*HEADER    DNA                                     14-MAR-14   2MMF              
*TITLE     SOLUTION STRUCTURE OF AGA MODIFIED                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DNA_(5'-D(*CP*TP*AP*AP*(FAG)P*AP*TP*TP*CP*A)-3');          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MOL_ID: 2;                                                           
*COMPND   6 MOLECULE: DNA_(5'-D(*TP*GP*AP*AP*TP*CP*TP*TP*AP*G)-3');              
*COMPND   7 CHAIN: B;                                                            
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 MOL_ID: 2;                                                           
*SOURCE   4 SYNTHETIC: YES                                                       
*KEYWDS    AFLATOXIN B1, FAPY, FORMAMIDOPYRIMIDINE, INTERCALATION, DNA DUPLEX,   
*KEYWDS   2 DNA ADDUCT, SEQUENCE DEPENDENCE, DNA                                 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    1                                                                     
*AUTHOR    L.LI, M.STONE                                                         
*REVDAT   1   25-FEB-15 2MMF    0                                                


#
#   1 DC5   H2'1  1 DC5 H3'     1.660   2.380
 &rst
  ixpk= 0, nxpk= 0, iat=  26,  24, r1= 1.16, r2= 1.66, r3= 2.38, r4= 2.88, 
      rk2=32.0, rk3=32.0, ir6=1, ialtd=0,
 &end
#
#   1 DC5   H2'2  1 DC5 H3'     2.090   2.850
 &rst
  ixpk= 0, nxpk= 0, iat=  27,  24, r1= 1.59, r2= 2.09, r3= 2.85, r4= 3.35,  &end
#
#   1 DC5   H1'   1 DC5 H3'     2.990   3.870
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  24, r1= 2.49, r2= 2.99, r3= 3.87, r4= 4.37,  &end
#
#   1 DC5   H1'   1 DC5 H2'1    2.440   3.030
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  26, r1= 1.94, r2= 2.44, r3= 3.03, r4= 3.53,  &end
#
#   1 DC5   H5    1 DC5 H3'     6.190   6.590
 &rst
  ixpk= 0, nxpk= 0, iat=  15,  24, r1= 5.69, r2= 6.19, r3= 6.59, r4= 7.09,  &end
#
#   1 DC5   H5    1 DC5 H2'1    4.060   4.500
 &rst
  ixpk= 0, nxpk= 0, iat=  15,  26, r1= 3.56, r2= 4.06, r3= 4.50, r4= 5.00,  &end
#
#   1 DC5   H5    1 DC5 H2'2    5.260   5.700
 &rst
  ixpk= 0, nxpk= 0, iat=  15,  27, r1= 4.76, r2= 5.26, r3= 5.70, r4= 6.20,  &end
#
#   1 DC5   H6    1 DC5 H3'     3.440   4.280
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  24, r1= 2.94, r2= 3.44, r3= 4.28, r4= 4.78,  &end
#
#   1 DC5   H6    1 DC5 H2'1    1.670   2.340
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  26, r1= 1.17, r2= 1.67, r3= 2.34, r4= 2.84,  &end
#
#   1 DC5   H6    1 DC5 H2'2    3.160   3.820
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  27, r1= 2.66, r2= 3.16, r3= 3.82, r4= 4.32,  &end
#
#   1 DC5   H6    1 DC5 H1'     3.160   3.790
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  10, r1= 2.66, r2= 3.16, r3= 3.79, r4= 4.29,  &end
#
#   2 DT    H3   20 DG3 H1      3.100   3.510  
 &rst
  ixpk= 0, nxpk= 0, iat=  52, 661, r1= 2.60, r2= 3.10, r3= 3.51, r4= 4.01,  &end
#
#   2 DT    Q5    1 DC5 H2'1    2.500   3.510
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  26, r1= 2.00, r2= 2.50, r3= 4.22, r4= 4.72,
 igr1=  46,  47,  48,
 &end
#
#   2 DT    Q5    1 DC5 H2'2    2.610   3.590
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  27, r1= 2.11, r2= 2.61, r3= 4.31, r4= 4.81,
 igr1=  46,  47,  48,
 &end
#
#   2 DT    Q5    1 DC5 H1'     2.960   4.530
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  10, r1= 2.46, r2= 2.96, r3= 5.44, r4= 5.94,
 igr1=  46,  47,  48,
 &end
#
#   2 DT    Q5    1 DC5 H5      1.570   2.930
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  15, r1= 1.07, r2= 1.57, r3= 3.52, r4= 4.02,
 igr1=  46,  47,  48,
 &end
#
#   2 DT    Q5    1 DC5 H6      2.010   3.060
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  13, r1= 1.51, r2= 2.01, r3= 3.67, r4= 4.17,
 igr1=  46,  47,  48,
 &end
#
#   2 DT    H6    1 DC5 H1'     3.980   4.180
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  10, r1= 3.48, r2= 3.98, r3= 4.18, r4= 4.68,  &end
#
#   2 DT    H6    1 DC5 H2'2    2.500   2.710
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  27, r1= 2.00, r2= 2.50, r3= 2.71, r4= 3.21,  &end
#
#   2 DT    H6    1 DC5 H2'1    3.810   4.290  
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  26, r1= 3.31, r2= 3.81, r3= 4.29, r4= 4.79,  &end
#
#   2 DT    H6    1 DC5 H3'     4.980   5.280
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  24, r1= 4.48, r2= 4.98, r3= 5.28, r4= 5.78,  &end
#
#   2 DT    H6    1 DC5 H6      5.000   5.320
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  13, r1= 4.50, r2= 5.00, r3= 5.32, r4= 5.82,  &end
#
#   2 DT    Q5    2 DT  H3'     3.250   6.510
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  56, r1= 2.75, r2= 3.25, r3= 7.82, r4= 8.32,
 igr1=  46,  47,  48,
 &end
#
#   2 DT    Q5    2 DT  H1'     3.800   5.670
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  40, r1= 3.30, r2= 3.80, r3= 6.81, r4= 7.31,
 igr1=  46,  47,  48,
 &end
#
#   2 DT    H2'2  2 DT  H3'     2.290   2.950
 &rst
  ixpk= 0, nxpk= 0, iat=  59,  56, r1= 1.79, r2= 2.29, r3= 2.95, r4= 3.45,  &end
#
#   2 DT    H1'   2 DT  H3'     3.590   4.010
 &rst
  ixpk= 0, nxpk= 0, iat=  40,  56, r1= 3.09, r2= 3.59, r3= 4.01, r4= 4.51,  &end
#
#   2 DT    H1'   2 DT  H2'1    2.510   3.080
 &rst
  ixpk= 0, nxpk= 0, iat=  40,  58, r1= 2.01, r2= 2.51, r3= 3.08, r4= 3.58,  &end
#
#   2 DT    H1'   2 DT  H2'2    1.870   2.490
 &rst
  ixpk= 0, nxpk= 0, iat=  40,  59, r1= 1.37, r2= 1.87, r3= 2.49, r4= 2.99,  &end
#
#   2 DT    H6    2 DT  H1'     3.540   3.960
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  40, r1= 3.04, r2= 3.54, r3= 3.96, r4= 4.46,  &end
#
#   3 DA    H61   2 DT  H3      3.570   3.720
 &rst
  ixpk= 0, nxpk= 0, iat=  80,  52, r1= 3.07, r2= 3.57, r3= 3.72, r4= 4.22,  &end
#
#   3 DA    H62   2 DT  H3      4.270   4.520  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  52, r1= 3.77, r2= 4.27, r3= 4.52, r4= 5.02,  &end
#
#   3 DA    H2    2 DT  H3      3.770   4.220
 &rst
  ixpk= 0, nxpk= 0, iat=  84,  52, r1= 3.27, r2= 3.77, r3= 4.22, r4= 4.72,  &end
#
#   3 DA    H61  18 DT  H3      2.370   2.620
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 600, r1= 1.87, r2= 2.37, r3= 2.62, r4= 3.12,  &end
#
#   3 DA    H62  18 DT  H3      3.770   4.120
 &rst
  ixpk= 0, nxpk= 0, iat=  81, 600, r1= 3.27, r2= 3.77, r3= 4.12, r4= 4.62,  &end
#
#   3 DA    H2   19 DA  H2      2.570   3.020
 &rst
  ixpk= 0, nxpk= 0, iat=  84, 632, r1= 2.07, r2= 2.57, r3= 3.02, r4= 3.52,  &end
#
#   3 DA    H8    2 DT  H3'     4.970   5.220
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  56, r1= 4.47, r2= 4.97, r3= 5.22, r4= 5.72,  &end
#
#   3 DA    H8    2 DT  H2'1    4.400   4.660
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  58, r1= 3.90, r2= 4.40, r3= 4.66, r4= 5.16,  &end
#
#   3 DA    H8    2 DT  H2'2    2.650   3.060
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  59, r1= 2.15, r2= 2.65, r3= 3.06, r4= 3.56,  &end
#
#   3 DA    H8    2 DT  H1'     3.640   3.950
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  40, r1= 3.14, r2= 3.64, r3= 3.95, r4= 4.45,  &end
#
#   3 DA    H1'   3 DA  H2'2    2.260   2.960
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  91, r1= 1.76, r2= 2.26, r3= 2.96, r4= 3.46,  &end
#
#   3 DA    H1'   3 DA  H2'1    3.070   3.850
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  90, r1= 2.57, r2= 3.07, r3= 3.85, r4= 4.35,  &end
#
#   3 DA    H8    3 DA  H1'     3.710   4.120
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  72, r1= 3.21, r2= 3.71, r3= 4.12, r4= 4.62,  &end
#
#   3 DA    H8    3 DA  H2'2    3.310   4.320
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  91, r1= 2.81, r2= 3.31, r3= 4.32, r4= 4.82,  &end
#
#   4 DA    H2    3 DA  H2      4.470   4.820  
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  84, r1= 3.97, r2= 4.47, r3= 4.82, r4= 5.32,  &end
#
#   4 DA    H2   18 DT  H3      4.270   4.420
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 600, r1= 3.77, r2= 4.27, r3= 4.42, r4= 4.92,  &end
#
#   4 DA    H61  18 DT  H3      4.870   5.120
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 600, r1= 4.37, r2= 4.87, r3= 5.12, r4= 5.62,  &end
#
#   4 DA    H62  18 DT  H3      5.770   6.120
 &rst
  ixpk= 0, nxpk= 0, iat= 113, 600, r1= 5.27, r2= 5.77, r3= 6.12, r4= 6.62,  &end
#
#   4 DA    H2   17 DT  H3      2.370   2.620
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 568, r1= 1.87, r2= 2.37, r3= 2.62, r4= 3.12,  &end
#
#   4 DA    H61  17 DT  H3      2.770   3.020
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 568, r1= 2.27, r2= 2.77, r3= 3.02, r4= 3.52,  &end
#
#   4 DA    H62  17 DT  H3      4.170   4.620
 &rst
  ixpk= 0, nxpk= 0, iat= 113, 568, r1= 3.67, r2= 4.17, r3= 4.62, r4= 5.12,  &end
#
#   4 DA    H1'   3 DA  H1'     5.410   5.610
 &rst
  ixpk= 0, nxpk= 0, iat= 104,  72, r1= 4.91, r2= 5.41, r3= 5.61, r4= 6.11,  &end
#
#   4 DA    H8    3 DA  H2'1    3.820   4.010
 &rst
  ixpk= 0, nxpk= 0, iat= 107,  90, r1= 3.32, r2= 3.82, r3= 4.01, r4= 4.51,  &end
#
#   4 DA    H8    3 DA  H2'2    2.420   2.610
 &rst
  ixpk= 0, nxpk= 0, iat= 107,  91, r1= 1.92, r2= 2.42, r3= 2.61, r4= 3.11,  &end
#
#   4 DA    H8    3 DA  H1'     3.860   4.060
 &rst
  ixpk= 0, nxpk= 0, iat= 107,  72, r1= 3.36, r2= 3.86, r3= 4.06, r4= 4.56,  &end
#
#   4 DA    H8    3 DA  H8      4.670   4.980
 &rst
  ixpk= 0, nxpk= 0, iat= 107,  75, r1= 4.17, r2= 4.67, r3= 4.98, r4= 5.48,  &end
#
#   4 DA    H1'   4 DA  H3'     3.580   4.240
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 120, r1= 3.08, r2= 3.58, r3= 4.24, r4= 4.74,  &end
#
#   4 DA    H1'   4 DA  H2'1    2.700   3.090
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 122, r1= 2.20, r2= 2.70, r3= 3.09, r4= 3.59,  &end
#
#   4 DA    H1'   4 DA  H2'2    2.040   2.500
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 123, r1= 1.54, r2= 2.04, r3= 2.50, r4= 3.00,  &end
#
#   4 DA    H8    4 DA  H2'1    1.800   2.290
 &rst
  ixpk= 0, nxpk= 0, iat= 107, 122, r1= 1.30, r2= 1.80, r3= 2.29, r4= 2.79,  &end
#
#   4 DA    H8    4 DA  H2'2    3.340   3.500    
 &rst
  ixpk= 0, nxpk= 0, iat= 107, 123, r1= 2.84, r2= 3.34, r3= 3.50, r4= 4.00,  &end
#
#   4 DA    H8    4 DA  H1'     3.160   3.740
 &rst
  ixpk= 0, nxpk= 0, iat= 107, 104, r1= 2.66, r2= 3.16, r3= 3.74, r4= 4.24,  &end
#
#   5 FAG   H9A   4 DA  H8      3.150   3.670
 &rst
  ixpk= 0, nxpk= 0, iat= 161, 107, r1= 2.65, r2= 3.15, r3= 3.67, r4= 4.17,  &end
#
#   5 FAG   H6A   4 DA  H3'     4.070   4.620
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 120, r1= 3.57, r2= 4.07, r3= 4.62, r4= 5.12,  &end
#
#   5 FAG   H6A   4 DA  H2'1    2.370   3.840
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 122, r1= 1.87, r2= 2.37, r3= 3.84, r4= 4.34,  &end
#
#   5 FAG   H6A   4 DA  H2'2    1.870   2.240
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 123, r1= 1.37, r2= 1.87, r3= 2.24, r4= 2.74,  &end
#
#   5 FAG   H6A   4 DA  H1'     2.340   3.160
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 104, r1= 1.84, r2= 2.34, r3= 3.16, r4= 3.66,  &end
#
#   5 FAG   H6A   4 DA  H8      2.310   2.890
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 107, r1= 1.81, r2= 2.31, r3= 2.89, r4= 3.39,  &end
#
#   5 FAG   H5    4 DA  H2'1    5.450   5.860
 &rst
  ixpk= 0, nxpk= 0, iat= 185, 122, r1= 4.95, r2= 5.45, r3= 5.86, r4= 6.36,  &end
#
#   5 FAG   H5    4 DA  H2'2    4.420   4.830
 &rst
  ixpk= 0, nxpk= 0, iat= 185, 123, r1= 3.92, r2= 4.42, r3= 4.83, r4= 5.33,  &end
#
#   5 FAG   H5    4 DA  H1'     3.070   3.480
 &rst
  ixpk= 0, nxpk= 0, iat= 185, 104, r1= 2.57, r2= 3.07, r3= 3.48, r4= 3.98,  &end
#
#   5 FAG   H5    4 DA  H8      5.070   6.200
 &rst
  ixpk= 0, nxpk= 0, iat= 185, 107, r1= 4.57, r2= 5.07, r3= 6.20, r4= 6.70,  &end
#
#   5 FAG   MA   17 DT  H3      2.500   5.500
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 568, r1= 2.00, r2= 2.50, r3= 6.61, r4= 7.11,
 igr1= 181, 182, 183,
 &end
#
#   5 FAG   MA 4 DA  H2      2.000   3.000  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 116, r1= 1.50, r2= 2.00, r3= 3.60, r4= 4.10,
 igr1= 181, 182, 183,
 &end
#
#     5 FAG  H2'1   5 FAG   H1'  3.000   3.500         
 &rst
  ixpk= 0, nxpk= 0, iat= 194, 136, r1= 2.50, r2= 3.00, r3= 3.50, r4= 4.00,  &end
#
#     5 FAG  H2'2   5 FAG   H1'  2.400   2.800         
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 136, r1= 1.90, r2= 2.40, r3= 2.80, r4= 3.30,  &end
#
#     5 FAG  H3'    5 FAG   H1'  3.700   4.100         
 &rst
  ixpk= 0, nxpk= 0, iat= 192, 136, r1= 3.20, r2= 3.70, r3= 4.10, r4= 4.60,  &end
#
#     5 FAG  H3'    5 FAG   H2'1   2.500   2.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 192, 194, r1= 2.00, r2= 2.50, r3= 2.90, r4= 3.40,  &end
#
#     5 FAG  H3'    5 FAG   H2'2   2.700   3.100         
 &rst
  ixpk= 0, nxpk= 0, iat= 192, 195, r1= 2.20, r2= 2.70, r3= 3.10, r4= 3.60,  &end
#
#     5 FAG  H8     5 FAG   H8A  1.800   2.400                               
 &rst
  ixpk= 0, nxpk= 0, iat= 152, 155, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#     5 FAG  H9A    5 FAG   H8A  3.600   4.000         
 &rst
  ixpk= 0, nxpk= 0, iat= 161, 155, r1= 3.10, r2= 3.60, r3= 4.00, r4= 4.50,  &end
#
#     5 FAG  H9A    5 FAG   H8   5.200   6.800         
 &rst
  ixpk= 0, nxpk= 0, iat= 161, 152, r1= 4.70, r2= 5.20, r3= 6.80, r4= 7.30,  &end
#
#     5 FAG  H9A    5 FAG   H9  2.500   2.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 161, 159, r1= 2.00, r2= 2.50, r3= 2.90, r4= 3.40,  &end
#
#     5 FAG  H6A    5 FAG   H8A  3.400   3.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 155, r1= 2.90, r2= 3.40, r3= 3.90, r4= 4.40,  &end
#
#     5 FAG  H6A    5 FAG   H9  3.800   4.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 159, r1= 3.30, r2= 3.80, r3= 4.20, r4= 4.70,  &end
#
#     5 FAG  H6A    5 FAG   H9A  2.300   2.600  
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 161, r1= 1.80, r2= 2.30, r3= 2.60, r4= 3.10,  &end
#
#     5 FAG  H6A    5 FAG   H8   5.000   5.700       
 &rst
  ixpk= 0, nxpk= 0, iat= 189, 152, r1= 4.50, r2= 5.00, r3= 5.70, r4= 6.20,  &end
#
#     5 FAG  H5     5 FAG   H1'  4.680   5.530 
 &rst
  ixpk= 0, nxpk= 0, iat= 185, 136, r1= 4.18, r2= 4.68, r3= 5.53, r4= 6.03,  &end
#
#     5 FAG  H8    5 FAG   HN9    3.050   5.720
 &rst
  ixpk= 0, nxpk= 0, iat= 152, 138, r1= 2.55, r2= 3.05, r3= 5.72, r4= 6.22,  &end
#
#     5 FAG  H2'1   5 FAG   HN9    2.040   3.780
 &rst
  ixpk= 0, nxpk= 0, iat= 194, 138, r1= 1.54, r2= 2.04, r3= 3.78, r4= 4.28,  &end
#
#     5 FAG  H2'2   5 FAG   HN9    1.900   3.460
 &rst
  ixpk= 0, nxpk= 0, iat= 195, 138, r1= 1.40, r2= 1.90, r3= 3.46, r4= 3.96,  &end
#
#     5 FAG  H8     6 DA    H8     3.170   5.230    
 &rst
  ixpk= 0, nxpk= 0, iat= 152, 211, r1= 2.67, r2= 3.17, r3= 5.23, r4= 5.73,  &end
#
#     6 DA   H8     5 FAG   H1'  2.900   3.500         
 &rst
  ixpk= 0, nxpk= 0, iat= 211, 136, r1= 2.40, r2= 2.90, r3= 3.50, r4= 4.00,  &end
#
#     6 DA   H8     5 FAG   H2'1   4.600   5.000         
 &rst
  ixpk= 0, nxpk= 0, iat= 211, 194, r1= 4.10, r2= 4.60, r3= 5.00, r4= 5.50,  &end
#
#     6 DA   H8     5 FAG   H2'2   2.900   3.500         
 &rst
  ixpk= 0, nxpk= 0, iat= 211, 195, r1= 2.40, r2= 2.90, r3= 3.50, r4= 4.00,  &end
#
#     6 DA   H8     5 FAG   H3'  5.200   5.900    
 &rst
  ixpk= 0, nxpk= 0, iat= 211, 192, r1= 4.70, r2= 5.20, r3= 5.90, r4= 6.40,  &end
#
#     6 DA   H1'    6 DA    H3'  3.700   4.100         
 &rst
  ixpk= 0, nxpk= 0, iat= 208, 224, r1= 3.20, r2= 3.70, r3= 4.10, r4= 4.60,  &end
#
#     6 DA   H1'    6 DA    H2'1   2.800   3.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 208, 226, r1= 2.30, r2= 2.80, r3= 3.20, r4= 3.70,  &end
#
#     6 DA   H1'    6 DA    H2'2   2.100   2.500                  
 &rst
