.467
   59    H2*    U   6           H2*        U   6   6.165   6.208  -1.629
   60   2HO*    U   6          2HO*        U   6   7.142   8.123  -0.894
   61    H1*    U   6           H1*        U   6   4.156   7.018   0.151
   62    H3     U   6           H3         U   6   4.743   2.424  -0.051
   63    H5     U   6           H5         U   6   1.981   3.374  -3.094
   64    H6     U   6           H6         U   6   2.382   5.701  -2.670
   65   1H5*    G   7          1H5*        G   7   9.822   7.423  -3.898
   66   2H5*    G   7          2H5*        G   7   8.238   6.667  -4.097
   67    H4*    G   7           H4*        G   7  10.266   6.057  -1.897
   68    H3*    G   7           H3*        G   7   9.221   4.605  -4.347
   69    H2*    G   7           H2*        G   7   9.501   2.512  -3.182
   70   2HO*    G   7          2HO*        G   7  10.457   2.419  -1.150
   71    H1*    G   7           H1*        G   7   8.253   3.329  -0.933
   72    H8     G   7           H8         G   7   6.493   5.250  -3.688
   73    H1     G   7           H1         G   7   4.827  -0.966  -3.495
   74   1H2     G   7          1H2         G   7   7.350  -1.253  -1.104
   75   2H2     G   7          2H2         G   7   6.159  -2.054  -2.108
   76   1H5*    G   8          1H5*        G   8  12.491   1.029  -5.934
   77   2H5*    G   8          2H5*        G   8  10.839   1.477  -6.403
   78    H4*    G   8           H4*        G   8  11.629  -0.136  -3.958
   79    H3*    G   8           H3*        G   8  11.447  -1.119  -6.439
   80    H2*    G   8           H2*        G   8   9.357  -0.618  -7.118
   81   2HO*    G   8          2HO*        G   8   7.688  -2.105  -6.437
   82    H1*    G   8           H1*        G   8   7.929  -0.579  -4.481
   83    H8     G   8           H8         G   8   8.903   2.750  -5.669
   84    H1     G   8           H1         G   8   3.504   0.454  -8.345
   85   1H2     G   8          1H2         G   8   4.642  -2.603  -7.021
   86   2H2     G   8          2H2         G   8   3.374  -1.783  -7.920
   87   1H5*    A   9          1H5*        A   9  10.949  -6.553  -5.307
   88   2H5*    A   9          2H5*        A   9   9.306  -6.419  -5.916
   89    H4*    A   9           H4*        A   9   9.174  -6.753  -3.539
   90    H3*    A   9           H3*        A   9   8.662  -3.914  -4.329
   91    H2*    A   9           H2*        A   9   7.844  -3.553  -2.069
   92   2HO*    A   9          2HO*        A   9   7.926  -6.387  -1.842
   93    H1*    A   9           H1*        A   9   9.876  -5.233  -1.024
   94    H8     A   9           H8         A   9   9.635  -1.894  -3.170
   95   1H6     A   9          1H6         A   9  13.607   0.346   1.004
   96   2H6     A   9          2H6         A   9  12.540   0.744  -0.330
   97    H2     A   9           H2         A   9  13.185  -4.017   1.795
   98   1H5*    U  10          1H5*        U  10   5.076  -6.547  -3.106
   99   2H5*    U  10          2H5*        U  10   3.346  -6.279  -3.301
  100    H4*    U  10           H4*        U  10   5.235  -4.379  -1.820
  101    H3*    U  10           H3*        U  10   3.184  -6.388  -0.841
  102    H2*    U  10           H2*        U  10   2.929  -5.021   1.029
  103   2HO*    U  10          2HO*        U  10   4.556  -3.459   1.628
  104    H1*    U  10           H1*        U  10   3.845  -2.659  -0.526
  105    H3     U  10           H3         U  10   0.368  -1.260   2.215
  106    H5     U  10           H5         U  10  -1.451  -3.735  -0.674
  107    H6     U  10           H6         U  10   0.740  -4.308  -1.502
  108   1H5*    A  11          1H5*        A  11   8.052  -8.291   1.395
  109   2H5*    A  11          2H5*        A  11   7.160  -8.469   2.922
  110    H4*    A  11           H4*        A  11   9.397  -7.482   3.311
  111    H3*    A  11           H3*        A  11   7.023  -5.610   3.710
  112    H2*    A  11           H2*        A  11   8.485  -3.950   4.356
  113   2HO*    A  11          2HO*        A  11  10.386  -6.012   4.875
  114    H1*    A  11           H1*        A  11  10.664  -4.738   2.709
  115    H8     A  11           H8         A  11   7.429  -4.283   0.862
  116   1H6     A  11          1H6         A  11   9.003   1.734   0.438
  117   2H6     A  11          2H6         A  11   7.997   0.494  -0.280
  118    H2     A  11           H2         A  11  11.481  -0.128   3.608
  119   1H5*    A  12          1H5*        A  12   6.395  -3.901   8.212
  120   2H5*    A  12          2H5*        A  12   5.934  -3.607   6.529
  121    H4*    A  12           H4*        A  12   8.318  -2.394   8.002
  122    H3*    A  12           H3*        A  12   5.643  -1.402   6.972
  123    H2*    A  12           H2*        A  12   6.587   0.722   6.407
  124   2HO*    A  12          2HO*        A  12   8.750   1.206   6.932
  125    H1*    A  12           H1*        A  12   8.776  -0.330   5.144
  126    H8     A  12           H8         A  12   6.268  -2.996   4.362
  127   1H6     A  12          1H6         A  12   4.407   0.633  -0.289
  128   2H6     A  12          2H6         A  12   4.302  -0.954   0.446
  129    H2     A  12           H2         A  12   6.885   3.139   2.472
  130   1H5*    A  13          1H5*        A  13   6.654   2.089   8.965
  131   2H5*    A  13          2H5*        A  13   5.322   2.511  10.060
  132    H4*    A  13           H4*        A  13   5.645   4.318   8.471
  133    H3*    A  13           H3*        A  13   3.156   2.659   7.872
  134    H2*    A  13           H2*        A  13   2.581   4.365   6.336
  135   2HO*    A  13          2HO*        A  13   3.356   6.094   7.826
  136    H1*    A  13           H1*        A  13   5.192   4.634   5.346
  137    H8     A  13           H8         A  13   4.175   1.023   5.950
  138   1H6     A  13          1H6         A  13   1.300   1.279   0.439
  139   2H6     A  13          2H6         A  13   1.968   0.200   1.652
  140    H2     A  13           H2         A  13   2.311   5.439   1.678
  141   1H5*    A  14          1H5*        A  14   1.626   6.780   8.427
  142   2H5*    A  14          2H5*        A  14   0.022   6.664   9.166
  143    H4*    A  14           H4*        A  14   0.090   7.794   6.905
  144    H3*    A  14           H3*        A  14  -1.567   5.257   7.156
  145    H2*    A  14           H2*        A  14  -2.438   5.840   4.970
  146   2HO*    A  14          2HO*        A  14  -1.915   7.799   3.991
  147    H1*    A  14           H1*        A  14   0.069   6.548   3.998
  148    H8     A  14           H8         A  14   0.737   3.302   5.770
  149   1H6     A  14          1H6         A  14  -1.935   0.637   0.817
  150   2H6     A  14          2H6         A  14  -0.902   0.357   2.203
  151    H2     A  14           H2         A  14  -3.092   4.970   0.921
  152   1H5*    G  15          1H5*        G  15  -4.098   8.486   5.293
  153   2H5*    G  15          2H5*        G  15  -5.688   8.334   6.037
  154    H4*    G  15           H4*        G  15  -5.922   8.280   3.621
  155    H3*    G  15           H3*        G  15  -6.299   5.539   4.871
  156    H2*    G  15           H2*        G  15  -7.356   4.945   2.900
  157   2HO*    G  15          2HO*        G  15  -7.677   6.445   1.190
  158    H1*    G  15           H1*        G  15  -5.303   6.041   1.384
  159    H8     G  15           H8         G  15  -4.114   4.421   4.559
  160    H1     G  15           H1         G  15  -5.976   0.161   0.096
  161   1H2     G  15          1H2         G  15  -7.491   2.974  -1.356
  162   2H2     G  15          2H2         G  15  -7.244   1.242  -1.433
  163   1H5*    C  16          1H5*        C  16  -9.945   6.705   2.767
  164   2H5*    C  16          2H5*        C  16 -11.396   6.217   3.646
  165    H4*    C  16           H4*        C  16 -11.271   5.371   1.275
  166    H3*    C  16           H3*        C  16 -11.371   3.321   3.516
  167    H2*    C  16           H2*        C  16 -11.733   1.680   1.807
  168   2HO*    C  16          2HO*        C  16 -13.140   2.882   0.481
  169    H1*    C  16           H1*        C  16  -9.759   2.776   0.132
  170   1H4     C  16          1H4         C  16  -6.343  -0.934   4.419
  171   2H4     C  16          2H4         C  16  -6.909  -2.033   3.174
  172    H5     C  16           H5         C  16  -7.153   1.403   4.584
  173    H6     C  16           H6         C  16  -8.465   3.087   3.490
  174   1H5*    C  17          1H5*        C  17 -15.346   1.215   4.876
  175   2H5*    C  17          2H5*        C  17 -13.754   0.602   5.324
  176    H4*    C  17           H4*        C  17 -15.248   0.144   2.703
  177    H3*    C  17           H3*        C  17 -14.073  -1.624   4.887
  178    H2*    C  17           H2*        C  17 -13.861  -3.354   3.301
  179   2HO*    C  17          2HO*        C  17 -14.697  -3.067   1.150
  180    H1*    C  17           H1*        C  17 -12.838  -1.687   1.305
  181   1H4     C  17          1H4         C  17  -7.979  -3.035   5.705
  182   2H4     C  17          2H4         C  17  -8.001  -4.389   4.593
  183    H5     C  17           H5         C  17  -9.652  -1.210   5.608
  184    H6     C  17           H6         C  17 -11.611  -0.411   4.437
  185    H3T    C  17           H3T        C  17 -16.546  -1.692   3.489
  Start of MODEL   11
    1   1H5*    G   1          1H5*        G   1  -5.813 -13.516   0.859
    2   2H5*    G   1          2H5*        G   1  -5.141 -13.109  -0.729
    3    H4*    G   1           H4*        G   1  -7.520 -12.486  -0.598
    4    H3*    G   1           H3*        G   1  -5.664 -10.070  -0.584
    5    H2*    G   1           H2*        G   1  -7.661  -8.775  -0.962
    6   2HO*    G   1          2HO*        G   1  -9.614  -9.728  -1.435
    7    H1*    G   1           H1*        G   1  -9.129 -10.264   0.899
    8    H8     G   1           H8         G   1  -5.662  -9.565   2.317
    9    H1     G   1           H1         G   1  -9.824  -4.671   2.908
   10   1H2     G   1          1H2         G   1 -11.727  -6.477   0.592
   11   2H2     G   1          2H2         G   1 -11.583  -5.023   1.558
   12    H5T    G   1           H5T        G   1  -4.196 -11.282   0.197
   13   1H5*    G   2          1H5*        G   2  -8.552  -9.900  -3.983
   14   2H5*    G   2          2H5*        G   2  -7.779  -9.100  -5.356
   15    H4*    G   2           H4*        G   2  -9.905  -8.001  -4.679
   16    H3*    G   2           H3*        G   2  -7.350  -6.394  -4.300
   17    H2*    G   2           H2*        G   2  -8.732  -4.543  -3.797
   18   2HO*    G   2          2HO*        G   2 -10.863  -6.066  -4.911
   19    H1*    G   2           H1*        G   2 -10.645  -6.011  -2.395
   20    H8     G   2           H8         G   2  -7.145  -6.865  -1.279
   21    H1     G   2           H1         G   2  -9.351  -1.330   1.174
   22   1H2     G   2          1H2         G   2 -11.756  -1.596  -1.364
   23   2H2     G   2          2H2         G   2 -11.090  -0.622  -0.067
   24   1H5*    C   3          1H5*        C   3 -10.006  -3.786  -6.728
   25   2H5*    C   3          2H5*        C   3  -8.959  -2.921  -7.864
   26    H4*    C   3           H4*        C   3 -10.164  -1.362  -6.354
   27    H3*    C   3           H3*        C   3  -7.151  -1.540  -5.968
   28    H2*    C   3           H2*        C   3  -7.318   0.250  -4.480
   29   2HO*    C   3          2HO*        C   3  -8.697   1.553  -5.791
   30    H1*    C   3           H1*        C   3  -9.825  -0.563  -3.410
   31   1H4     C   3          1H4         C   3  -4.320  -2.828  -0.245
   32   2H4     C   3          2H4         C   3  -4.930  -1.455   0.666
   33    H5     C   3           H5         C   3  -5.351  -3.507  -2.442
   34    H6     C   3           H6         C   3  -7.169  -3.065  -3.941
   35   1H5*    U   4          1H5*        U   4  -8.355   2.960  -7.071
   36   2H5*    U   4          2H5*        U   4  -6.968   3.508  -8.022
   37    H4*    U   4           H4*        U   4  -7.506   5.001  -6.103
   38    H3*    U   4           H3*        U   4  -4.800   3.616  -6.037
   39    H2*    U   4           H2*        U   4  -4.298   5.198  -4.228
   40   2HO*    U   4          2HO*        U   4  -5.778   6.771  -3.640
   41    H1*    U   4           H1*        U   4  -6.644   4.698  -2.962
   42    H3     U   4           H3         U   4  -3.536   2.593  -0.402
   43    H5     U   4           H5         U   4  -4.450  -0.151  -3.469
   44    H6     U   4           H6         U   4  -5.636   1.597  -4.609
   45   1H5*    U   5          1H5*        U   5  -4.138   7.909  -5.555
   46   2H5*    U   5          2H5*        U   5  -2.678   8.368  -6.439
   47    H4*    U   5           H4*        U   5  -2.546   9.019  -4.089
   48    H3*    U   5           H3*        U   5  -0.628   6.769  -4.836
   49    H2*    U   5           H2*        U   5   0.429   7.357  -2.684
   50   2HO*    U   5          2HO*        U   5  -0.376   9.033  -1.446
   51    H1*    U   5           H1*        U   5  -1.921   7.301  -1.392
   52    H3     U   5           H3         U   5   0.054   3.433  -0.093
   53    H5     U   5           H5         U   5  -1.743   2.537  -3.808
   54    H6     U   5           H6         U   5  -2.237   4.852  -4.081
   55   1H5*    U   6          1H5*        U   6   1.790   9.854  -3.041
   56   2H5*    U   6          2H5*        U   6   3.313   9.996  -3.931
   57    H4*    U   6           H4*        U   6   3.694   9.487  -1.552
   58    H3*    U   6           H3*        U   6   4.410   7.222  -3.457
   59    H2*    U   6           H2*        U   6   5.506   6.235  -1.561
   60   2HO*    U   6          2HO*        U   6   6.266   8.374  -0.786
   61    H1*    U   6           H1*        U   6   3.375   6.869   0.175
   62    H3     U   6           H3         U   6   3.979   2.303  -0.478
   63    H5     U   6           H5         U   6   1.423   3.580  -3.577
   64    H6     U   6           H6         U   6   1.788   5.852  -2.872
   65   1H5*    G   7          1H5*        G   7   8.119   7.719  -1.191
   66   2H5*    G   7          2H5*        G   7   9.435   7.608  -2.371
   67    H4*    G   7           H4*        G   7   9.672   5.920  -0.629
   68    H3*    G   7           H3*        G   7   8.950   4.798  -3.364
   69    H2*    G   7           H2*        G   7   9.482   2.607  -2.390
   70   2HO*    G   7          2HO*        G   7  10.426   4.080  -0.154
   71    H1*    G   7           H1*        G   7   8.032   3.088  -0.136
   72    H8     G   7           H8         G   7   6.158   4.753  -3.000
   73    H1     G   7           H1         G   7   5.647  -1.669  -3.007
   74   1H2     G   7          1H2         G   7   8.169  -1.534  -0.581
   75   2H2     G   7          2H2         G   7   7.150  -2.549  -1.580
   76   1H5*    G   8          1H5*        G   8  11.905   1.921  -5.619
   77   2H5*    G   8          2H5*        G   8  10.532   2.923  -6.140
   78    H4*    G   8           H4*        G   8  10.227   0.723  -4.069
   79    H3*    G   8           H3*        G   8  10.939   0.037  -6.565
   80    H2*    G   8           H2*        G   8   9.165   1.519  -7.554
   81   2HO*    G   8          2HO*        G   8   8.000  -1.076  -7.470
   82    H1*    G   8           H1*        G   8   7.427   0.131  -5.436
   83    H8     G   8           H8         G   8   7.351   3.789  -5.977
   84    H1     G   8           H1         G   8   2.160   0.687  -8.208
   85   1H2     G   8          1H2         G   8   4.122  -2.169  -7.661
   86   2H2     G   8          2H2         G   8   2.577  -1.533  -8.192
   87   1H5*    A   9          1H5*        A   9  12.097  -4.303  -5.655
   88   2H5*    A   9          2H5*        A   9  10.654  -5.331  -5.827
   89    H4*    A   9           H4*        A   9  11.979  -6.004  -3.875
   90    H3*    A   9           H3*        A   9   9.175  -5.347  -3.791
   91    H2*    A   9           H2*        A   9   9.315  -3.424  -2.691
   92   2HO*    A   9          2HO*        A   9   9.572  -5.224  -0.528
   93    H1*    A   9           H1*        A   9  11.687  -4.370  -1.036
   94    H8     A   9           H8         A   9  10.175  -1.430  -3.166
   95   1H6     A   9          1H6         A   9  13.501   2.296   0.526
   96   2H6     A   9          2H6         A   9  12.210   2.243  -0.662
   97    H2     A   9           H2         A   9  14.636  -1.906   1.470
   98   1H5*    U  10          1H5*        U  10   7.545  -9.156  -3.586
   99   2H5*    U  10          2H5*        U  10   7.388  -7.942  -2.298
  100    H4*    U  10           H4*        U  10   5.976  -9.959  -1.918
  101    H3*    U  10           H3*        U  10   8.244  -9.549   0.077
  102    H2*    U  10           H2*        U  10   7.260 -11.326   1.336
  103   2HO*    U  10          2HO*        U  10   5.104 -10.630   1.179
  104    H1*    U  10           H1*        U  10   6.539 -12.801  -0.994
  105    H3     U  10           H3         U  10   9.592 -15.533   1.116
  106    H5     U  10           H5         U  10  11.867 -12.163  -0.005
  107    H6     U  10           H6         U  10   9.855 -11.120  -0.804
  108   1H5*    A  11          1H5*        A  11   7.797  -5.826   1.398
  109   2H5*    A  11          2H5*        A  11   8.734  -7.040   0.508
  110    H4*    A  11           H4*        A  11  10.362  -7.139   2.412
  111    H3*    A  11           H3*        A  11   8.518  -5.011   3.555
  112    H2*    A  11           H2*        A  11  10.372  -3.875   4.432
  113   2HO*    A  11          2HO*        A  11  11.831  -6.275   3.916
  114    H1*    A  11           H1*        A  11  12.030  -4.185   2.253
  115    H8     A  11           H8         A  11   8.406  -3.592   1.341
  116   1H6     A  11          1H6         A  11   9.685   2.465   1.728
  117   2H6     A  11          2H6         A  11   8.593   1.283   1.031
  118    H2     A  11           H2         A  11  12.874   0.220   3.880
  119   1H5*    A  12          1H5*        A  12   7.196  -4.369   7.335
  120   2H5*    A  12          2H5*        A  12   7.061  -4.485   5.566
  121    H4*    A  12           H4*        A  12   8.640  -2.280   6.977
  122    H3*    A  12           H3*        A  12   5.756  -2.321   6.039
  123    H2*    A  12           H2*        A  12   6.027   0.080   5.665
  124   2HO*    A  12          2HO*        A  12   7.968   1.106   6.209
  125    H1*    A  12           H1*        A  12   8.426  -0.285   4.333
  126    H8     A  12           H8         A  12   6.248  -3.280   3.456
  127   1H6     A  12          1H6         A  12   3.600   0.412  -0.790
  128   2H6     A  12          2H6         A  12   3.759  -1.240  -0.226
  129    H2     A  12           H2         A  12   6.091   2.969   1.889
  130   1H5*    A  13          1H5*        A  13   6.319   1.216   8.549
  131   2H5*    A  13          2H5*        A  13   4.902   1.419   9.591
  132    H4*    A  13           H4*        A  13   5.333   3.441   8.250
  133    H3*    A  13           H3*        A  13   2.816   1.907   7.487
  134    H2*    A  13           H2*        A  13   2.257   3.824   6.189
  135   2HO*    A  13          2HO*        A  13   3.122   5.328   7.862
  136    H1*    A  13           H1*        A  13   4.832   4.124   5.159
  137    H8     A  13           H8         A  13   3.742   0.497   5.413
  138   1H6     A  13          1H6         A  13   0.641   1.395   0.098
  139   2H6     A  13          2H6         A  13   1.312   0.179   1.168
  140    H2     A  13           H2         A  13   1.786   5.379   1.736
  141   1H5*    A  14          1H5*        A  14   1.516   6.037   8.670
  142   2H5*    A  14          2H5*        A  14  -0.112   5.929   9.350
  143    H4*    A  14           H4*        A  14   0.153   7.398   7.287
