*HEADER    DNA                                     29-AUG-01   1JVE              
*TITLE     NMR STRUCTURE OF AN AT-RICH DNA WITH THE GAA-HAIRPIN LOOP             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: AT-RICH DNA WITH THE GAA-HAIRPIN LOOP;                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: DESIGNED AT-RICH SEQUENCE                             
*KEYWDS    DEOXYRIBONUCLEIC ACID, DNA OLIGONUCLEOTIDE, STEM-AND-LOOP,            
*KEYWDS   2 AT-RICH, GAA HAIRPIN LOOP, PRIBNOW BOX                               
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    N.B.ULYANOV, W.R.BAUER, T.L.JAMES                                     
*REVDAT   1   22-MAY-02 1JVE    0                                                
# May 25, 2001
#
# N.B. Ulyanov, W.R. Bauer, T.L. James
#
# Experimental data for the DNA 27mer d(CCTAATTATAACGAAGTTATAATTAGG)
#
# Content of this file:
#
# (1)  Distance restraints for nonexchangeable protons
# (2)  Distance restraints for exchangeable protons
# (3)  Integrated intensities of cross-peaks in the 150-ms
#  D2O NOESY acquired with a weak presat of HDO
# (4)  Integrated intensities of cross-peaks in the 150-ms
#  D2O NOESY acquired without presat
# (5)  Integrated intensities of cross-peaks in the 75-ms
#  D2O NOESY acquired without presat
#
# Distances are in angstroms, force constants are in kcal/mol per
# angstrom squared
#
# Format is a modified MARDIGRAS format: first four columns contain
# atom names and residue numbers; columns 5 and 6 contain lower and
# upper distance bounds; columns 7 and 8 contain lower and upper
# force constants
#
# M7 stands for pseudoatom involving a methyl group (protons 1H5M, 2H5M, 3H5M)
#
# (1) Distance restraints involving nonexchangeable protons were calculated with
# the MARDIGRAS program using integrated intensities in three D2O NOESY datasets.
# The RANDMARDI procedure was run 50 times with correlation times of 8 and 9 ns
# for each of the three data sets. For each proton pair, all distance estimates
# were pooled together, and 10% of the lowest and 10% of the highest estimates
# were discarded. Min-max of the remaining estimates were accepted as the lower
# and upper bounds.
# Fixed distances and intra-sugar distances with low variation (such as H1*-H2*)
# were excluded from the list of restraints.
#
# (2) Distance restraints involving exchangeable protons were qualitatively
# categorized based on water NOESY dataset intensities.
#
# (1) restraints involving nonexchangeable protons
#
ATOM- i ATOM- j   r_low   r_up     k_low     k_up
H4'   1 H1'   1   2.510   2.990    10.00    10.00
H6    1 1H2'  1   1.950   2.240    10.00    10.00
H6    1 H3'   1   2.940   3.710    10.00    10.00
H6    1 H4'   1   3.230   5.060    10.00    10.00
H4'   2 H1'   2   2.240   2.680    10.00    10.00
H5    2 1H2'  1   2.530   3.420    10.00    10.00
H5    2 H1'   1   3.560   5.780    10.00    10.00
H5    2 H3'   1   2.810   3.670    10.00    10.00
H5    2 H5    1   3.210   3.490    10.00    10.00
H5    2 H6    1   3.140   3.680    10.00    10.00
H5    2 1H2'  2   3.210   6.310    10.00    10.00
H6    2 2H2'  1   2.400   2.920    10.00    10.00
H6    2 1H2'  1   2.390   2.920    10.00    10.00
H6    2 H1'   1   3.080   4.860    10.00    10.00
H6    2 H3'   1   2.840   6.300    10.00    10.00
H6    2 2H2'  2   2.180   2.620    10.00    10.00
H6    2 1H2'  2   1.720   2.310    10.00    10.00
H6    2 H1'   2   2.400   4.260    10.00    10.00
H6    2 H3'   2   2.870   6.210    10.00    10.00
H6    2 H4'   2   2.840   4.680    10.00    10.00
H6    3 2H2'  2   2.020   3.470    10.00    10.00
H6    3 H1'   2   2.310   5.280    10.00    10.00
H6    3 H5    2   3.190   6.400    10.00    10.00
H6    3 2H2'  3   2.120   5.350    10.00    10.00
H6    3 H1'   3   3.100   5.200    10.00    10.00
H6    3 H3'   3   2.690   4.500    10.00    10.00
M7    3 2H2'  2   3.240   5.830    10.00    10.00
M7    3 H1'   2   3.800   6.880    10.00    10.00
M7    3 H3'   2   4.410   7.010    10.00    10.00
M7    3 H5    2   3.560   3.860    10.00    10.00
M7    3 H6    2   3.360   4.340    10.00    10.00
M7    3 H1'   3   3.700   6.000    10.00    10.00
H8    4 2H2'  3   2.680   3.160    10.00    10.00
H8    4 1H2'  3   2.840   4.350    10.00    10.00
H8    4 H1'   3   3.040   3.590    10.00    10.00
H8    4 H6    3   3.260   5.100    10.00    10.00
H8    4 2H2'  4   2.430   5.510    10.00    10.00
H8    4 1H2'  4   1.930   2.250    10.00    10.00
H8    4 H1'   4   2.970   5.620    10.00    10.00
H8    4 H3'   4   3.400   6.490    10.00    10.00
1H5'  5 H1'   4   2.440   2.730    10.00    10.00
H2    5 H2    4   3.060   3.380    10.00    10.00
H8    5 2H2'  4   2.220   3.800    10.00    10.00
H8    5 1H2'  4   2.250   3.100    10.00    10.00
H8    5 H1'   4   2.620   2.980    10.00    10.00
H8    5 H3'   4   3.150   6.720    10.00    10.00
H8    5 2H2'  5   2.170   4.270    10.00    10.00
H8    5 1H2'  5   1.940   2.420    10.00    10.00
H8    5 H1'   5   3.320   5.800    10.00    10.00
H8    5 H3'   5   3.480   6.220    10.00    10.00
H1'   6 H2    5   3.180   3.550    10.00    10.00
H4'   6 H1'   6   2.040   2.530    10.00    10.00
H6    6 H1'   5   3.060   3.630    10.00    10.00
H6    6 H1'   6   2.740   3.600    10.00    10.00
H6    6 H3'   6   2.760   3.100    10.00    10.00
M7    6 2H2'  5   3.110   5.340    10.00    10.00
M7    6 1H2'  5   3.080   5.250    10.00    10.00
M7    6 H1'   5   4.070   5.720    10.00    10.00
M7    6 H3'   5   3.960   4.430    10.00    10.00
M7    6 H8    5   3.120   3.470    10.00    10.00
H4'   7 H1'   7   2.480   2.860    10.00    10.00
H6    7 2H2'  6   2.070   3.980    10.00    10.00
H6    7 1H2'  6   2.720   5.780    10.00    10.00
H6    7 H1'   6   3.090   6.110    10.00    10.00
H6    7 H3'   6   3.190   5.110    10.00    10.00
H6    7 2H2'  7   2.650   4.820    10.00    10.00
H6    7 1H2'  7   2.160   2.610    10.00    10.00
H6    7 H1'   7   3.020   4.680    10.00    10.00
M7    7 2H2'  6   3.460   6.300    10.00    10.00
M7    7 1H2'  6   2.890   3.280    10.00    10.00
M7    7 H1'   6   4.020   6.580    10.00    10.00
M7    7 H3'   6   4.210   6.860    10.00    10.00
M7    7 H6    6   3.290   3.490    10.00    10.00
M7    7 M7    6   3.970   4.470    10.00    10.00
H4'   8 H1'   8   2.890   3.460    10.00    10.00
H2    8 H1'   8   3.550   4.500    10.00    10.00
H8    8 H1'   7   3.100   5.930    10.00    10.00
H8    8 H6    7   2.930   4.980    10.00    10.00
H8    8 2H2'  8   2.460   3.170    10.00    10.00
H8    8 H1'   8   3.470   6.160    10.00    10.00
H8    8 H3'   8   3.430   5.530    10.00    10.00
H1'   9 H2    8   3.410   3.980    10.00    10.00
H4'   9 H1'   9   2.500   2.810    10.00    10.00
H6    9 H1'   8   3.470   5.010    10.00    10.00
H6    9 H8    8   3.540   6.540    10.00    10.00
H6    9 2H2'  9   2.850   4.870    10.00    10.00
H6    9 1H2'  9   2.050   2.480    10.00    10.00
H6    9 H1'   9   3.060   3.840    10.00    10.00
M7    9 2H2'  8   3.430   6.470    10.00    10.00
M7    9 1H2'  8   2.990   4.050    10.00    10.00
M7    9 H1'   8   4.260   5.760    10.00    10.00
M7    9 H3'   8   4.620   7.240    10.00    10.00
M7    9 H8    8   3.530   3.730    10.00    10.00
H8   10 2H2'  9   2.620   3.090    10.00    10.00
H8   10 H1'   9   3.160   4.020    10.00    10.00
H8   10 2H2' 10   2.790   5.780    10.00    10.00
H4'  11 H1'  11   2.700   2.940    10.00    10.00
H2   11 H2   10   3.390   3.660    10.00    10.00
H2   11 H1'  11   3.640   4.400    10.00    10.00
H8   11 2H2' 10   2.230   3.150    10.00    10.00
H8   11 1H2' 10   2.870   3.310    10.00    10.00
H8   11 H1'  10   3.150   4.340    10.00    10.00
H8   11 H3'  10   3.520   6.090    10.00    10.00
H8   11 H8   10   3.510   5.710    10.00    10.00
H8   11 1H2' 11   2.060   2.570    10.00    10.00
H8   11 H1'  11   3.070   5.630    10.00    10.00
H8   11 H3'  11   3.210   5.570    10.00    10.00
H4'  12 H1'  12   2.580   2.710    10.00    10.00
H5   12 1H2' 11   2.580   5.180    10.00    10.00
H5   12 H8   11   3.050   3.420    10.00    10.00
H6   12 2H2' 11   2.600   4.390    10.00    10.00
H6   12 1H2' 12   2.330   2.930    10.00    10.00
H8   13 H6   12   3.610   6.350    10.00    10.00
H8   13 2H2' 13   2.490   5.280    10.00    10.00
H8   13 1H2' 13   2.050   2.350    10.00    10.00
H8   13 H3'  13   3.120   5.990    10.00    10.00
2H5' 14 1H5' 14   1.700   2.030    10.00    10.00
H3'  14 1H5' 14   2.760   5.290    10.00    10.00
H3'  14 2H5' 14   2.370   2.650    10.00    10.00
H4'  14 1H5' 14   2.410   2.940    10.00    10.00
H4'  14 2H5' 14   2.350   2.590    10.00    10.00
H8   14 2H2' 13   2.150   2.540    10.00    10.00
H8   14 H1'  13   3.190   3.480    10.00    10.00
H8   14 2H2' 14   2.390   3.630    10.00    10.00
H8   14 1H2' 14   2.150   2.710    10.00    10.00
H8   14 H1'  14   2.970   3.570    10.00    10.00
H8   14 H3'  14   3.260   6.230    10.00    10.00
H2   15 H4'  13   3.730   4.720    10.00    10.00
H2   15 2H5' 14   3.640   6.330    10.00    10.00
H2   15 H4'  14   3.570   4.540    10.00    10.00
H1'  16 H2   15   3.600   5.420    10.00    10.00
H8   16 H3'  15   3.990   5.130    10.00    10.00
H8   16 H1'  16   3.470   5.960    10.00    10.00
H8   16 H3'  16   3.090   3.760    10.00    10.00
H6   17 H1'  16   2.730   3.170    10.00    10.00
H6   17 H8   16   3.040   5.120    10.00    10.00
H6   17 1H2' 17   1.920   2.170    10.00    10.00
H6   17 H1'  17   3.300   5.730    10.00    10.00
M7   17 H1'  16   4.620   7.540    10.00    10.00
M7   17 H8   16   4.080   6.880    10.00    10.00
H6   18 2H2' 17   2.380   2.670    10.00    10.00
H6   18 H1'  17   3.030   3.550    10.00    10.00
H6   18 2H2' 18   2.640   4.670    10.00    10.00
H6   18 H1'  18   3.180   4.040    10.00    10.00
M7   18 2H2' 17   3.200   6.560    10.00    10.00
M7   18 1H2' 17   3.020   3.180    10.00    10.00
M7   18 H1'  17   4.380   7.660    10.00    10.00
M7   18 H6   17   3.640   4.170    10.00    10.00
M7   18 M7   17   4.020   4.550    10.00    10.00
H4'  19 H1'  19   2.500   2.650    10.00    10.00
H2   19 H2   10   3.050   3.260    10.00    10.00
H8   19 2H2' 18   2.460   3.110    10.00    10.00
H8   19 1H2' 18   2.790   5.840    10.00    10.00
H8   19 H1'  18   3.110   3.680    10.00    10.00
H8   19 2H2' 19   2.630   5.860    10.00    10.00
H8   19 1H2' 19   2.000   2.330    10.00    10.00
H8   19 H1'  19   2.930   4.780    10.00    10.00
H8   19 H3'  19   3.420   5.770    10.00    10.00
H1'  20 H2   19   3.610   4.570    10.00    10.00
H6   20 H1'  19   3.180   4.120    10.00    10.00
H6   20 H8   19   3.260   5.930    10.00    10.00
H6   20 2H2' 20   2.180   3.640    10.00    10.00
H6   20 1H2' 20   1.840   2.090    10.00    10.00
H6   20 H1'  20   3.060   5.580    10.00    10.00
M7   20 2H2' 19   3.340   3.950    10.00    10.00
M7   20 1H2' 19   3.570   5.030    10.00    10.00
M7   20 H1'  19   4.070   7.560    10.00    10.00
M7   20 H3'  19   3.960   7.020    10.00    10.00
M7   20 H8   19   3.240   3.470    10.00    10.00
H1'  21 H2    8   3.440   4.220    10.00    10.00
H2   21 H2    8   2.870   3.090    10.00    10.00
H8   21 2H2' 20   2.400   2.840    10.00    10.00
H8   21 1H2' 20   2.660   4.040    10.00    10.00
H8   21 H1'  20   2.990   3.370    10.00    10.00
H8   21 H3'  20   3.260   5.780    10.00    10.00
H8   21 2H2' 21   2.300   5.750    10.00    10.00
H8   21 1H2' 21   1.990   2.260    10.00    10.00
H8   21 H1'  21   3.130   6.190    10.00    10.00
H8   21 H3'  21   3.490   5.710    10.00    10.00
H8   21 H4'  21   3.330   4.990    10.00    10.00
H2   22 H1'   7   3.260   3.680    10.00    10.00
H2   22 H2   21   3.140   3.410    10.00    10.00
H8   22 1H2' 21   2.430   4.640    10.00    10.00
H8   22 H1'  21   2.770   3.370    10.00    10.00
H8   22 1H2' 22   1.930   2.250    10.00    10.00
H8   22 H1'  22   3.590   6.170    10.00    10.00
H8   22 H3'  22   2.900   5.480    10.00    10.00
H1'  23 H2   22   3.410   4.210    10.00    10.00
H6   23 H1'  22   3.180   3.600    10.00    10.00
H6   23 H8   22   3.660   6.350    10.00    10.00
H6   23 H1'  23   2.860   3.850    10.00    10.00
M7   23 2H2' 22   3.500   4.360    10.00    10.00
M7   23 1H2' 22   3.170   3.570    10.00    10.00
M7   23 H1'  22   4.190   5.490    10.00    10.00
M7   23 H3'  22   4.120   6.340    10.00    10.00
M7   23 H8   22   3.380   3.600    10.00    10.00
H1'  24 H2    4   3.600   4.450    10.00    10.00
H1'  24 H2    5   3.350   3.660    10.00    10.00
H6   24 2H2' 23   2.090   2.700    10.00    10.00
H6   24 1H2' 23   2.280   6.150    10.00    10.00
H6   24 H1'  23   2.780   5.650    10.00    10.00
H6   24 H3'  23   3.360   4.760    10.00    10.00
H6   24 H6   23   3.350   5.290    10.00    10.00
H6   24 2H2' 24   2.430   5.460    10.00    10.00
H6   24 1H2' 24   1.810   2.160    10.00    10.00
H6   24 H1'  24   2.770   4.830    10.00    10.00
H6   24 H3'  24   3.580   6.100    10.00    10.00
M7   24 2H2' 23   3.250   6.720    10.00    10.00
M7   24 1H2' 23   2.920   3.670    10.00    10.00
M7   24 H1'  23   4.300   6.630    10.00    10.00
M7   24 H3'  23   3.840   4.350    10.00    10.00
M7   24 H6   23   3.180   3.470    10.00    10.00
M7   24 M7   23   4.080   4.620    10.00    10.00
H2   25 H2    4   2.750   2.930    10.00    10.00
H8   25 2H2' 24   2.560   3.040    10.00    10.00
H8   25 H1'  24   3.270   4.490    10.00    10.00
H8   25 H6   24   3.150   5.470    10.00    10.00
H8   25 2H2' 25   2.570   4.330    10.00    10.00
H4'  26 H1'  26   2.400   3.010    10.00    10.00
H8   26 2H2' 25   2.310   3.500    10.00    10.00
H8   26 H1'  25   3.180   3.820    10.00    10.00
H8   26 H3'  25   3.420   5.630    10.00    10.00
H8   26 H8   25   3.240   5.460    10.00    10.00
H8   26 2H2' 26   2.520   4.480    10.00    10.00
H8   26 1H2' 26   2.050   2.460    10.00    10.00
H8   26 H1'  26   3.250   6.520    10.00    10.00
H8   26 H3'  26   3.510   4.780    10.00    10.00
H1'  27 H1'  26   3.300   5.030    10.00    10.00
H4'  27 2H2' 27   2.400   3.910    10.00    10.00
H4'  27 H1'  27   2.210   3.310    10.00    10.00
H8   27 2H2' 26   2.410   2.920    10.00    10.00
H8   27 1H2' 26   2.720   4.620    10.00    10.00
H8   27 H1'  26   2.460   2.920    10.00    10.00
H8   27 H3'  26   3.270   4.220    10.00    10.00
H8   27 H4'  26   3.950   6.230    10.00    10.00
H8   27 2H2' 27   2.390   5.150    10.00    10.00
H8   27 1H2' 27   1.980   2.280    10.00    10.00
H8   27 H1'  27   2.910   5.800    10.00    10.00
H8   27 H3'  27   2.510   4.280    10.00    10.00
H8   27 H4'  27   2.440   3.640    10.00    10.00
H5    1 H3'   1   3.690   6.500    10.00    10.00
H6    1 2H2'  1   2.480   4.910    10.00    10.00
H5    2 2H2'  1   2.920   4.730    10.00    10.00
H6    2 H6    1   2.630   5.210    10.00    10.00
H6    3 H6    2   2.680   5.050    10.00    10.00
H2    4 H1'   4   3.520   4.120    10.00    10.00
H8    4 H3'   3   3.720   6.020    10.00    10.00
H1'   5 H2    4   3.880   4.500    10.00    10.00
H2    5 H1'   5   3.920   5.140    10.00    10.00
H8    5 H8    4   3.050   6.300    10.00    10.00
H8    5 H4'   5   3.220   3.850    10.00    10.00
M7    6 H4'   5   5.120   7.340    10.00    10.00
M7    6 1H2'  6   3.580   4.580    10.00    10.00
H6    7 H6    6   3.230   4.780    10.00    10.00
H8    8 2H2'  7   2.020   2.320    10.00    10.00
H8    8 H3'   7   4.010   5.840    10.00    10.00
H8    8 1H2'  8   2.380   2.750    10.00    10.00
M7    9 H1'   9   4.790   7.710    10.00    10.00
H8   10 H6    9   3.530   4.800    10.00    10.00
H8   10 H1'  10   3.190   4.430    10.00    10.00
H8   10 H3'  10   3.160   5.490    10.00    10.00
H8   11 H4'  10   4.190   6.630    10.00    10.00
H8   11 H4'  11   3.710   5.110    10.00    10.00
H1'  12 H2   11   3.810   4.470    10.00    10.00
H6   12 1H2' 11   2.490   4.070    10.00    10.00
H6   12 H8   11   3.700   6.530    10.00    10.00
H8   13 H1'  12   4.050   5.890    10.00    10.00
H8   13 H4'  13   3.880   5.630    10.00    10.00
2H5' 14 H4'  13   3.330   4.410    10.00    10.00
H4'  14 H1'  14   2.980   3.280    10.00    10.00
H8   14 1H2' 13   2.430   4.810    10.00    10.00
H8   14 H3'  13   3.510   4.070    10.00    10.00
H8   14 H4'  13   3.510   4.650    10.00    10.00
H8   14 1H5' 14   3.090   5.450    10.00    10.00
H8   14 2H5' 14   3.120   5.060    10.00    10.00
H8   14 H4'  14   3.810   6.410    10.00    10.00
H4'  15 H1'  15   2.930   3.330    10.00    10.00
H2   15 1H5' 14   3.090   3.920    10.00    10.00
H8   15 H1'  15   3.950   4.670    10.00    10.00
2H5' 16 H1'  15   2.180   4.850    10.00    10.00
H4'  16 H1'  15   3.060   5.630    10.00    10.00
H8   16 2H5' 16   2.760   3.620    10.00    10.00
H8   16 H4'  16   3.060   3.990    10.00    10.00
H6   17 H4'  17   3.520   5.880    10.00    10.00
H1'  18 H2   11   3.830   4.480    10.00    10.00
M7   18 H3'  17   4.790   6.750    10.00    10.00
M7   18 H4'  17   5.410   7.730    10.00    10.00
H1'  19 H2   10   3.590   4.020    10.00    10.00
H2   19 H1'  10   3.960   4.700    10.00    10.00
H2   19 H4'  10   4.070   4.940    10.00    10.00
H2   19 H1'  19   3.710   4.290    10.00    10.00
H8   19 H3'  18   3.960   6.410    10.00    10.00
H8   19 H6   18   3.170   5.390    10.00    10.00
H8   19 H4'  19   3.440   5.990    10.00    10.00
H6   20 H4'  19   3.470   4.970    10.00    10.00
M7   20 H4'  19   4.310   7.400    10.00    10.00
M7   20 2H2' 20   4.230   7.600    10.00    10.00
M7   20 1H2' 20   4.390   6.500    10.00    10.00
M7   20 H3'  20   4.740   7.780    10.00    10.00
H8   21 H6   20   3.650   6.160    10.00    10.00
H8   22 H4'  21   4.200   6.290    10.00    10.00
H8   22 H4'  22   3.310   5.850    10.00    10.00
M7   23 H4'  22   4.890   7.700    10.00    10.00
M7   23 1H2' 23   4.410   7.390    10.00    10.00
H8   25 H1'  25   3.110   4.980    10.00    10.00
H8   25 H3'  25   3.340   4.510    10.00    10.00
H8   26 1H2' 25   2.770   4.650    10.00    10.00
H8   26 H4'  26   3.510   4.400    10.00    10.00
H3'   3 H1'   2   3.760   5.620    10.00    10.00
H6    3 H3'   2   3.100   5.100    10.00    10.00
M7    3 H3'   3   5.400   7.540    10.00    10.00
H8    4 H4'   4   3.680   6.140    10.00    10.00
1H5'  5 2H2'  4   2.460   3.010    10.00    10.00
H4'   5 H1'   4   4.180   5.570    10.00    10.00
H8    5 1H5'  5   3.140   4.790    10.00    10.00
H8    5 2H5'  5   2.770   5.070    10.00    10.00
H1'   6 H1'   5   3.560   4.360    10.00    10.00
H3'   6 H1'   5   3.890   5.280    10.00    10.00
M7    6 H1'   6   4.950   7.710    10.00    10.00
H4'   7 H1'   6   3.900   5.670    10.00    10.00
H4'   7 2H2'  7   2.480   2.840    10.00    10.00
H8    8 H4'   8   3.890   5.610    10.00    10.00
H1'   9 H1'   8   4.240   5.400    10.00    10.00
M7    9 2H2'  9   4.000   5.800    10.00    10.00
H4'  10 H1'   9   3.850   5.330    10.00    10.00
H2   10 H1'  10   3.950   4.680    10.00    10.00
H8   10 1H2'  9   3.560   5.700    10.00    10.00
H1'  11 H2   10   4.160   5.440    10.00    10.00
H4'  12 2H2' 11   3.150   4.840    10.00    10.00
H4'  12 H1'  11   3.710   5.370    10.00    10.00
H5   12 2H2' 11   2.420   2.710    10.00    10.00
H6   12 H1'  11   3.520   4.350    10.00    10.00
H6   12 H1'  12   3.260   4.160    10.00    10.00
H4'  13 H1'  12   3.340   3.730    10.00    10.00
H4'  13 2H2' 13   3.300   5.540    10.00    10.00
H8   13 2H2' 12   2.640   3.410    10.00    10.00
H3'  15 1H5' 15   2.520   2.770    10.00    10.00
H4'  15 1H5' 15   2.480   2.800    10.00    10.00
H8   16 1H5' 16   2.740   5.590    10.00    10.00
H8   16 1H2' 16   1.990   2.260    10.00    10.00
M7   17 H4'  16   5.300   7.330    10.00    10.00
H2   19 H1'   9   4.140   5.300    10.00    10.00
H1'  20 H1'  19   3.520   4.130    10.00    10.00
H2   21 H1'   8   3.910   4.690    10.00    10.00
H2   21 H1'  21   3.870   4.720    10.00    10.00
H1'  22 H2   21   4.200   5.590    10.00    10.00
H4'  22 H1'  21   3.940   5.290    10.00    10.00
H3'  23 H1'  22   4.070   5.680    10.00    10.00
M7   23 H1'  21   5.360   7.450    10.00    10.00
M7   23 H1'  23   5.630   7.520    10.00    10.00
H1'  25 H2    4   4.040   4.960    10.00    10.00
H4'  25 H1'  24   3.890   5.650    10.00    10.00
H8   25 1H2' 24   3.580   5.430    10.00    10.00
#
# (2) restraints involving exchangeable protons
#
H2   22 H3    6     1.80 3.00   10.0 10.0
H2    5 H3   23     1.80 3.00   10.0 10.0
H3   17 H2   11     1.80 3.00   10.0 10.0
H2    4 H3   24     1.80 3.00   10.0 10.0
H2   21 H3    7     1.80 3.00   10.0 10.0
H2   11 H3   17     1.80 3.00   10.0 10.0
H2   25 H3    3     1.80 3.00   10.0 10.0
H2   10 H3   18     1.80 3.00   10.0 10.0
H41   2 H1   26     1.80 3.00   10.0 10.0
H41  12 H1   16     1.80 3.00   10.0 10.0
H1   26 H41   2     1.80 4.00   10.0 10.0
H62   4 H3   24     1.80 4.00   10.0 10.0
H62  22 H3    6     1.80 4.00   10.0 10.0
H62   5 H3   23     1.80 4.00   10.0 10.0
H61   4 H3   24     1.80 4.00   10.0 10.0
H61  22 H3    6     1.80 4.00   10.0 10.0
H61   5 H3   23     1.80 4.00   10.0 10.0
H42   2 H1   26     1.80 4.00   10.0 10.0
H62  25 H3    3     1.80 4.00   10.0 10.0
H2   22 H3    7     1.80 4.00   10.0 10.0
H61  25 H3    3     1.80 4.00   10.0 10.0
H3    6 H3    7     1.80 4.00   10.0 10.0
H42  12 H1   16     1.80 4.00   10.0 10.0
H3   18 H2   11     1.80 4.00   10.0 10.0
H62  11 H3   17     1.80 4.00   10.0 10.0
H41   1 H41   2     1.80 5.00   10.0 10.0
H2   11 H3   18     1.80 5.00   10.0 10.0
H3    3 H1   26     1.80 5.00   10.0 10.0
H3    7 H3    6     1.80 5.00   10.0 10.0
H2   11 H1   16     1.80 5.00   10.0 10.0
H3   17 H3   18     1.80 5.00   10.0 10.0
H1   26 H3    3     1.80 5.00   10.0 10.0
H1   16 H3   17     1.80 5.00   10.0 10.0
H3   17 H1   16     1.80 5.00   10.0 10.0
H62  25 H41   2     1.80 5.00   10.0 10.0
H62  11 H1   16     1.80 5.00   10.0 10.0
H41   1 H1   27     1.80 5.00   10.0 10.0
H3    7 H3   20     1.80 5.00   10.0 10.0
H5    1 H41   2     1.80 5.00   10.0 10.0
H2   25 H1   26     1.80 5.00   10.0 10.0
H1'  12 H1   16     1.80 5.00   10.0 10.0
H1'   6 H3    6     1.80 5.00   10.0 10.0
H2   10 H3    9     1.80 5.00   10.0 10.0
H41   2 H3    3     1.80 5.00   10.0 10.0
H2    8 H3    7     1.80 5.00   10.0 10.0
H5    2 H1   26     1.80 5.00   10.0 10.0
H1'   7 H3    7     1.80 5.00   10.0 10.0
H3    9 H3   18     1.80 5.00   10.0 10.0
H2   19 H3   18     1.80 5.00   10.0 10.0
H1'  24 H3   24     1.80 6.00   10.0 10.0
H3    3 H41   2     1.80 6.00   10.0 10.0
H5    1 H1   27     1.80 6.00   10.0 10.0
H3   20 H3    7     1.80 6.00   10.0 10.0
H2    4 H3   23     1.80 6.00   10.0 10.0
H1'   9 H3    9     1.80 6.00   10.0 10.0
H5   12 H1   16     1.80 6.00   10.0 10.0
H1'  17 H1   16     1.80 6.00   10.0 10.0
H1'  20 H3   20     1.80 6.00   10.0 10.0
H1'  17 H3   17     1.80 6.00   10.0 10.0
H1'  23 H3   23     1.80 6.00   10.0 10.0
H41  12 H3   17     1.80 6.00   10.0 10.0
H1'  13 H1   16     1.80 6.00   10.0 10.0
H1'   3 H3    3     1.80 6.00   10.0 10.0
#
# (3)  Integrated intensities of cross-peaks in the 150-ms
#               D2O NOESY acquired with a weak presat of HDO
#
# Relative integration error was determined by comparing the below- and
# above-the-diagonal intensities, but in no case it was set below 10%.
# The intensities are not normalized.
#
MIXING TIME: 0.15
ATOM1   ATOM2   INTENSITY   ERROR    Note    
1H2'  1 H3'   1   2.701e+07   10.0
1H2'  1 H4'   1   4.273e+06   10.0
1H2'  1 H5    1   4.625e+06   16.7
1H2'  1 H6    1   3.264e+07   10.0
2H2'  1 H3'   1   9.852e+06   10.0
2H2'  1 H6    1   1.114e+07   10.0
H1'   1 1H2'  1   1.455e+07   10.0
H1'   1 2H2'  1   3.581e+07   10.0
H1'   1 H4'   1   1.592e+07   10.0
H3'   1 H1'   1   5.402e+06   10.0
H3'   1 H4'   1   2.423e+07   10.0
H3'   1 H5    1   1.974e+06   10.0
H3'   1 H6    1   1.224e+07   10.0
H4'   1 H6    1   4.106e+06   10.0
1H2'  1 H5    2   1.063e+07   10.0
1H2'  1 H6    2   1.275e+07   10.0
2H2'  1 H5    2   8.077e+06   22.0
2H2'  1 H6    2   1.112e+07   10.0
H1'   1 H6    2   6.058e+06   10.0
H3'   1 H5    2   6.880e+06   10.0
H3'   1 H6    2   6.410e+06   10.0
H6    1 H5    2   6.761e+06   10.0
H6    1 H6    2   2.001e+06   10.0
1H2'  2 H3'   2   2.223e+07   10.0
1H2'  2 H5    2   6.172e+06   12.8
1H2'  2 H6    2   3.121e+07   10.0
2H2'  2 H6    2   1.388e+07   10.0
H1'   2 1H2'  2   1.654e+07   10.0
H1'   2 2H2'  2   3.338e+07   10.0
H1'   2 H4'   2   2.050e+07   10.0
H1'   2 H6    2   8.742e+06   10.0
H3'   2 H1'   2   6.705e+06   10.0
H3'   2 H6    2   9.178e+06   10.0
H4'   2 H6    2   3.815e+06   10.0
2H2'  2 H6    3   1.224e+07   10.0
2H2'  2 M7    3   1.562e+07   10.0
H1'   2 H6    3   6.221e+06   10.0
H1'   2 M7    3   7.416e+06   10.0
H3'   2 H6    3   3.205e+06   10.0
H3'   2 M7    3   8.646e+06   10.0
H5    2 H6    3   1.276e+06   10.0
H5    2 M7    3   1.274e+07   10.0
H6    2 H6    3   2.281e+06   12.1
H6    2 M7    3   1.806e+07   10.0
H3'   3 H1'   2   8.575e+05   10.0
2H2'  3 H6    3   1.900e+07   10.0
2H2'  3 M7    3   3.227e+06   10.0
H1'   3 1H2'  3   1.372e+07   18.5
H1'   3 2H2'  3   2.757e+07   10.0
H1'   3 H6    3   6.762e+06   13.9
H1'   3 M7    3   1.674e+06   10.0
H3'   3 1H2'  3   1.786e+07   10.0
H3'   3 H6    3   8.087e+06   10.0
H3'   3 M7    3   1.276e+06   10.0
H6    3 M7    3   3.221e+07   10.0
1H2'  3 H8    4   4.333e+06   24.1
2H2'  3 H8    4   7.191e+06   16.7
H1'   3 H8    4   6.304e+06   10.0
H3'   3 H8    4   2.367e+06   10.0
H6    3 H8    4   3.037e+06   10.0
1H2'  4 H4'   4   4.914e+06   27.9
1H2'  4 H8    4   2.927e+07   10.0
2H2'  4 H8    4   1.665e+07   10.0
H1'   4 1H2'  4   1.370e+07   19.9
H1'   4 H2    4   2.172e+06   10.0
H1'   4 H8    4   6.476e+06   10.0
H3'   4 1H2'  4   2.480e+07   10.0
H3'   4 H8    4   8.652e+06   10.0
H4'   4 H8    4   2.352e+06   10.0
1H2'  4 H8    5   1.033e+07   19.4
2H2'  4 1H5'  5   8.174e+06   10.0
2H2'  4 H8    5   1.203e+07   10.0
H1'   4 1H5'  5   1.304e+07   20.2
H1'   4 H8    5   1.008e+07   12.8
H2    4 H1'   5   1.657e+06   28.6
H2    4 H2    5   8.385e+06   11.3
H3'   4 H8    5   3.336e+06   10.0
H8    4 H8    5   3.131e+06   18.8
H2    4 H2   25   1.834e+07   10.0
H4'   5 H1'   4   2.564e+06   10.0
1H2'  5 H8    5   1.886e+07   10.0
1H5'  5 H8    5   1.829e+06   10.0
2H2'  5 H8    5   1.525e+07   10.0
2H5'  5 H8    5   1.484e+06   10.0
H1'   5 H2    5   1.209e+06   10.0
H1'   5 H8    5   6.105e+06   10.0
H3'   5 H8    5   5.397e+06   10.0
H4'   5 H8    5   2.642e+06   10.0
1H2'  5 M7    6   2.118e+07   10.0
2H2'  5 M7    6   1.840e+07   10.0
H1'   5 M7    6   7.849e+06   25.6
H2    5 H1'   6   4.524e+06   10.0
H3'   5 M7    6   3.893e+06   10.0
H4'   5 M7    6   1.315e+06   10.0
H8    5 H6    6   3.708e+06   15.1
H8    5 M7    6   1.886e+07   10.0
H2    5 H1'  24   3.777e+06   18.9
H1'   6 H1'   5   2.296e+06   10.0
H3'   6 H1'   5   1.930e+06   10.0
1H2'  6 M7    6   4.579e+06   10.0 lineshape?
