NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
582275 2mh9 19530 cing 1-original 1 XPLOR/CNS distance NOE simple


assign ( resid    3  and name    HA  )  ( resid   3  and name   HG2#  )     2.855    1.055    1.055    !  3.910

assign ( resid    4  and name   HB#  )  ( resid   4  and name    HE#  )     2.150    0.350    0.350    !  2.500
assign ( resid    4  and name    HA  )  ( resid   4  and name    HG#  )     2.710    0.910    0.910    !  3.620
assign ( resid    4  and name   HB#  )  ( resid   4  and name    HG#  )     2.165    0.365    0.365    !  2.530
assign ( resid    4  and name    HA  )  ( resid   4  and name    HB#  )     2.300    0.500    0.500    !  2.800
assign ( resid    4  and name   HB#  )  ( resid   5  and name     HN  )     3.070    1.270    1.270    !  4.340
assign ( resid    4  and name    HN  )  ( resid   4  and name    HE#  )     3.650    1.850    1.850    !  5.500
assign ( resid    4  and name   HG#  )  ( resid   5  and name     HN  )     3.460    1.660    1.660    !  5.120
assign ( resid    4  and name    HN  )  ( resid   4  and name    HG#  )     3.650    1.850    1.850    !  5.500
assign ( resid    4  and name   HB#  )  ( resid   5  and name    HB#  )     3.275    1.475    1.475    !  4.750

assign ( resid    5  and name    HA  )  ( resid   6  and name    HD#  )     3.610    1.810    1.810    !  5.420
assign ( resid    5  and name    HA  )  ( resid   6  and name     HN  )     2.290    0.490    0.490    !  2.780
assign ( resid    5  and name    HN  )  ( resid   6  and name     HN  )     3.305    1.505    1.505    !  4.810
assign ( resid    5  and name    HN  )  ( resid   5  and name    HB#  )     2.695    0.895    0.895    !  3.590
assign ( resid    5  and name   HB#  )  ( resid   6  and name     HN  )     3.095    1.295    1.295    !  4.390

assign ( resid    6  and name    HA  )  ( resid   6  and name    HD#  )     2.825    1.025    1.025    !  3.850
assign ( resid    6  and name    HN  )  ( resid   6  and name    HD#  )     3.150    1.350    1.350    !  4.500
assign ( resid    6  and name   HB1  )  ( resid   7  and name     HN  )     3.140    1.340    1.340    !  4.480
assign ( resid    6  and name   HB2  )  ( resid   7  and name     HN  )     3.140    1.340    1.340    !  4.480
assign ( resid    6  and name    HN  )  ( resid   6  and name    HB2  )     2.820    1.020    1.020    !  3.840
assign ( resid    6  and name    HN  )  ( resid   6  and name    HB1  )     2.820    1.020    1.020    !  3.840
assign ( resid    6  and name    HN  )  ( resid   7  and name     HN  )     3.375    1.575    1.575    !  4.950
assign ( resid    6  and name    HN  )  ( resid   6  and name    HB#  )     2.530    0.730    0.730    !  3.260
assign ( resid    6  and name    HA  )  ( resid   6  and name    HB#  )     2.190    0.390    0.390    !  2.580
assign ( resid    6  and name   HB#  )  ( resid   7  and name     HN  )     2.810    1.010    1.010    !  3.820

assign ( resid    7  and name    HA  )  ( resid   7  and name    HB#  )     2.410    0.610    0.610    !  3.020
assign ( resid    7  and name   HB#  )  ( resid   7  and name    HG#  )     2.260    0.460    0.460    !  2.720
assign ( resid    7  and name    HA  )  ( resid   7  and name    HG#  )     2.475    0.675    0.675    !  3.150
assign ( resid    7  and name    HA  )  ( resid   8  and name     HN  )     2.415    0.615    0.615    !  3.030
assign ( resid    7  and name   HB#  )  ( resid   8  and name     HN  )     2.815    1.015    1.015    !  3.830
assign ( resid    7  and name   HG#  )  ( resid   8  and name     HN  )     3.350    1.550    1.550    !  4.900
assign ( resid    7  and name    HN  )  ( resid   8  and name     HN  )     3.450    1.650    1.650    !  5.100

assign ( resid    8  and name  HG2#  )  ( resid  10  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid    8  and name    HA  )  ( resid   9  and name    HG#  )     3.650    1.850    1.850    !  5.500
assign ( resid    8  and name  HG2#  )  ( resid   9  and name     HN  )     2.695    0.895    0.895    !  3.590
assign ( resid    8  and name  HG2#  )  ( resid   9  and name    HB#  )     2.655    0.855    0.855    !  3.510
assign ( resid    8  and name  HG2#  )  ( resid   9  and name     HA  )     3.190    1.390    1.390    !  4.580
assign ( resid    8  and name    HA  )  ( resid   8  and name   HG2#  )     2.670    0.870    0.870    !  3.540
assign ( resid    8  and name  HG2#  )  ( resid  10  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid    8  and name    HN  )  ( resid   8  and name   HG2#  )     2.910    1.110    1.110    !  4.020
assign ( resid    8  and name    HB  )  ( resid   9  and name     HN  )     2.850    1.050    1.050    !  3.900
assign ( resid    8  and name    HN  )  ( resid   9  and name     HN  )     3.235    1.435    1.435    !  4.670
assign ( resid    8  and name    HN  )  ( resid   8  and name     HB  )     2.790    0.990    0.990    !  3.780
assign ( resid    8  and name    HA  )  ( resid   9  and name     HN  )     2.455    0.655    0.655    !  3.110
assign ( resid    8  and name  HG2#  )  ( resid   9  and name    HD#  )     3.550    1.750    1.750    !  5.300

assign ( resid    9  and name    HA  )  ( resid   9  and name    HG#  )     2.510    0.710    0.710    !  3.220
assign ( resid    9  and name   HB#  )  ( resid   9  and name    HD2  )     2.385    0.585    0.585    !  2.970
assign ( resid    9  and name   HB#  )  ( resid   9  and name    HD1  )     2.385    0.585    0.585    !  2.970
assign ( resid    9  and name    HA  )  ( resid  10  and name     HN  )     2.445    0.645    0.645    !  3.090
assign ( resid    9  and name    HN  )  ( resid   9  and name    HG#  )     2.840    1.040    1.040    !  3.880
assign ( resid    9  and name   HB#  )  ( resid  10  and name     HN  )     2.830    1.030    1.030    !  3.860
assign ( resid    9  and name   HG#  )  ( resid  10  and name     HN  )     3.015    1.215    1.215    !  4.230
assign ( resid    9  and name    HN  )  ( resid   9  and name    HB#  )     2.700    0.900    0.900    !  3.600
assign ( resid    9  and name   HB#  )  ( resid   9  and name    HD#  )     2.190    0.390    0.390    !  2.580

assign ( resid   10  and name    HA  )  ( resid  122  and name     HA )     3.075    1.275    1.275    !  4.350
assign ( resid   10  and name    HA  )  ( resid  11  and name   HG1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   10  and name    HA  )  ( resid  11  and name   HG2#  )     3.650    1.850    1.850    !  5.500
assign ( resid   10  and name    HA  )  ( resid  122  and name    HB# )     3.340    1.540    1.540    !  4.880
assign ( resid   10  and name   HB2  )  ( resid  11  and name     HN  )     3.090    1.290    1.290    !  4.380
assign ( resid   10  and name   HB1  )  ( resid  12  and name     HN  )     3.470    1.670    1.670    !  5.140
assign ( resid   10  and name   HB2  )  ( resid  12  and name     HN  )     3.470    1.670    1.670    !  5.140
assign ( resid   10  and name    HN  )  ( resid  122  and name     HA )     3.650    1.850    1.850    !  5.500
assign ( resid   10  and name   HB1  )  ( resid  11  and name     HN  )     3.090    1.290    1.290    !  4.380
assign ( resid   10  and name    HA  )  ( resid  11  and name     HN  )     2.595    0.795    0.795    !  3.390
assign ( resid   10  and name    HN  )  ( resid  10  and name    HB#  )     2.285    0.485    0.485    !  2.770
assign ( resid   10  and name    HN  )  ( resid  11  and name   HG2#  )     3.620    1.820    1.820    !  5.440
assign ( resid   10  and name    HA  )  ( resid  11  and name   HG2#  )     3.160    1.360    1.360    !  4.520
assign ( resid   10  and name   HB#  )  ( resid  11  and name     HA  )     3.505    1.705    1.705    !  5.210
assign ( resid   10  and name   HB#  )  ( resid  12  and name     HN  )     3.100    1.300    1.300    !  4.400
assign ( resid   10  and name   HB#  )  ( resid  12  and name   HG2#  )     2.600    0.800    0.800    !  3.400
assign ( resid   10  and name   HB#  )  ( resid  122  and name     HA )     3.225    1.425    1.425    !  4.650

assign ( resid   11  and name  HG2#  )  ( resid  122  and name     HA )     3.280    1.480    1.480    !  4.760
assign ( resid   11  and name  HG1#  )  ( resid  122  and name     HA )     3.280    1.480    1.480    !  4.760
assign ( resid   11  and name  HG1#  )  ( resid  123  and name     HA )     3.380    1.580    1.580    !  4.960
assign ( resid   11  and name    HA  )  ( resid  11  and name   HG1#  )     2.865    1.065    1.065    !  3.930
assign ( resid   11  and name  HG2#  )  ( resid  123  and name    HB2 )     3.355    1.555    1.555    !  4.910
assign ( resid   11  and name    HA  )  ( resid  11  and name   HG2#  )     2.865    1.065    1.065    !  3.930
assign ( resid   11  and name  HG2#  )  ( resid  123  and name    HB1 )     3.355    1.555    1.555    !  4.910
assign ( resid   11  and name  HG1#  )  ( resid  123  and name    HB1 )     3.355    1.555    1.555    !  4.910
assign ( resid   11  and name  HG1#  )  ( resid  123  and name    HB2 )     3.355    1.555    1.555    !  4.910
assign ( resid   11  and name  HG2#  )  ( resid  123  and name    HD# )     3.390    1.590    1.590    !  4.980
 
assign ( resid   11  and name    HB  )  ( resid  79  and name   HD1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   11  and name    HB  )  ( resid  79  and name   HD2#  )     3.650    1.850    1.850    !  5.500
 
assign ( resid   11  and name  HG2#  )  ( resid  123  and name     HA )     3.380    1.580    1.580    !  4.960
assign ( resid   11  and name    HN  )  ( resid  122  and name    HB# )     3.170    1.370    1.370    !  4.540
assign ( resid   11  and name    HB  )  ( resid  15  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   11  and name    HA  )  ( resid  14  and name     HN  )     2.795    0.995    0.995    !  3.790
assign ( resid   11  and name  HG2#  )  ( resid  123  and name     HN )     3.045    1.245    1.245    !  4.290
assign ( resid   11  and name  HG2#  )  ( resid  12  and name     HN  )     3.215    1.415    1.415    !  4.630
assign ( resid   11  and name    HN  )  ( resid  122  and name     HA )     2.990    1.190    1.190    !  4.180
assign ( resid   11  and name  HG1#  )  ( resid  123  and name     HN )     3.045    1.245    1.245    !  4.290
assign ( resid   11  and name  HG1#  )  ( resid  12  and name     HN  )     3.215    1.415    1.415    !  4.630
assign ( resid   11  and name    HN  )  ( resid  123  and name     HN )     3.170    1.370    1.370    !  4.540
assign ( resid   11  and name  HG1#  )  ( resid  123  and name    HD# )     3.390    1.590    1.590    !  4.980
assign ( resid   11  and name    HN  )  ( resid  11  and name   HG2#  )     2.690    0.890    0.890    !  3.580
assign ( resid   11  and name    HA  )  ( resid  14  and name    HB#  )     3.570    1.770    1.770    !  5.340
assign ( resid   11  and name    HA  )  ( resid  15  and name    HG#  )     3.620    1.820    1.820    !  5.440
assign ( resid   11  and name    HB  )  ( resid  15  and name    HG#  )     3.620    1.820    1.820    !  5.440
assign ( resid   11  and name    HB  )  ( resid  121  and name   HG2# )     3.620    1.820    1.820    !  5.440
assign ( resid   11  and name  HG2#  )  ( resid  12  and name     HN  )     2.905    1.105    1.105    !  4.010
 
assign ( resid   11  and name  HG2#  )  ( resid  14  and name     HN  )     3.305    1.505    1.505    !  4.810
assign ( resid   11  and name  HG2#  )  ( resid  15  and name     HN  )     3.000    1.200    1.200    !  4.200
assign ( resid   11  and name  HG2#  )  ( resid  15  and name     HB  )     3.620    1.820    1.820    !  5.440
assign ( resid   11  and name  HG1#  )  ( resid  15  and name    HG#  )     2.525    0.725    0.725    !  3.250
assign ( resid   11  and name  HG1#  )  ( resid  79  and name   HD1#  )     2.660    0.860    0.860    !  3.520
assign ( resid   11  and name  HG2#  )  ( resid  121  and name     HB )     3.620    1.820    1.820    !  5.440
assign ( resid   11  and name  HG2#  )  ( resid  122  and name     HA )     2.830    1.030    1.030    !  3.860
assign ( resid   11  and name  HG2#  )  ( resid  123  and name     HN )     2.750    0.950    0.950    !  3.700
assign ( resid   11  and name  HG2#  )  ( resid  123  and name     HA )     2.895    1.095    1.095    !  3.990
assign ( resid   11  and name  HG2#  )  ( resid  123  and name    HB# )     2.600    0.800    0.800    !  3.400
assign ( resid   11  and name  HG2#  )  ( resid  123  and name    HD# )     3.060    1.260    1.260    !  4.320
 
  

assign ( resid   12  and name  HG2#  )  ( resid  120  and name     HA )     2.660    0.860    0.860    !  3.520
assign ( resid   12  and name  HG2#  )  ( resid  119  and name   HD2# )     3.300    1.500    1.500    !  4.800
assign ( resid   12  and name    HB  )  ( resid  15  and name     HB  )     3.075    1.275    1.275    !  4.350
assign ( resid   12  and name    HA  )  ( resid  12  and name   HG2#  )     2.765    0.965    0.965    !  3.730
assign ( resid   12  and name  HG2#  )  ( resid  119  and name   HD1# )     3.300    1.500    1.500    !  4.800
assign ( resid   12  and name  HG2#  )  ( resid  120  and name    HB2 )     2.100    0.300    0.300    !  2.400
assign ( resid   12  and name    HB  )  ( resid  15  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   12  and name    HB  )  ( resid  120  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   12  and name    HA  )  ( resid  14  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   12  and name  HG2#  )  ( resid  15  and name     HB  )     3.355    1.555    1.555    !  4.910
assign ( resid   12  and name  HG2#  )  ( resid  120  and name    HB1 )     2.100    0.300    0.300    !  2.400
assign ( resid   12  and name  HG2#  )  ( resid  120  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   12  and name  HG2#  )  ( resid  119  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   12  and name  HG2#  )  ( resid  16  and name    HE#  )     3.650    1.850    1.850    !  5.500
assign ( resid   12  and name    HN  )  ( resid  12  and name   HG2#  )     2.945    1.145    1.145    !  4.090
assign ( resid   12  and name  HG2#  )  ( resid  13  and name     HN  )     2.985    1.185    1.185    !  4.170
assign ( resid   12  and name  HG2#  )  ( resid  14  and name     HN  )     3.650    1.850    1.850    !  5.500
 
assign ( resid   12  and name    HB  )  ( resid  14  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   12  and name    HN  )  ( resid  12  and name    HG1  )     3.050    1.250    1.250    !  4.300
assign ( resid   12  and name    HB  )  ( resid  121  and name     HN )     3.395    1.595    1.595    !  4.990
assign ( resid   12  and name  HG2#  )  ( resid  121  and name     HN )     2.720    0.920    0.920    !  3.640
assign ( resid   12  and name  HG2#  )  ( resid  16  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   12  and name    HN  )  ( resid  15  and name     HN  )     3.540    1.740    1.740    !  5.280
assign ( resid   12  and name    HN  )  ( resid  12  and name     HB  )     2.960    1.160    1.160    !  4.120
assign ( resid   12  and name    HB  )  ( resid  13  and name     HN  )     3.400    1.600    1.600    !  5.000
assign ( resid   12  and name    HN  )  ( resid  120  and name    HB# )     3.570    1.770    1.770    !  5.340
assign ( resid   12  and name    HA  )  ( resid  121  and name   HG2# )     3.585    1.785    1.785    !  5.370
assign ( resid   12  and name    HB  )  ( resid  15  and name    HG#  )     3.375    1.575    1.575    !  4.950
assign ( resid   12  and name    HB  )  ( resid  120  and name    HB# )     3.180    1.380    1.380    !  4.560
assign ( resid   12  and name    HB  )  ( resid  121  and name   HG2# )     3.620    1.820    1.820    !  5.440
assign ( resid   12  and name  HG2#  )  ( resid  15  and name    HG#  )     3.105    1.305    1.305    !  4.410
assign ( resid   12  and name  HG2#  )  ( resid  121  and name   HG2# )     2.845    1.045    1.045    !  3.890

assign ( resid   13  and name    HA  )  ( resid  16  and name    HB1  )     2.965    1.165    1.165    !  4.130
assign ( resid   13  and name    HA  )  ( resid  16  and name    HB2  )     2.965    1.165    1.165    !  4.130
assign ( resid   13  and name    HA  )  ( resid  16  and name     HN  )     2.795    0.995    0.995    !  3.790
assign ( resid   13  and name   HB#  )  ( resid  15  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   13  and name    HN  )  ( resid  14  and name     HN  )     2.750    0.950    0.950    !  3.700
assign ( resid   13  and name   HB#  )  ( resid  14  and name     HN  )     2.585    0.785    0.785    !  3.370
assign ( resid   13  and name    HN  )  ( resid  13  and name    HB#  )     2.540    0.740    0.740    !  3.280
assign ( resid   13  and name    HA  )  ( resid  16  and name    HB#  )     2.565    0.765    0.765    !  3.330