  ixpk= 0, nxpk= 0, iat= 208, 227, r1= 1.60, r2= 2.10, r3= 2.50, r4= 3.00,  &end
#
#     6 DA   H8     6 DA    H1'  3.700   4.100            
 &rst
  ixpk= 0, nxpk= 0, iat= 211, 208, r1= 3.20, r2= 3.70, r3= 4.10, r4= 4.60,  &end
#
#   7 DT    H2'1  7 DT  H3'     2.200   2.820
 &rst
  ixpk= 0, nxpk= 0, iat= 258, 256, r1= 1.70, r2= 2.20, r3= 2.82, r4= 3.32,  &end
#
#   7 DT    H2'2  7 DT  H3'     2.470   3.090
 &rst
  ixpk= 0, nxpk= 0, iat= 259, 256, r1= 1.97, r2= 2.47, r3= 3.09, r4= 3.59,  &end
#
#   7 DT    H1'   7 DT  H2'1    2.780   3.220
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 258, r1= 2.28, r2= 2.78, r3= 3.22, r4= 3.72,  &end
#
#   7 DT    H1'   7 DT  H2'2    2.020   2.520
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 259, r1= 1.52, r2= 2.02, r3= 2.52, r4= 3.02,  &end
#
#   7 DT    H6    7 DT  H2'1    1.710   2.250
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 258, r1= 1.21, r2= 1.71, r3= 2.25, r4= 2.75,  &end
#
#   7 DT    H6    7 DT  H2'2    3.220   3.730
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 259, r1= 2.72, r2= 3.22, r3= 3.73, r4= 4.23,  &end
#
#   8 DT    H6    7 DT  H2'1    3.650   4.120
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 258, r1= 3.15, r2= 3.65, r3= 4.12, r4= 4.62,  &end
#
#   8 DT    H6    7 DT  H2'2    2.180   2.660
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 259, r1= 1.68, r2= 2.18, r3= 2.66, r4= 3.16,  &end
#
#   8 DT    H6    7 DT  H1'     2.800   3.290
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 240, r1= 2.30, r2= 2.80, r3= 3.29, r4= 3.79,  &end
#
#   8 DT    H6    7 DT  H6      4.810   5.390  
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 243, r1= 4.31, r2= 4.81, r3= 5.39, r4= 5.89,  &end
#
#   8 DT    Q5 7 DT  H3'     2.380   4.510         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 256, r1= 1.88, r2= 2.38, r3= 5.42, r4= 5.92,
 igr1= 278, 279, 280,
 &end
#
#   8 DT    Q5 7 DT  H2'1    2.170   3.000         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 258, r1= 1.67, r2= 2.17, r3= 3.60, r4= 4.10,
 igr1= 278, 279, 280,
 &end
#
#   8 DT    Q5 7 DT  H2'2    2.130   3.040         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 259, r1= 1.63, r2= 2.13, r3= 3.65, r4= 4.15,
 igr1= 278, 279, 280,
 &end
#
#   8 DT    Q5 7 DT  H1'     2.910   4.410
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 240, r1= 2.41, r2= 2.91, r3= 5.30, r4= 5.80,
 igr1= 278, 279, 280,
 &end
#
#   8 DT    Q5 7 DT  H6      2.520   3.470  
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 243, r1= 2.02, r2= 2.52, r3= 4.17, r4= 4.67,
 igr1= 278, 279, 280,
 &end
#
#   8 DT    H3'   7 DT  H1'     4.610   5.490
 &rst
  ixpk= 0, nxpk= 0, iat= 288, 240, r1= 4.11, r2= 4.61, r3= 5.49, r4= 5.99,  &end
#
#   8 DT    H2'1  8 DT  H3'     2.500   3.230
 &rst
  ixpk= 0, nxpk= 0, iat= 290, 288, r1= 2.00, r2= 2.50, r3= 3.23, r4= 3.73,  &end
#
#   8 DT    H2'2  8 DT  H3'     2.400   3.060
 &rst
  ixpk= 0, nxpk= 0, iat= 291, 288, r1= 1.90, r2= 2.40, r3= 3.06, r4= 3.56,  &end
#
#   8 DT    H1'   8 DT  H3'     3.500   5.100
 &rst
  ixpk= 0, nxpk= 0, iat= 272, 288, r1= 3.00, r2= 3.50, r3= 5.10, r4= 5.60,  &end
#
#   8 DT    H1'   8 DT  H2'1    2.720   3.200
 &rst
  ixpk= 0, nxpk= 0, iat= 272, 290, r1= 2.22, r2= 2.72, r3= 3.20, r4= 3.70,  &end
#
#   8 DT    Q5    8 DT  H3'     3.050   5.940
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 288, r1= 2.55, r2= 3.05, r3= 7.13, r4= 7.63,
 igr1= 278, 279, 280,
 &end
#
#   8 DT    Q5    8 DT  H1'     3.190   5.960
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 272, r1= 2.69, r2= 3.19, r3= 7.16, r4= 7.66,
 igr1= 278, 279, 280,
 &end
#
#   8 DT    H6    8 DT  H2'1    2.000   2.880
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 290, r1= 1.50, r2= 2.00, r3= 2.88, r4= 3.38,  &end
#
#   8 DT    H6    8 DT  H2'2    3.770   4.280
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 291, r1= 3.27, r2= 3.77, r3= 4.28, r4= 4.78,  &end
#
#   8 DT    H6    8 DT  H1'     3.530   4.220
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 272, r1= 3.03, r2= 3.53, r3= 4.22, r4= 4.72,  &end
#
#   9 DC    H6 8 DT  H2'1    3.600   4.310    
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 290, r1= 3.10, r2= 3.60, r3= 4.31, r4= 4.81,  &end
#
#   9 DC    H6 8 DT  H2'2    2.200   2.840  
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 291, r1= 1.70, r2= 2.20, r3= 2.84, r4= 3.34,  &end
#
#   9 DC    H6 8 DT  H1'     2.830   3.390    
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 272, r1= 2.33, r2= 2.83, r3= 3.39, r4= 3.89,  &end
#
#   9 DC    H6 8 DT  H6      4.900   5.300    
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 275, r1= 4.40, r2= 4.90, r3= 5.30, r4= 5.80,  &end
#
#   9 DC    H5 8 DT  H3'     5.000   5.500    
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 288, r1= 4.50, r2= 5.00, r3= 5.50, r4= 6.00,  &end
#
#   9 DC    H5 8 DT  H2'2    2.410   3.360    
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 291, r1= 1.91, r2= 2.41, r3= 3.36, r4= 3.86,  &end
#
#   9 DC    H5 8 DT  H1'     3.320   4.050 
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 272, r1= 2.82, r2= 3.32, r3= 4.05, r4= 4.55,  &end
#
#   9 DC    H5 8 DT  Q5      2.810   3.900    
 &rst
  ixpk= 0, nxpk= 0, iat= 309,  -1, r1= 2.31, r2= 2.81, r3= 4.68, r4= 5.18,
 igr2= 278, 279, 280,
 &end
#
#   9 DC    H5 8 DT  H6      3.590   4.080
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 275, r1= 3.09, r2= 3.59, r3= 4.08, r4= 4.58,  &end
#
#   9 DC    H1'   9 DC  H3'     3.730   4.290 
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 318, r1= 3.23, r2= 3.73, r3= 4.29, r4= 4.79,  &end
#
#   9 DC    H1'   9 DC  H2'1    2.780   3.270
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 320, r1= 2.28, r2= 2.78, r3= 3.27, r4= 3.77,  &end
#
#   9 DC    H1'   9 DC  H2'2    2.120   2.660
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 321, r1= 1.62, r2= 2.12, r3= 2.66, r4= 3.16,  &end
#
#   9 DC    H5    9 DC  H2'1    4.100   4.680
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 320, r1= 3.60, r2= 4.10, r3= 4.68, r4= 5.18,  &end
#
#   9 DC    H5    9 DC  H2'2    5.300   5.740
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 321, r1= 4.80, r2= 5.30, r3= 5.74, r4= 6.24,  &end
#
#   9 DC    H6    9 DC  H2'1    1.700   2.160
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 320, r1= 1.20, r2= 1.70, r3= 2.16, r4= 2.66,  &end
#
#   9 DC    H6    9 DC  H2'2    3.220   3.730
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 321, r1= 2.72, r2= 3.22, r3= 3.73, r4= 4.23,  &end
#
#   9 DC    H6    9 DC  H1'     3.500   4.210
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 304, r1= 3.00, r2= 3.50, r3= 4.21, r4= 4.71,  &end
#
#  10 DA3   H8    9 DC  H2'1    3.690   4.290
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 320, r1= 3.19, r2= 3.69, r3= 4.29, r4= 4.79,  &end
#
#  10 DA3   H8    9 DC  H2'2    2.480   2.980
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 321, r1= 1.98, r2= 2.48, r3= 2.98, r4= 3.48,  &end
#
#  10 DA3   H8    9 DC  H6      4.430   5.240
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 307, r1= 3.93, r2= 4.43, r3= 5.24, r4= 5.74,  &end
#
#  10 DA3   H8    9 DC  H1'     3.590   4.290
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 304, r1= 3.09, r2= 3.59, r3= 4.29, r4= 4.79,  &end
#
#  10 DA3   H2'1 10 DA3 H3'     2.270   2.770
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 350, r1= 1.77, r2= 2.27, r3= 2.77, r4= 3.27,  &end
#
#  10 DA3   H2'2 10 DA3 H3'     2.510   3.070
 &rst
  ixpk= 0, nxpk= 0, iat= 353, 350, r1= 2.01, r2= 2.51, r3= 3.07, r4= 3.57,  &end
#
#  10 DA3   H1'  10 DA3 H3'     3.550   4.060
 &rst
  ixpk= 0, nxpk= 0, iat= 334, 350, r1= 3.05, r2= 3.55, r3= 4.06, r4= 4.56,  &end
#
#  10 DA3   H1'  10 DA3 H2'1    2.710   3.200
 &rst
  ixpk= 0, nxpk= 0, iat= 334, 352, r1= 2.21, r2= 2.71, r3= 3.20, r4= 3.70,  &end
#
#  10 DA3   H1'  10 DA3 H2'2    1.980   2.550
 &rst
  ixpk= 0, nxpk= 0, iat= 334, 353, r1= 1.48, r2= 1.98, r3= 2.55, r4= 3.05,  &end
#
#  10 DA3   H8   10 DA3 H3'     4.150   4.730
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 350, r1= 3.65, r2= 4.15, r3= 4.73, r4= 5.23,  &end
#
#  10 DA3   H8   10 DA3 H2'2    3.460   3.960
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 353, r1= 2.96, r2= 3.46, r3= 3.96, r4= 4.46,  &end
#
#  10 DA3   H8   10 DA3 H1'     3.570   4.070
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 334, r1= 3.07, r2= 3.57, r3= 4.07, r4= 4.57,  &end
#
#  11 DT5   H1'  11 DT5 H3'     3.740   4.280
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 381, r1= 3.24, r2= 3.74, r3= 4.28, r4= 4.78,  &end
#
#  11 DT5   H1'  11 DT5 H2'1    2.720   3.200
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 383, r1= 2.22, r2= 2.72, r3= 3.20, r4= 3.70,  &end
#
#  11 DT5   H1'  11 DT5 H2'2    2.120   2.610
 &rst
  ixpk= 0, nxpk= 0, iat= 365, 384, r1= 1.62, r2= 2.12, r3= 2.61, r4= 3.11,  &end
#
#  11 DT5   Q5   11 DT5 H1'     3.410   5.850
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 365, r1= 2.91, r2= 3.41, r3= 7.03, r4= 7.53,
 igr1= 371, 372, 373,
 &end
#
#  11 DT5   H6   11 DT5 H3'     3.820   4.280
 &rst
  ixpk= 0, nxpk= 0, iat= 368, 381, r1= 3.32, r2= 3.82, r3= 4.28, r4= 4.78,  &end
#
#  11 DT5   H6   11 DT5 H2'1    1.730   2.340
 &rst
  ixpk= 0, nxpk= 0, iat= 368, 383, r1= 1.23, r2= 1.73, r3= 2.34, r4= 2.84,  &end
#
#  11 DT5   H6   11 DT5 H2'2    3.110   3.810
 &rst
  ixpk= 0, nxpk= 0, iat= 368, 384, r1= 2.61, r2= 3.11, r3= 3.81, r4= 4.31,  &end
#
#  11 DT5   H6   11 DT5 H1'     2.730   4.390
 &rst
  ixpk= 0, nxpk= 0, iat= 368, 365, r1= 2.23, r2= 2.73, r3= 4.39, r4= 4.89,  &end
#
#  11 DT5   H6   11 DT5 Q5      2.020   2.850
 &rst
  ixpk= 0, nxpk= 0, iat= 368,  -1, r1= 1.52, r2= 2.02, r3= 3.42, r4= 3.92,
 igr2= 371, 372, 373,
 &end
#
#  12 DG    H8   11 DT5 H3'     4.990   5.480
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 381, r1= 4.49, r2= 4.99, r3= 5.48, r4= 5.98,  &end
#
#  12 DG    H8   11 DT5 H2'1    3.590   4.680
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 383, r1= 3.09, r2= 3.59, r3= 4.68, r4= 5.18,  &end
#
#  12 DG    H8   11 DT5 H2'2    2.570   3.640
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 384, r1= 2.07, r2= 2.57, r3= 3.64, r4= 4.14,  &end
#
#  12 DG    H8   11 DT5 H1'     3.550   4.020
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 365, r1= 3.05, r2= 3.55, r3= 4.02, r4= 4.52,  &end
#
#  12 DG    H8   11 DT5 H6      4.660   5.240
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 368, r1= 4.16, r2= 4.66, r3= 5.24, r4= 5.74,  &end
#
#  12 DG    H8   12 DG  H1'     3.700   5.260 
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 397, r1= 3.20, r2= 3.70, r3= 5.26, r4= 5.76,  &end
#
#  13 DA    H8   12 DG  H1'     3.440   4.080
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 397, r1= 2.94, r2= 3.44, r3= 4.08, r4= 4.58,  &end
#
#  13 DA    H8   12 DG  H8      5.080   5.690
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 400, r1= 4.58, r2= 5.08, r3= 5.69, r4= 6.19,  &end
#
#  13 DA    H8   12 DG  H2'1    4.500   5.000
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 416, r1= 4.00, r2= 4.50, r3= 5.00, r4= 5.50,  &end
#
#  13 DA    H8   12 DG  H2'2    2.800   3.400 
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 417, r1= 2.30, r2= 2.80, r3= 3.40, r4= 3.90,  &end
#
#  13 DA    H1'  13 DA  H3'     3.630   4.150
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 446, r1= 3.13, r2= 3.63, r3= 4.15, r4= 4.65,  &end
#
#  13 DA    H1'  13 DA  H2'1    2.750   3.230
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 448, r1= 2.25, r2= 2.75, r3= 3.23, r4= 3.73,  &end
#
#  13 DA    H1'  13 DA  H2'2    2.120   2.610
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 449, r1= 1.62, r2= 2.12, r3= 2.61, r4= 3.11,  &end
#
#  13 DA    H8   13 DA  H1'     3.680   4.180
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 430, r1= 3.18, r2= 3.68, r3= 4.18, r4= 4.68,  &end
#
#  13 DA    H8   13 DA  H2'2    3.480   3.980 
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 449, r1= 2.98, r2= 3.48, r3= 3.98, r4= 4.48,  &end
#
#  14 DA    H8   13 DA  H1'     2.410   3.190
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 430, r1= 1.91, r2= 2.41, r3= 3.19, r4= 3.69,  &end
#
#  14 DA    H8   13 DA  H8      4.490   4.990
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 433, r1= 3.99, r2= 4.49, r3= 4.99, r4= 5.49,  &end
#
#  14 DA    H8   13 DA  H2'1    3.800   4.300
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 448, r1= 3.30, r2= 3.80, r3= 4.30, r4= 4.80,  &end
#
#  14 DA    H8   13 DA  H2'2    2.400   2.900  
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 449, r1= 1.90, r2= 2.40, r3= 2.90, r4= 3.40,  &end
#
#  14 DA    H1'  14 DA  H2'1    2.800   3.310
 &rst
  ixpk= 0, nxpk= 0, iat= 462, 480, r1= 2.30, r2= 2.80, r3= 3.31, r4= 3.81,  &end
#
#  14 DA    H1'  14 DA  H2'2    2.120   2.630
 &rst
  ixpk= 0, nxpk= 0, iat= 462, 481, r1= 1.62, r2= 2.12, r3= 2.63, r4= 3.13,  &end
#
#  14 DA    H8   14 DA  H2'1    2.030   2.510
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 480, r1= 1.53, r2= 2.03, r3= 2.51, r4= 3.01,  &end
#
#  14 DA    H8   14 DA  H1'     3.650   4.130   
 &rst
  ixpk= 0, nxpk= 0, iat= 465, 462, r1= 3.15, r2= 3.65, r3= 4.13, r4= 4.63,  &end
#
#    15 DT   H2'1  15 DT    H3'  2.100   2.700         
 &rst
  ixpk= 0, nxpk= 0, iat= 512, 510, r1= 1.60, r2= 2.10, r3= 2.70, r4= 3.20,  &end
#
#    15 DT   H2'2  15 DT    H3'  2.500   2.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 513, 510, r1= 2.00, r2= 2.50, r3= 2.90, r4= 3.40,  &end
#
#    15 DT   H1'   15 DT    H3'  3.700   4.100         
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 510, r1= 3.20, r2= 3.70, r3= 4.10, r4= 4.60,  &end
#
#    15 DT   H1'   15 DT    H2'1   2.800   3.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 512, r1= 2.30, r2= 2.80, r3= 3.20, r4= 3.70,  &end
#
#    15 DT   H1'   15 DT    H2'2   2.100   2.500         
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 513, r1= 1.60, r2= 2.10, r3= 2.50, r4= 3.00,  &end
#
#    15 DT   Q5    14 DA    H1'  3.790   5.190         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 462, r1= 3.29, r2= 3.79, r3= 6.23, r4= 6.73,
 igr1= 500, 501, 502,
 &end
#
#    15 DT   Q5    14 DA    H8  2.630   3.810         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 465, r1= 2.13, r2= 2.63, r3= 4.58, r4= 5.08,
 igr1= 500, 501, 502,
 &end
#
#    15 DT   H6    14 DA    H2'2   1.900   2.300         
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 481, r1= 1.40, r2= 1.90, r3= 2.30, r4= 2.80,  &end
#
#    15 DT   H6    14 DA    H1'  3.200   3.800         
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 462, r1= 2.70, r2= 3.20, r3= 3.80, r4= 4.30,  &end
#
#    15 DT   H6    14 DA    H8  4.700   5.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 465, r1= 4.20, r2= 4.70, r3= 5.20, r4= 5.70,  &end
#
#    15 DT   H6    15 DT    H3'  4.000   4.600         
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 510, r1= 3.50, r2= 4.00, r3= 4.60, r4= 5.10,  &end
#
#    15 DT   H6    15 DT    H1'  3.500   3.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 494, r1= 3.00, r2= 3.50, r3= 3.90, r4= 4.40,  &end
#
#    15 DT   H6    15 DT    Q5  2.240   3.710 
 &rst
  ixpk= 0, nxpk= 0, iat= 497,  -1, r1= 1.74, r2= 2.24, r3= 4.46, r4= 4.96,
 igr2= 500, 501, 502,
 &end
#
#    16 DC   H2'2   5 FAG   H2B    3.500  4.000
 &rst
  ixpk= 0, nxpk= 0, iat= 543, 172, r1= 3.00, r2= 3.50, r3= 4.00, r4= 4.50,  &end
#
#    16 DC   H1'    5 FAG   H2B  4.100  4.600    
 &rst
  ixpk= 0, nxpk= 0, iat= 526, 172, r1= 3.60, r2= 4.10, r3= 4.60, r4= 5.10,  &end