  144    H3*    A  14           H3*        A  14  -1.801   5.074   7.184
  145    H2*    A  14           H2*        A  14  -2.557   6.055   5.084
  146   2HO*    A  14          2HO*        A  14  -1.699   8.021   4.363
  147    H1*    A  14           H1*        A  14   0.003   6.456   4.173
  148    H8     A  14           H8         A  14   0.304   3.048   5.719
  149   1H6     A  14          1H6         A  14  -2.579   1.045   0.592
  150   2H6     A  14          2H6         A  14  -1.558   0.573   1.935
  151    H2     A  14           H2         A  14  -3.361   5.443   1.050
  152   1H5*    G  15          1H5*        G  15  -3.902   8.658   5.613
  153   2H5*    G  15          2H5*        G  15  -5.489   8.669   6.379
  154    H4*    G  15           H4*        G  15  -5.770   8.795   3.983
  155    H3*    G  15           H3*        G  15  -6.457   6.051   5.080
  156    H2*    G  15           H2*        G  15  -7.602   5.671   3.114
  157   2HO*    G  15          2HO*        G  15  -7.111   8.419   2.455
  158    H1*    G  15           H1*        G  15  -5.497   6.627   1.590
  159    H8     G  15           H8         G  15  -4.376   4.729   4.622
  160    H1     G  15           H1         G  15  -6.806   0.924   0.026
  161   1H2     G  15          1H2         G  15  -8.140   3.942  -1.176
  162   2H2     G  15          2H2         G  15  -8.058   2.202  -1.362
  163   1H5*    C  16          1H5*        C  16 -10.012   7.521   3.144
  164   2H5*    C  16          2H5*        C  16 -11.448   7.207   4.125
  165    H4*    C  16           H4*        C  16 -11.592   6.238   1.819
  166    H3*    C  16           H3*        C  16 -11.577   4.305   4.167
  167    H2*    C  16           H2*        C  16 -12.143   2.588   2.610
  168   2HO*    C  16          2HO*        C  16 -13.695   3.788   1.442
  169    H1*    C  16           H1*        C  16 -10.394   3.600   0.615
  170   1H4     C  16          1H4         C  16  -6.839  -0.360   4.632
  171   2H4     C  16          2H4         C  16  -7.536  -1.403   3.405
  172    H5     C  16           H5         C  16  -7.447   2.036   4.825
  173    H6     C  16           H6         C  16  -8.709   3.814   3.818
  174   1H5*    C  17          1H5*        C  17 -16.168   2.015   4.237
  175   2H5*    C  17          2H5*        C  17 -14.502   1.558   4.640
  176    H4*    C  17           H4*        C  17 -15.912   1.042   1.976
  177    H3*    C  17           H3*        C  17 -15.073  -0.703   4.336
  178    H2*    C  17           H2*        C  17 -14.791  -2.511   2.834
  179   2HO*    C  17          2HO*        C  17 -16.682  -1.990   1.544
  180    H1*    C  17           H1*        C  17 -13.467  -0.969   0.918
  181   1H4     C  17          1H4         C  17  -8.960  -2.270   5.644
  182   2H4     C  17          2H4         C  17  -8.941  -3.652   4.567
  183    H5     C  17           H5         C  17 -10.640  -0.458   5.449
  184    H6     C  17           H6         C  17 -12.522   0.330   4.163
  185    H3T    C  17           H3T        C  17 -17.287  -0.047   4.146
  Start of MODEL   12
    1   1H5*    G   1          1H5*        G   1  -5.232 -12.848   1.918
    2   2H5*    G   1          2H5*        G   1  -6.517 -13.971   2.405
    3    H4*    G   1           H4*        G   1  -8.140 -12.756   0.941
    4    H3*    G   1           H3*        G   1  -5.762 -10.905   0.527
    5    H2*    G   1           H2*        G   1  -7.292  -9.140   0.305
    6   2HO*    G   1          2HO*        G   1  -8.704  -9.889  -1.195
    7    H1*    G   1           H1*        G   1  -9.237 -10.486   2.035
    8    H8     G   1           H8         G   1  -6.022  -9.615   3.827
    9    H1     G   1           H1         G   1 -10.087  -4.634   3.256
   10   1H2     G   1          1H2         G   1 -11.715  -6.696   0.941
   11   2H2     G   1          2H2         G   1 -11.668  -5.135   1.738
   12    H5T    G   1           H5T        G   1  -5.196 -14.752   0.687
   13   1H5*    G   2          1H5*        G   2  -8.838 -10.560  -3.097
   14   2H5*    G   2          2H5*        G   2  -7.842 -10.006  -4.453
   15    H4*    G   2           H4*        G   2  -9.807  -8.537  -4.050
   16    H3*    G   2           H3*        G   2  -7.096  -7.273  -3.492
   17    H2*    G   2           H2*        G   2  -8.277  -5.212  -3.356
   18   2HO*    G   2          2HO*        G   2 -10.379  -4.965  -4.053
   19    H1*    G   2           H1*        G   2 -10.500  -6.359  -2.055
   20    H8     G   2           H8         G   2  -7.195  -7.359  -0.463
   21    H1     G   2           H1         G   2  -9.290  -1.525   1.302
   22   1H2     G   2          1H2         G   2 -11.526  -1.913  -1.372
   23   2H2     G   2          2H2         G   2 -10.915  -0.864  -0.105
   24   1H5*    C   3          1H5*        C   3  -9.261  -4.788  -6.565
   25   2H5*    C   3          2H5*        C   3  -8.036  -4.057  -7.611
   26    H4*    C   3           H4*        C   3  -9.464  -2.361  -6.481
   27    H3*    C   3           H3*        C   3  -6.535  -2.415  -5.668
   28    H2*    C   3           H2*        C   3  -6.941  -0.436  -4.468
   29   2HO*    C   3          2HO*        C   3  -9.374  -0.237  -5.939
   30    H1*    C   3           H1*        C   3  -9.543  -1.201  -3.645
   31   1H4     C   3          1H4         C   3  -4.423  -2.784   0.435
   32   2H4     C   3          2H4         C   3  -5.158  -1.330   1.082
   33    H5     C   3           H5         C   3  -5.199  -3.828  -1.702
   34    H6     C   3           H6         C   3  -6.797  -3.648  -3.481
   35   1H5*    U   4          1H5*        U   4  -7.690   1.718  -7.202
   36   2H5*    U   4          2H5*        U   4  -6.315   2.366  -8.105
   37    H4*    U   4           H4*        U   4  -7.134   3.896  -6.335
   38    H3*    U   4           H3*        U   4  -4.312   2.820  -5.956
   39    H2*    U   4           H2*        U   4  -4.149   4.578  -4.226
   40   2HO*    U   4          2HO*        U   4  -5.583   6.018  -5.538
   41    H1*    U   4           H1*        U   4  -6.505   3.858  -3.102
   42    H3     U   4           H3         U   4  -3.331   2.243  -0.264
   43    H5     U   4           H5         U   4  -3.884  -0.783  -3.150
   44    H6     U   4           H6         U   4  -5.162   0.763  -4.456
   45   1H5*    U   5          1H5*        U   5  -4.013   7.193  -5.648
   46   2H5*    U   5          2H5*        U   5  -2.556   7.689  -6.516
   47    H4*    U   5           H4*        U   5  -2.536   8.488  -4.217
   48    H3*    U   5           H3*        U   5  -0.475   6.308  -4.761
   49    H2*    U   5           H2*        U   5   0.492   7.111  -2.628
   50   2HO*    U   5          2HO*        U   5  -0.471   8.801  -1.524
   51    H1*    U   5           H1*        U   5  -1.877   6.964  -1.391
   52    H3     U   5           H3         U   5   0.331   3.297   0.114
   53    H5     U   5           H5         U   5  -1.432   2.092  -3.529
   54    H6     U   5           H6         U   5  -2.061   4.355  -3.928
   55   1H5*    U   6          1H5*        U   6   1.668   9.674  -3.121
   56   2H5*    U   6          2H5*        U   6   3.159   9.916  -4.044
   57    H4*    U   6           H4*        U   6   3.646   9.632  -1.657
   58    H3*    U   6           H3*        U   6   4.520   7.301  -3.414
   59    H2*    U   6           H2*        U   6   5.747   6.554  -1.507
   60   2HO*    U   6          2HO*        U   6   6.409   8.749  -0.904
   61    H1*    U   6           H1*        U   6   3.645   7.140   0.277
   62    H3     U   6           H3         U   6   4.560   2.581  -0.044
   63    H5     U   6           H5         U   6   1.750   3.439  -3.071
   64    H6     U   6           H6         U   6   2.017   5.772  -2.594
   65   1H5*    G   7          1H5*        G   7   8.244   8.033  -1.640
   66   2H5*    G   7          2H5*        G   7   9.481   7.960  -2.908
   67    H4*    G   7           H4*        G   7   9.823   6.218  -1.216
   68    H3*    G   7           H3*        G   7   8.955   5.180  -3.939
   69    H2*    G   7           H2*        G   7   9.429   2.961  -3.065
   70   2HO*    G   7          2HO*        G   7  10.513   4.299  -0.805
   71    H1*    G   7           H1*        G   7   8.085   3.419  -0.713
   72    H8     G   7           H8         G   7   6.081   5.282  -3.319
   73    H1     G   7           H1         G   7   5.318  -1.099  -3.698
   74   1H2     G   7          1H2         G   7   8.150  -1.225  -1.650
   75   2H2     G   7          2H2         G   7   7.001  -2.120  -2.620
   76   1H5*    G   8          1H5*        G   8  12.815   2.228  -5.751
   77   2H5*    G   8          2H5*        G   8  11.125   2.451  -6.246
   78    H4*    G   8           H4*        G   8  12.119   0.706  -3.969
   79    H3*    G   8           H3*        G   8  12.254  -0.075  -6.495
   80    H2*    G   8           H2*        G   8  10.142   0.546  -7.247
   81   2HO*    G   8          2HO*        G   8   9.658  -2.081  -6.281
   82    H1*    G   8           H1*        G   8   8.733  -0.504  -4.778
   83    H8     G   8           H8         G   8   8.941   3.139  -5.372
   84    H1     G   8           H1         G   8   3.740   0.449  -8.052
   85   1H2     G   8          1H2         G   8   5.314  -2.553  -7.143
   86   2H2     G   8          2H2         G   8   3.911  -1.800  -7.877
   87   1H5*    A   9          1H5*        A   9  13.969  -4.877  -4.049
   88   2H5*    A   9          2H5*        A   9  12.768  -5.730  -5.008
   89    H4*    A   9           H4*        A   9  11.858  -5.832  -2.893
   90    H3*    A   9           H3*        A   9  10.598  -3.352  -4.124
   91    H2*    A   9           H2*        A   9   9.209  -3.268  -2.194
   92   2HO*    A   9          2HO*        A   9  10.166  -5.880  -1.598
   93    H1*    A   9           H1*        A   9  11.295  -4.019  -0.463
   94    H8     A   9           H8         A   9  10.679  -1.188  -3.184
   95   1H6     A   9          1H6         A   9  11.891   2.522  -0.318
   96   2H6     A   9          2H6         A   9  12.782   2.633   1.192
   97    H2     A   9           H2         A   9  13.601  -1.532   2.559
   98   1H5*    U  10          1H5*        U  10   8.761  -7.241  -3.146
   99   2H5*    U  10          2H5*        U  10   7.656  -7.754  -4.428
  100    H4*    U  10           H4*        U  10   6.547  -6.980  -1.703
  101    H3*    U  10           H3*        U  10   7.905  -9.598  -2.448
  102    H2*    U  10           H2*        U  10   6.332 -10.685  -1.008
  103   2HO*    U  10          2HO*        U  10   6.512  -9.209   0.724
  104    H1*    U  10           H1*        U  10   4.191  -8.942  -1.737
  105    H3     U  10           H3         U  10   2.746 -13.045  -3.254
  106    H5     U  10           H5         U  10   6.147 -12.248  -5.616
  107    H6     U  10           H6         U  10   6.527 -10.254  -4.323
  108   1H5*    A  11          1H5*        A  11   8.692  -8.563   2.941
  109   2H5*    A  11          2H5*        A  11   8.068  -7.455   1.704
  110    H4*    A  11           H4*        A  11  10.581  -6.958   3.379
  111    H3*    A  11           H3*        A  11   7.746  -5.834   3.396
  112    H2*    A  11           H2*        A  11   8.613  -3.842   4.180
  113   2HO*    A  11          2HO*        A  11  10.678  -3.650   5.139
  114    H1*    A  11           H1*        A  11  11.145  -4.181   2.808
  115    H8     A  11           H8         A  11   8.132  -4.157   0.566
  116   1H6     A  11          1H6         A  11   8.619   2.051   0.668
  117   2H6     A  11          2H6         A  11   7.978   0.711  -0.263
  118    H2     A  11           H2         A  11  10.942   0.435   4.069
  119   1H5*    A  12          1H5*        A  12   6.359  -4.165   7.917
  120   2H5*    A  12          2H5*        A  12   6.010  -3.857   6.208
  121    H4*    A  12           H4*        A  12   8.094  -2.426   7.919
  122    H3*    A  12           H3*        A  12   5.390  -1.705   6.749
  123    H2*    A  12           H2*        A  12   6.131   0.556   6.369
  124   2HO*    A  12          2HO*        A  12   8.448  -0.199   7.840
  125    H1*    A  12           H1*        A  12   8.484  -0.164   5.214
  126    H8     A  12           H8         A  12   6.400  -3.052   4.092
  127   1H6     A  12          1H6         A  12   4.450  -1.009   0.148
  128   2H6     A  12          2H6         A  12   4.315   0.645  -0.413
  129    H2     A  12           H2         A  12   6.300   3.230   2.641
  130   1H5*    A  13          1H5*        A  13   6.175   1.759   9.078
  131   2H5*    A  13          2H5*        A  13   4.753   2.098  10.080
  132    H4*    A  13           H4*        A  13   5.256   4.012   8.634
  133    H3*    A  13           H3*        A  13   2.746   2.475   7.856
  134    H2*    A  13           H2*        A  13   2.278   4.268   6.387
  135   2HO*    A  13          2HO*        A  13   3.474   6.191   6.397
  136    H1*    A  13           H1*        A  13   4.900   4.478   5.461
  137    H8     A  13           H8         A  13   3.784   0.887   5.960
  138   1H6     A  13          1H6         A  13   1.017   1.323   0.410
  139   2H6     A  13          2H6         A  13   1.609   0.206   1.625
  140    H2     A  13           H2         A  13   2.071   5.436   1.768
  141   1H5*    A  14          1H5*        A  14   1.548   6.617   8.479
  142   2H5*    A  14          2H5*        A  14  -0.065   6.679   9.207
  143    H4*    A  14           H4*        A  14   0.125   7.878   7.005
  144    H3*    A  14           H3*        A  14  -1.771   5.504   7.136
  145    H2*    A  14           H2*        A  14  -2.553   6.234   4.959
  146   2HO*    A  14          2HO*        A  14  -1.801   8.156   4.043
  147    H1*    A  14           H1*        A  14   0.010   6.676   4.015
  148    H8     A  14           H8         A  14   0.413   3.411   5.818
  149   1H6     A  14          1H6         A  14  -2.328   0.886   0.857
  150   2H6     A  14          2H6         A  14  -1.289   0.576   2.233
  151    H2     A  14           H2         A  14  -3.327   5.268   0.972
  152   1H5*    G  15          1H5*        G  15  -4.023   8.870   5.286
  153   2H5*    G  15          2H5*        G  15  -5.610   8.865   6.054
  154    H4*    G  15           H4*        G  15  -5.902   8.773   3.662
  155    H3*    G  15           H3*        G  15  -6.425   6.083   4.965
  156    H2*    G  15           H2*        G  15  -7.535   5.491   3.032
  157   2HO*    G  15          2HO*        G  15  -7.177   8.195   2.150
  158    H1*    G  15           H1*        G  15  -5.459   6.411   1.454
  159    H8     G  15           H8         G  15  -4.310   4.891   4.697
  160    H1     G  15           H1         G  15  -6.355   0.509   0.440
  161   1H2     G  15          1H2         G  15  -7.782   3.302  -1.124
  162   2H2     G  15          2H2         G  15  -7.597   1.560  -1.120
  163   1H5*    C  16          1H5*        C  16 -10.066   7.298   2.923
  164   2H5*    C  16          2H5*        C  16 -11.501   6.886   3.869
  165    H4*    C  16           H4*        C  16 -11.501   5.925   1.561
  166    H3*    C  16           H3*        C  16 -11.433   3.933   3.855
  167    H2*    C  16           H2*        C  16 -11.972   2.277   2.149
  168   2HO*    C  16          2HO*        C  16 -12.324   2.914   0.005
  169    H1*    C  16           H1*        C  16 -10.031   3.304   0.413
  170   1H4     C  16          1H4         C  16  -6.827  -0.419   4.921
  171   2H4     C  16          2H4         C  16  -7.406  -1.529   3.691
  172    H5     C  16           H5         C  16  -7.476   1.976   4.944
  173    H6     C  16           H6         C  16  -8.681   3.680   3.758
  174   1H5*    C  17          1H5*        C  17 -14.879   3.039   1.294
  175   2H5*    C  17          2H5*        C  17 -16.271   2.630   2.307
  176    H4*    C  17           H4*        C  17 -15.800   0.865   0.657
  177    H3*    C  17           H3*        C  17 -15.265   0.068   3.560
  178    H2*    C  17           H2*        C  17 -15.078  -2.175   2.746
  179   2HO*    C  17          2HO*        C  17 -16.024  -1.187   0.251
  180    H1*    C  17           H1*        C  17 -13.582  -1.364   0.488
  181   1H4     C  17          1H4         C  17  -9.375  -1.822   5.661
  182   2H4     C  17          2H4         C  17  -9.338  -3.373   4.848
  183    H5     C  17           H5         C  17 -10.963  -0.028   5.027
  184    H6     C  17           H6         C  17 -12.711   0.576   3.494
  185    H3T    C  17           H3T        C  17 -17.390   0.755   3.069
  Start of MODEL   13
    1   1H5*    G   1          1H5*        G   1  -6.629 -13.811   2.624
    2   2H5*    G   1          2H5*        G   1  -5.737 -13.628   1.103
    3    H4*    G   1           H4*        G   1  -8.081 -12.865   0.869
    4    H3*    G   1           H3*        G   1  -6.025 -10.620   0.788
    5    H2*    G   1           H2*        G   1  -7.840  -9.228   0.034
    6   2HO*    G   1          2HO*        G   1  -9.802 -10.066  -0.581
    7    H1*    G   1           H1*        G   1  -9.655 -10.374   1.844
    8    H8     G   1           H8         G   1  -6.371  -9.674   3.638
    9    H1     G   1           H1         G   1 -10.251  -4.552   3.035
   10   1H2     G   1          1H2         G   1 -11.921  -6.549   0.693
   11   2H2     G   1          2H2         G   1 -11.828  -4.994   1.495
   12    H5T    G   1           H5T        G   1  -4.535 -12.882   2.875
   13   1H5*    G   2          1H5*        G   2  -8.516 -10.609  -2.938
   14   2H5*    G   2          2H5*        G   2  -7.508 -10.050  -4.278
   15    H4*    G   2           H4*        G   2  -9.547  -8.661  -3.990
   16    H3*    G   2           H3*        G   2  -6.901  -7.286  -3.395
   17    H2*    G   2           H2*        G   2  -8.128  -5.266  -3.309
   18   2HO*    G   2          2HO*        G   2 -10.219  -5.067  -4.069
   19    H1*    G   2           H1*        G   2 -10.360  -6.408  -2.043
   20    H8     G   2           H8         G   2  -7.110  -7.395  -0.370
   21    H1     G   2           H1         G   2  -9.140  -1.485   1.208
   22   1H2     G   2          1H2         G   2 -11.332  -1.903  -1.494
   23   2H2     G   2          2H2         G   2 -10.722  -0.831  -0.247
   24   1H5*    C   3          1H5*        C   3  -9.032  -4.884  -6.536
   25   2H5*    C   3          2H5*        C   3  -7.791  -4.183  -7.584
   26    H4*    C   3           H4*        C   3  -9.206  -2.442  -6.502
   27    H3*    C   3           H3*        C   3  -6.294  -2.539  -5.632
   28    H2*    C   3           H2*        C   3  -6.676  -0.532  -4.493
   29   2HO*    C   3          2HO*        C   3  -8.500   0.757  -4.820
   30    H1*    C   3           H1*        C   3  -9.314  -1.239  -3.695
   31   1H4     C   3          1H4         C   3  -4.284  -2.797   0.506
   32   2H4     C   3          2H4         C   3  -5.000  -1.311   1.100
   33    H5     C   3           H5         C   3  -5.040  -3.880  -1.615
   34    H6     C   3           H6         C   3  -6.617  -3.723  -3.422
   35   1H5*    U   4          1H5*        U   4  -7.361   1.563  -7.287
   36   2H5*    U   4          2H5*        U   4  -5.959   2.176  -8.172
   37    H4*    U   4           H4*        U   4  -6.812   3.761  -6.472
   38    H3*    U   4           H3*        U   4  -4.010   2.680  -5.981
   39    H2*    U   4           H2*        U   4  -3.889   4.509  -4.309
   40   2HO*    U   4          2HO*        U   4  -5.272   5.904  -5.712
   41    H1*    U   4           H1*        U   4  -6.262   3.829  -3.225
   42    H3     U   4           H3         U   4  -3.170   2.288  -0.257
   43    H5     U   4           H5         U   4  -3.695  -0.835  -3.041