assign ( resid   14  and name    HA  )  ( resid  17  and name     HN  )     3.360    1.560    1.560    !  4.920
assign ( resid   14  and name    HN  )  ( resid  14  and name     HA  )     2.350    0.550    0.550    !  2.900
assign ( resid   14  and name   HB1  )  ( resid  18  and name   HD1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   14  and name   HB2  )  ( resid  18  and name   HD1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   14  and name    HN  )  ( resid  14  and name    HB2  )     2.795    0.995    0.995    !  3.790
assign ( resid   14  and name    HN  )  ( resid  14  and name    HB1  )     2.795    0.995    0.995    !  3.790
assign ( resid   14  and name    HN  )  ( resid  15  and name     HN  )     2.720    0.920    0.920    !  3.640
assign ( resid   14  and name    HN  )  ( resid  15  and name     HB  )     3.390    1.590    1.590    !  4.980
assign ( resid   14  and name    HN  )  ( resid  15  and name    HG#  )     3.030    1.230    1.230    !  4.260
assign ( resid   14  and name    HN  )  ( resid  16  and name    HB#  )     3.565    1.765    1.765    !  5.330
assign ( resid   14  and name   HB#  )  ( resid  15  and name     HN  )     2.530    0.730    0.730    !  3.260
assign ( resid   14  and name   HB1  )  ( resid  79  and name   HD1#  )     4.000    2.200    2.000    !  5.500 ! added (10/2)
assign ( resid   14  and name   HB2  )  ( resid  79  and name   HD1#  )     4.000    2.200    2.000    !  5.500 ! added (10/2) 

assign ( resid   15  and name    HA  )  ( resid  18  and name     HB  )     2.920    1.120    1.120    !  4.040
assign ( resid   15  and name    HA  )  ( resid  18  and name   HG2#  )     2.945    1.145    1.145    !  4.090
assign ( resid   15  and name    HA  )  ( resid  18  and name   HD1#  )     2.900    1.100    1.100    !  4.000
assign ( resid   15  and name    HN  )  ( resid  16  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid   15  and name    HA  )  ( resid  19  and name     HN  )     3.295    1.495    1.495    !  4.790
assign ( resid   15  and name    HA  )  ( resid  79  and name   HD1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   15  and name    HA  )  ( resid  79  and name   HD2#  )     3.650    1.850    1.850    !  5.500
assign ( resid   15  and name    HN  )  ( resid  15  and name     HB  )     2.720    0.920    0.920    !  3.640
assign ( resid   15  and name    HB  )  ( resid  16  and name     HN  )     2.860    1.060    1.060    !  3.920
assign ( resid   15  and name    HN  )  ( resid  16  and name     HN  )     2.850    1.050    1.050    !  3.900
assign ( resid   15  and name    HN  )  ( resid  17  and name     HN  )     3.415    1.615    1.615    !  5.030
assign ( resid   15  and name    HA  )  ( resid  18  and name     HN  )     2.955    1.155    1.155    !  4.110
assign ( resid   15  and name    HN  )  ( resid  18  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   15  and name    HN  )  ( resid  18  and name   HD1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   15  and name    HN  )  ( resid  15  and name    HG#  )     2.530    0.730    0.730    !  3.260
assign ( resid   15  and name    HN  )  ( resid  79  and name   HD1#  )     3.650    1.850    1.850    !  5.500 ! originally 5.44 (10/2), exist
assign ( resid   15  and name    HA  )  ( resid  18  and name   HG1#  )     3.570    1.770    1.770    !  5.340
assign ( resid   15  and name    HA  )  ( resid  83  and name   HD1#  )     3.620    1.820    1.820    !  5.440
assign ( resid   15  and name    HB  )  ( resid  79  and name   HD1#  )     3.650    1.850    1.850    !  5.500 ! originally 5.44 (10/2), originally HD1#
assign ( resid   15  and name    HB  )  ( resid  121  and name   HG2# )     3.005    1.205    1.205    !  4.210
assign ( resid   15  and name   HG#  )  ( resid  16  and name     HN  )     2.980    1.180    1.180    !  4.160
assign ( resid   15  and name   HG#  )  ( resid  18  and name   HD1#  )     3.035    1.235    1.235    !  4.270
assign ( resid   15  and name   HG#  )  ( resid  79  and name   HD1#  )     2.745    0.945    0.945    !  3.690
assign ( resid   15  and name   HG#  )  ( resid  83  and name   HD1#  )     2.690    0.890    0.890    !  3.580

assign ( resid   16  and name   HD#  )  ( resid  16  and name    HE#  )     2.325    0.525    0.525    !  2.850
assign ( resid   16  and name    HA  )  ( resid  19  and name     HB  )     2.595    0.795    0.795    !  3.390
assign ( resid   16  and name    HA  )  ( resid  20  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   16  and name    HA  )  ( resid  16  and name    HD#  )     2.845    1.045    1.045    !  3.890
assign ( resid   16  and name    HA  )  ( resid  16  and name    HE#  )     3.650    1.850    1.850    !  5.500
assign ( resid   16  and name    HA  )  ( resid  19  and name     HN  )     3.020    1.220    1.220    !  4.240
assign ( resid   16  and name    HN  )  ( resid  16  and name    HG#  )     2.995    1.195    1.195    !  4.190
assign ( resid   16  and name    HN  )  ( resid  16  and name    HB2  )     2.640    0.840    0.840    !  3.480
assign ( resid   16  and name    HN  )  ( resid  17  and name     HN  )     2.850    1.050    1.050    !  3.900
assign ( resid   16  and name   HB2  )  ( resid  17  and name     HN  )     2.840    1.040    1.040    !  3.880
assign ( resid   16  and name   HB1  )  ( resid  17  and name     HN  )     2.840    1.040    1.040    !  3.880
assign ( resid   16  and name   HG#  )  ( resid  17  and name     HN  )     3.580    1.780    1.780    !  5.360
assign ( resid   16  and name    HN  )  ( resid  16  and name    HB1  )     2.640    0.840    0.840    !  3.480
assign ( resid   16  and name    HN  )  ( resid  16  and name    HB#  )     2.355    0.555    0.555    !  2.910
assign ( resid   16  and name    HN  )  ( resid  19  and name   HG2#  )     3.260    1.460    1.460    !  4.720
assign ( resid   16  and name    HA  )  ( resid  19  and name   HG2#  )     2.525    0.725    0.725    !  3.250
assign ( resid   16  and name   HB#  )  ( resid  16  and name    HE#  )     3.315    1.515    1.515    !  4.830
assign ( resid   16  and name   HE#  )  ( resid  19  and name   HG2#  )     3.035    1.235    1.235    !  4.270

assign ( resid   17  and name    HN  )  ( resid  18  and name     HN  )     2.815    1.015    1.015    !  3.830
assign ( resid   17  and name    HN  )  ( resid  17  and name    HB#  )     2.590    0.790    0.790    !  3.380
assign ( resid   17  and name    HA  )  ( resid  20  and name     HN  )     3.245    1.445    1.445    !  4.690
assign ( resid   17  and name    HN  )  ( resid  19  and name     HN  )     3.260    1.460    1.460    !  4.720
assign ( resid   17  and name    HN  )  ( resid  20  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   17  and name   HB#  )  ( resid  18  and name     HN  )     3.120    1.320    1.320    !  4.440
assign ( resid   17  and name    HA  )  ( resid  21  and name     HN  )     3.650    1.850    1.850    !  5.500 ! added (10/1)

assign ( resid   18  and name  HD1#  )  ( resid  79  and name   HD1#  )     3.500    1.700    1.700    !  5.200
assign ( resid   18  and name    HA  )  ( resid  18  and name   HG2#  )     2.730    0.930    0.930    !  3.660
assign ( resid   18  and name  HG2#  )  ( resid  19  and name   HG1#  )     3.170    1.370    1.370    !  4.540
assign ( resid   18  and name    HA  )  ( resid  21  and name     HN  )     3.590    1.790    1.790    !  5.380
assign ( resid   18  and name  HD1#  )  ( resid  19  and name     HN  )     3.400    1.600    1.600    !  5.000
assign ( resid   18  and name  HD1#  )  ( resid  52  and name    HE#  )     3.250    1.450    1.450    !  4.700
assign ( resid   18  and name  HD1#  )  ( resid  80  and name    HE#  )     3.505    1.705    1.705    !  5.210
assign ( resid   18  and name    HB  )  ( resid  18  and name   HD1#  )     2.815    1.015    1.015    !  3.830
assign ( resid   18  and name  HG2#  )  ( resid  80  and name     HZ  )     3.650    1.850    1.850    !  5.500
assign ( resid   18  and name    HB  )  ( resid  19  and name     HA  )     3.465    1.665    1.665    !  5.130
assign ( resid   18  and name  HD1#  )  ( resid  52  and name    HD#  )     3.650    1.850    1.850    !  5.500
assign ( resid   18  and name  HD1#  )  ( resid  83  and name     HG  )     3.650    1.850    1.850    !  5.500
assign ( resid   18  and name  HG2#  )  ( resid  79  and name   HD1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   18  and name  HG2#  )  ( resid  79  and name   HD2#  )     3.650    1.850    1.850    !  5.500
assign ( resid   18  and name  HG2#  )  ( resid  19  and name   HG2#  )     3.170    1.370    1.370    !  4.540
assign ( resid   18  and name  HG12  )  ( resid  80  and name     HZ  )     3.650    1.850    1.850    !  5.500
assign ( resid   18  and name    HA  )  ( resid  52  and name    HD#  )     3.650    1.850    1.850    !  5.500
assign ( resid   18  and name  HG2#  )  ( resid  21  and name    HB#  )     3.105    1.305    1.305    !  4.410
assign ( resid   18  and name  HG2#  )  ( resid  19  and name     HB  )     3.185    1.385    1.385    !  4.570
assign ( resid   18  and name  HG2#  )  ( resid  19  and name     HA  )     2.945    1.145    1.145    !  4.090
assign ( resid   18  and name    HA  )  ( resid  18  and name   HD1#  )     3.165    1.365    1.365    !  4.530
assign ( resid   18  and name  HD1#  )  ( resid  79  and name   HD2#  )     3.500    1.700    1.700    !  5.200
assign ( resid   18  and name  HG2#  )  ( resid  18  and name   HD1#  )     2.380    0.580    0.580    !  2.960
assign ( resid   18  and name    HA  )  ( resid  64  and name   HD1#  )     2.730    0.930    0.930    !  3.660
assign ( resid   18  and name  HG2#  )  ( resid  19  and name     HN  )     2.870    1.070    1.070    !  3.940
assign ( resid   18  and name    HN  )  ( resid  18  and name   HG2#  )     2.755    0.955    0.955    !  3.710
assign ( resid   18  and name    HN  )  ( resid  19  and name     HB  )     3.395    1.595    1.595    !  4.990
assign ( resid   18  and name    HN  )  ( resid  19  and name     HN  )     2.910    1.110    1.110    !  4.020
assign ( resid   18  and name    HN  )  ( resid  18  and name     HB  )     2.590    0.790    0.790    !  3.380
assign ( resid   18  and name    HB  )  ( resid  19  and name     HN  )     2.750    0.950    0.950    !  3.700
assign ( resid   18  and name  HG2#  )  ( resid  22  and name     HN  )     3.250    1.450    1.450    !  4.700
assign ( resid   18  and name    HN  )  ( resid  18  and name   HD1#  )     3.030    1.230    1.230    !  4.260
assign ( resid   18  and name  HG2#  )  ( resid  20  and name     HN  )     3.430    1.630    1.630    !  5.060
assign ( resid   18  and name    HN  )  ( resid  20  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   18  and name  HD1#  )  ( resid  80  and name     HZ  )     3.095    1.295    1.295    !  4.390
assign ( resid   18  and name  HD1#  )  ( resid  80  and name    HE#  )     3.585    1.785    1.785    !  5.370
assign ( resid   18  and name  HG11  )  ( resid  80  and name     HZ  )     3.650    1.850    1.850    !  5.500
assign ( resid   18  and name    HN  )  ( resid  18  and name   HG1#  )     3.085    1.285    1.285    !  4.370
assign ( resid   18  and name    HN  )  ( resid  19  and name   HG2#  )     3.215    1.415    1.415    !  4.630
assign ( resid   18  and name  HG2#  )  ( resid  19  and name   HG2#  )     2.750    0.950    0.950    !  3.700
assign ( resid   18  and name  HG2#  )  ( resid  22  and name   HG2#  )     3.225    1.425    1.425    !  4.650
assign ( resid   18  and name  HG1#  )  ( resid  19  and name     HN  )     3.500    1.700    1.700    !  5.200
assign ( resid   18  and name  HG1#  )  ( resid  52  and name    HD#  )     3.230    1.430    1.430    !  4.660
assign ( resid   18  and name  HG1#  )  ( resid  64  and name   HD1#  )     2.850    1.050    1.050    !  3.900
assign ( resid   18  and name  HD1#  )  ( resid  22  and name   HG2#  )     3.620    1.820    1.820    !  5.440
assign ( resid   18  and name  HD1#  )  ( resid  79  and name   HD1#  )     3.050    1.250    1.250    !  4.300
assign ( resid   18  and name  HD1#  )  ( resid  83  and name   HD1#  )     3.025    1.225    1.225    !  4.250
assign ( resid   18  and name    HA  )  ( resid  22  and name     HN  )     3.650    1.850    1.850    !  5.500 ! added (10/1)

assign ( resid   19  and name    HA  )  ( resid  22  and name     HN  )     3.095    1.295    1.295    !  4.390
assign ( resid   19  and name    HA  )  ( resid  20  and name    HB#  )     3.610    1.810    1.810    !  5.420
assign ( resid   19  and name    HN  )  ( resid  19  and name     HB  )     2.670    0.870    0.870    !  3.540
assign ( resid   19  and name    HN  )  ( resid  20  and name     HN  )     2.805    1.005    1.005    !  3.810
assign ( resid   19  and name    HA  )  ( resid  23  and name     HN  )     3.615    1.815    1.815    !  5.430
assign ( resid   19  and name    HB  )  ( resid  20  and name     HN  )     2.785    0.985    0.985    !  3.770
assign ( resid   19  and name    HN  )  ( resid  21  and name     HN  )     3.360    1.560    1.560    !  4.920
assign ( resid   19  and name    HN  )  ( resid  20  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid   19  and name    HN  )  ( resid  19  and name   HG2#  )     2.370    0.570    0.570    !  2.940
assign ( resid   19  and name    HA  )  ( resid  22  and name   HG2#  )     2.805    1.005    1.005    !  3.810
assign ( resid   19  and name  HG2#  )  ( resid  20  and name     HN  )     2.885    1.085    1.085    !  3.970
assign ( resid   19  and name  HG2#  )  ( resid  20  and name     HA  )     3.650    1.850    1.850    !  5.500 originally 2.76 0.96 0.96 (08/23)
assign ( resid   19  and name  HG2#  )  ( resid  21  and name     HN  )     3.620    1.820    1.820    !  5.440
assign ( resid   19  and name  HG2#  )  ( resid  23  and name     HN  )     3.415    1.615    1.615    !  5.030

assign ( resid   20  and name   HG#  )  ( resid  21  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid   20  and name   HB#  )  ( resid  20  and name    HD#  )     2.725    0.925    0.925    !  3.650
assign ( resid   20  and name    HA  )  ( resid  23  and name    HB1  )     3.070    1.270    1.270    !  4.340
assign ( resid   20  and name   HB#  )  ( resid  21  and name    HD#  )     3.650    1.850    1.850    !  5.500
assign ( resid   20  and name    HA  )  ( resid  23  and name     HN  )     3.245    1.445    1.445    !  4.690
assign ( resid   20  and name    HN  )  ( resid  20  and name    HB#  )     2.230    0.430    0.430    !  2.660
assign ( resid   20  and name    HA  )  ( resid  20  and name    HD#  )     3.250    1.450    1.450    !  4.700
assign ( resid   20  and name    HA  )  ( resid  23  and name    HB2  )     3.070    1.270    1.270    !  4.340
assign ( resid   20  and name   HG#  )  ( resid  20  and name    HD#  )     2.100    0.300    0.300    !  2.400
assign ( resid   20  and name   HB#  )  ( resid  21  and name     HN  )     2.630    0.830    0.830    !  3.460
assign ( resid   20  and name   HB#  )  ( resid  22  and name     HN  )     3.500    1.700    1.700    !  5.200
assign ( resid   20  and name    HN  )  ( resid  21  and name     HA  )     3.630    1.830    1.830    !  5.460
assign ( resid   20  and name    HN  )  ( resid  21  and name     HN  )     2.845    1.045    1.045    !  3.890
assign ( resid   20  and name    HA  )  ( resid  23  and name    HB#  )     2.705    0.905    0.905    !  3.610