#
#    16 DC   H2'2  16 DC    H3'  2.500   3.000         
 &rst
  ixpk= 0, nxpk= 0, iat= 543, 540, r1= 2.00, r2= 2.50, r3= 3.00, r4= 3.50,  &end
#
#    16 DC   H1'   16 DC    H3'  3.700   4.100         
 &rst
  ixpk= 0, nxpk= 0, iat= 526, 540, r1= 3.20, r2= 3.70, r3= 4.10, r4= 4.60,  &end
#
#    16 DC   H5    15 DT    H3'  5.200   5.600         
 &rst
  ixpk= 0, nxpk= 0, iat= 531, 510, r1= 4.70, r2= 5.20, r3= 5.60, r4= 6.10,  &end
#
#    16 DC   H5    15 DT    H2'1   3.000   3.400         
 &rst
  ixpk= 0, nxpk= 0, iat= 531, 512, r1= 2.50, r2= 3.00, r3= 3.40, r4= 3.90,  &end
#
#    16 DC   H5    15 DT    H2'2   2.700   3.300         
 &rst
  ixpk= 0, nxpk= 0, iat= 531, 513, r1= 2.20, r2= 2.70, r3= 3.30, r4= 3.80,  &end
#
#    16 DC   H5    15 DT    Q5  2.630   4.110         
 &rst
  ixpk= 0, nxpk= 0, iat= 531,  -1, r1= 2.13, r2= 2.63, r3= 4.94, r4= 5.44,
 igr2= 500, 501, 502,
 &end
#
#    16 DC   H5    15 DT    H6  3.500   3.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 531, 497, r1= 3.00, r2= 3.50, r3= 3.90, r4= 4.40,  &end
#
#    16 DC   H6    15 DT    H3'  4.600   5.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 510, r1= 4.10, r2= 4.60, r3= 5.20, r4= 5.70,  &end
#
#    16 DC   H6    15 DT    H2'1   3.400   3.800         
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 512, r1= 2.90, r2= 3.40, r3= 3.80, r4= 4.30,  &end
#
#    16 DC   H6    15 DT    H2'2   2.200   2.600         
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 513, r1= 1.70, r2= 2.20, r3= 2.60, r4= 3.10,  &end
#
#    16 DC   H6    15 DT    H1'  3.700   4.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 494, r1= 3.20, r2= 3.70, r3= 4.20, r4= 4.70,  &end
#
#    16 DC   H6    15 DT    H6  4.700   5.100         
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 497, r1= 4.20, r2= 4.70, r3= 5.10, r4= 5.60,  &end
#
#    16 DC   H6    16 DC    H1'  3.500   3.900           
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 526, r1= 3.00, r2= 3.50, r3= 3.90, r4= 4.40,  &end
#
#    17 DT   H2'1  17 DT    H3'  2.300   2.700         
 &rst
  ixpk= 0, nxpk= 0, iat= 574, 572, r1= 1.80, r2= 2.30, r3= 2.70, r4= 3.20,  &end
#
#    17 DT   H2'2  17 DT    H3'  2.500   2.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 575, 572, r1= 2.00, r2= 2.50, r3= 2.90, r4= 3.40,  &end
#
#    17 DT   H1'   17 DT    H3'  3.700   4.100         
 &rst
  ixpk= 0, nxpk= 0, iat= 556, 572, r1= 3.20, r2= 3.70, r3= 4.10, r4= 4.60,  &end
#
#    17 DT   H1'   17 DT    H2'2   2.100   2.500         
 &rst
  ixpk= 0, nxpk= 0, iat= 556, 575, r1= 1.60, r2= 2.10, r3= 2.50, r4= 3.00,  &end
#
#    17 DT   H6    17 DT    H3'  3.800   4.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 572, r1= 3.30, r2= 3.80, r3= 4.20, r4= 4.70,  &end
#
#    17 DT   H6    17 DT    H2'1   1.700   2.300         
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 574, r1= 1.20, r2= 1.70, r3= 2.30, r4= 2.80,  &end
#
#    17 DT   H6    17 DT    H2'2   3.200   3.700         
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 575, r1= 2.70, r2= 3.20, r3= 3.70, r4= 4.20,  &end
#
#    17 DT   H6    17 DT    H1'  3.500   3.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 556, r1= 3.00, r2= 3.50, r3= 3.90, r4= 4.40,  &end
#
#    17 DT   Q5    17 DT    H2'1   2.160   4.620         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 574, r1= 1.66, r2= 2.16, r3= 5.55, r4= 6.05,
 igr1= 562, 563, 564,
 &end
#
#    17 DT   Q5    17 DT    H6  2.000   3.550
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 559, r1= 1.50, r2= 2.00, r3= 4.26, r4= 4.76,
 igr1= 562, 563, 564,
 &end
#
#    18 DT   Q5    17 DT    H2'1   2.570   3.270         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 574, r1= 2.07, r2= 2.57, r3= 3.93, r4= 4.43,
 igr1= 594, 595, 596,
 &end
#
#    18 DT   Q5    17 DT    H2'2   2.550   3.330         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 575, r1= 2.05, r2= 2.55, r3= 4.00, r4= 4.50,
 igr1= 594, 595, 596,
 &end
#
#    18 DT   Q5    17 DT    H1'  3.400   4.750         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 556, r1= 2.90, r2= 3.40, r3= 5.70, r4= 6.20,
 igr1= 594, 595, 596,
 &end
#
#    18 DT   Q5    17 DT    H6  2.200   3.340         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 559, r1= 1.70, r2= 2.20, r3= 4.01, r4= 4.51,
 igr1= 594, 595, 596,
 &end
#
#    18 DT   Q5    17 DT    Q5  2.750   3.330
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 2.25, r2= 2.75, r3= 4.80, r4= 5.30,
 igr1= 594, 595, 596,
 igr2= 562, 563, 564,
 &end
#
#    18 DT   Q5    17 DT    H3'  3.750   4.330         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 572, r1= 3.25, r2= 3.75, r3= 5.20, r4= 5.70,
 igr1= 594, 595, 596,
 &end
#
#    18 DT   Q5    18 DT    H2'1   2.640   4.570
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 606, r1= 2.14, r2= 2.64, r3= 5.49, r4= 5.99,
 igr1= 594, 595, 596,
 &end
#
#    18 DT   H6    17 DT    H1'    2.900   3.300
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 556, r1= 2.40, r2= 2.90, r3= 3.30, r4= 3.80,  &end
#
#    18 DT   H6    17 DT    H2'1   4.000   4.500         
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 574, r1= 3.50, r2= 4.00, r3= 4.50, r4= 5.00,  &end
#
#    18 DT   H6    17 DT    H2'2   2.500   2.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 575, r1= 2.00, r2= 2.50, r3= 2.90, r4= 3.40,  &end
#
#    18 DT   H6    17 DT    H6  5.000   5.500            
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 559, r1= 4.50, r2= 5.00, r3= 5.50, r4= 6.00,  &end
#
#    18 DT   H2'2  18 DT    H3'  2.500   2.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 607, 604, r1= 2.00, r2= 2.50, r3= 2.90, r4= 3.40,  &end
#
#    18 DT   H1'   18 DT    H3'  3.700   4.100         
 &rst
  ixpk= 0, nxpk= 0, iat= 588, 604, r1= 3.20, r2= 3.70, r3= 4.10, r4= 4.60,  &end
#
#    18 DT   H1'   18 DT    H2'1   2.800   3.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 588, 606, r1= 2.30, r2= 2.80, r3= 3.20, r4= 3.70,  &end
#
#    18 DT   H1'   18 DT    H2'2   2.100   2.500         
 &rst
  ixpk= 0, nxpk= 0, iat= 588, 607, r1= 1.60, r2= 2.10, r3= 2.50, r4= 3.00,  &end
#
#    18 DT   Q5    17 DT    H3'  2.810   4.960         
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 572, r1= 2.31, r2= 2.81, r3= 5.96, r4= 6.46,
 igr1= 594, 595, 596,
 &end
#
#    18 DT   H6    18 DT    H2'1   2.000   2.400         
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 606, r1= 1.50, r2= 2.00, r3= 2.40, r4= 2.90,  &end
#
#    18 DT   H6    18 DT    H2'2   3.100   3.600         
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 607, r1= 2.60, r2= 3.10, r3= 3.60, r4= 4.10,  &end
#
#    18 DT   H6    18 DT    H1'  3.500   3.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 591, 588, r1= 3.00, r2= 3.50, r3= 3.90, r4= 4.40,  &end
#
#    18 DT   H6    18 DT    Q5  2.210   3.270           
 &rst
  ixpk= 0, nxpk= 0, iat= 591,  -1, r1= 1.71, r2= 2.21, r3= 3.93, r4= 4.43,
 igr2= 594, 595, 596,
 &end
#
#    19 DA   H1'   19 DA    H2'1   2.800   3.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 620, 638, r1= 2.30, r2= 2.80, r3= 3.20, r4= 3.70,  &end
#
#    19 DA   H1'   19 DA    H2'2   2.100   2.500         
 &rst
  ixpk= 0, nxpk= 0, iat= 620, 639, r1= 1.60, r2= 2.10, r3= 2.50, r4= 3.00,  &end
#
#    19 DA   H8    18 DT    H2'1   4.800   5.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 623, 606, r1= 4.30, r2= 4.80, r3= 5.20, r4= 5.70,  &end
#
#    19 DA   H8    18 DT    H2'2   3.000   3.400         
 &rst
  ixpk= 0, nxpk= 0, iat= 623, 607, r1= 2.50, r2= 3.00, r3= 3.40, r4= 3.90,  &end
#
#    19 DA   H8    18 DT    H1'  3.800   4.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 623, 588, r1= 3.30, r2= 3.80, r3= 4.20, r4= 4.70,  &end
#
#    19 DA   H8    18 DT    H6  6.000   6.600         
 &rst
  ixpk= 0, nxpk= 0, iat= 623, 591, r1= 5.50, r2= 6.00, r3= 6.60, r4= 7.10,  &end
#
#    19 DA   H8    19 DA    H3'  4.200   4.600         
 &rst
  ixpk= 0, nxpk= 0, iat= 623, 636, r1= 3.70, r2= 4.20, r3= 4.60, r4= 5.10,  &end
#
#    19 DA   H8    19 DA    H2'2   3.500   4.000         
 &rst
  ixpk= 0, nxpk= 0, iat= 623, 639, r1= 3.00, r2= 3.50, r3= 4.00, r4= 4.50,  &end
#
#    19 DA   H8    19 DA    H1'  3.700   4.100     
 &rst
  ixpk= 0, nxpk= 0, iat= 623, 620, r1= 3.20, r2= 3.70, r3= 4.10, r4= 4.60,  &end
#
#    20 DG3  H2'1  20 DG3   H3'  2.300   2.700         
 &rst
  ixpk= 0, nxpk= 0, iat= 671, 669, r1= 1.80, r2= 2.30, r3= 2.70, r4= 3.20,  &end
#
#    20 DG3  H2'2  20 DG3   H3'  2.500   2.900         
 &rst
  ixpk= 0, nxpk= 0, iat= 672, 669, r1= 2.00, r2= 2.50, r3= 2.90, r4= 3.40,  &end
#
#    20 DG3  H1'   20 DG3   H3'  3.700   4.100         
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 669, r1= 3.20, r2= 3.70, r3= 4.10, r4= 4.60,  &end
#
#    20 DG3  H1'   20 DG3   H2'1   2.800   3.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 671, r1= 2.30, r2= 2.80, r3= 3.20, r4= 3.70,  &end
#
#    20 DG3  H1'   20 DG3   H2'2   2.100   2.600         
 &rst
  ixpk= 0, nxpk= 0, iat= 652, 672, r1= 1.60, r2= 2.10, r3= 2.60, r4= 3.10,  &end
#
#    20 DG3  H8    19 DA    H3'  4.700   5.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 655, 636, r1= 4.20, r2= 4.70, r3= 5.20, r4= 5.70,  &end
#
#    20 DG3  H8    19 DA    H2'1   3.500   4.100         
 &rst
  ixpk= 0, nxpk= 0, iat= 655, 638, r1= 3.00, r2= 3.50, r3= 4.10, r4= 4.60,  &end
#
#    20 DG3  H8    19 DA    H2'2   2.100   2.500         
 &rst
  ixpk= 0, nxpk= 0, iat= 655, 639, r1= 1.60, r2= 2.10, r3= 2.50, r4= 3.00,  &end
#
#    20 DG3  H8    19 DA    H1'  3.000   3.600         
 &rst
  ixpk= 0, nxpk= 0, iat= 655, 620, r1= 2.50, r2= 3.00, r3= 3.60, r4= 4.10,  &end
#
#    20 DG3  H8    19 DA    H8  4.800   5.200         
 &rst
  ixpk= 0, nxpk= 0, iat= 655, 623, r1= 4.30, r2= 4.80, r3= 5.20, r4= 5.70,  &end
#
#    20 DG3  H8    20 DG3   H3'  4.200   4.600         
 &rst
  ixpk= 0, nxpk= 0, iat= 655, 669, r1= 3.70, r2= 4.20, r3= 4.60, r4= 5.10,  &end
#
#    20 DG3  H8    20 DG3   H2'1   2.000   2.500         
 &rst
  ixpk= 0, nxpk= 0, iat= 655, 671, r1= 1.50, r2= 2.00, r3= 2.50, r4= 3.00,  &end
#
#  1  DC5  H42 20  DG3  O6  1.80 2.00
 &rst
  ixpk= 0, nxpk= 0, iat=  19, 659, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#  1  DC5  N3 20  DG3  H1  1.84 2.04
 &rst
  ixpk= 0, nxpk= 0, iat=  20, 661, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  1  DC5  N3 20  DG3  N1  2.85 3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  20, 660, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  &end
#
#  1  DC5  N4 20  DG3  O6  2.81 3.01
 &rst
  ixpk= 0, nxpk= 0, iat=  17, 659, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51,  &end
#
#  1  DC5  O2 20  DG3  H22  1.75 1.95
 &rst
  ixpk= 0, nxpk= 0, iat=  22, 665, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45,  &end
#
#  2  DT   H3 19  DA   N1  1.71 1.91
 &rst
  ixpk= 0, nxpk= 0, iat=  52, 630, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41,  &end
#
#  2  DT   N3 19  DA   N1  2.72 2.92
 &rst
  ixpk= 0, nxpk= 0, iat=  51, 630, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  &end
#
#  2  DT   O4 19  DA   H61  1.84 2.04
 &rst
  ixpk= 0, nxpk= 0, iat=  50, 628, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  3  DA   H61 18  DT   O4  1.84 2.04
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 598, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  3  DA   N1 18  DT   H3  1.71 1.91
 &rst
  ixpk= 0, nxpk= 0, iat=  82, 600, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41,  &end
#
#  3  DA   N1 18  DT   N3  2.72 2.92
 &rst
  ixpk= 0, nxpk= 0, iat=  82, 599, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  &end
#
#  4  DA   H61 17  DT   O4  1.84 2.04
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 566, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  4  DA   N1 17  DT   H3  1.71 1.91
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 568, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41,  &end
#
#  4  DA   N1 17  DT   N3  2.72 2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 567, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  &end
#
#  5  FAG  H1 16  DC   N3  1.84 2.04
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 536, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  5  FAG  H22 16  DC   O2  1.75 1.95
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 538, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45,  &end
#
#  5  FAG  N1 16  DC   N3  2.85 3.05
 &rst
  ixpk= 0, nxpk= 0, iat= 145, 536, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  &end
#
#  5  FAG  O6 16  DC   H42  1.80 2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 535, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  5  FAG  O6 16  DC   N4  2.81 3.01
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 533, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51,  &end
#
#  6  DA   H62  5  FAG  O8  1.91 2.11
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 533, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51,  &end
#
#  6  DA   H61 15  DT   O4  1.84 2.04
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 598, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  6  DA   N1 15  DT   H3  1.71 1.91
 &rst
  ixpk= 0, nxpk= 0, iat=  82, 600, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41,  &end
#
#  6  DA   N1 15  DT   N3  2.72 2.92
 &rst
  ixpk= 0, nxpk= 0, iat=  82, 599, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  &end
#
#  7  DT   H3 14  DA   N1  1.71 1.91
 &rst
  ixpk= 0, nxpk= 0, iat= 252, 472, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41,  &end
#
#  7  DT   N3 14  DA   N1  2.72 2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 251, 472, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  &end
#
#  7  DT   O4 14  DA   H61  1.84 2.04
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 470, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  8  DT   H3 13  DA   N1  1.71 1.91
 &rst
  ixpk= 0, nxpk= 0, iat= 284, 440, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41,  &end
#
#  8  DT   N3 13  DA   N1  2.72 2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 283, 440, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  &end
#
#  8  DT   O4 13  DA   H61  1.84 2.04
 &rst
  ixpk= 0, nxpk= 0, iat= 282, 438, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  9  DC   H42 12  DG   O6  1.80 2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 404, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  9  DC   N3 12  DG   H1  1.84 2.04
 &rst
  ixpk= 0, nxpk= 0, iat= 314, 406, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  9  DC   N3 12  DG   N1  2.85 3.05
 &rst
  ixpk= 0, nxpk= 0, iat= 314, 405, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  &end
#
#  9  DC   N4 12  DG   O6  2.81 3.01
 &rst
  ixpk= 0, nxpk= 0, iat= 311, 404, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51,  &end
#
#  9  DC   O2 12  DG   H22  1.75 1.95
 &rst
  ixpk= 0, nxpk= 0, iat= 316, 410, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45,  &end
#
#  10 DA3  H61 11  DT5  O4  1.84 2.04
 &rst
  ixpk= 0, nxpk= 0, iat= 342, 375, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  10 DA3  N1 11  DT5  H3  1.71 1.91
 &rst
  ixpk= 0, nxpk= 0, iat= 344, 377, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41,  &end
#
#  10 DA3  N1 11  DT5  N3  2.72 2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 344, 376, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  &end
# 674 atoms read from pdb file AGA_mod_amber.pdb.
# 2 DT ALPHA:  (1 DC5 O3')-(2 DT P)-(2 DT O5')-(2 DT C5') -90.0 -30.0
 &rst     iat =    28,    29,    32,    33,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
   rk2 =   2.0, rk3 =   2.0,    &end