   44    H6     U   4           H6         U   4  -4.906   0.682  -4.444
   45   1H5*    U   5          1H5*        U   5  -3.711   7.068  -5.935
   46   2H5*    U   5          2H5*        U   5  -2.212   7.524  -6.752
   47    H4*    U   5           H4*        U   5  -2.329   8.433  -4.490
   48    H3*    U   5           H3*        U   5  -0.208   6.269  -4.832
   49    H2*    U   5           H2*        U   5   0.623   7.189  -2.671
   50   2HO*    U   5          2HO*        U   5  -0.069   9.388  -3.245
   51    H1*    U   5           H1*        U   5  -1.783   6.995  -1.564
   52    H3     U   5           H3         U   5   0.367   3.378   0.122
   53    H5     U   5           H5         U   5  -1.219   2.079  -3.567
   54    H6     U   5           H6         U   5  -1.818   4.332  -4.055
   55   1H5*    U   6          1H5*        U   6   1.892   9.722  -3.288
   56   2H5*    U   6          2H5*        U   6   3.462   9.855  -4.094
   57    H4*    U   6           H4*        U   6   3.661   9.687  -1.624
   58    H3*    U   6           H3*        U   6   4.763   7.357  -3.231
   59    H2*    U   6           H2*        U   6   5.720   6.600  -1.185
   60   2HO*    U   6          2HO*        U   6   5.660   7.843   0.712
   61    H1*    U   6           H1*        U   6   3.427   7.151   0.332
   62    H3     U   6           H3         U   6   4.408   2.604   0.013
   63    H5     U   6           H5         U   6   1.916   3.529  -3.266
   64    H6     U   6           H6         U   6   2.141   5.850  -2.721
   65   1H5*    G   7          1H5*        G   7   8.144   8.028  -0.858
   66   2H5*    G   7          2H5*        G   7   9.590   7.927  -1.881
   67    H4*    G   7           H4*        G   7   9.582   6.160  -0.188
   68    H3*    G   7           H3*        G   7   9.176   5.175  -3.035
   69    H2*    G   7           H2*        G   7   9.355   2.902  -2.117
   70   2HO*    G   7          2HO*        G   7  10.063   4.194   0.311
   71    H1*    G   7           H1*        G   7   7.596   3.375  -0.119
   72    H8     G   7           H8         G   7   6.353   5.500  -3.033
   73    H1     G   7           H1         G   7   5.041  -0.768  -3.638
   74   1H2     G   7          1H2         G   7   6.147  -1.922  -2.040
   75   2H2     G   7          2H2         G   7   7.153  -1.119  -0.860
   76   1H5*    G   8          1H5*        G   8  12.215   1.936  -4.829
   77   2H5*    G   8          2H5*        G   8  11.283   3.227  -5.598
   78    H4*    G   8           H4*        G   8  10.086   1.009  -3.889
   79    H3*    G   8           H3*        G   8  10.985   0.490  -6.354
   80    H2*    G   8           H2*        G   8   9.999   2.559  -7.301
   81   2HO*    G   8          2HO*        G   8   8.189   1.895  -8.587
   82    H1*    G   8           H1*        G   8   7.438   1.652  -5.907
   83    H8     G   8           H8         G   8   9.512   4.742  -6.240
   84    H1     G   8           H1         G   8   3.236   5.755  -7.166
   85   1H2     G   8          1H2         G   8   2.164   3.785  -6.988
   86   2H2     G   8          2H2         G   8   3.035   2.286  -6.700
   87   1H5*    A   9          1H5*        A   9  10.397  -4.260  -6.326
   88   2H5*    A   9          2H5*        A   9   8.674  -4.485  -6.711
   89    H4*    A   9           H4*        A   9   9.385  -5.952  -4.857
   90    H3*    A   9           H3*        A   9   7.089  -4.230  -4.812
   91    H2*    A   9           H2*        A   9   7.858  -2.672  -3.432
   92   2HO*    A   9          2HO*        A   9   7.042  -4.725  -1.669
   93    H1*    A   9           H1*        A   9   9.439  -4.702  -1.783
   94    H8     A   9           H8         A   9   9.356  -1.144  -3.383
   95   1H6     A   9          1H6         A   9  12.520   1.005  -0.355
   96   2H6     A   9          2H6         A   9  13.597   0.385   0.883
   97    H2     A   9           H2         A   9  12.966  -4.018   1.124
   98   1H5*    U  10          1H5*        U  10   6.896  -9.958  -4.060
   99   2H5*    U  10          2H5*        U  10   5.169  -9.633  -3.775
  100    H4*    U  10           H4*        U  10   5.558  -9.795  -1.312
  101    H3*    U  10           H3*        U  10   8.382 -10.543  -2.177
  102    H2*    U  10           H2*        U  10   8.499 -11.778  -0.115
  103   2HO*    U  10          2HO*        U  10   6.885 -11.570   1.467
  104    H1*    U  10           H1*        U  10   5.776 -12.628  -0.393
  105    H3     U  10           H3         U  10   8.208 -16.539  -0.605
  106    H5     U  10           H5         U  10   9.335 -14.459  -4.096
  107    H6     U  10           H6         U  10   8.008 -12.591  -3.364
  108   1H5*    A  11          1H5*        A  11   8.067  -8.642   2.929
  109   2H5*    A  11          2H5*        A  11   7.598  -7.649   1.553
  110    H4*    A  11           H4*        A  11  10.166  -7.253   3.205
  111    H3*    A  11           H3*        A  11   7.447  -5.901   3.380
  112    H2*    A  11           H2*        A  11   8.564  -4.013   4.189
  113   2HO*    A  11          2HO*        A  11  10.706  -4.077   4.972
  114    H1*    A  11           H1*        A  11  10.939  -4.575   2.613
  115    H8     A  11           H8         A  11   7.728  -4.183   0.646
  116   1H6     A  11          1H6         A  11   8.039   0.672  -0.133
  117   2H6     A  11          2H6         A  11   9.067   1.896   0.582
  118    H2     A  11           H2         A  11  11.621  -0.030   3.653
  119   1H5*    A  12          1H5*        A  12   6.398  -4.071   7.879
  120   2H5*    A  12          2H5*        A  12   6.012  -3.788   6.176
  121    H4*    A  12           H4*        A  12   8.266  -2.476   7.762
  122    H3*    A  12           H3*        A  12   5.574  -1.585   6.688
  123    H2*    A  12           H2*        A  12   6.448   0.611   6.230
  124   2HO*    A  12          2HO*        A  12   8.775  -0.273   7.607
  125    H1*    A  12           H1*        A  12   8.686  -0.305   4.963
  126    H8     A  12           H8         A  12   6.362  -3.074   4.048
  127   1H6     A  12          1H6         A  12   4.077  -0.966   0.328
  128   2H6     A  12          2H6         A  12   3.996   0.681  -0.263
  129    H2     A  12           H2         A  12   6.507   3.175   2.463
  130   1H5*    A  13          1H5*        A  13   6.486   1.872   8.891
  131   2H5*    A  13          2H5*        A  13   5.128   2.217   9.979
  132    H4*    A  13           H4*        A  13   5.496   4.122   8.511
  133    H3*    A  13           H3*        A  13   2.998   2.525   7.801
  134    H2*    A  13           H2*        A  13   2.455   4.319   6.355
  135   2HO*    A  13          2HO*        A  13   3.279   5.954   7.941
  136    H1*    A  13           H1*        A  13   5.039   4.579   5.348
  137    H8     A  13           H8         A  13   4.034   0.971   5.897
  138   1H6     A  13          1H6         A  13   0.957   1.333   0.508
  139   2H6     A  13          2H6         A  13   1.653   0.230   1.679
  140    H2     A  13           H2         A  13   1.958   5.471   1.826
  141   1H5*    A  14          1H5*        A  14   1.598   6.701   8.574
  142   2H5*    A  14          2H5*        A  14  -0.035   6.609   9.244
  143    H4*    A  14           H4*        A  14   0.215   7.902   7.081
  144    H3*    A  14           H3*        A  14  -1.673   5.524   7.136
  145    H2*    A  14           H2*        A  14  -2.422   6.295   4.947
  146   2HO*    A  14          2HO*        A  14  -0.767   8.567   5.408
  147    H1*    A  14           H1*        A  14   0.136   6.688   4.034
  148    H8     A  14           H8         A  14   0.506   3.468   5.934
  149   1H6     A  14          1H6         A  14  -2.206   0.831   1.008
  150   2H6     A  14          2H6         A  14  -1.206   0.540   2.417
  151    H2     A  14           H2         A  14  -3.126   5.221   0.959
  152   1H5*    G  15          1H5*        G  15  -3.881   8.889   5.266
  153   2H5*    G  15          2H5*        G  15  -5.486   8.891   5.995
  154    H4*    G  15           H4*        G  15  -5.712   8.810   3.593
  155    H3*    G  15           H3*        G  15  -6.302   6.125   4.875
  156    H2*    G  15           H2*        G  15  -7.370   5.552   2.913
  157   2HO*    G  15          2HO*        G  15  -6.931   8.245   2.030
  158    H1*    G  15           H1*        G  15  -5.235   6.431   1.395
  159    H8     G  15           H8         G  15  -4.200   4.925   4.678
  160    H1     G  15           H1         G  15  -6.213   0.530   0.419
  161   1H2     G  15          1H2         G  15  -7.546   3.331  -1.214
  162   2H2     G  15          2H2         G  15  -7.396   1.585  -1.183
  163   1H5*    C  16          1H5*        C  16  -9.857   7.412   2.731
  164   2H5*    C  16          2H5*        C  16 -11.330   7.025   3.626
  165    H4*    C  16           H4*        C  16 -11.273   6.088   1.312
  166    H3*    C  16           H3*        C  16 -11.348   4.074   3.588
  167    H2*    C  16           H2*        C  16 -11.882   2.453   1.831
  168   2HO*    C  16          2HO*        C  16 -13.134   4.139   0.629
  169    H1*    C  16           H1*        C  16  -9.833   3.413   0.199
  170   1H4     C  16          1H4         C  16  -6.866  -0.337   4.840
  171   2H4     C  16          2H4         C  16  -7.421  -1.448   3.600
  172    H5     C  16           H5         C  16  -7.469   2.066   4.823
  173    H6     C  16           H6         C  16  -8.600   3.781   3.587
  174   1H5*    C  17          1H5*        C  17 -14.845   3.239   0.950
  175   2H5*    C  17          2H5*        C  17 -16.222   2.866   1.996
  176    H4*    C  17           H4*        C  17 -15.785   1.064   0.365
  177    H3*    C  17           H3*        C  17 -15.239   0.309   3.278
  178    H2*    C  17           H2*        C  17 -15.120  -1.953   2.472
  179   2HO*    C  17          2HO*        C  17 -16.896  -1.715   0.982
  180    H1*    C  17           H1*        C  17 -13.612  -1.186   0.206
  181   1H4     C  17          1H4         C  17  -9.433  -1.729   5.398
  182   2H4     C  17          2H4         C  17  -9.443  -3.288   4.599
  183    H5     C  17           H5         C  17 -10.958   0.111   4.738
  184    H6     C  17           H6         C  17 -12.677   0.758   3.188
  185    H3T    C  17           H3T        C  17 -17.362   1.026   2.794
  Start of MODEL   14
    1   1H5*    G   1          1H5*        G   1  -4.656 -13.562   0.290
    2   2H5*    G   1          2H5*        G   1  -4.066 -12.529   1.607
    3    H4*    G   1           H4*        G   1  -6.995 -12.714   0.705
    4    H3*    G   1           H3*        G   1  -4.846 -10.623   0.210
    5    H2*    G   1           H2*        G   1  -6.571  -9.033   0.076
    6   2HO*    G   1          2HO*        G   1  -7.986  -9.906  -1.340
    7    H1*    G   1           H1*        G   1  -8.259 -10.574   1.901
    8    H8     G   1           H8         G   1  -5.064  -9.407   3.541
    9    H1     G   1           H1         G   1  -9.584  -4.815   3.171
   10   1H2     G   1          1H2         G   1 -11.123  -7.014   0.925
   11   2H2     G   1          2H2         G   1 -11.179  -5.455   1.724
   12    H5T    G   1           H5T        G   1  -6.022 -14.577   1.827
   13   1H5*    G   2          1H5*        G   2  -8.155 -10.674  -3.216
   14   2H5*    G   2          2H5*        G   2  -7.328 -10.031  -4.645
   15    H4*    G   2           H4*        G   2  -9.439  -8.816  -4.127
   16    H3*    G   2           H3*        G   2  -6.863  -7.221  -3.826
   17    H2*    G   2           H2*        G   2  -8.266  -5.310  -3.585
   18   2HO*    G   2          2HO*        G   2  -9.719  -6.157  -5.350
   19    H1*    G   2           H1*        G   2 -10.211  -6.641  -2.078
   20    H8     G   2           H8         G   2  -6.716  -7.339  -0.810
   21    H1     G   2           H1         G   2  -9.096  -1.676   1.129
   22   1H2     G   2          1H2         G   2 -11.408  -2.180  -1.458
   23   2H2     G   2          2H2         G   2 -10.800  -1.097  -0.219
   24   1H5*    C   3          1H5*        C   3  -9.384  -4.746  -6.654
   25   2H5*    C   3          2H5*        C   3  -8.214  -3.998  -7.748
   26    H4*    C   3           H4*        C   3  -9.506  -2.322  -6.424
   27    H3*    C   3           H3*        C   3  -6.524  -2.509  -5.862
   28    H2*    C   3           H2*        C   3  -6.754  -0.590  -4.539
   29   2HO*    C   3          2HO*        C   3  -8.066   0.592  -6.029
   30    H1*    C   3           H1*        C   3  -9.320  -1.319  -3.539
   31   1H4     C   3          1H4         C   3  -3.955  -3.263   0.054
   32   2H4     C   3          2H4         C   3  -4.600  -1.813   0.807
   33    H5     C   3           H5         C   3  -4.902  -4.156  -2.096
   34    H6     C   3           H6         C   3  -6.653  -3.853  -3.718
   35   1H5*    U   4          1H5*        U   4  -7.611   1.899  -7.360
   36   2H5*    U   4          2H5*        U   4  -6.165   2.373  -8.258
   37    H4*    U   4           H4*        U   4  -6.825   4.001  -6.491
   38    H3*    U   4           H3*        U   4  -4.124   2.645  -6.160
   39    H2*    U   4           H2*        U   4  -3.739   4.378  -4.457
   40   2HO*    U   4          2HO*        U   4  -5.249   5.979  -4.093
   41    H1*    U   4           H1*        U   4  -6.142   3.952  -3.295
   42    H3     U   4           H3         U   4  -3.097   2.122  -0.446
   43    H5     U   4           H5         U   4  -3.871  -0.892  -3.291
   44    H6     U   4           H6         U   4  -5.044   0.731  -4.616
   45   1H5*    U   5          1H5*        U   5  -3.622   7.008  -6.084
   46   2H5*    U   5          2H5*        U   5  -2.115   7.440  -6.899
   47    H4*    U   5           H4*        U   5  -2.223   8.349  -4.632
   48    H3*    U   5           H3*        U   5  -0.123   6.164  -4.982
   49    H2*    U   5           H2*        U   5   0.722   7.067  -2.830
   50   2HO*    U   5          2HO*        U   5   0.052   9.280  -3.427
   51    H1*    U   5           H1*        U   5  -1.711   6.955  -1.714
   52    H3     U   5           H3         U   5   0.371   3.343   0.088
   53    H5     U   5           H5         U   5  -1.111   1.997  -3.629
   54    H6     U   5           H6         U   5  -1.685   4.249  -4.167
   55   1H5*    U   6          1H5*        U   6   2.001   9.651  -3.428
   56   2H5*    U   6          2H5*        U   6   3.569   9.755  -4.240
   57    H4*    U   6           H4*        U   6   3.783   9.615  -1.782
   58    H3*    U   6           H3*        U   6   4.817   7.206  -3.327
   59    H2*    U   6           H2*        U   6   5.810   6.534  -1.266
   60   2HO*    U   6          2HO*        U   6   5.123   9.103  -0.268
   61    H1*    U   6           H1*        U   6   3.536   7.218   0.253
   62    H3     U   6           H3         U   6   4.529   2.654   0.233
   63    H5     U   6           H5         U   6   2.041   3.337  -3.103
   64    H6     U   6           H6         U   6   2.219   5.692  -2.699
   65   1H5*    G   7          1H5*        G   7   8.221   7.934  -1.067
   66   2H5*    G   7          2H5*        G   7   9.658   7.746  -2.088
   67    H4*    G   7           H4*        G   7   9.623   6.087  -0.288
   68    H3*    G   7           H3*        G   7   9.165   4.876  -3.043
   69    H2*    G   7           H2*        G   7   9.429   2.707  -1.911
   70   2HO*    G   7          2HO*        G   7  11.054   3.357  -0.429
   71    H1*    G   7           H1*        G   7   7.615   3.354  -0.011
   72    H8     G   7           H8         G   7   6.412   5.248  -3.075
   73    H1     G   7           H1         G   7   5.223  -1.066  -3.386
   74   1H2     G   7          1H2         G   7   6.417  -2.126  -1.839
   75   2H2     G   7          2H2         G   7   7.344  -1.279  -0.613
   76   1H5*    G   8          1H5*        G   8  12.226   1.442  -3.910
   77   2H5*    G   8          2H5*        G   8  11.848   2.261  -5.441
   78    H4*    G   8           H4*        G   8   9.884   0.769  -3.624
   79    H3*    G   8           H3*        G   8  11.257   0.156  -6.192
   80    H2*    G   8           H2*        G   8   9.355  -0.390  -7.250
   81   2HO*    G   8          2HO*        G   8   8.326  -1.835  -5.042
   82    H1*    G   8           H1*        G   8   7.813   0.226  -4.707
   83    H8     G   8           H8         G   8   7.781   2.949  -7.167
   84    H1     G   8           H1         G   8   2.978  -1.249  -8.099
   85   1H2     G   8          1H2         G   8   3.424  -3.154  -6.981
   86   2H2     G   8          2H2         G   8   4.918  -3.360  -6.087
   87   1H5*    A   9          1H5*        A   9  12.093  -5.284  -5.182
   88   2H5*    A   9          2H5*        A   9  10.424  -5.554  -5.659
   89    H4*    A   9           H4*        A   9  10.530  -5.881  -3.313
   90    H3*    A   9           H3*        A   9   9.321  -3.155  -3.891
   91    H2*    A   9           H2*        A   9   8.631  -3.196  -1.586
   92   2HO*    A   9          2HO*        A   9   8.088  -5.553  -1.761
   93    H1*    A   9           H1*        A   9  11.080  -4.387  -0.790
   94    H8     A   9           H8         A   9  10.024  -1.162  -2.827
   95   1H6     A   9          1H6         A   9  12.810   1.986  -0.361
   96   2H6     A   9          2H6         A   9  13.987   1.781   0.923
   97    H2     A   9           H2         A   9  14.244  -2.560   1.854
   98   1H5*    U  10          1H5*        U  10   4.886  -3.802  -1.893
   99   2H5*    U  10          2H5*        U  10   6.406  -4.479  -1.291
  100    H4*    U  10           H4*        U  10   4.531  -5.463  -0.085
  101    H3*    U  10           H3*        U  10   5.785  -7.430  -2.063
  102    H2*    U  10           H2*        U  10   4.413  -9.089  -1.033
  103   2HO*    U  10          2HO*        U  10   4.791  -8.476   1.128
  104    H1*    U  10           H1*        U  10   2.213  -7.296  -0.735
  105    H3     U  10           H3         U  10   0.663 -10.522  -3.642
  106    H5     U  10           H5         U  10   3.701  -8.572  -5.825
  107    H6     U  10           H6         U  10   4.198  -7.253  -3.879
  108   1H5*    A  11          1H5*        A  11   7.880  -8.081   3.091
  109   2H5*    A  11          2H5*        A  11   7.364  -6.612   2.244
  110    H4*    A  11           H4*        A  11  10.183  -7.208   3.264
  111    H3*    A  11           H3*        A  11   7.954  -5.247   3.932
  112    H2*    A  11           H2*        A  11   9.504  -3.645   4.511
  113   2HO*    A  11          2HO*        A  11  11.710  -4.123   4.909
  114    H1*    A  11           H1*        A  11  11.426  -4.343   2.548
  115    H8     A  11           H8         A  11   7.915  -4.023   1.227
  116   1H6     A  11          1H6         A  11   8.014   0.800   0.238
  117   2H6     A  11          2H6         A  11   9.058   2.077   0.834
  118    H2     A  11           H2         A  11  12.045   0.290   3.576
  119   1H5*    A  12          1H5*        A  12   7.737  -3.502   8.488
  120   2H5*    A  12          2H5*        A  12   6.886  -3.292   6.947
  121    H4*    A  12           H4*        A  12   9.480  -1.903   7.751
  122    H3*    A  12           H3*        A  12   6.556  -1.135   7.646
  123    H2*    A  12           H2*        A  12   6.986   0.959   6.630
  124   2HO*    A  12          2HO*        A  12   9.066   1.844   6.543
  125    H1*    A  12           H1*        A  12   8.999   0.149   4.934
  126    H8     A  12           H8         A  12   6.693  -2.748   4.604
  127   1H6     A  12          1H6         A  12   4.315  -1.026   0.712
  128   2H6     A  12          2H6         A  12   4.169   0.573   0.009
  129    H2     A  12           H2         A  12   6.525   3.366   2.572