assign ( resid   21  and name   HD#  )  ( resid  64  and name   HD1#  )     3.115    1.315    1.315    !  4.430
assign ( resid   21  and name   HE#  )  ( resid  64  and name   HG2#  )     2.820    1.020    1.020    !  3.840
assign ( resid   21  and name   HD#  )  ( resid  64  and name   HG2#  )     2.705    0.905    0.905    !  3.610
assign ( resid   21  and name    HN  )  ( resid  64  and name   HG2#  )     3.650    1.850    1.850    !  5.500
assign ( resid   21  and name    HA  )  ( resid  21  and name    HD#  )     2.995    1.195    1.195    !  4.190
assign ( resid   21  and name   HD#  )  ( resid  22  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid   21  and name   HD#  )  ( resid  63  and name    HA2  )     3.490    1.690    1.690    !  5.180
assign ( resid   21  and name   HD#  )  ( resid  63  and name    HA1  )     3.490    1.690    1.690    !  5.180
assign ( resid   21  and name   HE#  )  ( resid  63  and name    HA2  )     3.650    1.850    1.850    !  5.500
assign ( resid   21  and name   HE#  )  ( resid  63  and name    HA1  )     3.650    1.850    1.850    !  5.500
assign ( resid   21  and name   HB#  )  ( resid  64  and name   HG2#  )     3.430    1.630    1.630    !  5.060
assign ( resid   21  and name    HA  )  ( resid  64  and name   HG2#  )     3.650    1.850    1.850    !  5.500
assign ( resid   21  and name   HB#  )  ( resid  64  and name   HD1#  )     2.955    1.155    1.155    !  4.110
assign ( resid   21  and name   HE#  )  ( resid  64  and name     HB  )     3.650    1.850    1.850    !  5.500
assign ( resid   21  and name   HD#  )  ( resid  22  and name     HN  )     3.285    1.485    1.485    !  4.770
assign ( resid   21  and name    HA  )  ( resid  24  and name     HN  )     3.165    1.365    1.365    !  4.530
assign ( resid   21  and name    HN  )  ( resid  21  and name    HD#  )     3.025    1.225    1.225    !  4.250
assign ( resid   21  and name    HN  )  ( resid  22  and name     HN  )     2.920    1.120    1.120    !  4.040
assign ( resid   21  and name    HN  )  ( resid  23  and name     HN  )     3.510    1.710    1.710    !  5.220
assign ( resid   21  and name   HB#  )  ( resid  23  and name     HN  )     3.260    1.460    1.460    !  4.720
assign ( resid   21  and name   HE#  )  ( resid  64  and name     HN  )     3.390    1.590    1.590    !  4.980
assign ( resid   21  and name    HN  )  ( resid  21  and name    HB#  )     2.515    0.715    0.715    !  3.230
assign ( resid   21  and name   HB#  )  ( resid  22  and name     HN  )     2.785    0.985    0.985    !  3.770
assign ( resid   21  and name    HN  )  ( resid  22  and name   HG2#  )     3.620    1.820    1.820    !  5.440
assign ( resid   21  and name    HA  )  ( resid  24  and name    HB#  )     3.255    1.455    1.455    !  4.710
assign ( resid   21  and name    HA  )  ( resid  24  and name    HG#  )     2.510    0.710    0.710    !  3.220
assign ( resid   21  and name    HA  )  ( resid  64  and name   HG1#  )     3.570    1.770    1.770    !  5.340
assign ( resid   21  and name   HB#  )  ( resid  64  and name   HG1#  )     3.360    1.560    1.560    !  4.920
assign ( resid   21  and name   HD#  )  ( resid  22  and name   HG2#  )     3.585    1.785    1.785    !  5.370
assign ( resid   21  and name   HD#  )  ( resid  63  and name    HA#  )     3.175    1.375    1.375    !  4.550
assign ( resid   21  and name   HE#  )  ( resid  63  and name    HA#  )     3.255    1.455    1.455    !  4.710

assign ( resid   22  and name    HA  )  ( resid  22  and name   HG2#  )     2.705    0.905    0.905    !  3.610
assign ( resid   22  and name    HA  )  ( resid  22  and name   HG1#  )     2.705    0.905    0.905    !  3.610
assign ( resid   22  and name    HA  )  ( resid  25  and name    HD2  )     3.650    1.850    1.850    !  5.500
assign ( resid   22  and name    HN  )  ( resid  22  and name   HG1#  )     2.825    1.025    1.025    !  3.850
assign ( resid   22  and name    HN  )  ( resid  22  and name   HG2#  )     2.825    1.025    1.025    !  3.850
assign ( resid   22  and name    HA  )  ( resid  25  and name     HN  )     3.100    1.300    1.300    !  4.400
assign ( resid   22  and name    HN  )  ( resid  22  and name     HB  )     2.710    0.910    0.910    !  3.620
assign ( resid   22  and name    HN  )  ( resid  22  and name   HG2#  )     2.540    0.740    0.740    !  3.280
assign ( resid   22  and name    HN  )  ( resid  23  and name    HB#  )     3.415    1.615    1.615    !  5.030
assign ( resid   22  and name    HA  )  ( resid  24  and name    HG#  )     3.570    1.770    1.770    !  5.340
assign ( resid   22  and name    HA  )  ( resid  25  and name    HB#  )     3.570    1.770    1.770    !  5.340
assign ( resid   22  and name  HG2#  )  ( resid  23  and name     HN  )     2.530    0.730    0.730    !  3.260
assign ( resid   22  and name  HG2#  )  ( resid  23  and name     HA  )     2.735    0.935    0.935    !  3.670
assign ( resid   22  and name  HG2#  )  ( resid  23  and name    HB#  )     3.005    1.205    1.205    !  4.210
assign ( resid   22  and name  HG2#  )  ( resid  24  and name     HN  )     3.230    1.430    1.430    !  4.660
assign ( resid   22  and name  HG2#  )  ( resid  25  and name     HN  )     3.320    1.520    1.520    !  4.840

assign ( resid   23  and name    HA  )  ( resid  23  and name    HG1  )     3.020    1.220    1.220    !  4.240
assign ( resid   23  and name    HA  )  ( resid  26  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   23  and name    HA  )  ( resid  23  and name    HG2  )     3.020    1.220    1.220    !  4.240
assign ( resid   23  and name    HN  )  ( resid  24  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid   23  and name    HN  )  ( resid  23  and name    HB2  )     2.635    0.835    0.835    !  3.470
assign ( resid   23  and name    HN  )  ( resid  24  and name     HN  )     2.915    1.115    1.115    !  4.030
assign ( resid   23  and name   HB2  )  ( resid  24  and name     HN  )     2.975    1.175    1.175    !  4.150
assign ( resid   23  and name    HN  )  ( resid  25  and name     HN  )     3.245    1.445    1.445    !  4.690
assign ( resid   23  and name    HN  )  ( resid  23  and name    HB1  )     2.635    0.835    0.835    !  3.470
assign ( resid   23  and name   HB1  )  ( resid  24  and name     HN  )     2.975    1.175    1.175    !  4.150
assign ( resid   23  and name    HA  )  ( resid  25  and name     HN  )     3.015    1.215    1.215    !  4.230
assign ( resid   23  and name    HN  )  ( resid  23  and name    HB#  )     2.375    0.575    0.575    !  2.950
assign ( resid   23  and name    HN  )  ( resid  24  and name    HG#  )     3.395    1.595    1.595    !  4.990
assign ( resid   23  and name    HA  )  ( resid  23  and name    HG#  )     2.625    0.825    0.825    !  3.450
assign ( resid   23  and name    HA  )  ( resid  23  and name   HE2#  )     2.935    1.135    1.135    !  4.070
assign ( resid   23  and name   HB#  )  ( resid  24  and name     HN  )     2.605    0.805    0.805    !  3.410
assign ( resid   23  and name   HB#  )  ( resid  24  and name     HA  )     3.455    1.655    1.655    !  5.110
assign ( resid   23  and name   HG#  )  ( resid  23  and name   HE2#  )     2.410    0.610    0.610    !  3.020

assign ( resid   24  and name    HN  )  ( resid  25  and name     HN  )     2.835    1.035    1.035    !  3.870
assign ( resid   24  and name    HN  )  ( resid  24  and name    HG1  )     2.850    1.050    1.050    !  3.900
assign ( resid   24  and name    HN  )  ( resid  24  and name    HG2  )     2.850    1.050    1.050    !  3.900
assign ( resid   24  and name    HN  )  ( resid  24  and name    HB#  )     2.515    0.715    0.715    !  3.230
assign ( resid   24  and name    HN  )  ( resid  24  and name    HG#  )     2.570    0.770    0.770    !  3.340
assign ( resid   24  and name    HA  )  ( resid  24  and name    HB#  )     2.195    0.395    0.395    !  2.590
assign ( resid   24  and name    HA  )  ( resid  24  and name    HG#  )     2.765    0.965    0.965    !  3.730
assign ( resid   24  and name   HB#  )  ( resid  25  and name     HN  )     2.845    1.045    1.045    !  3.890
assign ( resid   24  and name   HG#  )  ( resid  25  and name     HN  )     3.415    1.615    1.615    !  5.030

assign ( resid   25  and name   HB1  )  ( resid  26  and name     HN  )     3.140    1.340    1.340    !  4.480
assign ( resid   25  and name    HN  )  ( resid  25  and name    HB2  )     2.810    1.010    1.010    !  3.820
assign ( resid   25  and name    HN  )  ( resid  26  and name     HN  )     2.700    0.900    0.900    !  3.600
assign ( resid   25  and name    HA  )  ( resid  26  and name     HN  )     2.645    0.845    0.845    !  3.490
assign ( resid   25  and name    HN  )  ( resid  25  and name    HB1  )     2.810    1.010    1.010    !  3.820
assign ( resid   25  and name   HB2  )  ( resid  26  and name     HN  )     3.140    1.340    1.340    !  4.480
assign ( resid   25  and name    HN  )  ( resid  25  and name    HB#  )     2.560    0.760    0.760    !  3.320
assign ( resid   25  and name    HA  )  ( resid  25  and name    HB#  )     2.140    0.340    0.340    !  2.480

assign ( resid   26  and name    HN  )  ( resid  27  and name     HN  )     2.980    1.180    1.180    !  4.160
assign ( resid   26  and name   HB#  )  ( resid  27  and name     HN  )     2.945    1.145    1.145    !  4.090
assign ( resid   26  and name    HN  )  ( resid  26  and name    HB#  )     2.315    0.515    0.515    !  2.830

assign ( resid   27  and name    HA  )  ( resid  27  and name    HB#  )     2.100    0.300    0.300    !  2.400
assign ( resid   27  and name    HN  )  ( resid  27  and name    HB#  )     2.975    1.175    1.175    !  4.150

assign ( resid   29  and name    HA  )  ( resid  29  and name    HG#  )     2.780    0.980    0.980    !  3.760
assign ( resid   29  and name   HG#  )  ( resid  30  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   29  and name   HG#  )  ( resid  29  and name   HE21  )     2.100    0.300    0.300    !  2.400
assign ( resid   29  and name   HB#  )  ( resid  29  and name    HG#  )     2.055    0.255    0.255    !  2.310

assign ( resid   31  and name    HN  )  ( resid  31  and name    HG#  )     3.095    1.295    1.295    !  4.390

assign ( resid   33  and name   HB#  )  ( resid  34  and name     HN  )     2.845    1.045    1.045    !  3.890

assign ( resid   34  and name  HG2#  )  ( resid  61  and name    HG#  )     2.695    0.895    0.895    !  3.590
assign ( resid   34  and name    HA  )  ( resid  34  and name   HG2#  )     2.670    0.870    0.870    !  3.540
assign ( resid   34  and name    HB  )  ( resid  34  and name   HD1#  )     2.750    0.950    0.950    !  3.700
assign ( resid   34  and name  HD1#  )  ( resid  65  and name    HE#  )     2.880    1.080    1.080    !  3.960
assign ( resid   34  and name  HD1#  )  ( resid  65  and name     HZ  )     3.030    1.230    1.230    !  4.260
assign ( resid   34  and name    HB  )  ( resid  61  and name    HG#  )     2.925    1.125    1.125    !  4.050
assign ( resid   34  and name  HG2#  )  ( resid  35  and name     HN  )     2.910    1.110    1.110    !  4.020
assign ( resid   34  and name  HD1#  )  ( resid  65  and name    HD#  )     3.495    1.695    1.695    !  5.190
assign ( resid   34  and name    HN  )  ( resid  61  and name    HG#  )     3.505    1.705    1.705    !  5.210
assign ( resid   34  and name    HN  )  ( resid  34  and name   HG1#  )     3.140    1.340    1.340    !  4.480
assign ( resid   34  and name    HA  )  ( resid  34  and name   HG1#  )     2.450    0.650    0.650    !  3.100
assign ( resid   34  and name  HG1#  )  ( resid  61  and name    HB#  )     3.255    1.455    1.455    !  4.710

assign ( resid   35  and name    HN  )  ( resid  35  and name    HE#  )     3.650    1.850    1.850    !  5.500
assign ( resid   35  and name    HN  )  ( resid  35  and name    HB#  )     2.655    0.855    0.855    !  3.510
assign ( resid   35  and name    HN  )  ( resid  35  and name    HG#  )     3.650    1.850    1.850    !  5.500

assign ( resid   36  and name   HB#  )  ( resid  36  and name    HD2  )     2.450    0.650    0.650    !  3.100
assign ( resid   36  and name    HA  )  ( resid  37  and name     HA  )     3.310    1.510    1.510    !  4.820
assign ( resid   36  and name   HB#  )  ( resid  37  and name     HN  )     3.000    1.200    1.200    !  4.200
assign ( resid   36  and name    HA  )  ( resid  37  and name     HN  )     2.615    0.815    0.815    !  3.430

assign ( resid   37  and name    HA  )  ( resid  37  and name    HG#  )     2.360    0.560    0.560    !  2.920
assign ( resid   37  and name    HN  )  ( resid  37  and name    HG#  )     2.710    0.910    0.910    !  3.620
assign ( resid   37  and name    HB  )  ( resid  38  and name     HN  )     3.155    1.355    1.355    !  4.510
assign ( resid   37  and name    HA  )  ( resid  38  and name     HN  )     2.565    0.765    0.765    !  3.330
assign ( resid   37  and name    HN  )  ( resid  38  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   37  and name   HG#  )  ( resid  38  and name     HN  )     2.995    1.195    1.195    !  4.190
assign ( resid   37  and name    HN  )  ( resid  37  and name     HB  )     2.850    1.050    1.050    !  3.900

assign ( resid   38  and name    HN  )  ( resid  39  and name    HD#  )     3.130    1.330    1.330    !  4.460

assign ( resid   41  and name   HA#  )  ( resid  42  and name     HN  )     2.635    0.835    0.835    !  3.470

assign ( resid   42  and name    HA  )  ( resid  42  and name    HD#  )     2.840    1.040    1.040    !  3.880
assign ( resid   42  and name    HN  )  ( resid  43  and name    HE#  )     3.650    1.850    1.850    !  5.500
assign ( resid   42  and name    HN  )  ( resid  42  and name    HD#  )     3.245    1.445    1.445    !  4.690
assign ( resid   42  and name    HN  )  ( resid  43  and name     HN  )     3.010    1.210    1.210    !  4.220
 
assign ( resid   42  and name    HN  )  ( resid  42  and name    HG#  )     2.615    0.815    0.815    !  3.430
assign ( resid   42  and name    HA  )  ( resid  42  and name    HG#  )     2.690    0.890    0.890    !  3.580
assign ( resid   42  and name   HB#  )  ( resid  42  and name    HD#  )     2.690    0.890    0.890    !  3.580

assign ( resid   43  and name    HA  )  ( resid  47  and name    HB#  )     2.925    1.125    1.125    !  4.050
assign ( resid   43  and name    HA  )  ( resid  44  and name   HG2#  )     3.515    1.715    1.715    !  5.230
assign ( resid   43  and name    HA  )  ( resid  43  and name    HD#  )     3.040    1.240    1.240    !  4.280
assign ( resid   43  and name   HD#  )  ( resid  48  and name   HD2#  )     2.610    0.810    0.810    !  3.420
assign ( resid   43  and name    HA  )  ( resid  48  and name   HD1#  )     3.570    1.770    1.770    !  5.340
assign ( resid   43  and name    HA  )  ( resid  48  and name     HG  )     3.235    1.435    1.435    !  4.670
assign ( resid   43  and name    HA  )  ( resid  48  and name   HD2#  )     3.585    1.785    1.785    !  5.370
assign ( resid   43  and name   HB1  )  ( resid  48  and name   HD2#  )     3.225    1.425    1.425    !  4.650
assign ( resid   43  and name   HB2  )  ( resid  48  and name   HD2#  )     3.225    1.425    1.425    !  4.650
assign ( resid   43  and name    HA  )  ( resid  44  and name     HN  )     2.600    0.800    0.800    !  3.400
assign ( resid   43  and name    HN  )  ( resid  43  and name    HD#  )     3.095    1.295    1.295    !  4.390
assign ( resid   43  and name   HD#  )  ( resid  44  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   43  and name   HB2  )  ( resid  44  and name     HN  )     3.310    1.510    1.510    !  4.820
assign ( resid   43  and name   HB1  )  ( resid  44  and name     HN  )     3.310    1.510    1.510    !  4.820
assign ( resid   43  and name    HA  )  ( resid  47  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   43  and name    HN  )  ( resid  43  and name    HB#  )     2.710    0.910    0.910    !  3.620
assign ( resid   43  and name    HA  )  ( resid  105  and name   HG2# )     3.650    1.850    1.850    !  5.500 ! originally 5.44 (10/1)
assign ( resid   43  and name   HB#  )  ( resid  47  and name    HB#  )     3.570    1.770    1.770    !  5.340
assign ( resid   43  and name   HB#  )  ( resid  48  and name   HD2#  )     2.940    1.140    1.140    !  4.080