H1'   6 1H2'  6   1.245e+07   10.0
H1'   6 2H2'  6   2.044e+07   10.0
H1'   6 H4'   6   2.631e+07   10.0
H1'   6 H6    6   5.834e+06   10.0
H1'   6 M7    6   1.222e+06   10.0
H3'   6 1H2'  6   1.627e+07   10.0
H3'   6 H1'   6   6.669e+06   10.0
H3'   6 H6    6   8.173e+06   10.0
H6    6 M7    6   2.800e+07   10.0
1H2'  6 H6    7   9.740e+06   10.0
1H2'  6 M7    7   2.028e+07   10.0
2H2'  6 H6    7   1.071e+07   10.0
2H2'  6 M7    7   1.464e+07   10.0
H1'   6 H6    7   5.609e+06   10.0
H1'   6 M7    7   6.101e+06   10.0
H3'   6 H6    7   3.967e+06   10.0
H3'   6 M7    7   7.847e+06   10.0
H6    6 H6    7   2.547e+06   26.6
H6    6 M7    7   1.638e+07   10.0
H4'   7 H1'   6   1.292e+06   10.0
M7    7 M7    6   2.878e+07   10.0
1H2'  7 H4'   7   3.816e+06   10.0
1H2'  7 H6    7   1.527e+07   10.0
2H2'  7 H4'   7   8.966e+06   10.0
2H2'  7 H6    7   1.115e+07   10.0
H1'   7 2H2'  7   2.403e+07   10.0
H1'   7 H4'   7   1.322e+07   23.0
H1'   7 H6    7   6.245e+06   10.0
H6    7 M7    7   2.122e+07   10.0
1H2'  7 H8    8   6.478e+06   10.0
H1'   7 H8    8   7.304e+06   10.0
H6    7 H8    8   3.449e+06   10.2
H1'   7 H2   22   3.915e+06   10.0
H8    8 2H2'  7   2.133e+07   10.0
1H2'  8 H1'   8   1.825e+07   10.0
2H2'  8 H1'   8   1.979e+07   10.0
2H2'  8 H8    8   1.063e+07   10.0
H1'   8 H2    8   1.618e+06   10.0
H1'   8 H4'   8   8.575e+06   10.0
H1'   8 H8    8   5.061e+06   10.3
H3'   8 H8    8   5.063e+06   10.0
H4'   8 H8    8   1.782e+06   10.0
H8    8 1H2'  8   1.168e+07   10.0
1H2'  8 M7    9   1.767e+07   10.0
2H2'  8 M7    9   1.068e+07   10.0
H1'   8 M7    9   5.925e+06   10.0
H3'   8 M7    9   3.601e+06   10.0
H8    8 H6    9   2.510e+06   10.0
H8    8 M7    9   1.227e+07   10.0
H1'   8 H2   21   1.466e+06   20.7
H2    8 H2   21   1.378e+07   10.0
H1'   9 H1'   8   7.547e+05   10.0
H1'   9 H2    8   2.501e+06   10.0
1H2'  9 H6    9   1.526e+07   10.0
2H2'  9 H6    9   1.059e+07   10.6
2H2'  9 M7    9   3.165e+06   26.3
H1'   9 1H2'  9   1.175e+07   10.0
H1'   9 H4'   9   1.614e+07   10.0
H1'   9 H6    9   4.552e+06   10.0
H1'   9 M7    9   1.124e+06   10.0
H3'   9 H1'   9   6.682e+06   10.0
H6    9 M7    9   1.750e+07   10.0
2H2'  9 H8   10   6.845e+06   15.4
H1'   9 H4'  10   2.033e+06   10.0
H1'   9 H8   10   5.532e+06   10.0
H6    9 H8   10   1.837e+06   49.0
H1'   9 H2   19   9.437e+05   10.0
H8   10 1H2'  9   3.810e+06   10.0
2H2' 10 H8   10   1.145e+07   10.6
H1'  10 1H2' 10   1.600e+07   10.0
H1'  10 H2   10   1.537e+06   20.2
H3'  10 2H2' 10   2.060e+07   10.0
H3'  10 H8   10   5.998e+06   10.0
H8   10 H1'  10   6.220e+06   10.0
2H2' 10 H8   11   1.265e+07   14.5
H1'  10 H8   11   7.907e+06   10.0
H2   10 H1'  11   1.021e+06   10.0
H2   10 H2   11   6.140e+06   18.6
H3'  10 H8   11   3.464e+06   10.0
H4'  10 H8   11   8.486e+05   10.0
H8   10 H8   11   2.382e+06   12.8
H1'  10 H2   19   1.553e+06   10.0
H2   10 H1'  19   2.296e+06   10.0
H2   10 H2   19   1.059e+07   10.0
H4'  10 H2   19   1.183e+06   10.0
1H2' 11 H4'  11   3.495e+06   10.0
1H2' 11 H8   11   1.832e+07   10.0
H1'  11 1H2' 11   1.330e+07   12.5
H1'  11 2H2' 11   2.214e+07   10.0
H1'  11 H2   11   1.958e+06   23.9
H1'  11 H4'  11   1.058e+07   10.0
H1'  11 H8   11   5.678e+06   10.0
H4'  11 H8   11   2.067e+06   26.3
1H2' 11 H5   12   8.564e+06   10.0
1H2' 11 H6   12   5.601e+06   23.9
2H2' 11 H4'  12   4.077e+06   10.0
2H2' 11 H5   12   1.226e+07   10.0
2H2' 11 H6   12   6.872e+06   10.0
H2   11 H1'  12   1.860e+06   35.9
H8   11 H6   12   2.613e+06   10.0
H2   11 H1'  18   1.841e+06   36.8
H4'  12 H1'  11   2.498e+06   10.0
H5   12 H8   11   7.325e+06   10.0
H6   12 H1'  11   3.769e+06   10.0
1H2' 12 H6   12   1.316e+07   11.8
H1'  12 H6   12   5.425e+06   16.2
H3'  12 2H2' 12   1.164e+07   10.0
H1'  12 H8   13   2.632e+06   10.0
H6   12 H8   13   2.451e+06   18.8
H4'  13 H1'  12   4.993e+06   10.0
H8   13 2H2' 12   7.716e+06   10.0
1H2' 13 H8   13   2.414e+07   10.0
2H2' 13 H4'  13   4.186e+06   10.0
2H2' 13 H8   13   1.604e+07   10.0
H3'  13 1H2' 13   9.623e+06   10.0
H3'  13 H4'  13   1.980e+07   10.0
H3'  13 H8   13   5.176e+06   10.0
H4'  13 H8   13   2.407e+06   26.7
1H2' 13 H8   14   9.652e+06   10.0
2H2' 13 H8   14   1.572e+07   10.0
H3'  13 H8   14   2.458e+06   10.0
H4'  13 2H5' 14   2.800e+06   10.0
H4'  13 H8   14   1.463e+06   24.6
1H2' 14 H3'  14   2.633e+07   10.0
1H2' 14 H8   14   1.988e+07   13.8
1H5' 14 H8   14   1.624e+06   10.0
2H2' 14 H3'  14   1.895e+07   26.6
2H2' 14 H8   14   1.860e+07   14.2
2H5' 14 1H5' 14   5.785e+07   10.0
H1'  14 H3'  14   8.261e+06   14.9
H1'  14 H4'  14   8.226e+06   10.0
H1'  14 H8   14   1.082e+07   10.0
H3'  14 1H5' 14   1.213e+07   15.7
H3'  14 2H5' 14   2.051e+07   10.0
H3'  14 H4'  14   2.194e+07   10.0
H3'  14 H8   14   6.827e+06   10.0
H4'  14 1H5' 14   2.606e+07   10.0
H4'  14 2H5' 14   2.727e+07   10.0
H4'  14 H8   14   1.978e+06   10.0
H8   14 2H5' 14   3.504e+06   10.0
1H5' 14 H2   15   3.136e+06   10.0
H4'  14 H2   15   2.241e+06   10.0
H1'  15 H4'  15   6.649e+06   27.7
H1'  15 H8   15   5.202e+06   16.8
H3'  15 1H5' 15   1.683e+07   10.0
H4'  15 1H5' 15   1.958e+07   23.5
H1'  15 1H5' 16   4.151e+06   20.5
H1'  15 2H5' 16   1.065e+07   15.3
H1'  15 H4'  16   5.940e+06   10.0
H1'  15 H8   16   3.627e+06   10.0
H3'  15 H8   16   2.796e+06   10.0
H1'  16 H2   15   1.005e+06   10.0
1H5' 16 H8   16   1.315e+06   10.0
2H5' 16 H8   16   2.617e+06   10.0
H1'  16 H8   16   5.254e+06   14.6
H3'  16 H8   16   3.557e+06   10.0
H4'  16 H8   16   2.861e+06   53.3
H8   16 1H2' 16   2.046e+07   10.0
H1'  16 H6   17   9.744e+06   10.0
H1'  16 M7   17   9.398e+06   10.0
H3'  16 M7   17   5.226e+06   10.0
H8   16 H6   17   2.553e+06   10.0
H8   16 M7   17   7.887e+06   10.0
M7   17 H4'  16   1.516e+06   10.0
1H2' 17 H4'  17   7.152e+06   10.0
1H2' 17 H6   17   2.742e+07   10.0
H1'  17 1H2' 17   1.436e+07   10.0
H1'  17 H6   17   6.376e+06   10.6
H4'  17 H6   17   3.608e+06   10.0
H6   17 M7   17   2.196e+07   10.1
M7   17 1H2' 17   1.279e+06   10.0
2H2' 17 H6   18   1.036e+07   11.4
2H2' 17 M7   18   1.945e+07   22.1
H1'  17 H6   18   6.656e+06   10.0
H1'  17 M7   18   4.998e+06   10.0
H6   17 M7   18   1.459e+07   14.1
M7   18 H4'  17   1.341e+06   10.0
M7   18 M7   17   2.072e+07   10.0
1H2' 18 H4'  18   6.161e+06   10.0
2H2' 18 H6   18   1.344e+07   22.8
H1'  18 1H2' 18   1.186e+07   10.0
H1'  18 2H2' 18   2.358e+07   10.0
H1'  18 H6   18   4.786e+06   10.0
H6   18 M7   18   2.365e+07   10.0
1H2' 18 H8   19   6.968e+06   10.0
2H2' 18 H8   19   8.453e+06   20.6
H1'  18 H8   19   5.664e+06   15.9
H3'  18 H8   19   1.758e+06   10.0
H6   18 H8   19   2.703e+06   10.0
1H2' 19 H1'  19   1.813e+07   10.0
1H2' 19 H8   19   1.966e+07   10.0
2H2' 19 H1'  19   2.657e+07   10.0
2H2' 19 H8   19   1.085e+07   12.5
H1'  19 H2   19   1.790e+06   10.0
H1'  19 H4'  19   1.335e+07   10.0
H1'  19 H8   19   6.793e+06   10.0
H3'  19 H8   19   5.880e+06   10.0
H4'  19 H8   19   2.857e+06   34.5
1H2' 19 M7   20   1.253e+07   10.0
2H2' 19 M7   20   1.342e+07   11.4
H1'  19 M7   20   6.158e+06   13.0
H3'  19 M7   20   3.887e+06   10.0
H4'  19 H6   20   2.229e+06   10.0
H4'  19 M7   20   1.941e+06   30.7
H8   19 H6   20   4.160e+06   10.0
H8   19 M7   20   1.935e+07   10.0
H1'  20 H1'  19   2.254e+06   10.0
H1'  20 H2   19   1.608e+06   10.0
1H2' 20 H6   20   2.722e+07   10.0
1H2' 20 M7   20   5.143e+06   10.0
2H2' 20 H6   20   1.777e+07   10.0
2H2' 20 M7   20   2.981e+06   10.0
H1'  20 1H2' 20   1.093e+07   10.0
H1'  20 2H2' 20   2.362e+07   10.0
H1'  20 H6   20   5.632e+06   10.0
H3'  20 M7   20   1.804e+06   10.0
H6   20 M7   20   2.750e+07   10.0
1H2' 20 H8   21   7.242e+06   10.0
2H2' 20 H8   21   1.171e+07   10.0
H1'  20 H8   21   7.983e+06   10.0
H3'  20 H8   21   3.126e+06   10.0
H6   20 H8   21   2.858e+06   10.0
H1'  21 H2    8   2.176e+06   10.0
1H2' 21 H8   21   2.674e+07   10.0
2H2' 21 H8   21   1.555e+07   10.0
H1'  21 1H2' 21   1.095e+07   16.3
H1'  21 H2   21   1.659e+06   24.1
H1'  21 H8   21   6.179e+06   16.0
H3'  21 H8   21   6.678e+06   10.0
H4'  21 H8   21   3.854e+06   16.6
1H2' 21 H8   22   1.151e+07   10.0
H1'  21 H8   22   1.007e+07   10.0
H2   21 H1'  22   8.174e+05   33.1
H2   21 H2   22   8.670e+06   10.0
H4'  21 H8   22   8.842e+05   10.0
H1'  21 M7   23   1.439e+06   10.0
H4'  22 H1'  21   1.747e+06   10.0
1H2' 22 H8   22   2.452e+07   10.0
H1'  22 H8   22   6.311e+06   10.0
H3'  22 H8   22   7.667e+06   10.0
H4'  22 H8   22   2.832e+06   31.2
1H2' 22 M7   23   1.841e+07   10.0
2H2' 22 M7   23   1.664e+07   10.0
H1'  22 M7   23   6.593e+06   11.7
H3'  22 M7   23   5.096e+06   10.0
H4'  22 M7   23   1.311e+06   10.0
H8   22 H6   23   3.287e+06   10.0
H8   22 M7   23   1.522e+07   10.0
H1'  23 H2   22   4.074e+06   10.0
H3'  23 H1'  22   1.316e+06   10.0
1H2' 23 M7   23   5.012e+06   10.0
H1'  23 1H2' 23   1.482e+07   10.0
H1'  23 H6   23   6.809e+06   10.0
H1'  23 M7   23   1.242e+06   20.2
H3'  23 1H2' 23   1.692e+07   10.0
H3'  23 H1'  23   8.086e+06   10.0
H3'  23 H4'  23   1.968e+07   10.0
H6   23 M7   23   2.603e+07   10.0
1H2' 23 H6   24   1.377e+07   14.6
1H2' 23 M7   24   1.896e+07   10.0
2H2' 23 H6   24   1.485e+07   10.0
2H2' 23 M7   24   1.641e+07   10.0
H1'  23 H6   24   6.955e+06   10.0
H1'  23 M7   24   5.934e+06   10.0
H3'  23 H6   24   3.574e+06   10.0
H3'  23 M7   24   8.740e+06   10.0
H6   23 H6   24   2.497e+06   10.0
H6   23 M7   24   1.940e+07   14.2
M7   24 M7   23   2.389e+07   10.0
1H2' 24 H6   24   2.431e+07   10.0
2H2' 24 H6   24   1.299e+07   10.0
H1'  24 1H2' 24   1.384e+07   18.6
H1'  24 2H2' 24   2.469e+07   10.0
H1'  24 H6   24   7.163e+06   10.0
H3'  24 H6   24   5.691e+06   10.0
H6   24 M7   24   2.521e+07   10.0
2H2' 24 H8   25   1.043e+07   10.0
H1'  24 H4'  25   3.139e+06   10.0
H1'  24 H8   25   4.581e+06   10.0
H6   24 H8   25   2.865e+06   10.0
H1'  25 H2    4   1.296e+06   10.0
H8   25 1H2' 24   4.734e+06   10.0
2H2' 25 H8   25   1.725e+07   10.0
H1'  25 1H2' 25   1.078e+07   30.9
H1'  25 2H2' 25   2.268e+07   10.0
H3'  25 2H2' 25   1.494e+07   10.0
H3'  25 H8   25   7.519e+06   10.0
H8   25 H1'  25   5.576e+06   10.0
1H2' 25 H8   26   6.310e+06   10.0
2H2' 25 H8   26   7.650e+06   30.1
H1'  25 H8   26   4.806e+06   10.0
H3'  25 H8   26   2.373e+06   10.0
H8   25 H8   26   2.721e+06   14.8
1H2' 26 H4'  26   3.141e+06   10.0
1H2' 26 H8   26   2.021e+07   10.0
2H2' 26 H8   26   1.200e+07   10.4
H1'  26 1H2' 26   1.194e+07   10.0
H1'  26 2H2' 26   2.030e+07   10.0
H1'  26 H4'  26   1.100e+07   30.0
H1'  26 H8   26   4.647e+06   16.1
H4'  26 H8   26   2.753e+06   29.6
1H2' 26 H8   27   4.651e+06   10.0
2H2' 26 H8   27   1.004e+07   12.2
H1'  26 H1'  27   2.851e+06   14.2
H1'  26 H8   27   1.084e+07   10.0
H4'  26 H8   27   1.343e+06   10.0
1H2' 27 H3'  27   2.774e+07   17.3
1H2' 27 H4'  27   6.261e+06   10.0
1H2' 27 H8   27   2.984e+07   12.6
2H2' 27 H3'  27   2.313e+07   10.0
2H2' 27 H4'  27   7.689e+06   12.8
2H2' 27 H8   27   1.593e+07   13.2
H1'  27 1H2' 27   2.431e+07   10.0
H1'  27 2H2' 27   4.474e+07   10.0
H1'  27 H4'  27   2.016e+07   10.0
H1'  27 H8   27   8.073e+06   21.1
H3'  27 H1'  27   8.934e+06   10.0
H3'  27 H4'  27   2.830e+07   10.0
H3'  27 H8   27   1.016e+07   10.0
H4'  27 H8   27   5.505e+06   14.8
#
#       (4)  Integrated intensities of cross-peaks in the 150-ms
#               D2O NOESY acquired without presat
#
MIXING TIME: 0.15
ATOM1   ATOM2   INTENSITY   ERROR    Note    
1H2'  1 H5    1   2.818e+06   11.1
1H2'  1 H6    1   1.630e+07   10.0
2H2'  1 H6    1   5.810e+06   10.0
H1'   1 1H2'  1   9.215e+06   10.0
H1'   1 2H2'  1   1.868e+07   10.0
H3'   1 1H2'  1   1.283e+07   10.0
H3'   1 2H2'  1   4.431e+06   10.0
H3'   1 H1'   1   2.936e+06   10.0
H3'   1 H4'   1   1.475e+07   10.0
H3'   1 H5    1   7.794e+05   10.0
H3'   1 H6    1   6.489e+06   10.0
H4'   1 1H2'  1   4.337e+06   10.0
H4'   1 H6    1   2.197e+06   10.0
1H2'  1 H5    2   6.594e+06   25.9
1H2'  1 H6    2   5.904e+06   18.3
2H2'  1 H5    2   3.590e+06   10.0
2H2'  1 H6    2   6.152e+06   10.0
H3'   1 H6    2   4.061e+06   10.0
H6    1 H5    2   4.098e+06   10.0
H6    1 H6    2   1.486e+06   13.7
H5    2 H1'   1   2.385e+06   10.0
H5    2 H5    1   3.100e+06   10.0
H6    2 H1'   1   3.678e+06   10.0
1H2'  2 H5    2   3.414e+06   17.5
1H2'  2 H6    2   1.414e+07   10.0
2H2'  2 H6    2   7.842e+06   10.0
H1'   2 1H2'  2   8.994e+06   10.0
H1'   2 2H2'  2   1.608e+07   10.0
H3'   2 1H2'  2   1.288e+07   10.0
H3'   2 H1'   2   4.752e+06   10.0
H3'   2 H6    2   5.149e+06   10.0
H6    2 H1'   2   5.818e+06   10.0
2H2'  2 H6    3   1.033e+07   27.4
2H2'  2 M7    3   8.659e+06   10.0
H1'   2 H6    3   3.367e+06   10.0
H1'   2 M7    3   4.565e+06   10.0
H3'   2 M7    3   5.004e+06   10.0
H5    2 H6    3   8.959e+05   10.0
H5    2 M7    3   7.534e+06   16.8
H6    2 H6    3   1.289e+06   15.1
H6    2 M7    3   9.288e+06   10.0
2H2'  3 H6    3   6.899e+06   21.3
2H2'  3 M7    3   1.090e+06   10.0
H1'   3 1H2'  3   6.565e+06   10.0
H1'   3 2H2'  3   1.549e+07   10.0
H1'   3 H6    3   4.129e+06   10.0
H1'   3 M7    3   9.270e+05   10.0
H3'   3 1H2'  3   1.336e+07   10.0
H3'   3 H6    3   5.992e+06   10.0
H6    3 M7    3   1.631e+07   10.0
1H2'  3 H8    4   3.162e+06   10.0
2H2'  3 H8    4   3.844e+06   11.7
H1'   3 H8    4   3.056e+06   10.0
H3'   3 H8    4   1.474e+06   10.0
H6    3 H8    4   1.875e+06   10.0
1H2'  4 H8    4   1.411e+07   10.0
2H2'  4 H8    4   8.982e+06   10.0
H1'   4 1H2'  4   7.750e+06   13.0
H1'   4 H2    4   1.883e+06   10.0
H1'   4 H8    4   3.965e+06   10.0
H3'   4 H8    4   4.331e+06   10.0
1H2'  4 H8    5   5.841e+06   10.0
2H2'  4 H8    5   6.347e+06   22.4
H1'   4 H8    5   5.817e+06   10.0
H2    4 H1'   5   9.053e+05   10.0
H2    4 H2    5   4.906e+06   10.0
H3'   4 H8    5   2.745e+06   10.0
H8    4 H8    5   1.613e+06   14.4
H2    4 H2   25   1.147e+07   10.0
1H2'  5 H8    5   1.058e+07   10.0
2H2'  5 H8    5   7.375e+06   10.0
H1'   5 H2    5   1.111e+06   10.0
H1'   5 H8    5   3.540e+06   10.0
H3'   5 H8    5   3.565e+06   10.0
H4'   5 H8    5   1.616e+06   10.0
1H2'  5 M7    6   9.858e+06   10.0
2H2'  5 M7    6   1.115e+07   10.0
H1'   5 H6    6   5.385e+06   10.0
H1'   5 M7    6   4.976e+06   10.0
H2    5 H1'   6   3.361e+06   10.0
H3'   5 M7    6   4.587e+06   10.0
H4'   5 M7    6   1.329e+06   10.0
H8    5 H6    6   1.333e+06   10.0
H8    5 M7    6   1.074e+07   10.0
1H2'  6 M7    6   3.130e+06   10.0
H1'   6 1H2'  6   7.647e+06   10.0
H1'   6 2H2'  6   1.188e+07   10.0
H1'   6 H6    6   3.043e+06   10.0
H3'   6 1H2'  6   8.223e+06   10.0
H3'   6 H1'   6   6.041e+06   10.0
H3'   6 H6    6   4.546e+06   10.0
H3'   6 M7    6   8.377e+05   10.0
H6    6 M7    6   1.429e+07   10.0
1H2'  6 H6    7   5.385e+06   10.0
1H2'  6 M7    7   1.106e+07   10.0
2H2'  6 H6    7   9.450e+06   10.0
2H2'  6 M7    7   6.762e+06   10.0
H1'   6 H6    7   3.110e+06   10.0
H1'   6 M7    7   3.785e+06   13.1
H3'   6 H6    7   2.163e+06   10.0
H3'   6 M7    7   4.297e+06   10.0
H6    6 H6    7   1.682e+06   15.8
H6    6 M7    7   8.585e+06   10.0
M7    7 M7    6   1.063e+07   10.0
1H2'  7 H6    7   8.563e+06   10.0
2H2'  7 H6    7   5.727e+06   10.0
H1'   7 2H2'  7   1.268e+07   10.0
H1'   7 H6    7   3.292e+06   22.6
H3'   7 1H2'  7   1.289e+07   10.0
H6    7 M7    7   1.091e+07   10.0
1H2'  7 H8    8   4.084e+06   10.0
H1'   7 H8    8   4.843e+06   10.0
H3'   7 H8    8   1.326e+06   10.0 INT?
H6    7 H8    8   2.668e+06   22.2
H1'   7 H2   22   2.544e+06   10.0
H8    8 2H2'  7   8.356e+06   10.0
1H2'  8 H1'   8   9.837e+06   10.0
2H2'  8 H8    8   6.479e+06   10.0
H1'   8 2H2'  8   1.228e+07   10.0
H1'   8 H2    8   1.154e+06   10.0
H1'   8 H8    8   2.849e+06   10.0
H3'   8 H8    8   2.829e+06   10.0
H8    8 1H2'  8   7.276e+06   10.0
1H2'  8 M7    9   9.078e+06   10.3
2H2'  8 M7    9   5.327e+06   10.0
H1'   8 M7    9   3.041e+06   28.0
H3'   8 M7    9   2.570e+06   10.0
H8    8 H6    9   1.832e+06   10.0
H8    8 M7    9   6.716e+06   10.0
H2    8 H2   21   8.196e+06   10.0
H1'   9 H2    8   1.494e+06   10.0
2H2'  9 H6    9   4.375e+06   11.3
H1'   9 1H2'  9   5.665e+06   10.0
H1'   9 H6    9   2.274e+06   10.0
H1'   9 M7    9   6.130e+05   10.0
H6    9 M7    9   1.044e+07   10.0
2H2'  9 H8   10   3.335e+06   28.4
H1'   9 H8   10   2.915e+06   10.0
H6    9 H8   10   1.203e+06   15.1
2H2' 10 H8   10   5.724e+06   10.0
H1'  10 1H2' 10   8.053e+06   12.6
H1'  10 H8   10   2.134e+06   10.0
H3'  10 H8   10   4.188e+06   10.0
2H2' 10 H8   11   8.092e+06   10.0
H1'  10 H8   11   3.578e+06   10.0
H2   10 H2   11   2.984e+06   16.1
H3'  10 H8   11   1.863e+06   10.0
H4'  10 H8   11   4.260e+05   10.0
H8   10 H8   11   1.317e+06   10.0
H1'  10 H2   19   8.678e+05   10.0
H2   10 H1'  19   1.243e+06   15.7
H2   10 H2   19   5.775e+06   10.0
H4'  10 H2   19   5.616e+05   10.0
1H2' 11 H8   11   1.136e+07   10.0
H1'  11 2H2' 11   1.382e+07   10.6
H1'  11 H2   11   1.090e+06   10.0
H1'  11 H4'  11   6.389e+06   10.0
H1'  11 H8   11   2.604e+06   20.8
H3'  11 1H2' 11   1.212e+07   10.0
H3'  11 H8   11   5.143e+06   10.0
H4'  11 H8   11   1.154e+06   10.0
1H2' 11 H6   12   5.453e+06   10.0
2H2' 11 H6   12   4.138e+06   10.0
H8   11 H6   12   1.909e+06   10.0
H1'  12 H2   11   8.156e+05   10.0
H5   12 1H2' 11   6.247e+06   10.0
H5   12 H8   11   4.234e+06   10.0
1H2' 12 H6   12   6.443e+06   10.0
H3'  12 2H2' 12   8.276e+06   10.0
H1'  12 H8   13   1.050e+06   10.0
H6   12 H8   13   9.439e+05   31.6
1H2' 13 H8   13   1.417e+07   10.0
2H2' 13 H8   13   6.909e+06   11.8
H3'  13 1H2' 13   8.974e+06   10.0
H3'  13 H8   13   3.908e+06   10.0
H4'  13 H8   13   7.132e+05   10.0
1H2' 13 H8   14   4.737e+06   12.4
2H2' 13 H8   14   9.381e+06   10.0
H3'  13 H8   14   2.562e+06   10.0
H4'  13 2H5' 14   9.831e+05   10.0
H4'  13 H8   14   1.486e+06   10.0
1H2' 14 H8   14   1.019e+07   10.0
1H5' 14 H8   14   3.831e+04   10.0
2H2' 14 H8   14   8.746e+06   19.3
2H5' 14 1H5' 14   2.891e+07   10.0
2H5' 14 H8   14   7.712e+05   10.0
H1'  14 H4'  14   3.619e+06   10.0
H1'  14 H8   14   5.254e+06   10.0
H3'  14 H8   14   3.887e+06   10.0
H4'  14 1H5' 14   1.212e+07   10.0
H4'  14 2H5' 14   1.353e+07   10.0
H4'  14 H8   14   5.228e+05   19.6
1H5' 14 H2   15   2.548e+06   10.0
2H5' 14 H2   15   9.477e+05   10.0
H4'  14 H2   15   1.046e+06   10.0
H1'  15 H8   15   1.940e+06   10.0 broad
H4'  15 H1'  15   3.233e+06   10.0
H1'  15 H8   16   2.176e+06   10.0 broad
H3'  15 H8   16   1.853e+06   10.0
2H5' 16 H1'  15   2.808e+06   10.0
H1'  16 H2   15   1.298e+06   10.0
H4'  16 H1'  15   1.178e+06   10.0
2H5' 16 H8   16   1.641e+06   10.0
H1'  16 H8   16   2.635e+06   10.0
H3'  16 H8   16   3.163e+06   10.0
H4'  16 H8   16   7.089e+05   10.0
H1'  16 H6   17   4.071e+06   10.0
H1'  16 M7   17   5.517e+06   19.0
H3'  16 M7   17   2.819e+06   10.0
H8   16 H6   17   2.505e+06   11.1
H8   16 M7   17   4.297e+06   10.0
1H2' 17 H6   17   1.400e+07   10.0
H1'  17 1H2' 17   8.750e+06   10.0
H1'  17 H6   17   3.441e+06   10.0
H3'  17 1H2' 17   1.109e+07   10.0
H4'  17 H6   17   1.395e+06   10.0
H6   17 M7   17   9.960e+06   10.0
2H2' 17 H6   18   6.340e+06   10.0
2H2' 17 M7   18   7.422e+06   10.0
H1'  17 H6   18   4.359e+06   10.0
H1'  17 M7   18   2.603e+06   10.0
H3'  17 M7   18   3.508e+06   10.0
H4'  17 M7   18   9.501e+05   10.0
H6   17 M7   18   7.003e+06   10.3
H1'  18 H2   11   9.652e+05   10.0
M7   18 M7   17   7.835e+06   10.0
2H2' 18 H6   18   5.836e+06   31.5
H1'  18 1H2' 18   6.579e+06   10.0
H1'  18 2H2' 18   1.291e+07   13.0
H1'  18 H6   18   2.485e+06   10.0
H3'  18 1H2' 18   1.105e+07   10.0
H4'  18 1H2' 18   2.745e+06   10.0
H6   18 M7   18   1.158e+07   10.0
1H2' 18 H8   19   3.013e+06   10.0
2H2' 18 H8   19   5.217e+06   10.0
H1'  18 H8   19   3.056e+06   10.0
H3'  18 H8   19   1.431e+06   10.0 INT?
H6   18 H8   19   2.043e+06   10.0
1H2' 19 H1'  19   1.109e+07   10.0
1H2' 19 H8   19   1.184e+07   10.0
2H2' 19 H8   19   7.554e+06   10.0
H1'  19 2H2' 19   1.501e+07   10.0
H1'  19 H2   19   1.065e+06   10.0
H1'  19 H8   19   4.330e+06   10.0
H3'  19 H8   19   3.599e+06   10.0
H4'  19 H8   19   1.723e+06   10.0
1H2' 19 M7   20   7.203e+06   10.0
2H2' 19 M7   20   7.413e+06   11.2
H1'  19 M7   20   4.009e+06   10.0
H3'  19 M7   20   4.673e+06   10.0
H4'  19 H6   20   7.200e+05   10.0
H4'  19 M7   20   2.528e+06   10.0
H8   19 H6   20   1.813e+06   10.0
H8   19 M7   20   1.064e+07   10.0
H1'  20 H2   19   1.087e+06   10.0
1H2' 20 M7   20   2.492e+06   10.0
2H2' 20 H6   20   8.722e+06   10.0
2H2' 20 M7   20   1.590e+06   10.0
H1'  20 1H2' 20   6.666e+06   10.0
H1'  20 2H2' 20   1.170e+07   10.0
H1'  20 H6   20   3.571e+06   10.0
H3'  20 M7   20   6.810e+05   10.0
H6   20 M7   20   1.439e+07   10.0
1H2' 20 H8   21   5.045e+06   16.7
2H2' 20 H8   21   6.072e+06   10.0
H1'  20 H8   21   4.323e+06   10.0
H3'  20 H8   21   2.586e+06   10.0
H6   20 H8   21   1.988e+06   10.0
H1'  21 H2    8   1.602e+06   10.0
1H2' 21 H8   21   1.437e+07   10.0
2H2' 21 H8   21   8.326e+06   10.0
H1'  21 1H2' 21   7.651e+06   10.0
H1'  21 H8   21   3.046e+06   10.0
H3'  21 H8   21   4.549e+06   10.0
H4'  21 H8   21   1.706e+06   10.0
1H2' 21 H8   22   5.533e+06   13.1
H1'  21 H8   22   5.322e+06   10.0
H2   21 H2   22   5.378e+06   10.0
H4'  21 H8   22   7.133e+05   10.0
1H2' 22 H8   22   1.248e+07   10.0
H1'  22 H8   22   3.276e+06   10.0
H3'  22 H8   22   5.706e+06   10.0
H4'  22 H8   22   1.243e+06   10.0
1H2' 22 M7   23   9.516e+06   10.0
2H2' 22 M7   23   8.075e+06   10.0
H1'  22 H6   23   4.099e+06   10.0
H1'  22 M7   23   3.613e+06   10.0
H3'  22 M7   23   3.890e+06   10.0
H4'  22 M7   23   1.406e+06   10.0
H8   22 H6   23   1.887e+06   15.8
H8   22 M7   23   8.676e+06   10.0
H1'  23 H2   22   1.588e+06   10.0
1H2' 23 M7   23   2.617e+06   10.0
H1'  23 1H2' 23   7.263e+06   16.1
H1'  23 2H2' 23   1.239e+07   10.0
H1'  23 H6   23   3.801e+06   10.0
H3'  23 1H2' 23   1.119e+07   10.0
H3'  23 H1'  23   5.759e+06   10.0
H6   23 M7   23   1.202e+07   10.0
1H2' 23 H6   24   4.671e+06   10.0
1H2' 23 M7   24   9.663e+06   10.0
2H2' 23 H6   24   5.759e+06   10.0
2H2' 23 M7   24   9.103e+06   12.8
H1'  23 H6   24   4.507e+06   17.4
H1'  23 M7   24   3.860e+06   10.0
H3'  23 H6   24   2.669e+06   10.0
H3'  23 M7   24   5.855e+06   10.0
H6   23 H6   24   1.999e+06   10.0
H6   23 M7   24   1.062e+07   10.0
H1'  24 H2    5   2.448e+06   10.0
M7   24 M7   23   8.765e+06   10.0
1H2' 24 H6   24   1.291e+07   10.0
2H2' 24 H6   24   7.806e+06   10.0
H1'  24 1H2' 24   8.268e+06   10.0
H1'  24 2H2' 24   1.250e+07   10.0
H1'  24 H6   24   3.534e+06   10.0
H3'  24 H6   24   4.010e+06   10.0
H6   24 M7   24   1.360e+07   10.0
2H2' 24 H8   25   4.118e+06   12.1
H1'  24 H8   25   2.608e+06   10.0
H6   24 H8   25   2.394e+06   10.0
2H2' 25 H8   25   9.518e+06   12.8
H1'  25 1H2' 25   9.650e+06   31.2
H1'  25 2H2' 25   1.154e+07   17.1
H1'  25 H8   25   3.772e+06   10.0
H3'  25 H8   25   4.588e+06   10.0
1H2' 25 H8   26   3.521e+06   50.9
2H2' 25 H8   26   5.567e+06   12.5
H1'  25 H8   26   3.686e+06   10.0
H3'  25 H8   26   2.036e+06   10.0
H8   25 H8   26   2.061e+06   10.0
1H2' 26 H8   26   1.305e+07   10.0
2H2' 26 H8   26   8.411e+06   12.4
H1'  26 1H2' 26   9.935e+06   22.8
H1'  26 2H2' 26   1.544e+07   11.6
H1'  26 H4'  26   8.863e+06   10.0
H1'  26 H8   26   2.872e+06   10.0
H3'  26 H8   26   4.084e+06   10.0
H4'  26 H8   26   1.667e+06   10.0
1H2' 26 H8   27   3.959e+06   10.0
2H2' 26 H8   27   5.732e+06   10.0
H1'  26 H8   27   7.636e+06   10.0
H3'  26 H8   27   2.634e+06   10.0
H4'  26 H8   27   9.635e+05   10.0
1H2' 27 H8   27   1.641e+07   11.5
2H2' 27 H8   27   8.589e+06   14.1
H1'  27 1H2' 27   1.405e+07   10.0
H1'  27 2H2' 27   2.300e+07   10.0
H1'  27 H8   27   5.168e+06   10.0
H3'  27 H1'  27   5.680e+06   10.0
H3'  27 H8   27   6.466e+06   10.0
H4'  27 2H2' 27   4.222e+06   10.0
H4'  27 H8   27   3.727e+06   10.0
#
#       (5)  Integrated intensities of cross-peaks in the 75-ms
#               D2O NOESY acquired without presat
#
MIXING TIME: 0.075
ATOM1   ATOM2   INTENSITY   ERROR    Note    
1H2'  1 H6    1   1.263e+07   10.0
H1'   1 1H2'  1   4.070e+06   15.8
H1'   1 2H2'  1   1.373e+07   10.0
H1'   1 H4'   1   4.375e+06   10.0
H3'   1 1H2'  1   9.207e+06   10.0
H3'   1 2H2'  1   3.226e+06   10.0
H3'   1 H4'   1   1.003e+07   10.0
H3'   1 H6    1   4.398e+06   10.0
H4'   1 H6    1   1.197e+06   10.0
1H2'  1 H5    2   2.778e+06   10.0
1H2'  1 H6    2   4.451e+06   10.0
2H2'  1 H6    2   4.352e+06   10.0
H1'   1 H6    2   1.999e+06   20.9
H3'   1 H5    2   4.196e+06   10.0
H3'   1 H6    2   9.955e+05   10.0
H6    1 H5    2   2.512e+06   10.0
H5    2 H1'   1   1.088e+06   10.0
H5    2 H5    1   2.175e+06   10.0
1H2'  2 H1'   2   4.628e+06   10.0
1H2'  2 H5    2   1.862e+06   10.0
1H2'  2 H6    2   1.281e+07   10.0
2H2'  2 H6    2   3.412e+06   14.0
H1'   2 2H2'  2   1.297e+07   10.0
H1'   2 H6    2   2.550e+06   10.0
H3'   2 1H2'  2   1.228e+07   10.0
H3'   2 H1'   2   2.057e+06   10.0
H3'   2 H6    2   2.529e+06   10.0
H4'   2 H1'   2   5.835e+06   10.0
H4'   2 H6    2   1.379e+06   10.0
2H2'  2 H6    3   5.758e+06   21.4
2H2'  2 M7    3   4.653e+06   10.0
H1'   2 H6    3   1.825e+06   10.0
H1'   2 M7    3   2.248e+06   10.0
H3'   2 M7    3   2.911e+06   10.0
H5    2 H6    3   4.605e+05   10.0
H5    2 M7    3   4.129e+06   14.8
H6    2 M7    3   5.725e+06   10.0
2H2'  3 H6    3   6.061e+06   10.0
H1'   3 2H2'  3   1.259e+07   10.0
H1'   3 H6    3   1.838e+06   30.8
H1'   3 M7    3   7.203e+05   10.0
H3'   3 1H2'  3   1.269e+07   10.0
H3'   3 H6    3   3.572e+06   10.0
H6    3 M7    3   1.156e+07   10.0
1H2'  3 H8    4   2.888e+06   10.0
2H2'  3 H8    4   3.459e+06   10.0
H1'   3 H8    4   1.949e+06   13.4
H6    3 H8    4   1.040e+06   10.0
1H2'  4 H8    4   1.371e+07   10.0
2H2'  4 H8    4   4.864e+06   12.0
H1'   4 1H2'  4   5.049e+06   10.0
H3'   4 1H2'  4   1.090e+07   10.0
H3'   4 H8    4   2.648e+06   10.0
H8    4 H1'   4   1.352e+06   10.0
1H2'  4 H8    5   3.936e+06   12.4
2H2'  4 H8    5   5.113e+06   10.9
H1'   4 1H5'  5   5.579e+06   10.0
H1'   4 H8    5   4.210e+06   10.0
H2    4 H2    5   3.452e+06   10.0
H3'   4 H8    5   2.112e+06   10.0
H2    4 H2   25   6.536e+06   10.0
1H2'  5 H8    5   1.121e+07   10.0
2H2'  5 H1'   5   1.173e+07   10.0
2H2'  5 H8    5   5.755e+06   10.0
H1'   5 H8    5   2.089e+06   10.0
H3'   5 H8    5   2.118e+06   10.0
1H2'  5 M7    6   6.194e+06   10.0
2H2'  5 M7    6   6.553e+06   10.0
H1'   5 H6    6   3.833e+06   11.2
H1'   5 M7    6   2.420e+06   10.0
H2    5 H1'   6   1.817e+06   10.0
H3'   5 M7    6   2.675e+06   10.0
H8    5 M7    6   6.686e+06   10.0
H1'   6 1H2'  6   5.205e+06   37.2
H1'   6 2H2'  6   9.567e+06   10.0
H1'   6 H6    6   1.489e+06   10.0
H3'   6 H1'   6   3.166e+06   10.0
H3'   6 H6    6   3.018e+06   10.0
H4'   6 H1'   6   8.831e+06   10.0
H6    6 M7    6   9.640e+06   17.0
1H2'  6 H6    7   3.357e+06   10.0
1H2'  6 M7    7   9.779e+06   14.2
2H2'  6 H6    7   2.432e+06   10.0
2H2'  6 M7    7   3.368e+06   18.6
H1'   6 H6    7   2.037e+06   10.0
H1'   6 M7    7   9.090e+05   10.0
H3'   6 H6    7   1.948e+06   10.0
H3'   6 M7    7   1.756e+06   10.0
H6    6 M7    7   6.112e+06   10.0
M7    6 M7    7   6.299e+06   19.7
1H2'  7 H6    7   1.000e+07   10.0
2H2'  7 H6    7   4.337e+06   10.0
H1'   7 H4'   7   7.852e+06   10.0
H1'   7 H6    7   2.748e+06   12.3
H6    7 M7    7   7.792e+06   10.0
1H2'  7 H8    8   2.656e+06   10.0
H6    7 H8    8   9.445e+05   10.0
H1'   7 H2   22   1.856e+06   10.0
H8    8 H1'   7   2.665e+06   10.0
2H2'  8 H1'   8   1.033e+07   10.0
2H2'  8 H8    8   5.120e+06   20.3
H1'   8 H2    8   9.660e+05   10.0
H3'   8 H8    8   1.341e+06   10.0
H4'   8 H1'   8   1.926e+06   10.0
H8    8 H1'   8   1.461e+06   10.0
1H2'  8 M7    9   4.445e+06   10.0
2H2'  8 M7    9   4.785e+06   19.1
H1'   8 H6    9   1.744e+06   29.0
H1'   8 M7    9   1.518e+06   23.2
H3'   8 M7    9   1.068e+06   10.0
H8    8 M7    9   4.276e+06   10.0
H2    8 H2   21   5.123e+06   10.0
H1'   9 H2    8   1.317e+06   10.0
H6    9 H8    8   1.119e+06   10.0
1H2'  9 H6    9   1.142e+07   10.0
2H2'  9 H6    9   3.484e+06   10.0
H1'   9 H6    9   1.593e+06   10.0
H4'   9 H1'   9   5.285e+06   10.0
H6    9 M7    9   7.583e+06   15.8
2H2'  9 H8   10   3.409e+06   10.0
H1'   9 H8   10   1.417e+06   10.0
2H2' 10 H8   10   3.231e+06   10.0
H3'  10 2H2' 10   6.980e+06   10.0
1H2' 10 H8   11   4.480e+06   10.0
2H2' 10 H8   11   6.638e+06   10.0
H1'  10 H8   11   2.307e+06   21.9
H2   10 H2   11   1.799e+06   10.0
H3'  10 H8   11   9.053e+05   10.0
H8   10 H8   11   8.296e+05   10.0
H2   10 H2   19   3.590e+06   10.0
1H2' 11 H8   11   1.024e+07   10.0
2H2' 11 H8   11   2.741e+06   10.0
H1'  11 1H2' 11   4.513e+06   10.0
H1'  11 2H2' 11   1.035e+07   10.0
H1'  11 H2   11   8.634e+05   10.0
H1'  11 H4'  11   5.011e+06   10.0
H1'  11 H8   11   1.340e+06   10.0
H3'  11 H8   11   2.843e+06   10.0
2H2' 11 H6   12   4.341e+06   10.0
H5   12 1H2' 11   4.112e+06   10.0
H5   12 H8   11   2.540e+06   10.0
1H2' 12 H6   12   7.181e+06   10.0
H1'  12 H4'  12   6.338e+06   10.0
H3'  12 1H2' 12   9.825e+06   10.0
H3'  12 2H2' 12   6.075e+06   10.0
H6   12 H8   13   8.577e+05   10.0
1H2' 13 H8   13   1.206e+07   10.0
2H2' 13 H8   13   4.294e+06   13.5
H3'  13 1H2' 13   7.393e+06   10.0
H3'  13 H8   13   1.222e+06   10.0
2H2' 13 H8   14   7.044e+06   10.0
H1'  13 H8   14   2.731e+06   10.0
H4'  13 H2   15   6.304e+05   10.0
1H2' 14 H8   14   6.839e+06   11.6
2H2' 14 H8   14   5.505e+06   14.1
2H5' 14 1H5' 14   3.047e+07   10.0
H1'  14 H8   14   2.551e+06   21.8
H3'  14 1H2' 14   7.130e+06   10.0
H3'  14 1H5' 14   2.269e+06   10.0
H3'  14 2H2' 14   6.498e+06   10.0
H3'  14 2H5' 14   8.207e+06   10.0
H3'  14 H1'  14   2.765e+06   10.0
H3'  14 H4'  14   6.463e+06   10.0
H3'  14 H8   14   1.604e+06   10.0
H4'  14 1H5' 14   7.785e+06   10.0
H4'  14 2H5' 14   9.323e+06   10.0
2H5' 14 H2   15   8.896e+05   22.9
H4'  14 H2   15   1.092e+06   10.0
H1'  15 H8   16   1.050e+06   10.0
H3'  15 H8   16   8.806e+05   10.0
H1'  16 H2   15   8.870e+05   10.0
H1'  16 H8   16   1.436e+06   10.0
H3'  16 H8   16   2.791e+06   10.0
H1'  16 H6   17   4.234e+06   34.1
H1'  16 M7   17   2.320e+06   10.0
H8   16 M7   17   2.439e+06   13.8
H6   17 H8   16   1.256e+06   10.0
1H2' 17 H6   17   1.309e+07   10.0
H1'  17 1H2' 17   4.354e+06   10.0
H1'  17 H6   17   1.880e+06   10.0
H4'  17 1H2' 17   9.201e+05   10.0
H6   17 M7   17   6.768e+06   10.0
2H2' 17 H6   18   6.690e+06   10.0
2H2' 17 M7   18   4.012e+06   10.0
H1'  17 H6   18   2.543e+06   10.0
H1'  17 M7   18   1.293e+06   10.0
H6   17 M7   18   4.034e+06   10.0
M7   17 M7   18   4.652e+06   15.8
M7   18 1H2' 17   8.071e+06   10.0
2H2' 18 H6   18   4.443e+06   10.5
H1'  18 1H2' 18   5.384e+06   10.0
H1'  18 2H2' 18   1.010e+07   10.0
H1'  18 H6   18   1.458e+06   10.0
H6   18 M7   18   7.786e+06   10.0
1H2' 18 H8   19   2.341e+06   10.0
2H2' 18 H8   19   5.045e+06   10.0
H1'  18 H8   19   2.479e+06   10.0
1H2' 19 H8   19   1.054e+07   10.0
2H2' 19 H1'  19   1.290e+07   10.0
2H2' 19 H8   19   4.545e+06   10.0
H1'  19 H8   19   2.013e+06   10.0
H3'  19 H8   19   2.104e+06   10.0
H4'  19 H1'  19   6.744e+06   10.0
1H2' 19 M7   20   4.794e+06   10.0
2H2' 19 M7   20   4.784e+06   11.8
H1'  19 H6   20   2.495e+06   20.6
H1'  19 M7   20   2.017e+06   19.3
H3'  19 M7   20   2.353e+06   10.0
H8   19 H6   20   1.434e+06   10.0
H8   19 M7   20   6.934e+06   10.0
H1'  20 H2   19   8.024e+05   10.0
1H2' 20 H6   20   1.460e+07   10.0
2H2' 20 H6   20   4.977e+06   10.0
H1'  20 2H2' 20   1.386e+07   34.1
H1'  20 H6   20   1.814e+06   10.0
H6   20 M7   20   1.036e+07   10.0
1H2' 20 H8   21   2.923e+06   10.0
2H2' 20 H8   21   4.652e+06   11.2
H1'  20 H8   21   3.322e+06   10.0
H3'  20 H8   21   1.835e+06   10.0
H1'  21 H2    8   1.318e+06   10.0
1H2' 21 H8   21   1.273e+07   10.0
2H2' 21 H8   21   5.176e+06   13.4
H1'  21 1H2' 21   5.775e+06   29.5
H1'  21 H8   21   1.372e+06   23.4
H3'  21 H8   21   2.103e+06   10.0
H4'  21 H8   21   6.081e+05   10.0
1H2' 21 H8   22   3.715e+06   10.0
H1'  21 H8   22   3.793e+06   14.0
H2   21 H2   22   2.707e+06   23.7
1H2' 22 H8   22   1.114e+07   10.0
2H2' 22 H1'  22   9.582e+06   10.0
H1'  22 H8   22   1.360e+06   10.0
H3'  22 H8   22   2.600e+06   10.0
1H2' 22 M7   23   6.931e+06   10.0
2H2' 22 M7   23   5.196e+06   10.0
H1'  22 H6   23   2.532e+06   10.4
H1'  22 M7   23   1.809e+06   10.0
H3'  22 M7   23   2.183e+06   10.0
H8   22 M7   23   5.705e+06   10.0
H1'  23 H2   22   9.072e+05   10.0
H6   23 H8   22   9.179e+05   10.0
2H2' 23 H1'  23   1.195e+07   10.0
H1'  23 1H2' 23   5.822e+06   12.2
H1'  23 H6   23   1.781e+06   16.4
H3'  23 H1'  23   3.735e+06   10.0
H6   23 M7   23   8.828e+06   10.0
1H2' 23 H6   24   4.048e+06   10.0
1H2' 23 M7   24   1.062e+07   10.0
2H2' 23 H6   24   8.358e+06   10.0
2H2' 23 M7   24   5.320e+06   10.0
H1'  23 H6   24   2.255e+06   17.0
H1'  23 M7   24   1.607e+06   12.5
H3'  23 H6   24   1.434e+06   10.0
H3'  23 M7   24   3.092e+06   10.0
H6   23 H6   24   1.242e+06   10.0
H6   23 M7   24   7.093e+06   10.0
M7   23 M7   24   5.201e+06   17.0
H1'  24 H2    4   7.854e+05   10.0
H1'  24 H2    5   1.482e+06   10.0
1H2' 24 H6   24   1.307e+07   10.0
2H2' 24 H6   24   4.330e+06   20.9
H1'  24 1H2' 24   5.032e+06   10.0
H1'  24 2H2' 24   1.098e+07   10.0
H1'  24 H6   24   2.370e+06   10.0
H3'  24 H6   24   1.637e+06   10.0
H6   24 M7   24   9.215e+06   10.0
2H2' 24 H8   25   4.201e+06   10.0
H1'  24 H8   25   1.435e+06   10.0
H6   24 H8   25   1.219e+06   10.0
2H2' 25 H8   25   6.117e+06   10.0
H1'  25 2H2' 25   1.170e+07   10.0
2H2' 25 H8   26   4.256e+06   10.0
H1'  25 H8   26   1.832e+06   10.0
H3'  25 H8   26   1.369e+06   10.0
H8   25 H8   26   1.350e+06   16.9
1H2' 26 H8   26   1.292e+07   10.2
2H2' 26 H8   26   8.837e+06   10.0
H1'  26 1H2' 26   5.807e+06   10.0
H1'  26 2H2' 26   1.211e+07   10.6
H1'  26 H4'  26   8.047e+06   10.0
H1'  26 H8   26   1.255e+06   10.0
H3'  26 H8   26   2.119e+06   10.0
1H2' 26 H8   27   2.754e+06   10.0
2H2' 26 H8   27   4.641e+06   10.0
H1'  26 H1'  27   6.456e+05   10.0
H1'  26 H8   27   4.664e+06   10.0
H3'  26 H8   27   1.240e+06   10.0
H4'  26 H8   27   5.152e+05   10.0
1H2' 27 H8   27   1.214e+07   11.8
2H2' 27 H8   27   4.734e+06   17.3
H1'  27 1H2' 27   1.002e+07   10.0
H1'  27 2H2' 27   1.639e+07   10.0
H1'  27 H4'  27   5.977e+06   13.2
H1'  27 H8   27   2.402e+06   11.7
H3'  27 1H2' 27   9.911e+06   10.0
H3'  27 2H2' 27   7.150e+06   10.0
H3'  27 H1'  27   2.358e+06   10.0
H3'  27 H4'  27   8.481e+06   10.0
H3'  27 H8   27   3.069e+06   10.0
H4'  27 2H2' 27   1.965e+06   10.0
H4'  27 H8   27   2.101e+06   10.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    C   1          1H5*        C   1   6.343 -21.416  15.151
    2   2H5*    C   1          2H5*        C   1   5.284 -21.252  16.552
    3    H4*    C   1           H4*        C   1   4.574 -22.317  13.873
    4    H3*    C   1           H3*        C   1   4.276 -19.559  14.912
    5    H1*    C   1           H1*        C   1   1.647 -22.333  13.917
    6   1H4     C   1          1H4         C   1  -3.301 -22.033  17.763
    7   2H4     C   1          2H4         C   1  -2.323 -21.526  19.097
    8    H5     C   1           H5         C   1   0.060 -21.111  18.915
    9    H6     C   1           H6         C   1   1.964 -21.114  17.368
   10   1H2*    C   1          1H2*        C   1   1.967 -19.585  14.917
   11   2H2*    C   1          2H2*        C   1   1.984 -20.185  13.260
   12   1H5*    C   2          1H5*        C   2   2.464 -20.158  10.869
   13   2H5*    C   2          2H5*        C   2   3.204 -18.879   9.906
   14    H4*    C   2           H4*        C   2   0.947 -19.048   9.310
   15    H3*    C   2           H3*        C   2   1.914 -16.584   9.959
   16    H1*    C   2           H1*        C   2  -1.537 -17.766  11.219
   17   1H4     C   2          1H4         C   2  -2.935 -18.685  17.260
   18   2H4     C   2          2H4         C   2  -1.288 -18.480  17.754
   19    H5     C   2           H5         C   2   0.526 -18.084  16.194
   20    H6     C   2           H6         C   2   1.083 -17.811  13.820
   21   1H2*    C   2          1H2*        C   2   1.012 -16.513  12.210
   22   2H2*    C   2          2H2*        C   2  -0.301 -15.785  11.285
   23   1H5*    T   3          1H5*        T   3  -2.529 -16.357   9.032
   24   2H5*    T   3          2H5*        T   3  -2.762 -14.983   7.951
   25    H4*    T   3           H4*        T   3  -4.531 -15.017   9.478
   26    H3*    T   3           H3*        T   3  -2.925 -12.705   9.351
   27   1H2*    T   3          1H2*        T   3  -2.197 -12.743  11.606
   28   2H2*    T   3          2H2*        T   3  -3.816 -12.101  11.884
   29    H1*    T   3           H1*        T   3  -4.690 -14.189  12.471
   30    H3     T   3           H3         T   3  -3.444 -15.353  16.503
   31   1H5M    T   3          1H5M        T   3   0.917 -13.653  15.161
   32   2H5M    T   3          2H5M        T   3   1.032 -14.567  13.658