  130   1H5*    A  13          1H5*        A  13   4.384   1.530   9.774
  131   2H5*    A  13          2H5*        A  13   4.774   0.771   8.218
  132    H4*    A  13           H4*        A  13   5.107   3.763   8.785
  133    H3*    A  13           H3*        A  13   2.813   2.147   7.635
  134    H2*    A  13           H2*        A  13   2.269   4.024   6.317
  135   2HO*    A  13          2HO*        A  13   3.305   6.039   6.575
  136    H1*    A  13           H1*        A  13   4.887   4.529   5.542
  137    H8     A  13           H8         A  13   4.174   0.849   5.803
  138   1H6     A  13          1H6         A  13   0.989   1.300   0.479
  139   2H6     A  13          2H6         A  13   1.713   0.181   1.617
  140    H2     A  13           H2         A  13   1.891   5.422   1.917
  141   1H5*    A  14          1H5*        A  14   1.301   6.110   8.638
  142   2H5*    A  14          2H5*        A  14  -0.362   6.032   9.236
  143    H4*    A  14           H4*        A  14   0.002   7.501   7.213
  144    H3*    A  14           H3*        A  14  -1.932   5.170   6.994
  145    H2*    A  14           H2*        A  14  -2.564   6.099   4.830
  146   2HO*    A  14          2HO*        A  14  -0.887   8.294   5.528
  147    H1*    A  14           H1*        A  14   0.013   6.456   4.033
  148    H8     A  14           H8         A  14   0.358   3.176   5.807
  149   1H6     A  14          1H6         A  14  -2.224   0.733   0.715
  150   2H6     A  14          2H6         A  14  -1.259   0.393   2.137
  151    H2     A  14           H2         A  14  -3.180   5.121   0.832
  152   1H5*    G  15          1H5*        G  15  -4.025   8.574   5.168
  153   2H5*    G  15          2H5*        G  15  -5.631   8.602   5.896
  154    H4*    G  15           H4*        G  15  -5.900   8.555   3.506
  155    H3*    G  15           H3*        G  15  -6.436   5.823   4.720
  156    H2*    G  15           H2*        G  15  -7.534   5.315   2.751
  157   2HO*    G  15          2HO*        G  15  -7.773   6.860   1.060
  158    H1*    G  15           H1*        G  15  -5.435   6.311   1.233
  159    H8     G  15           H8         G  15  -4.322   4.601   4.394
  160    H1     G  15           H1         G  15  -6.378   0.479  -0.112
  161   1H2     G  15          1H2         G  15  -7.750   3.371  -1.551
  162   2H2     G  15          2H2         G  15  -7.590   1.628  -1.632
  163   1H5*    C  16          1H5*        C  16 -10.067   7.052   2.727
  164   2H5*    C  16          2H5*        C  16 -11.502   6.610   3.661
  165    H4*    C  16           H4*        C  16 -11.486   5.679   1.351
  166    H3*    C  16           H3*        C  16 -11.380   3.660   3.620
  167    H2*    C  16           H2*        C  16 -11.842   1.991   1.908
  168   2HO*    C  16          2HO*        C  16 -12.182   4.186   0.134
  169    H1*    C  16           H1*        C  16  -9.925   3.071   0.190
  170   1H4     C  16          1H4         C  16  -6.583  -0.480   4.730
  171   2H4     C  16          2H4         C  16  -7.113  -1.618   3.501
  172    H5     C  16           H5         C  16  -7.344   1.885   4.745
  173    H6     C  16           H6         C  16  -8.610   3.527   3.542
  174   1H5*    C  17          1H5*        C  17 -14.748   2.549   1.071
  175   2H5*    C  17          2H5*        C  17 -16.132   2.145   2.099
  176    H4*    C  17           H4*        C  17 -15.615   0.305   0.558
  177    H3*    C  17           H3*        C  17 -14.988  -0.319   3.485
  178    H2*    C  17           H2*        C  17 -14.752  -2.595   2.765
  179   2HO*    C  17          2HO*        C  17 -15.243  -3.176   0.603
  180    H1*    C  17           H1*        C  17 -13.338  -1.830   0.435
  181   1H4     C  17          1H4         C  17  -9.009  -1.959   5.529
  182   2H4     C  17          2H4         C  17  -8.939  -3.539   4.775
  183    H5     C  17           H5         C  17 -10.656  -0.236   4.853
  184    H6     C  17           H6         C  17 -12.449   0.258   3.331
  185    H3T    C  17           H3T        C  17 -17.147   0.282   3.008
  Start of MODEL   15
    1   1H5*    G   1          1H5*        G   1  -5.016 -13.390   0.629
    2   2H5*    G   1          2H5*        G   1  -4.963 -12.292   2.023
    3    H4*    G   1           H4*        G   1  -7.496 -12.987   0.441
    4    H3*    G   1           H3*        G   1  -5.659 -10.563   0.366
    5    H2*    G   1           H2*        G   1  -7.603  -9.294  -0.320
    6   2HO*    G   1          2HO*        G   1  -8.882 -11.821  -0.613
    7    H1*    G   1           H1*        G   1  -9.264 -10.566   1.523
    8    H8     G   1           H8         G   1  -5.969  -9.790   3.250
    9    H1     G   1           H1         G   1 -10.047  -4.801   2.900
   10   1H2     G   1          1H2         G   1 -11.687  -6.779   0.518
   11   2H2     G   1          2H2         G   1 -11.636  -5.248   1.371
   12    H5T    G   1           H5T        G   1  -6.507 -14.668   1.807
   13   1H5*    G   2          1H5*        G   2  -8.203 -10.549  -3.294
   14   2H5*    G   2          2H5*        G   2  -7.232  -9.930  -4.637
   15    H4*    G   2           H4*        G   2  -9.291  -8.597  -4.297
   16    H3*    G   2           H3*        G   2  -6.681  -7.174  -3.653
   17    H2*    G   2           H2*        G   2  -7.957  -5.193  -3.481
   18   2HO*    G   2          2HO*        G   2 -10.056  -5.016  -4.228
   19    H1*    G   2           H1*        G   2 -10.155  -6.437  -2.255
   20    H8     G   2           H8         G   2  -6.876  -7.426  -0.643
   21    H1     G   2           H1         G   2  -9.016  -1.629   1.192
   22   1H2     G   2          1H2         G   2 -11.235  -1.994  -1.496
   23   2H2     G   2          2H2         G   2 -10.635  -0.958  -0.215
   24   1H5*    C   3          1H5*        C   3  -8.897  -4.722  -6.700
   25   2H5*    C   3          2H5*        C   3  -7.683  -3.941  -7.723
   26    H4*    C   3           H4*        C   3  -9.156  -2.293  -6.574
   27    H3*    C   3           H3*        C   3  -6.237  -2.315  -5.722
   28    H2*    C   3           H2*        C   3  -6.686  -0.365  -4.510
   29   2HO*    C   3          2HO*        C   3  -8.554   0.870  -4.784
   30    H1*    C   3           H1*        C   3  -9.290  -1.193  -3.726
   31   1H4     C   3          1H4         C   3  -4.176  -2.708   0.387
   32   2H4     C   3          2H4         C   3  -4.937  -1.268   1.036
   33    H5     C   3           H5         C   3  -4.915  -3.750  -1.759
   34    H6     C   3           H6         C   3  -6.508  -3.587  -3.552
   35   1H5*    U   4          1H5*        U   4  -7.463   1.804  -7.214
   36   2H5*    U   4          2H5*        U   4  -6.089   2.507  -8.076
   37    H4*    U   4           H4*        U   4  -6.996   3.979  -6.296
   38    H3*    U   4           H3*        U   4  -4.146   2.992  -5.889
   39    H2*    U   4           H2*        U   4  -4.068   4.734  -4.136
   40   2HO*    U   4          2HO*        U   4  -5.531   6.140  -5.450
   41    H1*    U   4           H1*        U   4  -6.411   3.915  -3.056
   42    H3     U   4           H3         U   4  -3.222   2.376  -0.192
   43    H5     U   4           H5         U   4  -3.647  -0.639  -3.110
   44    H6     U   4           H6         U   4  -4.944   0.884  -4.427
   45   1H5*    U   5          1H5*        U   5  -3.989   7.359  -5.544
   46   2H5*    U   5          2H5*        U   5  -2.536   7.914  -6.384
   47    H4*    U   5           H4*        U   5  -2.589   8.690  -4.084
   48    H3*    U   5           H3*        U   5  -0.434   6.601  -4.615
   49    H2*    U   5           H2*        U   5   0.467   7.375  -2.452
   50   2HO*    U   5          2HO*        U   5  -1.613   9.285  -2.454
   51    H1*    U   5           H1*        U   5  -1.913   7.137  -1.252
   52    H3     U   5           H3         U   5   0.380   3.508   0.208
   53    H5     U   5           H5         U   5  -1.289   2.332  -3.490
   54    H6     U   5           H6         U   5  -1.981   4.580  -3.847
   55   1H5*    U   6          1H5*        U   6   1.594   9.975  -2.869
   56   2H5*    U   6          2H5*        U   6   3.101  10.269  -3.751
   57    H4*    U   6           H4*        U   6   3.527   9.906  -1.358
   58    H3*    U   6           H3*        U   6   4.502   7.666  -3.179
   59    H2*    U   6           H2*        U   6   5.681   6.872  -1.263
   60   2HO*    U   6          2HO*        U   6   6.267   9.066  -0.555
   61    H1*    U   6           H1*        U   6   3.523   7.344   0.477
   62    H3     U   6           H3         U   6   4.583   2.829   0.010
   63    H5     U   6           H5         U   6   1.820   3.724  -3.050
   64    H6     U   6           H6         U   6   2.003   6.041  -2.478
   65   1H5*    G   7          1H5*        G   7   8.085   8.214  -1.134
   66   2H5*    G   7          2H5*        G   7   9.407   8.196  -2.315
   67    H4*    G   7           H4*        G   7   9.573   6.303  -0.745
   68    H3*    G   7           H3*        G   7   8.903   5.558  -3.616
   69    H2*    G   7           H2*        G   7   9.182   3.252  -2.938
   70   2HO*    G   7          2HO*        G   7  11.016   3.607  -1.596
   71    H1*    G   7           H1*        G   7   7.723   3.531  -0.629
   72    H8     G   7           H8         G   7   6.052   5.697  -3.287
   73    H1     G   7           H1         G   7   4.766  -0.589  -3.857
   74   1H2     G   7          1H2         G   7   7.140  -0.949  -1.299
   75   2H2     G   7          2H2         G   7   6.021  -1.748  -2.377
   76   1H5*    G   8          1H5*        G   8  12.803   2.536  -5.244
   77   2H5*    G   8          2H5*        G   8  11.209   2.927  -5.915
   78    H4*    G   8           H4*        G   8  11.784   0.914  -3.717
   79    H3*    G   8           H3*        G   8  12.277   0.363  -6.217
   80    H2*    G   8           H2*        G   8  10.299   1.316  -7.160
   81   2HO*    G   8          2HO*        G   8   8.797  -0.351  -7.727
   82    H1*    G   8           H1*        G   8   8.561  -0.064  -5.078
   83    H8     G   8           H8         G   8   8.895   3.617  -5.293
   84    H1     G   8           H1         G   8   3.817   1.322  -8.520
   85   1H2     G   8          1H2         G   8   3.921  -0.933  -8.531
   86   2H2     G   8          2H2         G   8   5.247  -1.792  -7.772
   87   1H5*    A   9          1H5*        A   9   8.743  -3.423  -6.701
   88   2H5*    A   9          2H5*        A   9   9.253  -2.279  -5.474
   89    H4*    A   9           H4*        A   9   9.607  -5.309  -5.425
   90    H3*    A   9           H3*        A   9   7.319  -3.777  -4.864
   91    H2*    A   9           H2*        A   9   8.211  -2.407  -3.328
   92   2HO*    A   9          2HO*        A   9   7.338  -4.652  -1.841
   93    H1*    A   9           H1*        A   9   9.739  -4.676  -1.996
   94    H8     A   9           H8         A   9  10.026  -1.039  -3.448
   95   1H6     A   9          1H6         A   9  13.821   0.049   1.351
   96   2H6     A   9          2H6         A   9  12.947   0.784   0.019
   97    H2     A   9           H2         A   9  12.765  -4.276   1.417
   98   1H5*    U  10          1H5*        U  10   7.765  -7.852  -2.414
   99   2H5*    U  10          2H5*        U  10   7.704  -9.189  -3.581
  100    H4*    U  10           H4*        U  10   5.553  -8.606  -1.481
  101    H3*    U  10           H3*        U  10   7.876 -10.571  -1.484
  102    H2*    U  10           H2*        U  10   6.524 -11.957  -0.064
  103   2HO*    U  10          2HO*        U  10   4.883  -9.655   0.249
  104    H1*    U  10           H1*        U  10   4.142 -11.291  -1.500
  105    H3     U  10           H3         U  10   4.589 -15.809  -2.279
  106    H5     U  10           H5         U  10   7.955 -14.127  -4.183
  107    H6     U  10           H6         U  10   7.313 -11.973  -3.325
  108   1H5*    A  11          1H5*        A  11   7.902  -8.151   3.511
  109   2H5*    A  11          2H5*        A  11   7.391  -7.242   2.072
  110    H4*    A  11           H4*        A  11   9.905  -6.648   3.718
  111    H3*    A  11           H3*        A  11   7.187  -5.288   3.602
  112    H2*    A  11           H2*        A  11   8.299  -3.318   4.203
  113   2HO*    A  11          2HO*        A  11  10.381  -3.278   5.090
  114    H1*    A  11           H1*        A  11  10.720  -4.105   2.826
  115    H8     A  11           H8         A  11   7.618  -3.871   0.665
  116   1H6     A  11          1H6         A  11   9.202   2.110  -0.070
  117   2H6     A  11          2H6         A  11   8.167   0.842  -0.691
  118    H2     A  11           H2         A  11  11.429   0.518   3.421
  119   1H5*    A  12          1H5*        A  12   8.932  -3.772   7.359
  120   2H5*    A  12          2H5*        A  12   7.584  -3.440   8.453
  121    H4*    A  12           H4*        A  12   8.897  -1.405   7.853
  122    H3*    A  12           H3*        A  12   6.010  -1.475   6.917
  123    H2*    A  12           H2*        A  12   6.320   0.882   6.366
  124   2HO*    A  12          2HO*        A  12   8.241   1.939   6.881
  125    H1*    A  12           H1*        A  12   8.748   0.412   5.118
  126    H8     A  12           H8         A  12   6.223  -2.462   4.538
  127   1H6     A  12          1H6         A  12   4.230  -0.718   0.463
  128   2H6     A  12          2H6         A  12   4.289   0.844  -0.331
  129    H2     A  12           H2         A  12   6.998   3.444   2.083
  130   1H5*    A  13          1H5*        A  13   6.506   2.267   9.108
  131   2H5*    A  13          2H5*        A  13   5.071   2.504  10.120
  132    H4*    A  13           H4*        A  13   5.398   4.419   8.627
  133    H3*    A  13           H3*        A  13   3.015   2.671   7.896
  134    H2*    A  13           H2*        A  13   2.382   4.437   6.443
  135   2HO*    A  13          2HO*        A  13   3.429   6.441   6.445
  136    H1*    A  13           H1*        A  13   4.984   4.846   5.499
  137    H8     A  13           H8         A  13   4.104   1.177   5.930
  138   1H6     A  13          1H6         A  13   1.117   1.573   0.495
  139   2H6     A  13          2H6         A  13   1.828   0.465   1.653
  140    H2     A  13           H2         A  13   1.980   5.709   1.916
  141   1H5*    A  14          1H5*        A  14   1.562   6.738   8.619
  142   2H5*    A  14          2H5*        A  14  -0.051   6.697   9.347
  143    H4*    A  14           H4*        A  14   0.106   7.976   7.188
  144    H3*    A  14           H3*        A  14  -1.729   5.554   7.261
  145    H2*    A  14           H2*        A  14  -2.536   6.304   5.097
  146   2HO*    A  14          2HO*        A  14  -0.980   8.644   5.566
  147    H1*    A  14           H1*        A  14  -0.003   6.823   4.145
  148    H8     A  14           H8         A  14   0.521   3.558   5.918
  149   1H6     A  14          1H6         A  14  -2.151   0.997   0.936
  150   2H6     A  14          2H6         A  14  -1.098   0.704   2.306
  151    H2     A  14           H2         A  14  -3.298   5.337   1.105
  152   1H5*    G  15          1H5*        G  15  -4.097   8.859   5.467
  153   2H5*    G  15          2H5*        G  15  -5.678   8.794   6.247
  154    H4*    G  15           H4*        G  15  -5.993   8.697   3.853
  155    H3*    G  15           H3*        G  15  -6.386   5.976   5.138
  156    H2*    G  15           H2*        G  15  -7.496   5.372   3.204
  157   2HO*    G  15          2HO*        G  15  -7.840   6.850   1.483
  158    H1*    G  15           H1*        G  15  -5.462   6.402   1.627
  159    H8     G  15           H8         G  15  -4.240   4.849   4.831
  160    H1     G  15           H1         G  15  -6.159   0.505   0.474
  161   1H2     G  15          1H2         G  15  -7.657   3.292  -1.034
  162   2H2     G  15          2H2         G  15  -7.420   1.556  -1.068
  163   1H5*    C  16          1H5*        C  16 -10.077   7.182   3.123
  164   2H5*    C  16          2H5*        C  16 -11.506   6.679   4.031
  165    H4*    C  16           H4*        C  16 -11.449   5.862   1.666
  166    H3*    C  16           H3*        C  16 -11.404   3.743   3.846
  167    H2*    C  16           H2*        C  16 -11.908   2.187   2.022
  168   2HO*    C  16          2HO*        C  16 -13.251   3.854   0.919
  169    H1*    C  16           H1*        C  16  -9.925   3.303   0.407
  170   1H4     C  16          1H4         C  16  -6.732  -0.548   4.807
  171   2H4     C  16          2H4         C  16  -7.263  -1.618   3.522
  172    H5     C  16           H5         C  16  -7.441   1.822   4.927
  173    H6     C  16           H6         C  16  -8.667   3.547   3.801
  174   1H5*    C  17          1H5*        C  17 -14.936   2.910   1.240
  175   2H5*    C  17          2H5*        C  17 -16.270   2.416   2.294
  176    H4*    C  17           H4*        C  17 -15.772   0.739   0.540
  177    H3*    C  17           H3*        C  17 -15.203  -0.148   3.406
  178    H2*    C  17           H2*        C  17 -14.952  -2.354   2.513
  179   2HO*    C  17          2HO*        C  17 -15.935  -1.314   0.055
  180    H1*    C  17           H1*        C  17 -13.498  -1.417   0.272
  181   1H4     C  17          1H4         C  17  -9.252  -2.015   5.397
  182   2H4     C  17          2H4         C  17  -9.209  -3.538   4.531
  183    H5     C  17           H5         C  17 -10.858  -0.212   4.831
  184    H6     C  17           H6         C  17 -12.622   0.428   3.329
  185    H3T    C  17           H3T        C  17 -17.292  -1.078   3.109
  Start of MODEL   16
    1   1H5*    G   1          1H5*        G   1  -4.977 -11.626   1.772
    2   2H5*    G   1          2H5*        G   1  -5.704 -13.226   2.021
    3    H4*    G   1           H4*        G   1  -7.466 -12.710   0.355
    4    H3*    G   1           H3*        G   1  -5.967 -10.069   0.162
    5    H2*    G   1           H2*        G   1  -8.090  -9.058  -0.447
    6   2HO*    G   1          2HO*        G   1  -9.076 -11.726  -0.562
    7    H1*    G   1           H1*        G   1  -9.454 -10.363   1.555
    8    H8     G   1           H8         G   1  -6.080  -9.474   3.035
    9    H1     G   1           H1         G   1 -10.289  -4.588   2.904
   10   1H2     G   1          1H2         G   1 -12.023  -6.613   0.634
   11   2H2     G   1          2H2         G   1 -11.952  -5.075   1.472
   12    H5T    G   1           H5T        G   1  -4.785 -12.273  -0.489
   13   1H5*    G   2          1H5*        G   2  -8.644 -10.340  -3.298
   14   2H5*    G   2          2H5*        G   2  -7.792  -9.721  -4.720
   15    H4*    G   2           H4*        G   2  -9.892  -8.495  -4.346
   16    H3*    G   2           H3*        G   2  -7.336  -6.918  -3.842
   17    H2*    G   2           H2*        G   2  -8.688  -4.998  -3.639
   18   2HO*    G   2          2HO*        G   2 -10.777  -6.565  -4.779
   19    H1*    G   2           H1*        G   2 -10.742  -6.258  -2.260
   20    H8     G   2           H8         G   2  -7.353  -7.225  -0.896
   21    H1     G   2           H1         G   2  -9.369  -1.429   1.070
   22   1H2     G   2          1H2         G   2 -11.703  -1.768  -1.522
   23   2H2     G   2          2H2         G   2 -11.032  -0.736  -0.272
   24   1H5*    C   3          1H5*        C   3  -9.612  -4.500  -6.715
   25   2H5*    C   3          2H5*        C   3  -8.447  -3.760  -7.823
   26    H4*    C   3           H4*        C   3  -9.741  -2.054  -6.570
   27    H3*    C   3           H3*        C   3  -6.781  -2.246  -5.904
   28    H2*    C   3           H2*        C   3  -7.032  -0.332  -4.592
   29   2HO*    C   3          2HO*        C   3  -9.523   0.069  -5.920