assign ( resid   44  and name  HG2#  )  ( resid  104  and name     HA )     3.185    1.385    1.385    !  4.570
assign ( resid   44  and name  HG2#  )  ( resid  102  and name   HG2# )     2.665    0.865    0.865    !  3.530
assign ( resid   44  and name    HB  )  ( resid  102  and name   HG2# )     3.555    1.755    1.755    !  5.310
assign ( resid   44  and name    HA  )  ( resid  44  and name   HG2#  )     2.880    1.080    1.080    !  3.960
assign ( resid   44  and name    HA  )  ( resid  44  and name     HB  )     2.210    0.410    0.410    !  2.620
assign ( resid   44  and name  HG2#  )  ( resid  47  and name    HB#  )     3.060    1.260    1.260    !  4.320
assign ( resid   44  and name  HG2#  )  ( resid  102  and name   HD1# )     3.200    1.400    1.400    !  4.600
assign ( resid   44  and name    HA  )  ( resid  105  and name     HB )     2.905    1.105    1.105    !  4.010
assign ( resid   44  and name    HA  )  ( resid  105  and name     HN )     3.275    1.475    1.475    !  4.750
assign ( resid   44  and name  HG2#  )  ( resid  104  and name    HB# )     2.600    0.800    0.800    !  3.400
assign ( resid   44  and name  HG2#  )  ( resid  104  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   44  and name  HG2#  )  ( resid  105  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   44  and name    HB  )  ( resid  45  and name     HN  )     2.605    0.805    0.805    !  3.410
assign ( resid   44  and name  HG2#  )  ( resid  47  and name     HN  )     3.460    1.660    1.660    !  5.120
assign ( resid   44  and name    HN  )  ( resid  47  and name    HB#  )     2.650    0.850    0.850    !  3.500
assign ( resid   44  and name    HN  )  ( resid  47  and name     HN  )     2.990    1.190    1.190    !  4.180
assign ( resid   44  and name  HG2#  )  ( resid  45  and name     HN  )     2.940    1.140    1.140    !  4.080
assign ( resid   44  and name  HG2#  )  ( resid  46  and name     HN  )     3.290    1.490    1.490    !  4.780
assign ( resid   44  and name    HN  )  ( resid  104  and name    HB# )     3.585    1.785    1.785    !  5.370
assign ( resid   44  and name    HN  )  ( resid  44  and name   HG2#  )     2.750    0.950    0.950    !  3.700
assign ( resid   44  and name    HN  )  ( resid  48  and name     HG  )     3.650    1.850    1.850    !  5.500
assign ( resid   44  and name    HN  )  ( resid  104  and name    HD# )     3.650    1.850    1.850    !  5.500
assign ( resid   44  and name  HG2#  )  ( resid  104  and name    HD# )     2.890    1.090    1.090    !  3.980
assign ( resid   44  and name  HG2#  )  ( resid  104  and name    HE# )     3.265    1.465    1.465    !  4.730
assign ( resid   44  and name    HA  )  ( resid  105  and name   HG2# )     3.075    1.275    1.275    !  4.350
assign ( resid   44  and name    HA  )  ( resid  47  and name     HN  )     3.650    1.850    1.850    !  5.500 (added 9/4)

assign ( resid   45  and name    HA  )  ( resid  105  and name     HB )     2.880    1.080    1.080    !  3.960
assign ( resid   45  and name    HA  )  ( resid  48  and name   HD1#  )     2.955    1.155    1.155    !  4.110
assign ( resid   45  and name    HA  )  ( resid  48  and name    HB2  )     3.300    1.500    1.500    !  4.800
assign ( resid   45  and name    HA  )  ( resid  48  and name   HD2#  )     3.600    1.800    1.800    !  5.400
assign ( resid   45  and name   HG#  )  ( resid  46  and name   HD22  )     3.650    1.850    1.850    !  5.500
assign ( resid   45  and name   HG#  )  ( resid  46  and name     HA  )     3.025    1.225    1.225    !  4.250
assign ( resid   45  and name   HB#  )  ( resid  80  and name    HB1  )     3.135    1.335    1.335    !  4.470
assign ( resid   45  and name    HA  )  ( resid  48  and name     HN  )     3.395    1.595    1.595    !  4.990
assign ( resid   45  and name    HA  )  ( resid  49  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   45  and name    HA  )  ( resid  48  and name     HG  )     3.500    1.700    1.700    !  5.200
assign ( resid   45  and name   HB#  )  ( resid  48  and name   HD1#  )     2.925    1.125    1.125    !  4.050
assign ( resid   45  and name   HG#  )  ( resid  48  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   45  and name    HA  )  ( resid  47  and name     HN  )     3.390    1.590    1.590    !  4.980
assign ( resid   45  and name    HN  )  ( resid  46  and name     HN  )     3.010    1.210    1.210    !  4.220
assign ( resid   45  and name   HG#  )  ( resid  46  and name     HN  )     2.570    0.770    0.770    !  3.340
assign ( resid   45  and name    HN  )  ( resid  105  and name     HB )     2.930    1.130    1.130    !  4.060
assign ( resid   45  and name    HN  )  ( resid  46  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid   45  and name    HN  )  ( resid  48  and name    HB2  )     3.650    1.850    1.850    !  5.500
assign ( resid   45  and name    HN  )  ( resid  48  and name   HD1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   45  and name   HG#  )  ( resid  46  and name   HD21  )     3.650    1.850    1.850    !  5.500
assign ( resid   45  and name    HA  )  ( resid  80  and name    HE#  )     3.650    1.850    1.850    !  5.500
assign ( resid   45  and name   HB#  )  ( resid  80  and name    HD#  )     2.975    1.175    1.175    !  4.150
assign ( resid   45  and name    HN  )  ( resid  105  and name   HG2# )     2.915    1.115    1.115    !  4.030
assign ( resid   45  and name    HA  )  ( resid  49  and name   HG2#  )     3.620    1.820    1.820    !  5.440
assign ( resid   45  and name    HA  )  ( resid  105  and name   HG2# )     2.415    0.615    0.615    !  3.030
assign ( resid   45  and name   HB#  )  ( resid  49  and name   HG2#  )     3.300    1.500    1.500    !  4.800

assign ( resid   46  and name    HA  )  ( resid  49  and name     HB  )     3.130    1.330    1.330    !  4.460
assign ( resid   46  and name    HN  )  ( resid  47  and name     HN  )     2.965    1.165    1.165    !  4.130
assign ( resid   46  and name    HN  )  ( resid  48  and name     HG  )     3.650    1.850    1.850    !  5.500
assign ( resid   46  and name    HN  )  ( resid  46  and name    HB2  )     2.725    0.925    0.925    !  3.650
assign ( resid   46  and name    HN  )  ( resid  46  and name    HB1  )     2.725    0.925    0.925    !  3.650
assign ( resid   46  and name    HA  )  ( resid  49  and name     HN  )     2.710    0.910    0.910    !  3.620
assign ( resid   46  and name    HN  )  ( resid  49  and name   HG2#  )     3.620    1.820    1.820    !  5.440
assign ( resid   46  and name    HN  )  ( resid  105  and name   HG2# )     3.620    1.820    1.820    !  5.440
assign ( resid   46  and name    HA  )  ( resid  49  and name   HG2#  )     3.080    1.280    1.280    !  4.360
assign ( resid   46  and name   HB#  )  ( resid  47  and name     HN  )     2.750    0.950    0.950    !  3.700
assign ( resid   46  and name   HB#  )  ( resid  49  and name   HG2#  )     3.540    1.740    1.740    !  5.280

assign ( resid   47  and name   HB#  )  ( resid  47  and name    HE#  )     2.905    1.105    1.105    !  4.010
assign ( resid   47  and name    HN  )  ( resid  48  and name   HD2#  )     3.315    1.515    1.515    !  4.830
assign ( resid   47  and name    HN  )  ( resid  47  and name    HE#  )     3.300    1.500    1.500    !  4.800
assign ( resid   47  and name    HN  )  ( resid  47  and name    HB#  )     2.605    0.805    0.805    !  3.410
assign ( resid   47  and name   HB#  )  ( resid  48  and name     HN  )     3.095    1.295    1.295    !  4.390
assign ( resid   47  and name    HN  )  ( resid  48  and name     HG  )     3.250    1.450    1.450    !  4.700
assign ( resid   47  and name    HA  )  ( resid  50  and name     HN  )     3.650    1.850    1.850    !  5.500 ! added (10/1)

assign ( resid   48  and name    HG  )  ( resid  105  and name     HB )     2.985    1.185    1.185    !  4.170
assign ( resid   48  and name    HG  )  ( resid  105  and name   HG1# )     3.410    1.610    1.610    !  5.020
assign ( resid   48  and name    HG  )  ( resid  105  and name   HG2# )     3.410    1.610    1.610    !  5.020
assign ( resid   48  and name   HB2  )  ( resid  48  and name   HD2#  )     2.920    1.120    1.120    !  4.040
assign ( resid   48  and name    HA  )  ( resid  51  and name   HD1#  )     2.955    1.155    1.155    !  4.110
assign ( resid   48  and name   HB2  )  ( resid  48  and name   HD1#  )     2.220    0.420    0.420    !  2.640
assign ( resid   48  and name    HA  )  ( resid  48  and name   HD2#  )     2.325    0.525    0.525    !  2.850
assign ( resid   48  and name   HB1  )  ( resid  48  and name   HD2#  )     2.915    1.115    1.115    !  4.030
assign ( resid   48  and name   HB1  )  ( resid  48  and name   HD1#  )     2.870    1.070    1.070    !  3.940
assign ( resid   48  and name    HN  )  ( resid  48  and name   HD2#  )     2.465    0.665    0.665    !  3.130
assign ( resid   48  and name   HB1  )  ( resid  49  and name     HN  )     3.290    1.490    1.490    !  4.780
assign ( resid   48  and name    HA  )  ( resid  51  and name     HB  )     2.880    1.080    1.080    !  3.960
assign ( resid   48  and name    HA  )  ( resid  48  and name   HD1#  )     2.915    1.115    1.115    !  4.030
assign ( resid   48  and name    HN  )  ( resid  48  and name     HG  )     2.705    0.905    0.905    !  3.610
assign ( resid   48  and name    HN  )  ( resid  48  and name    HB1  )     2.780    0.980    0.980    !  3.760
assign ( resid   48  and name    HN  )  ( resid  49  and name     HB  )     3.650    1.850    1.850    !  5.500
assign ( resid   48  and name   HB2  )  ( resid  49  and name     HN  )     3.015    1.215    1.215    !  4.230
assign ( resid   48  and name   HB2  )  ( resid  50  and name     HN  )     3.535    1.735    1.735    !  5.270
assign ( resid   48  and name    HN  )  ( resid  48  and name    HB2  )     2.690    0.890    0.890    !  3.580
assign ( resid   48  and name    HN  )  ( resid  48  and name   HD1#  )     2.850    1.050    1.050    !  3.900
assign ( resid   48  and name    HG  )  ( resid  49  and name     HN  )     3.110    1.310    1.310    !  4.420
assign ( resid   48  and name    HN  )  ( resid  49  and name     HN  )     2.720    0.920    0.920    !  3.640
assign ( resid   48  and name  HD1#  )  ( resid  80  and name    HE#  )     2.785    0.985    0.985    !  3.770
assign ( resid   48  and name   HB1  )  ( resid  80  and name     HZ  )     3.040    1.240    1.240    !  4.280
assign ( resid   48  and name   HB2  )  ( resid  80  and name     HZ  )     3.230    1.430    1.430    !  4.660
assign ( resid   48  and name   HB2  )  ( resid  49  and name   HG2#  )     3.200    1.400    1.400    !  4.600
assign ( resid   48  and name    HG  )  ( resid  105  and name   HG2# )     2.785    0.985    0.985    !  3.770
assign ( resid   48  and name  HD1#  )  ( resid  105  and name   HG2# )     2.590    0.790    0.790    !  3.380
assign ( resid   48  and name    HA  )  ( resid  51  and name     HN  )     3.650    1.850    1.850    !  5.500 ! added (10/1)
assign ( resid   48  and name    HA  )  ( resid  52  and name     HN  )     3.650    1.850    1.850    !  5.500 ! added (10/1)

assign ( resid   49  and name    HA  )  ( resid  49  and name   HG2#  )     2.855    1.055    1.055    !  3.910
assign ( resid   49  and name  HG2#  )  ( resid  76  and name    HB#  )     2.660    0.860    0.860    !  3.520
assign ( resid   49  and name    HA  )  ( resid  76  and name    HB#  )     3.195    1.395    1.395    !  4.590
assign ( resid   49  and name  HG2#  )  ( resid  77  and name    HG#  )     3.080    1.280    1.280    !  4.360
assign ( resid   49  and name    HA  )  ( resid  52  and name     HN  )     3.305    1.505    1.505    !  4.810
assign ( resid   49  and name    HA  )  ( resid  53  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   49  and name  HG1#  )  ( resid  77  and name    HG#  )     3.080    1.280    1.280    !  4.360
assign ( resid   49  and name  HG1#  )  ( resid  76  and name    HB#  )     2.660    0.860    0.860    !  3.520
assign ( resid   49  and name    HA  )  ( resid  49  and name   HG1#  )     2.855    1.055    1.055    !  3.910
assign ( resid   49  and name    HN  )  ( resid  49  and name   HG2#  )     2.495    0.695    0.695    !  3.190
assign ( resid   49  and name  HG1#  )  ( resid  50  and name     HN  )     3.095    1.295    1.295    !  4.390
assign ( resid   49  and name  HG1#  )  ( resid  77  and name     HN  )     3.440    1.640    1.640    !  5.080
assign ( resid   49  and name    HN  )  ( resid  49  and name   HG1#  )     2.495    0.695    0.695    !  3.190
assign ( resid   49  and name    HN  )  ( resid  49  and name     HB  )     2.730    0.930    0.930    !  3.660
assign ( resid   49  and name    HN  )  ( resid  50  and name     HN  )     2.785    0.985    0.985    !  3.770
assign ( resid   49  and name    HB  )  ( resid  50  and name     HN  )     2.900    1.100    1.100    !  4.000
assign ( resid   49  and name  HG2#  )  ( resid  50  and name     HN  )     3.095    1.295    1.295    !  4.390
assign ( resid   49  and name    HB  )  ( resid  52  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   49  and name    HA  )  ( resid  51  and name     HN  )     3.265    1.465    1.465    !  4.730
assign ( resid   49  and name  HG2#  )  ( resid  77  and name     HN  )     3.440    1.640    1.640    !  5.080
assign ( resid   49  and name    HA  )  ( resid  80  and name     HZ  )     3.615    1.815    1.815    !  5.430
assign ( resid   49  and name    HA  )  ( resid  80  and name    HE#  )     3.100    1.300    1.300    !  4.400
assign ( resid   49  and name    HN  )  ( resid  49  and name   HG2#  )     2.190    0.390    0.390    !  2.580
assign ( resid   49  and name    HN  )  ( resid  50  and name    HB#  )     3.285    1.485    1.485    !  4.770
assign ( resid   49  and name  HG2#  )  ( resid  50  and name     HN  )     2.675    0.875    0.875    !  3.550
assign ( resid   49  and name  HG2#  )  ( resid  76  and name     HN  )     3.620    1.820    1.820    !  5.440
assign ( resid   49  and name  HG2#  )  ( resid  76  and name     HA  )     3.275    1.475    1.475    !  4.750
assign ( resid   49  and name  HG2#  )  ( resid  76  and name    HB#  )     2.190    0.390    0.390    !  2.580
assign ( resid   49  and name  HG2#  )  ( resid  77  and name     HN  )     3.010    1.210    1.210    !  4.220
assign ( resid   49  and name  HG2#  )  ( resid  77  and name     HA  )     2.870    1.070    1.070    !  3.940
assign ( resid   49  and name  HG2#  )  ( resid  77  and name    HG#  )     2.790    0.990    0.990    !  3.780
assign ( resid   49  and name  HG2#  )  ( resid  78  and name     HN  )     3.620    1.820    1.820    !  5.440
assign ( resid   49  and name  HG2#  )  ( resid  80  and name    HB2  )     3.295    1.495    1.495    !  4.790
assign ( resid   49  and name  HG2#  )  ( resid  80  and name     HZ  )     2.975    1.175    1.175    !  4.150
assign ( resid   49  and name  HG2#  )  ( resid  80  and name    HE#  )     2.655    0.855    0.855    !  3.510
assign ( resid   49  and name  HG2#  )  ( resid  80  and name    HD#  )     2.575    0.775    0.775    !  3.350

assign ( resid   50  and name   HB1  )  ( resid  51  and name     HN  )     3.365    1.565    1.565    !  4.930
assign ( resid   50  and name   HB2  )  ( resid  51  and name     HN  )     3.365    1.565    1.565    !  4.930
assign ( resid   50  and name    HN  )  ( resid  50  and name     HA  )     2.345    0.545    0.545    !  2.890
assign ( resid   50  and name    HA  )  ( resid  52  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   50  and name    HN  )  ( resid  50  and name    HB1  )     2.710    0.910    0.910    !  3.620
assign ( resid   50  and name    HN  )  ( resid  50  and name    HB2  )     2.710    0.910    0.910    !  3.620
assign ( resid   50  and name   HB1  )  ( resid  58  and name     HN  )     3.640    1.840    1.840    !  5.480
assign ( resid   50  and name    HN  )  ( resid  51  and name     HB  )     3.615    1.815    1.815    !  5.430
assign ( resid   50  and name    HN  )  ( resid  58  and name    HB#  )     3.650    1.850    1.850    !  5.500
assign ( resid   50  and name    HA  )  ( resid  53  and name     HN  )     3.115    1.315    1.315    !  4.430
assign ( resid   50  and name   HB2  )  ( resid  58  and name     HN  )     3.640    1.840    1.840    !  5.480
assign ( resid   50  and name    HN  )  ( resid  50  and name    HB#  )     2.480    0.680    0.680    !  3.160
assign ( resid   50  and name    HN  )  ( resid  55  and name    HB#  )     3.385    1.585    1.585    !  4.970
assign ( resid   50  and name    HA  )  ( resid  53  and name   HD1#  )     3.620    1.820    1.820    !  5.440
assign ( resid   50  and name    HA  )  ( resid  55  and name    HB#  )     2.280    0.480    0.480    !  2.760
assign ( resid   50  and name   HB#  )  ( resid  51  and name   HD1#  )     3.215    1.415    1.415    !  4.630
assign ( resid   50  and name   HB#  )  ( resid  55  and name    HB#  )     2.750    0.950    0.950    !  3.700
assign ( resid   50  and name   HB#  )  ( resid  58  and name     HN  )     3.235    1.435    1.435    !  4.670
assign ( resid   50  and name   HB#  )  ( resid  58  and name    HB#  )     3.095    1.295    1.295    !  4.390