   33   3H5M    T   3          3H5M        T   3   1.029 -15.412  15.207
   34    H6     T   3           H6         T   3  -1.002 -14.144  12.581
   35   1H5*    A   4          1H5*        A   4  -7.508 -12.411  10.233
   36   2H5*    A   4          2H5*        A   4  -8.046 -10.825   9.680
   37    H4*    A   4           H4*        A   4  -9.332 -11.651  11.541
   38    H3*    A   4           H3*        A   4  -8.609  -9.041  11.358
   39    H1*    A   4           H1*        A   4  -8.200 -10.939  14.694
   40    H8     A   4           H8         A   4  -4.716 -10.424  13.080
   41   1H6     A   4          1H6         A   4  -2.570 -12.755  18.373
   42   2H6     A   4          2H6         A   4  -2.148 -12.054  16.849
   43    H2     A   4           H2         A   4  -7.055 -12.924  18.479
   44   1H2*    A   4          1H2*        A   4  -6.649  -9.199  12.794
   45   2H2*    A   4          2H2*        A   4  -7.906  -8.749  13.945
   46   1H5*    A   5          1H5*        A   5 -11.216 -10.386  14.785
   47   2H5*    A   5          2H5*        A   5 -12.551  -9.241  14.910
   48    H4*    A   5           H4*        A   5 -12.236 -10.235  17.002
   49    H3*    A   5           H3*        A   5 -12.343  -7.522  16.903
   50    H1*    A   5           H1*        A   5  -9.682  -9.295  19.065
   51    H8     A   5           H8         A   5  -7.987  -7.884  15.871
   52   1H6     A   5          1H6         A   5  -2.731  -9.421  18.713
   53   2H6     A   5          2H6         A   5  -3.432  -8.679  17.316
   54    H2     A   5           H2         A   5  -6.160 -10.745  21.288
   55   1H2*    A   5          1H2*        A   5  -9.941  -7.149  16.975
   56   2H2*    A   5          2H2*        A   5 -10.363  -7.096  18.686
   57   1H5*    T   6          1H5*        T   6 -12.053  -9.178  21.204
   58   2H5*    T   6          2H5*        T   6 -12.928  -8.126  22.315
   59    H4*    T   6           H4*        T   6 -10.905  -8.924  23.256
   60    H3*    T   6           H3*        T   6 -11.255  -5.996  22.950
   61   1H2*    T   6          1H2*        T   6  -8.995  -5.522  22.896
   62   2H2*    T   6          2H2*        T   6  -8.759  -6.528  24.326
   63    H1*    T   6           H1*        T   6  -8.046  -8.295  23.097
   64    H3     T   6           H3         T   6  -4.326  -6.997  21.137
   65   1H5M    T   6          1H5M        T   6  -7.259  -4.187  18.396
   66   2H5M    T   6          2H5M        T   6  -8.391  -5.482  18.001
   67   3H5M    T   6          3H5M        T   6  -6.722  -5.566  17.436
   68    H6     T   6           H6         T   6  -8.943  -6.272  20.157
   69   1H5*    T   7          1H5*        T   7  -9.298  -7.549  26.550
   70   2H5*    T   7          2H5*        T   7  -9.784  -6.639  27.980
   71    H4*    T   7           H4*        T   7  -7.435  -7.102  27.982
   72    H3*    T   7           H3*        T   7  -8.416  -4.578  28.566
   73   1H2*    T   7          1H2*        T   7  -7.656  -3.505  26.559
   74   2H2*    T   7          2H2*        T   7  -6.191  -3.392  27.535
   75    H1*    T   7           H1*        T   7  -5.207  -5.256  26.518
   76    H3     T   7           H3         T   7  -3.665  -4.086  22.594
   77   1H5M    T   7          1H5M        T   7  -7.840  -2.060  21.674
   78   2H5M    T   7          2H5M        T   7  -8.947  -3.080  22.594
   79   3H5M    T   7          3H5M        T   7  -8.197  -3.697  21.121
   80    H6     T   7           H6         T   7  -8.052  -4.062  24.480
   81   1H5*    A   8          1H5*        A   8  -3.818  -5.251  29.186
   82   2H5*    A   8          2H5*        A   8  -3.633  -4.674  30.842
   83    H4*    A   8           H4*        A   8  -1.640  -4.223  29.745
   84    H3*    A   8           H3*        A   8  -2.913  -2.088  30.918
   85    H1*    A   8           H1*        A   8  -1.160  -1.850  27.482
   86    H8     A   8           H8         A   8  -5.008  -1.743  26.962
   87   1H6     A   8          1H6         A   8  -3.559  -0.171  21.175
   88   2H6     A   8          2H6         A   8  -4.846  -0.436  22.301
   89    H2     A   8           H2         A   8   0.251  -0.955  23.414
   90   1H2*    A   8          1H2*        A   8  -3.719  -1.088  28.874
   91   2H2*    A   8          2H2*        A   8  -2.124  -0.346  28.996
   92   1H5*    T   9          1H5*        T   9   1.332  -1.490  29.273
   93   2H5*    T   9          2H5*        T   9   2.215  -0.511  30.445
   94    H4*    T   9           H4*        T   9   3.013  -0.092  28.249
   95    H3*    T   9           H3*        T   9   2.259   2.027  29.913
   96   1H2*    T   9          1H2*        T   9   0.432   2.791  28.589
   97   2H2*    T   9          2H2*        T   9   1.748   3.542  27.688
   98    H1*    T   9           H1*        T   9   1.788   1.850  26.072
   99    H3     T   9           H3         T   9  -1.547   2.480  23.314
  100   1H5M    T   9          1H5M        T   9  -4.248   2.929  27.346
  101   2H5M    T   9          2H5M        T   9  -3.690   1.444  28.117
  102   3H5M    T   9          3H5M        T   9  -4.624   1.365  26.622
  103    H6     T   9           H6         T   9  -1.355   1.613  28.006
  104   1H5*    A  10          1H5*        A  10   4.772   3.075  26.236
  105   2H5*    A  10          2H5*        A  10   5.894   4.375  26.637
  106    H4*    A  10           H4*        A  10   5.016   4.643  24.450
  107    H3*    A  10           H3*        A  10   4.721   6.766  26.396
  108    H1*    A  10           H1*        A  10   2.552   5.744  23.291
  109    H8     A  10           H8         A  10   0.569   5.457  26.617
  110   1H6     A  10          1H6         A  10  -4.364   5.607  22.916
  111   2H6     A  10          2H6         A  10  -3.811   5.485  24.551
  112    H2     A  10           H2         A  10  -0.685   5.954  20.369
  113   1H2*    A  10          1H2*        A  10   2.471   7.199  25.920
  114   2H2*    A  10          2H2*        A  10   3.070   7.759  24.359
  115   1H5*    A  11          1H5*        A  11   5.346   7.604  21.908
  116   2H5*    A  11          2H5*        A  11   6.355   9.045  21.794
  117    H4*    A  11           H4*        A  11   4.800   8.909  19.981
  118    H3*    A  11           H3*        A  11   5.217  11.266  21.313
  119    H1*    A  11           H1*        A  11   1.688  10.091  20.276
  120    H8     A  11           H8         A  11   2.073   9.753  24.122
  121   1H6     A  11          1H6         A  11  -3.982   8.574  24.014
  122   2H6     A  11          2H6         A  11  -2.591   8.800  25.018
  123    H2     A  11           H2         A  11  -2.567   9.053  19.782
  124   1H2*    A  11          1H2*        A  11   3.192  11.202  22.634
  125   2H2*    A  11          2H2*        A  11   2.623  12.031  21.184
  126   1H5*    C  12          1H5*        C  12   2.229  11.566  17.718
  127   2H5*    C  12          2H5*        C  12   2.733  13.039  16.890
  128    H4*    C  12           H4*        C  12   0.399  12.839  16.731
  129    H3*    C  12           H3*        C  12   1.492  15.178  17.848
  130    H1*    C  12           H1*        C  12  -1.840  13.447  18.819
  131   1H4     C  12          1H4         C  12  -3.171  11.890  24.729
  132   2H4     C  12          2H4         C  12  -1.517  12.020  25.226
  133    H5     C  12           H5         C  12   0.280  12.618  23.713
  134    H6     C  12           H6         C  12   0.810  13.212  21.392
  135   1H2*    C  12          1H2*        C  12   0.478  14.972  19.984
  136   2H2*    C  12          2H2*        C  12  -0.923  15.580  19.101
  137   1H5*    G  13          1H5*        G  13  -2.787  15.495  16.810
  138   2H5*    G  13          2H5*        G  13  -3.136  17.008  15.973
  139    H4*    G  13           H4*        G  13  -4.833  16.474  17.565
  140    H3*    G  13           H3*        G  13  -3.896  19.012  17.351
  141    H1*    G  13           H1*        G  13  -4.372  17.411  20.830
  142    H8     G  13           H8         G  13  -0.634  18.007  20.199
  143    H1     G  13           H1         G  13  -2.109  14.752  25.522
  144   1H2     G  13          1H2         G  13  -4.309  14.248  25.556
  145   2H2     G  13          2H2         G  13  -5.311  14.741  24.255
  146   1H2*    G  13          1H2*        G  13  -2.316  18.877  19.198
  147   2H2*    G  13          2H2*        G  13  -3.757  19.502  19.998
  148   1H5*    A  14          1H5*        A  14  -7.878  18.199  18.836
  149   2H5*    A  14          2H5*        A  14  -9.129  19.443  18.825
  150    H4*    A  14           H4*        A  14  -9.458  17.855  20.584
  151    H3*    A  14           H3*        A  14  -9.833  20.501  21.022
  152    H1*    A  14           H1*        A  14  -7.822  18.413  23.568
  153    H8     A  14           H8         A  14  -5.299  20.309  21.289
  154   1H6     A  14          1H6         A  14  -1.197  18.826  25.653
  155   2H6     A  14          2H6         A  14  -1.446  19.647  24.150
  156    H2     A  14           H2         A  14  -5.171  17.091  26.812
  157   1H2*    A  14          1H2*        A  14  -7.623  20.939  21.953
  158   2H2*    A  14          2H2*        A  14  -8.574  20.613  23.402
  159   1H5*    A  15          1H5*        A  15 -12.705  18.325  25.584
  160   2H5*    A  15          2H5*        A  15 -11.068  18.358  24.928
  161    H4*    A  15           H4*        A  15 -13.253  16.709  23.763
  162    H3*    A  15           H3*        A  15 -12.373  16.078  26.302
  163    H1*    A  15           H1*        A  15 -11.091  14.344  23.095
  164    H8     A  15           H8         A  15  -8.147  15.340  25.107
  165   1H6     A  15          1H6         A  15  -4.820  14.926  19.927
  166   2H6     A  15          2H6         A  15  -4.764  15.079  21.651
  167    H2     A  15           H2         A  15  -9.167  14.767  18.822
  168   1H2*    A  15          1H2*        A  15 -10.116  15.518  25.690
  169   2H2*    A  15          2H2*        A  15 -10.912  13.971  25.398
  170   1H5*    G  16          1H5*        G  16 -14.020  11.175  25.877
  171   2H5*    G  16          2H5*        G  16 -12.343  10.666  26.082
  172    H4*    G  16           H4*        G  16 -13.636  12.120  23.869
  173    H3*    G  16           H3*        G  16 -13.364   9.497  23.736
  174    H1*    G  16           H1*        G  16 -10.279  11.370  22.428
  175    H8     G  16           H8         G  16  -9.934  11.188  26.320
  176    H1     G  16           H1         G  16  -4.563  12.116  22.945
  177   1H2     G  16          1H2         G  16  -5.016  12.154  20.735
  178   2H2     G  16          2H2         G  16  -6.632  11.949  20.197
  179   1H2*    G  16          1H2*        G  16 -11.035   9.439  24.585
  180   2H2*    G  16          2H2*        G  16 -10.869   9.178  22.849
  181   1H5*    T  17          1H5*        T  17 -11.460  11.440  19.945
  182   2H5*    T  17          2H5*        T  17 -12.408  10.621  18.704
  183    H4*    T  17           H4*        T  17 -10.343  11.206  17.780
  184    H3*    T  17           H3*        T  17 -11.148   8.602  17.554
  185   1H2*    T  17          1H2*        T  17  -9.715   7.714  19.291
  186   2H2*    T  17          2H2*        T  17  -8.665   7.577  17.881
  187    H1*    T  17           H1*        T  17  -7.496   9.534  18.389
  188    H3     T  17           H3         T  17  -4.664   8.723  21.631
  189   1H5M    T  17          1H5M        T  17  -7.993   6.774  24.197
  190   2H5M    T  17          2H5M        T  17  -9.495   7.241  23.396
  191   3H5M    T  17          3H5M        T  17  -8.661   8.388  24.447
  192    H6     T  17           H6         T  17  -9.419   8.396  21.336
  193   1H5*    T  18          1H5*        T  18  -7.268   9.778  15.272
  194   2H5*    T  18          2H5*        T  18  -7.330   8.930  13.727
  195    H4*    T  18           H4*        T  18  -5.084   9.142  14.508
  196    H3*    T  18           H3*        T  18  -6.061   6.715  13.588
  197   1H2*    T  18          1H2*        T  18  -6.087   5.595  15.707
  198   2H2*    T  18          2H2*        T  18  -4.401   5.342  15.258
  199    H1*    T  18           H1*        T  18  -3.641   7.120  16.578
  200    H3     T  18           H3         T  18  -3.587   5.933  20.792
  201   1H5M    T  18          1H5M        T  18  -7.945   4.089  20.078
  202   2H5M    T  18          2H5M        T  18  -8.632   5.333  19.032
  203   3H5M    T  18          3H5M        T  18  -8.307   5.687  20.730
  204    H6     T  18           H6         T  18  -7.070   6.124  17.530
  205   1H5*    A  19          1H5*        A  19  -1.485   6.972  14.569
  206   2H5*    A  19          2H5*        A  19  -0.821   6.398  13.039
  207    H4*    A  19           H4*        A  19   0.694   5.743  14.634
  208    H3*    A  19           H3*        A  19  -0.454   3.688  13.196
  209    H1*    A  19           H1*        A  19   0.328   3.481  16.975
  210    H8     A  19           H8         A  19  -3.513   3.583  16.441
  211   1H6     A  19          1H6         A  19  -3.769   2.344  22.480
  212   2H6     A  19          2H6         A  19  -4.688   2.580  21.031
  213    H2     A  19           H2         A  19   0.540   2.842  21.329
  214   1H2*    A  19          1H2*        A  19  -1.826   2.828  14.975
  215   2H2*    A  19          2H2*        A  19  -0.317   1.977  15.303
  216   1H5*    T  20          1H5*        T  20   3.326   2.952  15.594
  217   2H5*    T  20          2H5*        T  20   4.394   1.810  14.777
  218    H4*    T  20           H4*        T  20   4.611   1.642  17.145
  219    H3*    T  20           H3*        T  20   4.221  -0.630  15.569
  220   1H2*    T  20          1H2*        T  20   2.075  -1.212  16.435
  221   2H2*    T  20          2H2*        T  20   3.081  -1.896  17.712
  222    H1*    T  20           H1*        T  20   2.786  -0.047  19.119
  223    H3     T  20           H3         T  20  -1.163  -0.378  20.964
  224   1H5M    T  20          1H5M        T  20  -2.832  -1.043  16.465
  225   2H5M    T  20          2H5M        T  20  -1.950   0.277  15.693
  226   3H5M    T  20          3H5M        T  20  -3.208   0.630  16.879
  227    H6     T  20           H6         T  20   0.252   0.110  16.429
  228   1H5*    A  21          1H5*        A  21   5.552  -1.241  19.968
  229   2H5*    A  21          2H5*        A  21   6.900  -2.370  19.828
  230    H4*    A  21           H4*        A  21   5.827  -2.780  21.859
  231    H3*    A  21           H3*        A  21   6.186  -4.901  20.154
  232    H1*    A  21           H1*        A  21   2.945  -4.392  22.195
  233    H8     A  21           H8         A  21   2.226  -3.714  18.445
  234   1H6     A  21          1H6         A  21  -3.670  -3.475  20.244
  235   2H6     A  21          2H6         A  21  -2.587  -3.415  18.896
  236    H2     A  21           H2         A  21  -1.111  -4.040  23.888
  237   1H2*    A  21          1H2*        A  21   3.891  -5.056  19.415
  238   2H2*    A  21          2H2*        A  21   3.846  -6.081  20.850
  239   1H5*    A  22          1H5*        A  22   4.990  -5.861  24.580
  240   2H5*    A  22          2H5*        A  22   5.956  -7.279  24.992
  241    H4*    A  22           H4*        A  22   3.913  -7.279  26.199
  242    H3*    A  22           H3*        A  22   4.763  -9.558  24.965
  243    H1*    A  22           H1*        A  22   1.069  -8.454  24.789
  244    H8     A  22           H8         A  22   2.729  -7.973  21.327
  245   1H6     A  22          1H6         A  22  -2.954  -6.459  19.462
  246   2H6     A  22          2H6         A  22  -1.320  -6.740  18.970
  247    H2     A  22           H2         A  22  -3.058  -7.107  23.901
  248   1H2*    A  22          1H2*        A  22   3.321  -9.378  23.022
  249   2H2*    A  22          2H2*        A  22   2.311 -10.315  24.122
  250   1H5*    T  23          1H5*        T  23   1.046 -10.053  27.656
  251   2H5*    T  23          2H5*        T  23   0.918 -11.692  28.298
  252    H4*    T  23           H4*        T  23  -1.186 -10.712  27.635
  253    H3*    T  23           H3*        T  23  -0.325 -13.336  26.585
  254   1H2*    T  23          1H2*        T  23  -1.475 -13.159  24.589
  255   2H2*    T  23          2H2*        T  23  -2.935 -12.777  25.501
  256    H1*    T  23           H1*        T  23  -2.710 -10.536  25.153
  257    H3     T  23           H3         T  23  -3.311 -10.015  20.828
  258   1H5M    T  23          1H5M        T  23   1.077 -12.153  20.400
  259   2H5M    T  23          2H5M        T  23   1.868 -11.129  21.599
  260   3H5M    T  23          3H5M        T  23   1.250 -10.423  20.105
  261    H6     T  23           H6         T  23   0.430 -11.408  23.451
  262   1H5*    T  24          1H5*        T  24  -4.605 -12.720  27.426
  263   2H5*    T  24          2H5*        T  24  -5.269 -14.155  28.208
  264    H4*    T  24           H4*        T  24  -6.795 -13.297  26.602
  265    H3*    T  24           H3*        T  24  -6.149 -15.989  26.631
  266   1H2*    T  24          1H2*        T  24  -4.871 -15.997  24.599
  267   2H2*    T  24          2H2*        T  24  -6.495 -16.185  23.937
  268    H1*    T  24           H1*        T  24  -6.692 -13.913  23.414
  269    H3     T  24           H3         T  24  -4.401 -13.031  19.789
  270   1H5M    T  24          1H5M        T  24  -0.766 -15.428  21.608
  271   2H5M    T  24          2H5M        T  24  -0.995 -15.193  23.342
  272   3H5M    T  24          3H5M        T  24  -0.426 -13.859  22.339
  273    H6     T  24           H6         T  24  -3.163 -14.815  24.042
  274   1H5*    A  25          1H5*        A  25  -9.670 -14.802  23.761
  275   2H5*    A  25          2H5*        A  25 -10.905 -15.953  24.269
  276    H4*    A  25           H4*        A  25 -11.183 -15.530  21.987
  277    H3*    A  25           H3*        A  25 -11.081 -18.123  22.779
  278    H1*    A  25           H1*        A  25  -9.121 -16.981  19.657
  279    H8     A  25           H8         A  25  -6.659 -17.879  22.470
  280   1H6     A  25          1H6         A  25  -2.284 -16.315  18.410
  281   2H6     A  25          2H6         A  25  -2.605 -16.988  19.972
  282    H2     A  25           H2         A  25  -6.278 -15.322  16.623
  283   1H2*    A  25          1H2*        A  25  -8.737 -18.485  22.231
  284   2H2*    A  25          2H2*        A  25  -9.540 -18.999  20.747
  285   1H5*    G  26          1H5*        G  26 -12.694 -17.207  18.483
  286   2H5*    G  26          2H5*        G  26 -13.923 -18.440  18.202
  287    H4*    G  26           H4*        G  26 -12.996 -17.663  16.154
  288    H3*    G  26           H3*        G  26 -13.413 -20.304  16.518
  289    H1*    G  26           H1*        G  26 -10.028 -19.136  15.090
  290    H8     G  26           H8         G  26  -9.575 -19.972  18.869
  291    H1     G  26           H1         G  26  -4.263 -18.809  15.472
  292   1H2     G  26          1H2         G  26  -4.790 -18.232  13.354
  293   2H2     G  26          2H2         G  26  -6.437 -18.160  12.880
  294   1H2*    G  26          1H2*        G  26 -11.159 -20.831  17.297
  295   2H2*    G  26          2H2*        G  26 -11.049 -21.172  15.570
  296   1H5*    G  27          1H5*        G  27 -11.320 -19.146  12.536
  297   2H5*    G  27          2H5*        G  27 -12.246 -20.037  11.328
  298    H4*    G  27           H4*        G  27 -10.044 -19.778  10.557
  299    H3*    G  27           H3*        G  27 -11.149 -22.292  10.564
  300    H1*    G  27           H1*        G  27  -7.480 -21.622  11.573
  301    H8     G  27           H8         G  27  -9.542 -22.393  14.791
  302    H1     G  27           H1         G  27  -3.153 -22.336  15.321
  303   1H2     G  27          1H2         G  27  -2.202 -21.790  13.349
  304   2H2     G  27          2H2         G  27  -3.196 -21.462  11.991
  305   1H2*    G  27          1H2*        G  27  -9.927 -23.128  12.472
  306   2H2*    G  27          2H2*        G  27  -8.803 -23.509  11.167
  Start of MODEL    2
    1   1H5*    C   1          1H5*        C   1   5.618 -23.489  15.391
    2   2H5*    C   1          2H5*        C   1   4.597 -23.246  16.808
    3    H4*    C   1           H4*        C   1   3.712 -23.727  14.014
    4    H3*    C   1           H3*        C   1   4.116 -21.151  15.411
    5    H1*    C   1           H1*        C   1   0.887 -22.989  14.074
    6   1H4     C   1          1H4         C   1  -3.962 -22.026  17.932
    7   2H4     C   1          2H4         C   1  -2.934 -21.956  19.324
    8    H5     C   1           H5         C   1  -0.518 -22.114  19.198
    9    H6     C   1           H6         C   1   1.380 -22.372  17.666
   10   1H2*    C   1          1H2*        C   1   1.876 -20.596  15.491
   11   2H2*    C   1          2H2*        C   1   1.762 -20.910  13.759
   12   1H5*    C   2          1H5*        C   2   2.329 -20.926  11.385
   13   2H5*    C   2          2H5*        C   2   3.259 -19.726  10.488
   14    H4*    C   2           H4*        C   2   0.998 -19.467   9.943
   15    H3*    C   2           H3*        C   2   2.385 -17.256  10.775
   16    H1*    C   2           H1*        C   2  -1.234 -17.961  11.922
   17   1H4     C   2          1H4         C   2  -2.875 -18.957  17.886
   18   2H4     C   2          2H4         C   2  -1.227 -19.067  18.404
   19    H5     C   2           H5         C   2   0.656 -18.899  16.887
   20    H6     C   2           H6         C   2   1.296 -18.585  14.539
   21   1H2*    C   2          1H2*        C   2   1.459 -17.166  13.006
   22   2H2*    C   2          2H2*        C   2   0.287 -16.195  12.117
   23   1H5*    T   3          1H5*        T   3  -1.976 -16.555   9.398
   24   2H5*    T   3          2H5*        T   3  -1.913 -15.124   8.368
   25    H4*    T   3           H4*        T   3  -3.981 -15.190   9.501
   26    H3*    T   3           H3*        T   3  -2.456 -12.886   9.590
   27   1H2*    T   3          1H2*        T   3  -1.811 -13.058  11.897
   28   2H2*    T   3          2H2*        T   3  -3.373 -12.258  12.073
   29    H1*    T   3           H1*        T   3  -4.491 -14.250  12.580
   30    H3     T   3           H3         T   3  -3.661 -15.535  16.689
   31   1H5M    T   3          1H5M        T   3   1.072 -15.036  14.206
   32   2H5M    T   3          2H5M        T   3   0.886 -15.982  15.684
   33   3H5M    T   3          3H5M        T   3   0.905 -14.219  15.760
   34    H6     T   3           H6         T   3  -0.834 -14.520  12.977
   35   1H5*    A   4          1H5*        A   4  -7.076 -12.590  10.222
   36   2H5*    A   4          2H5*        A   4  -7.574 -11.005   9.631
   37    H4*    A   4           H4*        A   4  -8.975 -11.825  11.412
   38    H3*    A   4           H3*        A   4  -8.242  -9.216  11.261
   39    H1*    A   4           H1*        A   4  -8.037 -11.094  14.626
   40    H8     A   4           H8         A   4  -4.458 -10.683  13.182
   41   1H6     A   4          1H6         A   4  -2.643 -12.800  18.684
   42   2H6     A   4          2H6         A   4  -2.126 -12.183  17.153
   43    H2     A   4           H2         A   4  -7.128 -12.868  18.564
   44   1H2*    A   4          1H2*        A   4  -6.373  -9.366  12.813
   45   2H2*    A   4          2H2*        A   4  -7.698  -8.909  13.884
   46   1H5*    A   5          1H5*        A   5 -10.902 -10.548  14.694
   47   2H5*    A   5          2H5*        A   5 -12.252  -9.413  14.701
   48    H4*    A   5           H4*        A   5 -12.024 -10.281  16.854
   49    H3*    A   5           H3*        A   5 -12.125  -7.578  16.606
   50    H1*    A   5           H1*        A   5  -9.548  -9.220  18.962
   51    H8     A   5           H8         A   5  -7.734  -7.998  15.755
   52   1H6     A   5          1H6         A   5  -2.588  -9.358  18.874
   53   2H6     A   5          2H6         A   5  -3.237  -8.702  17.410
   54    H2     A   5           H2         A   5  -6.110 -10.532  21.395
   55   1H2*    A   5          1H2*        A   5  -9.725  -7.200  16.742
   56   2H2*    A   5          2H2*        A   5 -10.211  -7.047  18.430
   57   1H5*    T   6          1H5*        T   6 -12.003  -9.224  20.845
   58   2H5*    T   6          2H5*        T   6 -13.038  -8.278  21.913
   59    H4*    T   6           H4*        T   6 -11.116  -9.097  23.066
   60    H3*    T   6           H3*        T   6 -11.840  -6.372  23.173
   61   1H2*    T   6          1H2*        T   6  -9.832  -5.512  22.258
   62   2H2*    T   6          2H2*        T   6  -9.228  -5.853  23.879
   63    H1*    T   6           H1*        T   6  -8.266  -7.887  23.239
   64    H3     T   6           H3         T   6  -4.526  -6.891  21.215
   65   1H5M    T   6          1H5M        T   6  -8.525  -5.249  18.027
   66   2H5M    T   6          2H5M        T   6  -6.918  -5.612  17.394
   67   3H5M    T   6          3H5M        T   6  -7.196  -4.118  18.291
   68    H6     T   6           H6         T   6  -9.105  -6.126  20.097
   69   1H5*    T   7          1H5*        T   7  -9.133  -7.773  26.591
   70   2H5*    T   7          2H5*        T   7  -9.404  -6.812  28.045
   71    H4*    T   7           H4*        T   7  -7.073  -7.153  27.494
   72    H3*    T   7           H3*        T   7  -8.174  -4.500  28.028
   73   1H2*    T   7          1H2*        T   7  -6.932  -3.407  26.395
   74   2H2*    T   7          2H2*        T   7  -5.500  -3.936  27.278
   75    H1*    T   7           H1*        T   7  -5.129  -5.729  25.858
   76    H3     T   7           H3         T   7  -3.603  -3.980  22.159
   77   1H5M    T   7          1H5M        T   7  -8.006  -3.273  20.713
   78   2H5M    T   7          2H5M        T   7  -7.910  -1.832  21.725
   79   3H5M    T   7          3H5M        T   7  -8.916  -3.194  22.222
   80    H6     T   7           H6         T   7  -7.953  -4.111  24.124
   81   1H5*    A   8          1H5*        A   8  -3.872  -5.370  29.086
   82   2H5*    A   8          2H5*        A   8  -3.643  -4.758  30.724
   83    H4*    A   8           H4*        A   8  -1.668  -4.382  29.542
   84    H3*    A   8           H3*        A   8  -2.867  -2.216  30.761
   85    H1*    A   8           H1*        A   8  -1.161  -2.048  27.298
   86    H8     A   8           H8         A   8  -5.009  -1.763  26.850
   87   1H6     A   8          1H6         A   8  -3.592  -0.165  21.063
   88   2H6     A   8          2H6         A   8  -4.870  -0.395  22.206
   89    H2     A   8           H2         A   8   0.219  -1.130  23.227
   90   1H2*    A   8          1H2*        A   8  -3.642  -1.151  28.748
   91   2H2*    A   8          2H2*        A   8  -2.004  -0.501  28.838
   92   1H5*    T   9          1H5*        T   9   1.361  -1.741  29.052
   93   2H5*    T   9          2H5*        T   9   2.302  -0.818  30.224
   94    H4*    T   9           H4*        T   9   3.073  -0.368  28.032
   95    H3*    T   9           H3*        T   9   2.396   1.737  29.739
   96   1H2*    T   9          1H2*        T   9   0.550   2.552  28.467
   97   2H2*    T   9          2H2*        T   9   1.861   3.304  27.558
   98    H1*    T   9           H1*        T   9   1.846   1.645  25.906
   99    H3     T   9           H3         T   9  -1.534   2.291  23.207
  100   1H5M    T   9          1H5M        T   9  -4.112   2.913  27.301
  101   2H5M    T   9          2H5M        T   9  -3.595   1.415  28.076
  102   3H5M    T   9          3H5M        T   9  -4.568   1.358  26.605
  103    H6     T   9           H6         T   9  -1.257   1.510  27.909
  104   1H5*    A  10          1H5*        A  10   4.743   2.812  25.927
  105   2H5*    A  10          2H5*        A  10   5.987   3.959  26.423
  106    H4*    A  10           H4*        A  10   5.244   4.556  24.288
  107    H3*    A  10           H3*        A  10   5.019   6.460  26.370
  108    H1*    A  10           H1*        A  10   2.700   5.972  23.291
  109    H8     A  10           H8         A  10   0.792   5.270  26.604
  110   1H6     A  10          1H6         A  10  -4.216   5.423  23.004
  111   2H6     A  10          2H6         A  10  -3.627   5.242  24.622
  112    H2     A  10           H2         A  10  -0.603   6.027  20.412
  113   1H2*    A  10          1H2*        A  10   2.686   6.797  26.185
  114   2H2*    A  10          2H2*        A  10   3.166   7.728  24.766
  115   1H5*    A  11          1H5*        A  11   5.241   7.778  21.954
  116   2H5*    A  11          2H5*        A  11   6.215   9.246  21.896
  117    H4*    A  11           H4*        A  11   4.529   9.275  20.213
  118    H3*    A  11           H3*        A  11   4.926  11.463  21.863
  119    H1*    A  11           H1*        A  11   1.460  10.224  20.680
  120    H8     A  11           H8         A  11   1.861   9.532  24.482
  121   1H6     A  11          1H6         A  11  -4.177   8.286  24.257
  122   2H6     A  11          2H6         A  11  -2.785   8.420  25.278
  123    H2     A  11           H2         A  11  -2.785   9.243  20.100
  124   1H2*    A  11          1H2*        A  11   2.895  11.242  23.122
  125   2H2*    A  11          2H2*        A  11   2.292  12.142  21.731
  126   1H5*    C  12          1H5*        C  12   1.947  12.210  18.277
  127   2H5*    C  12          2H5*        C  12   2.440  13.802  17.697
  128    H4*    C  12           H4*        C  12   0.104  13.607  17.520
  129    H3*    C  12           H3*        C  12   1.196  15.745  19.009
  130    H1*    C  12           H1*        C  12  -2.138  13.854  19.632
  131   1H4     C  12          1H4         C  12  -3.558  11.472  25.237
  132   2H4     C  12          2H4         C  12  -1.907  11.497  25.760
  133    H5     C  12           H5         C  12  -0.085  12.289  24.372
  134    H6     C  12           H6         C  12   0.477  13.222  22.172
  135   1H2*    C  12          1H2*        C  12   0.124  15.235  21.056
  136   2H2*    C  12          2H2*        C  12  -1.267  15.940  20.232
  137   1H5*    G  13          1H5*        G  13  -3.093  16.325  17.896
  138   2H5*    G  13          2H5*        G  13  -3.375  17.992  17.394
  139    H4*    G  13           H4*        G  13  -5.104  17.143  18.844
  140    H3*    G  13           H3*        G  13  -4.145  19.682  19.078
  141    H1*    G  13           H1*        G  13  -4.723  17.484  22.196
  142    H8     G  13           H8         G  13  -0.959  18.165  21.777
  143    H1     G  13           H1         G  13  -2.614  14.168  26.510
  144   1H2     G  13          1H2         G  13  -4.817  13.691  26.406
  145   2H2     G  13          2H2         G  13  -5.778  14.384  25.166
  146   1H2*    G  13          1H2*        G  13  -2.638  19.243  20.929
  147   2H2*    G  13          2H2*        G  13  -4.115  19.699  21.778
  148   1H5*    A  14          1H5*        A  14  -8.145  18.552  20.943
  149   2H5*    A  14          2H5*        A  14  -9.207  19.956  20.837
  150    H4*    A  14           H4*        A  14  -9.910  18.547  22.585
  151    H3*    A  14           H3*        A  14  -9.794  21.181  23.068
  152    H1*    A  14           H1*        A  14  -8.131  18.842  25.642
  153    H8     A  14           H8         A  14  -5.397  20.320  23.317
  154   1H6     A  14          1H6         A  14  -1.449  17.699  27.266
  155   2H6     A  14          2H6         A  14  -1.610  18.693  25.859
  156    H2     A  14           H2         A  14  -5.618  16.608  28.516
  157   1H2*    A  14          1H2*        A  14  -7.484  21.196  23.896
  158   2H2*    A  14          2H2*        A  14  -8.433  21.129  25.380
  159   1H5*    A  15          1H5*        A  15 -13.450  17.998  25.372
  160   2H5*    A  15          2H5*        A  15 -11.704  17.761  25.464
  161    H4*    A  15           H4*        A  15 -13.698  16.218  23.875
  162    H3*    A  15           H3*        A  15 -13.079  15.627  26.463
  163    H1*    A  15           H1*        A  15 -11.368  13.788  23.533
  164    H8     A  15           H8         A  15  -8.674  14.633  25.738
  165   1H6     A  15          1H6         A  15  -4.895  15.091  20.883
  166   2H6     A  15          2H6         A  15  -4.994  14.965  22.606
  167    H2     A  15           H2         A  15  -9.122  15.074  19.376
  168   1H2*    A  15          1H2*        A  15 -10.716  15.217  26.100
  169   2H2*    A  15          2H2*        A  15 -11.391  13.605  25.861
  170   1H5*    G  16          1H5*        G  16 -14.535  10.658  25.951
  171   2H5*    G  16          2H5*        G  16 -12.869  10.206  26.311
  172    H4*    G  16           H4*        G  16 -13.970  11.697  24.003
  173    H3*    G  16           H3*        G  16 -13.652   9.060  23.890
  174    H1*    G  16           H1*        G  16 -10.580  11.110  22.786
  175    H8     G  16           H8         G  16 -10.334  10.721  26.669
  176    H1     G  16           H1         G  16  -4.894  11.897  23.485
  177   1H2     G  16          1H2         G  16  -5.291  12.038  21.268
  178   2H2     G  16          2H2         G  16  -6.889  11.836  20.679
  179   1H2*    G  16          1H2*        G  16 -11.360   9.039  24.804
  180   2H2*    G  16          2H2*        G  16 -11.113   8.877  23.065
  181   1H5*    T  17          1H5*        T  17 -11.677  11.205  20.293
  182   2H5*    T  17          2H5*        T  17 -12.588  10.443  18.988
  183    H4*    T  17           H4*        T  17 -10.544  11.150  18.116
  184    H3*    T  17           H3*        T  17 -11.243   8.544  17.715
  185   1H2*    T  17          1H2*        T  17  -9.828   7.605  19.447
  186   2H2*    T  17          2H2*        T  17  -8.747   7.564  18.055
  187    H1*    T  17           H1*        T  17  -7.636   9.519  18.685
  188    H3     T  17           H3         T  17  -4.853   8.564  21.930
  189   1H5M    T  17          1H5M        T  17  -8.208   6.549  24.394
  190   2H5M    T  17          2H5M        T  17  -9.698   6.993  23.561
  191   3H5M    T  17          3H5M        T  17  -8.923   8.140  24.655
  192    H6     T  17           H6         T  17  -9.603   8.251  21.550
  193   1H5*    T  18          1H5*        T  18  -7.344   9.978  15.669
  194   2H5*    T  18          2H5*        T  18  -7.373   9.293  14.044
  195    H4*    T  18           H4*        T  18  -5.140   9.472  14.812
  196    H3*    T  18           H3*        T  18  -6.064   7.074  13.766
  197   1H2*    T  18          1H2*        T  18  -6.030   5.837  15.818
  198   2H2*    T  18          2H2*        T  18  -4.342   5.661  15.339
  199    H1*    T  18           H1*        T  18  -3.621   7.384  16.748
  200    H3     T  18           H3         T  18  -3.484   5.968  20.889
  201   1H5M    T  18          1H5M        T  18  -8.181   5.550  20.874
  202   2H5M    T  18          2H5M        T  18  -7.796   4.022  20.080
  203   3H5M    T  18          3H5M        T  18  -8.533   5.335  19.160
  204    H6     T  18           H6         T  18  -7.006   6.228  17.675
  205   1H5*    A  19          1H5*        A  19  -1.457   7.318  14.669
  206   2H5*    A  19          2H5*        A  19  -0.809   6.793  13.114
  207    H4*    A  19           H4*        A  19   0.688   6.033  14.680
  208    H3*    A  19           H3*        A  19  -0.539   4.066  13.162
  209    H1*    A  19           H1*        A  19   0.329   3.716  16.914
  210    H8     A  19           H8         A  19  -3.525   3.868  16.464
  211   1H6     A  19          1H6         A  19  -3.661   2.303  22.431
  212   2H6     A  19          2H6         A  19  -4.608   2.629  21.020
  213    H2     A  19           H2         A  19   0.627   2.811  21.210
  214   1H2*    A  19          1H2*        A  19  -1.856   3.122  14.931
  215   2H2*    A  19          2H2*        A  19  -0.336   2.268  15.200
  216   1H5*    T  20          1H5*        T  20   3.186   3.165  15.574
  217   2H5*    T  20          2H5*        T  20   4.254   2.089  14.673
  218    H4*    T  20           H4*        T  20   4.497   1.739  17.009
  219    H3*    T  20           H3*        T  20   4.040  -0.417  15.288
  220   1H2*    T  20          1H2*        T  20   1.909  -1.033  16.162
  221   2H2*    T  20          2H2*        T  20   2.932  -1.805  17.372
  222    H1*    T  20           H1*        T  20   2.688  -0.049  18.899
  223    H3     T  20           H3         T  20  -1.226  -0.540  20.783
  224   1H5M    T  20          1H5M        T  20  -3.368   0.882  16.901
  225   2H5M    T  20          2H5M        T  20  -2.961  -0.701  16.236
  226   3H5M    T  20          3H5M        T  20  -2.127   0.741  15.655
  227    H6     T  20           H6         T  20   0.099   0.398  16.292
  228   1H5*    A  21          1H5*        A  21   5.646  -1.292  19.605
  229   2H5*    A  21          2H5*        A  21   6.919  -2.478  19.308
  230    H4*    A  21           H4*        A  21   5.943  -2.884  21.414
  231    H3*    A  21           H3*        A  21   6.234  -4.966  19.663