   30    H1*    C   3           H1*        C   3  -9.631  -1.008  -3.667
   31   1H4     C   3          1H4         C   3  -4.384  -3.037   0.048
   32   2H4     C   3          2H4         C   3  -5.006  -1.570   0.784
   33    H5     C   3           H5         C   3  -5.323  -3.938  -2.095
   34    H6     C   3           H6         C   3  -7.026  -3.598  -3.762
   35   1H5*    U   4          1H5*        U   4  -7.827   2.017  -7.219
   36   2H5*    U   4          2H5*        U   4  -6.473   2.596  -8.202
   37    H4*    U   4           H4*        U   4  -7.048   4.165  -6.394
   38    H3*    U   4           H3*        U   4  -4.330   2.826  -6.109
   39    H2*    U   4           H2*        U   4  -3.945   4.538  -4.387
   40   2HO*    U   4          2HO*        U   4  -5.472   6.115  -3.980
   41    H1*    U   4           H1*        U   4  -6.328   4.070  -3.204
   42    H3     U   4           H3         U   4  -3.257   2.186  -0.422
   43    H5     U   4           H5         U   4  -4.060  -0.770  -3.319
   44    H6     U   4           H6         U   4  -5.245   0.877  -4.600
   45   1H5*    U   5          1H5*        U   5  -3.845   7.182  -5.945
   46   2H5*    U   5          2H5*        U   5  -2.355   7.637  -6.779
   47    H4*    U   5           H4*        U   5  -2.416   8.505  -4.499
   48    H3*    U   5           H3*        U   5  -0.334   6.317  -4.916
   49    H2*    U   5           H2*        U   5   0.559   7.204  -2.763
   50   2HO*    U   5          2HO*        U   5  -0.123   9.417  -3.301
   51    H1*    U   5           H1*        U   5  -1.822   7.029  -1.608
   52    H3     U   5           H3         U   5   0.255   3.352   0.029
   53    H5     U   5           H5         U   5  -1.356   2.126  -3.674
   54    H6     U   5           H6         U   5  -1.889   4.404  -4.147
   55   1H5*    U   6          1H5*        U   6   1.833   9.744  -3.394
   56   2H5*    U   6          2H5*        U   6   3.386   9.864  -4.232
   57    H4*    U   6           H4*        U   6   3.640   9.708  -1.770
   58    H3*    U   6           H3*        U   6   4.684   7.350  -3.378
   59    H2*    U   6           H2*        U   6   5.691   6.610  -1.337
   60   2HO*    U   6          2HO*        U   6   5.690   7.881   0.531
   61    H1*    U   6           H1*        U   6   3.432   7.195   0.213
   62    H3     U   6           H3         U   6   4.278   2.628  -0.043
   63    H5     U   6           H5         U   6   1.792   3.561  -3.323
   64    H6     U   6           H6         U   6   2.087   5.885  -2.823
   65   1H5*    G   7          1H5*        G   7   8.213   8.245  -1.156
   66   2H5*    G   7          2H5*        G   7   9.598   8.123  -2.260
   67    H4*    G   7           H4*        G   7   9.770   6.463  -0.466
   68    H3*    G   7           H3*        G   7   9.166   5.271  -3.199
   69    H2*    G   7           H2*        G   7   9.521   3.088  -2.138
   70   2HO*    G   7          2HO*        G   7  10.396   2.876  -0.174
   71    H1*    G   7           H1*        G   7   7.918   3.675  -0.020
   72    H8     G   7           H8         G   7   6.410   5.460  -3.053
   73    H1     G   7           H1         G   7   5.351  -0.885  -3.003
   74   1H2     G   7          1H2         G   7   7.615  -0.887  -0.323
   75   2H2     G   7          2H2         G   7   6.590  -1.836  -1.370
   76   1H5*    G   8          1H5*        G   8  12.151   1.983  -5.003
   77   2H5*    G   8          2H5*        G   8  11.117   3.177  -5.799
   78    H4*    G   8           H4*        G   8  10.131   1.084  -3.822
   79    H3*    G   8           H3*        G   8  10.863   0.376  -6.297
   80    H2*    G   8           H2*        G   8   9.729   2.316  -7.336
   81   2HO*    G   8          2HO*        G   8   7.851   1.488  -8.410
   82    H1*    G   8           H1*        G   8   7.318   1.462  -5.668
   83    H8     G   8           H8         G   8   9.275   4.550  -6.442
   84    H1     G   8           H1         G   8   2.926   5.411  -6.893
   85   1H2     G   8          1H2         G   8   2.827   1.981  -6.136
   86   2H2     G   8          2H2         G   8   1.909   3.443  -6.459
   87   1H5*    A   9          1H5*        A   9  10.443  -4.401  -5.882
   88   2H5*    A   9          2H5*        A   9   8.695  -4.667  -6.083
   89    H4*    A   9           H4*        A   9   9.597  -5.996  -4.215
   90    H3*    A   9           H3*        A   9   7.285  -4.316  -4.074
   91    H2*    A   9           H2*        A   9   8.122  -2.633  -2.906
   92   2HO*    A   9          2HO*        A   9   7.528  -4.568  -0.938
   93    H1*    A   9           H1*        A   9   9.933  -4.441  -1.242
   94    H8     A   9           H8         A   9   9.507  -1.035  -3.085
   95   1H6     A   9          1H6         A   9  14.351   0.897   0.270
   96   2H6     A   9          2H6         A   9  13.034   1.405  -0.771
   97    H2     A   9           H2         A   9  13.991  -3.507   0.833
   98   1H5*    U  10          1H5*        U  10   6.609  -9.973  -3.016
   99   2H5*    U  10          2H5*        U  10   5.070  -9.221  -2.541
  100    H4*    U  10           H4*        U  10   5.682  -9.493  -0.136
  101    H3*    U  10           H3*        U  10   8.082 -10.963  -1.304
  102    H2*    U  10           H2*        U  10   8.026 -12.322   0.680
  103   2HO*    U  10          2HO*        U  10   6.739 -11.773   2.448
  104    H1*    U  10           H1*        U  10   5.175 -12.387   0.696
  105    H3     U  10           H3         U  10   6.412 -16.770  -0.018
  106    H5     U  10           H5         U  10   7.683 -14.782  -3.513
  107    H6     U  10           H6         U  10   6.995 -12.698  -2.530
  108   1H5*    A  11          1H5*        A  11   9.597  -8.398   3.061
  109   2H5*    A  11          2H5*        A  11   8.674  -7.315   1.997
  110    H4*    A  11           H4*        A  11  11.514  -6.833   3.045
  111    H3*    A  11           H3*        A  11   8.837  -5.577   3.779
  112    H2*    A  11           H2*        A  11  10.132  -3.680   4.484
  113   2HO*    A  11          2HO*        A  11  11.697  -4.966   5.633
  114    H1*    A  11           H1*        A  11  12.045  -4.071   2.392
  115    H8     A  11           H8         A  11   8.377  -3.904   1.306
  116   1H6     A  11          1H6         A  11   9.225   2.253   1.004
  117   2H6     A  11          2H6         A  11   8.171   0.947   0.502
  118    H2     A  11           H2         A  11  12.709   0.504   3.119
  119   1H5*    A  12          1H5*        A  12   8.475  -3.811   8.357
  120   2H5*    A  12          2H5*        A  12   7.326  -4.090   7.033
  121    H4*    A  12           H4*        A  12   9.501  -1.938   7.009
  122    H3*    A  12           H3*        A  12   6.467  -1.912   7.379
  123    H2*    A  12           H2*        A  12   6.411   0.184   6.293
  124   2HO*    A  12          2HO*        A  12   8.076   1.120   7.576
  125    H1*    A  12           H1*        A  12   8.687  -0.392   4.620
  126    H8     A  12           H8         A  12   6.193  -3.086   3.996
  127   1H6     A  12          1H6         A  12   3.871  -0.977   0.281
  128   2H6     A  12          2H6         A  12   3.813   0.665  -0.326
  129    H2     A  12           H2         A  12   6.442   3.133   2.307
  130   1H5*    A  13          1H5*        A  13   4.382   1.190   9.632
  131   2H5*    A  13          2H5*        A  13   4.589   0.422   8.045
  132    H4*    A  13           H4*        A  13   5.198   3.363   8.635
  133    H3*    A  13           H3*        A  13   2.752   1.952   7.523
  134    H2*    A  13           H2*        A  13   2.324   3.894   6.246
  135   2HO*    A  13          2HO*        A  13   4.394   5.157   7.758
  136    H1*    A  13           H1*        A  13   4.948   4.206   5.409
  137    H8     A  13           H8         A  13   3.950   0.583   5.651
  138   1H6     A  13          1H6         A  13   0.777   1.326   0.362
  139   2H6     A  13          2H6         A  13   1.444   0.145   1.472
  140    H2     A  13           H2         A  13   1.950   5.359   1.858
  141   1H5*    A  14          1H5*        A  14   1.495   5.970   8.572
  142   2H5*    A  14          2H5*        A  14  -0.144   5.968   9.240
  143    H4*    A  14           H4*        A  14   0.179   7.409   7.202
  144    H3*    A  14           H3*        A  14  -1.820   5.128   7.037
  145    H2*    A  14           H2*        A  14  -2.491   6.080   4.897
  146   2HO*    A  14          2HO*        A  14  -0.741   8.232   5.546
  147    H1*    A  14           H1*        A  14   0.077   6.389   4.031
  148    H8     A  14           H8         A  14   0.367   3.081   5.769
  149   1H6     A  14          1H6         A  14  -2.413   0.759   0.723
  150   2H6     A  14          2H6         A  14  -1.427   0.377   2.120
  151    H2     A  14           H2         A  14  -3.223   5.174   0.895
  152   1H5*    G  15          1H5*        G  15  -3.875   8.618   5.307
  153   2H5*    G  15          2H5*        G  15  -5.467   8.669   6.063
  154    H4*    G  15           H4*        G  15  -5.768   8.665   3.673
  155    H3*    G  15           H3*        G  15  -6.369   5.937   4.862
  156    H2*    G  15           H2*        G  15  -7.507   5.484   2.902
  157   2HO*    G  15          2HO*        G  15  -7.715   7.053   1.229
  158    H1*    G  15           H1*        G  15  -5.395   6.424   1.369
  159    H8     G  15           H8         G  15  -4.300   4.665   4.507
  160    H1     G  15           H1         G  15  -6.541   0.633   0.009
  161   1H2     G  15          1H2         G  15  -7.840   3.573  -1.395
  162   2H2     G  15          2H2         G  15  -7.733   1.827  -1.491
  163   1H5*    C  16          1H5*        C  16  -9.971   7.355   2.904
  164   2H5*    C  16          2H5*        C  16 -11.419   6.945   3.833
  165    H4*    C  16           H4*        C  16 -11.447   6.094   1.490
  166    H3*    C  16           H3*        C  16 -11.449   4.004   3.694
  167    H2*    C  16           H2*        C  16 -12.007   2.419   1.932
  168   2HO*    C  16          2HO*        C  16 -12.224   4.683   0.228
  169    H1*    C  16           H1*        C  16 -10.035   3.444   0.243
  170   1H4     C  16          1H4         C  16  -6.897  -0.426   4.669
  171   2H4     C  16          2H4         C  16  -7.488  -1.498   3.411
  172    H5     C  16           H5         C  16  -7.515   1.976   4.749
  173    H6     C  16           H6         C  16  -8.692   3.720   3.601
  174   1H5*    C  17          1H5*        C  17 -14.890   3.208   1.116
  175   2H5*    C  17          2H5*        C  17 -16.295   2.838   2.127
  176    H4*    C  17           H4*        C  17 -15.879   1.047   0.494
  177    H3*    C  17           H3*        C  17 -15.312   0.248   3.391
  178    H2*    C  17           H2*        C  17 -15.205  -2.001   2.563
  179   2HO*    C  17          2HO*        C  17 -15.707  -2.448   0.372
  180    H1*    C  17           H1*        C  17 -13.720  -1.213   0.287
  181   1H4     C  17          1H4         C  17  -9.424  -1.809   5.364
  182   2H4     C  17          2H4         C  17  -9.455  -3.361   4.550
  183    H5     C  17           H5         C  17 -10.972   0.033   4.768
  184    H6     C  17           H6         C  17 -12.734   0.693   3.272
  185    H3T    C  17           H3T        C  17 -17.429   0.997   2.931
  Start of MODEL   17
    1   1H5*    G   1          1H5*        G   1  -4.531 -11.823   1.596
    2   2H5*    G   1          2H5*        G   1  -5.201 -13.449   1.833
    3    H4*    G   1           H4*        G   1  -6.994 -12.975   0.188
    4    H3*    G   1           H3*        G   1  -5.587 -10.284   0.010
    5    H2*    G   1           H2*        G   1  -7.748  -9.337  -0.568
    6   2HO*    G   1          2HO*        G   1  -8.647 -12.035  -0.698
    7    H1*    G   1           H1*        G   1  -9.047 -10.701   1.436
    8    H8     G   1           H8         G   1  -5.687  -9.734   2.896
    9    H1     G   1           H1         G   1 -10.024  -4.960   2.841
   10   1H2     G   1          1H2         G   1 -11.722  -7.010   0.565
   11   2H2     G   1          2H2         G   1 -11.684  -5.478   1.416
   12    H5T    G   1           H5T        G   1  -4.338 -12.439  -0.675
   13   1H5*    G   2          1H5*        G   2  -8.288 -10.603  -3.426
   14   2H5*    G   2          2H5*        G   2  -7.469  -9.947  -4.850
   15    H4*    G   2           H4*        G   2  -9.603  -8.788  -4.445
   16    H3*    G   2           H3*        G   2  -7.087  -7.142  -3.960
   17    H2*    G   2           H2*        G   2  -8.487  -5.264  -3.714
   18   2HO*    G   2          2HO*        G   2 -10.549  -6.873  -4.844
   19    H1*    G   2           H1*        G   2 -10.487  -6.589  -2.321
   20    H8     G   2           H8         G   2  -7.060  -7.490  -1.015
   21    H1     G   2           H1         G   2  -9.174  -1.759   1.031
   22   1H2     G   2          1H2         G   2 -11.524  -2.119  -1.545
   23   2H2     G   2          2H2         G   2 -10.861  -1.085  -0.292
   24   1H5*    C   3          1H5*        C   3  -9.455  -4.729  -6.744
   25   2H5*    C   3          2H5*        C   3  -8.323  -3.958  -7.865
   26    H4*    C   3           H4*        C   3  -9.608  -2.285  -6.564
   27    H3*    C   3           H3*        C   3  -6.632  -2.457  -5.959
   28    H2*    C   3           H2*        C   3  -6.871  -0.571  -4.611
   29   2HO*    C   3          2HO*        C   3  -9.387  -0.161  -5.887
   30    H1*    C   3           H1*        C   3  -9.448  -1.275  -3.648
   31   1H4     C   3          1H4         C   3  -4.137  -3.343  -0.049
   32   2H4     C   3          2H4         C   3  -4.758  -1.891   0.720
   33    H5     C   3           H5         C   3  -5.100  -4.206  -2.203
   34    H6     C   3           H6         C   3  -6.832  -3.849  -3.833
   35   1H5*    U   4          1H5*        U   4  -7.752   1.822  -7.202
   36   2H5*    U   4          2H5*        U   4  -6.424   2.420  -8.207
   37    H4*    U   4           H4*        U   4  -6.966   3.966  -6.367
   38    H3*    U   4           H3*        U   4  -4.237   2.635  -6.166
   39    H2*    U   4           H2*        U   4  -3.814   4.306  -4.423
   40   2HO*    U   4          2HO*        U   4  -5.324   5.888  -3.958
   41    H1*    U   4           H1*        U   4  -6.192   3.846  -3.209
   42    H3     U   4           H3         U   4  -3.145   1.949  -0.429
   43    H5     U   4           H5         U   4  -3.908  -0.987  -3.359
   44    H6     U   4           H6         U   4  -5.096   0.666  -4.634
   45   1H5*    U   5          1H5*        U   5  -3.673   6.964  -5.891
   46   2H5*    U   5          2H5*        U   5  -2.183   7.405  -6.732
   47    H4*    U   5           H4*        U   5  -2.176   8.169  -4.413
   48    H3*    U   5           H3*        U   5  -0.165   5.943  -4.970
   49    H2*    U   5           H2*        U   5   0.777   6.676  -2.795
   50   2HO*    U   5          2HO*        U   5   0.171   8.944  -3.237
   51    H1*    U   5           H1*        U   5  -1.611   6.594  -1.607
   52    H3     U   5           H3         U   5   0.324   2.815  -0.047
   53    H5     U   5           H5         U   5  -1.230   1.731  -3.820
   54    H6     U   5           H6         U   5  -1.755   4.024  -4.213
   55   1H5*    U   6          1H5*        U   6   2.120   9.302  -3.204
   56   2H5*    U   6          2H5*        U   6   3.628   9.439  -4.118
   57    H4*    U   6           H4*        U   6   4.054   9.167  -1.715
   58    H3*    U   6           H3*        U   6   4.866   6.786  -3.433
   59    H2*    U   6           H2*        U   6   6.038   6.017  -1.481
   60   2HO*    U   6          2HO*        U   6   6.781   8.174  -0.898
   61    H1*    U   6           H1*        U   6   3.924   6.708   0.244
   62    H3     U   6           H3         U   6   4.542   2.108   0.073
   63    H5     U   6           H5         U   6   1.918   3.055  -3.088
   64    H6     U   6           H6         U   6   2.318   5.373  -2.673
   65   1H5*    G   7          1H5*        G   7   8.698   7.612  -1.556
   66   2H5*    G   7          2H5*        G   7   9.914   7.429  -2.836
   67    H4*    G   7           H4*        G   7  10.285   5.793  -1.050
   68    H3*    G   7           H3*        G   7   9.248   4.570  -3.636
   69    H2*    G   7           H2*        G   7   9.766   2.404  -2.594
   70   2HO*    G   7          2HO*        G   7  10.846   2.264  -0.690
   71    H1*    G   7           H1*        G   7   8.510   3.078  -0.276
   72    H8     G   7           H8         G   7   6.645   4.719  -3.204
   73    H1     G   7           H1         G   7   5.367  -1.534  -2.456
   74   1H2     G   7          1H2         G   7   6.769  -2.432  -0.957
   75   2H2     G   7          2H2         G   7   7.979  -1.470  -0.140
   76   1H5*    G   8          1H5*        G   8  11.993   1.408  -5.884
   77   2H5*    G   8          2H5*        G   8  10.589   2.312  -6.501
   78    H4*    G   8           H4*        G   8  10.362   0.347  -4.195
   79    H3*    G   8           H3*        G   8  11.052  -0.535  -6.688
   80    H2*    G   8           H2*        G   8   9.042   0.577  -7.692
   81   2HO*    G   8          2HO*        G   8   8.329  -2.121  -7.148
   82    H1*    G   8           H1*        G   8   7.705  -0.603  -5.190
   83    H8     G   8           H8         G   8   7.059   2.792  -6.527
   84    H1     G   8           H1         G   8   2.034  -1.234  -6.718
   85   1H2     G   8          1H2         G   8   2.739  -3.298  -6.133
   86   2H2     G   8          2H2         G   8   4.432  -3.630  -5.817
   87   1H5*    A   9          1H5*        A   9  12.271  -5.178  -4.816
   88   2H5*    A   9          2H5*        A   9  10.666  -5.909  -5.051
   89    H4*    A   9           H4*        A   9  11.601  -6.545  -2.867
   90    H3*    A   9           H3*        A   9   9.014  -5.438  -3.261
   91    H2*    A   9           H2*        A   9   9.339  -3.386  -2.447
   92   2HO*    A   9          2HO*        A   9   8.897  -3.240  -0.195
   93    H1*    A   9           H1*        A   9  11.323  -4.308  -0.345
   94    H8     A   9           H8         A   9  10.491  -1.635  -3.107
   95   1H6     A   9          1H6         A   9  14.211   2.131   0.122
   96   2H6     A   9          2H6         A   9  12.995   2.057  -1.139
   97    H2     A   9           H2         A   9  14.638  -1.968   1.821
   98   1H5*    U  10          1H5*        U  10   5.694  -8.047  -2.868
   99   2H5*    U  10          2H5*        U  10   7.006  -7.347  -3.807
  100    H4*    U  10           H4*        U  10   7.072  -5.409  -2.185
  101    H3*    U  10           H3*        U  10   4.774  -6.926  -0.923
  102    H2*    U  10           H2*        U  10   3.684  -4.935  -0.564
  103   2HO*    U  10          2HO*        U  10   4.772  -2.944  -0.237
  104    H1*    U  10           H1*        U  10   5.376  -3.527  -2.589
  105    H3     U  10           H3         U  10   1.192  -1.493  -2.619
  106    H5     U  10           H5         U  10   0.616  -5.299  -4.347
  107    H6     U  10           H6         U  10   2.864  -5.876  -3.747
  108   1H5*    A  11          1H5*        A  11   8.613  -7.527   1.874
  109   2H5*    A  11          2H5*        A  11   7.874  -7.893   3.447
  110    H4*    A  11           H4*        A  11  10.115  -7.176   3.880
  111    H3*    A  11           H3*        A  11   8.160  -4.906   4.439
  112    H2*    A  11           H2*        A  11  10.020  -3.677   5.295
  113   2HO*    A  11          2HO*        A  11  10.941  -5.503   6.428
  114    H1*    A  11           H1*        A  11  11.749  -4.392   3.267