assign ( resid   51  and name    HA  )  ( resid  65  and name    HD#  )     3.060    1.260    1.260    !  4.320
assign ( resid   51  and name  HD1#  )  ( resid  65  and name    HE#  )     2.850    1.050    1.050    !  3.900
assign ( resid   51  and name  HD1#  )  ( resid  60  and name   HG2#  )     2.960    1.160    1.160    !  4.120
assign ( resid   51  and name    HB  )  ( resid  52  and name     HN  )     2.485    0.685    0.685    !  3.170
assign ( resid   51  and name    HB  )  ( resid  51  and name   HD1#  )     2.325    0.525    0.525    !  2.850
assign ( resid   51  and name  HG2#  )  ( resid  58  and name    HB#  )     2.815    1.015    1.015    !  3.830
assign ( resid   51  and name  HG2#  )  ( resid  65  and name    HE#  )     2.570    0.770    0.770    !  3.340
assign ( resid   51  and name    HN  )  ( resid  51  and name   HG2#  )     3.020    1.220    1.220    !  4.240
assign ( resid   51  and name  HG2#  )  ( resid  66  and name     HN  )     3.315    1.515    1.515    !  4.830
assign ( resid   51  and name  HG2#  )  ( resid  65  and name     HA  )     2.820    1.020    1.020    !  3.840
assign ( resid   51  and name    HA  )  ( resid  51  and name   HG2#  )     2.265    0.465    0.465    !  2.730
assign ( resid   51  and name  HG2#  )  ( resid  65  and name    HB2  )     3.285    1.485    1.485    !  4.770
assign ( resid   51  and name  HD1#  )  ( resid  65  and name    HD#  )     3.325    1.525    1.525    !  4.850
assign ( resid   51  and name  HG2#  )  ( resid  51  and name   HG12  )     2.900    1.100    1.100    !  4.000
assign ( resid   51  and name  HG2#  )  ( resid  51  and name   HG11  )     2.900    1.100    1.100    !  4.000
assign ( resid   51  and name  HG2#  )  ( resid  65  and name     HZ  )     3.650    1.850    1.850    !  5.500
assign ( resid   51  and name  HD1#  )  ( resid  60  and name     HB  )     3.650    1.850    1.850    !  5.500 originally 3.65 (08/27)
assign ( resid   51  and name    HA  )  ( resid  58  and name    HB#  )     2.690    0.890    0.890    !  3.580
assign ( resid   51  and name  HG2#  )  ( resid  52  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid   51  and name  HG2#  )  ( resid  58  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid   51  and name  HG2#  )  ( resid  52  and name     HN  )     2.720    0.920    0.920    !  3.640
assign ( resid   51  and name    HN  )  ( resid  52  and name     HN  )     2.880    1.080    1.080    !  3.960
assign ( resid   51  and name    HN  )  ( resid  54  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   51  and name  HG2#  )  ( resid  54  and name     HN  )     3.260    1.460    1.460    !  4.720
assign ( resid   51  and name    HA  )  ( resid  60  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   51  and name  HD1#  )  ( resid  60  and name     HN  )     2.695    0.895    0.895    !  3.590
assign ( resid   51  and name    HN  )  ( resid  51  and name   HD1#  )     2.810    1.010    1.010    !  3.820
assign ( resid   51  and name  HG11  )  ( resid  52  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   51  and name  HG12  )  ( resid  52  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   51  and name  HG12  )  ( resid  60  and name     HN  )     2.965    1.165    1.165    !  4.130
assign ( resid   51  and name  HG11  )  ( resid  60  and name     HN  )     2.965    1.165    1.165    !  4.130
assign ( resid   51  and name  HG2#  )  ( resid  65  and name     HN  )     3.140    1.340    1.340    !  4.480
assign ( resid   51  and name    HN  )  ( resid  52  and name    HB#  )     3.445    1.645    1.645    !  5.090
assign ( resid   51  and name    HN  )  ( resid  51  and name     HB  )     2.665    0.865    0.865    !  3.530
assign ( resid   51  and name    HN  )  ( resid  55  and name     HN  )     3.625    1.825    1.825    !  5.450
assign ( resid   51  and name  HG2#  )  ( resid  65  and name    HD#  )     2.800    1.000    1.000    !  3.800
assign ( resid   51  and name    HN  )  ( resid  51  and name   HG1#  )     2.800    1.000    1.000    !  3.800
assign ( resid   51  and name    HN  )  ( resid  55  and name    HB#  )     3.570    1.770    1.770    !  5.340
assign ( resid   51  and name    HA  )  ( resid  51  and name   HG1#  )     2.625    0.825    0.825    !  3.450
assign ( resid   51  and name  HG2#  )  ( resid  51  and name   HG1#  )     2.475    0.675    0.675    !  3.150
assign ( resid   51  and name  HG1#  )  ( resid  52  and name     HN  )     3.260    1.460    1.460    !  4.720
assign ( resid   51  and name  HG1#  )  ( resid  58  and name     HN  )     3.490    1.690    1.690    !  5.180
assign ( resid   51  and name  HG1#  )  ( resid  58  and name    HB#  )     2.925    1.125    1.125    !  4.050
assign ( resid   51  and name  HG1#  )  ( resid  60  and name     HN  )     2.670    0.870    0.870    !  3.540
assign ( resid   51  and name  HG1#  )  ( resid  60  and name   HD1#  )     3.455    1.655    1.655    !  5.110

assign ( resid   52  and name    HA  )  ( resid  52  and name    HD#  )     2.900    1.100    1.100    !  4.000
assign ( resid   52  and name   HD#  )  ( resid  64  and name   HD1#  )     2.945    1.145    1.145    !  4.090
assign ( resid   52  and name   HE#  )  ( resid  64  and name   HD1#  )     2.990    1.190    1.190    !  4.180
assign ( resid   52  and name    HN  )  ( resid  64  and name   HD1#  )     3.590    1.790    1.790    !  5.380
assign ( resid   52  and name   HB#  )  ( resid  64  and name   HD1#  )     3.050    1.250    1.250    !  4.300
assign ( resid   52  and name   HD#  )  ( resid  64  and name   HG2#  )     3.075    1.275    1.275    !  4.350
assign ( resid   52  and name   HD#  )  ( resid  76  and name    HB#  )     3.045    1.245    1.245    !  4.290
assign ( resid   52  and name   HB#  )  ( resid  76  and name    HB#  )     3.320    1.520    1.520    !  4.840
assign ( resid   52  and name   HD#  )  ( resid  53  and name   HD2#  )     3.615    1.815    1.815    !  5.430
assign ( resid   52  and name   HE#  )  ( resid  76  and name    HB#  )     3.380    1.580    1.580    !  4.960
assign ( resid   52  and name   HD#  )  ( resid  64  and name     HB  )     3.650    1.850    1.850    !  5.500
assign ( resid   52  and name    HA  )  ( resid  64  and name   HD1#  )     2.975    1.175    1.175    !  4.150
assign ( resid   52  and name    HA  )  ( resid  68  and name     HN  )     3.475    1.675    1.675    !  5.150
assign ( resid   52  and name    HN  )  ( resid  53  and name     HN  )     3.015    1.215    1.215    !  4.230
assign ( resid   52  and name    HA  )  ( resid  66  and name     HN  )     3.450    1.650    1.650    !  5.100
assign ( resid   52  and name   HD#  )  ( resid  53  and name     HN  )     3.135    1.335    1.335    !  4.470
assign ( resid   52  and name    HN  )  ( resid  52  and name    HD#  )     3.085    1.285    1.285    !  4.370
assign ( resid   52  and name   HB#  )  ( resid  53  and name     HN  )     2.765    0.965    0.965    !  3.730
assign ( resid   52  and name    HA  )  ( resid  54  and name     HN  )     3.085    1.285    1.285    !  4.370
assign ( resid   52  and name   HE#  )  ( resid  68  and name     HN  )     3.615    1.815    1.815    !  5.430
assign ( resid   52  and name    HN  )  ( resid  52  and name    HB#  )     2.625    0.825    0.825    !  3.450
assign ( resid   52  and name   HB#  )  ( resid  80  and name     HZ  )     3.650    1.850    1.850    !  5.500
assign ( resid   52  and name   HD#  )  ( resid  67  and name    HB#  )     3.490    1.690    1.690    !  5.180
assign ( resid   52  and name   HD#  )  ( resid  53  and name   HD1#  )     3.615    1.815    1.815    !  5.430
assign ( resid   52  and name   HB#  )  ( resid  80  and name    HE#  )     3.320    1.520    1.520    !  4.840
assign ( resid   52  and name    HA  )  ( resid  53  and name   HD1#  )     3.620    1.820    1.820    !  5.440
assign ( resid   52  and name   HB#  )  ( resid  53  and name   HD1#  )     2.330    0.530    0.530    !  2.860
assign ( resid   52  and name   HD#  )  ( resid  53  and name   HD1#  )     3.220    1.420    1.420    !  4.640
assign ( resid   52  and name   HD#  )  ( resid  67  and name    HG#  )     3.570    1.770    1.770    !  5.340
assign ( resid   52  and name   HD#  )  ( resid  79  and name   HD1#  )     3.620    1.820    1.820    !  5.440
assign ( resid   52  and name   HE#  )  ( resid  53  and name   HD1#  )     3.555    1.755    1.755    !  5.310
assign ( resid   52  and name   HE#  )  ( resid  79  and name   HD1#  )     3.610    1.810    1.810    !  5.420

assign ( resid   53  and name    HA  )  ( resid  69  and name     HA  )     3.055    1.255    1.255    !  4.310
assign ( resid   53  and name    HA  )  ( resid  53  and name   HD2#  )     2.790    0.990    0.990    !  3.780
assign ( resid   53  and name  HD2#  )  ( resid  76  and name    HB#  )     2.755    0.955    0.955    !  3.710
assign ( resid   53  and name    HA  )  ( resid  53  and name   HD1#  )     2.790    0.990    0.990    !  3.780
assign ( resid   53  and name  HD2#  )  ( resid  71  and name    HB2  )     3.310    1.510    1.510    !  4.820
assign ( resid   53  and name  HD1#  )  ( resid  71  and name    HB1  )     3.310    1.510    1.510    !  4.820
assign ( resid   53  and name  HD1#  )  ( resid  71  and name    HB2  )     3.310    1.510    1.510    !  4.820
assign ( resid   53  and name  HD2#  )  ( resid  71  and name    HB1  )     3.310    1.510    1.510    !  4.820
assign ( resid   53  and name  HD1#  )  ( resid  76  and name    HB#  )     2.755    0.955    0.955    !  3.710
assign ( resid   53  and name  HD2#  )  ( resid  76  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   53  and name    HN  )  ( resid  53  and name    HB1  )     2.760    0.960    0.960    !  3.720
assign ( resid   53  and name  HD2#  )  ( resid  54  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   53  and name    HA  )  ( resid  71  and name     HN  )     3.580    1.780    1.780    !  5.360
assign ( resid   53  and name    HN  )  ( resid  54  and name     HN  )     2.875    1.075    1.075    !  3.950
assign ( resid   53  and name  HD1#  )  ( resid  54  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   53  and name   HB2  )  ( resid  54  and name     HN  )     3.205    1.405    1.405    !  4.610
assign ( resid   53  and name  HD1#  )  ( resid  74  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   53  and name  HD2#  )  ( resid  74  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   53  and name    HN  )  ( resid  53  and name    HB2  )     2.760    0.960    0.960    !  3.720
assign ( resid   53  and name   HB1  )  ( resid  54  and name     HN  )     3.205    1.405    1.405    !  4.610
assign ( resid   53  and name    HN  )  ( resid  55  and name     HN  )     3.165    1.365    1.365    !  4.530
assign ( resid   53  and name  HD1#  )  ( resid  55  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   53  and name  HD2#  )  ( resid  55  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   53  and name  HD1#  )  ( resid  76  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   53  and name    HA  )  ( resid  55  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   53  and name    HN  )  ( resid  53  and name    HB#  )     2.425    0.625    0.625    !  3.050
assign ( resid   53  and name    HN  )  ( resid  53  and name   HD1#  )     2.335    0.535    0.535    !  2.870
assign ( resid   53  and name    HN  )  ( resid  55  and name    HB#  )     3.250    1.450    1.450    !  4.700
assign ( resid   53  and name    HA  )  ( resid  53  and name   HD1#  )     2.515    0.715    0.715    !  3.230
assign ( resid   53  and name   HB#  )  ( resid  54  and name     HN  )     2.785    0.985    0.985    !  3.770
assign ( resid   53  and name   HB#  )  ( resid  55  and name     HN  )     2.680    0.880    0.880    !  3.560
assign ( resid   53  and name   HB#  )  ( resid  69  and name     HA  )     3.305    1.505    1.505    !  4.810
assign ( resid   53  and name  HD1#  )  ( resid  54  and name     HN  )     3.250    1.450    1.450    !  4.700
assign ( resid   53  and name  HD1#  )  ( resid  68  and name     HN  )     3.620    1.820    1.820    !  5.440
assign ( resid   53  and name  HD1#  )  ( resid  69  and name     HA  )     2.625    0.825    0.825    !  3.450
assign ( resid   53  and name  HD1#  )  ( resid  70  and name     HA  )     3.620    1.820    1.820    !  5.440
assign ( resid   53  and name  HD1#  )  ( resid  71  and name     HN  )     2.860    1.060    1.060    !  3.920
assign ( resid   53  and name  HD1#  )  ( resid  71  and name     HA  )     3.295    1.495    1.495    !  4.790
assign ( resid   53  and name  HD2#  )  ( resid  71  and name    HB#  )     2.485    0.685    0.685    !  3.170
assign ( resid   53  and name  HD1#  )  ( resid  71  and name    HD#  )     3.620    1.820    1.820    !  5.440
assign ( resid   53  and name  HD1#  )  ( resid  72  and name     HN  )     3.350    1.550    1.550    !  4.900
assign ( resid   53  and name  HD1#  )  ( resid  72  and name     HA  )     3.105    1.305    1.305    !  4.410
assign ( resid   53  and name  HD1#  )  ( resid  76  and name     HN  )     2.920    1.120    1.120    !  4.040
assign ( resid   53  and name  HD1#  )  ( resid  76  and name     HA  )     3.485    1.685    1.685    !  5.170
assign ( resid   53  and name  HD1#  )  ( resid  76  and name    HB#  )     2.240    0.440    0.440    !  2.680
assign ( resid   53  and name  HD1#  )  ( resid  80  and name    HE#  )     3.620    1.820    1.820    !  5.440

assign ( resid   54  and name    HN  )  ( resid  55  and name     HN  )     2.650    0.850    0.850    !  3.500
assign ( resid   54  and name   HA2  )  ( resid  66  and name     HN  )     3.065    1.265    1.265    !  4.330
assign ( resid   54  and name   HA1  )  ( resid  66  and name     HN  )     3.065    1.265    1.265    !  4.330
assign ( resid   54  and name    HN  )  ( resid  66  and name     HN  )     3.110    1.310    1.310    !  4.420
assign ( resid   54  and name    HN  )  ( resid  55  and name    HB#  )     3.030    1.230    1.230    !  4.260
assign ( resid   54  and name    HN  )  ( resid  66  and name    HA#  )     3.570    1.770    1.770    !  5.340
assign ( resid   54  and name   HA#  )  ( resid  66  and name     HN  )     2.795    0.995    0.995    !  3.790

assign ( resid   55  and name   HB2  )  ( resid  58  and name    HB#  )     3.190    1.390    1.390    !  4.580
assign ( resid   55  and name    HN  )  ( resid  58  and name    HB#  )     3.605    1.805    1.805    !  5.410
assign ( resid   55  and name   HB1  )  ( resid  58  and name    HB#  )     3.190    1.390    1.390    !  4.580
assign ( resid   55  and name    HN  )  ( resid  58  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   55  and name    HN  )  ( resid  55  and name    HB#  )     2.445    0.645    0.645    !  3.090
assign ( resid   55  and name   HB#  )  ( resid  58  and name     HN  )     2.675    0.875    0.875    !  3.550
assign ( resid   55  and name   HB#  )  ( resid  58  and name    HB#  )     2.805    1.005    1.005    !  3.810