# 3 DA ALPHA:  (2 DT O3')-(3 DA P)-(3 DA O5')-(3 DA C5') -90.0 -30.0
 &rst     iat =    60,    61,    64,    65,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 4 DA ALPHA:  (3 DA O3')-(4 DA P)-(4 DA O5')-(4 DA C5') -90.0 -30.0
 &rst     iat =    92,    93,    96,    97,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 6 DA ALPHA:  (5 FAG O3')-(6 DA P)-(6 DA O5')-(6 DA C5') -90.0 -30.0
 &rst     iat =   196,   197,   200,   201,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 7 DT ALPHA:  (6 DA O3')-(7 DT P)-(7 DT O5')-(7 DT C5') -90.0 -30.0
 &rst     iat =   228,   229,   232,   233,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 8 DT ALPHA:  (7 DT O3')-(8 DT P)-(8 DT O5')-(8 DT C5') -90.0 -30.0
 &rst     iat =   260,   261,   264,   265,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 9 DC ALPHA:  (8 DT O3')-(9 DC P)-(9 DC O5')-(9 DC C5') -90.0 -30.0
 &rst     iat =   292,   293,   296,   297,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 12 DG ALPHA:  (11 DT5 O3')-(12 DG P)-(12 DG O5')-(12 DG C5') -90.0 -30.0
 &rst     iat =   385,   386,   389,   390,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 13 DA ALPHA:  (12 DG O3')-(13 DA P)-(13 DA O5')-(13 DA C5') -90.0 -30.0
 &rst     iat =   418,   419,   422,   423,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 14 DA ALPHA:  (13 DA O3')-(14 DA P)-(14 DA O5')-(14 DA C5') -90.0 -30.0
 &rst     iat =   450,   451,   454,   455,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 15 DT ALPHA:  (14 DA O3')-(15 DT P)-(15 DT O5')-(15 DT C5') -90.0 -30.0
 &rst     iat =   482,   483,   486,   487,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 17 DT ALPHA:  (16 DC O3')-(17 DT P)-(17 DT O5')-(17 DT C5') -90.0 -30.0
 &rst     iat =   544,   545,   548,   549,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 18 DT ALPHA:  (17 DT O3')-(18 DT P)-(18 DT O5')-(18 DT C5') -90.0 -30.0
 &rst     iat =   576,   577,   580,   581,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 19 DA ALPHA:  (18 DT O3')-(19 DA P)-(19 DA O5')-(19 DA C5') -90.0 -30.0
 &rst     iat =   608,   609,   612,   613,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 2 DT BETA:  (2 DT P)-(2 DT O5')-(2 DT C5')-(2 DT C4') 150.0 210.0
 &rst     iat =    29,    32,    33,    36,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 3 DA BETA:  (3 DA P)-(3 DA O5')-(3 DA C5')-(3 DA C4') 150.0 210.0
 &rst     iat =    61,    64,    65,    68,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 4 DA BETA:  (4 DA P)-(4 DA O5')-(4 DA C5')-(4 DA C4') 150.0 210.0
 &rst     iat =    93,    96,    97,   100,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 6 DA BETA:  (6 DA P)-(6 DA O5')-(6 DA C5')-(6 DA C4') 150.0 210.0
 &rst     iat =   197,   200,   201,   204,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 7 DT BETA:  (7 DT P)-(7 DT O5')-(7 DT C5')-(7 DT C4') 150.0 210.0
 &rst     iat =   229,   232,   233,   236,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 8 DT BETA:  (8 DT P)-(8 DT O5')-(8 DT C5')-(8 DT C4') 150.0 210.0
 &rst     iat =   261,   264,   265,   268,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 9 DC BETA:  (9 DC P)-(9 DC O5')-(9 DC C5')-(9 DC C4') 150.0 210.0
 &rst     iat =   293,   296,   297,   300,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 12 DG BETA:  (12 DG P)-(12 DG O5')-(12 DG C5')-(12 DG C4') 150.0 210.0
 &rst     iat =   386,   389,   390,   393,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 13 DA BETA:  (13 DA P)-(13 DA O5')-(13 DA C5')-(13 DA C4') 150.0 210.0
 &rst     iat =   419,   422,   423,   426,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 14 DA BETA:  (14 DA P)-(14 DA O5')-(14 DA C5')-(14 DA C4') 150.0 210.0
 &rst     iat =   451,   454,   455,   458,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 15 DT BETA:  (15 DT P)-(15 DT O5')-(15 DT C5')-(15 DT C4') 150.0 210.0
 &rst     iat =   483,   486,   487,   490,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 17 DT BETA:  (17 DT P)-(17 DT O5')-(17 DT C5')-(17 DT C4') 150.0 210.0
 &rst     iat =   545,   548,   549,   552,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 18 DT BETA:  (18 DT P)-(18 DT O5')-(18 DT C5')-(18 DT C4') 150.0 210.0
 &rst     iat =   577,   580,   581,   584,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 19 DA BETA:  (19 DA P)-(19 DA O5')-(19 DA C5')-(19 DA C4') 150.0 210.0
 &rst     iat =   609,   612,   613,   616,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 2 DT GAMMA:  (2 DT O5')-(2 DT C5')-(2 DT C4')-(2 DT C3')  30.0  90.0
 &rst     iat =    32,    33,    36,    55,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 3 DA GAMMA:  (3 DA O5')-(3 DA C5')-(3 DA C4')-(3 DA C3')  30.0  90.0
 &rst     iat =    64,    65,    68,    87,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 4 DA GAMMA:  (4 DA O5')-(4 DA C5')-(4 DA C4')-(4 DA C3')  30.0  90.0
 &rst     iat =    96,    97,   100,   119,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 6 DA GAMMA:  (6 DA O5')-(6 DA C5')-(6 DA C4')-(6 DA C3')  30.0  90.0
 &rst     iat =   200,   201,   204,   223,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 7 DT GAMMA:  (7 DT O5')-(7 DT C5')-(7 DT C4')-(7 DT C3')  30.0  90.0
 &rst     iat =   232,   233,   236,   255,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 8 DT GAMMA:  (8 DT O5')-(8 DT C5')-(8 DT C4')-(8 DT C3')  30.0  90.0
 &rst     iat =   264,   265,   268,   287,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 9 DC GAMMA:  (9 DC O5')-(9 DC C5')-(9 DC C4')-(9 DC C3')  30.0  90.0
 &rst     iat =   296,   297,   300,   317,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 12 DG GAMMA:  (12 DG O5')-(12 DG C5')-(12 DG C4')-(12 DG C3')  30.0  90.0
 &rst     iat =   389,   390,   393,   413,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 13 DA GAMMA:  (13 DA O5')-(13 DA C5')-(13 DA C4')-(13 DA C3')  30.0  90.0
 &rst     iat =   422,   423,   426,   445,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 14 DA GAMMA:  (14 DA O5')-(14 DA C5')-(14 DA C4')-(14 DA C3')  30.0  90.0
 &rst     iat =   454,   455,   458,   477,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 15 DT GAMMA:  (15 DT O5')-(15 DT C5')-(15 DT C4')-(15 DT C3')  30.0  90.0
 &rst     iat =   486,   487,   490,   509,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 17 DT GAMMA:  (17 DT O5')-(17 DT C5')-(17 DT C4')-(17 DT C3')  30.0  90.0
 &rst     iat =   548,   549,   552,   571,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 18 DT GAMMA:  (18 DT O5')-(18 DT C5')-(18 DT C4')-(18 DT C3')  30.0  90.0
 &rst     iat =   580,   581,   584,   603,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 19 DA GAMMA:  (19 DA O5')-(19 DA C5')-(19 DA C4')-(19 DA C3')  30.0  90.0
 &rst     iat =   612,   613,   616,   635,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 2 DT EPSILN:  (2 DT C4')-(2 DT C3')-(2 DT O3')-(3 DA P) 165.0 225.0
 &rst     iat =    36,    55,    60,    61,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 3 DA EPSILN:  (3 DA C4')-(3 DA C3')-(3 DA O3')-(4 DA P) 165.0 225.0
 &rst     iat =    68,    87,    92,    93,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 4 DA EPSILN:  (4 DA C4')-(4 DA C3')-(4 DA O3')-(5 FAG P) 165.0 225.0
 &rst     iat =   100,   119,   124,   125,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 6 DA EPSILN:  (6 DA C4')-(6 DA C3')-(6 DA O3')-(7 DT P) 165.0 225.0
 &rst     iat =   204,   223,   228,   229,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 7 DT EPSILN:  (7 DT C4')-(7 DT C3')-(7 DT O3')-(8 DT P) 165.0 225.0
 &rst     iat =   236,   255,   260,   261,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 8 DT EPSILN:  (8 DT C4')-(8 DT C3')-(8 DT O3')-(9 DC P) 165.0 225.0
 &rst     iat =   268,   287,   292,   293,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 9 DC EPSILN:  (9 DC C4')-(9 DC C3')-(9 DC O3')-(10 DA3 P) 165.0 225.0
 &rst     iat =   300,   317,   322,   323,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 12 DG EPSILN:  (12 DG C4')-(12 DG C3')-(12 DG O3')-(13 DA P) 165.0 225.0
 &rst     iat =   393,   413,   418,   419,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 13 DA EPSILN:  (13 DA C4')-(13 DA C3')-(13 DA O3')-(14 DA P) 165.0 225.0
 &rst     iat =   426,   445,   450,   451,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 14 DA EPSILN:  (14 DA C4')-(14 DA C3')-(14 DA O3')-(15 DT P) 165.0 225.0
 &rst     iat =   458,   477,   482,   483,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 15 DT EPSILN:  (15 DT C4')-(15 DT C3')-(15 DT O3')-(16 DC P) 165.0 225.0
 &rst     iat =   490,   509,   514,   515,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 17 DT EPSILN:  (17 DT C4')-(17 DT C3')-(17 DT O3')-(18 DT P) 165.0 225.0
 &rst     iat =   552,   571,   576,   577,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 18 DT EPSILN:  (18 DT C4')-(18 DT C3')-(18 DT O3')-(19 DA P) 165.0 225.0
 &rst     iat =   584,   603,   608,   609,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 19 DA EPSILN:  (19 DA C4')-(19 DA C3')-(19 DA O3')-(20 DG3 P) 165.0 225.0
 &rst     iat =   616,   635,   640,   641,
   r1 = 164.0, r2 = 165.0, r3 = 225.0, r4 = 226.0,
 &end