  232    H1*    A  21           H1*        A  21   3.038  -4.515  21.782
  233    H8     A  21           H8         A  21   2.253  -3.688  18.076
  234   1H6     A  21          1H6         A  21  -3.603  -3.432  20.000
  235   2H6     A  21          2H6         A  21  -2.546  -3.340  18.634
  236    H2     A  21           H2         A  21  -0.980  -4.153  23.571
  237   1H2*    A  21          1H2*        A  21   3.922  -5.066  18.958
  238   2H2*    A  21          2H2*        A  21   3.899  -6.149  20.351
  239   1H5*    A  22          1H5*        A  22   5.127  -5.930  24.086
  240   2H5*    A  22          2H5*        A  22   6.054  -7.375  24.486
  241    H4*    A  22           H4*        A  22   4.055  -7.284  25.762
  242    H3*    A  22           H3*        A  22   4.779  -9.606  24.520
  243    H1*    A  22           H1*        A  22   1.125  -8.363  24.514
  244    H8     A  22           H8         A  22   2.657  -7.833  20.985
  245   1H6     A  22          1H6         A  22  -3.144  -6.538  19.331
  246   2H6     A  22          2H6         A  22  -1.515  -6.735  18.782
  247    H2     A  22           H2         A  22  -3.079  -7.285  23.755
  248   1H2*    A  22          1H2*        A  22   3.243  -9.419  22.657
  249   2H2*    A  22          2H2*        A  22   2.255 -10.290  23.829
  250   1H5*    T  23          1H5*        T  23   1.138  -9.706  27.334
  251   2H5*    T  23          2H5*        T  23   1.198 -11.219  28.237
  252    H4*    T  23           H4*        T  23  -1.054 -10.520  27.879
  253    H3*    T  23           H3*        T  23  -0.260 -13.128  27.343
  254   1H2*    T  23          1H2*        T  23  -0.489 -13.012  24.962
  255   2H2*    T  23          2H2*        T  23  -2.163 -13.351  25.401
  256    H1*    T  23           H1*        T  23  -2.802 -11.104  25.243
  257    H3     T  23           H3         T  23  -3.238  -9.978  21.036
  258   1H5M    T  23          1H5M        T  23   0.969 -12.256  20.351
  259   2H5M    T  23          2H5M        T  23   1.844 -11.568  21.719
  260   3H5M    T  23          3H5M        T  23   1.365 -10.537  20.370
  261    H6     T  23           H6         T  23   0.438 -11.680  23.562
  262   1H5*    T  24          1H5*        T  24  -4.788 -12.145  27.390
  263   2H5*    T  24          2H5*        T  24  -5.511 -13.451  28.328
  264    H4*    T  24           H4*        T  24  -7.039 -12.682  26.692
  265    H3*    T  24           H3*        T  24  -6.578 -15.373  26.965
  266   1H2*    T  24          1H2*        T  24  -5.194 -15.619  24.999
  267   2H2*    T  24          2H2*        T  24  -6.799 -15.866  24.310
  268    H1*    T  24           H1*        T  24  -6.945 -13.670  23.517
  269    H3     T  24           H3         T  24  -4.493 -13.137  19.922
  270   1H5M    T  24          1H5M        T  24  -0.628 -14.006  22.520
  271   2H5M    T  24          2H5M        T  24  -1.105 -15.662  22.143
  272   3H5M    T  24          3H5M        T  24  -1.280 -15.046  23.787
  273    H6     T  24           H6         T  24  -3.481 -14.642  24.339
  274   1H5*    A  25          1H5*        A  25  -9.954 -14.265  23.894
  275   2H5*    A  25          2H5*        A  25 -11.258 -15.337  24.406
  276    H4*    A  25           H4*        A  25 -11.403 -15.043  22.088
  277    H3*    A  25           H3*        A  25 -11.404 -17.595  23.059
  278    H1*    A  25           H1*        A  25  -9.382 -16.641  19.912
  279    H8     A  25           H8         A  25  -6.976 -17.545  22.779
  280   1H6     A  25          1H6         A  25  -2.522 -16.425  18.660
  281   2H6     A  25          2H6         A  25  -2.880 -16.997  20.254
  282    H2     A  25           H2         A  25  -6.459 -15.323  16.808
  283   1H2*    A  25          1H2*        A  25  -9.093 -18.098  22.528
  284   2H2*    A  25          2H2*        A  25  -9.906 -18.612  21.050
  285   1H5*    G  26          1H5*        G  26 -12.564 -16.905  18.568
  286   2H5*    G  26          2H5*        G  26 -13.900 -18.031  18.324
  287    H4*    G  26           H4*        G  26 -12.800 -17.631  16.276
  288    H3*    G  26           H3*        G  26 -13.382 -20.182  16.967
  289    H1*    G  26           H1*        G  26  -9.891 -19.340  15.559
  290    H8     G  26           H8         G  26  -9.612 -19.980  19.378
  291    H1     G  26           H1         G  26  -4.145 -18.895  16.208
  292   1H2     G  26          1H2         G  26  -4.572 -18.372  14.055
  293   2H2     G  26          2H2         G  26  -6.194 -18.315  13.501
  294   1H2*    G  26          1H2*        G  26 -11.192 -20.724  17.889
  295   2H2*    G  26          2H2*        G  26 -11.030 -21.264  16.218
  296   1H5*    G  27          1H5*        G  27 -12.077 -19.393  12.554
  297   2H5*    G  27          2H5*        G  27 -12.944 -20.577  11.575
  298    H4*    G  27           H4*        G  27 -10.864 -19.887  10.583
  299    H3*    G  27           H3*        G  27 -11.682 -22.455  10.464
  300    H1*    G  27           H1*        G  27  -8.053 -21.709  11.530
  301    H8     G  27           H8         G  27 -10.164 -22.417  14.733
  302    H1     G  27           H1         G  27  -3.793 -22.178  15.410
  303   1H2     G  27          1H2         G  27  -2.809 -21.663  13.445
  304   2H2     G  27          2H2         G  27  -3.778 -21.399  12.054
  305   1H2*    G  27          1H2*        G  27 -10.483 -23.216  12.452
  306   2H2*    G  27          2H2*        G  27  -9.351 -23.605  11.157
  Start of MODEL    3
    1   1H5*    C   1          1H5*        C   1   6.936 -20.178  14.206
    2   2H5*    C   1          2H5*        C   1   5.643 -19.995  15.392
    3    H4*    C   1           H4*        C   1   5.553 -21.561  12.852
    4    H3*    C   1           H3*        C   1   5.081 -18.813  13.042
    5    H1*    C   1           H1*        C   1   2.387 -21.576  12.713
    6   1H4     C   1          1H4         C   1  -2.461 -21.785  16.680
    7   2H4     C   1          2H4         C   1  -1.445 -21.460  18.044
    8    H5     C   1           H5         C   1   0.929 -21.013  17.854
    9    H6     C   1           H6         C   1   2.791 -20.796  16.269
   10   1H2*    C   1          1H2*        C   1   2.949 -18.963  14.097
   11   2H2*    C   1          2H2*        C   1   2.448 -19.253  12.432
   12   1H5*    C   2          1H5*        C   2   2.504 -19.288   9.272
   13   2H5*    C   2          2H5*        C   2   2.991 -17.803   8.453
   14    H4*    C   2           H4*        C   2   0.670 -17.822   8.799
   15    H3*    C   2           H3*        C   2   2.228 -15.692  10.104
   16    H1*    C   2           H1*        C   2  -1.218 -17.401  10.978
   17   1H4     C   2          1H4         C   2  -2.026 -18.488  17.086
   18   2H4     C   2          2H4         C   2  -0.352 -18.222  17.442
   19    H5     C   2           H5         C   2   1.289 -17.652  15.752
   20    H6     C   2           H6         C   2   1.612 -17.226  13.357
   21   1H2*    C   2          1H2*        C   2   0.834 -15.487  11.938
   22   2H2*    C   2          2H2*        C   2  -0.507 -15.228  10.823
   23   1H5*    T   3          1H5*        T   3  -1.717 -15.207   8.365
   24   2H5*    T   3          2H5*        T   3  -1.971 -13.679   7.523
   25    H4*    T   3           H4*        T   3  -3.965 -14.356   8.611
   26    H3*    T   3           H3*        T   3  -2.998 -11.784   8.952
   27   1H2*    T   3          1H2*        T   3  -2.335 -12.029  11.245
   28   2H2*    T   3          2H2*        T   3  -4.041 -11.641  11.464
   29    H1*    T   3           H1*        T   3  -4.656 -13.882  11.745
   30    H3     T   3           H3         T   3  -3.568 -15.235  15.765
   31   1H5M    T   3          1H5M        T   3   0.996 -14.788  14.631
   32   2H5M    T   3          2H5M        T   3   0.667 -13.110  15.062
   33   3H5M    T   3          3H5M        T   3   0.944 -13.549  13.376
   34    H6     T   3           H6         T   3  -1.011 -13.433  12.156
   35   1H5*    A   4          1H5*        A   4  -7.364 -12.708  10.429
   36   2H5*    A   4          2H5*        A   4  -8.263 -11.316   9.826
   37    H4*    A   4           H4*        A   4  -9.268 -12.069  11.812
   38    H3*    A   4           H3*        A   4  -8.590  -9.406  11.597
   39    H1*    A   4           H1*        A   4  -8.172 -11.455  14.846
   40    H8     A   4           H8         A   4  -4.677 -10.649  13.364
   41   1H6     A   4          1H6         A   4  -2.571 -12.882  18.715
   42   2H6     A   4          2H6         A   4  -2.141 -12.147  17.209
   43    H2     A   4           H2         A   4  -7.038 -13.322  18.669
   44   1H2*    A   4          1H2*        A   4  -6.720  -9.468  13.112
   45   2H2*    A   4          2H2*        A   4  -8.041  -9.197  14.249
   46   1H5*    A   5          1H5*        A   5 -11.134 -10.879  15.029
   47   2H5*    A   5          2H5*        A   5 -12.510  -9.785  15.169
   48    H4*    A   5           H4*        A   5 -12.102 -10.741  17.267
   49    H3*    A   5           H3*        A   5 -12.310  -8.024  17.115
   50    H1*    A   5           H1*        A   5  -9.606  -9.714  19.288
   51    H8     A   5           H8         A   5  -7.938  -8.211  16.121
   52   1H6     A   5          1H6         A   5  -2.655  -9.538  19.018
   53   2H6     A   5          2H6         A   5  -3.371  -8.822  17.614
   54    H2     A   5           H2         A   5  -6.053 -11.012  21.550
   55   1H2*    A   5          1H2*        A   5  -9.935  -7.554  17.221
   56   2H2*    A   5          2H2*        A   5 -10.367  -7.535  18.930
   57   1H5*    T   6          1H5*        T   6 -12.168  -9.654  21.492
   58   2H5*    T   6          2H5*        T   6 -13.000  -8.534  22.570
   59    H4*    T   6           H4*        T   6 -10.987  -9.433  23.492
   60    H3*    T   6           H3*        T   6 -11.238  -6.468  23.214
   61   1H2*    T   6          1H2*        T   6  -8.965  -6.087  23.431
   62   2H2*    T   6          2H2*        T   6  -8.852  -7.290  24.715
   63    H1*    T   6           H1*        T   6  -8.077  -8.846  23.289
   64    H3     T   6           H3         T   6  -4.452  -7.166  21.396
   65   1H5M    T   6          1H5M        T   6  -7.096  -5.894  17.737
   66   2H5M    T   6          2H5M        T   6  -7.441  -4.474  18.724
   67   3H5M    T   6          3H5M        T   6  -8.694  -5.685  18.453
   68    H6     T   6           H6         T   6  -9.119  -6.726  20.482
   69   1H5*    T   7          1H5*        T   7  -9.399  -7.427  27.091
   70   2H5*    T   7          2H5*        T   7  -9.841  -6.132  28.204
   71    H4*    T   7           H4*        T   7  -7.447  -6.564  27.924
   72    H3*    T   7           H3*        T   7  -8.613  -3.844  27.724
   73   1H2*    T   7          1H2*        T   7  -6.935  -2.999  26.380
   74   2H2*    T   7          2H2*        T   7  -5.729  -3.677  27.473
   75    H1*    T   7           H1*        T   7  -5.383  -5.482  26.144
   76    H3     T   7           H3         T   7  -3.772  -4.001  22.331
   77   1H5M    T   7          1H5M        T   7  -7.839  -2.889  20.675
   78   2H5M    T   7          2H5M        T   7  -8.671  -2.351  22.136
   79   3H5M    T   7          3H5M        T   7  -8.897  -3.999  21.548
   80    H6     T   7           H6         T   7  -8.181  -4.126  24.163
   81   1H5*    A   8          1H5*        A   8  -4.719  -4.601  29.673
   82   2H5*    A   8          2H5*        A   8  -4.621  -3.665  31.164
   83    H4*    A   8           H4*        A   8  -2.502  -3.757  30.103
   84    H3*    A   8           H3*        A   8  -3.472  -1.364  31.009
   85    H1*    A   8           H1*        A   8  -1.674  -1.681  27.608
   86    H8     A   8           H8         A   8  -5.493  -1.317  26.972
   87   1H6     A   8          1H6         A   8  -3.793  -0.311  21.127
   88   2H6     A   8          2H6         A   8  -5.124  -0.401  22.230
   89    H2     A   8           H2         A   8  -0.104  -1.156  23.537
   90   1H2*    A   8          1H2*        A   8  -4.145  -0.499  28.851
   91   2H2*    A   8          2H2*        A   8  -2.477   0.065  28.937
   92   1H5*    T   9          1H5*        T   9   0.870  -1.429  29.392
   93   2H5*    T   9          2H5*        T   9   1.811  -0.455  30.523
   94    H4*    T   9           H4*        T   9   2.723  -0.301  28.336
   95    H3*    T   9           H3*        T   9   2.203   1.995  29.813
   96   1H2*    T   9          1H2*        T   9   0.412   2.811  28.448
   97   2H2*    T   9          2H2*        T   9   1.785   3.420  27.523
   98    H1*    T   9           H1*        T   9   1.710   1.653  25.991
   99    H3     T   9           H3         T   9  -1.552   2.373  23.167
  100   1H5M    T   9          1H5M        T   9  -4.677   1.587  26.599
  101   2H5M    T   9          2H5M        T   9  -4.311   3.266  27.000
  102   3H5M    T   9          3H5M        T   9  -3.751   1.965  28.053
  103    H6     T   9           H6         T   9  -1.452   1.780  27.904
  104   1H5*    A  10          1H5*        A  10   4.567   2.524  25.870
  105   2H5*    A  10          2H5*        A  10   5.929   3.550  26.321
  106    H4*    A  10           H4*        A  10   5.323   4.077  24.127
  107    H3*    A  10           H3*        A  10   5.340   6.133  26.022
  108    H1*    A  10           H1*        A  10   2.870   5.777  23.058
  109    H8     A  10           H8         A  10   0.991   5.262  26.423
  110   1H6     A  10          1H6         A  10  -4.076   5.810  22.946
  111   2H6     A  10          2H6         A  10  -3.463   5.593  24.550
  112    H2     A  10           H2         A  10  -0.492   6.084  20.259
  113   1H2*    A  10          1H2*        A  10   3.004   6.605  25.950
  114   2H2*    A  10          2H2*        A  10   3.505   7.497  24.514
  115   1H5*    A  11          1H5*        A  11   5.438   7.124  21.527
  116   2H5*    A  11          2H5*        A  11   6.533   8.487  21.306
  117    H4*    A  11           H4*        A  11   4.776   8.542  19.701
  118    H3*    A  11           H3*        A  11   5.427  10.804  21.180
  119    H1*    A  11           H1*        A  11   1.842   9.770  20.157
  120    H8     A  11           H8         A  11   2.283   9.277  23.991
  121   1H6     A  11          1H6         A  11  -3.867   8.801  23.997
  122   2H6     A  11          2H6         A  11  -2.437   8.805  24.970
  123    H2     A  11           H2         A  11  -2.507   9.376  19.759
  124   1H2*    A  11          1H2*        A  11   3.412  10.890  22.469
  125   2H2*    A  11          2H2*        A  11   2.855  11.702  21.006
  126   1H5*    C  12          1H5*        C  12   2.439  11.519  17.623
  127   2H5*    C  12          2H5*        C  12   3.071  12.986  16.878
  128    H4*    C  12           H4*        C  12   0.726  13.024  16.756
  129    H3*    C  12           H3*        C  12   2.058  15.173  17.972
  130    H1*    C  12           H1*        C  12  -1.398  13.723  18.964
  131   1H4     C  12          1H4         C  12  -2.696  11.863  24.794
  132   2H4     C  12          2H4         C  12  -1.025  11.837  25.249
  133    H5     C  12           H5         C  12   0.774  12.394  23.723
  134    H6     C  12           H6         C  12   1.290  13.093  21.428
  135   1H2*    C  12          1H2*        C  12   1.108  14.910  20.136
  136   2H2*    C  12          2H2*        C  12  -0.249  15.723  19.355
  137   1H5*    G  13          1H5*        G  13  -2.197  15.843  17.235
  138   2H5*    G  13          2H5*        G  13  -2.540  17.440  16.570
  139    H4*    G  13           H4*        G  13  -4.121  16.816  18.258
  140    H3*    G  13           H3*        G  13  -3.052  19.331  18.178
  141    H1*    G  13           H1*        G  13  -3.478  17.411  21.501
  142    H8     G  13           H8         G  13   0.277  17.871  20.737
  143    H1     G  13           H1         G  13  -1.188  14.566  26.032
  144   1H2     G  13          1H2         G  13  -3.414  14.209  26.149
  145   2H2     G  13          2H2         G  13  -4.435  14.805  24.907
  146   1H2*    G  13          1H2*        G  13  -1.446  19.010  19.962
  147   2H2*    G  13          2H2*        G  13  -2.852  19.570  20.866
  148   1H5*    A  14          1H5*        A  14  -6.553  18.362  20.730
  149   2H5*    A  14          2H5*        A  14  -7.715  19.664  20.984
  150    H4*    A  14           H4*        A  14  -7.598  18.113  22.833
  151    H3*    A  14           H3*        A  14  -7.883  20.783  23.216
  152    H1*    A  14           H1*        A  14  -5.313  18.798  25.301
  153    H8     A  14           H8         A  14  -3.423  20.719  22.497
  154   1H6     A  14          1H6         A  14   1.623  19.193  25.702
  155   2H6     A  14          2H6         A  14   1.011  20.044  24.325
  156    H2     A  14           H2         A  14  -1.940  17.382  27.745
  157   1H2*    A  14          1H2*        A  14  -5.525  21.259  23.587
  158   2H2*    A  14          2H2*        A  14  -6.104  20.990  25.232
  159   1H5*    A  15          1H5*        A  15 -10.785  18.612  27.621
  160   2H5*    A  15          2H5*        A  15  -9.212  18.234  26.921
  161    H4*    A  15           H4*        A  15 -11.833  17.850  25.558
  162    H3*    A  15           H3*        A  15 -11.209  16.176  27.601
  163    H1*    A  15           H1*        A  15 -10.298  15.219  23.975
  164    H8     A  15           H8         A  15  -7.098  15.795  25.988
  165   1H6     A  15          1H6         A  15  -4.157  14.856  20.647
  166   2H6     A  15          2H6         A  15  -3.978  15.080  22.353
  167    H2     A  15           H2         A  15  -8.564  15.036  19.812
  168   1H2*    A  15          1H2*        A  15  -9.065  15.443  26.709
  169   2H2*    A  15          2H2*        A  15 -10.162  14.215  26.075
  170   1H5*    G  16          1H5*        G  16 -13.126  11.352  25.931
  171   2H5*    G  16          2H5*        G  16 -11.742  12.403  26.234
  172    H4*    G  16           H4*        G  16 -13.069  12.875  23.727
  173    H3*    G  16           H3*        G  16 -13.100  10.221  23.894
  174    H1*    G  16           H1*        G  16  -9.829  11.733  22.520
  175    H8     G  16           H8         G  16  -9.490  11.521  26.409
  176    H1     G  16           H1         G  16  -4.085  12.139  23.018
  177   1H2     G  16          1H2         G  16  -4.545  12.249  20.812
  178   2H2     G  16          2H2         G  16  -6.173  12.168  20.280
  179   1H2*    G  16          1H2*        G  16 -10.800   9.992  24.756
  180   2H2*    G  16          2H2*        G  16 -10.635   9.627  23.038
  181   1H5*    T  17          1H5*        T  17 -11.352  11.735  19.887
  182   2H5*    T  17          2H5*        T  17 -12.288  10.826  18.698
  183    H4*    T  17           H4*        T  17 -10.196  11.389  17.777
  184    H3*    T  17           H3*        T  17 -11.051   8.792  17.631
  185   1H2*    T  17          1H2*        T  17  -9.631   7.930  19.389
  186   2H2*    T  17          2H2*        T  17  -8.580   7.745  17.985
  187    H1*    T  17           H1*        T  17  -7.389   9.703  18.448
  188    H3     T  17           H3         T  17  -4.569   8.909  21.703
  189   1H5M    T  17          1H5M        T  17  -8.543   8.749  24.549
  190   2H5M    T  17          2H5M        T  17  -7.953   7.102  24.318
  191   3H5M    T  17          3H5M        T  17  -9.440   7.625  23.525
  192    H6     T  17           H6         T  17  -9.332   8.687  21.427
  193   1H5*    T  18          1H5*        T  18  -7.192   9.883  15.269
  194   2H5*    T  18          2H5*        T  18  -7.312   9.020  13.735
  195    H4*    T  18           H4*        T  18  -5.040   9.227  14.416
  196    H3*    T  18           H3*        T  18  -6.058   6.784  13.595
  197   1H2*    T  18          1H2*        T  18  -6.022   5.722  15.747
  198   2H2*    T  18          2H2*        T  18  -4.356   5.437  15.243
  199    H1*    T  18           H1*        T  18  -3.528   7.239  16.485
  200    H3     T  18           H3         T  18  -3.330   6.159  20.723
  201   1H5M    T  18          1H5M        T  18  -8.444   5.583  19.170
  202   2H5M    T  18          2H5M        T  18  -8.054   5.980  20.843
  203   3H5M    T  18          3H5M        T  18  -7.736   4.359  20.223
  204    H6     T  18           H6         T  18  -6.931   6.314  17.590
  205   1H5*    A  19          1H5*        A  19  -1.480   7.107  14.336
  206   2H5*    A  19          2H5*        A  19  -0.812   6.426  12.852
  207    H4*    A  19           H4*        A  19   0.694   5.962  14.560
  208    H3*    A  19           H3*        A  19  -0.304   3.810  13.126
  209    H1*    A  19           H1*        A  19   0.417   3.770  16.924
  210    H8     A  19           H8         A  19  -3.423   3.678  16.331
  211   1H6     A  19          1H6         A  19  -3.684   2.273  22.333
  212   2H6     A  19          2H6         A  19  -4.598   2.516  20.885
  213    H2     A  19           H2         A  19   0.615   2.946  21.233
  214   1H2*    A  19          1H2*        A  19  -1.619   2.871  14.897
  215   2H2*    A  19          2H2*        A  19  -0.049   2.167  15.285
  216   1H5*    T  20          1H5*        T  20   3.133   3.233  15.956
  217   2H5*    T  20          2H5*        T  20   4.380   2.247  15.193
  218    H4*    T  20           H4*        T  20   4.400   1.860  17.513
  219    H3*    T  20           H3*        T  20   4.091  -0.322  15.757
  220   1H2*    T  20          1H2*        T  20   1.992  -1.051  16.580
  221   2H2*    T  20          2H2*        T  20   2.998  -1.701  17.875
  222    H1*    T  20           H1*        T  20   2.563   0.104  19.298
  223    H3     T  20           H3         T  20  -1.407  -0.607  20.978
  224   1H5M    T  20          1H5M        T  20  -2.835  -0.864  16.290
  225   2H5M    T  20          2H5M        T  20  -2.136   0.692  15.839
  226   3H5M    T  20          3H5M        T  20  -3.453   0.623  17.011
  227    H6     T  20           H6         T  20   0.098   0.376  16.554
  228   1H5*    A  21          1H5*        A  21   5.533  -1.209  20.091
  229   2H5*    A  21          2H5*        A  21   6.854  -2.357  19.875
  230    H4*    A  21           H4*        A  21   5.725  -2.868  21.869
  231    H3*    A  21           H3*        A  21   6.127  -4.875  20.030
  232    H1*    A  21           H1*        A  21   2.855  -4.488  22.050
  233    H8     A  21           H8         A  21   2.188  -3.662  18.322
  234   1H6     A  21          1H6         A  21  -3.730  -3.454  20.054
  235   2H6     A  21          2H6         A  21  -2.630  -3.354  18.723
  236    H2     A  21           H2         A  21  -1.220  -4.152  23.709
  237   1H2*    A  21          1H2*        A  21   3.847  -5.004  19.254
  238   2H2*    A  21          2H2*        A  21   3.783  -6.103  20.633
  239   1H5*    A  22          1H5*        A  22   5.103  -6.003  24.417
  240   2H5*    A  22          2H5*        A  22   6.027  -7.462  24.781
  241    H4*    A  22           H4*        A  22   4.025  -7.378  26.064
  242    H3*    A  22           H3*        A  22   4.762  -9.686  24.801
  243    H1*    A  22           H1*        A  22   1.103  -8.458  24.798
  244    H8     A  22           H8         A  22   2.627  -7.961  21.267
  245   1H6     A  22          1H6         A  22  -3.148  -6.530  19.634
  246   2H6     A  22          2H6         A  22  -1.527  -6.773  19.077
  247    H2     A  22           H2         A  22  -3.076  -7.242  24.064
  248   1H2*    A  22          1H2*        A  22   3.230  -9.488  22.936
  249   2H2*    A  22          2H2*        A  22   2.242 -10.373  24.098
  250   1H5*    T  23          1H5*        T  23   1.065  -9.854  27.548
  251   2H5*    T  23          2H5*        T  23   1.145 -11.373  28.440
  252    H4*    T  23           H4*        T  23  -1.116 -10.746  28.046
  253    H3*    T  23           H3*        T  23  -0.227 -13.316  27.453
  254   1H2*    T  23          1H2*        T  23  -0.446 -13.150  25.077
  255   2H2*    T  23          2H2*        T  23  -2.114 -13.538  25.492
  256    H1*    T  23           H1*        T  23  -2.804 -11.304  25.383
  257    H3     T  23           H3         T  23  -3.239 -10.106  21.196
  258   1H5M    T  23          1H5M        T  23   1.060 -12.248  20.533
  259   2H5M    T  23          2H5M        T  23   1.895 -11.502  21.897
  260   3H5M    T  23          3H5M        T  23   1.369 -10.510  20.536
  261    H6     T  23           H6         T  23   0.468 -11.743  23.722
  262   1H5*    T  24          1H5*        T  24  -4.844 -12.595  27.502
  263   2H5*    T  24          2H5*        T  24  -5.456 -13.976  28.412
  264    H4*    T  24           H4*        T  24  -7.037 -13.330  26.780
  265    H3*    T  24           H3*        T  24  -6.314 -15.970  26.989
  266   1H2*    T  24          1H2*        T  24  -4.909 -16.030  25.025
  267   2H2*    T  24          2H2*        T  24  -6.481 -16.411  24.320
  268    H1*    T  24           H1*        T  24  -6.835 -14.218  23.585
  269    H3     T  24           H3         T  24  -4.421 -13.283  20.041
  270   1H5M    T  24          1H5M        T  24  -0.887 -15.724  22.176
  271   2H5M    T  24          2H5M        T  24  -1.074 -15.122  23.823
  272   3H5M    T  24          3H5M        T  24  -0.500 -14.044  22.551
  273    H6     T  24           H6         T  24  -3.310 -14.955  24.374
  274   1H5*    A  25          1H5*        A  25  -9.904 -15.370  23.997
  275   2H5*    A  25          2H5*        A  25 -10.913 -16.806  24.177
  276    H4*    A  25           H4*        A  25 -10.726 -16.186  21.911
  277    H3*    A  25           H3*        A  25  -9.735 -18.840  22.714
  278    H1*    A  25           H1*        A  25  -8.783 -16.415  19.752
  279    H8     A  25           H8         A  25  -5.940 -17.314  22.235
  280   1H6     A  25          1H6         A  25  -2.226 -16.043  17.474
  281   2H6     A  25          2H6         A  25  -2.302 -16.495  19.143
  282    H2     A  25           H2         A  25  -6.476 -15.646  16.086
  283   1H2*    A  25          1H2*        A  25  -8.056 -18.941  21.127
  284   2H2*    A  25          2H2*        A  25  -9.280 -18.649  19.892
  285   1H5*    G  26          1H5*        G  26 -11.979 -18.053  18.914
  286   2H5*    G  26          2H5*        G  26 -13.088 -19.387  18.596
  287    H4*    G  26           H4*        G  26 -12.236 -18.473  16.568
  288    H3*    G  26           H3*        G  26 -12.352 -21.173  16.924
  289    H1*    G  26           H1*        G  26  -9.251 -19.498  15.352
  290    H8     G  26           H8         G  26  -8.404 -20.516  19.018
  291    H1     G  26           H1         G  26  -3.543 -18.609  15.298
  292   1H2     G  26          1H2         G  26  -4.302 -17.979  13.268
  293   2H2     G  26          2H2         G  26  -5.982 -18.059  12.928
  294   1H2*    G  26          1H2*        G  26 -10.011 -21.483  17.481
  295   2H2*    G  26          2H2*        G  26  -9.982 -21.683  15.729
  296   1H5*    G  27          1H5*        G  27 -11.350 -19.933  12.229
  297   2H5*    G  27          2H5*        G  27 -12.163 -21.300  11.467
  298    H4*    G  27           H4*        G  27 -10.344 -20.859  10.175
  299    H3*    G  27           H3*        G  27  -9.793 -23.314  11.868
  300    H1*    G  27           H1*        G  27  -6.965 -20.788  10.965
  301    H8     G  27           H8         G  27  -8.838 -22.374  13.988
  302    H1     G  27           H1         G  27  -2.473 -21.802  14.494
  303   1H2     G  27          1H2         G  27  -1.597 -21.003  12.574
  304   2H2     G  27          2H2         G  27  -2.631 -20.646  11.253
  305   1H2*    G  27          1H2*        G  27  -7.584 -23.402  10.860
  306   2H2*    G  27          2H2*        G  27  -8.046 -22.286   9.575
  Start of MODEL    4
    1   1H5*    C   1          1H5*        C   1   5.593 -22.697  14.491
    2   2H5*    C   1          2H5*        C   1   4.096 -22.360  15.360
    3    H4*    C   1           H4*        C   1   4.377 -23.251  12.533
    4    H3*    C   1           H3*        C   1   4.795 -20.666  13.113
    5    H1*    C   1           H1*        C   1   1.192 -21.723  12.241
    6   1H4     C   1          1H4         C   1  -3.504 -21.858  16.398
    7   2H4     C   1          2H4         C   1  -2.420 -21.839  17.748
    8    H5     C   1           H5         C   1  -0.007 -21.807  17.514
    9    H6     C   1           H6         C   1   1.831 -21.787  15.890
   10   1H2*    C   1          1H2*        C   1   2.740 -20.354  14.417
   11   2H2*    C   1          2H2*        C   1   2.286 -19.758  12.821
   12   1H5*    C   2          1H5*        C   2   1.795 -20.432   9.445
   13   2H5*    C   2          2H5*        C   2   2.563 -19.164   8.489
   14    H4*    C   2           H4*        C   2   0.247 -18.782   8.531
   15    H3*    C   2           H3*        C   2   1.968 -16.742   9.360
   16    H1*    C   2           H1*        C   2  -1.528 -17.521  10.833
   17   1H4     C   2          1H4         C   2  -2.463 -18.792  16.893
   18   2H4     C   2          2H4         C   2  -0.769 -18.741  17.244
   19    H5     C   2           H5         C   2   0.927 -18.374  15.551
   20    H6     C   2           H6         C   2   1.292 -17.979  13.157
   21   1H2*    C   2          1H2*        C   2   1.245 -16.666  11.631
   22   2H2*    C   2          2H2*        C   2  -0.046 -15.712  10.903
   23   1H5*    T   3          1H5*        T   3  -2.379 -15.911   8.270
   24   2H5*    T   3          2H5*        T   3  -2.479 -14.375   7.409
   25    H4*    T   3           H4*        T   3  -4.456 -14.777   8.683
   26    H3*    T   3           H3*        T   3  -3.122 -12.335   8.827
   27   1H2*    T   3          1H2*        T   3  -2.406 -12.538  11.098
   28   2H2*    T   3          2H2*        T   3  -4.052 -11.965  11.369
   29    H1*    T   3           H1*        T   3  -4.878 -14.117  11.781
   30    H3     T   3           H3         T   3  -3.755 -15.299  15.839
   31   1H5M    T   3          1H5M        T   3   0.729 -15.472  14.726
   32   2H5M    T   3          2H5M        T   3   0.708 -13.721  14.503
   33   3H5M    T   3          3H5M        T   3   0.809 -14.788  13.101
   34    H6     T   3           H6         T   3  -1.185 -14.142  11.985
   35   1H5*    A   4          1H5*        A   4  -7.586 -12.630  10.262
   36   2H5*    A   4          2H5*        A   4  -8.308 -11.115   9.720
   37    H4*    A   4           H4*        A   4  -9.359 -11.894  11.708
   38    H3*    A   4           H3*        A   4  -8.583  -9.267  11.473
   39    H1*    A   4           H1*        A   4  -8.153 -11.301  14.731
   40    H8     A   4           H8         A   4  -4.670 -10.773  13.092
   41   1H6     A   4          1H6         A   4  -2.510 -12.896  18.466
   42   2H6     A   4          2H6         A   4  -2.091 -12.264  16.911
   43    H2     A   4           H2         A   4  -6.994 -13.023  18.606
   44   1H2*    A   4          1H2*        A   4  -6.658  -9.416  12.921
   45   2H2*    A   4          2H2*        A   4  -7.924  -9.060  14.096
   46   1H5*    A   5          1H5*        A   5 -11.083 -10.651  14.967
   47   2H5*    A   5          2H5*        A   5 -12.431  -9.522  15.097
   48    H4*    A   5           H4*        A   5 -12.080 -10.476  17.197
   49    H3*    A   5           H3*        A   5 -12.191  -7.762  17.059
   50    H1*    A   5           H1*        A   5  -9.510  -9.511  19.216
   51    H8     A   5           H8         A   5  -7.845  -8.138  15.987
   52   1H6     A   5          1H6         A   5  -2.562  -9.612  18.814
   53   2H6     A   5          2H6         A   5  -3.276  -8.896  17.410
   54    H2     A   5           H2         A   5  -5.967 -10.906  21.436
   55   1H2*    A   5          1H2*        A   5  -9.792  -7.384  17.108
   56   2H2*    A   5          2H2*        A   5 -10.197  -7.315  18.822
   57   1H5*    T   6          1H5*        T   6 -12.115  -9.439  21.440
   58   2H5*    T   6          2H5*        T   6 -12.913  -8.287  22.512
   59    H4*    T   6           H4*        T   6 -10.995  -9.295  23.488
   60    H3*    T   6           H3*        T   6 -10.964  -6.305  23.161
   61   1H2*    T   6          1H2*        T   6  -8.689  -6.161  23.657
   62   2H2*    T   6          2H2*        T   6  -8.802  -7.482  24.821
   63    H1*    T   6           H1*        T   6  -7.992  -8.918  23.304
   64    H3     T   6           H3         T   6  -4.325  -7.127  21.560
   65   1H5M    T   6          1H5M        T   6  -6.945  -5.939  17.825
   66   2H5M    T   6          2H5M        T   6  -7.216  -4.486  18.787
   67   3H5M    T   6          3H5M        T   6  -8.526  -5.644  18.552
   68    H6     T   6           H6         T   6  -8.972  -6.758  20.527
   69   1H5*    T   7          1H5*        T   7  -9.429  -7.571  26.990
   70   2H5*    T   7          2H5*        T   7  -9.944  -6.404  28.208
   71    H4*    T   7           H4*        T   7  -7.543  -6.920  28.200
   72    H3*    T   7           H3*        T   7  -8.632  -4.386  28.636
   73   1H2*    T   7          1H2*        T   7  -7.820  -3.379  26.631
   74   2H2*    T   7          2H2*        T   7  -6.361  -3.253  27.614
   75    H1*    T   7           H1*        T   7  -5.391  -5.159  26.662
   76    H3     T   7           H3         T   7  -3.795  -4.011  22.757
   77   1H5M    T   7          1H5M        T   7  -8.535  -2.265  22.297
   78   2H5M    T   7          2H5M        T   7  -9.022  -3.950  22.107
   79   3H5M    T   7          3H5M        T   7  -7.898  -3.222  20.959
   80    H6     T   7           H6         T   7  -8.231  -4.133  24.524
   81   1H5*    A   8          1H5*        A   8  -4.104  -4.963  29.411
   82   2H5*    A   8          2H5*        A   8  -3.885  -4.275  31.019
   83    H4*    A   8           H4*        A   8  -1.917  -3.900  29.844
   84    H3*    A   8           H3*        A   8  -3.212  -1.682  30.878
   85    H1*    A   8           H1*        A   8  -1.391  -1.754  27.468
   86    H8     A   8           H8         A   8  -5.229  -1.572  26.875
   87   1H6     A   8          1H6         A   8  -3.634  -0.257  21.062
   88   2H6     A   8          2H6         A   8  -4.948  -0.461  22.169
   89    H2     A   8           H2         A   8   0.116  -0.990  23.417
   90   1H2*    A   8          1H2*        A   8  -3.910  -0.753  28.779
   91   2H2*    A   8          2H2*        A   8  -2.274  -0.100  28.868
   92   1H5*    T   9          1H5*        T   9   1.122  -1.318  29.387
   93   2H5*    T   9          2H5*        T   9   1.982  -0.315  30.556
   94    H4*    T   9           H4*        T   9   2.919  -0.045  28.394
   95    H3*    T   9           H3*        T   9   2.220   2.176  29.906
   96   1H2*    T   9          1H2*        T   9   0.395   2.894  28.532
   97   2H2*    T   9          2H2*        T   9   1.734   3.621  27.644
   98    H1*    T   9           H1*        T   9   1.809   1.891  26.071
   99    H3     T   9           H3         T   9  -1.458   2.377  23.200
  100   1H5M    T   9          1H5M        T   9  -3.693   1.822  28.053
  101   2H5M    T   9          2H5M        T   9  -4.589   1.469  26.575
  102   3H5M    T   9          3H5M        T   9  -4.280   3.142  27.041
  103    H6     T   9           H6         T   9  -1.377   1.814  27.942
  104   1H5*    A  10          1H5*        A  10   4.708   2.900  26.112
  105   2H5*    A  10          2H5*        A  10   5.969   4.052  26.554
  106    H4*    A  10           H4*        A  10   5.323   4.437  24.326
  107    H3*    A  10           H3*        A  10   5.206   6.555  26.171
  108    H1*    A  10           H1*        A  10   2.830   5.926  23.171
  109    H8     A  10           H8         A  10   0.911   5.565  26.532
  110   1H6     A  10          1H6         A  10  -4.106   5.648  22.942
  111   2H6     A  10          2H6         A  10  -3.516   5.571  24.567
  112    H2     A  10           H2         A  10  -0.485   5.884  20.301
  113   1H2*    A  10          1H2*        A  10   2.872   6.952  26.001
  114   2H2*    A  10          2H2*        A  10   3.373   7.762  24.517
  115   1H5*    A  11          1H5*        A  11   5.307   7.503  21.739
  116   2H5*    A  11          2H5*        A  11   6.263   8.950  21.422
  117    H4*    A  11           H4*        A  11   4.368   8.814  19.976
  118    H3*    A  11           H3*        A  11   4.899  11.158  21.499
  119    H1*    A  11           H1*        A  11   1.481   9.681  20.366
  120    H8     A  11           H8         A  11   1.797   9.677  24.241
  121   1H6     A  11          1H6         A  11  -4.283   8.643  24.086
  122   2H6     A  11          2H6         A  11  -2.902   8.879  25.102
  123    H2     A  11           H2         A  11  -2.792   8.892  19.860