  115    H8     A  11           H8         A  11   8.117  -3.839   2.175
  116   1H6     A  11          1H6         A  11   9.922   1.972   0.940
  117   2H6     A  11          2H6         A  11   8.719   0.753   0.562
  118    H2     A  11           H2         A  11  12.961   0.127   3.602
  119   1H5*    A  12          1H5*        A  12   9.056  -3.096   9.180
  120   2H5*    A  12          2H5*        A  12   7.419  -3.424   8.628
  121    H4*    A  12           H4*        A  12   9.655  -1.883   7.218
  122    H3*    A  12           H3*        A  12   6.777  -1.233   8.010
  123    H2*    A  12           H2*        A  12   6.853   0.471   6.372
  124   2HO*    A  12          2HO*        A  12   8.859   1.361   7.148
  125    H1*    A  12           H1*        A  12   8.781  -1.010   4.781
  126    H8     A  12           H8         A  12   5.876  -3.208   4.749
  127   1H6     A  12          1H6         A  12   3.831  -1.447   0.695
  128   2H6     A  12          2H6         A  12   4.003   0.059  -0.182
  129    H2     A  12           H2         A  12   6.993   2.529   2.025
  130   1H5*    A  13          1H5*        A  13   5.018   1.778   9.707
  131   2H5*    A  13          2H5*        A  13   5.246   0.793   8.247
  132    H4*    A  13           H4*        A  13   5.452   3.847   8.320
  133    H3*    A  13           H3*        A  13   3.151   2.008   7.577
  134    H2*    A  13           H2*        A  13   2.404   3.806   6.180
  135   2HO*    A  13          2HO*        A  13   3.403   5.832   6.203
  136    H1*    A  13           H1*        A  13   4.972   4.278   5.173
  137    H8     A  13           H8         A  13   4.187   0.585   5.660
  138   1H6     A  13          1H6         A  13   0.880   0.914   0.398
  139   2H6     A  13          2H6         A  13   1.583  -0.177   1.576
  140    H2     A  13           H2         A  13   1.958   5.064   1.623
  141   1H5*    A  14          1H5*        A  14   1.623   6.031   8.470
  142   2H5*    A  14          2H5*        A  14  -0.002   5.966   9.168
  143    H4*    A  14           H4*        A  14   0.231   7.351   7.067
  144    H3*    A  14           H3*        A  14  -1.692   4.995   7.014
  145    H2*    A  14           H2*        A  14  -2.439   5.924   4.871
  146   2HO*    A  14          2HO*        A  14  -2.036   8.176   5.734
  147    H1*    A  14           H1*        A  14   0.101   6.272   3.953
  148    H8     A  14           H8         A  14   0.468   2.977   5.722
  149   1H6     A  14          1H6         A  14  -2.281   0.583   0.689
  150   2H6     A  14          2H6         A  14  -1.277   0.226   2.079
  151    H2     A  14           H2         A  14  -3.191   4.980   0.866
  152   1H5*    G  15          1H5*        G  15  -3.921   8.436   5.254
  153   2H5*    G  15          2H5*        G  15  -5.496   8.413   6.045
  154    H4*    G  15           H4*        G  15  -5.826   8.394   3.655
  155    H3*    G  15           H3*        G  15  -6.315   5.652   4.865
  156    H2*    G  15           H2*        G  15  -7.475   5.165   2.919
  157   2HO*    G  15          2HO*        G  15  -7.775   6.721   1.259
  158    H1*    G  15           H1*        G  15  -5.418   6.183   1.354
  159    H8     G  15           H8         G  15  -4.220   4.414   4.454
  160    H1     G  15           H1         G  15  -6.422   0.387  -0.074
  161   1H2     G  15          1H2         G  15  -7.784   3.321  -1.437
  162   2H2     G  15          2H2         G  15  -7.640   1.580  -1.559
  163   1H5*    C  16          1H5*        C  16  -9.994   7.001   2.963
  164   2H5*    C  16          2H5*        C  16 -11.420   6.534   3.899
  165    H4*    C  16           H4*        C  16 -11.444   5.714   1.539
  166    H3*    C  16           H3*        C  16 -11.368   3.589   3.712
  167    H2*    C  16           H2*        C  16 -11.927   2.038   1.901
  168   2HO*    C  16          2HO*        C  16 -13.281   3.714   0.826
  169    H1*    C  16           H1*        C  16  -9.970   3.128   0.243
  170   1H4     C  16          1H4         C  16  -6.707  -0.722   4.589
  171   2H4     C  16          2H4         C  16  -7.279  -1.793   3.322
  172    H5     C  16           H5         C  16  -7.392   1.657   4.712
  173    H6     C  16           H6         C  16  -8.624   3.386   3.602
  174   1H5*    C  17          1H5*        C  17 -14.931   2.716   1.204
  175   2H5*    C  17          2H5*        C  17 -16.248   2.252   2.292
  176    H4*    C  17           H4*        C  17 -15.788   0.526   0.576
  177    H3*    C  17           H3*        C  17 -15.154  -0.292   3.451
  178    H2*    C  17           H2*        C  17 -14.948  -2.524   2.585
  179   2HO*    C  17          2HO*        C  17 -15.464  -2.951   0.390
  180    H1*    C  17           H1*        C  17 -13.532  -1.634   0.304
  181   1H4     C  17          1H4         C  17  -9.173  -2.154   5.338
  182   2H4     C  17          2H4         C  17  -9.175  -3.703   4.518
  183    H5     C  17           H5         C  17 -10.764  -0.343   4.757
  184    H6     C  17           H6         C  17 -12.554   0.280   3.279
  185    H3T    C  17           H3T        C  17 -17.412  -0.765   1.793
  Start of MODEL   18
    1   1H5*    G   1          1H5*        G   1  -4.404 -13.642   2.456
    2   2H5*    G   1          2H5*        G   1  -3.606 -13.303   0.909
    3    H4*    G   1           H4*        G   1  -6.050 -12.857   0.804
    4    H3*    G   1           H3*        G   1  -4.316 -10.356   0.681
    5    H2*    G   1           H2*        G   1  -6.338  -9.214   0.039
    6   2HO*    G   1          2HO*        G   1  -8.182 -10.290  -0.532
    7    H1*    G   1           H1*        G   1  -7.889 -10.644   1.901
    8    H8     G   1           H8         G   1  -4.678  -9.478   3.573
    9    H1     G   1           H1         G   1  -9.281  -4.972   3.196
   10   1H2     G   1          1H2         G   1 -10.740  -7.167   0.891
   11   2H2     G   1          2H2         G   1 -10.838  -5.622   1.712
   12    H5T    G   1           H5T        G   1  -3.717 -11.530   3.119
   13   1H5*    G   2          1H5*        G   2  -6.974 -10.714  -2.935
   14   2H5*    G   2          2H5*        G   2  -6.136 -10.000  -4.318
   15    H4*    G   2           H4*        G   2  -8.372  -8.974  -3.917
   16    H3*    G   2           H3*        G   2  -5.948  -7.186  -3.504
   17    H2*    G   2           H2*        G   2  -7.465  -5.386  -3.311
   18   2HO*    G   2          2HO*        G   2  -9.622  -5.528  -3.915
   19    H1*    G   2           H1*        G   2  -9.404  -6.836  -1.912
   20    H8     G   2           H8         G   2  -5.955  -7.334  -0.454
   21    H1     G   2           H1         G   2  -8.721  -1.786   1.301
   22   1H2     G   2          1H2         G   2 -10.906  -2.451  -1.357
   23   2H2     G   2          2H2         G   2 -10.404  -1.323  -0.111
   24   1H5*    C   3          1H5*        C   3  -8.553  -5.029  -6.409
   25   2H5*    C   3          2H5*        C   3  -7.470  -4.200  -7.537
   26    H4*    C   3           H4*        C   3  -8.920  -2.602  -6.304
   27    H3*    C   3           H3*        C   3  -5.947  -2.495  -5.671
   28    H2*    C   3           H2*        C   3  -6.367  -0.590  -4.387
   29   2HO*    C   3          2HO*        C   3  -7.726   0.458  -5.936
   30    H1*    C   3           H1*        C   3  -8.887  -1.494  -3.430
   31   1H4     C   3          1H4         C   3  -3.539  -3.047   0.365
   32   2H4     C   3          2H4         C   3  -4.315  -1.649   1.092
   33    H5     C   3           H5         C   3  -4.314  -3.978  -1.841
   34    H6     C   3           H6         C   3  -6.019  -3.816  -3.513
   35   1H5*    U   4          1H5*        U   4  -7.347   1.769  -7.316
   36   2H5*    U   4          2H5*        U   4  -5.922   2.330  -8.201
   37    H4*    U   4           H4*        U   4  -6.732   3.946  -6.508
   38    H3*    U   4           H3*        U   4  -3.956   2.795  -6.045
   39    H2*    U   4           H2*        U   4  -3.748   4.581  -4.358
   40   2HO*    U   4          2HO*        U   4  -6.269   5.482  -5.284
   41    H1*    U   4           H1*        U   4  -6.143   4.006  -3.262
   42    H3     U   4           H3         U   4  -3.121   2.343  -0.294
   43    H5     U   4           H5         U   4  -3.580  -0.692  -3.183
   44    H6     U   4           H6         U   4  -4.785   0.867  -4.551
   45   1H5*    U   5          1H5*        U   5  -3.603   7.137  -5.998
   46   2H5*    U   5          2H5*        U   5  -2.098   7.610  -6.800
   47    H4*    U   5           H4*        U   5  -2.241   8.510  -4.543
   48    H3*    U   5           H3*        U   5  -0.106   6.357  -4.854
   49    H2*    U   5           H2*        U   5   0.682   7.215  -2.671
   50   2HO*    U   5          2HO*        U   5  -1.345   9.164  -2.890
   51    H1*    U   5           H1*        U   5  -1.770   7.076  -1.610
   52    H3     U   5           H3         U   5   0.337   3.466   0.159
   53    H5     U   5           H5         U   5  -1.088   2.159  -3.592
   54    H6     U   5           H6         U   5  -1.689   4.409  -4.100
   55   1H5*    U   6          1H5*        U   6   1.975   9.713  -3.137
   56   2H5*    U   6          2H5*        U   6   3.556   9.870  -3.921
   57    H4*    U   6           H4*        U   6   3.809   9.560  -1.490
   58    H3*    U   6           H3*        U   6   4.626   7.118  -3.087
   59    H2*    U   6           H2*        U   6   5.683   6.373  -1.106
   60   2HO*    U   6          2HO*        U   6   5.634   7.540   0.822
   61    H1*    U   6           H1*        U   6   3.384   6.985   0.388
   62    H3     U   6           H3         U   6   4.348   2.446  -0.052
   63    H5     U   6           H5         U   6   1.934   3.458  -3.358
   64    H6     U   6           H6         U   6   2.113   5.770  -2.716
   65   1H5*    G   7          1H5*        G   7   9.591   7.631  -2.644
   66   2H5*    G   7          2H5*        G   7   8.065   6.884  -3.131
   67    H4*    G   7           H4*        G   7   9.688   6.214  -0.628
   68    H3*    G   7           H3*        G   7   9.050   4.814  -3.228
   69    H2*    G   7           H2*        G   7   9.281   2.660  -1.996
   70   2HO*    G   7          2HO*        G   7  10.968   3.434  -0.588
   71    H1*    G   7           H1*        G   7   7.501   3.478  -0.109
   72    H8     G   7           H8         G   7   6.322   5.427  -3.103
   73    H1     G   7           H1         G   7   5.262  -0.881  -3.834
   74   1H2     G   7          1H2         G   7   6.258  -2.016  -2.191
   75   2H2     G   7          2H2         G   7   7.137  -1.213  -0.907
   76   1H5*    G   8          1H5*        G   8  10.164   2.622  -5.717
   77   2H5*    G   8          2H5*        G   8   9.132   2.987  -4.341
   78    H4*    G   8           H4*        G   8   9.682   0.698  -3.412
   79    H3*    G   8           H3*        G   8  11.541   0.405  -5.314
   80    H2*    G   8           H2*        G   8  10.071   0.931  -7.182
   81   2HO*    G   8          2HO*        G   8   9.369  -1.087  -8.187
   82    H1*    G   8           H1*        G   8   7.917  -0.910  -6.062
   83    H8     G   8           H8         G   8   7.034   2.657  -6.216
   84    H1     G   8           H1         G   8   5.783  -0.369 -11.768
   85   1H2     G   8          1H2         G   8   7.753  -2.922 -10.390
   86   2H2     G   8          2H2         G   8   6.800  -2.385 -11.760
   87   1H5*    A   9          1H5*        A   9  12.106  -5.254  -4.735
   88   2H5*    A   9          2H5*        A   9  10.564  -5.649  -5.480
   89    H4*    A   9           H4*        A   9  10.162  -6.032  -3.229
   90    H3*    A   9           H3*        A   9   9.175  -3.216  -3.814
   91    H2*    A   9           H2*        A   9   8.280  -3.197  -1.633
   92   2HO*    A   9          2HO*        A   9   8.761  -6.003  -1.572
   93    H1*    A   9           H1*        A   9  10.468  -4.554  -0.485
   94    H8     A   9           H8         A   9   9.682  -1.318  -2.522
   95   1H6     A   9          1H6         A   9  13.882   1.413   1.112
   96   2H6     A   9          2H6         A   9  12.665   1.670  -0.126
   97    H2     A   9           H2         A   9  13.939  -2.946   2.037
   98   1H5*    U  10          1H5*        U  10   6.726  -7.046  -3.617
   99   2H5*    U  10          2H5*        U  10   5.322  -7.588  -4.520
  100    H4*    U  10           H4*        U  10   5.035  -5.866  -2.007
  101    H3*    U  10           H3*        U  10   5.121  -8.880  -2.359
  102    H2*    U  10           H2*        U  10   3.556  -9.016  -0.555
  103   2HO*    U  10          2HO*        U  10   4.657  -7.524   0.798
  104    H1*    U  10           H1*        U  10   2.202  -6.612  -1.346
  105    H3     U  10           H3         U  10  -1.193  -9.684  -1.863
  106    H5     U  10           H5         U  10   1.757 -11.005  -4.571
  107    H6     U  10           H6         U  10   3.211  -9.252  -3.780
  108   1H5*    A  11          1H5*        A  11   6.889  -8.108   2.667
  109   2H5*    A  11          2H5*        A  11   6.654  -6.754   1.543
  110    H4*    A  11           H4*        A  11   9.275  -7.348   3.014
  111    H3*    A  11           H3*        A  11   6.988  -5.403   3.485
  112    H2*    A  11           H2*        A  11   8.517  -3.856   4.326
  113   2HO*    A  11          2HO*        A  11  10.648  -4.423   4.921
  114    H1*    A  11           H1*        A  11  10.618  -4.586   2.537
  115    H8     A  11           H8         A  11   7.268  -3.920   0.893
  116   1H6     A  11          1H6         A  11   7.891   0.877   0.079
  117   2H6     A  11          2H6         A  11   9.007   2.045   0.757
  118    H2     A  11           H2         A  11  11.623  -0.083   3.658
  119   1H5*    A  12          1H5*        A  12   6.266  -3.887   8.099
  120   2H5*    A  12          2H5*        A  12   5.719  -3.515   6.460
  121    H4*    A  12           H4*        A  12   8.130  -2.338   7.910
  122    H3*    A  12           H3*        A  12   5.441  -1.335   6.924
  123    H2*    A  12           H2*        A  12   6.365   0.800   6.363
  124   2HO*    A  12          2HO*        A  12   7.788   0.824   8.254
  125    H1*    A  12           H1*        A  12   8.524  -0.215   5.035
  126    H8     A  12           H8         A  12   6.131  -2.975   4.300
  127   1H6     A  12          1H6         A  12   3.999   0.586  -0.294
  128   2H6     A  12          2H6         A  12   4.037  -1.030   0.380
  129    H2     A  12           H2         A  12   6.382   3.194   2.451
  130   1H5*    A  13          1H5*        A  13   6.356   2.196   9.062
  131   2H5*    A  13          2H5*        A  13   4.985   2.496  10.149
  132    H4*    A  13           H4*        A  13   5.235   4.383   8.643
  133    H3*    A  13           H3*        A  13   2.851   2.627   7.923
  134    H2*    A  13           H2*        A  13   2.213   4.379   6.464
  135   2HO*    A  13          2HO*        A  13   3.248   6.388   6.455
  136    H1*    A  13           H1*        A  13   4.806   4.784   5.504
  137    H8     A  13           H8         A  13   3.953   1.119   6.010
  138   1H6     A  13          1H6         A  13   1.003   1.402   0.541
  139   2H6     A  13          2H6         A  13   1.701   0.316   1.728
  140    H2     A  13           H2         A  13   1.835   5.564   1.890
  141   1H5*    A  14          1H5*        A  14   1.365   6.700   8.634
  142   2H5*    A  14          2H5*        A  14  -0.266   6.641   9.321
  143    H4*    A  14           H4*        A  14  -0.059   7.926   7.172
  144    H3*    A  14           H3*        A  14  -1.885   5.497   7.170
  145    H2*    A  14           H2*        A  14  -2.625   6.278   4.981
  146   2HO*    A  14          2HO*        A  14  -1.047   8.591   5.509
  147    H1*    A  14           H1*        A  14  -0.073   6.751   4.109
  148    H8     A  14           H8         A  14   0.316   3.503   5.984
  149   1H6     A  14          1H6         A  14  -2.159   0.910   0.914
  150   2H6     A  14          2H6         A  14  -1.190   0.615   2.343
  151    H2     A  14           H2         A  14  -3.206   5.273   0.942
  152   1H5*    G  15          1H5*        G  15  -4.173   8.784   5.277
  153   2H5*    G  15          2H5*        G  15  -5.781   8.735   5.997
  154    H4*    G  15           H4*        G  15  -6.015   8.653   3.604
  155    H3*    G  15           H3*        G  15  -6.468   5.916   4.838
  156    H2*    G  15           H2*        G  15  -7.548   5.375   2.852
  157   2HO*    G  15          2HO*        G  15  -8.408   7.666   2.564
  158    H1*    G  15           H1*        G  15  -5.456   6.399   1.355
  159    H8     G  15           H8         G  15  -4.343   4.774   4.558
  160    H1     G  15           H1         G  15  -6.215   0.514   0.105
  161   1H2     G  15          1H2         G  15  -7.658   3.335  -1.400
  162   2H2     G  15          2H2         G  15  -7.446   1.596  -1.448
  163   1H5*    C  16          1H5*        C  16 -10.209   6.943   2.793
  164   2H5*    C  16          2H5*        C  16 -11.589   6.409   3.759
  165    H4*    C  16           H4*        C  16 -11.524   5.462   1.446
  166    H3*    C  16           H3*        C  16 -11.304   3.476   3.738
  167    H2*    C  16           H2*        C  16 -11.726   1.789   2.011
  168   2HO*    C  16          2HO*        C  16 -13.185   3.311   0.836
  169    H1*    C  16           H1*        C  16  -9.837   2.930   0.309
  170   1H4     C  16          1H4         C  16  -6.428  -0.429   4.957
  171   2H4     C  16          2H4         C  16  -6.902  -1.609   3.747
  172    H5     C  16           H5         C  16  -7.244   1.913   4.900
  173    H6     C  16           H6         C  16  -8.536   3.492   3.643
  174   1H5*    C  17          1H5*        C  17 -14.776   2.244   1.224
  175   2H5*    C  17          2H5*        C  17 -16.065   1.715   2.315
  176    H4*    C  17           H4*        C  17 -15.453  -0.018   0.650
  177    H3*    C  17           H3*        C  17 -14.815  -0.710   3.558
  178    H2*    C  17           H2*        C  17 -14.437  -2.944   2.759
  179   2HO*    C  17          2HO*        C  17 -16.198  -3.038   1.312
  180    H1*    C  17           H1*        C  17 -13.054  -2.021   0.472
  181   1H4     C  17          1H4         C  17  -8.790  -2.111   5.624
  182   2H4     C  17          2H4         C  17  -8.642  -3.664   4.827
  183    H5     C  17           H5         C  17 -10.501  -0.440   4.971
  184    H6     C  17           H6         C  17 -12.289   0.021   3.433
  185    H3T    C  17           H3T        C  17 -17.022  -1.272   1.851
  Start of MODEL   19
    1   1H5*    G   1          1H5*        G   1  -6.517 -13.608   0.454
    2   2H5*    G   1          2H5*        G   1  -6.015 -12.602   1.828
    3    H4*    G   1           H4*        G   1  -8.823 -12.601   0.591
    4    H3*    G   1           H3*        G   1  -6.499 -10.652   0.347
    5    H2*    G   1           H2*        G   1  -8.144  -8.984  -0.104
    6   2HO*    G   1          2HO*        G   1 -10.197  -9.444  -0.719
    7    H1*    G   1           H1*        G   1 -10.004 -10.196   1.724
    8    H8     G   1           H8         G   1  -6.699  -9.531   3.446
    9    H1     G   1           H1         G   1 -10.548  -4.367   3.036
   10   1H2     G   1          1H2         G   1 -12.282  -6.300   0.684
   11   2H2     G   1          2H2         G   1 -12.161  -4.764   1.517
   12    H5T    G   1           H5T        G   1  -6.676 -14.703   2.446
   13   1H5*    G   2          1H5*        G   2  -9.350 -10.241  -3.162
   14   2H5*    G   2          2H5*        G   2  -8.417  -9.689  -4.559