# 2 DT ZETA:  (2 DT C3')-(2 DT O3')-(3 DA P)-(3 DA O5') -135.0 -75.0
 &rst     iat =    55,    60,    61,    64,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 3 DA ZETA:  (3 DA C3')-(3 DA O3')-(4 DA P)-(4 DA O5') -135.0 -75.0
 &rst     iat =    87,    92,    93,    96,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 4 DA ZETA:  (4 DA C3')-(4 DA O3')-(5 FAG P)-(5 FAG O5') -135.0 -75.0
 &rst     iat =   119,   124,   125,   128,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 6 DA ZETA:  (6 DA C3')-(6 DA O3')-(7 DT P)-(7 DT O5') -135.0 -75.0
 &rst     iat =   223,   228,   229,   232,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 7 DT ZETA:  (7 DT C3')-(7 DT O3')-(8 DT P)-(8 DT O5') -135.0 -75.0
 &rst     iat =   255,   260,   261,   264,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 8 DT ZETA:  (8 DT C3')-(8 DT O3')-(9 DC P)-(9 DC O5') -135.0 -75.0
 &rst     iat =   287,   292,   293,   296,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 9 DC ZETA:  (9 DC C3')-(9 DC O3')-(10 DA3 P)-(10 DA3 O5') -135.0 -75.0
 &rst     iat =   317,   322,   323,   326,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 12 DG ZETA:  (12 DG C3')-(12 DG O3')-(13 DA P)-(13 DA O5') -135.0 -75.0
 &rst     iat =   413,   418,   419,   422,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 13 DA ZETA:  (13 DA C3')-(13 DA O3')-(14 DA P)-(14 DA O5') -135.0 -75.0
 &rst     iat =   445,   450,   451,   454,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 14 DA ZETA:  (14 DA C3')-(14 DA O3')-(15 DT P)-(15 DT O5') -135.0 -75.0
 &rst     iat =   477,   482,   483,   486,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 15 DT ZETA:  (15 DT C3')-(15 DT O3')-(16 DC P)-(16 DC O5') -135.0 -75.0
 &rst     iat =   509,   514,   515,   518,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 17 DT ZETA:  (17 DT C3')-(17 DT O3')-(18 DT P)-(18 DT O5') -135.0 -75.0
 &rst     iat =   571,   576,   577,   580,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 18 DT ZETA:  (18 DT C3')-(18 DT O3')-(19 DA P)-(19 DA O5') -135.0 -75.0
 &rst     iat =   603,   608,   609,   612,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 19 DA ZETA:  (19 DA C3')-(19 DA O3')-(20 DG3 P)-(20 DG3 O5') -135.0 -75.0
 &rst     iat =   635,   640,   641,   644,
   r1 = -136.0, r2 = -135.0, r3 = -75.0, r4 = -74.0,
 &end