  124   1H2*    A  11          1H2*        A  11   2.795  11.271  22.558
  125   2H2*    A  11          2H2*        A  11   2.260  11.807  20.965
  126   1H5*    C  12          1H5*        C  12   2.363  11.948  17.669
  127   2H5*    C  12          2H5*        C  12   2.856  13.536  17.080
  128    H4*    C  12           H4*        C  12   0.524  13.324  16.974
  129    H3*    C  12           H3*        C  12   1.616  15.410  18.742
  130    H1*    C  12           H1*        C  12  -1.766  13.379  18.774
  131   1H4     C  12          1H4         C  12  -3.626  11.741  24.520
  132   2H4     C  12          2H4         C  12  -2.023  11.867  25.165
  133    H5     C  12           H5         C  12  -0.109  12.543  23.841
  134    H6     C  12           H6         C  12   0.614  13.236  21.601
  135   1H2*    C  12          1H2*        C  12  -0.108  15.323  20.281
  136   2H2*    C  12          2H2*        C  12  -1.236  15.601  18.954
  137   1H5*    G  13          1H5*        G  13  -2.162  16.484  16.969
  138   2H5*    G  13          2H5*        G  13  -2.137  18.159  16.418
  139    H4*    G  13           H4*        G  13  -4.117  17.607  17.674
  140    H3*    G  13           H3*        G  13  -2.907  20.003  17.945
  141    H1*    G  13           H1*        G  13  -3.874  18.048  21.124
  142    H8     G  13           H8         G  13  -0.044  18.073  20.751
  143    H1     G  13           H1         G  13  -2.393  14.589  25.593
  144   1H2     G  13          1H2         G  13  -4.643  14.479  25.467
  145   2H2     G  13          2H2         G  13  -5.461  15.273  24.186
  146   1H2*    G  13          1H2*        G  13  -1.507  19.387  19.850
  147   2H2*    G  13          2H2*        G  13  -2.912  20.110  20.633
  148   1H5*    A  14          1H5*        A  14  -7.070  19.524  18.838
  149   2H5*    A  14          2H5*        A  14  -8.198  20.878  18.916
  150    H4*    A  14           H4*        A  14  -8.845  19.074  20.358
  151    H3*    A  14           H3*        A  14  -9.033  21.658  21.171
  152    H1*    A  14           H1*        A  14  -7.547  18.982  23.521
  153    H8     A  14           H8         A  14  -4.574  20.854  21.841
  154   1H6     A  14          1H6         A  14  -1.274  18.480  26.481
  155   2H6     A  14          2H6         A  14  -1.232  19.470  25.062
  156    H2     A  14           H2         A  14  -5.522  17.106  26.932
  157   1H2*    A  14          1H2*        A  14  -6.940  21.710  22.410
  158   2H2*    A  14          2H2*        A  14  -8.089  21.246  23.664
  159   1H5*    A  15          1H5*        A  15 -12.592  19.312  25.080
  160   2H5*    A  15          2H5*        A  15 -10.908  19.193  24.571
  161    H4*    A  15           H4*        A  15 -13.144  17.852  23.138
  162    H3*    A  15           H3*        A  15 -12.573  17.001  25.692
  163    H1*    A  15           H1*        A  15 -11.145  15.298  22.531
  164    H8     A  15           H8         A  15  -8.350  15.624  24.818
  165   1H6     A  15          1H6         A  15  -4.559  15.792  19.954
  166   2H6     A  15          2H6         A  15  -4.669  15.602  21.671
  167    H2     A  15           H2         A  15  -8.756  16.406  18.487
  168   1H2*    A  15          1H2*        A  15 -10.313  16.289  25.250
  169   2H2*    A  15          2H2*        A  15 -11.202  14.827  24.822
  170   1H5*    G  16          1H5*        G  16 -14.582  12.284  25.000
  171   2H5*    G  16          2H5*        G  16 -12.965  11.665  25.338
  172    H4*    G  16           H4*        G  16 -13.964  13.221  23.039
  173    H3*    G  16           H3*        G  16 -13.860  10.579  22.921
  174    H1*    G  16           H1*        G  16 -10.596  12.291  21.835
  175    H8     G  16           H8         G  16 -10.486  12.071  25.738
  176    H1     G  16           H1         G  16  -4.873  12.518  22.672
  177   1H2     G  16          1H2         G  16  -5.195  12.577  20.440
  178   2H2     G  16          2H2         G  16  -6.789  12.505  19.811
  179   1H2*    G  16          1H2*        G  16 -11.596  10.365  23.895
  180   2H2*    G  16          2H2*        G  16 -11.339  10.130  22.167
  181   1H5*    T  17          1H5*        T  17 -11.302  12.280  19.334
  182   2H5*    T  17          2H5*        T  17 -12.234  11.527  18.040
  183    H4*    T  17           H4*        T  17 -10.054  11.713  17.276
  184    H3*    T  17           H3*        T  17 -11.151   9.191  17.274
  185   1H2*    T  17          1H2*        T  17  -9.904   8.343  19.158
  186   2H2*    T  17          2H2*        T  17  -8.786   7.989  17.840
  187    H1*    T  17           H1*        T  17  -7.479   9.884  18.259
  188    H3     T  17           H3         T  17  -4.921   9.073  21.716
  189   1H5M    T  17          1H5M        T  17  -9.993   8.399  23.328
  190   2H5M    T  17          2H5M        T  17  -8.984   9.413  24.361
  191   3H5M    T  17          3H5M        T  17  -8.627   7.694  24.192
  192    H6     T  17           H6         T  17  -9.664   9.228  21.170
  193   1H5*    T  18          1H5*        T  18  -7.088   9.909  15.258
  194   2H5*    T  18          2H5*        T  18  -7.121   9.023  13.733
  195    H4*    T  18           H4*        T  18  -4.900   9.195  14.605
  196    H3*    T  18           H3*        T  18  -5.952   6.747  13.737
  197   1H2*    T  18          1H2*        T  18  -5.884   5.643  15.844
  198   2H2*    T  18          2H2*        T  18  -4.187   5.465  15.400
  199    H1*    T  18           H1*        T  18  -3.515   7.291  16.700
  200    H3     T  18           H3         T  18  -3.354   5.580  20.726
  201   1H5M    T  18          1H5M        T  18  -8.531   6.383  19.543
  202   2H5M    T  18          2H5M        T  18  -7.952   6.357  21.209
  203   3H5M    T  18          3H5M        T  18  -8.110   4.849  20.306
  204    H6     T  18           H6         T  18  -6.982   6.772  17.859
  205   1H5*    A  19          1H5*        A  19  -1.329   7.048  14.517
  206   2H5*    A  19          2H5*        A  19  -0.731   6.436  12.975
  207    H4*    A  19           H4*        A  19   0.842   5.855  14.571
  208    H3*    A  19           H3*        A  19  -0.234   3.792  13.104
  209    H1*    A  19           H1*        A  19   0.518   3.517  16.884
  210    H8     A  19           H8         A  19  -3.320   3.593  16.333
  211   1H6     A  19          1H6         A  19  -3.595   2.235  22.345
  212   2H6     A  19          2H6         A  19  -4.508   2.489  20.898
  213    H2     A  19           H2         A  19   0.714   2.801  21.228
  214   1H2*    A  19          1H2*        A  19  -1.622   2.893  14.860
  215   2H2*    A  19          2H2*        A  19  -0.108   2.045  15.176
  216   1H5*    T  20          1H5*        T  20   3.293   2.987  15.836
  217   2H5*    T  20          2H5*        T  20   4.438   1.926  15.015
  218    H4*    T  20           H4*        T  20   4.518   1.553  17.349
  219    H3*    T  20           H3*        T  20   4.117  -0.602  15.594
  220   1H2*    T  20          1H2*        T  20   1.972  -1.230  16.399
  221   2H2*    T  20          2H2*        T  20   2.949  -1.969  17.668
  222    H1*    T  20           H1*        T  20   2.624  -0.185  19.147
  223    H3     T  20           H3         T  20  -1.366  -0.699  20.856
  224   1H5M    T  20          1H5M        T  20  -2.824  -0.871  16.167
  225   2H5M    T  20          2H5M        T  20  -2.074   0.666  15.732
  226   3H5M    T  20          3H5M        T  20  -3.387   0.627  16.911
  227    H6     T  20           H6         T  20   0.152   0.234  16.425
  228   1H5*    A  21          1H5*        A  21   5.483  -1.405  19.966
  229   2H5*    A  21          2H5*        A  21   6.784  -2.582  19.779
  230    H4*    A  21           H4*        A  21   5.722  -2.969  21.831
  231    H3*    A  21           H3*        A  21   6.015  -5.082  20.098
  232    H1*    A  21           H1*        A  21   2.815  -4.517  22.190
  233    H8     A  21           H8         A  21   2.056  -3.806  18.453
  234   1H6     A  21          1H6         A  21  -3.806  -3.449  20.341
  235   2H6     A  21          2H6         A  21  -2.742  -3.406  18.978
  236    H2     A  21           H2         A  21  -1.206  -4.082  23.944
  237   1H2*    A  21          1H2*        A  21   3.708  -5.185  19.393
  238   2H2*    A  21          2H2*        A  21   3.661  -6.217  20.822
  239   1H5*    A  22          1H5*        A  22   5.086  -5.976  24.599
  240   2H5*    A  22          2H5*        A  22   6.057  -7.404  24.956
  241    H4*    A  22           H4*        A  22   4.144  -7.316  26.355
  242    H3*    A  22           H3*        A  22   4.830  -9.656  25.187
  243    H1*    A  22           H1*        A  22   1.147  -8.517  25.116
  244    H8     A  22           H8         A  22   2.717  -7.988  21.614
  245   1H6     A  22          1H6         A  22  -3.030  -6.539  19.899
  246   2H6     A  22          2H6         A  22  -1.402  -6.787  19.366
  247    H2     A  22           H2         A  22  -3.021  -7.246  24.331
  248   1H2*    A  22          1H2*        A  22   3.327  -9.461  23.277
  249   2H2*    A  22          2H2*        A  22   2.353 -10.384  24.420
  250   1H5*    T  23          1H5*        T  23   1.019 -10.034  27.825
  251   2H5*    T  23          2H5*        T  23   0.930 -11.665  28.489
  252    H4*    T  23           H4*        T  23  -1.188 -10.812  27.778
  253    H3*    T  23           H3*        T  23  -0.170 -13.349  26.617
  254   1H2*    T  23          1H2*        T  23  -1.435 -13.210  24.689
  255   2H2*    T  23          2H2*        T  23  -2.861 -12.823  25.652
  256    H1*    T  23           H1*        T  23  -2.661 -10.605  25.245
  257    H3     T  23           H3         T  23  -3.098 -10.054  20.900
  258   1H5M    T  23          1H5M        T  23   1.264 -12.196  20.559
  259   2H5M    T  23          2H5M        T  23   2.034 -11.281  21.855
  260   3H5M    T  23          3H5M        T  23   1.513 -10.458  20.384
  261    H6     T  23           H6         T  23   0.541 -11.477  23.647
  262   1H5*    T  24          1H5*        T  24  -4.425 -12.954  27.521
  263   2H5*    T  24          2H5*        T  24  -5.031 -14.429  28.273
  264    H4*    T  24           H4*        T  24  -6.600 -13.543  26.705
  265    H3*    T  24           H3*        T  24  -5.944 -16.230  26.716
  266   1H2*    T  24          1H2*        T  24  -4.683 -16.225  24.672
  267   2H2*    T  24          2H2*        T  24  -6.312 -16.426  24.027
  268    H1*    T  24           H1*        T  24  -6.534 -14.155  23.509
  269    H3     T  24           H3         T  24  -4.312 -13.359  19.824
  270   1H5M    T  24          1H5M        T  24  -0.567 -15.536  21.732
  271   2H5M    T  24          2H5M        T  24  -0.783 -15.183  23.448
  272   3H5M    T  24          3H5M        T  24  -0.284 -13.904  22.339
  273    H6     T  24           H6         T  24  -2.968 -14.918  24.134
  274   1H5*    A  25          1H5*        A  25  -9.539 -15.018  23.961
  275   2H5*    A  25          2H5*        A  25 -10.746 -16.248  24.334
  276    H4*    A  25           H4*        A  25 -10.945 -15.645  22.072
  277    H3*    A  25           H3*        A  25 -10.668 -18.323  22.731
  278    H1*    A  25           H1*        A  25  -9.071 -16.653  19.630
  279    H8     A  25           H8         A  25  -6.302 -17.681  22.147
  280   1H6     A  25          1H6         A  25  -2.446 -16.194  17.567
  281   2H6     A  25          2H6         A  25  -2.577 -16.826  19.172
  282    H2     A  25           H2         A  25  -6.633 -15.285  16.229
  283   1H2*    A  25          1H2*        A  25  -8.463 -18.611  21.835
  284   2H2*    A  25          2H2*        A  25  -9.415 -18.847  20.369
  285   1H5*    G  26          1H5*        G  26 -12.187 -17.127  18.454
  286   2H5*    G  26          2H5*        G  26 -13.510 -18.265  18.194
  287    H4*    G  26           H4*        G  26 -12.568 -17.629  16.123
  288    H3*    G  26           H3*        G  26 -13.046 -20.255  16.601
  289    H1*    G  26           H1*        G  26  -9.698 -19.166  15.021
  290    H8     G  26           H8         G  26  -9.093 -20.244  18.698
  291    H1     G  26           H1         G  26  -3.934 -18.554  15.286
  292   1H2     G  26          1H2         G  26  -4.548 -17.784  13.255
  293   2H2     G  26          2H2         G  26  -6.210 -17.722  12.839
  294   1H2*    G  26          1H2*        G  26 -10.779 -20.827  17.282
  295   2H2*    G  26          2H2*        G  26 -10.740 -21.182  15.556
  296   1H5*    G  27          1H5*        G  27 -11.998 -18.977  12.212
  297   2H5*    G  27          2H5*        G  27 -12.966 -20.057  11.208
  298    H4*    G  27           H4*        G  27 -10.997 -19.283  10.084
  299    H3*    G  27           H3*        G  27 -11.817 -21.833   9.810
  300    H1*    G  27           H1*        G  27  -8.106 -21.187  10.627
  301    H8     G  27           H8         G  27  -9.952 -22.166  13.918
  302    H1     G  27           H1         G  27  -3.550 -21.887  14.123
  303   1H2     G  27          1H2         G  27  -2.725 -21.196  12.139
  304   2H2     G  27          2H2         G  27  -3.802 -20.832  10.854
  305   1H2*    G  27          1H2*        G  27 -10.464 -22.748  11.633
  306   2H2*    G  27          2H2*        G  27  -9.450 -23.040  10.221
  Start of MODEL    5
    1   1H5*    C   1          1H5*        C   1   7.353 -19.631  14.443
    2   2H5*    C   1          2H5*        C   1   6.096 -19.510  15.676
    3    H4*    C   1           H4*        C   1   5.931 -20.947  13.065
    4    H3*    C   1           H3*        C   1   5.418 -18.202  13.464
    5    H1*    C   1           H1*        C   1   2.832 -21.049  12.941
    6   1H4     C   1          1H4         C   1  -2.088 -21.523  16.795
    7   2H4     C   1          2H4         C   1  -1.103 -21.244  18.191
    8    H5     C   1           H5         C   1   1.266 -20.741  18.066
    9    H6     C   1           H6         C   1   3.148 -20.409  16.527
   10   1H2*    C   1          1H2*        C   1   3.258 -18.454  14.406
   11   2H2*    C   1          2H2*        C   1   2.818 -18.721  12.718
   12   1H5*    C   2          1H5*        C   2   2.820 -19.016   9.764
   13   2H5*    C   2          2H5*        C   2   3.297 -17.658   8.742
   14    H4*    C   2           H4*        C   2   0.970 -17.680   8.847
   15    H3*    C   2           H3*        C   2   2.299 -15.365   9.730
   16    H1*    C   2           H1*        C   2  -1.005 -16.843  11.120
   17   1H4     C   2          1H4         C   2  -1.771 -18.242  17.173
   18   2H4     C   2          2H4         C   2  -0.114 -17.907  17.541
   19    H5     C   2           H5         C   2   1.513 -17.250  15.869
   20    H6     C   2           H6         C   2   1.830 -16.785  13.479
   21   1H2*    C   2          1H2*        C   2   1.507 -15.418  11.968
   22   2H2*    C   2          2H2*        C   2   0.059 -14.762  11.204
   23   1H5*    T   3          1H5*        T   3  -2.069 -15.284   8.369
   24   2H5*    T   3          2H5*        T   3  -2.409 -13.757   7.553
   25    H4*    T   3           H4*        T   3  -4.335 -14.572   8.704
   26    H3*    T   3           H3*        T   3  -3.519 -11.933   8.956
   27   1H2*    T   3          1H2*        T   3  -2.805 -12.072  11.240
   28   2H2*    T   3          2H2*        T   3  -4.530 -11.799  11.483
   29    H1*    T   3           H1*        T   3  -4.978 -14.070  11.829
   30    H3     T   3           H3         T   3  -3.708 -15.295  15.839
   31   1H5M    T   3          1H5M        T   3   0.279 -12.641  14.850
   32   2H5M    T   3          2H5M        T   3   0.658 -13.463  13.337
   33   3H5M    T   3          3H5M        T   3   0.729 -14.346  14.862
   34    H6     T   3           H6         T   3  -1.383 -13.304  12.174
   35   1H5*    A   4          1H5*        A   4  -7.847 -13.087  10.533
   36   2H5*    A   4          2H5*        A   4  -8.780 -11.769   9.823
   37    H4*    A   4           H4*        A   4  -9.826 -12.444  11.808
   38    H3*    A   4           H3*        A   4  -9.300  -9.786  11.468
   39    H1*    A   4           H1*        A   4  -8.717 -11.539  14.857
   40    H8     A   4           H8         A   4  -5.299 -10.725  13.221
   41   1H6     A   4          1H6         A   4  -2.942 -12.655  18.586
   42   2H6     A   4          2H6         A   4  -2.588 -11.967  17.039
   43    H2     A   4           H2         A   4  -7.387 -13.263  18.705
   44   1H2*    A   4          1H2*        A   4  -7.351  -9.700  12.906
   45   2H2*    A   4          2H2*        A   4  -8.642  -9.347  14.054
   46   1H5*    A   5          1H5*        A   5 -11.703 -10.830  15.084
   47   2H5*    A   5          2H5*        A   5 -12.955  -9.661  15.502
   48    H4*    A   5           H4*        A   5 -11.912 -10.520  17.443
   49    H3*    A   5           H3*        A   5 -11.877  -7.648  16.959
   50    H1*    A   5           H1*        A   5  -9.452 -10.028  18.938
   51    H8     A   5           H8         A   5  -7.744  -8.272  15.928
   52   1H6     A   5          1H6         A   5  -2.546  -9.406  19.053
   53   2H6     A   5          2H6         A   5  -3.223  -8.750  17.602
   54    H2     A   5           H2         A   5  -6.009 -10.857  21.512
   55   1H2*    A   5          1H2*        A   5  -9.688  -7.321  17.678
   56   2H2*    A   5          2H2*        A   5 -10.252  -7.870  19.257
   57   1H5*    T   6          1H5*        T   6 -12.134  -9.260  21.108
   58   2H5*    T   6          2H5*        T   6 -12.987  -8.200  22.230
   59    H4*    T   6           H4*        T   6 -11.038  -9.137  23.191
   60    H3*    T   6           H3*        T   6 -11.160  -6.162  22.949
   61   1H2*    T   6          1H2*        T   6  -8.877  -5.875  23.215
   62   2H2*    T   6          2H2*        T   6  -8.845  -7.086  24.498
   63    H1*    T   6           H1*        T   6  -8.106  -8.673  23.086
   64    H3     T   6           H3         T   6  -4.348  -7.118  21.345
   65   1H5M    T   6          1H5M        T   6  -6.956  -5.898  17.552
   66   2H5M    T   6          2H5M        T   6  -6.955  -4.386  18.462
   67   3H5M    T   6          3H5M        T   6  -8.435  -5.339  18.337
   68    H6     T   6           H6         T   6  -8.957  -6.522  20.244
   69   1H5*    T   7          1H5*        T   7  -9.457  -7.234  26.868
   70   2H5*    T   7          2H5*        T   7  -9.873  -5.927  27.977
   71    H4*    T   7           H4*        T   7  -7.497  -6.447  27.762
   72    H3*    T   7           H3*        T   7  -8.538  -3.678  27.496
   73   1H2*    T   7          1H2*        T   7  -6.753  -2.913  26.243
   74   2H2*    T   7          2H2*        T   7  -5.633  -3.677  27.369
   75    H1*    T   7           H1*        T   7  -5.339  -5.469  26.019
   76    H3     T   7           H3         T   7  -3.604  -4.071  22.229
   77   1H5M    T   7          1H5M        T   7  -8.305  -2.049  21.931
   78   2H5M    T   7          2H5M        T   7  -8.766  -3.697  21.496
   79   3H5M    T   7          3H5M        T   7  -7.604  -2.813  20.503
   80    H6     T   7           H6         T   7  -8.033  -3.940  24.013
   81   1H5*    A   8          1H5*        A   8  -4.735  -4.529  29.596
   82   2H5*    A   8          2H5*        A   8  -4.706  -3.593  31.090
   83    H4*    A   8           H4*        A   8  -2.537  -3.707  30.144
   84    H3*    A   8           H3*        A   8  -3.501  -1.313  31.017
   85    H1*    A   8           H1*        A   8  -1.619  -1.585  27.659
   86    H8     A   8           H8         A   8  -5.419  -1.204  26.948
   87   1H6     A   8          1H6         A   8  -3.621  -0.359  21.108
   88   2H6     A   8          2H6         A   8  -4.967  -0.396  22.195
   89    H2     A   8           H2         A   8   0.017  -1.235  23.585
   90   1H2*    A   8          1H2*        A   8  -4.148  -0.462  28.838
   91   2H2*    A   8          2H2*        A   8  -2.494   0.135  28.972
   92   1H5*    T   9          1H5*        T   9   0.868  -1.329  29.487
   93   2H5*    T   9          2H5*        T   9   1.785  -0.343  30.626
   94    H4*    T   9           H4*        T   9   2.715  -0.160  28.454
   95    H3*    T   9           H3*        T   9   2.105   2.130  29.912
   96   1H2*    T   9          1H2*        T   9   0.328   2.897  28.505
   97   2H2*    T   9          2H2*        T   9   1.704   3.526  27.599
   98    H1*    T   9           H1*        T   9   1.694   1.742  26.083
   99    H3     T   9           H3         T   9  -1.539   2.295  23.187
  100   1H5M    T   9          1H5M        T   9  -4.724   1.685  26.564
  101   2H5M    T   9          2H5M        T   9  -4.311   3.341  27.010
  102   3H5M    T   9          3H5M        T   9  -3.813   2.000  28.042
  103    H6     T   9           H6         T   9  -1.494   1.893  27.946
  104   1H5*    A  10          1H5*        A  10   4.506   2.637  25.999
  105   2H5*    A  10          2H5*        A  10   5.878   3.629  26.493
  106    H4*    A  10           H4*        A  10   5.384   4.157  24.277
  107    H3*    A  10           H3*        A  10   5.429   6.225  26.110
  108    H1*    A  10           H1*        A  10   2.902   5.970  23.197
  109    H8     A  10           H8         A  10   1.063   5.471  26.577
  110   1H6     A  10          1H6         A  10  -4.051   5.768  23.139
  111   2H6     A  10          2H6         A  10  -3.417   5.634  24.743
  112    H2     A  10           H2         A  10  -0.501   5.987  20.400
  113   1H2*    A  10          1H2*        A  10   3.063   6.642  26.127
  114   2H2*    A  10          2H2*        A  10   3.537   7.615  24.735
  115   1H5*    A  11          1H5*        A  11   5.390   7.278  21.606
  116   2H5*    A  11          2H5*        A  11   6.428   8.685  21.376
  117    H4*    A  11           H4*        A  11   4.603   8.717  19.849
  118    H3*    A  11           H3*        A  11   5.193  10.957  21.443
  119    H1*    A  11           H1*        A  11   1.689   9.750  20.296
  120    H8     A  11           H8         A  11   2.070   9.219  24.133
  121   1H6     A  11          1H6         A  11  -4.080   8.752  24.029
  122   2H6     A  11          2H6         A  11  -2.665   8.722  25.023
  123    H2     A  11           H2         A  11  -2.655   9.464  19.834
  124   1H2*    A  11          1H2*        A  11   3.128  11.024  22.613
  125   2H2*    A  11          2H2*        A  11   2.584  11.756  21.105
  126   1H5*    C  12          1H5*        C  12   2.386  11.937  17.754
  127   2H5*    C  12          2H5*        C  12   3.039  13.476  17.194
  128    H4*    C  12           H4*        C  12   0.683  13.522  17.064
  129    H3*    C  12           H3*        C  12   2.035  15.547  18.445
  130    H1*    C  12           H1*        C  12  -1.415  14.046  19.366
  131   1H4     C  12          1H4         C  12  -2.632  11.570  24.985
  132   2H4     C  12          2H4         C  12  -0.966  11.607  25.453
  133    H5     C  12           H5         C  12   0.806  12.391  23.996
  134    H6     C  12           H6         C  12   1.292  13.303  21.770
  135   1H2*    C  12          1H2*        C  12   1.132  15.077  20.597
  136   2H2*    C  12          2H2*        C  12  -0.227  15.982  19.930
  137   1H5*    G  13          1H5*        G  13  -2.228  16.247  17.909
  138   2H5*    G  13          2H5*        G  13  -2.622  17.902  17.444
  139    H4*    G  13           H4*        G  13  -4.117  17.059  19.117
  140    H3*    G  13           H3*        G  13  -3.101  19.591  19.266
  141    H1*    G  13           H1*        G  13  -3.333  17.316  22.377
  142    H8     G  13           H8         G  13   0.380  17.873  21.447
  143    H1     G  13           H1         G  13  -0.792  14.169  26.547
  144   1H2     G  13          1H2         G  13  -3.009  13.803  26.764
  145   2H2     G  13          2H2         G  13  -4.097  14.493  25.633
  146   1H2*    G  13          1H2*        G  13  -1.405  19.116  20.928
  147   2H2*    G  13          2H2*        G  13  -2.775  19.545  21.951
  148   1H5*    A  14          1H5*        A  14  -6.615  18.328  21.719
  149   2H5*    A  14          2H5*        A  14  -7.742  19.612  22.157
  150    H4*    A  14           H4*        A  14  -7.661  17.811  23.771
  151    H3*    A  14           H3*        A  14  -7.850  20.432  24.507
  152    H1*    A  14           H1*        A  14  -5.448  18.009  26.309
  153    H8     A  14           H8         A  14  -3.353  20.148  23.820
  154   1H6     A  14          1H6         A  14   1.448  18.217  27.180
  155   2H6     A  14          2H6         A  14   0.945  19.183  25.836
  156    H2     A  14           H2         A  14  -2.283  16.399  28.887
  157   1H2*    A  14          1H2*        A  14  -5.508  20.741  25.051
  158   2H2*    A  14          2H2*        A  14  -6.158  20.214  26.604
  159   1H5*    A  15          1H5*        A  15 -10.703  17.653  28.728
  160   2H5*    A  15          2H5*        A  15  -9.096  17.482  28.022
  161    H4*    A  15           H4*        A  15 -11.657  16.989  26.579
  162    H3*    A  15           H3*        A  15 -10.869  15.214  28.504
  163    H1*    A  15           H1*        A  15 -10.021  14.676  24.776
  164    H8     A  15           H8         A  15  -6.798  15.041  26.783
  165   1H6     A  15          1H6         A  15  -3.946  14.924  21.314
  166   2H6     A  15          2H6         A  15  -3.738  14.905  23.032
  167    H2     A  15           H2         A  15  -8.370  15.147  20.588
  168   1H2*    A  15          1H2*        A  15  -8.742  14.638  27.500
  169   2H2*    A  15          2H2*        A  15  -9.806  13.447  26.752
  170   1H5*    G  16          1H5*        G  16 -13.267  13.583  24.896
  171   2H5*    G  16          2H5*        G  16 -13.873  11.936  25.064
  172    H4*    G  16           H4*        G  16 -12.769  12.695  22.886
  173    H3*    G  16           H3*        G  16 -13.162  10.142  23.790
  174    H1*    G  16           H1*        G  16  -9.748  11.327  22.431
  175    H8     G  16           H8         G  16  -9.527  11.048  26.313
  176    H1     G  16           H1         G  16  -4.040  11.884  23.104
  177   1H2     G  16          1H2         G  16  -4.444  12.110  20.895
  178   2H2     G  16          2H2         G  16  -6.058  12.044  20.317
  179   1H2*    G  16          1H2*        G  16 -10.962   9.844  24.751
  180   2H2*    G  16          2H2*        G  16 -10.686   9.294  23.098
  181   1H5*    T  17          1H5*        T  17 -12.002  10.880  19.500
  182   2H5*    T  17          2H5*        T  17 -12.632   9.665  18.388
  183    H4*    T  17           H4*        T  17 -10.563  10.651  17.629
  184    H3*    T  17           H3*        T  17 -11.066   7.935  17.477
  185   1H2*    T  17          1H2*        T  17  -9.548   7.267  19.215
  186   2H2*    T  17          2H2*        T  17  -8.436   7.336  17.847
  187    H1*    T  17           H1*        T  17  -7.642   9.460  18.425
  188    H3     T  17           H3         T  17  -4.782   8.890  21.685
  189   1H5M    T  17          1H5M        T  17  -8.025   6.654  24.200
  190   2H5M    T  17          2H5M        T  17  -9.544   7.172  23.466
  191   3H5M    T  17          3H5M        T  17  -8.658   8.267  24.529
  192    H6     T  17           H6         T  17  -9.487   8.147  21.352
  193   1H5*    T  18          1H5*        T  18  -7.295   9.553  15.333
  194   2H5*    T  18          2H5*        T  18  -7.294   8.767  13.754
  195    H4*    T  18           H4*        T  18  -5.071   9.138  14.449
  196    H3*    T  18           H3*        T  18  -5.828   6.616  13.612
  197   1H2*    T  18          1H2*        T  18  -5.760   5.567  15.773
  198   2H2*    T  18          2H2*        T  18  -4.068   5.414  15.302
  199    H1*    T  18           H1*        T  18  -3.408   7.278  16.553
  200    H3     T  18           H3         T  18  -3.227   6.288  20.818
  201   1H5M    T  18          1H5M        T  18  -7.384   4.007  20.219
  202   2H5M    T  18          2H5M        T  18  -8.190   5.121  19.114
  203   3H5M    T  18          3H5M        T  18  -7.908   5.591  20.791
  204    H6     T  18           H6         T  18  -6.724   6.020  17.578
  205   1H5*    A  19          1H5*        A  19  -1.289   7.209  14.559
  206   2H5*    A  19          2H5*        A  19  -0.572   6.635  13.054
  207    H4*    A  19           H4*        A  19   0.940   6.130  14.727
  208    H3*    A  19           H3*        A  19   0.028   4.006  13.226
  209    H1*    A  19           H1*        A  19   0.646   3.811  17.036
  210    H8     A  19           H8         A  19  -3.177   3.748  16.351
  211   1H6     A  19          1H6         A  19  -3.591   2.210  22.311
  212   2H6     A  19          2H6         A  19  -4.468   2.482  20.845
  213    H2     A  19           H2         A  19   0.733   2.920  21.340
  214   1H2*    A  19          1H2*        A  19  -1.362   3.031  14.934
  215   2H2*    A  19          2H2*        A  19   0.188   2.286  15.322
  216   1H5*    T  20          1H5*        T  20   3.408   3.338  16.144
  217   2H5*    T  20          2H5*        T  20   4.659   2.360  15.378
  218    H4*    T  20           H4*        T  20   4.615   1.905  17.688
  219    H3*    T  20           H3*        T  20   4.317  -0.223  15.851
  220   1H2*    T  20          1H2*        T  20   2.217  -0.977  16.638
  221   2H2*    T  20          2H2*        T  20   3.206  -1.646  17.936
  222    H1*    T  20           H1*        T  20   2.746   0.130  19.387
  223    H3     T  20           H3         T  20  -1.247  -0.619  20.990
  224   1H5M    T  20          1H5M        T  20  -1.921   0.842  15.896
  225   2H5M    T  20          2H5M        T  20  -3.257   0.644  17.032
  226   3H5M    T  20          3H5M        T  20  -2.558  -0.768  16.236
  227    H6     T  20           H6         T  20   0.324   0.459  16.610
  228   1H5*    A  21          1H5*        A  21   5.758  -1.151  20.175
  229   2H5*    A  21          2H5*        A  21   7.063  -2.319  19.962
  230    H4*    A  21           H4*        A  21   5.919  -2.772  21.974
  231    H3*    A  21           H3*        A  21   6.366  -4.817  20.194
  232    H1*    A  21           H1*        A  21   3.051  -4.421  22.141
  233    H8     A  21           H8         A  21   2.453  -3.597  18.398
  234   1H6     A  21          1H6         A  21  -3.505  -3.517  19.998
  235   2H6     A  21          2H6         A  21  -2.377  -3.383  18.693
  236    H2     A  21           H2         A  21  -1.064  -4.203  23.701
  237   1H2*    A  21          1H2*        A  21   4.101  -4.969  19.372
  238   2H2*    A  21          2H2*        A  21   4.019  -6.048  20.765
  239   1H5*    A  22          1H5*        A  22   5.117  -5.876  24.567
  240   2H5*    A  22          2H5*        A  22   6.079  -7.299  24.967
  241    H4*    A  22           H4*        A  22   4.047  -7.298  26.191
  242    H3*    A  22           H3*        A  22   4.873  -9.572  24.928
  243    H1*    A  22           H1*        A  22   1.184  -8.443  24.820
  244    H8     A  22           H8         A  22   2.814  -7.817  21.355
  245   1H6     A  22          1H6         A  22  -2.949  -6.564  19.544
  246   2H6     A  22          2H6         A  22  -1.302  -6.734  19.043
  247    H2     A  22           H2         A  22  -3.009  -7.377  23.958
  248   1H2*    A  22          1H2*        A  22   3.398  -9.382  23.013
  249   2H2*    A  22          2H2*        A  22   2.400 -10.314  24.129
  250   1H5*    T  23          1H5*        T  23   1.127  -9.936  27.614
  251   2H5*    T  23          2H5*        T  23   1.204 -11.495  28.435
  252    H4*    T  23           H4*        T  23  -1.051 -10.868  27.963
  253    H3*    T  23           H3*        T  23  -0.070 -13.410  27.294
  254   1H2*    T  23          1H2*        T  23  -0.352 -13.213  24.941
  255   2H2*    T  23          2H2*        T  23  -2.023 -13.574  25.370
  256    H1*    T  23           H1*        T  23  -2.667 -11.325  25.309
  257    H3     T  23           H3         T  23  -3.138 -10.147  21.126
  258   1H5M    T  23          1H5M        T  23   1.272 -12.126  20.502
  259   2H5M    T  23          2H5M        T  23   2.054 -11.278  21.837
  260   3H5M    T  23          3H5M        T  23   1.461 -10.374  20.443
  261    H6     T  23           H6         T  23   0.622 -11.665  23.649
  262   1H5*    T  24          1H5*        T  24  -4.660 -12.673  27.468
  263   2H5*    T  24          2H5*        T  24  -5.261 -14.063  28.374
  264    H4*    T  24           H4*        T  24  -6.912 -13.346  26.852
  265    H3*    T  24           H3*        T  24  -6.221 -16.002  26.920
  266   1H2*    T  24          1H2*        T  24  -4.927 -16.005  24.879
  267   2H2*    T  24          2H2*        T  24  -6.542 -16.335  24.249
  268    H1*    T  24           H1*        T  24  -6.900 -14.111  23.620
  269    H3     T  24           H3         T  24  -4.689 -13.155  19.957
  270   1H5M    T  24          1H5M        T  24  -1.128 -14.993  23.540
  271   2H5M    T  24          2H5M        T  24  -0.634 -13.866  22.276
  272   3H5M    T  24          3H5M        T  24  -1.006 -15.541  21.868
  273    H6     T  24           H6         T  24  -3.330 -14.843  24.212
  274   1H5*    A  25          1H5*        A  25  -9.779 -15.303  23.968
  275   2H5*    A  25          2H5*        A  25 -10.872 -16.650  24.287
  276    H4*    A  25           H4*        A  25 -10.780 -16.267  21.975
  277    H3*    A  25           H3*        A  25 -10.039 -18.841  22.969
  278    H1*    A  25           H1*        A  25  -8.798 -16.929  19.808
  279    H8     A  25           H8         A  25  -5.897 -17.677  22.280
  280   1H6     A  25          1H6         A  25  -2.306 -15.894  17.591
  281   2H6     A  25          2H6         A  25  -2.339 -16.496  19.213
  282    H2     A  25           H2         A  25  -6.589 -15.481  16.316
  283   1H2*    A  25          1H2*        A  25  -7.959 -18.952  21.873
  284   2H2*    A  25          2H2*        A  25  -8.955 -19.180  20.435
  285   1H5*    G  26          1H5*        G  26 -11.787 -18.207  18.763
  286   2H5*    G  26          2H5*        G  26 -12.858 -19.570  18.436
  287    H4*    G  26           H4*        G  26 -11.858 -18.781  16.427
  288    H3*    G  26           H3*        G  26 -11.902 -21.469  16.997
  289    H1*    G  26           H1*        G  26  -8.842 -19.707  15.429
  290    H8     G  26           H8         G  26  -8.016 -20.677  19.106
  291    H1     G  26           H1         G  26  -3.209 -18.424  15.511
  292   1H2     G  26          1H2         G  26  -3.965 -17.817  13.473
  293   2H2     G  26          2H2         G  26  -5.629 -17.995  13.098
  294   1H2*    G  26          1H2*        G  26  -9.573 -21.663  17.598
  295   2H2*    G  26          2H2*        G  26  -9.484 -21.916  15.854
  296   1H5*    G  27          1H5*        G  27 -11.045 -20.384  12.265
  297   2H5*    G  27          2H5*        G  27 -11.706 -21.847  11.534
  298    H4*    G  27           H4*        G  27  -9.948 -21.206  10.223
  299    H3*    G  27           H3*        G  27  -9.167 -23.603  11.901
  300    H1*    G  27           H1*        G  27  -6.574 -20.822  11.037
  301    H8     G  27           H8         G  27  -8.354 -22.539  14.040
  302    H1     G  27           H1         G  27  -2.048 -21.521  14.601
  303   1H2     G  27          1H2         G  27  -1.212 -20.672  12.685
  304   2H2     G  27          2H2         G  27  -2.256 -20.394  11.354
  305   1H2*    G  27          1H2*        G  27  -6.954 -23.475  10.904
  306   2H2*    G  27          2H2*        G  27  -7.514 -22.398   9.624
  Start of MODEL    6
    1   1H5*    C   1          1H5*        C   1   6.333 -21.530  12.579
    2   2H5*    C   1          2H5*        C   1   5.326 -21.798  14.002
    3    H4*    C   1           H4*        C   1   4.469 -21.804  11.167
    4    H3*    C   1           H3*        C   1   4.262 -19.584  13.195
    5    H1*    C   1           H1*        C   1   1.430 -21.732  11.449
    6   1H4     C   1          1H4         C   1  -2.913 -21.759  15.988
    7   2H4     C   1          2H4         C   1  -1.745 -21.415  17.219
    8    H5     C   1           H5         C   1   0.609 -21.069  16.754
    9    H6     C   1           H6         C   1   2.292 -20.992  14.970
   10   1H2*    C   1          1H2*        C   1   1.997 -19.243  12.725
   11   2H2*    C   1          2H2*        C   1   2.218 -19.678  11.030
   12   1H5*    C   2          1H5*        C   2   2.973 -18.635   9.201
   13   2H5*    C   2          2H5*        C   2   3.563 -17.029   8.772
   14    H4*    C   2           H4*        C   2   1.245 -17.423   8.162
   15    H3*    C   2           H3*        C   2   2.140 -15.027   9.104
   16    H1*    C   2           H1*        C   2  -1.145 -16.578  10.407