assign ( resid   58  and name   HB#  )  ( resid  65  and name    HD#  )     2.855    1.055    1.055    !  3.910
assign ( resid   58  and name   HB#  )  ( resid  59  and name     HN  )     3.360    1.560    1.560    !  4.920
assign ( resid   58  and name   HB#  )  ( resid  59  and name     HA  )     3.120    1.320    1.320    !  4.440
assign ( resid   58  and name   HB#  )  ( resid  65  and name    HB2  )     3.650    1.850    1.850    !  5.500
assign ( resid   58  and name    HN  )  ( resid  59  and name     HN  )     3.290    1.490    1.490    !  4.780
assign ( resid   58  and name    HN  )  ( resid  60  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   58  and name   HB#  )  ( resid  61  and name   HE22  )     3.155    1.355    1.355    !  4.510
assign ( resid   58  and name    HN  )  ( resid  61  and name   HE21  )     3.650    1.850    1.850    !  5.500
assign ( resid   58  and name    HN  )  ( resid  58  and name    HB#  )     2.515    0.715    0.715    !  3.230
assign ( resid   58  and name   HB#  )  ( resid  61  and name   HE21  )     3.155    1.355    1.355    !  4.510
assign ( resid   58  and name    HN  )  ( resid  61  and name   HE22  )     3.650    1.850    1.850    !  5.500
assign ( resid   58  and name   HB#  )  ( resid  60  and name     HN  )     2.495    0.695    0.695    !  3.190
assign ( resid   58  and name    HN  )  ( resid  61  and name   HE2#  )     3.285    1.485    1.485    !  4.770
assign ( resid   58  and name   HB#  )  ( resid  61  and name   HE2#  )     2.790    0.990    0.990    !  3.780

assign ( resid   59  and name    HN  )  ( resid  60  and name     HN  )     2.965    1.165    1.165    !  4.130
assign ( resid   59  and name    HN  )  ( resid  59  and name    HB#  )     2.605    0.805    0.805    !  3.410

assign ( resid   60  and name    HB  )  ( resid  60  and name   HD1#  )     2.900    1.100    1.100    !  4.000
assign ( resid   60  and name    HA  )  ( resid  60  and name   HG2#  )     2.810    1.010    1.010    !  3.820
assign ( resid   60  and name  HG2#  )  ( resid  60  and name   HG12  )     2.810    1.010    1.010    !  3.820
assign ( resid   60  and name  HG2#  )  ( resid  60  and name   HG11  )     2.810    1.010    1.010    !  3.820
assign ( resid   60  and name  HG2#  )  ( resid  60  and name   HD1#  )     2.585    0.785    0.785    !  3.370
assign ( resid   60  and name    HA  )  ( resid  60  and name   HD1#  )     2.810    1.010    1.010    !  3.820
assign ( resid   60  and name  HG2#  )  ( resid  61  and name     HN  )     3.290    1.490    1.490    !  4.780
assign ( resid   60  and name  HG2#  )  ( resid  62  and name    HB#  )     3.480    1.680    1.680    !  5.160
assign ( resid   60  and name  HG2#  )  ( resid  65  and name    HB2  )     3.650    1.850    1.850    !  5.500
assign ( resid   60  and name  HG2#  )  ( resid  61  and name     HA  )     3.285    1.485    1.485    !  4.770
assign ( resid   60  and name    HN  )  ( resid  60  and name   HG11  )     3.205    1.405    1.405    !  4.610
assign ( resid   60  and name    HN  )  ( resid  60  and name   HG2#  )     2.945    1.145    1.145    !  4.090
assign ( resid   60  and name    HN  )  ( resid  60  and name     HB  )     2.515    0.715    0.715    !  3.230
assign ( resid   60  and name    HN  )  ( resid  60  and name   HG12  )     3.205    1.405    1.405    !  4.610
assign ( resid   60  and name    HN  )  ( resid  61  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   60  and name  HG2#  )  ( resid  62  and name     HN  )     2.670    0.870    0.870    !  3.540
assign ( resid   60  and name  HD1#  )  ( resid  62  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   60  and name    HN  )  ( resid  60  and name   HG1#  )     2.890    1.090    1.090    !  3.980
assign ( resid   60  and name    HA  )  ( resid  60  and name   HG1#  )     2.645    0.845    0.845    !  3.490
assign ( resid   60  and name    HA  )  ( resid  61  and name   HE2#  )     2.980    1.180    1.180    !  4.160
assign ( resid   60  and name  HG2#  )  ( resid  60  and name   HG1#  )     2.435    0.635    0.635    !  3.070

assign ( resid   61  and name    HA  )  ( resid  61  and name    HG#  )     2.600    0.800    0.800    !  3.400
assign ( resid   61  and name    HA  )  ( resid  65  and name    HB2  )     2.960    1.160    1.160    !  4.120
assign ( resid   61  and name    HN  )  ( resid  61  and name    HG#  )     3.650    1.850    1.850    !  5.500
assign ( resid   61  and name    HA  )  ( resid  65  and name    HD#  )     2.685    0.885    0.885    !  3.570
assign ( resid   61  and name   HG#  )  ( resid  62  and name     HN  )     3.325    1.525    1.525    !  4.850
assign ( resid   61  and name    HN  )  ( resid  62  and name     HN  )     3.035    1.235    1.235    !  4.270
assign ( resid   61  and name    HA  )  ( resid  61  and name    HB#  )     2.220    0.420    0.420    !  2.640
assign ( resid   61  and name    HA  )  ( resid  61  and name   HE2#  )     2.950    1.150    1.150    !  4.100
assign ( resid   61  and name   HB#  )  ( resid  61  and name   HE2#  )     2.985    1.185    1.185    !  4.170
assign ( resid   61  and name   HB#  )  ( resid  62  and name     HN  )     3.010    1.210    1.210    !  4.220
assign ( resid   61  and name   HB#  )  ( resid  65  and name    HB2  )     3.570    1.770    1.770    !  5.340

assign ( resid   62  and name    HN  )  ( resid  65  and name    HB1  )     3.650    1.850    1.850    !  5.500
assign ( resid   62  and name    HN  )  ( resid  65  and name    HB2  )     3.200    1.400    1.400    !  4.600

assign ( resid   63  and name   HA#  )  ( resid  64  and name   HG2#  )     3.570    1.770    1.770    !  5.340
assign ( resid   63  and name   HA#  )  ( resid  65  and name     HN  )     3.005    1.205    1.205    !  4.210

assign ( resid   64  and name    HN  )  ( resid  64  and name   HD1#  )     3.250    1.450    1.450    !  4.700
assign ( resid   64  and name    HA  )  ( resid  64  and name   HD1#  )     2.975    1.175    1.175    !  4.150
assign ( resid   64  and name    HB  )  ( resid  64  and name   HD1#  )     2.905    1.105    1.105    !  4.010
assign ( resid   64  and name    HA  )  ( resid  64  and name   HG2#  )     2.630    0.830    0.830    !  3.460
assign ( resid   64  and name  HG2#  )  ( resid  64  and name   HD1#  )     2.450    0.650    0.650    !  3.100
assign ( resid   64  and name    HA  )  ( resid  67  and name    HG2  )     2.795    0.995    0.995    !  3.790
assign ( resid   64  and name    HA  )  ( resid  67  and name    HG1  )     2.795    0.995    0.995    !  3.790
assign ( resid   64  and name  HG2#  )  ( resid  68  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   64  and name    HB  )  ( resid  67  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   64  and name    HN  )  ( resid  64  and name   HG2#  )     2.945    1.145    1.145    !  4.090
assign ( resid   64  and name    HN  )  ( resid  64  and name   HG12  )     3.300    1.500    1.500    !  4.800
assign ( resid   64  and name  HG2#  )  ( resid  65  and name     HN  )     3.345    1.545    1.545    !  4.890
assign ( resid   64  and name    HN  )  ( resid  64  and name   HG11  )     3.300    1.500    1.500    !  4.800
assign ( resid   64  and name    HN  )  ( resid  65  and name     HN  )     3.075    1.275    1.275    !  4.350
assign ( resid   64  and name  HG2#  )  ( resid  67  and name     HN  )     3.065    1.265    1.265    !  4.330
assign ( resid   64  and name    HN  )  ( resid  64  and name   HG1#  )     2.945    1.145    1.145    !  4.090
assign ( resid   64  and name    HA  )  ( resid  67  and name    HG#  )     2.545    0.745    0.745    !  3.290
assign ( resid   64  and name  HG2#  )  ( resid  67  and name    HG#  )     2.660    0.860    0.860    !  3.520
assign ( resid   64  and name  HG1#  )  ( resid  65  and name     HN  )     3.545    1.745    1.745    !  5.290

assign ( resid   65  and name    HN  )  ( resid  65  and name    HB2  )     2.360    0.560    0.560    !  2.920
assign ( resid   65  and name    HA  )  ( resid  65  and name    HD#  )     2.940    1.140    1.140    !  4.080
assign ( resid   65  and name    HN  )  ( resid  66  and name     HN  )     3.255    1.455    1.455    !  4.710
assign ( resid   65  and name   HD#  )  ( resid  66  and name     HN  )     3.610    1.810    1.810    !  5.420
assign ( resid   65  and name   HB1  )  ( resid  66  and name     HN  )     3.240    1.440    1.440    !  4.680
assign ( resid   65  and name    HA  )  ( resid  66  and name     HN  )     2.400    0.600    0.600    !  3.000
assign ( resid   65  and name    HN  )  ( resid  65  and name    HB1  )     2.815    1.015    1.015    !  3.830
assign ( resid   65  and name    HN  )  ( resid  67  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   65  and name   HD#  )  ( resid  67  and name     HN  )     3.650    1.850    1.850    !  5.500

assign ( resid   66  and name    HN  )  ( resid  67  and name    HB#  )     3.300    1.500    1.500    !  4.800
assign ( resid   66  and name    HN  )  ( resid  68  and name     HN  )     3.410    1.610    1.610    !  5.020
assign ( resid   66  and name    HN  )  ( resid  67  and name     HN  )     2.930    1.130    1.130    !  4.060
assign ( resid   66  and name    HN  )  ( resid  66  and name    HA#  )     2.190    0.390    0.390    !  2.580

assign ( resid   67  and name    HN  )  ( resid  67  and name    HG2  )     3.025    1.225    1.225    !  4.250
assign ( resid   67  and name   HB#  )  ( resid  68  and name     HN  )     2.845    1.045    1.045    !  3.890
assign ( resid   67  and name    HN  )  ( resid  68  and name     HN  )     2.475    0.675    0.675    !  3.150
assign ( resid   67  and name    HN  )  ( resid  67  and name    HG1  )     3.025    1.225    1.225    !  4.250
assign ( resid   67  and name    HN  )  ( resid  67  and name    HB#  )     2.490    0.690    0.690    !  3.180
assign ( resid   67  and name    HN  )  ( resid  67  and name    HG#  )     2.715    0.915    0.915    !  3.630
assign ( resid   67  and name    HA  )  ( resid  67  and name    HD#  )     3.230    1.430    1.430    !  4.660
assign ( resid   67  and name   HG#  )  ( resid  68  and name     HN  )     3.570    1.770    1.770    !  5.340

assign ( resid   68  and name   HA2  )  ( resid  71  and name    HD#  )     3.255    1.455    1.455    !  4.710
assign ( resid   68  and name    HN  )  ( resid  69  and name     HN  )     3.155    1.355    1.355    !  4.510
assign ( resid   68  and name   HA1  )  ( resid  71  and name    HD#  )     3.255    1.455    1.455    !  4.710
assign ( resid   68  and name   HA#  )  ( resid  69  and name     HA  )     3.395    1.595    1.595    !  4.990
assign ( resid   68  and name   HA#  )  ( resid  71  and name     HN  )     3.560    1.760    1.760    !  5.320
assign ( resid   68  and name   HA#  )  ( resid  71  and name    HD#  )     2.955    1.155    1.155    !  4.110

assign ( resid   69  and name    HA  )  ( resid  70  and name    HB#  )     3.650    1.850    1.850    !  5.500
assign ( resid   69  and name    HA  )  ( resid  71  and name     HN  )     2.990    1.190    1.190    !  4.180
assign ( resid   69  and name    HN  )  ( resid  70  and name     HN  )     2.670    0.870    0.870    !  3.540
assign ( resid   69  and name    HN  )  ( resid  71  and name     HN  )     3.015    1.215    1.215    !  4.230
assign ( resid   69  and name    HN  )  ( resid  69  and name    HB#  )     2.725    0.925    0.925    !  3.650
assign ( resid   69  and name   HB#  )  ( resid  70  and name     HN  )     2.950    1.150    1.150    !  4.100
assign ( resid   69  and name   HB#  )  ( resid  71  and name     HN  )     3.570    1.770    1.770    !  5.340

assign ( resid   70  and name   HB#  )  ( resid  71  and name     HN  )     2.750    0.950    0.950    !  3.700
assign ( resid   70  and name    HN  )  ( resid  71  and name     HN  )     2.585    0.785    0.785    !  3.370
assign ( resid   70  and name    HN  )  ( resid  70  and name    HB#  )     2.420    0.620    0.620    !  3.040
assign ( resid   70  and name   HB#  )  ( resid  71  and name    HD#  )     3.385    1.585    1.585    !  4.970
assign ( resid   70  and name    HA  )  ( resid  71  and name    HB#  )     3.570    1.770    1.770    !  5.340

assign ( resid   71  and name    HA  )  ( resid  72  and name    HB1  )     3.550    1.750    1.750    !  5.300
assign ( resid   71  and name   HE#  )  ( resid  79  and name   HD1#  )     3.510    1.710    1.710    !  5.220
assign ( resid   71  and name   HD#  )  ( resid  76  and name    HB#  )     3.160    1.360    1.360    !  4.520
assign ( resid   71  and name   HB2  )  ( resid  76  and name    HB#  )     2.910    1.110    1.110    !  4.020
assign ( resid   71  and name    HA  )  ( resid  72  and name    HB2  )     3.550    1.750    1.750    !  5.300
assign ( resid   71  and name   HD#  )  ( resid  76  and name     HA  )     3.110    1.310    1.310    !  4.420
assign ( resid   71  and name   HB1  )  ( resid  76  and name    HB#  )     2.910    1.110    1.110    !  4.020
assign ( resid   71  and name    HA  )  ( resid  71  and name    HD#  )     3.340    1.540    1.540    !  4.880
assign ( resid   71  and name    HN  )  ( resid  71  and name    HE#  )     3.565    1.765    1.765    !  5.330
assign ( resid   71  and name   HB2  )  ( resid  72  and name     HN  )     3.340    1.540    1.540    !  4.880
assign ( resid   71  and name    HN  )  ( resid  72  and name     HN  )     3.240    1.440    1.440    !  4.680
assign ( resid   71  and name   HD#  )  ( resid  72  and name     HN  )     3.590    1.790    1.790    !  5.380
assign ( resid   71  and name    HN  )  ( resid  71  and name    HB2  )     2.750    0.950    0.950    !  3.700
assign ( resid   71  and name    HN  )  ( resid  71  and name    HB1  )     2.750    0.950    0.950    !  3.700
assign ( resid   71  and name    HN  )  ( resid  71  and name    HD#  )     2.650    0.850    0.850    !  3.500
assign ( resid   71  and name   HB1  )  ( resid  72  and name     HN  )     3.340    1.540    1.540    !  4.880
assign ( resid   71  and name    HA  )  ( resid  72  and name     HN  )     2.445    0.645    0.645    !  3.090
assign ( resid   71  and name   HD#  )  ( resid  76  and name     HN  )     3.080    1.280    1.280    !  4.360
assign ( resid   71  and name    HA  )  ( resid  76  and name     HN  )     3.620    1.820    1.820    !  5.440
assign ( resid   71  and name   HD#  )  ( resid  77  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   71  and name   HE#  )  ( resid  79  and name   HD2#  )     3.510    1.710    1.710    !  5.220
assign ( resid   71  and name    HN  )  ( resid  71  and name    HB#  )     2.515    0.715    0.715    !  3.230
assign ( resid   71  and name    HA  )  ( resid  75  and name    HB#  )     2.985    1.185    1.185    !  4.170
assign ( resid   71  and name   HB#  )  ( resid  72  and name     HN  )     2.980    1.180    1.180    !  4.160
assign ( resid   71  and name   HB#  )  ( resid  76  and name     HN  )     3.045    1.245    1.245    !  4.290
assign ( resid   71  and name   HB#  )  ( resid  76  and name    HB#  )     2.645    0.845    0.845    !  3.490
assign ( resid   71  and name   HD#  )  ( resid  79  and name   HD1#  )     3.620    1.820    1.820    !  5.440
assign ( resid   71  and name   HE#  )  ( resid  79  and name   HD1#  )     3.070    1.270    1.270    !  4.340

assign ( resid   72  and name    HN  )  ( resid  75  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   72  and name    HN  )  ( resid  76  and name     HN  )     3.550    1.750    1.750    !  5.300
assign ( resid   72  and name    HA  )  ( resid  76  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   72  and name    HN  )  ( resid  76  and name    HB#  )     3.400    1.600    1.600    !  5.000
assign ( resid   72  and name    HN  )  ( resid  72  and name    HB#  )     2.155    0.355    0.355    !  2.510
assign ( resid   72  and name    HN  )  ( resid  75  and name    HB#  )     3.445    1.645    1.645    !  5.090
assign ( resid   72  and name   HB#  )  ( resid  75  and name     HN  )     3.180    1.380    1.380    !  4.560

assign ( resid   73  and name   HB#  )  ( resid  74  and name     HN  )     2.645    0.845    0.845    !  3.490