# 674 atoms read from pdb file AGA_mod_amber.pdb.
# 2 DT NU0:  (2 DT C4')-(2 DT O4')-(2 DT C1')-(2 DT C2') -52.1 -22.1
 &rst     iat =    36,    38,    39,    57,
   r1 = -53.1, r2 = -52.1, r3 = -22.1, r4 = -21.1,
   rk2 =   2.0, rk3 =   2.0,    &end

# 2 DT NU1:  (2 DT O4')-(2 DT C1')-(2 DT C2')-(2 DT C3')  15.0  45.0
 &rst     iat =    38,    39,    57,    55,
   r1 =  14.0, r2 =  15.0, r3 =  45.0, r4 =  46.0,
 &end

# 2 DT NU2:  (2 DT C1')-(2 DT C2')-(2 DT C3')-(2 DT C4') -27.4   2.6
 &rst     iat =    39,    57,    55,    36,
   r1 = -28.4, r2 = -27.4, r3 =   2.6, r4 =   3.6,
 &end

# 2 DT NU3:  (2 DT C2')-(2 DT C3')-(2 DT C4')-(2 DT O4') -25.0   5.0
 &rst     iat =    57,    55,    36,    38,
   r1 = -26.0, r2 = -25.0, r3 =   5.0, r4 =   6.0,
 &end

# 2 DT NU4:  (2 DT C3')-(2 DT C4')-(2 DT O4')-(2 DT C1')  13.5  43.5
 &rst     iat =    55,    36,    38,    39,
   r1 =  12.5, r2 =  13.5, r3 =  43.5, r4 =  44.5,
 &end

# 3 DA NU0:  (3 DA C4')-(3 DA O4')-(3 DA C1')-(3 DA C2') -43.9 -13.9
 &rst     iat =    68,    70,    71,    89,
   r1 = -44.9, r2 = -43.9, r3 = -13.9, r4 = -12.9,
 &end

# 3 DA NU1:  (3 DA O4')-(3 DA C1')-(3 DA C2')-(3 DA C3')  22.2  52.2
 &rst     iat =    70,    71,    89,    87,
   r1 =  21.2, r2 =  22.2, r3 =  52.2, r4 =  53.2,
 &end

# 3 DA NU2:  (3 DA C1')-(3 DA C2')-(3 DA C3')-(3 DA C4') -44.6 -14.6
 &rst     iat =    71,    89,    87,    68,
   r1 = -45.6, r2 = -44.6, r3 = -14.6, r4 = -13.6,
 &end

# 3 DA NU3:  (3 DA C2')-(3 DA C3')-(3 DA C4')-(3 DA O4')  -3.2  26.8
 &rst     iat =    89,    87,    68,    70,
   r1 =  -4.2, r2 =  -3.2, r3 =  26.8, r4 =  27.8,
 &end

# 3 DA NU4:  (3 DA C3')-(3 DA C4')-(3 DA O4')-(3 DA C1')  -4.4  25.6
 &rst     iat =    87,    68,    70,    71,
   r1 =  -5.4, r2 =  -4.4, r3 =  25.6, r4 =  26.6,
 &end

# 4 DA NU0:  (4 DA C4')-(4 DA O4')-(4 DA C1')-(4 DA C2') -43.9 -13.9
 &rst     iat =   100,   102,   103,   121,
   r1 = -44.9, r2 = -43.9, r3 = -13.9, r4 = -12.9,
 &end

# 4 DA NU1:  (4 DA O4')-(4 DA C1')-(4 DA C2')-(4 DA C3')  22.2  52.2
 &rst     iat =   102,   103,   121,   119,
   r1 =  21.2, r2 =  22.2, r3 =  52.2, r4 =  53.2,
 &end

# 4 DA NU2:  (4 DA C1')-(4 DA C2')-(4 DA C3')-(4 DA C4') -44.6 -14.6
 &rst     iat =   103,   121,   119,   100,
   r1 = -45.6, r2 = -44.6, r3 = -14.6, r4 = -13.6,
 &end

# 4 DA NU3:  (4 DA C2')-(4 DA C3')-(4 DA C4')-(4 DA O4')  -3.2  26.8
 &rst     iat =   121,   119,   100,   102,
   r1 =  -4.2, r2 =  -3.2, r3 =  26.8, r4 =  27.8,
 &end

# 4 DA NU4:  (4 DA C3')-(4 DA C4')-(4 DA O4')-(4 DA C1')  -4.4  25.6
 &rst     iat =   119,   100,   102,   103,
   r1 =  -5.4, r2 =  -4.4, r3 =  25.6, r4 =  26.6,
 &end

# 6 DA NU0:  (6 DA C4')-(6 DA O4')-(6 DA C1')-(6 DA C2') -43.9 -13.9
 &rst     iat =   204,   206,   207,   225,
   r1 = -44.9, r2 = -43.9, r3 = -13.9, r4 = -12.9,
 &end

# 6 DA NU1:  (6 DA O4')-(6 DA C1')-(6 DA C2')-(6 DA C3')  22.2  52.2
 &rst     iat =   206,   207,   225,   223,
   r1 =  21.2, r2 =  22.2, r3 =  52.2, r4 =  53.2,
 &end

# 6 DA NU2:  (6 DA C1')-(6 DA C2')-(6 DA C3')-(6 DA C4') -44.6 -14.6
 &rst     iat =   207,   225,   223,   204,
   r1 = -45.6, r2 = -44.6, r3 = -14.6, r4 = -13.6,
 &end

# 6 DA NU3:  (6 DA C2')-(6 DA C3')-(6 DA C4')-(6 DA O4')  -3.2  26.8
 &rst     iat =   225,   223,   204,   206,
   r1 =  -4.2, r2 =  -3.2, r3 =  26.8, r4 =  27.8,
 &end

# 6 DA NU4:  (6 DA C3')-(6 DA C4')-(6 DA O4')-(6 DA C1')  -4.4  25.6
 &rst     iat =   223,   204,   206,   207,
   r1 =  -5.4, r2 =  -4.4, r3 =  25.6, r4 =  26.6,
 &end

# 7 DT NU0:  (7 DT C4')-(7 DT O4')-(7 DT C1')-(7 DT C2') -52.1 -22.1
 &rst     iat =   236,   238,   239,   257,
   r1 = -53.1, r2 = -52.1, r3 = -22.1, r4 = -21.1,
 &end

# 7 DT NU1:  (7 DT O4')-(7 DT C1')-(7 DT C2')-(7 DT C3')  15.0  45.0
 &rst     iat =   238,   239,   257,   255,
   r1 =  14.0, r2 =  15.0, r3 =  45.0, r4 =  46.0,
 &end

# 7 DT NU2:  (7 DT C1')-(7 DT C2')-(7 DT C3')-(7 DT C4') -27.4   2.6
 &rst     iat =   239,   257,   255,   236,
   r1 = -28.4, r2 = -27.4, r3 =   2.6, r4 =   3.6,
 &end

# 7 DT NU3:  (7 DT C2')-(7 DT C3')-(7 DT C4')-(7 DT O4') -25.0   5.0
 &rst     iat =   257,   255,   236,   238,
   r1 = -26.0, r2 = -25.0, r3 =   5.0, r4 =   6.0,
 &end

# 7 DT NU4:  (7 DT C3')-(7 DT C4')-(7 DT O4')-(7 DT C1')  13.5  43.5
 &rst     iat =   255,   236,   238,   239,
   r1 =  12.5, r2 =  13.5, r3 =  43.5, r4 =  44.5,
 &end

# 8 DT NU0:  (8 DT C4')-(8 DT O4')-(8 DT C1')-(8 DT C2') -52.1 -22.1
 &rst     iat =   268,   270,   271,   289,
   r1 = -53.1, r2 = -52.1, r3 = -22.1, r4 = -21.1,
 &end

# 8 DT NU1:  (8 DT O4')-(8 DT C1')-(8 DT C2')-(8 DT C3')  15.0  45.0
 &rst     iat =   270,   271,   289,   287,
   r1 =  14.0, r2 =  15.0, r3 =  45.0, r4 =  46.0,
 &end

# 8 DT NU2:  (8 DT C1')-(8 DT C2')-(8 DT C3')-(8 DT C4') -27.4   2.6
 &rst     iat =   271,   289,   287,   268,
   r1 = -28.4, r2 = -27.4, r3 =   2.6, r4 =   3.6,
 &end

# 8 DT NU3:  (8 DT C2')-(8 DT C3')-(8 DT C4')-(8 DT O4') -25.0   5.0
 &rst     iat =   289,   287,   268,   270,
   r1 = -26.0, r2 = -25.0, r3 =   5.0, r4 =   6.0,
 &end

# 8 DT NU4:  (8 DT C3')-(8 DT C4')-(8 DT O4')-(8 DT C1')  13.5  43.5
 &rst     iat =   287,   268,   270,   271,
   r1 =  12.5, r2 =  13.5, r3 =  43.5, r4 =  44.5,
 &end

# 9 DC NU0:  (9 DC C4')-(9 DC O4')-(9 DC C1')-(9 DC C2') -44.7 -14.7
 &rst     iat =   300,   302,   303,   319,
   r1 = -45.7, r2 = -44.7, r3 = -14.7, r4 = -13.7,
 &end

# 9 DC NU1:  (9 DC O4')-(9 DC C1')-(9 DC C2')-(9 DC C3')  18.1  48.1
 &rst     iat =   302,   303,   319,   317,
   r1 =  17.1, r2 =  18.1, r3 =  48.1, r4 =  49.1,
 &end

# 9 DC NU2:  (9 DC C1')-(9 DC C2')-(9 DC C3')-(9 DC C4') -37.2  -6.7
 &rst     iat =   303,   319,   317,   300,
   r1 = -38.2, r2 = -37.2, r3 =  -6.7, r4 =  -5.7,
 &end

# 9 DC NU3:  (9 DC C2')-(9 DC C3')-(9 DC C4')-(9 DC O4') -16.9  24.2
 &rst     iat =   319,   317,   300,   302,
   r1 = -17.9, r2 = -16.9, r3 =  24.2, r4 =  25.2,
 &end

# 9 DC NU4:  (9 DC C3')-(9 DC C4')-(9 DC O4')-(9 DC C1')  -1.9  34.0
 &rst     iat =   317,   300,   302,   303,
   r1 =  -2.9, r2 =  -1.9, r3 =  34.0, r4 =  35.0,
 &end

# 12 DG NU0:  (12 DG C4')-(12 DG O4')-(12 DG C1')-(12 DG C2') -44.7 -14.7
 &rst     iat =   393,   395,   396,   415,
   r1 = -45.7, r2 = -44.7, r3 = -14.7, r4 = -13.7,
 &end

# 12 DG NU1:  (12 DG O4')-(12 DG C1')-(12 DG C2')-(12 DG C3')  18.1  48.1
 &rst     iat =   395,   396,   415,   413,
   r1 =  17.1, r2 =  18.1, r3 =  48.1, r4 =  49.1,
 &end

# 12 DG NU2:  (12 DG C1')-(12 DG C2')-(12 DG C3')-(12 DG C4') -37.2  -6.7
 &rst     iat =   396,   415,   413,   393,
   r1 = -38.2, r2 = -37.2, r3 =  -6.7, r4 =  -5.7,
 &end

# 12 DG NU3:  (12 DG C2')-(12 DG C3')-(12 DG C4')-(12 DG O4') -16.9  24.2
 &rst     iat =   415,   413,   393,   395,
   r1 = -17.9, r2 = -16.9, r3 =  24.2, r4 =  25.2,
 &end

# 12 DG NU4:  (12 DG C3')-(12 DG C4')-(12 DG O4')-(12 DG C1')  -1.9  34.0
 &rst     iat =   413,   393,   395,   396,
   r1 =  -2.9, r2 =  -1.9, r3 =  34.0, r4 =  35.0,
 &end

# 13 DA NU0:  (13 DA C4')-(13 DA O4')-(13 DA C1')-(13 DA C2') -43.9 -13.9
 &rst     iat =   426,   428,   429,   447,
   r1 = -44.9, r2 = -43.9, r3 = -13.9, r4 = -12.9,
 &end

# 13 DA NU1:  (13 DA O4')-(13 DA C1')-(13 DA C2')-(13 DA C3')  22.2  52.2
 &rst     iat =   428,   429,   447,   445,
   r1 =  21.2, r2 =  22.2, r3 =  52.2, r4 =  53.2,
 &end

# 13 DA NU2:  (13 DA C1')-(13 DA C2')-(13 DA C3')-(13 DA C4') -44.6 -14.6
 &rst     iat =   429,   447,   445,   426,
   r1 = -45.6, r2 = -44.6, r3 = -14.6, r4 = -13.6,
 &end