   17   1H4     C   2          1H4         C   2  -2.037 -18.432  16.327
   18   2H4     C   2          2H4         C   2  -0.365 -18.230  16.726
   19    H5     C   2           H5         C   2   1.309 -17.528  15.118
   20    H6     C   2           H6         C   2   1.669 -16.880  12.779
   21   1H2*    C   2          1H2*        C   2   1.410 -15.339  11.396
   22   2H2*    C   2          2H2*        C   2  -0.003 -14.561  10.682
   23   1H5*    T   3          1H5*        T   3  -2.371 -15.157   8.037
   24   2H5*    T   3          2H5*        T   3  -2.691 -13.655   7.171
   25    H4*    T   3           H4*        T   3  -4.592 -14.266   8.432
   26    H3*    T   3           H3*        T   3  -3.541 -11.706   8.675
   27   1H2*    T   3          1H2*        T   3  -2.762 -11.930  10.928
   28   2H2*    T   3          2H2*        T   3  -4.451 -11.531  11.243
   29    H1*    T   3           H1*        T   3  -5.058 -13.767  11.577
   30    H3     T   3           H3         T   3  -3.735 -15.158  15.514
   31   1H5M    T   3          1H5M        T   3   0.397 -12.818  14.483
   32   2H5M    T   3          2H5M        T   3   0.643 -13.519  12.883
   33   3H5M    T   3          3H5M        T   3   0.732 -14.543  14.317
   34    H6     T   3           H6         T   3  -1.407 -13.270  11.796
   35   1H5*    A   4          1H5*        A   4  -7.828 -12.510  10.441
   36   2H5*    A   4          2H5*        A   4  -8.728 -11.102   9.880
   37    H4*    A   4           H4*        A   4  -9.617 -11.788  11.939
   38    H3*    A   4           H3*        A   4  -8.843  -9.153  11.646
   39    H1*    A   4           H1*        A   4  -8.319 -11.200  14.882
   40    H8     A   4           H8         A   4  -4.886 -10.567  13.178
   41   1H6     A   4          1H6         A   4  -2.561 -12.750  18.460
   42   2H6     A   4          2H6         A   4  -2.192 -12.076  16.910
   43    H2     A   4           H2         A   4  -7.038 -12.986  18.691
   44   1H2*    A   4          1H2*        A   4  -6.901  -9.268  13.059
   45   2H2*    A   4          2H2*        A   4  -8.146  -8.949  14.266
   46   1H5*    A   5          1H5*        A   5 -11.266 -10.535  15.179
   47   2H5*    A   5          2H5*        A   5 -12.636  -9.432  15.305
   48    H4*    A   5           H4*        A   5 -12.284 -10.348  17.411
   49    H3*    A   5           H3*        A   5 -12.381  -7.637  17.260
   50    H1*    A   5           H1*        A   5  -9.689  -9.376  19.411
   51    H8     A   5           H8         A   5  -8.045  -8.013  16.171
   52   1H6     A   5          1H6         A   5  -2.746  -9.570  18.922
   53   2H6     A   5          2H6         A   5  -3.469  -8.833  17.533
   54    H2     A   5           H2         A   5  -6.134 -10.852  21.571
   55   1H2*    A   5          1H2*        A   5  -9.976  -7.274  17.279
   56   2H2*    A   5          2H2*        A   5 -10.366  -7.182  18.996
   57   1H5*    T   6          1H5*        T   6 -12.263  -9.232  21.663
   58   2H5*    T   6          2H5*        T   6 -13.058  -8.068  22.722
   59    H4*    T   6           H4*        T   6 -11.110  -9.026  23.692
   60    H3*    T   6           H3*        T   6 -11.180  -6.059  23.319
   61   1H2*    T   6          1H2*        T   6  -8.890  -5.809  23.571
   62   2H2*    T   6          2H2*        T   6  -8.871  -6.987  24.884
   63    H1*    T   6           H1*        T   6  -8.164  -8.616  23.505
   64    H3     T   6           H3         T   6  -4.436  -7.191  21.605
   65   1H5M    T   6          1H5M        T   6  -8.548  -5.607  18.547
   66   2H5M    T   6          2H5M        T   6  -6.919  -5.815  17.903
   67   3H5M    T   6          3H5M        T   6  -7.311  -4.391  18.867
   68    H6     T   6           H6         T   6  -9.062  -6.512  20.635
   69   1H5*    T   7          1H5*        T   7  -9.476  -6.977  27.258
   70   2H5*    T   7          2H5*        T   7  -9.895  -5.635  28.324
   71    H4*    T   7           H4*        T   7  -7.527  -6.142  28.165
   72    H3*    T   7           H3*        T   7  -8.549  -3.390  27.690
   73   1H2*    T   7          1H2*        T   7  -6.721  -2.716  26.449
   74   2H2*    T   7          2H2*        T   7  -5.636  -3.434  27.639
   75    H1*    T   7           H1*        T   7  -5.337  -5.293  26.390
   76    H3     T   7           H3         T   7  -3.567  -4.180  22.524
   77   1H5M    T   7          1H5M        T   7  -7.481  -2.716  20.774
   78   2H5M    T   7          2H5M        T   7  -8.328  -2.129  22.207
   79   3H5M    T   7          3H5M        T   7  -8.631  -3.761  21.609
   80    H6     T   7           H6         T   7  -7.990  -3.815  24.287
   81   1H5*    A   8          1H5*        A   8  -4.848  -4.147  29.942
   82   2H5*    A   8          2H5*        A   8  -4.765  -3.086  31.348
   83    H4*    A   8           H4*        A   8  -2.614  -3.383  30.365
   84    H3*    A   8           H3*        A   8  -3.465  -0.898  31.111
   85    H1*    A   8           H1*        A   8  -1.638  -1.472  27.760
   86    H8     A   8           H8         A   8  -5.415  -0.891  27.063
   87   1H6     A   8          1H6         A   8  -3.645  -0.528  21.164
   88   2H6     A   8          2H6         A   8  -4.976  -0.409  22.263
   89    H2     A   8           H2         A   8  -0.039  -1.492  23.656
   90   1H2*    A   8          1H2*        A   8  -4.083  -0.138  28.895
   91   2H2*    A   8          2H2*        A   8  -2.397   0.371  28.976
   92   1H5*    T   9          1H5*        T   9   0.872  -1.214  29.531
   93   2H5*    T   9          2H5*        T   9   1.860  -0.184  30.569
   94    H4*    T   9           H4*        T   9   2.721  -0.203  28.356
   95    H3*    T   9           H3*        T   9   2.287   2.200  29.680
   96   1H2*    T   9          1H2*        T   9   0.476   2.958  28.309
   97   2H2*    T   9          2H2*        T   9   1.835   3.474  27.310
   98    H1*    T   9           H1*        T   9   1.686   1.608  25.904
   99    H3     T   9           H3         T   9  -1.669   2.033  23.120
  100   1H5M    T   9          1H5M        T   9  -4.694   1.972  26.698
  101   2H5M    T   9          2H5M        T   9  -4.162   3.637  26.937
  102   3H5M    T   9          3H5M        T   9  -3.684   2.385  28.084
  103    H6     T   9           H6         T   9  -1.389   2.106  27.887
  104   1H5*    A  10          1H5*        A  10   4.456   2.549  25.576
  105   2H5*    A  10          2H5*        A  10   5.903   3.445  26.041
  106    H4*    A  10           H4*        A  10   5.385   4.124  23.894
  107    H3*    A  10           H3*        A  10   5.477   6.107  25.811
  108    H1*    A  10           H1*        A  10   2.885   6.013  22.945
  109    H8     A  10           H8         A  10   1.115   5.442  26.342
  110   1H6     A  10          1H6         A  10  -4.068   5.717  23.007
  111   2H6     A  10          2H6         A  10  -3.402   5.583  24.598
  112    H2     A  10           H2         A  10  -0.577   5.964  20.199
  113   1H2*    A  10          1H2*        A  10   3.109   6.520  25.905
  114   2H2*    A  10          2H2*        A  10   3.556   7.568  24.559
  115   1H5*    A  11          1H5*        A  11   5.471   7.528  21.429
  116   2H5*    A  11          2H5*        A  11   6.348   9.049  21.253
  117    H4*    A  11           H4*        A  11   4.373   8.953  19.907
  118    H3*    A  11           H3*        A  11   4.779  11.148  21.802
  119    H1*    A  11           H1*        A  11   1.539   9.489  20.295
  120    H8     A  11           H8         A  11   1.842   9.211  24.152
  121   1H6     A  11          1H6         A  11  -4.299   8.649  23.955
  122   2H6     A  11          2H6         A  11  -2.899   8.653  24.973
  123    H2     A  11           H2         A  11  -2.815   9.327  19.774
  124   1H2*    A  11          1H2*        A  11   2.547  11.338  22.407
  125   2H2*    A  11          2H2*        A  11   2.207  11.662  20.707
  126   1H5*    C  12          1H5*        C  12   2.679  12.121  17.831
  127   2H5*    C  12          2H5*        C  12   3.299  13.698  17.345
  128    H4*    C  12           H4*        C  12   0.980  13.563  16.890
  129    H3*    C  12           H3*        C  12   1.995  15.731  18.287
  130    H1*    C  12           H1*        C  12  -1.401  14.040  19.038
  131   1H4     C  12          1H4         C  12  -2.839  11.522  24.587
  132   2H4     C  12          2H4         C  12  -1.209  11.642  25.156
  133    H5     C  12           H5         C  12   0.609  12.506  23.804
  134    H6     C  12           H6         C  12   1.185  13.432  21.606
  135   1H2*    C  12          1H2*        C  12   1.023  15.183  20.410
  136   2H2*    C  12          2H2*        C  12  -0.336  16.027  19.667
  137   1H5*    G  13          1H5*        G  13  -2.280  16.168  17.634
  138   2H5*    G  13          2H5*        G  13  -2.722  17.786  17.091
  139    H4*    G  13           H4*        G  13  -4.199  17.008  18.797
  140    H3*    G  13           H3*        G  13  -3.173  19.549  18.878
  141    H1*    G  13           H1*        G  13  -3.476  17.343  22.033
  142    H8     G  13           H8         G  13   0.248  17.984  21.244
  143    H1     G  13           H1         G  13  -1.013  14.212  26.272
  144   1H2     G  13          1H2         G  13  -3.225  13.778  26.399
  145   2H2     G  13          2H2         G  13  -4.287  14.443  25.229
  146   1H2*    G  13          1H2*        G  13  -1.526  19.131  20.598
  147   2H2*    G  13          2H2*        G  13  -2.928  19.569  21.575
  148   1H5*    A  14          1H5*        A  14  -6.075  18.160  21.881
  149   2H5*    A  14          2H5*        A  14  -7.307  19.344  22.315
  150    H4*    A  14           H4*        A  14  -6.763  17.883  24.142
  151    H3*    A  14           H3*        A  14  -7.101  20.567  24.513
  152    H1*    A  14           H1*        A  14  -4.207  18.648  26.199
  153    H8     A  14           H8         A  14  -2.783  20.756  23.260
  154   1H6     A  14          1H6         A  14   2.700  19.306  25.689
  155   2H6     A  14          2H6         A  14   1.878  20.189  24.448
  156    H2     A  14           H2         A  14  -0.487  17.255  28.092
  157   1H2*    A  14          1H2*        A  14  -4.748  21.138  24.598
  158   2H2*    A  14          2H2*        A  14  -5.085  20.811  26.298
  159   1H5*    A  15          1H5*        A  15  -9.061  17.273  28.667
  160   2H5*    A  15          2H5*        A  15  -7.923  17.372  27.322
  161    H4*    A  15           H4*        A  15 -10.628  18.341  26.917
  162    H3*    A  15           H3*        A  15 -10.952  15.953  27.981
  163    H1*    A  15           H1*        A  15 -10.117  15.737  24.234
  164    H8     A  15           H8         A  15  -6.931  15.274  26.350
  165   1H6     A  15          1H6         A  15  -4.016  14.753  20.938
  166   2H6     A  15          2H6         A  15  -3.861  14.640  22.658
  167    H2     A  15           H2         A  15  -8.284  15.882  20.132
  168   1H2*    A  15          1H2*        A  15  -9.002  14.900  26.875
  169   2H2*    A  15          2H2*        A  15 -10.393  14.273  25.989
  170   1H5*    G  16          1H5*        G  16 -13.904  12.731  24.699
  171   2H5*    G  16          2H5*        G  16 -12.294  12.425  25.351
  172    H4*    G  16           H4*        G  16 -12.961  13.221  22.560
  173    H3*    G  16           H3*        G  16 -13.408  10.676  23.262
  174    H1*    G  16           H1*        G  16  -9.898  11.519  21.912
  175    H8     G  16           H8         G  16  -9.770  11.470  25.807
  176    H1     G  16           H1         G  16  -4.175  11.933  22.709
  177   1H2     G  16          1H2         G  16  -4.516  12.071  20.482
  178   2H2     G  16          2H2         G  16  -6.116  12.044  19.864
  179   1H2*    G  16          1H2*        G  16 -11.219  10.304  24.316
  180   2H2*    G  16          2H2*        G  16 -11.000   9.634  22.698
  181   1H5*    T  17          1H5*        T  17 -11.793  11.336  19.053
  182   2H5*    T  17          2H5*        T  17 -12.559  10.197  17.947
  183    H4*    T  17           H4*        T  17 -10.378  10.822  17.192
  184    H3*    T  17           H3*        T  17 -11.186   8.178  17.224
  185   1H2*    T  17          1H2*        T  17  -9.802   7.480  19.061
  186   2H2*    T  17          2H2*        T  17  -8.658   7.307  17.729
  187    H1*    T  17           H1*        T  17  -7.629   9.363  18.167
  188    H3     T  17           H3         T  17  -4.945   8.819  21.579
  189   1H5M    T  17          1H5M        T  17  -8.428   7.007  24.099
  190   2H5M    T  17          2H5M        T  17  -9.880   7.553  23.258
  191   3H5M    T  17          3H5M        T  17  -8.980   8.673  24.282
  192    H6     T  17           H6         T  17  -9.679   8.419  21.099
  193   1H5*    T  18          1H5*        T  18  -7.300   9.292  14.981
  194   2H5*    T  18          2H5*        T  18  -7.308   8.361  13.483
  195    H4*    T  18           H4*        T  18  -5.083   8.704  14.217
  196    H3*    T  18           H3*        T  18  -5.955   6.152  13.561
  197   1H2*    T  18          1H2*        T  18  -5.900   5.253  15.780
  198   2H2*    T  18          2H2*        T  18  -4.208   5.042  15.335
  199    H1*    T  18           H1*        T  18  -3.529   6.981  16.458
  200    H3     T  18           H3         T  18  -3.374   6.233  20.768
  201   1H5M    T  18          1H5M        T  18  -8.417   5.279  19.178
  202   2H5M    T  18          2H5M        T  18  -8.038   5.683  20.853
  203   3H5M    T  18          3H5M        T  18  -7.653   4.080  20.224
  204    H6     T  18           H6         T  18  -6.891   5.911  17.554
  205   1H5*    A  19          1H5*        A  19  -1.341   6.742  14.270
  206   2H5*    A  19          2H5*        A  19  -0.699   5.984  12.812
  207    H4*    A  19           H4*        A  19   0.859   5.687  14.526
  208    H3*    A  19           H3*        A  19   0.010   3.458  13.167
  209    H1*    A  19           H1*        A  19   0.574   3.481  16.990
  210    H8     A  19           H8         A  19  -3.240   3.374  16.265
  211   1H6     A  19          1H6         A  19  -3.727   2.218  22.306
  212   2H6     A  19          2H6         A  19  -4.585   2.393  20.813
  213    H2     A  19           H2         A  19   0.608   2.879  21.347
  214   1H2*    A  19          1H2*        A  19  -1.417   2.594  14.913
  215   2H2*    A  19          2H2*        A  19   0.126   1.865  15.358
  216   1H5*    T  20          1H5*        T  20   3.364   3.084  16.176
  217   2H5*    T  20          2H5*        T  20   4.652   2.114  15.459
  218    H4*    T  20           H4*        T  20   4.672   1.823  17.795
  219    H3*    T  20           H3*        T  20   4.517  -0.425  16.137
  220   1H2*    T  20          1H2*        T  20   2.361  -1.153  16.844
  221   2H2*    T  20          2H2*        T  20   3.315  -1.800  18.179
  222    H1*    T  20           H1*        T  20   2.811   0.000  19.588
  223    H3     T  20           H3         T  20  -1.222  -0.686  21.127
  224   1H5M    T  20          1H5M        T  20  -3.097   0.385  17.017
  225   2H5M    T  20          2H5M        T  20  -2.469  -1.152  16.422
  226   3H5M    T  20          3H5M        T  20  -1.732   0.363  15.899
  227    H6     T  20           H6         T  20   0.457   0.158  16.738
  228   1H5*    A  21          1H5*        A  21   5.733  -1.173  20.642
  229   2H5*    A  21          2H5*        A  21   7.091  -2.282  20.454
  230    H4*    A  21           H4*        A  21   5.937  -2.821  22.427
  231    H3*    A  21           H3*        A  21   6.455  -4.820  20.619
  232    H1*    A  21           H1*        A  21   3.100  -4.547  22.516
  233    H8     A  21           H8         A  21   2.547  -3.640  18.784
  234   1H6     A  21          1H6         A  21  -3.438  -3.743  20.278
  235   2H6     A  21          2H6         A  21  -2.291  -3.548  18.996
  236    H2     A  21           H2         A  21  -1.047  -4.469  24.006
  237   1H2*    A  21          1H2*        A  21   4.208  -5.003  19.754
  238   2H2*    A  21          2H2*        A  21   4.128  -6.117  21.118
  239   1H5*    A  22          1H5*        A  22   5.061  -6.001  24.903
  240   2H5*    A  22          2H5*        A  22   6.015  -7.424  25.325
  241    H4*    A  22           H4*        A  22   3.919  -7.481  26.430
  242    H3*    A  22           H3*        A  22   4.821  -9.699  25.066
  243    H1*    A  22           H1*        A  22   1.133  -8.545  25.042
  244    H8     A  22           H8         A  22   2.710  -7.900  21.554
  245   1H6     A  22          1H6         A  22  -3.095  -6.711  19.835
  246   2H6     A  22          2H6         A  22  -1.453  -6.853  19.309
  247    H2     A  22           H2         A  22  -3.081  -7.565  24.241
  248   1H2*    A  22          1H2*        A  22   3.307  -9.517  23.201
  249   2H2*    A  22          2H2*        A  22   2.314 -10.436  24.332
  250   1H5*    T  23          1H5*        T  23   1.137 -10.346  27.773
  251   2H5*    T  23          2H5*        T  23   1.080 -12.005  28.370
  252    H4*    T  23           H4*        T  23  -1.066 -11.109  27.752
  253    H3*    T  23           H3*        T  23  -0.093 -13.641  26.572
  254   1H2*    T  23          1H2*        T  23  -1.299 -13.442  24.612
  255   2H2*    T  23          2H2*        T  23  -2.753 -13.145  25.565
  256    H1*    T  23           H1*        T  23  -2.615 -10.890  25.285
  257    H3     T  23           H3         T  23  -3.256 -10.242  20.981
  258   1H5M    T  23          1H5M        T  23   1.203 -12.165  20.437
  259   2H5M    T  23          2H5M        T  23   1.965 -11.201  21.702
  260   3H5M    T  23          3H5M        T  23   1.329 -10.415  20.256
  261    H6     T  23           H6         T  23   0.549 -11.571  23.542
  262   1H5*    T  24          1H5*        T  24  -4.358 -13.177  27.500
  263   2H5*    T  24          2H5*        T  24  -4.968 -14.643  28.270
  264    H4*    T  24           H4*        T  24  -6.578 -13.783  26.761
  265    H3*    T  24           H3*        T  24  -5.881 -16.451  26.664
  266   1H2*    T  24          1H2*        T  24  -4.635 -16.345  24.610
  267   2H2*    T  24          2H2*        T  24  -6.264 -16.575  23.975
  268    H1*    T  24           H1*        T  24  -6.558 -14.297  23.527
  269    H3     T  24           H3         T  24  -4.375 -13.190  19.895
  270   1H5M    T  24          1H5M        T  24  -0.642 -15.571  21.532
  271   2H5M    T  24          2H5M        T  24  -0.833 -15.402  23.278
  272   3H5M    T  24          3H5M        T  24  -0.321 -14.019  22.309
  273    H6     T  24           H6         T  24  -2.993 -15.117  24.039
  274   1H5*    A  25          1H5*        A  25  -9.500 -15.322  23.956
  275   2H5*    A  25          2H5*        A  25 -10.659 -16.636  24.159
  276    H4*    A  25           H4*        A  25 -10.673 -15.897  21.917
  277    H3*    A  25           H3*        A  25 -10.200 -18.632  22.491
  278    H1*    A  25           H1*        A  25  -8.807 -16.496  19.556
  279    H8     A  25           H8         A  25  -5.937 -17.628  21.924
  280   1H6     A  25          1H6         A  25  -2.285 -15.913  17.256
  281   2H6     A  25          2H6         A  25  -2.341 -16.582  18.851
  282    H2     A  25           H2         A  25  -6.542 -15.124  16.073
  283   1H2*    A  25          1H2*        A  25  -8.120 -18.790  21.380
  284   2H2*    A  25          2H2*        A  25  -9.142 -18.779  19.943
  285   1H5*    G  26          1H5*        G  26 -11.525 -17.198  18.305
  286   2H5*    G  26          2H5*        G  26 -12.939 -18.217  18.032
  287    H4*    G  26           H4*        G  26 -12.068 -17.678  15.951
  288    H3*    G  26           H3*        G  26 -12.441 -20.318  16.453
  289    H1*    G  26           H1*        G  26  -9.188 -19.117  14.761
  290    H8     G  26           H8         G  26  -8.427 -20.092  18.444
  291    H1     G  26           H1         G  26  -3.432 -18.444  14.777
  292   1H2     G  26          1H2         G  26  -4.136 -17.759  12.746
  293   2H2     G  26          2H2         G  26  -5.815 -17.740  12.392
  294   1H2*    G  26          1H2*        G  26 -10.134 -20.810  17.058
  295   2H2*    G  26          2H2*        G  26 -10.142 -21.167  15.331
  296   1H5*    G  27          1H5*        G  27 -11.674 -19.067  11.961
  297   2H5*    G  27          2H5*        G  27 -12.680 -20.207  11.066
  298    H4*    G  27           H4*        G  27 -10.812 -19.428   9.783
  299    H3*    G  27           H3*        G  27 -11.585 -21.999   9.640
  300    H1*    G  27           H1*        G  27  -7.844 -21.267  10.213
  301    H8     G  27           H8         G  27  -9.480 -22.130  13.644
  302    H1     G  27           H1         G  27  -3.082 -21.757  13.462
  303   1H2     G  27          1H2         G  27  -2.386 -21.139  11.407
  304   2H2     G  27          2H2         G  27  -3.540 -20.845  10.172
  305   1H2*    G  27          1H2*        G  27 -10.114 -22.818  11.421
  306   2H2*    G  27          2H2*        G  27  -9.181 -23.153   9.962
  Start of MODEL    7
    1   1H5*    C   1          1H5*        C   1   6.414 -21.032  16.178
    2   2H5*    C   1          2H5*        C   1   4.911 -20.804  17.074
    3    H4*    C   1           H4*        C   1   5.305 -22.413  14.593
    4    H3*    C   1           H3*        C   1   4.979 -19.694  14.525
    5    H1*    C   1           H1*        C   1   2.032 -22.129  13.982
    6   1H4     C   1          1H4         C   1  -3.090 -21.999  17.594
    7   2H4     C   1          2H4         C   1  -2.162 -21.712  19.027
    8    H5     C   1           H5         C   1   0.245 -21.430  19.015
    9    H6     C   1           H6         C   1   2.233 -21.373  17.577
   10   1H2*    C   1          1H2*        C   1   2.775 -19.650  15.520
   11   2H2*    C   1          2H2*        C   1   2.370 -19.822  13.812
   12   1H5*    C   2          1H5*        C   2   2.447 -20.414  10.673
   13   2H5*    C   2          2H5*        C   2   3.212 -19.171   9.681
   14    H4*    C   2           H4*        C   2   0.909 -18.798   9.652
   15    H3*    C   2           H3*        C   2   2.573 -16.729  10.591
   16    H1*    C   2           H1*        C   2  -1.017 -17.592  11.783
   17   1H4     C   2          1H4         C   2  -2.365 -18.753  17.787
   18   2H4     C   2          2H4         C   2  -0.710 -18.585  18.268
   19    H5     C   2           H5         C   2   1.092 -18.162  16.704
   20    H6     C   2           H6         C   2   1.626 -17.817  14.334
   21   1H2*    C   2          1H2*        C   2   1.643 -16.584  12.767
   22   2H2*    C   2          2H2*        C   2   0.376 -15.716  11.901
   23   1H5*    T   3          1H5*        T   3  -1.607 -15.900   8.971
   24   2H5*    T   3          2H5*        T   3  -1.644 -14.356   8.120
   25    H4*    T   3           H4*        T   3  -3.726 -14.791   9.199
   26    H3*    T   3           H3*        T   3  -2.452 -12.337   9.480
   27   1H2*    T   3          1H2*        T   3  -1.902 -12.565  11.798
   28   2H2*    T   3          2H2*        T   3  -3.566 -11.998  11.947
   29    H1*    T   3           H1*        T   3  -4.416 -14.155  12.273
   30    H3     T   3           H3         T   3  -3.579 -15.604  16.325
   31   1H5M    T   3          1H5M        T   3   0.806 -13.475  15.505
   32   2H5M    T   3          2H5M        T   3   1.160 -14.515  14.124
   33   3H5M    T   3          3H5M        T   3   0.974 -15.217  15.732
   34    H6     T   3           H6         T   3  -0.777 -13.941  12.835
   35   1H5*    A   4          1H5*        A   4  -7.114 -12.614  10.325
   36   2H5*    A   4          2H5*        A   4  -7.691 -11.091   9.650
   37    H4*    A   4           H4*        A   4  -9.075 -11.845  11.442
   38    H3*    A   4           H3*        A   4  -8.409  -9.234  11.243
   39    H1*    A   4           H1*        A   4  -8.102 -10.990  14.661
   40    H8     A   4           H8         A   4  -4.572 -10.463  13.166
   41   1H6     A   4          1H6         A   4  -2.578 -12.719  18.551
   42   2H6     A   4          2H6         A   4  -2.113 -12.020  17.038
   43    H2     A   4           H2         A   4  -7.059 -12.972  18.495
   44   1H2*    A   4          1H2*        A   4  -6.490  -9.326  12.748
   45   2H2*    A   4          2H2*        A   4  -7.791  -8.837  13.832
   46   1H5*    A   5          1H5*        A   5 -11.123 -10.511  14.645
   47   2H5*    A   5          2H5*        A   5 -12.453  -9.355  14.713
   48    H4*    A   5           H4*        A   5 -12.165 -10.291  16.840
   49    H3*    A   5           H3*        A   5 -12.281  -7.580  16.647
   50    H1*    A   5           H1*        A   5  -9.661  -9.280  18.916
   51    H8     A   5           H8         A   5  -7.902  -7.962  15.715
   52   1H6     A   5          1H6         A   5  -2.703  -9.359  18.729
   53   2H6     A   5          2H6         A   5  -3.377  -8.672  17.290
   54    H2     A   5           H2         A   5  -6.181 -10.615  21.271
   55   1H2*    A   5          1H2*        A   5  -9.884  -7.192  16.763
   56   2H2*    A   5          2H2*        A   5 -10.343  -7.094  18.463
   57   1H5*    T   6          1H5*        T   6 -11.954  -9.387  20.794
   58   2H5*    T   6          2H5*        T   6 -13.030  -8.533  21.900
   59    H4*    T   6           H4*        T   6 -11.118  -9.330  23.055
   60    H3*    T   6           H3*        T   6 -11.867  -6.623  23.235
   61   1H2*    T   6          1H2*        T   6  -9.874  -5.715  22.322
   62   2H2*    T   6          2H2*        T   6  -9.268  -6.066  23.941
   63    H1*    T   6           H1*        T   6  -8.271  -8.077  23.279
   64    H3     T   6           H3         T   6  -4.539  -6.969  21.294
   65   1H5M    T   6          1H5M        T   6  -8.535  -5.463  18.047
   66   2H5M    T   6          2H5M        T   6  -6.877  -5.666  17.477
   67   3H5M    T   6          3H5M        T   6  -7.324  -4.228  18.396
   68    H6     T   6           H6         T   6  -9.127  -6.304  20.146
   69   1H5*    T   7          1H5*        T   7  -9.024  -8.034  26.532
   70   2H5*    T   7          2H5*        T   7  -9.481  -7.252  28.044
   71    H4*    T   7           H4*        T   7  -7.116  -7.289  27.781
   72    H3*    T   7           H3*        T   7  -8.481  -4.864  28.332
   73   1H2*    T   7          1H2*        T   7  -7.684  -3.669  26.456
   74   2H2*    T   7          2H2*        T   7  -6.199  -3.610  27.405
   75    H1*    T   7           H1*        T   7  -5.236  -5.410  26.260
   76    H3     T   7           H3         T   7  -3.829  -4.038  22.360
   77   1H5M    T   7          1H5M        T   7  -9.158  -3.356  22.443
   78   2H5M    T   7          2H5M        T   7  -8.278  -3.549  20.926
   79   3H5M    T   7          3H5M        T   7  -8.173  -2.031  21.820
   80    H6     T   7           H6         T   7  -8.163  -4.189  24.360
   81   1H5*    A   8          1H5*        A   8  -3.948  -5.315  29.307
   82   2H5*    A   8          2H5*        A   8  -3.814  -4.617  30.921
   83    H4*    A   8           H4*        A   8  -1.802  -4.248  29.769
   84    H3*    A   8           H3*        A   8  -3.054  -2.102  30.946
   85    H1*    A   8           H1*        A   8  -1.346  -1.897  27.486
   86    H8     A   8           H8         A   8  -5.198  -1.778  27.015
   87   1H6     A   8          1H6         A   8  -3.817  -0.238  21.203
   88   2H6     A   8          2H6         A   8  -5.091  -0.492  22.347
   89    H2     A   8           H2         A   8   0.017  -1.021  23.397
   90   1H2*    A   8          1H2*        A   8  -3.880  -1.110  28.908
   91   2H2*    A   8          2H2*        A   8  -2.278  -0.377  29.002
   92   1H5*    T   9          1H5*        T   9   1.184  -1.641  29.294
   93   2H5*    T   9          2H5*        T   9   2.111  -0.657  30.427
   94    H4*    T   9           H4*        T   9   2.908  -0.376  28.198
   95    H3*    T   9           H3*        T   9   2.333   1.830  29.811
   96   1H2*    T   9          1H2*        T   9   0.510   2.661  28.515
   97   2H2*    T   9          2H2*        T   9   1.845   3.320  27.568
   98    H1*    T   9           H1*        T   9   1.755   1.594  25.989
   99    H3     T   9           H3         T   9  -1.587   2.480  23.314
  100   1H5M    T   9          1H5M        T   9  -3.688   1.407  28.135
  101   2H5M    T   9          2H5M        T   9  -4.635   1.285  26.652
  102   3H5M    T   9          3H5M        T   9  -4.264   2.869  27.334
  103    H6     T   9           H6         T   9  -1.367   1.448  27.971
  104   1H5*    A  10          1H5*        A  10   4.690   2.583  25.976
  105   2H5*    A  10          2H5*        A  10   6.015   3.677  26.375
  106    H4*    A  10           H4*        A  10   5.264   4.165  24.212
  107    H3*    A  10           H3*        A  10   5.204   6.227  26.165
  108    H1*    A  10           H1*        A  10   2.836   5.666  23.130
  109    H8     A  10           H8         A  10   0.903   5.194  26.473
  110   1H6     A  10          1H6         A  10  -4.097   5.873  22.923
  111   2H6     A  10          2H6         A  10  -3.515   5.609  24.530
  112    H2     A  10           H2         A  10  -0.464   6.190  20.308
  113   1H2*    A  10          1H2*        A  10   2.913   6.749  25.937
  114   2H2*    A  10          2H2*        A  10   3.457   7.504  24.440
  115   1H5*    A  11          1H5*        A  11   5.377   7.073  21.751
  116   2H5*    A  11          2H5*        A  11   6.623   8.290  21.478
  117    H4*    A  11           H4*        A  11   4.983   8.471  19.799
  118    H3*    A  11           H3*        A  11   5.705  10.726  21.227
  119    H1*    A  11           H1*        A  11   2.092   9.936  20.101
  120    H8     A  11           H8         A  11   2.347   9.722  23.962
  121   1H6     A  11          1H6         A  11  -3.787   9.101  23.726
  122   2H6     A  11          2H6         A  11  -2.408   9.245  24.759
  123    H2     A  11           H2         A  11  -2.226   9.252  19.520
  124   1H2*    A  11          1H2*        A  11   3.659  10.947  22.466
  125   2H2*    A  11          2H2*        A  11   3.212  11.791  20.984
  126   1H5*    C  12          1H5*        C  12   3.390  11.381  17.352
  127   2H5*    C  12          2H5*        C  12   3.954  12.828  16.516
  128    H4*    C  12           H4*        C  12   1.584  12.523  16.289
  129    H3*    C  12           H3*        C  12   2.694  14.985  16.937
  130    H1*    C  12           H1*        C  12  -0.611  13.595  18.390
  131   1H4     C  12          1H4         C  12  -1.588  12.774  24.519
  132   2H4     C  12          2H4         C  12   0.076  13.057  24.905
  133    H5     C  12           H5         C  12   1.771  13.502  23.229
  134    H6     C  12           H6         C  12   2.167  13.756  20.821
  135   1H2*    C  12          1H2*        C  12   1.885  15.078  19.189
  136   2H2*    C  12          2H2*        C  12   0.460  15.676  18.340
  137   1H5*    G  13          1H5*        G  13  -1.663  15.123  16.249
  138   2H5*    G  13          2H5*        G  13  -2.163  16.539  15.322
  139    H4*    G  13           H4*        G  13  -3.628  16.077  17.178
  140    H3*    G  13           H3*        G  13  -2.854  18.622  16.539
  141    H1*    G  13           H1*        G  13  -2.967  17.387  20.195
  142    H8     G  13           H8         G  13   0.708  17.980  19.137
  143    H1     G  13           H1         G  13  -0.281  15.976  25.146
  144   1H2     G  13          1H2         G  13  -2.462  15.494  25.468
  145   2H2     G  13          2H2         G  13  -3.574  15.688  24.177
  146   1H2*    G  13          1H2*        G  13  -1.176  18.847  18.269
  147   2H2*    G  13          2H2*        G  13  -2.613  19.426  19.111
  148   1H5*    A  14          1H5*        A  14  -6.235  17.819  19.323
  149   2H5*    A  14          2H5*        A  14  -7.517  19.030  19.342
  150    H4*    A  14           H4*        A  14  -7.279  17.884  21.451
  151    H3*    A  14           H3*        A  14  -7.722  20.578  21.301
  152    H1*    A  14           H1*        A  14  -5.157  19.071  23.762
  153    H8     A  14           H8         A  14  -3.202  20.529  20.726
  154   1H6     A  14          1H6         A  14   1.664  20.197  24.505
  155   2H6     A  14          2H6         A  14   1.110  20.649  22.929
  156    H2     A  14           H2         A  14  -1.930  18.647  26.702
  157   1H2*    A  14          1H2*        A  14  -5.437  21.262  21.718
  158   2H2*    A  14          2H2*        A  14  -6.074  21.182  23.360
  159   1H5*    A  15          1H5*        A  15 -10.466  18.974  26.132
  160   2H5*    A  15          2H5*        A  15  -8.839  18.724  25.497
  161    H4*    A  15           H4*        A  15 -11.330  17.670  24.246
  162    H3*    A  15           H3*        A  15 -10.515  16.572  26.605
  163    H1*    A  15           H1*        A  15  -9.465  15.039  23.223
  164    H8     A  15           H8         A  15  -6.377  16.442  25.024
  165   1H6     A  15          1H6         A  15  -3.273  14.592  20.024
  166   2H6     A  15          2H6         A  15  -3.145  15.248  21.619
  167    H2     A  15           H2         A  15  -7.656  14.013  19.250
  168   1H2*    A  15          1H2*        A  15  -8.304  15.913  25.857
  169   2H2*    A  15          2H2*        A  15  -9.246  14.470  25.477
  170   1H5*    G  16          1H5*        G  16 -12.052  13.801  23.350
  171   2H5*    G  16          2H5*        G  16 -12.902  12.406  24.016
  172    H4*    G  16           H4*        G  16 -11.576  11.966  21.997
  173    H3*    G  16           H3*        G  16 -11.914  10.177  24.028
  174    H1*    G  16           H1*        G  16  -8.441  10.797  22.465
  175    H8     G  16           H8         G  16  -8.533  12.301  26.042
  176    H1     G  16           H1         G  16  -2.948  12.596  22.907
  177   1H2     G  16          1H2         G  16  -3.185  11.830  20.797
  178   2H2     G  16          2H2         G  16  -4.720  11.282  20.261
  179   1H2*    G  16          1H2*        G  16  -9.805  10.614  25.140
  180   2H2*    G  16          2H2*        G  16  -9.351   9.321  24.030
  181   1H5*    T  17          1H5*        T  17 -11.782  11.077  19.890
  182   2H5*    T  17          2H5*        T  17 -12.484  10.315  18.462
  183    H4*    T  17           H4*        T  17 -10.269  10.763  17.991
  184    H3*    T  17           H3*        T  17 -10.988   7.940  18.132
  185   1H2*    T  17          1H2*        T  17  -9.035   7.260  19.198
  186   2H2*    T  17          2H2*        T  17  -8.186   7.830  17.760
  187    H1*    T  17           H1*        T  17  -7.602   9.849  18.746
  188    H3     T  17           H3         T  17  -4.435   8.951  21.609
  189   1H5M    T  17          1H5M        T  17  -9.033   7.076  23.674
  190   2H5M    T  17          2H5M        T  17  -7.805   7.766  24.737
  191   3H5M    T  17          3H5M        T  17  -7.529   6.202  23.968
  192    H6     T  17           H6         T  17  -9.123   8.040  21.582
  193   1H5*    T  18          1H5*        T  18  -7.812   9.444  15.465
  194   2H5*    T  18          2H5*        T  18  -7.805   8.627  13.902
  195    H4*    T  18           H4*        T  18  -5.584   9.067  14.630
  196    H3*    T  18           H3*        T  18  -6.317   6.527  13.758
  197   1H2*    T  18          1H2*        T  18  -6.093   5.427  15.870
  198   2H2*    T  18          2H2*        T  18  -4.406   5.407  15.357
  199    H1*    T  18           H1*        T  18  -3.852   7.283  16.645
  200    H3     T  18           H3         T  18  -3.437   6.035  20.816
  201   1H5M    T  18          1H5M        T  18  -8.465   4.881  19.303
  202   2H5M    T  18          2H5M        T  18  -8.185   5.482  20.939
  203   3H5M    T  18          3H5M        T  18  -7.630   3.871  20.484
  204    H6     T  18           H6         T  18  -7.110   5.938  17.765
  205   1H5*    A  19          1H5*        A  19  -1.751   7.160  14.495
  206   2H5*    A  19          2H5*        A  19  -1.053   6.547  12.997
  207    H4*    A  19           H4*        A  19   0.434   5.995  14.679
  208    H3*    A  19           H3*        A  19  -0.639   3.873  13.225
  209    H1*    A  19           H1*        A  19   0.192   3.820  17.006
  210    H8     A  19           H8         A  19  -3.657   3.662  16.500
  211   1H6     A  19          1H6         A  19  -3.755   2.251  22.505
  212   2H6     A  19          2H6         A  19  -4.707   2.478  21.078
  213    H2     A  19           H2         A  19   0.504   3.002  21.307
  214   1H2*    A  19          1H2*        A  19  -1.876   2.897  15.021
  215   2H2*    A  19          2H2*        A  19  -0.287   2.216  15.369