assign ( resid   74  and name    HN  )  ( resid  74  and name    HB2  )     2.725    0.925    0.925    !  3.650
assign ( resid   74  and name    HN  )  ( resid  75  and name     HN  )     2.825    1.025    1.025    !  3.850
assign ( resid   74  and name    HN  )  ( resid  76  and name    HB#  )     3.650    1.850    1.850    !  5.500
assign ( resid   74  and name    HA  )  ( resid  76  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   74  and name    HN  )  ( resid  74  and name    HB1  )     2.725    0.925    0.925    !  3.650
assign ( resid   74  and name    HA  )  ( resid  77  and name     HN  )     3.205    1.405    1.405    !  4.610
assign ( resid   74  and name    HN  )  ( resid  76  and name     HN  )     3.105    1.305    1.305    !  4.410
assign ( resid   74  and name    HN  )  ( resid  74  and name    HD2  )     3.475    1.675    1.675    !  5.150
assign ( resid   74  and name   HB#  )  ( resid  75  and name     HN  )     2.820    1.020    1.020    !  3.840
assign ( resid   74  and name   HB#  )  ( resid  76  and name     HN  )     3.570    1.770    1.770    !  5.340

assign ( resid   75  and name    HA  )  ( resid  78  and name    HB#  )     2.860    1.060    1.060    !  3.920
assign ( resid   75  and name    HN  )  ( resid  78  and name    HB#  )     3.620    1.820    1.820    !  5.440
assign ( resid   75  and name   HB1  )  ( resid  76  and name     HN  )     3.235    1.435    1.435    !  4.670
assign ( resid   75  and name    HN  )  ( resid  75  and name    HB1  )     3.000    1.200    1.200    !  4.200
assign ( resid   75  and name    HN  )  ( resid  76  and name     HN  )     2.775    0.975    0.975    !  3.750
assign ( resid   75  and name   HB2  )  ( resid  76  and name     HN  )     3.235    1.435    1.435    !  4.670
assign ( resid   75  and name    HN  )  ( resid  75  and name    HB2  )     3.000    1.200    1.200    !  4.200
assign ( resid   75  and name    HN  )  ( resid  75  and name    HB#  )     2.580    0.780    0.780    !  3.360
assign ( resid   75  and name   HB#  )  ( resid  76  and name     HN  )     2.845    1.045    1.045    !  3.890
assign ( resid   75  and name    HA  )  ( resid  78  and name     HN  )     3.650    1.850    1.850    !  5.500 ! added (10/1)

assign ( resid   76  and name   HB#  )  ( resid  77  and name    HG#  )     2.940    1.140    1.140    !  4.080
assign ( resid   76  and name    HA  )  ( resid  79  and name    HB2  )     3.395    1.595    1.595    !  4.990
assign ( resid   76  and name    HA  )  ( resid  79  and name     HN  )     2.815    1.015    1.015    !  3.830
assign ( resid   76  and name    HN  )  ( resid  76  and name    HB#  )     2.595    0.795    0.795    !  3.390
assign ( resid   76  and name    HN  )  ( resid  77  and name     HN  )     2.850    1.050    1.050    !  3.900
assign ( resid   76  and name   HB#  )  ( resid  77  and name     HN  )     2.705    0.905    0.905    !  3.610
assign ( resid   76  and name   HB#  )  ( resid  78  and name     HN  )     3.145    1.345    1.345    !  4.490
assign ( resid   76  and name    HN  )  ( resid  78  and name     HN  )     3.520    1.720    1.720    !  5.240
assign ( resid   76  and name   HB#  )  ( resid  80  and name    HE#  )     3.315    1.515    1.515    !  4.830
assign ( resid   76  and name   HB#  )  ( resid  80  and name    HD#  )     3.650    1.850    1.850    !  5.500
assign ( resid   76  and name   HB#  )  ( resid  80  and name     HZ  )     3.650    1.850    1.850    !  5.500
assign ( resid   76  and name    HA  )  ( resid  79  and name   HD1#  )     2.910    1.110    1.110    !  4.020

assign ( resid   77  and name    HA  )  ( resid  77  and name    HG#  )     2.715    0.915    0.915    !  3.630
assign ( resid   77  and name   HB2  )  ( resid  77  and name    HG#  )     2.285    0.485    0.485    !  2.770
assign ( resid   77  and name   HB1  )  ( resid  77  and name    HG#  )     2.285    0.485    0.485    !  2.770
assign ( resid   77  and name    HA  )  ( resid  80  and name    HD#  )     2.895    1.095    1.095    !  3.990
assign ( resid   77  and name    HA  )  ( resid  80  and name    HB2  )     2.815    1.015    1.015    !  3.830
assign ( resid   77  and name    HA  )  ( resid  80  and name     HN  )     2.920    1.120    1.120    !  4.040
assign ( resid   77  and name    HN  )  ( resid  77  and name    HB2  )     2.895    1.095    1.095    !  3.990
assign ( resid   77  and name    HN  )  ( resid  77  and name    HG#  )     2.780    0.980    0.980    !  3.760
assign ( resid   77  and name    HN  )  ( resid  78  and name     HN  )     2.780    0.980    0.980    !  3.760
assign ( resid   77  and name   HG#  )  ( resid  78  and name     HN  )     3.375    1.575    1.575    !  4.950
assign ( resid   77  and name    HN  )  ( resid  77  and name    HB1  )     2.895    1.095    1.095    !  3.990
assign ( resid   77  and name    HN  )  ( resid  79  and name     HN  )     3.275    1.475    1.475    !  4.750
assign ( resid   77  and name    HN  )  ( resid  77  and name    HB#  )     2.585    0.785    0.785    !  3.370
assign ( resid   77  and name   HB#  )  ( resid  77  and name    HG#  )     2.050    0.250    0.250    !  2.300
assign ( resid   77  and name   HB#  )  ( resid  78  and name     HN  )     2.650    0.850    0.850    !  3.500

assign ( resid   78  and name   HB#  )  ( resid  79  and name     HA  )     3.060    1.260    1.260    !  4.320
assign ( resid   78  and name   HB#  )  ( resid  80  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   78  and name   HG#  )  ( resid  79  and name     HN  )     3.185    1.385    1.385    !  4.570
assign ( resid   78  and name    HN  )  ( resid  78  and name    HB#  )     2.550    0.750    0.750    !  3.300
assign ( resid   78  and name    HN  )  ( resid  78  and name    HG#  )     2.890    1.090    1.090    !  3.980
assign ( resid   78  and name    HN  )  ( resid  80  and name    HB2  )     3.630    1.830    1.830    !  5.460
assign ( resid   78  and name    HN  )  ( resid  79  and name    HB2  )     3.650    1.850    1.850    !  5.500
assign ( resid   78  and name    HN  )  ( resid  79  and name     HN  )     2.850    1.050    1.050    !  3.900
assign ( resid   78  and name   HB#  )  ( resid  79  and name     HN  )     2.820    1.020    1.020    !  3.840
assign ( resid   78  and name    HN  )  ( resid  79  and name   HD1#  )     3.620    1.820    1.820    !  5.440
assign ( resid   78  and name   HB#  )  ( resid  79  and name   HD1#  )     3.620    1.820    1.820    !  5.440
assign ( resid   78  and name    HA  )  ( resid  81  and name     HN  )     2.920    1.120    1.120    !  4.040 ! added (10/2) 

assign ( resid   79  and name    HA  )  ( resid  82  and name    HB#  )     3.150    1.350    1.350    !  4.500
assign ( resid   79  and name    HA  )  ( resid  123  and name    HD# )     3.050    1.250    1.250    !  4.300
assign ( resid   79  and name    HA  )  ( resid  79  and name   HD1#  )     3.275    1.475    1.475    !  4.750
assign ( resid   79  and name  HD1#  )  ( resid  80  and name     HN  )     3.635    1.835    1.835    !  5.470
assign ( resid   79  and name   HB1  )  ( resid  79  and name   HD1#  )     2.795    0.995    0.995    !  3.790
assign ( resid   79  and name    HN  )  ( resid  79  and name   HD2#  )     3.330    1.530    1.530    !  4.860
assign ( resid   79  and name    HA  )  ( resid  79  and name   HD2#  )     3.275    1.475    1.475    !  4.750
assign ( resid   79  and name   HB1  )  ( resid  79  and name   HD2#  )     2.795    0.995    0.995    !  3.790
assign ( resid   79  and name  HD1#  )  ( resid  83  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   79  and name  HD2#  )  ( resid  83  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   79  and name   HB2  )  ( resid  80  and name     HN  )     2.975    1.175    1.175    !  4.150
assign ( resid   79  and name    HN  )  ( resid  80  and name    HB2  )     3.275    1.475    1.475    !  4.750
assign ( resid   79  and name    HN  )  ( resid  79  and name    HB1  )     2.670    0.870    0.870    !  3.540
assign ( resid   79  and name    HN  )  ( resid  79  and name   HD1#  )     3.330    1.530    1.530    !  4.860
assign ( resid   79  and name  HD2#  )  ( resid  80  and name     HN  )     3.635    1.835    1.835    !  5.470
assign ( resid   79  and name    HN  )  ( resid  80  and name    HD#  )     3.035    1.235    1.235    !  4.270
assign ( resid   79  and name    HN  )  ( resid  80  and name     HN  )     2.835    1.035    1.035    !  3.870
assign ( resid   79  and name  HD1#  )  ( resid  82  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   79  and name  HD2#  )  ( resid  82  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   79  and name   HB2  )  ( resid  81  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   79  and name    HG  )  ( resid  81  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   79  and name    HN  )  ( resid  79  and name    HB2  )     2.710    0.910    0.910    !  3.620
assign ( resid   79  and name    HA  )  ( resid  82  and name     HN  )     3.055    1.255    1.255    !  4.310
assign ( resid   79  and name   HB1  )  ( resid  80  and name     HN  )     2.450    0.650    0.650    !  3.100
assign ( resid   79  and name   HB1  )  ( resid  80  and name    HD#  )     3.650    1.850    1.850    !  5.500
assign ( resid   79  and name    HN  )  ( resid  79  and name   HD1#  )     2.825    1.025    1.025    !  3.850
assign ( resid   79  and name    HA  )  ( resid  79  and name   HD1#  )     2.685    0.885    0.885    !  3.570
assign ( resid   79  and name   HB1  )  ( resid  83  and name   HD1#  )     3.510    1.710    1.710    !  5.220
assign ( resid   79  and name  HD1#  )  ( resid  80  and name     HN  )     3.150    1.350    1.350    !  4.500
assign ( resid   79  and name  HD1#  )  ( resid  80  and name     HA  )     3.515    1.715    1.715    !  5.230
assign ( resid   79  and name  HD1#  )  ( resid  80  and name    HE#  )     3.620    1.820    1.820    !  5.440
assign ( resid   79  and name  HD1#  )  ( resid  80  and name    HD#  )     3.540    1.740    1.740    !  5.280
assign ( resid   79  and name  HD1#  )  ( resid  81  and name     HN  )     3.620    1.820    1.820    !  5.440
assign ( resid   79  and name  HD1#  )  ( resid  82  and name    HB#  )     3.250    1.450    1.450    !  4.700
assign ( resid   79  and name  HD1#  )  ( resid  83  and name     HG  )     3.575    1.775    1.775    !  5.350
assign ( resid   79  and name  HD1#  )  ( resid  83  and name   HD1#  )     2.720    0.920    0.920    !  3.640
assign ( resid   79  and name  HD2#  )  ( resid  121  and name   HG2# )     3.285    1.485    1.485    !  4.770
assign ( resid   79  and name  HD2#  )  ( resid  123  and name    HB# )     2.810    1.010    1.010    !  3.820
assign ( resid   79  and name  HD1#  )  ( resid  123  and name    HD# )     2.870    1.070    1.070    !  3.940
assign ( resid   79  and name  HD1#  )  ( resid  124  and name     HN )     3.620    1.820    1.820    !  5.440

assign ( resid   80  and name   HD#  )  ( resid  89  and name     HG  )     3.465    1.665    1.665    !  5.130
assign ( resid   80  and name    HA  )  ( resid  83  and name   HD1#  )     3.135    1.335    1.335    !  4.470
assign ( resid   80  and name    HA  )  ( resid  83  and name    HB2  )     2.915    1.115    1.115    !  4.030
assign ( resid   80  and name    HA  )  ( resid  83  and name     HG  )     3.200    1.400    1.400    !  4.600
assign ( resid   80  and name    HA  )  ( resid  83  and name     HN  )     2.775    0.975    0.975    !  3.750
assign ( resid   80  and name    HA  )  ( resid  89  and name     HG  )     3.245    1.445    1.445    !  4.690
assign ( resid   80  and name    HA  )  ( resid  80  and name    HD#  )     3.360    1.560    1.560    !  4.920
assign ( resid   80  and name    HA  )  ( resid  80  and name    HD#  )     3.540    1.740    1.740    !  5.280
assign ( resid   80  and name    HA  )  ( resid  83  and name   HD2#  )     3.135    1.335    1.335    !  4.470
assign ( resid   80  and name    HN  )  ( resid  80  and name    HB2  )     2.505    0.705    0.705    !  3.210
assign ( resid   80  and name    HN  )  ( resid  82  and name    HB#  )     3.650    1.850    1.850    !  5.500
assign ( resid   80  and name    HN  )  ( resid  83  and name    HB2  )     3.650    1.850    1.850    !  5.500
assign ( resid   80  and name    HN  )  ( resid  81  and name     HN  )     2.725    0.925    0.925    !  3.650
assign ( resid   80  and name   HD#  )  ( resid  81  and name     HN  )     3.480    1.680    1.680    !  5.160
assign ( resid   80  and name    HN  )  ( resid  80  and name    HD#  )     2.800    1.000    1.000    !  3.800
assign ( resid   80  and name   HB2  )  ( resid  81  and name     HN  )     2.805    1.005    1.005    !  3.810
assign ( resid   80  and name   HB2  )  ( resid  82  and name     HN  )     3.515    1.715    1.715    !  5.230
assign ( resid   80  and name    HN  )  ( resid  80  and name    HE#  )     3.650    1.850    1.850    !  5.500
assign ( resid   80  and name    HA  )  ( resid  83  and name   HD1#  )     2.790    0.990    0.990    !  3.780
assign ( resid   80  and name   HD#  )  ( resid  83  and name   HD2#  )     3.550    1.750    1.750    !  5.300

assign ( resid   81  and name    HN  )  ( resid  81  and name    HB#  )     2.250    0.450    0.450    !  2.700
assign ( resid   81  and name   HB#  )  ( resid  82  and name     HN  )     2.440    0.640    0.640    !  3.080
assign ( resid   81  and name    HA  )  ( resid  84  and name   HD1#  )     3.310    1.510    1.510    !  4.820
assign ( resid   81  and name    HA  )  ( resid  84  and name   HG2#  )     2.805    1.005    1.005    !  3.810
assign ( resid   81  and name    HA  )  ( resid  83  and name     HN  )     3.595    1.795    1.795    !  5.390
assign ( resid   81  and name    HA  )  ( resid  81  and name    HG2  )     2.705    0.905    0.905    !  3.610
assign ( resid   81  and name    HA  )  ( resid  81  and name    HD#  )     2.915    1.115    1.115    !  4.030
assign ( resid   81  and name    HA  )  ( resid  84  and name     HB  )     3.650    1.850    1.850    !  5.500
assign ( resid   81  and name    HA  )  ( resid  81  and name    HG1  )     2.705    0.905    0.905    !  3.610
assign ( resid   81  and name    HA  )  ( resid  81  and name    HB#  )     2.190    0.390    0.390    !  2.580
assign ( resid   81  and name    HN  )  ( resid  81  and name    HG2  )     2.955    1.155    1.155    !  4.110
assign ( resid   81  and name    HN  )  ( resid  84  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   81  and name    HN  )  ( resid  82  and name     HN  )     2.740    0.940    0.940    !  3.680
assign ( resid   81  and name    HA  )  ( resid  84  and name     HN  )     3.070    1.270    1.270    !  4.340
assign ( resid   81  and name    HN  )  ( resid  81  and name    HG1  )     2.955    1.155    1.155    !  4.110
assign ( resid   81  and name    HN  )  ( resid  81  and name    HG#  )     2.560    0.760    0.760    !  3.320
assign ( resid   81  and name    HN  )  ( resid  83  and name   HD1#  )     3.620    1.820    1.820    !  5.440
assign ( resid   81  and name    HA  )  ( resid  81  and name    HG#  )     2.380    0.580    0.580    !  2.960

assign ( resid   82  and name    HA  )  ( resid  82  and name    HD#  )     3.365    1.565    1.565    !  4.930
assign ( resid   82  and name   HB#  )  ( resid  82  and name    HD#  )     2.495    0.695    0.695    !  3.190
assign ( resid   82  and name    HN  )  ( resid  82  and name    HB#  )     2.345    0.545    0.545    !  2.890
assign ( resid   82  and name   HD#  )  ( resid  123  and name    HD# )     3.255    1.455    1.455    !  4.710
assign ( resid   82  and name    HN  )  ( resid  82  and name    HG2  )     3.345    1.545    1.545    !  4.890
assign ( resid   82  and name    HA  )  ( resid  85  and name     HN  )     2.835    1.035    1.035    !  3.870
assign ( resid   82  and name    HN  )  ( resid  83  and name   HD2#  )     3.650    1.850    1.850    !  5.500
assign ( resid   82  and name    HN  )  ( resid  84  and name     HN  )     3.525    1.725    1.725    !  5.250
assign ( resid   82  and name    HN  )  ( resid  123  and name    HD# )     3.650    1.850    1.850    !  5.500
assign ( resid   82  and name    HN  )  ( resid  82  and name    HG1  )     3.345    1.545    1.545    !  4.890
assign ( resid   82  and name    HN  )  ( resid  82  and name    HD#  )     3.495    1.695    1.695    !  5.190
assign ( resid   82  and name    HN  )  ( resid  83  and name   HD1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   82  and name   HB#  )  ( resid  123  and name    HD# )     3.160    1.360    1.360    !  4.520
assign ( resid   82  and name    HN  )  ( resid  83  and name   HD1#  )     3.260    1.460    1.460    !  4.720
assign ( resid   82  and name    HA  )  ( resid  82  and name    HG#  )     2.570    0.770    0.770    !  3.340
assign ( resid   82  and name    HA  )  ( resid  82  and name    HE#  )     3.570    1.770    1.770    !  5.340
assign ( resid   82  and name   HB#  )  ( resid  82  and name    HE#  )     2.940    1.140    1.140    !  4.080
assign ( resid   82  and name   HB#  )  ( resid  121  and name   HG2# )     3.175    1.375    1.375    !  4.550
assign ( resid   82  and name   HG#  )  ( resid  83  and name     HN  )     2.945    1.145    1.145    !  4.090
assign ( resid   82  and name   HG#  )  ( resid  83  and name     HA  )     3.035    1.235    1.235    !  4.270
assign ( resid   82  and name   HE#  )  ( resid  121  and name     HA )     3.570    1.770    1.770    !  5.340
assign ( resid   82  and name   HE#  )  ( resid  121  and name   HG2# )     2.825    1.025    1.025    !  3.850
assign ( resid   82  and name   HE#  )  ( resid  123  and name    HD# )     3.570    1.770    1.770    !  5.340
assign ( resid   82  and name    HA  )  ( resid  85  and name     HN  )     3.650    1.850    1.850    !  5.500 ! added (10/1)