   15    H4*    G   2           H4*        G   2 -10.318  -8.180  -4.028
   16    H3*    G   2           H3*        G   2  -7.547  -7.002  -3.601
   17    H2*    G   2           H2*        G   2  -8.639  -4.919  -3.344
   18   2HO*    G   2          2HO*        G   2 -10.757  -4.560  -3.946
   19    H1*    G   2           H1*        G   2 -10.862  -6.017  -1.992
   20    H8     G   2           H8         G   2  -7.569  -7.132  -0.491
   21    H1     G   2           H1         G   2  -9.367  -1.207   1.298
   22   1H2     G   2          1H2         G   2 -11.663  -1.497  -1.335
   23   2H2     G   2          2H2         G   2 -10.981  -0.472  -0.086
   24   1H5*    C   3          1H5*        C   3  -9.747  -4.328  -6.473
   25   2H5*    C   3          2H5*        C   3  -8.536  -3.642  -7.564
   26    H4*    C   3           H4*        C   3  -9.772  -1.888  -6.303
   27    H3*    C   3           H3*        C   3  -6.822  -2.189  -5.632
   28    H2*    C   3           H2*        C   3  -7.017  -0.220  -4.381
   29   2HO*    C   3          2HO*        C   3  -8.787   1.176  -4.528
   30    H1*    C   3           H1*        C   3  -9.638  -0.828  -3.449
   31   1H4     C   3          1H4         C   3  -4.470  -2.851   0.372
   32   2H4     C   3          2H4         C   3  -5.073  -1.355   1.065
   33    H5     C   3           H5         C   3  -5.396  -3.783  -1.765
   34    H6     C   3           H6         C   3  -7.066  -3.457  -3.461
   35   1H5*    U   4          1H5*        U   4  -7.773   2.064  -7.033
   36   2H5*    U   4          2H5*        U   4  -6.397   2.624  -7.992
   37    H4*    U   4           H4*        U   4  -7.017   4.205  -6.192
   38    H3*    U   4           H3*        U   4  -4.287   2.894  -5.911
   39    H2*    U   4           H2*        U   4  -3.907   4.604  -4.188
   40   2HO*    U   4          2HO*        U   4  -5.443   6.174  -3.778
   41    H1*    U   4           H1*        U   4  -6.292   4.130  -3.004
   42    H3     U   4           H3         U   4  -3.223   2.286  -0.199
   43    H5     U   4           H5         U   4  -4.013  -0.701  -3.070
   44    H6     U   4           H6         U   4  -5.196   0.931  -4.370
   45   1H5*    U   5          1H5*        U   5  -3.783   7.237  -5.709
   46   2H5*    U   5          2H5*        U   5  -2.306   7.686  -6.570
   47    H4*    U   5           H4*        U   5  -2.295   8.524  -4.279
   48    H3*    U   5           H3*        U   5  -0.263   6.301  -4.777
   49    H2*    U   5           H2*        U   5   0.691   7.102  -2.642
   50   2HO*    U   5          2HO*        U   5   0.100   9.353  -3.126
   51    H1*    U   5           H1*        U   5  -1.706   7.051  -1.428
   52    H3     U   5           H3         U   5   0.327   3.346   0.230
   53    H5     U   5           H5         U   5  -1.308   2.128  -3.469
   54    H6     U   5           H6         U   5  -1.845   4.400  -3.934
   55   1H5*    U   6          1H5*        U   6   2.080   9.637  -3.213
   56   2H5*    U   6          2H5*        U   6   3.613   9.692  -4.097
   57    H4*    U   6           H4*        U   6   3.933   9.398  -1.658
   58    H3*    U   6           H3*        U   6   4.741   7.014  -3.371
   59    H2*    U   6           H2*        U   6   5.774   6.196  -1.379
   60   2HO*    U   6          2HO*        U   6   6.561   8.330  -0.733
   61    H1*    U   6           H1*        U   6   3.612   6.955   0.265
   62    H3     U   6           H3         U   6   4.384   2.353   0.049
   63    H5     U   6           H5         U   6   1.816   3.258  -3.170
   64    H6     U   6           H6         U   6   2.081   5.593  -2.667
   65   1H5*    G   7          1H5*        G   7   8.357   7.358  -1.212
   66   2H5*    G   7          2H5*        G   7   9.686   7.026  -2.337
   67    H4*    G   7           H4*        G   7   9.538   5.343  -0.547
   68    H3*    G   7           H3*        G   7   8.838   4.262  -3.299
   69    H2*    G   7           H2*        G   7   8.935   2.039  -2.197
   70   2HO*    G   7          2HO*        G   7  10.642   2.500  -0.755
   71    H1*    G   7           H1*        G   7   7.211   2.830  -0.284
   72    H8     G   7           H8         G   7   6.168   4.924  -3.282
   73    H1     G   7           H1         G   7   4.703  -1.312  -3.929
   74   1H2     G   7          1H2         G   7   5.566  -2.466  -2.166
   75   2H2     G   7          2H2         G   7   6.505  -1.666  -0.930
   76   1H5*    G   8          1H5*        G   8  11.300   0.602  -4.680
   77   2H5*    G   8          2H5*        G   8  10.809   1.606  -6.058
   78    H4*    G   8           H4*        G   8   9.018   0.048  -4.123
   79    H3*    G   8           H3*        G   8  10.323  -0.986  -6.304
   80    H2*    G   8           H2*        G   8   9.414   0.813  -7.756
   81   2HO*    G   8          2HO*        G   8   9.051  -1.348  -8.660
   82    H1*    G   8           H1*        G   8   6.760   0.041  -6.427
   83    H8     G   8           H8         G   8   7.511   3.626  -6.382
   84    H1     G   8           H1         G   8   4.018   2.035 -11.566
   85   1H2     G   8          1H2         G   8   4.835  -1.251 -10.646
   86   2H2     G   8          2H2         G   8   3.986  -0.216 -11.779
   87   1H5*    A   9          1H5*        A   9   9.778  -5.742  -5.553
   88   2H5*    A   9          2H5*        A   9   8.056  -5.957  -5.938
   89    H4*    A   9           H4*        A   9   8.691  -7.164  -3.923
   90    H3*    A   9           H3*        A   9   6.427  -5.483  -4.165
   91    H2*    A   9           H2*        A   9   7.162  -3.684  -3.129
   92   2HO*    A   9          2HO*        A   9   6.290  -5.290  -0.995
   93    H1*    A   9           H1*        A   9   8.733  -5.240  -1.037
   94    H8     A   9           H8         A   9   8.476  -2.062  -3.223
   95   1H6     A   9          1H6         A   9  13.271   0.094   0.070
   96   2H6     A   9          2H6         A   9  12.065   0.508  -1.133
   97    H2     A   9           H2         A   9  12.729  -4.195   1.131
   98   1H5*    U  10          1H5*        U  10   7.662  -9.439  -0.688
   99   2H5*    U  10          2H5*        U  10   8.315  -7.854  -1.147
  100    H4*    U  10           H4*        U  10   9.633 -10.554  -1.656
  101    H3*    U  10           H3*        U  10  10.323  -8.108   0.036
  102    H2*    U  10           H2*        U  10  12.588  -8.721  -0.167
  103   2HO*    U  10          2HO*        U  10  11.613 -11.328  -0.693
  104    H1*    U  10           H1*        U  10  12.058 -10.044  -2.742
  105    H3     U  10           H3         U  10  15.311  -7.293  -4.456
  106    H5     U  10           H5         U  10  12.845  -4.633  -2.314
  107    H6     U  10           H6         U  10  11.524  -6.528  -1.574
  108   1H5*    A  11          1H5*        A  11   7.586  -8.486   3.703
  109   2H5*    A  11          2H5*        A  11   8.114  -8.240   2.044
  110    H4*    A  11           H4*        A  11  10.047  -7.257   4.120
  111    H3*    A  11           H3*        A  11   7.330  -5.941   3.814
  112    H2*    A  11           H2*        A  11   8.491  -3.959   4.492
  113   2HO*    A  11          2HO*        A  11  10.657  -4.036   5.219
  114    H1*    A  11           H1*        A  11  10.797  -4.706   2.939
  115    H8     A  11           H8         A  11   7.447  -4.743   1.096
  116   1H6     A  11          1H6         A  11   7.489   0.010  -0.263
  117   2H6     A  11          2H6         A  11   8.516   1.333   0.250
  118    H2     A  11           H2         A  11  11.392  -0.133   3.253
  119   1H5*    A  12          1H5*        A  12   8.904  -4.210   7.424
  120   2H5*    A  12          2H5*        A  12   7.568  -3.907   8.543
  121    H4*    A  12           H4*        A  12   8.794  -1.849   7.912
  122    H3*    A  12           H3*        A  12   5.911  -2.006   6.970
  123    H2*    A  12           H2*        A  12   6.153   0.350   6.393
  124   2HO*    A  12          2HO*        A  12   8.677   0.193   7.695
  125    H1*    A  12           H1*        A  12   8.596  -0.063   5.150
  126    H8     A  12           H8         A  12   6.336  -3.081   4.465
  127   1H6     A  12          1H6         A  12   3.869   0.341  -0.091
  128   2H6     A  12          2H6         A  12   3.977  -1.268   0.598
  129    H2     A  12           H2         A  12   6.412   3.024   2.401
  130   1H5*    A  13          1H5*        A  13   6.379   1.752   9.193
  131   2H5*    A  13          2H5*        A  13   4.934   2.003  10.185
  132    H4*    A  13           H4*        A  13   5.342   3.916   8.688
  133    H3*    A  13           H3*        A  13   2.890   2.256   7.985
  134    H2*    A  13           H2*        A  13   2.314   4.048   6.529
  135   2HO*    A  13          2HO*        A  13   3.432   6.008   6.521
  136    H1*    A  13           H1*        A  13   4.928   4.350   5.568
  137    H8     A  13           H8         A  13   3.887   0.718   6.004
  138   1H6     A  13          1H6         A  13   0.913   1.264   0.571
  139   2H6     A  13          2H6         A  13   1.548   0.123   1.742
  140    H2     A  13           H2         A  13   2.029   5.348   1.956
  141   1H5*    A  14          1H5*        A  14   1.635   6.409   8.689
  142   2H5*    A  14          2H5*        A  14   0.011   6.454   9.390
  143    H4*    A  14           H4*        A  14   0.271   7.707   7.213
  144    H3*    A  14           H3*        A  14  -1.695   5.389   7.284
  145    H2*    A  14           H2*        A  14  -2.435   6.191   5.112
  146   2HO*    A  14          2HO*        A  14  -1.610   8.102   4.242
  147    H1*    A  14           H1*        A  14   0.142   6.550   4.194
  148    H8     A  14           H8         A  14   0.409   3.252   5.970
  149   1H6     A  14          1H6         A  14  -2.365   0.890   0.943
  150   2H6     A  14          2H6         A  14  -1.367   0.522   2.335
  151    H2     A  14           H2         A  14  -3.178   5.308   1.085
  152   1H5*    G  15          1H5*        G  15  -3.795   8.881   5.470
  153   2H5*    G  15          2H5*        G  15  -5.390   8.924   6.221
  154    H4*    G  15           H4*        G  15  -5.665   8.899   3.819
  155    H3*    G  15           H3*        G  15  -6.296   6.196   5.049
  156    H2*    G  15           H2*        G  15  -7.429   5.724   3.090
  157   2HO*    G  15          2HO*        G  15  -7.621   7.261   1.394
  158    H1*    G  15           H1*        G  15  -5.294   6.612   1.558
  159    H8     G  15           H8         G  15  -4.248   4.892   4.738
  160    H1     G  15           H1         G  15  -6.494   0.816   0.283
  161   1H2     G  15          1H2         G  15  -7.770   3.749  -1.159
  162   2H2     G  15          2H2         G  15  -7.674   2.001  -1.234
  163   1H5*    C  16          1H5*        C  16  -9.865   7.656   3.040
  164   2H5*    C  16          2H5*        C  16 -11.330   7.271   3.952
  165    H4*    C  16           H4*        C  16 -11.341   6.410   1.608
  166    H3*    C  16           H3*        C  16 -11.408   4.323   3.818
  167    H2*    C  16           H2*        C  16 -12.004   2.768   2.020
  168   2HO*    C  16          2HO*        C  16 -13.246   4.509   0.893
  169    H1*    C  16           H1*        C  16  -9.965   3.739   0.386
  170   1H4     C  16          1H4         C  16  -6.971  -0.186   4.858
  171   2H4     C  16          2H4         C  16  -7.568  -1.252   3.599
  172    H5     C  16           H5         C  16  -7.541   2.224   4.926
  173    H6     C  16           H6         C  16  -8.671   3.989   3.765
  174   1H5*    C  17          1H5*        C  17 -14.941   3.573   1.231
  175   2H5*    C  17          2H5*        C  17 -16.310   3.218   2.295
  176    H4*    C  17           H4*        C  17 -15.944   1.423   0.647
  177    H3*    C  17           H3*        C  17 -15.342   0.629   3.538
  178    H2*    C  17           H2*        C  17 -15.291  -1.627   2.710
  179   2HO*    C  17          2HO*        C  17 -17.097  -1.338   1.265
  180    H1*    C  17           H1*        C  17 -13.822  -0.869   0.415
  181   1H4     C  17          1H4         C  17  -9.517  -1.542   5.485
  182   2H4     C  17          2H4         C  17  -9.596  -3.099   4.685
  183    H5     C  17           H5         C  17 -11.013   0.340   4.872
  184    H6     C  17           H6         C  17 -12.756   1.037   3.372
  185    H3T    C  17           H3T        C  17 -17.462   1.394   3.115
  Start of MODEL   20
    1   1H5*    G   1          1H5*        G   1  -5.516 -12.927   0.421
    2   2H5*    G   1          2H5*        G   1  -6.736 -14.191   0.671
    3    H4*    G   1           H4*        G   1  -8.311 -12.971  -0.841
    4    H3*    G   1           H3*        G   1  -6.085 -10.891  -0.841
    5    H2*    G   1           H2*        G   1  -7.817  -9.272  -1.200
    6   2HO*    G   1          2HO*        G   1  -9.841  -9.801  -1.859
    7    H1*    G   1           H1*        G   1  -9.619 -10.662   0.520
    8    H8     G   1           H8         G   1  -6.258 -10.140   2.221
    9    H1     G   1           H1         G   1 -10.194  -5.031   2.469
   10   1H2     G   1          1H2         G   1 -11.980  -6.744  -0.009
   11   2H2     G   1          2H2         G   1 -11.851  -5.299   0.974
   12    H5T    G   1           H5T        G   1  -5.193 -14.693  -0.964
   13   1H5*    G   2          1H5*        G   2  -8.893 -10.277  -4.343
   14   2H5*    G   2          2H5*        G   2  -7.970  -9.558  -5.668
   15    H4*    G   2           H4*        G   2  -9.948  -8.193  -5.043
   16    H3*    G   2           H3*        G   2  -7.244  -6.931  -4.452
   17    H2*    G   2           H2*        G   2  -8.444  -4.928  -4.044
   18   2HO*    G   2          2HO*        G   2 -10.575  -4.634  -4.639
   19    H1*    G   2           H1*        G   2 -10.608  -6.238  -2.802
   20    H8     G   2           H8         G   2  -7.258  -7.371  -1.434
   21    H1     G   2           H1         G   2  -9.260  -1.728   0.951
   22   1H2     G   2          1H2         G   2 -11.590  -1.855  -1.666
   23   2H2     G   2          2H2         G   2 -10.927  -0.932  -0.330
   24   1H5*    C   3          1H5*        C   3  -9.565  -4.176  -7.163
   25   2H5*    C   3          2H5*        C   3  -8.388  -3.338  -8.184
   26    H4*    C   3           H4*        C   3  -9.767  -1.763  -6.844
   27    H3*    C   3           H3*        C   3  -6.811  -1.891  -6.141
   28    H2*    C   3           H2*        C   3  -7.168  -0.034  -4.752
   29   2HO*    C   3          2HO*        C   3  -9.646   0.306  -6.117
   30    H1*    C   3           H1*        C   3  -9.747  -0.879  -3.914
   31   1H4     C   3          1H4         C   3  -4.479  -2.815  -0.187
   32   2H4     C   3          2H4         C   3  -5.184  -1.425   0.617
   33    H5     C   3           H5         C   3  -5.337  -3.664  -2.374
   34    H6     C   3           H6         C   3  -7.002  -3.325  -4.071
   35   1H5*    U   4          1H5*        U   4  -7.985   2.387  -7.254
   36   2H5*    U   4          2H5*        U   4  -6.634   3.076  -8.165
   37    H4*    U   4           H4*        U   4  -7.321   4.504  -6.278
   38    H3*    U   4           H3*        U   4  -4.552   3.276  -6.006
   39    H2*    U   4           H2*        U   4  -4.285   4.920  -4.190
   40   2HO*    U   4          2HO*        U   4  -5.932   6.366  -3.719
   41    H1*    U   4           H1*        U   4  -6.660   4.226  -3.073
   42    H3     U   4           H3         U   4  -3.438   2.347  -0.429
   43    H5     U   4           H5         U   4  -4.115  -0.452  -3.510
   44    H6     U   4           H6         U   4  -5.411   1.200  -4.662
   45   1H5*    U   5          1H5*        U   5  -4.138   7.561  -5.552
   46   2H5*    U   5          2H5*        U   5  -2.664   8.109  -6.363
   47    H4*    U   5           H4*        U   5  -2.727   8.794  -4.027
   48    H3*    U   5           H3*        U   5  -0.596   6.699  -4.629
   49    H2*    U   5           H2*        U   5   0.282   7.367  -2.400
   50   2HO*    U   5          2HO*        U   5  -1.773   9.297  -2.362
   51    H1*    U   5           H1*        U   5  -2.110   7.068  -1.268
   52    H3     U   5           H3         U   5   0.290   3.379  -0.072
   53    H5     U   5           H5         U   5  -1.569   2.394  -3.735
   54    H6     U   5           H6         U   5  -2.227   4.658  -3.968
   55   1H5*    U   6          1H5*        U   6   1.746   9.463  -2.650
   56   2H5*    U   6          2H5*        U   6   3.267   9.706  -3.527
   57    H4*    U   6           H4*        U   6   3.701   8.779  -1.304
   58    H3*    U   6           H3*        U   6   4.120   6.775  -3.554
   59    H2*    U   6           H2*        U   6   5.135   5.328  -2.003
   60   2HO*    U   6          2HO*        U   6   5.175   7.559  -0.274
   61    H1*    U   6           H1*        U   6   3.103   5.707  -0.153
   62    H3     U   6           H3         U   6   3.062   1.520  -2.248
   63    H5     U   6           H5         U   6   0.929   4.094  -4.809
   64    H6     U   6           H6         U   6   1.432   5.910  -3.310
   65   1H5*    G   7          1H5*        G   7   9.125   7.266  -3.247
   66   2H5*    G   7          2H5*        G   7   7.640   6.322  -3.472
   67    H4*    G   7           H4*        G   7   9.792   5.812  -1.362
   68    H3*    G   7           H3*        G   7   8.901   4.373  -3.885
   69    H2*    G   7           H2*        G   7   9.690   2.310  -2.840
   70   2HO*    G   7          2HO*        G   7  10.731   2.355  -0.856
   71    H1*    G   7           H1*        G   7   8.385   2.861  -0.488
   72    H8     G   7           H8         G   7   6.319   4.292  -3.354
   73    H1     G   7           H1         G   7   5.561  -2.055  -2.584
   74   1H2     G   7          1H2         G   7   7.150  -2.852  -1.286
   75   2H2     G   7          2H2         G   7   8.326  -1.829  -0.483
   76   1H5*    G   8          1H5*        G   8  12.315   1.678  -6.196
   77   2H5*    G   8          2H5*        G   8  10.631   2.095  -6.558
   78    H4*    G   8           H4*        G   8  11.581   0.143  -4.449
   79    H3*    G   8           H3*        G   8  11.600  -0.496  -6.952
   80    H2*    G   8           H2*        G   8   9.463   0.391  -7.600
   81   2HO*    G   8          2HO*        G   8   7.849  -1.308  -7.662
   82    H1*    G   8           H1*        G   8   8.106  -0.764  -5.141
   83    H8     G   8           H8         G   8   8.594   2.864  -5.731
   84    H1     G   8           H1         G   8   2.704   0.717  -7.185
   85   1H2     G   8          1H2         G   8   2.711  -1.539  -7.089
   86   2H2     G   8          2H2         G   8   4.170  -2.432  -6.705
   87   1H5*    A   9          1H5*        A   9  11.581  -6.022  -6.132
   88   2H5*    A   9          2H5*        A   9   9.846  -6.291  -6.075
   89    H4*    A   9           H4*        A   9  10.777  -6.451  -3.845
   90    H3*    A   9           H3*        A   9   9.081  -3.966  -4.257
   91    H2*    A   9           H2*        A   9   9.269  -3.615  -1.937
   92   2HO*    A   9          2HO*        A   9   9.806  -6.390  -1.749
   93    H1*    A   9           H1*        A   9  11.836  -5.010  -1.796
   94    H8     A   9           H8         A   9  10.606  -1.644  -3.462
   95   1H6     A   9          1H6         A   9  13.097   1.367  -0.567
   96   2H6     A   9          2H6         A   9  14.309   1.103   0.674
   97    H2     A   9           H2         A   9  14.852  -3.296   1.103
   98   1H5*    U  10          1H5*        U  10   4.671  -7.373  -1.392
   99   2H5*    U  10          2H5*        U  10   4.371  -5.734  -1.970
  100    H4*    U  10           H4*        U  10   6.304  -4.987  -0.422