  216   1H5*    T  20          1H5*        T  20   3.031   3.258  15.798
  217   2H5*    T  20          2H5*        T  20   4.192   2.227  14.962
  218    H4*    T  20           H4*        T  20   4.334   1.879  17.297
  219    H3*    T  20           H3*        T  20   3.963  -0.304  15.568
  220   1H2*    T  20          1H2*        T  20   1.870  -1.007  16.443
  221   2H2*    T  20          2H2*        T  20   2.907  -1.687  17.695
  222    H1*    T  20           H1*        T  20   2.549   0.105  19.156
  223    H3     T  20           H3         T  20  -1.376  -0.490  20.982
  224   1H5M    T  20          1H5M        T  20  -2.239   0.609  15.811
  225   2H5M    T  20          2H5M        T  20  -3.517   0.661  17.026
  226   3H5M    T  20          3H5M        T  20  -2.977  -0.889  16.381
  227    H6     T  20           H6         T  20  -0.001   0.346  16.486
  228   1H5*    A  21          1H5*        A  21   5.383  -1.089  19.897
  229   2H5*    A  21          2H5*        A  21   6.731  -2.210  19.709
  230    H4*    A  21           H4*        A  21   5.656  -2.675  21.737
  231    H3*    A  21           H3*        A  21   6.050  -4.744  19.972
  232    H1*    A  21           H1*        A  21   2.805  -4.335  22.030
  233    H8     A  21           H8         A  21   2.068  -3.596  18.296
  234   1H6     A  21          1H6         A  21  -3.826  -3.472  20.114
  235   2H6     A  21          2H6         A  21  -2.748  -3.372  18.764
  236    H2     A  21           H2         A  21  -1.250  -4.063  23.741
  237   1H2*    A  21          1H2*        A  21   3.758  -4.920  19.235
  238   2H2*    A  21          2H2*        A  21   3.731  -5.978  20.645
  239   1H5*    A  22          1H5*        A  22   5.022  -5.762  24.399
  240   2H5*    A  22          2H5*        A  22   5.952  -7.207  24.795
  241    H4*    A  22           H4*        A  22   3.928  -7.105  26.053
  242    H3*    A  22           H3*        A  22   4.717  -9.436  24.867
  243    H1*    A  22           H1*        A  22   1.042  -8.262  24.766
  244    H8     A  22           H8         A  22   2.630  -7.797  21.256
  245   1H6     A  22          1H6         A  22  -3.147  -6.565  19.473
  246   2H6     A  22          2H6         A  22  -1.507  -6.769  18.957
  247    H2     A  22           H2         A  22  -3.152  -7.200  23.916
  248   1H2*    A  22          1H2*        A  22   3.217  -9.308  22.970
  249   2H2*    A  22          2H2*        A  22   2.221 -10.178  24.137
  250   1H5*    T  23          1H5*        T  23   1.043  -9.826  27.633
  251   2H5*    T  23          2H5*        T  23   0.915 -11.446  28.317
  252    H4*    T  23           H4*        T  23  -1.187 -10.473  27.615
  253    H3*    T  23           H3*        T  23  -0.337 -13.144  26.702
  254   1H2*    T  23          1H2*        T  23  -1.425 -13.039  24.666
  255   2H2*    T  23          2H2*        T  23  -2.913 -12.649  25.530
  256    H1*    T  23           H1*        T  23  -2.704 -10.409  25.127
  257    H3     T  23           H3         T  23  -3.307 -10.038  20.789
  258   1H5M    T  23          1H5M        T  23   1.870 -11.171  21.612
  259   2H5M    T  23          2H5M        T  23   1.297 -10.383  20.141
  260   3H5M    T  23          3H5M        T  23   1.068 -12.120  20.360
  261    H6     T  23           H6         T  23   0.443 -11.314  23.457
  262   1H5*    T  24          1H5*        T  24  -4.597 -12.338  27.479
  263   2H5*    T  24          2H5*        T  24  -5.312 -13.689  28.359
  264    H4*    T  24           H4*        T  24  -6.847 -12.859  26.761
  265    H3*    T  24           H3*        T  24  -6.338 -15.563  26.897
  266   1H2*    T  24          1H2*        T  24  -5.032 -15.705  24.878
  267   2H2*    T  24          2H2*        T  24  -6.657 -15.897  24.222
  268    H1*    T  24           H1*        T  24  -6.806 -13.655  23.569
  269    H3     T  24           H3         T  24  -4.472 -12.965  19.926
  270   1H5M    T  24          1H5M        T  24  -0.952 -15.466  21.831
  271   2H5M    T  24          2H5M        T  24  -1.168 -15.160  23.555
  272   3H5M    T  24          3H5M        T  24  -0.539 -13.888  22.506
  273    H6     T  24           H6         T  24  -3.317 -14.662  24.238
  274   1H5*    A  25          1H5*        A  25  -9.746 -14.411  23.879
  275   2H5*    A  25          2H5*        A  25 -11.025 -15.521  24.370
  276    H4*    A  25           H4*        A  25 -11.172 -15.225  22.058
  277    H3*    A  25           H3*        A  25 -11.022 -17.794  23.015
  278    H1*    A  25           H1*        A  25  -9.161 -16.640  19.831
  279    H8     A  25           H8         A  25  -6.607 -17.446  22.617
  280   1H6     A  25          1H6         A  25  -2.383 -16.282  18.274
  281   2H6     A  25          2H6         A  25  -2.648 -16.819  19.897
  282    H2     A  25           H2         A  25  -6.436 -15.387  16.568
  283   1H2*    A  25          1H2*        A  25  -8.730 -18.197  22.372
  284   2H2*    A  25          2H2*        A  25  -9.574 -18.679  20.900
  285   1H5*    G  26          1H5*        G  26 -12.191 -17.138  18.578
  286   2H5*    G  26          2H5*        G  26 -13.507 -18.274  18.275
  287    H4*    G  26           H4*        G  26 -12.330 -17.880  16.272
  288    H3*    G  26           H3*        G  26 -12.842 -20.457  17.022
  289    H1*    G  26           H1*        G  26  -9.426 -19.417  15.557
  290    H8     G  26           H8         G  26  -9.018 -20.274  19.316
  291    H1     G  26           H1         G  26  -3.698 -18.699  16.101
  292   1H2     G  26          1H2         G  26  -4.207 -18.058  13.999
  293   2H2     G  26          2H2         G  26  -5.844 -18.048  13.488
  294   1H2*    G  26          1H2*        G  26 -10.622 -20.956  17.850
  295   2H2*    G  26          2H2*        G  26 -10.468 -21.421  16.155
  296   1H5*    G  27          1H5*        G  27 -11.565 -19.908  12.354
  297   2H5*    G  27          2H5*        G  27 -12.345 -21.305  11.613
  298    H4*    G  27           H4*        G  27 -10.413 -20.952  10.449
  299    H3*    G  27           H3*        G  27 -10.082 -23.348  12.279
  300    H1*    G  27           H1*        G  27  -7.112 -20.945  11.506
  301    H8     G  27           H8         G  27  -9.270 -22.280  14.453
  302    H1     G  27           H1         G  27  -2.931 -22.056  15.381
  303   1H2     G  27          1H2         G  27  -1.877 -21.417  13.489
  304   2H2     G  27          2H2         G  27  -2.796 -21.074  12.082
  305   1H2*    G  27          1H2*        G  27  -7.803 -23.543  11.457
  306   2H2*    G  27          2H2*        G  27  -8.126 -22.469  10.095
  Start of MODEL    8
    1   1H5*    C   1          1H5*        C   1   6.234 -21.676  15.309
    2   2H5*    C   1          2H5*        C   1   4.817 -21.486  16.341
    3    H4*    C   1           H4*        C   1   4.865 -22.342  13.483
    4    H3*    C   1           H3*        C   1   5.030 -19.710  14.183
    5    H1*    C   1           H1*        C   1   1.646 -21.331  13.281
    6   1H4     C   1          1H4         C   1  -3.135 -21.875  17.294
    7   2H4     C   1          2H4         C   1  -2.130 -21.543  18.664
    8    H5     C   1           H5         C   1   0.252 -21.131  18.496
    9    H6     C   1           H6         C   1   2.135 -20.961  16.931
   10   1H2*    C   1          1H2*        C   1   2.928 -19.609  15.388
   11   2H2*    C   1          2H2*        C   1   2.415 -19.178  13.756
   12   1H5*    C   2          1H5*        C   2   2.198 -20.236  10.309
   13   2H5*    C   2          2H5*        C   2   2.915 -18.961   9.324
   14    H4*    C   2           H4*        C   2   0.593 -19.023   8.944
   15    H3*    C   2           H3*        C   2   1.774 -16.622   9.531
   16    H1*    C   2           H1*        C   2  -1.637 -17.649  11.020
   17   1H4     C   2          1H4         C   2  -2.669 -18.517  17.142
   18   2H4     C   2          2H4         C   2  -0.999 -18.283  17.533
   19    H5     C   2           H5         C   2   0.715 -17.899  15.863
   20    H6     C   2           H6         C   2   1.127 -17.666  13.455
   21   1H2*    C   2          1H2*        C   2   1.022 -16.494  11.826
   22   2H2*    C   2          2H2*        C   2  -0.321 -15.718  10.987
   23   1H5*    T   3          1H5*        T   3  -2.694 -16.340   8.592
   24   2H5*    T   3          2H5*        T   3  -2.965 -14.913   7.591
   25    H4*    T   3           H4*        T   3  -4.749 -15.176   9.116
   26    H3*    T   3           H3*        T   3  -3.312 -12.733   9.036
   27   1H2*    T   3          1H2*        T   3  -2.690 -12.708  11.315
   28   2H2*    T   3          2H2*        T   3  -4.379 -12.258  11.541
   29    H1*    T   3           H1*        T   3  -5.028 -14.441  12.078
   30    H3     T   3           H3         T   3  -3.801 -15.431  16.154
   31   1H5M    T   3          1H5M        T   3   0.464 -13.351  14.656
   32   2H5M    T   3          2H5M        T   3   0.707 -14.612  13.445
   33   3H5M    T   3          3H5M        T   3   0.661 -15.032  15.158
   34    H6     T   3           H6         T   3  -1.358 -14.087  12.277
   35   1H5*    A   4          1H5*        A   4  -7.770 -12.846  10.426
   36   2H5*    A   4          2H5*        A   4  -8.491 -11.358   9.812
   37    H4*    A   4           H4*        A   4  -9.498 -12.016  11.870
   38    H3*    A   4           H3*        A   4  -8.714  -9.411  11.453
   39    H1*    A   4           H1*        A   4  -8.237 -11.249  14.819
   40    H8     A   4           H8         A   4  -4.781 -10.776  13.112
   41   1H6     A   4          1H6         A   4  -2.535 -12.664  18.540
   42   2H6     A   4          2H6         A   4  -2.141 -12.090  16.955
   43    H2     A   4           H2         A   4  -7.016 -12.824  18.741
   44   1H2*    A   4          1H2*        A   4  -6.772  -9.471  12.880
   45   2H2*    A   4          2H2*        A   4  -8.020  -9.049  14.051
   46   1H5*    A   5          1H5*        A   5 -11.262 -10.606  14.939
   47   2H5*    A   5          2H5*        A   5 -12.619  -9.482  15.019
   48    H4*    A   5           H4*        A   5 -12.309 -10.399  17.142
   49    H3*    A   5           H3*        A   5 -12.445  -7.694  16.964
   50    H1*    A   5           H1*        A   5  -9.761  -9.355  19.184
   51    H8     A   5           H8         A   5  -8.088  -8.107  15.907
   52   1H6     A   5          1H6         A   5  -2.810  -9.374  18.840
   53   2H6     A   5          2H6         A   5  -3.522  -8.738  17.397
   54    H2     A   5           H2         A   5  -6.218 -10.574  21.501
   55   1H2*    A   5          1H2*        A   5 -10.045  -7.295  17.013
   56   2H2*    A   5          2H2*        A   5 -10.466  -7.181  18.722
   57   1H5*    T   6          1H5*        T   6 -11.979  -9.401  21.176
   58   2H5*    T   6          2H5*        T   6 -13.029  -8.503  22.272
   59    H4*    T   6           H4*        T   6 -11.055  -9.209  23.388
   60    H3*    T   6           H3*        T   6 -11.838  -6.485  23.426
   61   1H2*    T   6          1H2*        T   6  -9.839  -5.611  22.519
   62   2H2*    T   6          2H2*        T   6  -9.222  -5.950  24.137
   63    H1*    T   6           H1*        T   6  -8.248  -7.976  23.488
   64    H3     T   6           H3         T   6  -4.537  -6.841  21.485
   65   1H5M    T   6          1H5M        T   6  -7.414  -4.328  18.443
   66   2H5M    T   6          2H5M        T   6  -8.540  -5.649  18.128
   67   3H5M    T   6          3H5M        T   6  -6.861  -5.777  17.602
   68    H6     T   6           H6         T   6  -9.134  -6.350  20.289
   69   1H5*    T   7          1H5*        T   7  -9.061  -7.708  26.849
   70   2H5*    T   7          2H5*        T   7  -9.389  -6.727  28.278
   71    H4*    T   7           H4*        T   7  -7.048  -6.947  27.775
   72    H3*    T   7           H3*        T   7  -8.287  -4.309  28.107
   73   1H2*    T   7          1H2*        T   7  -6.977  -3.243  26.520
   74   2H2*    T   7          2H2*        T   7  -5.570  -3.749  27.454
   75    H1*    T   7           H1*        T   7  -5.142  -5.546  26.079
   76    H3     T   7           H3         T   7  -3.666  -3.805  22.345
   77   1H5M    T   7          1H5M        T   7  -8.066  -1.985  21.707
   78   2H5M    T   7          2H5M        T   7  -9.019  -3.331  22.336
   79   3H5M    T   7          3H5M        T   7  -8.116  -3.517  20.832
   80    H6     T   7           H6         T   7  -8.029  -4.162  24.252
   81   1H5*    A   8          1H5*        A   8  -4.091  -5.091  29.309
   82   2H5*    A   8          2H5*        A   8  -3.815  -4.393  30.906
   83    H4*    A   8           H4*        A   8  -1.851  -4.169  29.649
   84    H3*    A   8           H3*        A   8  -2.935  -1.907  30.813
   85    H1*    A   8           H1*        A   8  -1.277  -1.968  27.321
   86    H8     A   8           H8         A   8  -5.128  -1.613  26.886
   87   1H6     A   8          1H6         A   8  -3.690  -0.016  21.103
   88   2H6     A   8          2H6         A   8  -4.972  -0.248  22.241
   89    H2     A   8           H2         A   8   0.115  -0.975  23.283
   90   1H2*    A   8          1H2*        A   8  -3.669  -0.864  28.779
   91   2H2*    A   8          2H2*        A   8  -1.994  -0.316  28.815
   92   1H5*    T   9          1H5*        T   9   1.414  -1.683  29.120
   93   2H5*    T   9          2H5*        T   9   2.305  -0.756  30.326
   94    H4*    T   9           H4*        T   9   3.204  -0.390  28.157
   95    H3*    T   9           H3*        T   9   2.602   1.750  29.815
   96   1H2*    T   9          1H2*        T   9   0.746   2.582  28.545
   97   2H2*    T   9          2H2*        T   9   2.072   3.343  27.667
   98    H1*    T   9           H1*        T   9   2.072   1.718  25.984
   99    H3     T   9           H3         T   9  -1.261   2.508  23.262
  100   1H5M    T   9          1H5M        T   9  -3.980   2.915  27.235
  101   2H5M    T   9          2H5M        T   9  -3.383   1.492  28.089
  102   3H5M    T   9          3H5M        T   9  -4.317   1.301  26.605
  103    H6     T   9           H6         T   9  -1.068   1.503  27.927
  104   1H5*    A  10          1H5*        A  10   4.910   2.855  25.958
  105   2H5*    A  10          2H5*        A  10   6.151   4.000  26.466
  106    H4*    A  10           H4*        A  10   5.356   4.659  24.373
  107    H3*    A  10           H3*        A  10   5.076   6.487  26.547
  108    H1*    A  10           H1*        A  10   2.852   6.018  23.382
  109    H8     A  10           H8         A  10   0.869   5.266  26.639
  110   1H6     A  10          1H6         A  10  -4.056   5.579  22.936
  111   2H6     A  10          2H6         A  10  -3.505   5.339  24.559
  112    H2     A  10           H2         A  10  -0.382   6.241  20.446
  113   1H2*    A  10          1H2*        A  10   2.770   6.874  26.267
  114   2H2*    A  10          2H2*        A  10   3.301   7.784  24.853
  115   1H5*    A  11          1H5*        A  11   5.320   8.221  22.344
  116   2H5*    A  11          2H5*        A  11   6.131   9.786  22.364
  117    H4*    A  11           H4*        A  11   4.262   9.794  20.910
  118    H3*    A  11           H3*        A  11   4.335  11.699  23.145
  119    H1*    A  11           H1*        A  11   1.371  10.057  21.129
  120    H8     A  11           H8         A  11   1.422   9.400  24.958
  121   1H6     A  11          1H6         A  11  -4.594   8.263  24.199
  122   2H6     A  11          2H6         A  11  -3.282   8.307  25.327
  123    H2     A  11           H2         A  11  -2.882   9.476  20.232
  124   1H2*    A  11          1H2*        A  11   2.049  11.707  23.509
  125   2H2*    A  11          2H2*        A  11   1.851  12.196  21.826
  126   1H5*    C  12          1H5*        C  12   2.589  13.029  19.164
  127   2H5*    C  12          2H5*        C  12   3.094  14.699  18.902
  128    H4*    C  12           H4*        C  12   0.859  14.415  18.186
  129    H3*    C  12           H3*        C  12   1.503  16.488  19.912
  130    H1*    C  12           H1*        C  12  -1.766  14.427  20.074
  131   1H4     C  12          1H4         C  12  -3.539  11.195  25.134
  132   2H4     C  12          2H4         C  12  -1.992  11.371  25.891
  133    H5     C  12           H5         C  12  -0.129  12.522  24.850
  134    H6     C  12           H6         C  12   0.587  13.737  22.842
  135   1H2*    C  12          1H2*        C  12   0.365  15.621  21.836
  136   2H2*    C  12          2H2*        C  12  -0.985  16.418  21.024
  137   1H5*    G  13          1H5*        G  13  -2.716  16.668  18.803
  138   2H5*    G  13          2H5*        G  13  -3.233  18.310  18.416
  139    H4*    G  13           H4*        G  13  -4.794  17.195  19.849
  140    H3*    G  13           H3*        G  13  -4.062  19.788  20.300
  141    H1*    G  13           H1*        G  13  -4.370  17.244  23.188
  142    H8     G  13           H8         G  13  -0.671  18.260  22.739
  143    H1     G  13           H1         G  13  -1.927  13.923  27.292
  144   1H2     G  13          1H2         G  13  -4.097  13.305  27.216
  145   2H2     G  13          2H2         G  13  -5.134  13.994  26.038
  146   1H2*    G  13          1H2*        G  13  -2.498  19.330  22.092
  147   2H2*    G  13          2H2*        G  13  -3.999  19.543  22.993
  148   1H5*    A  14          1H5*        A  14  -7.028  17.769  22.841
  149   2H5*    A  14          2H5*        A  14  -8.389  18.756  23.372
  150    H4*    A  14           H4*        A  14  -7.731  17.048  24.964
  151    H3*    A  14           H3*        A  14  -8.577  19.503  25.735
  152    H1*    A  14           H1*        A  14  -5.400  17.993  27.317
  153    H8     A  14           H8         A  14  -4.359  20.678  24.712
  154   1H6     A  14          1H6         A  14   1.284  19.937  27.095
  155   2H6     A  14          2H6         A  14   0.319  20.817  25.959
  156    H2     A  14           H2         A  14  -1.484  17.027  29.102
  157   1H2*    A  14          1H2*        A  14  -6.364  20.497  25.964
  158   2H2*    A  14          2H2*        A  14  -6.677  19.921  27.601
  159   1H5*    A  15          1H5*        A  15 -11.615  16.596  28.909
  160   2H5*    A  15          2H5*        A  15 -10.030  16.171  28.260
  161    H4*    A  15           H4*        A  15 -12.559  16.507  26.719
  162    H3*    A  15           H3*        A  15 -12.214  14.240  28.117
  163    H1*    A  15           H1*        A  15 -10.939  14.309  24.480
  164    H8     A  15           H8         A  15  -7.958  14.239  26.868
  165   1H6     A  15          1H6         A  15  -4.491  14.829  21.799
  166   2H6     A  15          2H6         A  15  -4.485  14.547  23.507
  167    H2     A  15           H2         A  15  -8.794  15.322  20.623
  168   1H2*    A  15          1H2*        A  15  -9.969  13.744  27.263
  169   2H2*    A  15          2H2*        A  15 -11.007  12.771  26.222
  170   1H5*    G  16          1H5*        G  16 -13.630  13.724  23.791
  171   2H5*    G  16          2H5*        G  16 -14.668  12.307  23.624
  172    H4*    G  16           H4*        G  16 -13.167  12.763  21.726
  173    H3*    G  16           H3*        G  16 -13.905  10.265  22.549
  174    H1*    G  16           H1*        G  16 -10.238  11.098  21.675
  175    H8     G  16           H8         G  16 -10.571  10.607  25.513
  176    H1     G  16           H1         G  16  -4.673  11.606  23.204
  177   1H2     G  16          1H2         G  16  -4.754  12.035  20.990
  178   2H2     G  16          2H2         G  16  -6.269  12.056  20.185
  179   1H2*    G  16          1H2*        G  16 -11.896   9.782  23.814
  180   2H2*    G  16          2H2*        G  16 -11.452   9.177  22.218
  181   1H5*    T  17          1H5*        T  17 -12.184  10.709  18.418
  182   2H5*    T  17          2H5*        T  17 -12.505   9.450  17.226
  183    H4*    T  17           H4*        T  17 -10.267  10.376  17.155
  184    H3*    T  17           H3*        T  17 -10.740   7.470  17.322
  185   1H2*    T  17          1H2*        T  17  -8.799   6.997  18.484
  186   2H2*    T  17          2H2*        T  17  -7.893   7.844  17.231
  187    H1*    T  17           H1*        T  17  -7.738   9.761  18.468
  188    H3     T  17           H3         T  17  -5.082   8.596  21.777
  189   1H5M    T  17          1H5M        T  17  -8.727   6.207  23.691
  190   2H5M    T  17          2H5M        T  17 -10.092   7.156  23.098
  191   3H5M    T  17          3H5M        T  17  -9.019   7.827  24.329
  192    H6     T  17           H6         T  17  -9.759   8.030  20.993
  193   1H5*    T  18          1H5*        T  18  -7.515   9.227  14.960
  194   2H5*    T  18          2H5*        T  18  -7.236   8.401  13.427
  195    H4*    T  18           H4*        T  18  -5.181   9.101  14.413
  196    H3*    T  18           H3*        T  18  -5.529   6.480  13.500
  197   1H2*    T  18          1H2*        T  18  -5.329   5.411  15.620
  198   2H2*    T  18          2H2*        T  18  -3.616   5.650  15.277
  199    H1*    T  18           H1*        T  18  -3.482   7.575  16.601
  200    H3     T  18           H3         T  18  -3.223   6.174  20.733
  201   1H5M    T  18          1H5M        T  18  -7.282   3.889  20.243
  202   2H5M    T  18          2H5M        T  18  -8.046   4.710  18.881
  203   3H5M    T  18          3H5M        T  18  -8.001   5.485  20.465
  204    H6     T  18           H6         T  18  -6.700   5.970  17.467
  205   1H5*    A  19          1H5*        A  19  -1.060   7.340  14.557
  206   2H5*    A  19          2H5*        A  19  -0.263   6.814  13.075
  207    H4*    A  19           H4*        A  19   1.114   6.105  14.761
  208    H3*    A  19           H3*        A  19  -0.039   4.057  13.239
  209    H1*    A  19           H1*        A  19   0.759   3.938  17.028
  210    H8     A  19           H8         A  19  -3.086   3.861  16.461
  211   1H6     A  19          1H6         A  19  -3.300   2.349  22.439
  212   2H6     A  19          2H6         A  19  -4.226   2.621  21.003
  213    H2     A  19           H2         A  19   0.991   3.029  21.314
  214   1H2*    A  19          1H2*        A  19  -1.287   3.059  15.003
  215   2H2*    A  19          2H2*        A  19   0.291   2.359  15.366
  216   1H5*    T  20          1H5*        T  20   3.569   3.236  15.763
  217   2H5*    T  20          2H5*        T  20   4.708   2.133  14.990
  218    H4*    T  20           H4*        T  20   4.677   1.783  17.331
  219    H3*    T  20           H3*        T  20   4.208  -0.389  15.555
  220   1H2*    T  20          1H2*        T  20   2.145  -1.055  16.484
  221   2H2*    T  20          2H2*        T  20   3.171  -1.670  17.781
  222    H1*    T  20           H1*        T  20   2.807   0.203  19.137
  223    H3     T  20           H3         T  20  -1.134  -0.402  20.913
  224   1H5M    T  20          1H5M        T  20  -3.247   0.864  17.001
  225   2H5M    T  20          2H5M        T  20  -2.671  -0.623  16.245
  226   3H5M    T  20          3H5M        T  20  -1.955   0.928  15.799
  227    H6     T  20           H6         T  20   0.291   0.511  16.447
  228   1H5*    A  21          1H5*        A  21   5.784  -1.307  19.828
  229   2H5*    A  21          2H5*        A  21   7.006  -2.558  19.597
  230    H4*    A  21           H4*        A  21   5.874  -2.928  21.633
  231    H3*    A  21           H3*        A  21   6.114  -4.997  19.813
  232    H1*    A  21           H1*        A  21   2.965  -4.351  21.961
  233    H8     A  21           H8         A  21   2.199  -3.481  18.250
  234   1H6     A  21          1H6         A  21  -3.666  -3.297  20.158
  235   2H6     A  21          2H6         A  21  -2.603  -3.154  18.801
  236    H2     A  21           H2         A  21  -1.058  -4.152  23.710
  237   1H2*    A  21          1H2*        A  21   3.805  -5.073  19.160
  238   2H2*    A  21          2H2*        A  21   3.748  -6.088  20.601
  239   1H5*    A  22          1H5*        A  22   5.107  -5.908  24.271
  240   2H5*    A  22          2H5*        A  22   6.030  -7.364  24.644
  241    H4*    A  22           H4*        A  22   4.088  -7.212  26.009
  242    H3*    A  22           H3*        A  22   4.748  -9.574  24.841
  243    H1*    A  22           H1*        A  22   1.094  -8.332  24.800
  244    H8     A  22           H8         A  22   2.638  -7.863  21.271
  245   1H6     A  22          1H6         A  22  -3.128  -6.452  19.592
  246   2H6     A  22          2H6         A  22  -1.504  -6.698  19.048
  247    H2     A  22           H2         A  22  -3.082  -7.125  24.029
  248   1H2*    A  22          1H2*        A  22   3.224  -9.383  22.955
  249   2H2*    A  22          2H2*        A  22   2.236 -10.253  24.129
  250   1H5*    T  23          1H5*        T  23   1.064  -9.905  27.672
  251   2H5*    T  23          2H5*        T  23   0.965 -11.537  28.333
  252    H4*    T  23           H4*        T  23  -1.159 -10.616  27.713
  253    H3*    T  23           H3*        T  23  -0.268 -13.190  26.522
  254   1H2*    T  23          1H2*        T  23  -1.643 -13.037  24.672
  255   2H2*    T  23          2H2*        T  23  -2.995 -12.576  25.707
  256    H1*    T  23           H1*        T  23  -2.733 -10.380  25.238
  257    H3     T  23           H3         T  23  -3.333  -9.912  20.900
  258   1H5M    T  23          1H5M        T  23   0.960 -12.156  20.430
  259   2H5M    T  23          2H5M        T  23   1.802 -11.242  21.683
  260   3H5M    T  23          3H5M        T  23   1.247 -10.427  20.220
  261    H6     T  23           H6         T  23   0.376 -11.366  23.533
  262   1H5*    T  24          1H5*        T  24  -4.463 -12.728  27.690
  263   2H5*    T  24          2H5*        T  24  -5.069 -14.211  28.427
  264    H4*    T  24           H4*        T  24  -6.670 -13.247  26.930
  265    H3*    T  24           H3*        T  24  -6.108 -15.948  26.894
  266   1H2*    T  24          1H2*        T  24  -4.859 -15.948  24.836
  267   2H2*    T  24          2H2*        T  24  -6.499 -16.121  24.211
  268    H1*    T  24           H1*        T  24  -6.691 -13.845  23.704
  269    H3     T  24           H3         T  24  -4.475 -12.950  20.034
  270   1H5M    T  24          1H5M        T  24  -0.998 -15.122  23.513
  271   2H5M    T  24          2H5M        T  24  -0.444 -13.863  22.407
  272   3H5M    T  24          3H5M        T  24  -0.853 -15.465  21.788
  273    H6     T  24           H6         T  24  -3.160 -14.790  24.239
  274   1H5*    A  25          1H5*        A  25  -9.584 -14.644  24.040
  275   2H5*    A  25          2H5*        A  25 -10.855 -15.767  24.524
  276    H4*    A  25           H4*        A  25 -11.109 -15.351  22.245
  277    H3*    A  25           H3*        A  25 -10.912 -17.970  23.036
  278    H1*    A  25           H1*        A  25  -9.185 -16.633  19.851
  279    H8     A  25           H8         A  25  -6.518 -17.578  22.483
  280   1H6     A  25          1H6         A  25  -2.473 -16.127  18.056
  281   2H6     A  25          2H6         A  25  -2.672 -16.761  19.653
  282    H2     A  25           H2         A  25  -6.594 -15.161  16.565
  283   1H2*    A  25          1H2*        A  25  -8.643 -18.321  22.285
  284   2H2*    A  25          2H2*        A  25  -9.544 -18.729  20.824
  285   1H5*    G  26          1H5*        G  26 -12.420 -17.042  18.668
  286   2H5*    G  26          2H5*        G  26 -13.711 -18.226  18.457
  287    H4*    G  26           H4*        G  26 -12.770 -17.670  16.361
  288    H3*    G  26           H3*        G  26 -13.170 -20.285  16.983
  289    H1*    G  26           H1*        G  26  -9.875 -19.152  15.324
  290    H8     G  26           H8         G  26  -9.207 -19.933  19.075
  291    H1     G  26           H1         G  26  -4.113 -18.615  15.412
  292   1H2     G  26          1H2         G  26  -4.766 -18.053  13.326
  293   2H2     G  26          2H2         G  26  -6.435 -18.028  12.937
  294   1H2*    G  26          1H2*        G  26 -10.882 -20.763  17.655
  295   2H2*    G  26          2H2*        G  26 -10.847 -21.181  15.942
  296   1H5*    G  27          1H5*        G  27 -11.946 -19.691  12.292
  297   2H5*    G  27          2H5*        G  27 -12.739 -21.081  11.553
  298    H4*    G  27           H4*        G  27 -10.743 -20.751  10.471
  299    H3*    G  27           H3*        G  27 -10.587 -23.202  12.265
  300    H1*    G  27           H1*        G  27  -7.555 -20.871  11.446
  301    H8     G  27           H8         G  27  -9.486 -22.244  14.533
  302    H1     G  27           H1         G  27  -3.100 -21.953  15.016
  303   1H2     G  27          1H2         G  27  -2.189 -21.290  13.060
  304   2H2     G  27          2H2         G  27  -3.208 -20.948  11.724
  305   1H2*    G  27          1H2*        G  27  -8.307 -23.491  11.512
  306   2H2*    G  27          2H2*        G  27  -8.555 -22.437  10.119
  Start of MODEL    9
    1   1H5*    C   1          1H5*        C   1   6.868 -20.754  16.051
    2   2H5*    C   1          2H5*        C   1   5.444 -20.463  17.051
    3    H4*    C   1           H4*        C   1   5.617 -22.180  14.615
    4    H3*    C   1           H3*        C   1   5.259 -19.428  14.545
    5    H1*    C   1           H1*        C   1   2.435 -22.037  14.127
    6   1H4     C   1          1H4         C   1  -2.742 -21.755  17.653
    7   2H4     C   1          2H4         C   1  -1.824 -21.470  19.092
    8    H5     C   1           H5         C   1   0.585 -21.208  19.100
    9    H6     C   1           H6         C   1   2.585 -21.174  17.679
   10   1H2*    C   1          1H2*        C   1   3.044 -19.405  15.455
   11   2H2*    C   1          2H2*        C   1   2.664 -19.736  13.766
   12   1H5*    C   2          1H5*        C   2   2.746 -20.415  10.748
   13   2H5*    C   2          2H5*        C   2   3.460 -19.208   9.679
   14    H4*    C   2           H4*        C   2   1.145 -18.938   9.614
   15    H3*    C   2           H3*        C   2   2.704 -16.742  10.433
   16    H1*    C   2           H1*        C   2  -0.851 -17.693  11.660
   17   1H4     C   2          1H4         C   2  -2.199 -18.506  17.718
   18   2H4     C   2          2H4         C   2  -0.546 -18.310  18.193
   19    H5     C   2           H5         C   2   1.258 -17.963  16.610
   20    H6     C   2           H6         C   2   1.794 -17.738  14.227
   21   1H2*    C   2          1H2*        C   2   1.754 -16.511  12.595
   22   2H2*    C   2          2H2*        C   2   0.456 -15.753  11.672
   23   1H5*    T   3          1H5*        T   3  -1.511 -16.291   8.831
   24   2H5*    T   3          2H5*        T   3  -1.652 -14.831   7.852
   25    H4*    T   3           H4*        T   3  -3.704 -15.318   8.962
   26    H3*    T   3           H3*        T   3  -2.602 -12.765   9.042
   27   1H2*    T   3          1H2*        T   3  -2.070 -12.759  11.375
   28   2H2*    T   3          2H2*        T   3  -3.771 -12.306  11.466
   29    H1*    T   3           H1*        T   3  -4.466 -14.485  11.966
   30    H3     T   3           H3         T   3  -3.610 -15.367  16.165
   31   1H5M    T   3          1H5M        T   3   0.762 -13.380  15.164
   32   2H5M    T   3          2H5M        T   3   1.109 -14.458  13.811
   33   3H5M    T   3          3H5M        T   3   0.957 -15.110  15.443
   34    H6     T   3           H6         T   3  -0.825 -14.123  12.491
   35   1H5*    A   4          1H5*        A   4  -7.060 -13.338  10.335
   36   2H5*    A   4          2H5*        A   4  -7.894 -11.963   9.612
   37    H4*    A   4           H4*        A   4  -8.950 -12.586  11.639
   38    H3*    A   4           H3*        A   4  -8.322  -9.948  11.172
   39    H1*    A   4           H1*        A   4  -7.895 -11.638  14.621
   40    H8     A   4           H8         A   4  -4.400 -10.944  13.082
   41   1H6     A   4          1H6         A   4  -2.302 -12.593  18.645
   42   2H6     A   4          2H6         A   4  -1.872 -12.008  17.074
   43    H2     A   4           H2         A   4  -6.762 -13.096  18.619
   44   1H2*    A   4          1H2*        A   4  -6.452  -9.833  12.690
   45   2H2*    A   4          2H2*        A   4  -7.782  -9.455  13.784
   46   1H5*    A   5          1H5*        A   5 -10.901 -11.165  14.645
   47   2H5*    A   5          2H5*        A   5 -12.315 -10.110  14.667
   48    H4*    A   5           H4*        A   5 -11.961 -10.899  16.837
   49    H3*    A   5           H3*        A   5 -12.194  -8.196  16.487
   50    H1*    A   5           H1*        A   5  -9.570  -9.717  18.876
   51    H8     A   5           H8         A   5  -7.772  -8.480  15.659
   52   1H6     A   5          1H6         A   5  -2.624  -9.351  18.946
   53   2H6     A   5          2H6         A   5  -3.279  -8.812  17.438
   54    H2     A   5           H2         A   5  -6.124 -10.617  21.454
   55   1H2*    A   5          1H2*        A   5  -9.834  -7.686  16.672
   56   2H2*    A   5          2H2*        A   5 -10.340  -7.574  18.357
   57   1H5*    T   6          1H5*        T   6 -11.903  -9.766  20.747
   58   2H5*    T   6          2H5*        T   6 -13.038  -8.888  21.773
   59    H4*    T   6           H4*        T   6 -11.103  -9.521  23.001
   60    H3*    T   6           H3*        T   6 -11.989  -6.834  22.981
   61   1H2*    T   6          1H2*        T   6  -9.991  -5.890  22.137
   62   2H2*    T   6          2H2*        T   6  -9.435  -6.170  23.787
   63    H1*    T   6           H1*        T   6  -8.347  -8.163  23.227
   64    H3     T   6           H3         T   6  -4.597  -6.897  21.375
   65   1H5M    T   6          1H5M        T   6  -6.804  -6.037  17.361
   66   2H5M    T   6          2H5M        T   6  -7.395  -4.571  18.145
   67   3H5M    T   6          3H5M        T   6  -8.500  -5.911  17.831
   68    H6     T   6           H6         T   6  -9.150  -6.634  19.958
   69   1H5*    T   7          1H5*        T   7  -9.273  -7.932  26.461
   70   2H5*    T   7          2H5*        T   7  -9.755  -7.046  27.909
   71    H4*    T   7           H4*        T   7  -7.386  -7.064  27.614
   72    H3*    T   7           H3*        T   7  -8.821  -4.579  27.944
   73   1H2*    T   7          1H2*        T   7  -7.755  -3.459  26.185
   74   2H2*    T   7          2H2*        T   7  -6.324  -3.553  27.209
   75    H1*    T   7           H1*        T   7  -5.478  -5.420  26.081
   76    H3     T   7           H3         T   7  -3.803  -3.932  22.345
   77   1H5M    T   7          1H5M        T   7  -8.260  -2.213  21.441
   78   2H5M    T   7          2H5M        T   7  -9.140  -3.680  21.873
   79   3H5M    T   7          3H5M        T   7  -8.065  -3.677  20.474
   80    H6     T   7           H6         T   7  -8.283  -4.289  23.959
   81   1H5*    A   8          1H5*        A   8  -4.492  -5.056  29.242
   82   2H5*    A   8          2H5*        A   8  -4.357  -4.303  30.830
   83    H4*    A   8           H4*        A   8  -2.325  -4.034  29.678
   84    H3*    A   8           H3*        A   8  -3.529  -1.819  30.785
   85    H1*    A   8           H1*        A   8  -1.771  -1.773  27.344
   86    H8     A   8           H8         A   8  -5.613  -1.539  26.818
   87   1H6     A   8          1H6         A   8  -4.106  -0.168  20.995
   88   2H6     A   8          2H6         A   8  -5.402  -0.361  22.125
   89    H2     A   8           H2         A   8  -0.326  -1.015  23.262
   90   1H2*    A   8          1H2*        A   8  -4.288  -0.848  28.713
   91   2H2*    A   8          2H2*        A   8  -2.659  -0.177  28.807
   92   1H5*    T   9          1H5*        T   9   0.810  -1.556  29.306
   93   2H5*    T   9          2H5*        T   9   1.712  -0.562  30.450
   94    H4*    T   9           H4*        T   9   2.620  -0.383  28.251
   95    H3*    T   9           H3*        T   9   2.104   1.876  29.775
   96   1H2*    T   9          1H2*        T   9   0.273   2.693  28.462
   97   2H2*    T   9          2H2*        T   9   1.620   3.351  27.534
   98    H1*    T   9           H1*        T   9   1.554   1.624  25.955
   99    H3     T   9           H3         T   9  -1.767   2.337  23.196
  100   1H5M    T   9          1H5M        T   9  -4.492   3.131  27.052
  101   2H5M    T   9          2H5M        T   9  -3.867   1.875  28.122
  102   3H5M    T   9          3H5M        T   9  -4.807   1.431  26.697
  103    H6     T   9           H6         T   9  -1.577   1.674  27.921
  104   1H5*    A  10          1H5*        A  10   4.681   2.381  25.964
  105   2H5*    A  10          2H5*        A  10   6.012   3.441  26.429
  106    H4*    A  10           H4*        A  10   5.442   3.793  24.155
  107    H3*    A  10           H3*        A  10   5.652   5.950  25.892