# 13 DA NU3:  (13 DA C2')-(13 DA C3')-(13 DA C4')-(13 DA O4')  -3.2  26.8
 &rst     iat =   447,   445,   426,   428,
   r1 =  -4.2, r2 =  -3.2, r3 =  26.8, r4 =  27.8,
 &end

# 13 DA NU4:  (13 DA C3')-(13 DA C4')-(13 DA O4')-(13 DA C1')  -4.4  25.6
 &rst     iat =   445,   426,   428,   429,
   r1 =  -5.4, r2 =  -4.4, r3 =  25.6, r4 =  26.6,
 &end

# 14 DA NU0:  (14 DA C4')-(14 DA O4')-(14 DA C1')-(14 DA C2') -43.9 -13.9
 &rst     iat =   458,   460,   461,   479,
   r1 = -44.9, r2 = -43.9, r3 = -13.9, r4 = -12.9,
 &end

# 14 DA NU1:  (14 DA O4')-(14 DA C1')-(14 DA C2')-(14 DA C3')  22.2  52.2
 &rst     iat =   460,   461,   479,   477,
   r1 =  21.2, r2 =  22.2, r3 =  52.2, r4 =  53.2,
 &end

# 14 DA NU2:  (14 DA C1')-(14 DA C2')-(14 DA C3')-(14 DA C4') -44.6 -14.6
 &rst     iat =   461,   479,   477,   458,
   r1 = -45.6, r2 = -44.6, r3 = -14.6, r4 = -13.6,
 &end

# 14 DA NU3:  (14 DA C2')-(14 DA C3')-(14 DA C4')-(14 DA O4')  -3.2  26.8
 &rst     iat =   479,   477,   458,   460,
   r1 =  -4.2, r2 =  -3.2, r3 =  26.8, r4 =  27.8,
 &end

# 14 DA NU4:  (14 DA C3')-(14 DA C4')-(14 DA O4')-(14 DA C1')  -4.4  25.6
 &rst     iat =   477,   458,   460,   461,
   r1 =  -5.4, r2 =  -4.4, r3 =  25.6, r4 =  26.6,
 &end

# 15 DT NU0:  (15 DT C4')-(15 DT O4')-(15 DT C1')-(15 DT C2') -52.1 -22.1
 &rst     iat =   490,   492,   493,   511,
   r1 = -53.1, r2 = -52.1, r3 = -22.1, r4 = -21.1,
 &end

# 15 DT NU1:  (15 DT O4')-(15 DT C1')-(15 DT C2')-(15 DT C3')  15.0  45.0
 &rst     iat =   492,   493,   511,   509,
   r1 =  14.0, r2 =  15.0, r3 =  45.0, r4 =  46.0,
 &end

# 15 DT NU2:  (15 DT C1')-(15 DT C2')-(15 DT C3')-(15 DT C4') -27.4   2.6
 &rst     iat =   493,   511,   509,   490,
   r1 = -28.4, r2 = -27.4, r3 =   2.6, r4 =   3.6,
 &end

# 15 DT NU3:  (15 DT C2')-(15 DT C3')-(15 DT C4')-(15 DT O4') -25.0   5.0
 &rst     iat =   511,   509,   490,   492,
   r1 = -26.0, r2 = -25.0, r3 =   5.0, r4 =   6.0,
 &end

# 15 DT NU4:  (15 DT C3')-(15 DT C4')-(15 DT O4')-(15 DT C1')  13.5  43.5
 &rst     iat =   509,   490,   492,   493,
   r1 =  12.5, r2 =  13.5, r3 =  43.5, r4 =  44.5,
 &end

# 17 DT NU0:  (17 DT C4')-(17 DT O4')-(17 DT C1')-(17 DT C2') -52.1 -22.1
 &rst     iat =   552,   554,   555,   573,
   r1 = -53.1, r2 = -52.1, r3 = -22.1, r4 = -21.1,
 &end

# 17 DT NU1:  (17 DT O4')-(17 DT C1')-(17 DT C2')-(17 DT C3')  15.0  45.0
 &rst     iat =   554,   555,   573,   571,
   r1 =  14.0, r2 =  15.0, r3 =  45.0, r4 =  46.0,
 &end

# 17 DT NU2:  (17 DT C1')-(17 DT C2')-(17 DT C3')-(17 DT C4') -27.4   2.6
 &rst     iat =   555,   573,   571,   552,
   r1 = -28.4, r2 = -27.4, r3 =   2.6, r4 =   3.6,
 &end

# 17 DT NU3:  (17 DT C2')-(17 DT C3')-(17 DT C4')-(17 DT O4') -25.0   5.0
 &rst     iat =   573,   571,   552,   554,
   r1 = -26.0, r2 = -25.0, r3 =   5.0, r4 =   6.0,
 &end

# 17 DT NU4:  (17 DT C3')-(17 DT C4')-(17 DT O4')-(17 DT C1')  13.5  43.5
 &rst     iat =   571,   552,   554,   555,
   r1 =  12.5, r2 =  13.5, r3 =  43.5, r4 =  44.5,
 &end

# 18 DT NU0:  (18 DT C4')-(18 DT O4')-(18 DT C1')-(18 DT C2') -52.1 -22.1
 &rst     iat =   584,   586,   587,   605,
   r1 = -53.1, r2 = -52.1, r3 = -22.1, r4 = -21.1,
 &end

# 18 DT NU1:  (18 DT O4')-(18 DT C1')-(18 DT C2')-(18 DT C3')  15.0  45.0
 &rst     iat =   586,   587,   605,   603,
   r1 =  14.0, r2 =  15.0, r3 =  45.0, r4 =  46.0,
 &end

# 18 DT NU2:  (18 DT C1')-(18 DT C2')-(18 DT C3')-(18 DT C4') -27.4   2.6
 &rst     iat =   587,   605,   603,   584,
   r1 = -28.4, r2 = -27.4, r3 =   2.6, r4 =   3.6,
 &end

# 18 DT NU3:  (18 DT C2')-(18 DT C3')-(18 DT C4')-(18 DT O4') -25.0   5.0
 &rst     iat =   605,   603,   584,   586,
   r1 = -26.0, r2 = -25.0, r3 =   5.0, r4 =   6.0,
 &end

# 18 DT NU4:  (18 DT C3')-(18 DT C4')-(18 DT O4')-(18 DT C1')  13.5  43.5
 &rst     iat =   603,   584,   586,   587,
   r1 =  12.5, r2 =  13.5, r3 =  43.5, r4 =  44.5,
 &end

# 19 DA NU0:  (19 DA C4')-(19 DA O4')-(19 DA C1')-(19 DA C2') -43.9 -13.9
 &rst     iat =   616,   618,   619,   637,
   r1 = -44.9, r2 = -43.9, r3 = -13.9, r4 = -12.9,
 &end

# 19 DA NU1:  (19 DA O4')-(19 DA C1')-(19 DA C2')-(19 DA C3')  22.2  52.2
 &rst     iat =   618,   619,   637,   635,
   r1 =  21.2, r2 =  22.2, r3 =  52.2, r4 =  53.2,
 &end

# 19 DA NU2:  (19 DA C1')-(19 DA C2')-(19 DA C3')-(19 DA C4') -44.6 -14.6
 &rst     iat =   619,   637,   635,   616,
   r1 = -45.6, r2 = -44.6, r3 = -14.6, r4 = -13.6,
 &end

# 19 DA NU3:  (19 DA C2')-(19 DA C3')-(19 DA C4')-(19 DA O4')  -3.2  26.8
 &rst     iat =   637,   635,   616,   618,
   r1 =  -4.2, r2 =  -3.2, r3 =  26.8, r4 =  27.8,
 &end

# 19 DA NU4:  (19 DA C3')-(19 DA C4')-(19 DA O4')-(19 DA C1')  -4.4  25.6
 &rst     iat =   635,   616,   618,   619,
   r1 =  -5.4, r2 =  -4.4, r3 =  25.6, r4 =  26.6,
 &end