  101    H3*    U  10           H3*        U  10   5.827  -7.776   0.719
  102    H2*    U  10           H2*        U  10   6.614  -6.824   2.760
  103   2HO*    U  10          2HO*        U  10   8.452  -5.792   1.777
  104    H1*    U  10           H1*        U  10   5.503  -4.223   1.942
  105    H3     U  10           H3         U  10   3.504  -4.618   6.056
  106    H5     U  10           H5         U  10   2.300  -8.123   4.035
  107    H6     U  10           H6         U  10   3.687  -7.464   2.167
  108   1H5*    A  11          1H5*        A  11  11.562  -8.137   1.350
  109   2H5*    A  11          2H5*        A  11  10.650  -8.529   2.822
  110    H4*    A  11           H4*        A  11  12.463  -6.980   3.354
  111    H3*    A  11           H3*        A  11   9.718  -5.665   3.404
  112    H2*    A  11           H2*        A  11  10.773  -3.802   4.390
  113   2HO*    A  11          2HO*        A  11  12.076  -5.078   5.862
  114    H1*    A  11           H1*        A  11  13.080  -3.992   2.762
  115    H8     A  11           H8         A  11   9.819  -4.383   0.906
  116   1H6     A  11          1H6         A  11   8.864   0.372   0.119
  117   2H6     A  11          2H6         A  11   9.529   1.824   0.847
  118    H2     A  11           H2         A  11  12.763   0.632   3.637
  119   1H5*    A  12          1H5*        A  12   7.452  -4.247   6.966
  120   2H5*    A  12          2H5*        A  12   7.554  -4.206   5.193
  121    H4*    A  12           H4*        A  12   9.170  -2.320   6.958
  122    H3*    A  12           H3*        A  12   6.376  -2.023   5.816
  123    H2*    A  12           H2*        A  12   6.825   0.364   5.674
  124   2HO*    A  12          2HO*        A  12   9.258  -0.233   7.025
  125    H1*    A  12           H1*        A  12   9.257  -0.031   4.451
  126    H8     A  12           H8         A  12   7.253  -2.865   3.068
  127   1H6     A  12          1H6         A  12   4.230   1.298  -0.417
  128   2H6     A  12          2H6         A  12   4.467  -0.421  -0.135
  129    H2     A  12           H2         A  12   6.777   3.531   2.443
  130   1H5*    A  13          1H5*        A  13   6.723   1.254   8.431
  131   2H5*    A  13          2H5*        A  13   5.297   1.356   9.476
  132    H4*    A  13           H4*        A  13   5.619   3.444   8.226
  133    H3*    A  13           H3*        A  13   3.212   1.788   7.374
  134    H2*    A  13           H2*        A  13   2.554   3.635   6.079
  135   2HO*    A  13          2HO*        A  13   4.569   5.125   7.449
  136    H1*    A  13           H1*        A  13   5.115   4.193   5.118
  137    H8     A  13           H8         A  13   4.405   0.499   5.246
  138   1H6     A  13          1H6         A  13   0.912   1.247   0.145
  139   2H6     A  13          2H6         A  13   1.723   0.061   1.153
  140    H2     A  13           H2         A  13   1.863   5.271   1.793
  141   1H5*    A  14          1H5*        A  14   1.815   5.799   8.528
  142   2H5*    A  14          2H5*        A  14   0.220   5.703   9.290
  143    H4*    A  14           H4*        A  14   0.355   7.186   7.253
  144    H3*    A  14           H3*        A  14  -1.550   4.817   7.153
  145    H2*    A  14           H2*        A  14  -2.394   5.850   5.101
  146   2HO*    A  14          2HO*        A  14  -1.986   8.055   6.079
  147    H1*    A  14           H1*        A  14   0.118   6.311   4.112
  148    H8     A  14           H8         A  14   0.602   2.911   5.606
  149   1H6     A  14          1H6         A  14  -2.327   0.820   0.549
  150   2H6     A  14          2H6         A  14  -1.245   0.390   1.858
  151    H2     A  14           H2         A  14  -3.331   5.164   1.087
  152   1H5*    G  15          1H5*        G  15  -3.900   8.338   5.715
  153   2H5*    G  15          2H5*        G  15  -5.444   8.230   6.559
  154    H4*    G  15           H4*        G  15  -5.849   8.355   4.185
  155    H3*    G  15           H3*        G  15  -6.275   5.548   5.256
  156    H2*    G  15           H2*        G  15  -7.472   5.123   3.326
  157   2HO*    G  15          2HO*        G  15  -7.181   7.902   2.683
  158    H1*    G  15           H1*        G  15  -5.483   6.224   1.747
  159    H8     G  15           H8         G  15  -4.162   4.415   4.769
  160    H1     G  15           H1         G  15  -6.396   0.436   0.218
  161   1H2     G  15          1H2         G  15  -7.879   3.359  -1.025
  162   2H2     G  15          2H2         G  15  -7.695   1.625  -1.190
  163   1H5*    C  16          1H5*        C  16 -10.021   6.927   3.500
  164   2H5*    C  16          2H5*        C  16 -11.407   6.412   4.467
  165    H4*    C  16           H4*        C  16 -11.525   5.694   2.078
  166    H3*    C  16           H3*        C  16 -11.334   3.475   4.145
  167    H2*    C  16           H2*        C  16 -11.968   2.005   2.309
  168   2HO*    C  16          2HO*        C  16 -12.462   2.844   0.276
  169    H1*    C  16           H1*        C  16 -10.123   3.216   0.585
  170   1H4     C  16          1H4         C  16  -6.725  -0.954   4.533
  171   2H4     C  16          2H4         C  16  -7.362  -1.933   3.223
  172    H5     C  16           H5         C  16  -7.352   1.426   4.825
  173    H6     C  16           H6         C  16  -8.602   3.243   3.877
  174   1H5*    C  17          1H5*        C  17 -14.942   2.906   1.704
  175   2H5*    C  17          2H5*        C  17 -16.275   2.347   2.727
  176    H4*    C  17           H4*        C  17 -15.854   0.829   0.810
  177    H3*    C  17           H3*        C  17 -15.250  -0.346   3.565
  178    H2*    C  17           H2*        C  17 -15.086  -2.461   2.440
  179   2HO*    C  17          2HO*        C  17 -15.604  -2.615   0.210
  180    H1*    C  17           H1*        C  17 -13.645  -1.336   0.282
  181   1H4     C  17          1H4         C  17  -9.238  -2.505   5.149
  182   2H4     C  17          2H4         C  17  -9.267  -3.942   4.147
  183    H5     C  17           H5         C  17 -10.838  -0.637   4.838
  184    H6     C  17           H6         C  17 -12.648   0.174   3.481
  185    H3T    C  17           H3T        C  17 -17.510  -0.558   1.855
  Start of MODEL   21
    1   1H5*    G   1          1H5*        G   1  -4.388 -12.914   0.716
    2   2H5*    G   1          2H5*        G   1  -4.463 -11.800   2.097
    3    H4*    G   1           H4*        G   1  -6.897 -12.827   0.545
    4    H3*    G   1           H3*        G   1  -5.361 -10.207   0.408
    5    H2*    G   1           H2*        G   1  -7.455  -9.176  -0.267
    6   2HO*    G   1          2HO*        G   1  -8.462 -11.835  -0.423
    7    H1*    G   1           H1*        G   1  -8.903 -10.495   1.673
    8    H8     G   1           H8         G   1  -5.569  -9.537   3.233
    9    H1     G   1           H1         G   1  -9.915  -4.772   3.052
   10   1H2     G   1          1H2         G   1 -11.560  -6.847   0.761
   11   2H2     G   1          2H2         G   1 -11.547  -5.310   1.603
   12    H5T    G   1           H5T        G   1  -4.386 -13.997   2.723
   13   1H5*    G   2          1H5*        G   2  -7.981 -10.521  -3.155
   14   2H5*    G   2          2H5*        G   2  -7.123  -9.845  -4.546
   15    H4*    G   2           H4*        G   2  -9.299  -8.723  -4.169
   16    H3*    G   2           H3*        G   2  -6.811  -7.035  -3.696
   17    H2*    G   2           H2*        G   2  -8.265  -5.177  -3.492
   18   2HO*    G   2          2HO*        G   2  -9.613  -6.051  -5.347
   19    H1*    G   2           H1*        G   2 -10.247  -6.534  -2.091
   20    H8     G   2           H8         G   2  -6.814  -7.314  -0.734
   21    H1     G   2           H1         G   2  -9.119  -1.626   1.224
   22   1H2     G   2          1H2         G   2 -11.429  -2.080  -1.371
   23   2H2     G   2          2H2         G   2 -10.808  -1.015  -0.124
   24   1H5*    C   3          1H5*        C   3  -9.252  -4.632  -6.632
   25   2H5*    C   3          2H5*        C   3  -8.059  -3.851  -7.679
   26    H4*    C   3           H4*        C   3  -9.460  -2.214  -6.422
   27    H3*    C   3           H3*        C   3  -6.499  -2.305  -5.742
   28    H2*    C   3           H2*        C   3  -6.833  -0.401  -4.428
   29   2HO*    C   3          2HO*        C   3  -9.333  -0.100  -5.764
   30    H1*    C   3           H1*        C   3  -9.406  -1.190  -3.520
   31   1H4     C   3          1H4         C   3  -4.078  -2.975   0.207
   32   2H4     C   3          2H4         C   3  -4.765  -1.535   0.938
   33    H5     C   3           H5         C   3  -4.983  -3.931  -1.926
   34    H6     C   3           H6         C   3  -6.693  -3.666  -3.602
   35   1H5*    U   4          1H5*        U   4  -7.711   1.916  -7.049
   36   2H5*    U   4          2H5*        U   4  -6.381   2.559  -8.022
   37    H4*    U   4           H4*        U   4  -7.041   4.088  -6.200
   38    H3*    U   4           H3*        U   4  -4.258   2.888  -5.941
   39    H2*    U   4           H2*        U   4  -3.946   4.589  -4.201
   40   2HO*    U   4          2HO*        U   4  -5.550   6.086  -3.761
   41    H1*    U   4           H1*        U   4  -6.308   3.999  -3.013
   42    H3     U   4           H3         U   4  -3.138   2.254  -0.254
   43    H5     U   4           H5         U   4  -3.822  -0.728  -3.155
   44    H6     U   4           H6         U   4  -5.090   0.866  -4.423
   45   1H5*    U   5          1H5*        U   5  -3.960   7.257  -5.683
   46   2H5*    U   5          2H5*        U   5  -2.503   7.786  -6.529
   47    H4*    U   5           H4*        U   5  -2.558   8.606  -4.232
   48    H3*    U   5           H3*        U   5  -0.398   6.509  -4.731
   49    H2*    U   5           H2*        U   5   0.499   7.364  -2.581
   50   2HO*    U   5          2HO*        U   5  -0.250   9.572  -3.067
   51    H1*    U   5           H1*        U   5  -1.892   7.136  -1.384
   52    H3     U   5           H3         U   5   0.366   3.536   0.216
   53    H5     U   5           H5         U   5  -1.228   2.271  -3.483
   54    H6     U   5           H6         U   5  -1.881   4.518  -3.925
   55   1H5*    U   6          1H5*        U   6   1.719   9.941  -3.096
   56   2H5*    U   6          2H5*        U   6   3.215  10.147  -4.019
   57    H4*    U   6           H4*        U   6   3.662   9.856  -1.619
   58    H3*    U   6           H3*        U   6   4.546   7.534  -3.380
   59    H2*    U   6           H2*        U   6   5.728   6.751  -1.467
   60   2HO*    U   6          2HO*        U   6   5.163   9.269  -0.280
   61    H1*    U   6           H1*        U   6   3.612   7.367   0.300
   62    H3     U   6           H3         U   6   4.575   2.810  -0.029
   63    H5     U   6           H5         U   6   1.798   3.651  -3.089
   64    H6     U   6           H6         U   6   2.010   5.983  -2.585
   65   1H5*    G   7          1H5*        G   7   8.178   8.123  -1.489
   66   2H5*    G   7          2H5*        G   7   9.477   8.033  -2.693
   67    H4*    G   7           H4*        G   7   9.667   6.233  -1.027
   68    H3*    G   7           H3*        G   7   8.914   5.295  -3.821
   69    H2*    G   7           H2*        G   7   9.234   3.035  -2.960
   70   2HO*    G   7          2HO*        G   7  11.085   3.521  -1.687
   71    H1*    G   7           H1*        G   7   7.790   3.499  -0.680
   72    H8     G   7           H8         G   7   6.037   5.486  -3.391
   73    H1     G   7           H1         G   7   5.016  -0.859  -3.831
   74   1H2     G   7          1H2         G   7   7.582  -1.091  -1.462
   75   2H2     G   7          2H2         G   7   6.481  -1.956  -2.510
   76   1H5*    G   8          1H5*        G   8  12.696   2.107  -5.345
   77   2H5*    G   8          2H5*        G   8  11.074   2.444  -5.975
   78    H4*    G   8           H4*        G   8  11.754   0.617  -3.650
   79    H3*    G   8           H3*        G   8  12.164  -0.104  -6.105
   80    H2*    G   8           H2*        G   8  10.148   0.663  -7.120
   81   2HO*    G   8          2HO*        G   8   9.437  -1.968  -6.342
   82    H1*    G   8           H1*        G   8   8.380  -0.342  -4.876
   83    H8     G   8           H8         G   8   8.939   3.289  -5.270
   84    H1     G   8           H1         G   8   3.781   1.106  -8.445
   85   1H2     G   8          1H2         G   8   3.776  -1.153  -8.365
   86   2H2     G   8          2H2         G   8   5.062  -2.041  -7.569
   87   1H5*    A   9          1H5*        A   9  11.912  -5.646  -5.296
   88   2H5*    A   9          2H5*        A   9  10.197  -5.841  -5.626
   89    H4*    A   9           H4*        A   9  10.650  -6.083  -3.234
   90    H3*    A   9           H3*        A   9   9.072  -3.611  -4.004
   91    H2*    A   9           H2*        A   9   8.789  -3.171  -1.731
   92   2HO*    A   9          2HO*        A   9   9.250  -5.950  -1.302
   93    H1*    A   9           H1*        A   9  11.214  -4.657  -1.000
   94    H8     A   9           H8         A   9  10.535  -1.188  -2.843
   95   1H6     A   9          1H6         A   9  13.038   1.555   0.281
   96   2H6     A   9          2H6         A   9  13.981   1.190   1.714
   97    H2     A   9           H2         A   9  13.667  -3.192   2.444
   98   1H5*    U  10          1H5*        U  10   6.613  -7.968  -3.848
   99   2H5*    U  10          2H5*        U  10   4.938  -7.412  -4.020
  100    H4*    U  10           H4*        U  10   4.603  -8.141  -1.551
  101    H3*    U  10           H3*        U  10   7.142  -9.679  -2.275
  102    H2*    U  10           H2*        U  10   6.298 -11.436  -0.884
  103   2HO*    U  10          2HO*        U  10   5.632 -10.133   0.859
  104    H1*    U  10           H1*        U  10   3.600 -10.945  -1.721
  105    H3     U  10           H3         U  10   4.374 -15.234  -3.220
  106    H5     U  10           H5         U  10   7.061 -12.886  -5.469
  107    H6     U  10           H6         U  10   6.387 -10.962  -4.187
  108   1H5*    A  11          1H5*        A  11   7.679  -8.044   2.994
  109   2H5*    A  11          2H5*        A  11   7.133  -6.881   1.764
  110    H4*    A  11           H4*        A  11   9.730  -6.703   3.387
  111    H3*    A  11           H3*        A  11   7.128  -5.126   3.449
  112    H2*    A  11           H2*        A  11   8.380  -3.304   4.207
  113   2HO*    A  11          2HO*        A  11  10.501  -3.501   5.020
  114    H1*    A  11           H1*        A  11  10.723  -4.056   2.704
  115    H8     A  11           H8         A  11   7.543  -3.633   0.672
  116   1H6     A  11          1H6         A  11   9.291   2.301   0.143
  117   2H6     A  11          2H6         A  11   8.257   1.057  -0.531
  118    H2     A  11           H2         A  11  11.438   0.545   3.625
  119   1H5*    A  12          1H5*        A  12   8.893  -3.858   7.221
  120   2H5*    A  12          2H5*        A  12   7.548  -3.586   8.334
  121    H4*    A  12           H4*        A  12   8.831  -1.522   7.838
  122    H3*    A  12           H3*        A  12   5.952  -1.569   6.874
  123    H2*    A  12           H2*        A  12   6.244   0.801   6.380
  124   2HO*    A  12          2HO*        A  12   8.750   0.547   7.699
  125    H1*    A  12           H1*        A  12   8.676   0.408   5.138
  126    H8     A  12           H8         A  12   6.235  -2.514   4.464
  127   1H6     A  12          1H6         A  12   4.363   0.811  -0.416
  128   2H6     A  12          2H6         A  12   4.331  -0.765   0.350
  129    H2     A  12           H2         A  12   6.897   3.458   2.134
  130   1H5*    A  13          1H5*        A  13   6.414   2.122   9.163
  131   2H5*    A  13          2H5*        A  13   4.963   2.344  10.152
  132    H4*    A  13           H4*        A  13   5.325   4.276   8.680
  133    H3*    A  13           H3*        A  13   2.934   2.552   7.922
  134    H2*    A  13           H2*        A  13   2.326   4.330   6.468
  135   2HO*    A  13          2HO*        A  13   3.385   6.326   6.491
  136    H1*    A  13           H1*        A  13   4.942   4.729   5.552
  137    H8     A  13           H8         A  13   4.022   1.060   5.952
  138   1H6     A  13          1H6         A  13   1.158   1.506   0.459
  139   2H6     A  13          2H6         A  13   1.826   0.389   1.634
  140    H2     A  13           H2         A  13   2.054   5.629   1.893
  141   1H5*    A  14          1H5*        A  14   1.497   6.623   8.615
  142   2H5*    A  14          2H5*        A  14  -0.123   6.591   9.329
  143    H4*    A  14           H4*        A  14   0.042   7.842   7.146
  144    H3*    A  14           H3*        A  14  -1.768   5.400   7.234
  145    H2*    A  14           H2*        A  14  -2.567   6.134   5.064
  146   2HO*    A  14          2HO*        A  14  -1.892   8.095   4.182
  147    H1*    A  14           H1*        A  14  -0.022   6.685   4.137
  148    H8     A  14           H8         A  14   0.500   3.400   5.873
  149   1H6     A  14          1H6         A  14  -2.172   0.892   0.859
  150   2H6     A  14          2H6         A  14  -1.132   0.581   2.235
  151    H2     A  14           H2         A  14  -3.274   5.246   1.047
  152   1H5*    G  15          1H5*        G  15  -4.104   8.756   5.428
  153   2H5*    G  15          2H5*        G  15  -5.693   8.692   6.188
  154    H4*    G  15           H4*        G  15  -5.976   8.655   3.786
  155    H3*    G  15           H3*        G  15  -6.433   5.918   5.018
  156    H2*    G  15           H2*        G  15  -7.540   5.376   3.061
  157   2HO*    G  15          2HO*        G  15  -7.844   6.901   1.371
  158    H1*    G  15           H1*        G  15  -5.478   6.412   1.518
  159    H8     G  15           H8         G  15  -4.295   4.736   4.670
  160    H1     G  15           H1         G  15  -6.330   0.562   0.203
  161   1H2     G  15          1H2         G  15  -7.791   3.421  -1.209
  162   2H2     G  15          2H2         G  15  -7.588   1.684  -1.300
  163   1H5*    C  16          1H5*        C  16 -10.099   7.153   3.020
  164   2H5*    C  16          2H5*        C  16 -11.529   6.682   3.946
  165    H4*    C  16           H4*        C  16 -11.513   5.818   1.603
  166    H3*    C  16           H3*        C  16 -11.428   3.736   3.817
  167    H2*    C  16           H2*        C  16 -11.946   2.143   2.031
  168   2HO*    C  16          2HO*        C  16 -13.318   3.767   0.912
  169    H1*    C  16           H1*        C  16  -9.992   3.233   0.368
  170   1H4     C  16          1H4         C  16  -6.671  -0.480   4.783
  171   2H4     C  16          2H4         C  16  -7.222  -1.584   3.534
  172    H5     C  16           H5         C  16  -7.405   1.885   4.867
  173    H6     C  16           H6         C  16  -8.671   3.571   3.728
  174   1H5*    C  17          1H5*        C  17 -14.978   2.789   1.290
  175   2H5*    C  17          2H5*        C  17 -16.293   2.324   2.380
  176    H4*    C  17           H4*        C  17 -15.811   0.578   0.689
  177    H3*    C  17           H3*        C  17 -15.167  -0.189   3.575
  178    H2*    C  17           H2*        C  17 -14.926  -2.427   2.751
  179   2HO*    C  17          2HO*        C  17 -15.421  -2.905   0.559
  180    H1*    C  17           H1*        C  17 -13.526  -1.553   0.449
  181   1H4     C  17          1H4         C  17  -9.151  -1.945   5.481
  182   2H4     C  17          2H4         C  17  -9.123  -3.499   4.673
  183    H5     C  17           H5         C  17 -10.782  -0.173   4.893
  184    H6     C  17           H6         C  17 -12.586   0.405   3.412
  185    H3T    C  17           H3T        C  17 -17.255  -1.146   3.365