  108    H1*    A  10           H1*        A  10   3.041   5.636  23.055
  109    H8     A  10           H8         A  10   1.263   5.324  26.500
  110   1H6     A  10          1H6         A  10  -3.896   6.032  23.190
  111   2H6     A  10          2H6         A  10  -3.235   5.834  24.777
  112    H2     A  10           H2         A  10  -0.406   6.023  20.368
  113   1H2*    A  10          1H2*        A  10   3.328   6.522  25.919
  114   2H2*    A  10          2H2*        A  10   3.816   7.354  24.443
  115   1H5*    A  11          1H5*        A  11   5.404   6.722  21.374
  116   2H5*    A  11          2H5*        A  11   6.776   7.784  21.056
  117    H4*    A  11           H4*        A  11   5.135   8.232  19.459
  118    H3*    A  11           H3*        A  11   6.109  10.345  20.911
  119    H1*    A  11           H1*        A  11   2.364   9.988  20.035
  120    H8     A  11           H8         A  11   2.853   9.673  23.844
  121   1H6     A  11          1H6         A  11  -3.282   9.053  24.019
  122   2H6     A  11          2H6         A  11  -1.837   9.208  24.958
  123    H2     A  11           H2         A  11  -2.003   9.149  19.718
  124   1H2*    A  11          1H2*        A  11   4.186  10.606  22.350
  125   2H2*    A  11          2H2*        A  11   3.726  11.631  20.991
  126   1H5*    C  12          1H5*        C  12   4.160  11.126  16.925
  127   2H5*    C  12          2H5*        C  12   4.612  12.617  16.098
  128    H4*    C  12           H4*        C  12   2.280  11.945  15.796
  129    H3*    C  12           H3*        C  12   3.099  14.548  16.034
  130    H1*    C  12           H1*        C  12  -0.017  13.205  17.877
  131   1H4     C  12          1H4         C  12  -0.573  13.034  24.113
  132   2H4     C  12          2H4         C  12   1.111  13.354  24.355
  133    H5     C  12           H5         C  12   2.686  13.624  22.532
  134    H6     C  12           H6         C  12   2.915  13.634  20.089
  135   1H2*    C  12          1H2*        C  12   2.472  14.828  18.354
  136   2H2*    C  12          2H2*        C  12   0.978  15.293  17.541
  137   1H5*    G  13          1H5*        G  13  -1.268  14.474  15.874
  138   2H5*    G  13          2H5*        G  13  -1.910  15.711  14.793
  139    H4*    G  13           H4*        G  13  -3.104  15.656  16.861
  140    H3*    G  13           H3*        G  13  -2.295  18.037  15.759
  141    H1*    G  13           H1*        G  13  -2.065  17.307  19.546
  142    H8     G  13           H8         G  13   1.483  17.701  18.075
  143    H1     G  13           H1         G  13   1.094  16.330  24.326
  144   1H2     G  13          1H2         G  13  -1.045  15.912  24.911
  145   2H2     G  13          2H2         G  13  -2.280  15.990  23.723
  146   1H2*    G  13          1H2*        G  13  -0.450  18.430  17.267
  147   2H2*    G  13          2H2*        G  13  -1.774  19.172  18.165
  148   1H5*    A  14          1H5*        A  14  -4.910  17.806  19.296
  149   2H5*    A  14          2H5*        A  14  -6.160  19.044  19.423
  150    H4*    A  14           H4*        A  14  -5.333  18.242  21.561
  151    H3*    A  14           H3*        A  14  -6.036  20.818  21.156
  152    H1*    A  14           H1*        A  14  -2.675  20.038  22.877
  153    H8     A  14           H8         A  14  -2.000  20.996  19.173
  154   1H6     A  14          1H6         A  14   3.918  21.112  20.909
  155   2H6     A  14          2H6         A  14   2.808  21.383  19.610
  156    H2     A  14           H2         A  14   1.451  19.800  24.420
  157   1H2*    A  14          1H2*        A  14  -3.803  21.625  20.589
  158   2H2*    A  14          2H2*        A  14  -3.887  21.947  22.320
  159   1H5*    A  15          1H5*        A  15  -8.316  20.069  25.978
  160   2H5*    A  15          2H5*        A  15  -6.842  19.340  25.341
  161    H4*    A  15           H4*        A  15  -9.619  18.872  24.369
  162    H3*    A  15           H3*        A  15  -8.853  17.672  26.649
  163    H1*    A  15           H1*        A  15  -8.260  15.792  23.336
  164    H8     A  15           H8         A  15  -4.901  16.980  24.753
  165   1H6     A  15          1H6         A  15  -2.453  14.533  19.646
  166   2H6     A  15          2H6         A  15  -2.119  15.262  21.179
  167    H2     A  15           H2         A  15  -6.923  14.377  19.275
  168   1H2*    A  15          1H2*        A  15  -6.769  16.732  25.766
  169   2H2*    A  15          2H2*        A  15  -7.902  15.390  25.597
  170   1H5*    G  16          1H5*        G  16 -10.840  14.952  23.550
  171   2H5*    G  16          2H5*        G  16 -11.840  13.749  24.365
  172    H4*    G  16           H4*        G  16 -10.728  12.942  22.349
  173    H3*    G  16           H3*        G  16 -11.110  11.403  24.564
  174    H1*    G  16           H1*        G  16  -7.706  11.447  22.745
  175    H8     G  16           H8         G  16  -7.371  13.256  26.156
  176    H1     G  16           H1         G  16  -2.047  12.724  22.625
  177   1H2     G  16          1H2         G  16  -2.522  11.823  20.611
  178   2H2     G  16          2H2         G  16  -4.139  11.396  20.233
  179   1H2*    G  16          1H2*        G  16  -8.889  11.705  25.498
  180   2H2*    G  16          2H2*        G  16  -8.664  10.260  24.512
  181   1H5*    T  17          1H5*        T  17 -11.273  11.997  20.384
  182   2H5*    T  17          2H5*        T  17 -12.070  11.162  19.049
  183    H4*    T  17           H4*        T  17  -9.809  11.514  18.536
  184    H3*    T  17           H3*        T  17 -10.760   8.750  18.693
  185   1H2*    T  17          1H2*        T  17  -8.815   7.897  19.631
  186   2H2*    T  17          2H2*        T  17  -7.980   8.469  18.186
  187    H1*    T  17           H1*        T  17  -7.216  10.387  19.229
  188    H3     T  17           H3         T  17  -4.078   8.968  21.923
  189   1H5M    T  17          1H5M        T  17  -8.808   7.931  24.262
  190   2H5M    T  17          2H5M        T  17  -7.416   8.403  25.240
  191   3H5M    T  17          3H5M        T  17  -7.469   6.805  24.494
  192    H6     T  17           H6         T  17  -8.847   8.825  22.137
  193   1H5*    T  18          1H5*        T  18  -7.602   9.993  15.845
  194   2H5*    T  18          2H5*        T  18  -7.774   9.179  14.291
  195    H4*    T  18           H4*        T  18  -5.480   9.405  14.872
  196    H3*    T  18           H3*        T  18  -6.505   6.947  14.064
  197   1H2*    T  18          1H2*        T  18  -6.253   5.830  16.164
  198   2H2*    T  18          2H2*        T  18  -4.612   5.648  15.544
  199    H1*    T  18           H1*        T  18  -3.799   7.461  16.782
  200    H3     T  18           H3         T  18  -3.232   6.151  20.916
  201   1H5M    T  18          1H5M        T  18  -8.015   6.151  21.338
  202   2H5M    T  18          2H5M        T  18  -7.637   4.476  20.932
  203   3H5M    T  18          3H5M        T  18  -8.439   5.511  19.749
  204    H6     T  18           H6         T  18  -7.097   6.465  18.129
  205   1H5*    A  19          1H5*        A  19  -1.900   7.305  14.585
  206   2H5*    A  19          2H5*        A  19  -1.322   6.705  13.030
  207    H4*    A  19           H4*        A  19   0.279   6.138  14.609
  208    H3*    A  19           H3*        A  19  -0.796   4.074  13.131
  209    H1*    A  19           H1*        A  19   0.047   3.787  16.893
  210    H8     A  19           H8         A  19  -3.808   3.810  16.429
  211   1H6     A  19          1H6         A  19  -3.916   2.284  22.406
  212   2H6     A  19          2H6         A  19  -4.868   2.568  20.990
  213    H2     A  19           H2         A  19   0.358   2.925  21.196
  214   1H2*    A  19          1H2*        A  19  -2.112   3.114  14.905
  215   2H2*    A  19          2H2*        A  19  -0.567   2.310  15.184
  216   1H5*    T  20          1H5*        T  20   2.758   3.281  15.828
  217   2H5*    T  20          2H5*        T  20   3.918   2.276  14.958
  218    H4*    T  20           H4*        T  20   4.047   1.812  17.267
  219    H3*    T  20           H3*        T  20   3.653  -0.282  15.453
  220   1H2*    T  20          1H2*        T  20   1.502  -0.938  16.237
  221   2H2*    T  20          2H2*        T  20   2.487  -1.738  17.461
  222    H1*    T  20           H1*        T  20   2.177  -0.026  19.026
  223    H3     T  20           H3         T  20  -1.801  -0.558  20.759
  224   1H5M    T  20          1H5M        T  20  -2.540   0.856  15.649
  225   2H5M    T  20          2H5M        T  20  -3.841   0.847  16.841
  226   3H5M    T  20          3H5M        T  20  -3.313  -0.665  16.100
  227    H6     T  20           H6         T  20  -0.317   0.456  16.335
  228   1H5*    A  21          1H5*        A  21   5.409  -1.111  19.726
  229   2H5*    A  21          2H5*        A  21   6.647  -2.334  19.433
  230    H4*    A  21           H4*        A  21   5.728  -2.543  21.621
  231    H3*    A  21           H3*        A  21   6.128  -4.750  20.086
  232    H1*    A  21           H1*        A  21   2.839  -4.311  22.058
  233    H8     A  21           H8         A  21   2.164  -3.670  18.293
  234   1H6     A  21          1H6         A  21  -3.766  -3.537  19.990
  235   2H6     A  21          2H6         A  21  -2.662  -3.468  18.660
  236    H2     A  21           H2         A  21  -1.258  -4.009  23.682
  237   1H2*    A  21          1H2*        A  21   3.837  -4.954  19.295
  238   2H2*    A  21          2H2*        A  21   3.810  -5.970  20.736
  239   1H5*    A  22          1H5*        A  22   4.828  -5.448  24.534
  240   2H5*    A  22          2H5*        A  22   5.828  -6.809  25.043
  241    H4*    A  22           H4*        A  22   3.796  -6.777  26.262
  242    H3*    A  22           H3*        A  22   4.676  -9.115  25.167
  243    H1*    A  22           H1*        A  22   0.962  -8.088  24.963
  244    H8     A  22           H8         A  22   2.596  -7.687  21.469
  245   1H6     A  22          1H6         A  22  -3.173  -6.633  19.554
  246   2H6     A  22          2H6         A  22  -1.523  -6.823  19.070
  247    H2     A  22           H2         A  22  -3.240  -7.115  24.015
  248   1H2*    A  22          1H2*        A  22   3.212  -9.088  23.234
  249   2H2*    A  22          2H2*        A  22   2.229  -9.968  24.404
  250   1H5*    T  23          1H5*        T  23   0.943  -9.491  27.811
  251   2H5*    T  23          2H5*        T  23   0.894 -11.052  28.629
  252    H4*    T  23           H4*        T  23  -1.267 -10.291  27.864
  253    H3*    T  23           H3*        T  23  -0.273 -12.939  27.319
  254   1H2*    T  23          1H2*        T  23  -0.774 -12.918  25.029
  255   2H2*    T  23          2H2*        T  23  -2.452 -12.958  25.572
  256    H1*    T  23           H1*        T  23  -2.729 -10.649  25.311
  257    H3     T  23           H3         T  23  -3.255 -10.094  21.018
  258   1H5M    T  23          1H5M        T  23   1.254 -11.987  20.664
  259   2H5M    T  23          2H5M        T  23   1.972 -10.891  21.847
  260   3H5M    T  23          3H5M        T  23   1.325 -10.255  20.334
  261    H6     T  23           H6         T  23   0.534 -11.231  23.692
  262   1H5*    T  24          1H5*        T  24  -4.779 -12.319  27.524
  263   2H5*    T  24          2H5*        T  24  -5.462 -13.689  28.399
  264    H4*    T  24           H4*        T  24  -6.917 -13.071  26.650
  265    H3*    T  24           H3*        T  24  -6.109 -15.714  26.885
  266   1H2*    T  24          1H2*        T  24  -4.750 -15.775  24.910
  267   2H2*    T  24          2H2*        T  24  -6.332 -16.084  24.193
  268    H1*    T  24           H1*        T  24  -6.618 -13.857  23.531
  269    H3     T  24           H3         T  24  -4.189 -12.934  20.001
  270   1H5M    T  24          1H5M        T  24  -0.649 -15.368  22.041
  271   2H5M    T  24          2H5M        T  24  -0.893 -14.954  23.739
  272   3H5M    T  24          3H5M        T  24  -0.295 -13.736  22.612
  273    H6     T  24           H6         T  24  -3.106 -14.671  24.316
  274   1H5*    A  25          1H5*        A  25  -9.677 -14.879  23.903
  275   2H5*    A  25          2H5*        A  25 -10.819 -16.127  24.403
  276    H4*    A  25           H4*        A  25 -11.082 -15.764  22.106
  277    H3*    A  25           H3*        A  25 -10.686 -18.336  22.967
  278    H1*    A  25           H1*        A  25  -9.005 -16.950  19.778
  279    H8     A  25           H8         A  25  -6.330 -17.510  22.517
  280   1H6     A  25          1H6         A  25  -2.320 -15.992  18.082
  281   2H6     A  25          2H6         A  25  -2.502 -16.535  19.715
  282    H2     A  25           H2         A  25  -6.471 -15.504  16.449
  283   1H2*    A  25          1H2*        A  25  -8.376 -18.511  22.273
  284   2H2*    A  25          2H2*        A  25  -9.206 -19.039  20.810
  285   1H5*    G  26          1H5*        G  26 -12.119 -17.677  18.533
  286   2H5*    G  26          2H5*        G  26 -13.285 -18.979  18.294
  287    H4*    G  26           H4*        G  26 -12.262 -18.377  16.238
  288    H3*    G  26           H3*        G  26 -12.544 -20.997  16.885
  289    H1*    G  26           H1*        G  26  -9.213 -19.707  15.424
  290    H8     G  26           H8         G  26  -8.751 -20.446  19.207
  291    H1     G  26           H1         G  26  -3.538 -18.642  15.939
  292   1H2     G  26          1H2         G  26  -4.085 -18.098  13.818
  293   2H2     G  26          2H2         G  26  -5.720 -18.205  13.309
  294   1H2*    G  26          1H2*        G  26 -10.283 -21.315  17.729
  295   2H2*    G  26          2H2*        G  26 -10.105 -21.774  16.035
  296   1H5*    G  27          1H5*        G  27 -11.164 -20.396  12.164
  297   2H5*    G  27          2H5*        G  27 -11.916 -21.850  11.509
  298    H4*    G  27           H4*        G  27  -9.990 -21.555  10.331
  299    H3*    G  27           H3*        G  27  -9.607 -23.792  12.340
  300    H1*    G  27           H1*        G  27  -6.688 -21.383  11.403
  301    H8     G  27           H8         G  27  -8.837 -22.638  14.400
  302    H1     G  27           H1         G  27  -2.551 -21.907  15.433
  303   1H2     G  27          1H2         G  27  -1.502 -21.312  13.525
  304   2H2     G  27          2H2         G  27  -2.409 -21.122  12.082
  305   1H2*    G  27          1H2*        G  27  -7.318 -23.991  11.547
  306   2H2*    G  27          2H2*        G  27  -7.657 -23.033  10.105
  Start of MODEL   10
    1   1H5*    C   1          1H5*        C   1   5.185 -22.009  14.968
    2   2H5*    C   1          2H5*        C   1   3.745 -21.679  15.931
    3    H4*    C   1           H4*        C   1   3.897 -23.239  13.392
    4    H3*    C   1           H3*        C   1   3.819 -20.506  13.401
    5    H1*    C   1           H1*        C   1   0.626 -22.627  12.945
    6   1H4     C   1          1H4         C   1  -4.267 -22.150  16.836
    7   2H4     C   1          2H4         C   1  -3.243 -21.995  18.224
    8    H5     C   1           H5         C   1  -0.823 -21.934  18.088
    9    H6     C   1           H6         C   1   1.083 -22.015  16.546
   10   1H2*    C   1          1H2*        C   1   1.682 -20.290  14.519
   11   2H2*    C   1          2H2*        C   1   1.179 -20.360  12.830
   12   1H5*    C   2          1H5*        C   2   1.248 -20.525   9.569
   13   2H5*    C   2          2H5*        C   2   2.043 -19.155   8.791
   14    H4*    C   2           H4*        C   2  -0.236 -18.702   9.088
   15    H3*    C   2           H3*        C   2   1.680 -16.972  10.511
   16    H1*    C   2           H1*        C   2  -2.068 -17.971  11.233
   17   1H4     C   2          1H4         C   2  -3.225 -19.086  17.282
   18   2H4     C   2          2H4         C   2  -1.547 -19.035  17.700
   19    H5     C   2           H5         C   2   0.214 -18.658  16.078
   20    H6     C   2           H6         C   2   0.675 -18.253  13.701
   21   1H2*    C   2          1H2*        C   2   0.281 -16.510  12.294
   22   2H2*    C   2          2H2*        C   2  -0.942 -15.981  11.137
   23   1H5*    T   3          1H5*        T   3  -1.983 -15.715   8.585
   24   2H5*    T   3          2H5*        T   3  -1.964 -14.124   7.825
   25    H4*    T   3           H4*        T   3  -4.088 -14.581   8.806
   26    H3*    T   3           H3*        T   3  -2.827 -12.164   9.221
   27   1H2*    T   3          1H2*        T   3  -2.204 -12.559  11.512
   28   2H2*    T   3          2H2*        T   3  -3.834 -11.925  11.732
   29    H1*    T   3           H1*        T   3  -4.776 -14.054  11.971
   30    H3     T   3           H3         T   3  -3.923 -15.665  15.954
   31   1H5M    T   3          1H5M        T   3   0.561 -14.079  15.332
   32   2H5M    T   3          2H5M        T   3   0.799 -14.537  13.645
   33   3H5M    T   3          3H5M        T   3   0.672 -15.783  14.887
   34    H6     T   3           H6         T   3  -1.111 -14.117  12.418
   35   1H5*    A   4          1H5*        A   4  -7.432 -12.495  10.252
   36   2H5*    A   4          2H5*        A   4  -8.050 -10.946   9.677
   37    H4*    A   4           H4*        A   4  -9.349 -11.797  11.493
   38    H3*    A   4           H3*        A   4  -8.669  -9.171  11.392
   39    H1*    A   4           H1*        A   4  -8.320 -11.137  14.695
   40    H8     A   4           H8         A   4  -4.798 -10.628  13.144
   41   1H6     A   4          1H6         A   4  -2.767 -12.839  18.533
   42   2H6     A   4          2H6         A   4  -2.311 -12.179  17.000
   43    H2     A   4           H2         A   4  -7.252 -12.978  18.559
   44   1H2*    A   4          1H2*        A   4  -6.748  -9.329  12.878
   45   2H2*    A   4          2H2*        A   4  -8.045  -8.926  14.004
   46   1H5*    A   5          1H5*        A   5 -11.207 -10.638  14.841
   47   2H5*    A   5          2H5*        A   5 -12.562  -9.519  14.991
   48    H4*    A   5           H4*        A   5 -12.166 -10.511  17.079
   49    H3*    A   5           H3*        A   5 -12.352  -7.791  16.956
   50    H1*    A   5           H1*        A   5  -9.656  -9.521  19.109
   51    H8     A   5           H8         A   5  -7.983  -8.016  15.946
   52   1H6     A   5          1H6         A   5  -2.705  -9.392  18.826
   53   2H6     A   5          2H6         A   5  -3.418  -8.665  17.427
   54    H2     A   5           H2         A   5  -6.109 -10.850  21.361
   55   1H2*    A   5          1H2*        A   5  -9.972  -7.342  17.060
   56   2H2*    A   5          2H2*        A   5 -10.401  -7.333  18.770
   57   1H5*    T   6          1H5*        T   6 -12.122  -9.394  21.317
   58   2H5*    T   6          2H5*        T   6 -12.987  -8.298  22.395
   59    H4*    T   6           H4*        T   6 -10.937  -9.089  23.320
   60    H3*    T   6           H3*        T   6 -11.340  -6.164  22.995
   61   1H2*    T   6          1H2*        T   6  -9.087  -5.654  22.959
   62   2H2*    T   6          2H2*        T   6  -8.832  -6.677  24.372
   63    H1*    T   6           H1*        T   6  -8.087  -8.406  23.115
   64    H3     T   6           H3         T   6  -4.435  -7.020  21.086
   65   1H5M    T   6          1H5M        T   6  -8.614  -5.494  18.093
   66   2H5M    T   6          2H5M        T   6  -6.980  -5.639  17.442
   67   3H5M    T   6          3H5M        T   6  -7.419  -4.238  18.420
   68    H6     T   6           H6         T   6  -9.086  -6.372  20.213
   69   1H5*    T   7          1H5*        T   7  -9.362  -7.541  26.684
   70   2H5*    T   7          2H5*        T   7  -9.829  -6.530  28.051
   71    H4*    T   7           H4*        T   7  -7.455  -6.959  27.965
   72    H3*    T   7           H3*        T   7  -8.524  -4.400  28.414
   73   1H2*    T   7          1H2*        T   7  -7.628  -3.370  26.470
   74   2H2*    T   7          2H2*        T   7  -6.172  -3.348  27.463
   75    H1*    T   7           H1*        T   7  -5.293  -5.269  26.457
   76    H3     T   7           H3         T   7  -3.640  -4.108  22.582
   77   1H5M    T   7          1H5M        T   7  -8.946  -3.308  22.333
   78   2H5M    T   7          2H5M        T   7  -7.982  -3.580  20.879
   79   3H5M    T   7          3H5M        T   7  -7.902  -2.027  21.714
   80    H6     T   7           H6         T   7  -8.076  -4.043  24.350
   81   1H5*    A   8          1H5*        A   8  -3.996  -5.081  29.285
   82   2H5*    A   8          2H5*        A   8  -3.848  -4.429  30.918
   83    H4*    A   8           H4*        A   8  -1.825  -4.047  29.841
   84    H3*    A   8           H3*        A   8  -3.099  -1.863  30.917
   85    H1*    A   8           H1*        A   8  -1.277  -1.758  27.511
   86    H8     A   8           H8         A   8  -5.109  -1.575  26.924
   87   1H6     A   8          1H6         A   8  -3.534  -0.315  21.092
   88   2H6     A   8          2H6         A   8  -4.844  -0.487  22.211
   89    H2     A   8           H2         A   8   0.219  -1.119  23.419
   90   1H2*    A   8          1H2*        A   8  -3.853  -0.922  28.825
   91   2H2*    A   8          2H2*        A   8  -2.252  -0.194  28.954
   92   1H5*    T   9          1H5*        T   9   1.190  -1.449  29.408
   93   2H5*    T   9          2H5*        T   9   2.088  -0.448  30.549
   94    H4*    T   9           H4*        T   9   2.955  -0.199  28.349
   95    H3*    T   9           H3*        T   9   2.343   2.030  29.895
   96   1H2*    T   9          1H2*        T   9   0.495   2.789  28.577
   97   2H2*    T   9          2H2*        T   9   1.820   3.487  27.646
   98    H1*    T   9           H1*        T   9   1.807   1.756  26.072
   99    H3     T   9           H3         T   9  -1.527   2.419  23.322
  100   1H5M    T   9          1H5M        T   9  -4.568   1.344  26.736
  101   2H5M    T   9          2H5M        T   9  -4.262   3.004  27.248
  102   3H5M    T   9          3H5M        T   9  -3.639   1.658  28.203
  103    H6     T   9           H6         T   9  -1.328   1.643  28.029
  104   1H5*    A  10          1H5*        A  10   4.697   2.700  25.999
  105   2H5*    A  10          2H5*        A  10   6.025   3.776  26.435
  106    H4*    A  10           H4*        A  10   5.389   4.246  24.233
  107    H3*    A  10           H3*        A  10   5.339   6.331  26.113
  108    H1*    A  10           H1*        A  10   2.933   5.837  23.113
  109    H8     A  10           H8         A  10   1.015   5.342  26.462
  110   1H6     A  10          1H6         A  10  -4.011   5.850  22.919
  111   2H6     A  10          2H6         A  10  -3.417   5.635  24.530
  112    H2     A  10           H2         A  10  -0.393   6.164  20.279
  113   1H2*    A  10          1H2*        A  10   3.012   6.789  25.968
  114   2H2*    A  10          2H2*        A  10   3.527   7.624  24.502
  115   1H5*    A  11          1H5*        A  11   5.526   7.625  21.730
  116   2H5*    A  11          2H5*        A  11   6.523   9.071  21.571
  117    H4*    A  11           H4*        A  11   4.605   9.177  20.186
  118    H3*    A  11           H3*        A  11   5.018  11.262  22.212
  119    H1*    A  11           H1*        A  11   1.782   9.828  20.475
  120    H8     A  11           H8         A  11   1.890   9.821  24.364
  121   1H6     A  11          1H6         A  11  -4.179   8.817  23.885
  122   2H6     A  11          2H6         A  11  -2.851   9.033  24.972
  123    H2     A  11           H2         A  11  -2.473   9.121  19.744
  124   1H2*    A  11          1H2*        A  11   2.770  11.590  22.660
  125   2H2*    A  11          2H2*        A  11   2.553  11.945  20.946
  126   1H5*    C  12          1H5*        C  12   3.727  12.109  18.020
  127   2H5*    C  12          2H5*        C  12   4.114  13.723  17.425
  128    H4*    C  12           H4*        C  12   1.926  12.892  16.737
  129    H3*    C  12           H3*        C  12   2.414  15.505  17.394
  130    H1*    C  12           H1*        C  12  -0.736  13.642  18.628
  131   1H4     C  12          1H4         C  12  -2.003  12.545  24.665
  132   2H4     C  12          2H4         C  12  -0.425  13.044  25.170
  133    H5     C  12           H5         C  12   1.303  13.753  23.624
  134    H6     C  12           H6         C  12   1.822  14.113  21.253
  135   1H2*    C  12          1H2*        C  12   1.485  15.410  19.626
  136   2H2*    C  12          2H2*        C  12   0.058  15.840  18.685
  137   1H5*    G  13          1H5*        G  13  -1.863  15.011  16.611
  138   2H5*    G  13          2H5*        G  13  -2.509  16.308  15.606
  139    H4*    G  13           H4*        G  13  -3.941  15.831  17.462
  140    H3*    G  13           H3*        G  13  -3.338  18.412  16.764
  141    H1*    G  13           H1*        G  13  -3.453  17.246  20.444
  142    H8     G  13           H8         G  13   0.161  18.219  19.497
  143    H1     G  13           H1         G  13  -0.755  16.010  25.446
  144   1H2     G  13          1H2         G  13  -2.876  15.279  25.699
  145   2H2     G  13          2H2         G  13  -3.968  15.372  24.379
  146   1H2*    G  13          1H2*        G  13  -1.738  18.814  18.531
  147   2H2*    G  13          2H2*        G  13  -3.240  19.288  19.324
  148   1H5*    A  14          1H5*        A  14  -6.218  17.434  19.945
  149   2H5*    A  14          2H5*        A  14  -7.639  18.476  20.030
  150    H4*    A  14           H4*        A  14  -6.959  17.566  22.171
  151    H3*    A  14           H3*        A  14  -7.948  20.065  21.927
  152    H1*    A  14           H1*        A  14  -4.712  19.536  23.955
  153    H8     A  14           H8         A  14  -3.798  20.966  20.463
  154   1H6     A  14          1H6         A  14   1.866  21.544  22.838
  155   2H6     A  14          2H6         A  14   0.861  21.836  21.461
  156    H2     A  14           H2         A  14  -0.747  19.562  25.902
  157   1H2*    A  14          1H2*        A  14  -5.792  21.189  21.690
  158   2H2*    A  14          2H2*        A  14  -6.100  21.327  23.421
  159   1H5*    A  15          1H5*        A  15 -10.668  18.494  26.245
  160   2H5*    A  15          2H5*        A  15  -9.054  17.995  25.738
  161    H4*    A  15           H4*        A  15 -11.629  17.340  24.392
  162    H3*    A  15           H3*        A  15 -10.975  15.982  26.614
  163    H1*    A  15           H1*        A  15  -9.785  14.561  23.234
  164    H8     A  15           H8         A  15  -6.779  15.924  25.174
  165   1H6     A  15          1H6         A  15  -3.501  14.465  20.154
  166   2H6     A  15          2H6         A  15  -3.431  15.013  21.794
  167    H2     A  15           H2         A  15  -7.849  13.877  19.212
  168   1H2*    A  15          1H2*        A  15  -8.701  15.399  25.906
  169   2H2*    A  15          2H2*        A  15  -9.625  13.961  25.475
  170   1H5*    G  16          1H5*        G  16 -12.321  13.386  23.069
  171   2H5*    G  16          2H5*        G  16 -13.225  11.995  23.666
  172    H4*    G  16           H4*        G  16 -11.832  11.550  21.707
  173    H3*    G  16           H3*        G  16 -12.242   9.743  23.701
  174    H1*    G  16           H1*        G  16  -8.699  10.369  22.303
  175    H8     G  16           H8         G  16  -8.936  11.779  25.899
  176    H1     G  16           H1         G  16  -3.286  12.381  22.930
  177   1H2     G  16          1H2         G  16  -3.443  11.692  20.787
  178   2H2     G  16          2H2         G  16  -4.943  11.115  20.190
  179   1H2*    G  16          1H2*        G  16 -10.185  10.196  24.912
  180   2H2*    G  16          2H2*        G  16  -9.680   8.899  23.828
  181   1H5*    T  17          1H5*        T  17 -12.011  10.680  19.589
  182   2H5*    T  17          2H5*        T  17 -12.616   9.903  18.127
  183    H4*    T  17           H4*        T  17 -10.385  10.457  17.785
  184    H3*    T  17           H3*        T  17 -11.062   7.641  17.731
  185   1H2*    T  17          1H2*        T  17  -9.239   6.944  19.018
  186   2H2*    T  17          2H2*        T  17  -8.263   7.471  17.647
  187    H1*    T  17           H1*        T  17  -7.741   9.522  18.640
  188    H3     T  17           H3         T  17  -4.725   8.719  21.675
  189   1H5M    T  17          1H5M        T  17  -8.167   7.250  24.570
  190   2H5M    T  17          2H5M        T  17  -7.843   5.732  23.731
  191   3H5M    T  17          3H5M        T  17  -9.347   6.604  23.429
  192    H6     T  17           H6         T  17  -9.354   7.594  21.345
  193   1H5*    T  18          1H5*        T  18  -7.641   9.297  15.288
  194   2H5*    T  18          2H5*        T  18  -7.600   8.485  13.724
  195    H4*    T  18           H4*        T  18  -5.396   8.923  14.487
  196    H3*    T  18           H3*        T  18  -6.118   6.363  13.640
  197   1H2*    T  18          1H2*        T  18  -5.873   5.285  15.755
  198   2H2*    T  18          2H2*        T  18  -4.181   5.299  15.255
  199    H1*    T  18           H1*        T  18  -3.679   7.196  16.530
  200    H3     T  18           H3         T  18  -3.292   6.046  20.733
  201   1H5M    T  18          1H5M        T  18  -8.299   4.823  19.212
  202   2H5M    T  18          2H5M        T  18  -7.912   5.155  20.901
  203   3H5M    T  18          3H5M        T  18  -7.410   3.633  20.165
  204    H6     T  18           H6         T  18  -6.900   5.743  17.619
  205   1H5*    A  19          1H5*        A  19  -1.584   7.021  14.376
  206   2H5*    A  19          2H5*        A  19  -0.840   6.366  12.918
  207    H4*    A  19           H4*        A  19   0.581   5.853  14.670
  208    H3*    A  19           H3*        A  19  -0.493   3.688  13.241
  209    H1*    A  19           H1*        A  19   0.340   3.797  17.026
  210    H8     A  19           H8         A  19  -3.501   3.499  16.493
  211   1H6     A  19          1H6         A  19  -3.597   2.204  22.524
  212   2H6     A  19          2H6         A  19  -4.546   2.377  21.088
  213    H2     A  19           H2         A  19   0.650   3.043  21.335
  214   1H2*    A  19          1H2*        A  19  -1.656   2.696  15.060
  215   2H2*    A  19          2H2*        A  19  -0.037   2.114  15.445
  216   1H5*    T  20          1H5*        T  20   3.225   3.325  15.771
  217   2H5*    T  20          2H5*        T  20   4.418   2.292  14.984
  218    H4*    T  20           H4*        T  20   4.603   2.132  17.347
  219    H3*    T  20           H3*        T  20   4.455  -0.161  15.780
  220   1H2*    T  20          1H2*        T  20   2.307  -0.888  16.543
  221   2H2*    T  20          2H2*        T  20   3.308  -1.530  17.846
  222    H1*    T  20           H1*        T  20   2.843   0.267  19.272
  223    H3     T  20           H3         T  20  -1.148  -0.288  20.974
  224   1H5M    T  20          1H5M        T  20  -3.077   0.525  16.778
  225   2H5M    T  20          2H5M        T  20  -2.609  -1.145  16.453
  226   3H5M    T  20          3H5M        T  20  -1.757   0.180  15.659
  227    H6     T  20           H6         T  20   0.408   0.227  16.489
  228   1H5*    A  21          1H5*        A  21   5.424  -0.813  20.297
  229   2H5*    A  21          2H5*        A  21   6.895  -1.780  20.182
  230    H4*    A  21           H4*        A  21   5.804  -2.501  22.083
  231    H3*    A  21           H3*        A  21   6.303  -4.424  20.184
  232    H1*    A  21           H1*        A  21   3.009  -4.275  22.200
  233    H8     A  21           H8         A  21   2.312  -3.279  18.517
  234   1H6     A  21          1H6         A  21  -3.615  -3.523  20.212
  235   2H6     A  21          2H6         A  21  -2.516  -3.276  18.899
  236    H2     A  21           H2         A  21  -1.084  -4.301  23.836
  237   1H2*    A  21          1H2*        A  21   4.032  -4.625  19.391
  238   2H2*    A  21          2H2*        A  21   4.018  -5.781  20.722
  239   1H5*    A  22          1H5*        A  22   5.119  -5.741  24.453
  240   2H5*    A  22          2H5*        A  22   6.022  -7.207  24.833
  241    H4*    A  22           H4*        A  22   3.912  -7.163  25.956
  242    H3*    A  22           H3*        A  22   4.782  -9.422  24.625
  243    H1*    A  22           H1*        A  22   1.117  -8.190  24.614
  244    H8     A  22           H8         A  22   2.681  -7.618  21.102
  245   1H6     A  22          1H6         A  22  -3.138  -6.498  19.384
  246   2H6     A  22          2H6         A  22  -1.496  -6.634  18.856
  247    H2     A  22           H2         A  22  -3.105  -7.291  23.802
  248   1H2*    A  22          1H2*        A  22   3.245  -9.276  22.781
  249   2H2*    A  22          2H2*        A  22   2.243 -10.132  23.953
  250   1H5*    T  23          1H5*        T  23   1.092  -9.699  27.357
  251   2H5*    T  23          2H5*        T  23   1.205 -11.222  28.238
  252    H4*    T  23           H4*        T  23  -1.069 -10.629  27.858
  253    H3*    T  23           H3*        T  23  -0.134 -13.183  27.246
  254   1H2*    T  23          1H2*        T  23  -0.400 -13.021  24.876
  255   2H2*    T  23          2H2*        T  23  -2.057 -13.427  25.318
  256    H1*    T  23           H1*        T  23  -2.773 -11.200  25.222
  257    H3     T  23           H3         T  23  -3.317 -10.121  21.020
  258   1H5M    T  23          1H5M        T  23   1.311 -10.202  20.349
  259   2H5M    T  23          2H5M        T  23   1.115 -11.956  20.337
  260   3H5M    T  23          3H5M        T  23   1.905 -11.165  21.702
  261    H6     T  23           H6         T  23   0.507 -11.482  23.536
  262   1H5*    T  24          1H5*        T  24  -4.704 -12.384  27.372
  263   2H5*    T  24          2H5*        T  24  -5.352 -13.751  28.278
  264    H4*    T  24           H4*        T  24  -6.942 -12.972  26.696
  265    H3*    T  24           H3*        T  24  -6.394 -15.656  26.896
  266   1H2*    T  24          1H2*        T  24  -5.065 -15.818  24.885
  267   2H2*    T  24          2H2*        T  24  -6.683 -16.087  24.235
  268    H1*    T  24           H1*        T  24  -6.905 -13.876  23.504
  269    H3     T  24           H3         T  24  -4.603 -13.318  19.821
  270   1H5M    T  24          1H5M        T  24  -1.176 -15.003  23.606
  271   2H5M    T  24          2H5M        T  24  -0.625 -13.833  22.406
  272   3H5M    T  24          3H5M        T  24  -0.959 -15.498  21.925
  273    H6     T  24           H6         T  24  -3.366 -14.655  24.235
  274   1H5*    A  25          1H5*        A  25  -9.710 -14.447  23.895
  275   2H5*    A  25          2H5*        A  25 -11.050 -15.497  24.358
  276    H4*    A  25           H4*        A  25 -11.215 -15.102  22.066
  277    H3*    A  25           H3*        A  25 -11.147 -17.725  22.910
  278    H1*    A  25           H1*        A  25  -9.357 -16.467  19.724
  279    H8     A  25           H8         A  25  -6.734 -17.491  22.385
  280   1H6     A  25          1H6         A  25  -2.646 -16.468  17.879
  281   2H6     A  25          2H6         A  25  -2.869 -17.015  19.505
  282    H2     A  25           H2         A  25  -6.720 -15.355  16.359
  283   1H2*    A  25          1H2*        A  25  -8.919 -18.212  22.139
  284   2H2*    A  25          2H2*        A  25  -9.843 -18.550  20.675
  285   1H5*    G  26          1H5*        G  26 -12.856 -16.726  18.685
  286   2H5*    G  26          2H5*        G  26 -14.190 -17.855  18.451
  287    H4*    G  26           H4*        G  26 -13.225 -17.203  16.372
  288    H3*    G  26           H3*        G  26 -13.875 -19.791  16.813
  289    H1*    G  26           H1*        G  26 -10.446 -18.940  15.270
  290    H8     G  26           H8         G  26  -9.957 -19.994  18.974
  291    H1     G  26           H1         G  26  -4.655 -18.785  15.577
  292   1H2     G  26          1H2         G  26  -5.191 -18.019  13.524
  293   2H2     G  26          2H2         G  26  -6.841 -17.840  13.089
  294   1H2*    G  26          1H2*        G  26 -11.658 -20.513  17.526
  295   2H2*    G  26          2H2*        G  26 -11.628 -20.875  15.800
  296   1H5*    G  27          1H5*        G  27 -12.697 -19.003  12.076
  297   2H5*    G  27          2H5*        G  27 -13.666 -20.284  11.349
  298    H4*    G  27           H4*        G  27 -11.769 -20.116  10.092
  299    H3*    G  27           H3*        G  27 -11.617 -22.582  11.848
  300    H1*    G  27           H1*        G  27  -8.435 -20.506  10.976
  301    H8     G  27           H8         G  27 -10.593 -21.697  13.988
  302    H1     G  27           H1         G  27  -4.229 -22.128  14.634
  303   1H2     G  27          1H2         G  27  -3.198 -21.539  12.714
  304   2H2     G  27          2H2         G  27  -4.137 -21.064  11.359
  305   1H2*    G  27          1H2*        G  27  -9.418 -23.007  10.907
  306   2H2*    G  27          2H2*        G  27  -9.683 -21.868   9.587