  Entry H atom name         Submitted Coord H atom name
    1    H5'   DC   1           H5'       DC   1  14.168  16.660  -1.874
    2   H5''   DC   1          H5''       DC   1  14.996  15.605  -0.708
    3    H4'   DC   1           H4'       DC   1  13.122  16.671   0.352
    4    H3'   DC   1           H3'       DC   1  13.521  13.877   0.370
    5    H2'   DC   1           H2'       DC   1  11.782  13.362  -1.062
    6   H2''   DC   1          H2''       DC   1  10.829  13.371   0.430
    7    H1'   DC   1           H1'       DC   1  10.173  15.646   0.172
    8    H41   DC   1           H41       DC   1   7.423  14.345  -5.711
    9    H42   DC   1           H42       DC   1   6.247  15.225  -4.749
   10    H5    DC   1           H5        DC   1   9.692  13.864  -4.958
   11    H6    DC   1           H6        DC   1  11.231  14.206  -3.113
   12   HO5'   DC   1          H5T        DC   1  14.698  14.651  -2.843
   13    H5'   DT   2           H5'       DT   2   9.954  15.570   2.698
   14   H5''   DT   2          H5''       DT   2  10.159  15.097   4.391
   15    H4'   DT   2           H4'       DT   2   7.839  15.327   4.035
   16    H3'   DT   2           H3'       DT   2   8.785  12.825   4.923
   17    H2'   DT   2           H2'       DT   2   8.483  11.768   2.811
   18   H2''   DT   2          H2''       DT   2   6.887  11.443   3.539
   19    H1'   DT   2           H1'       DT   2   5.934  13.435   2.660
   20    H3    DT   2           H3        DT   2   4.662  12.871  -1.623
   21    H71   DT   2           H71       DT   2   9.204  11.884  -2.761
   22    H72   DT   2           H72       DT   2   8.813  10.265  -2.141
   23    H73   DT   2           H73       DT   2   9.871  11.350  -1.207
   24    H6    DT   2           H6        DT   2   8.769  11.963   0.706
   25    H5'   DA   3           H5'       DA   3   4.182  14.189   5.195
   26   H5''   DA   3          H5''       DA   3   3.639  13.859   6.814
   27    H4'   DA   3           H4'       DA   3   1.771  13.839   5.278
   28    H3'   DA   3           H3'       DA   3   2.139  11.793   7.070
   29    H2'   DA   3           H2'       DA   3   3.197  10.300   5.567
   30   H2''   DA   3          H2''       DA   3   1.512   9.750   5.324
   31    H1'   DA   3           H1'       DA   3   1.233  11.118   3.417
   32    H8    DA   3           H8        DA   3   4.834   9.903   4.198
   33    H61   DA   3           2H6       DA   3   6.130   8.933  -0.427
   34    H62   DA   3           1H6       DA   3   5.279   9.208  -1.972
   35    H2    DA   3           H2        DA   3   1.436  11.040  -1.129
   36    H5'   DA   4           H5'       DA   4  -1.577  11.102   3.983
   37   H5''   DA   4          H5''       DA   4  -2.914  10.867   5.095
   38    H4'   DA   4           H4'       DA   4  -3.456   9.580   3.218
   39    H3'   DA   4           H3'       DA   4  -3.302   8.230   5.616
   40    H2'   DA   4           H2'       DA   4  -1.116   7.410   5.326
   41   H2''   DA   4          H2''       DA   4  -2.082   6.075   4.649
   42    H1'   DA   4           H1'       DA   4  -1.812   6.765   2.438
   43    H8    DA   4           H8        DA   4   0.970   7.327   4.887
   44    H61   DA   4           2H6       DA   4   4.720   6.441   1.662
   45    H62   DA   4           1H6       DA   4   4.671   6.203  -0.083
   46    H2    DA   4           H2        DA   4   0.584   6.759  -1.478
   47    H31  FAG   5           H3A      FAG   5   1.425   3.972  -3.316
   48    H32  FAG   5           H3B      FAG   5   0.843   2.317  -3.235
   49   H2A1  FAG   5          H2A       FAG   5   3.310   3.262  -4.315
   50   H2A2  FAG   5          H2B       FAG   5   2.803   1.560  -4.131
   51   H5'1  FAG   5          H5'       FAG   5  -7.352   5.354   5.316
   52   H5'2  FAG   5          H5''      FAG   5  -5.612   5.152   5.280
   53    H4'  FAG   5           H4'      FAG   5  -7.468   3.941   3.209
   54    H1'  FAG   5           H1'      FAG   5  -5.465   1.697   2.808
   55    HN9  FAG   5           HN9      FAG   5  -2.954   2.152   4.151
   56   HN21  FAG   5          1HN2      FAG   5  -4.063   1.427  -1.146
   57   HN22  FAG   5          2HN2      FAG   5  -2.555   0.791  -1.797
   58    H1   FAG   5           1H       FAG   5  -0.897   0.243  -0.506
   59    H8   FAG   5           H8       FAG   5  -1.936  -0.445   5.375
   60   H2'1  FAG   5          H2'       FAG   5  -4.697   2.603   5.562
   61   H2'2  FAG   5          H2''      FAG   5  -5.412   1.037   5.106
   62    H3'  FAG   5           H3'      FAG   5  -7.067   3.112   5.866
   63    H8A  FAG   5           H8A      FAG   5  -0.221   1.223   5.646
   64    H9   FAG   5           H9       FAG   5   1.377   1.242   3.426
   65    HO9  FAG   5           HO9      FAG   5   2.160   1.208   5.596
   66    H9A  FAG   5           H9A      FAG   5   1.898   3.941   3.849
   67    H6A  FAG   5           H6A      FAG   5  -0.106   4.959   4.522
   68    H5B  FAG   5           H5       FAG   5  -2.097   4.200   0.596
   69    HM1  FAG   5           HA1      FAG   5  -0.462   5.398  -2.730
   70    HM2  FAG   5           HA2      FAG   5  -1.922   5.554  -1.747
   71    HM3  FAG   5           HA3      FAG   5  -1.952   4.592  -3.261
   72    H5'   DA   6           H5'       DA   6 -10.251  -0.036   2.248
   73   H5''   DA   6          H5''       DA   6  -8.542  -0.240   2.599
   74    H4'   DA   6           H4'       DA   6  -9.345   1.342   0.138
   75    H3'   DA   6           H3'       DA   6 -10.328  -1.222   0.430
   76    H2'   DA   6           H2'       DA   6  -8.266  -2.316   0.885
   77   H2''   DA   6          H2''       DA   6  -8.267  -2.447  -0.892
   78    H1'   DA   6           H1'       DA   6  -6.869  -0.643  -1.198
   79    H8    DA   6           H8        DA   6  -6.346  -1.036   2.624
   80    H61   DA   6           2H6       DA   6  -1.697  -2.635   2.301
   81    H62   DA   6           1H6       DA   6  -0.753  -3.184   0.924
   82    H2    DA   6           H2        DA   6  -3.082  -2.664  -2.681
   83    H5'   DT   7           H5'       DT   7  -8.410  -1.576  -3.735
   84   H5''   DT   7          H5''       DT   7  -9.612  -2.250  -4.827
   85    H4'   DT   7           H4'       DT   7  -7.612  -3.532  -5.110
   86    H3'   DT   7           H3'       DT   7  -9.951  -4.884  -4.112
   87    H2'   DT   7           H2'       DT   7  -8.857  -5.654  -2.173
   88   H2''   DT   7          H2''       DT   7  -8.161  -6.836  -3.313
   89    H1'   DT   7           H1'       DT   7  -6.222  -5.486  -3.698
   90    H3    DT   7           H3        DT   7  -3.290  -5.939  -0.305
   91    H71   DT   7           H71       DT   7  -8.126  -4.625   1.871
   92    H72   DT   7           H72       DT   7  -6.654  -3.988   2.634
   93    H73   DT   7           H73       DT   7  -7.003  -5.708   2.722
   94    H6    DT   7           H6        DT   7  -7.969  -4.772  -0.440
   95    H5'   DT   8           H5'       DT   8  -6.264  -6.249  -6.301
   96   H5''   DT   8          H5''       DT   8  -6.657  -7.333  -7.619
   97    H4'   DT   8           H4'       DT   8  -4.408  -7.716  -6.892
   98    H3'   DT   8           H3'       DT   8  -6.275  -9.788  -7.098
   99    H2'   DT   8           H2'       DT   8  -6.466 -10.143  -4.693
  100   H2''   DT   8          H2''       DT   8  -5.047 -11.176  -5.064
  101    H1'   DT   8           H1'       DT   8  -3.510  -9.478  -4.584
  102    H3    DT   8           H3        DT   8  -3.076  -9.404  -0.090
  103    H71   DT   8           H71       DT   8  -7.924  -9.425   0.112
  104    H72   DT   8           H72       DT   8  -8.309  -8.318  -1.210
  105    H73   DT   8           H73       DT   8  -7.546  -7.695   0.262
  106    H6    DT   8           H6        DT   8  -6.820  -8.671  -3.019
  107    H5'   DC   9           H5'       DC   9  -1.583 -10.747  -6.467
  108   H5''   DC   9          H5''       DC   9  -1.235 -11.946  -7.713
  109    H4'   DC   9           H4'       DC   9   0.269 -12.300  -5.851
  110    H3'   DC   9           H3'       DC   9  -1.396 -14.329  -6.854
  111    H2'   DC   9           H2'       DC   9  -2.851 -14.299  -5.008
  112   H2''   DC   9          H2''       DC   9  -1.683 -15.476  -4.388
  113    H1'   DC   9           H1'       DC   9  -0.444 -13.840  -3.201
  114    H41   DC   9           H41       DC   9  -5.880 -12.063   0.088
  115    H42   DC   9           H42       DC   9  -4.628 -12.504   1.282
  116    H5    DC   9           H5        DC   9  -5.511 -12.082  -2.257
  117    H6    DC   9           H6        DC   9  -3.873 -12.655  -3.996
  118    H5'   DA  10           H5'       DA  10   1.767 -15.643  -3.573
  119   H5''   DA  10          H5''       DA  10   2.535 -17.152  -4.051
  120    H4'   DA  10           H4'       DA  10   2.233 -17.151  -1.731
  121    H3'   DA  10           H3'       DA  10   0.987 -19.232  -3.359
  122   HO3'   DA  10          H3T        DA  10   2.676 -19.684  -1.868
  123    H2'   DA  10           H2'       DA  10  -1.158 -18.774  -2.674
  124   H2''   DA  10          H2''       DA  10  -0.665 -19.741  -1.263
  125    H1'   DA  10           H1'       DA  10   0.095 -17.789  -0.030
  126    H8    DA  10           H8        DA  10  -2.842 -16.965  -2.468
  127    H61   DA  10           2H6       DA  10  -5.988 -15.402   1.145
  128    H62   DA  10           1H6       DA  10  -5.670 -15.267   2.878
  129    H2    DA  10           H2        DA  10  -1.785 -16.778   3.885
  130    H5'   DT  11           H5'       DT  11  -5.736 -16.779  12.956
  131   H5''   DT  11          H5''       DT  11  -6.258 -16.070  11.434
  132    H4'   DT  11           H4'       DT  11  -4.278 -18.412  11.610
  133    H3'   DT  11           H3'       DT  11  -3.649 -15.896  12.430
  134    H2'   DT  11           H2'       DT  11  -4.295 -14.778  10.406
  135   H2''   DT  11          H2''       DT  11  -2.584 -15.083  10.040
  136    H1'   DT  11           H1'       DT  11  -3.031 -17.082   8.905
  137    H3    DT  11           H3        DT  11  -4.298 -15.863   4.720
  138    H71   DT  11           H71       DT  11  -7.577 -12.951   6.706
  139    H72   DT  11           H72       DT  11  -7.971 -13.808   8.215
  140    H73   DT  11           H73       DT  11  -8.522 -14.410   6.643
  141    H6    DT  11           H6        DT  11  -6.196 -15.083   9.079
  142   HO5'   DT  11          H5T        DT  11  -7.103 -18.217  10.908
  143    H5'   DG  12           H5'       DG  12   1.299 -14.947  11.016
  144   H5''   DG  12          H5''       DG  12  -0.154 -14.220  10.301
  145    H4'   DG  12           H4'       DG  12   1.822 -16.049   8.872
  146    H3'   DG  12           H3'       DG  12   2.279 -13.409   9.563
  147    H2'   DG  12           H2'       DG  12   0.212 -12.705   8.578
  148   H2''   DG  12          H2''       DG  12   1.381 -12.219   7.297
  149    H1'   DG  12           H1'       DG  12   1.104 -14.411   6.226
  150    H8    DG  12           H8        DG  12  -2.168 -13.235   7.965
  151    H1    DG  12           1H        DG  12  -2.156 -13.114   1.524
  152    H21   DG  12           H21       DG  12   1.137 -14.205   1.936
  153    H22   DG  12           H22       DG  12  -0.167 -13.825   0.830
  154    H5'   DA  13           H5'       DA  13   3.183 -14.509   4.936
  155   H5''   DA  13          H5''       DA  13   4.941 -14.405   5.054
  156    H4'   DA  13           H4'       DA  13   4.468 -14.201   2.832
  157    H3'   DA  13           H3'       DA  13   5.918 -12.174   3.944
  158    H2'   DA  13           H2'       DA  13   4.072 -10.749   4.274
  159   H2''   DA  13          H2''       DA  13   4.601 -10.161   2.656
  160    H1'   DA  13           H1'       DA  13   3.045 -11.393   1.514
  161    H8    DA  13           H8        DA  13   1.986 -10.567   5.127
  162    H61   DA  13           2H6       DA  13  -2.723  -9.203   3.914
  163    H62   DA  13           1H6       DA  13  -3.523  -9.295   2.344
  164    H2    DA  13           H2        DA  13  -0.782 -10.622  -0.678
  165    H5'   DA  14           H5'       DA  14   4.715 -12.063  -0.594
  166   H5''   DA  14          H5''       DA  14   6.166 -11.669  -1.541
  167    H4'   DA  14           H4'       DA  14   4.178 -10.887  -2.666
  168    H3'   DA  14           H3'       DA  14   6.286  -9.040  -2.018
  169    H2'   DA  14           H2'       DA  14   5.033  -8.062  -0.288
  170   H2''   DA  14          H2''       DA  14   4.606  -6.986  -1.692
  171    H1'   DA  14           H1'       DA  14   2.660  -8.341  -2.230
  172    H8    DA  14           H8        DA  14   3.530  -8.209   1.552
  173    H61   DA  14           2H6       DA  14  -0.908  -6.289   2.956
  174    H62   DA  14           1H6       DA  14  -2.305  -5.907   1.951
  175    H2    DA  14           H2        DA  14  -1.536  -6.923  -2.185
  176    H5'   DT  15           H5'       DT  15   5.717  -6.685  -6.888
  177   H5''   DT  15          H5''       DT  15   5.464  -6.536  -5.135
  178    H4'   DT  15           H4'       DT  15   3.127  -6.777  -7.075
  179    H3'   DT  15           H3'       DT  15   4.897  -4.557  -6.884
  180    H2'   DT  15           H2'       DT  15   4.204  -3.875  -4.807
  181   H2''   DT  15          H2''       DT  15   2.874  -3.072  -5.713
  182    H1'   DT  15           H1'       DT  15   1.452  -4.919  -5.554
  183    H3    DT  15           H3        DT  15  -0.603  -3.615  -1.710
  184    H71   DT  15           H71       DT  15   3.803  -3.587   0.304
  185    H72   DT  15           H72       DT  15   4.566  -4.953  -0.506
  186    H73   DT  15           H73       DT  15   3.240  -5.197   0.682
  187    H6    DT  15           H6        DT  15   3.872  -5.120  -2.722
  188    H5'   DC  16           H5'       DC  16   0.394  -3.415  -7.972
  189   H5''   DC  16          H5''       DC  16   0.479  -2.370  -9.421
  190    H4'   DC  16           H4'       DC  16  -1.305  -1.684  -8.045
  191    H3'   DC  16           H3'       DC  16   0.780   0.142  -8.705
  192    H2'   DC  16           H2'       DC  16   1.547   0.451  -6.562
  193   H2''   DC  16          H2''       DC  16   0.219   1.618  -6.437
  194    H1'   DC  16           H1'       DC  16  -1.297  -0.003  -5.543
  195    H41   DC  16           H41       DC  16   3.009  -1.145  -0.583
  196    H42   DC  16           H42       DC  16   1.475  -0.586   0.110
  197    H5    DC  16           H5        DC  16   3.323  -1.306  -2.970
  198    H6    DC  16           H6        DC  16   2.255  -1.078  -5.131
  199    H5'   DT  17           H5'       DT  17   0.599   4.084  -9.978
  200   H5''   DT  17          H5''       DT  17   1.551   3.170  -8.790
  201    H4'   DT  17           H4'       DT  17   0.031   5.701  -8.088
  202    H3'   DT  17           H3'       DT  17   2.349   5.555  -9.866
  203    H2'   DT  17           H2'       DT  17   3.799   5.477  -8.122
  204   H2''   DT  17          H2''       DT  17   3.519   7.256  -8.091
  205    H1'   DT  17           H1'       DT  17   1.689   6.992  -6.521
  206    H3    DT  17           H3        DT  17   3.033   6.555  -2.208
  207    H71   DT  17           H71       DT  17   7.338   5.414  -3.962
  208    H72   DT  17           H72       DT  17   6.676   3.782  -3.867
  209    H73   DT  17           H73       DT  17   6.952   4.540  -5.435
  210    H6    DT  17           H6        DT  17   4.848   4.985  -6.398
  211    H5'   DT  18           H5'       DT  18  -1.505   7.968  -8.715
  212   H5''   DT  18          H5''       DT  18  -2.298   9.248  -9.603
  213    H4'   DT  18           H4'       DT  18  -2.041  10.126  -7.470
  214    H3'   DT  18           H3'       DT  18  -0.696  11.481  -9.526
  215    H2'   DT  18           H2'       DT  18   1.433  10.794  -8.749
  216   H2''   DT  18          H2''       DT  18   1.241  12.357  -7.843
  217    H1'   DT  18           H1'       DT  18   0.165  11.191  -5.967
  218    H3    DT  18           H3        DT  18   3.195   9.991  -2.978
  219    H71   DT  18           H71       DT  18   5.610   7.808  -6.604
  220    H72   DT  18           H72       DT  18   6.291   9.429  -6.539
  221    H73   DT  18           H73       DT  18   5.251   8.959  -7.932
  222    H6    DT  18           H6        DT  18   3.063   9.742  -7.797
  223    H5'   DA  19           H5'       DA  19  -3.549  12.633  -5.848
  224   H5''   DA  19          H5''       DA  19  -4.758  13.791  -6.411
  225    H4'   DA  19           H4'       DA  19  -4.414  14.133  -4.066
  226    H3'   DA  19           H3'       DA  19  -4.132  16.309  -5.728
  227    H2'   DA  19           H2'       DA  19  -1.821  16.309  -5.897
  228   H2''   DA  19          H2''       DA  19  -1.906  17.298  -4.442
  229    H1'   DA  19           H1'       DA  19  -1.374  15.547  -2.997
  230    H8    DA  19           H8        DA  19  -0.336  14.876  -6.704
  231    H61   DA  19           2H6       DA  19   4.193  13.182  -5.600
  232    H62   DA  19           1H6       DA  19   4.928  12.755  -4.057
  233    H2    DA  19           H2        DA  19   2.180  13.824  -0.856
  234    H5'   DG  20           H5'       DG  20  -3.329  16.586  -1.016
  235   H5''   DG  20          H5''       DG  20  -4.036  18.103  -0.390
  236    H4'   DG  20           H4'       DG  20  -2.088  17.580   0.856
  237    H3'   DG  20           H3'       DG  20  -2.445  20.084  -0.405
  238   HO3'   DG  20          H3T        DG  20  -1.122  20.804   1.334
  239    H2'   DG  20           H2'       DG  20  -0.776  19.804  -1.990
  240   H2''   DG  20          H2''       DG  20   0.262  20.449  -0.679
  241    H1'   DG  20           H1'       DG  20   0.799  18.229   0.077
  242    H8    DG  20           H8        DG  20  -0.014  18.568  -3.703
  243    H1    DG  20           1H        DG  20   5.817  16.126  -2.382
  244    H21   DG  20           H21       DG  20   4.818  16.541   0.914
  245    H22   DG  20           H22       DG  20   6.098  16.077  -0.200