assign ( resid   83  and name   HB2  )  ( resid  89  and name     HG  )     2.895    1.095    1.095    !  3.990
assign ( resid   83  and name    HA  )  ( resid  83  and name   HD2#  )     3.215    1.415    1.415    !  4.630
assign ( resid   83  and name    HA  )  ( resid  88  and name   HD1#  )     3.005    1.205    1.205    !  4.210
assign ( resid   83  and name    HA  )  ( resid  86  and name    HB#  )     2.910    1.110    1.110    !  4.020
assign ( resid   83  and name   HB2  )  ( resid  89  and name    HD#  )     3.435    1.635    1.635    !  5.070
assign ( resid   83  and name    HA  )  ( resid  83  and name   HD1#  )     3.215    1.415    1.415    !  4.630
assign ( resid   83  and name   HB1  )  ( resid  88  and name     HB  )     3.340    1.540    1.540    !  4.880
assign ( resid   83  and name   HB1  )  ( resid  89  and name     HG  )     3.190    1.390    1.390    !  4.580
assign ( resid   83  and name    HN  )  ( resid  83  and name     HG  )     3.205    1.405    1.405    !  4.610
assign ( resid   83  and name   HB2  )  ( resid  88  and name   HG2#  )     3.650    1.850    1.850    !  5.500
assign ( resid   83  and name    HG  )  ( resid  88  and name   HG2#  )     3.650    1.850    1.850    !  5.500
assign ( resid   83  and name    HG  )  ( resid  89  and name    HD#  )     2.970    1.170    1.170    !  4.140
assign ( resid   83  and name   HB2  )  ( resid  84  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   83  and name    HN  )  ( resid  84  and name   HG2#  )     3.650    1.850    1.850    !  5.500
assign ( resid   83  and name    HN  )  ( resid  83  and name    HB2  )     2.570    0.770    0.770    !  3.340
assign ( resid   83  and name    HN  )  ( resid  83  and name   HD1#  )     3.030    1.230    1.230    !  4.260
assign ( resid   83  and name    HA  )  ( resid  85  and name     HN  )     3.085    1.285    1.285    !  4.370
assign ( resid   83  and name    HN  )  ( resid  83  and name   HD2#  )     3.030    1.230    1.230    !  4.260
assign ( resid   83  and name    HA  )  ( resid  89  and name     HN  )     3.420    1.620    1.620    !  5.040
assign ( resid   83  and name   HB2  )  ( resid  89  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   83  and name    HG  )  ( resid  89  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   83  and name    HN  )  ( resid  84  and name     HN  )     2.830    1.030    1.030    !  3.860
assign ( resid   83  and name    HN  )  ( resid  85  and name     HN  )     3.155    1.355    1.355    !  4.510
assign ( resid   83  and name    HA  )  ( resid  86  and name     HN  )     3.055    1.255    1.255    !  4.310
assign ( resid   83  and name    HN  )  ( resid  83  and name   HD1#  )     2.670    0.870    0.870    !  3.540
assign ( resid   83  and name    HA  )  ( resid  83  and name   HD1#  )     2.620    0.820    0.820    !  3.440
assign ( resid   83  and name   HB1  )  ( resid  89  and name    HB#  )     3.570    1.770    1.770    !  5.340
assign ( resid   83  and name  HD1#  )  ( resid  84  and name     HN  )     3.340    1.540    1.540    !  4.880
assign ( resid   83  and name  HD1#  )  ( resid  88  and name     HB  )     3.620    1.820    1.820    !  5.440
assign ( resid   83  and name  HD1#  )  ( resid  89  and name     HN  )     3.620    1.820    1.820    !  5.440
assign ( resid   83  and name  HD2#  )  ( resid  89  and name    HB#  )     3.540    1.740    1.740    !  5.280
assign ( resid   83  and name  HD1#  )  ( resid  89  and name     HG  )     2.775    0.975    0.975    !  3.750
assign ( resid   83  and name  HD2#  )  ( resid  89  and name    HD#  )     2.835    1.035    1.035    !  3.870

assign ( resid   84  and name  HG2#  )  ( resid  85  and name     HN  )     3.205    1.405    1.405    !  4.610
assign ( resid   84  and name    HA  )  ( resid  84  and name     HB  )     2.195    0.395    0.395    !  2.590
assign ( resid   84  and name    HA  )  ( resid  84  and name   HD1#  )     2.790    0.990    0.990    !  3.780
assign ( resid   84  and name    HN  )  ( resid  84  and name   HD1#  )     3.040    1.240    1.240    !  4.280
assign ( resid   84  and name    HA  )  ( resid  84  and name   HG2#  )     2.685    0.885    0.885    !  3.570
assign ( resid   84  and name  HG2#  )  ( resid  84  and name   HG11  )     2.665    0.865    0.865    !  3.530
assign ( resid   84  and name    HB  )  ( resid  84  and name   HD1#  )     2.340    0.540    0.540    !  2.880
assign ( resid   84  and name    HB  )  ( resid  85  and name     HN  )     3.095    1.295    1.295    !  4.390
assign ( resid   84  and name  HD1#  )  ( resid  85  and name     HG  )     2.855    1.055    1.055    !  3.910
assign ( resid   84  and name  HG2#  )  ( resid  84  and name   HD1#  )     2.515    0.715    0.715    !  3.230
assign ( resid   84  and name  HG2#  )  ( resid  84  and name   HG12  )     2.665    0.865    0.865    !  3.530
assign ( resid   84  and name  HD1#  )  ( resid  85  and name     HN  )     3.535    1.735    1.735    !  5.270
assign ( resid   84  and name    HN  )  ( resid  84  and name     HB  )     2.730    0.930    0.930    !  3.660
assign ( resid   84  and name  HG2#  )  ( resid  91  and name     HN  )     3.165    1.365    1.365    !  4.530
assign ( resid   84  and name    HN  )  ( resid  84  and name   HG2#  )     2.595    0.795    0.795    !  3.390
assign ( resid   84  and name    HN  )  ( resid  86  and name     HN  )     3.215    1.415    1.415    !  4.630
assign ( resid   84  and name    HN  )  ( resid  85  and name     HN  )     2.790    0.990    0.990    !  3.780
assign ( resid   84  and name    HA  )  ( resid  89  and name     HN  )     2.960    1.160    1.160    !  4.120
assign ( resid   84  and name    HN  )  ( resid  84  and name   HG1#  )     2.475    0.675    0.675    !  3.150
assign ( resid   84  and name    HA  )  ( resid  89  and name    HB#  )     3.395    1.595    1.595    !  4.990
assign ( resid   84  and name  HG2#  )  ( resid  91  and name    HG#  )     2.775    0.975    0.975    !  3.750
assign ( resid   84  and name  HG1#  )  ( resid  85  and name     HN  )     2.660    0.860    0.860    !  3.520
assign ( resid   84  and name  HG1#  )  ( resid  89  and name    HB#  )     3.490    1.690    1.690    !  5.180
assign ( resid   84  and name    HA  )  ( resid  87  and name     HN  )     3.650    1.850    1.850    !  5.500 ! added (10/1)

assign ( resid   85  and name    HA  )  ( resid  85  and name     HG  )     2.100    0.300    0.300    !  2.400
assign ( resid   85  and name    HN  )  ( resid  85  and name     HG  )     2.955    1.155    1.155    !  4.110
assign ( resid   85  and name   HB1  )  ( resid  86  and name     HN  )     3.050    1.250    1.250    !  4.300
assign ( resid   85  and name    HG  )  ( resid  86  and name     HN  )     3.565    1.765    1.765    !  5.330
assign ( resid   85  and name    HN  )  ( resid  86  and name     HN  )     2.715    0.915    0.915    !  3.630
assign ( resid   85  and name   HB2  )  ( resid  86  and name     HN  )     3.050    1.250    1.250    !  4.300
assign ( resid   85  and name    HN  )  ( resid  85  and name    HB#  )     2.260    0.460    0.460    !  2.720
assign ( resid   85  and name    HA  )  ( resid  85  and name    HD#  )     2.395    0.595    0.595    !  2.990
assign ( resid   85  and name   HB#  )  ( resid  86  and name     HN  )     2.620    0.820    0.820    !  3.440

assign ( resid   86  and name   HB#  )  ( resid  88  and name   HD1#  )     2.915    1.115    1.115    !  4.030
assign ( resid   86  and name    HN  )  ( resid  88  and name   HD1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   86  and name    HN  )  ( resid  86  and name    HB#  )     2.290    0.490    0.490    !  2.780
assign ( resid   86  and name    HN  )  ( resid  87  and name     HN  )     2.725    0.925    0.925    !  3.650
assign ( resid   86  and name   HB#  )  ( resid  87  and name     HN  )     2.815    1.015    1.015    !  3.830
assign ( resid   86  and name   HB#  )  ( resid  88  and name     HN  )     3.000    1.200    1.200    !  4.200
assign ( resid   86  and name    HN  )  ( resid  89  and name     HN  )     3.475    1.675    1.675    !  5.150
assign ( resid   86  and name    HN  )  ( resid  88  and name     HN  )     3.220    1.420    1.420    !  4.640
assign ( resid   86  and name    HN  )  ( resid  87  and name     HA  )     3.235    1.435    1.435    !  4.670

assign ( resid   87  and name    HN  )  ( resid  88  and name     HA  )     3.345    1.545    1.545    !  4.890
assign ( resid   87  and name   HB#  )  ( resid  110  and name    HG2 )     2.845    1.045    1.045    !  3.890
assign ( resid   87  and name   HB#  )  ( resid  110  and name    HG1 )     3.005    1.205    1.205    !  4.210
assign ( resid   87  and name   HB#  )  ( resid  88  and name     HB  )     3.615    1.815    1.815    !  5.430
assign ( resid   87  and name   HB#  )  ( resid  110  and name    HB1 )     3.210    1.410    1.410    !  4.620
assign ( resid   87  and name    HN  )  ( resid  87  and name    HG2  )     3.510    1.710    1.710    !  5.220
assign ( resid   87  and name    HN  )  ( resid  87  and name    HG1  )     3.170    1.370    1.370    !  4.540
assign ( resid   87  and name    HN  )  ( resid  88  and name   HD1#  )     3.650    1.850    1.850    !  5.500
assign ( resid   87  and name   HB#  )  ( resid  110  and name    HE# )     3.500    1.700    1.700    !  5.200
assign ( resid   87  and name    HA  )  ( resid  87  and name    HG1  )     2.325    0.525    0.525    !  2.850
assign ( resid   87  and name    HA  )  ( resid  87  and name    HG2  )     2.520    0.720    0.720    !  3.240
assign ( resid   87  and name    HN  )  ( resid  110  and name    HB2 )     3.650    1.850    1.850    !  5.500
assign ( resid   87  and name    HN  )  ( resid  89  and name     HN  )     2.995    1.195    1.195    !  4.190
assign ( resid   87  and name    HA  )  ( resid  89  and name     HN  )     3.000    1.200    1.200    !  4.200
assign ( resid   87  and name    HN  )  ( resid  88  and name     HN  )     2.780    0.980    0.980    !  3.760
assign ( resid   87  and name    HN  )  ( resid  88  and name     HB  )     2.855    1.055    1.055    !  3.910
assign ( resid   87  and name   HG2  )  ( resid  109  and name     HN )     3.145    1.345    1.345    !  4.490
assign ( resid   87  and name   HB#  )  ( resid  109  and name     HN )     3.265    1.465    1.465    !  4.730
assign ( resid   87  and name   HB#  )  ( resid  88  and name     HN  )     3.275    1.475    1.475    !  4.750
assign ( resid   87  and name   HB#  )  ( resid  110  and name     HN )     2.885    1.085    1.085    !  3.970
assign ( resid   87  and name    HN  )  ( resid  87  and name    HB#  )     2.780    0.980    0.980    !  3.760
assign ( resid   87  and name    HN  )  ( resid  89  and name    HD#  )     3.480    1.680    1.680    !  5.160
assign ( resid   87  and name   HB#  )  ( resid  109  and name   HD2# )     3.125    1.325    1.325    !  4.450
assign ( resid   87  and name   HG1  )  ( resid  109  and name   HD2# )     3.570    1.770    1.770    !  5.340

assign ( resid   88  and name    HA  )  ( resid  88  and name   HD1#  )     2.960    1.160    1.160    !  4.120
assign ( resid   88  and name    HA  )  ( resid  88  and name   HG2#  )     2.830    1.030    1.030    !  3.860
assign ( resid   88  and name    HA  )  ( resid  88  and name   HG11  )     3.005    1.205    1.205    !  4.210
assign ( resid   88  and name    HA  )  ( resid  110  and name    HB2 )     2.950    1.150    1.150    !  4.100
assign ( resid   88  and name    HB  )  ( resid  88  and name   HD1#  )     2.585    0.785    0.785    !  3.370
assign ( resid   88  and name  HG2#  )  ( resid  111  and name     HA )     2.590    0.790    0.790    !  3.380
assign ( resid   88  and name  HG2#  )  ( resid  111  and name    HB# )     2.925    1.125    1.125    !  4.050
assign ( resid   88  and name    HA  )  ( resid  111  and name    HB# )     3.285    1.485    1.485    !  4.770
assign ( resid   88  and name    HA  )  ( resid  111  and name     HA )     3.110    1.310    1.310    !  4.420
assign ( resid   88  and name    HN  )  ( resid  88  and name   HG2#  )     3.435    1.635    1.635    !  5.070
assign ( resid   88  and name  HG2#  )  ( resid  88  and name   HD1#  )     2.990    1.190    1.190    !  4.180
assign ( resid   88  and name  HG2#  )  ( resid  88  and name   HG12  )     2.410    0.610    0.610    !  3.020
assign ( resid   88  and name  HG2#  )  ( resid  89  and name     HN  )     3.020    1.220    1.220    !  4.240
assign ( resid   88  and name  HD1#  )  ( resid  89  and name     HN  )     3.575    1.775    1.775    !  5.350
assign ( resid   88  and name  HG11  )  ( resid  110  and name    HB1 )     3.115    1.315    1.315    !  4.430
assign ( resid   88  and name  HG11  )  ( resid  110  and name    HB2 )     3.220    1.420    1.420    !  4.640
assign ( resid   88  and name  HG2#  )  ( resid  89  and name    HD#  )     2.195    0.395    0.395    !  2.590
assign ( resid   88  and name    HA  )  ( resid  110  and name    HB1 )     2.755    0.955    0.955    !  3.710
assign ( resid   88  and name  HG2#  )  ( resid  89  and name     HG  )     3.650    1.850    1.850    !  5.500
assign ( resid   88  and name    HN  )  ( resid  89  and name     HN  )     2.670    0.870    0.870    !  3.540
assign ( resid   88  and name    HN  )  ( resid  88  and name   HG11  )     2.730    0.930    0.930    !  3.660
assign ( resid   88  and name    HA  )  ( resid  110  and name     HN )     2.965    1.165    1.165    !  4.130
assign ( resid   88  and name    HN  )  ( resid  110  and name    HG1 )     3.220    1.420    1.420    !  4.640
assign ( resid   88  and name    HB  )  ( resid  89  and name     HN  )     2.685    0.885    0.885    !  3.570
assign ( resid   88  and name    HN  )  ( resid  88  and name     HB  )     2.625    0.825    0.825    !  3.450
assign ( resid   88  and name    HN  )  ( resid  88  and name   HD1#  )     2.140    0.340    0.340    !  2.480
assign ( resid   88  and name  HG2#  )  ( resid  111  and name     HN )     3.325    1.525    1.525    !  4.850
assign ( resid   88  and name    HA  )  ( resid  111  and name     HN )     2.940    1.140    1.140    !  4.080
assign ( resid   88  and name    HN  )  ( resid  110  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   88  and name  HG2#  )  ( resid  110  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   88  and name  HG11  )  ( resid  110  and name     HN )     3.650    1.850    1.850    !  5.500

assign ( resid   89  and name    HA  )  ( resid  107  and name     HA )     3.090    1.290    1.290    !  4.380
assign ( resid   89  and name   HD#  )  ( resid  107  and name     HA )     2.790    0.990    0.990    !  3.780
assign ( resid   89  and name    HN  )  ( resid  89  and name     HG  )     3.650    1.850    1.850    !  5.500
assign ( resid   89  and name   HD#  )  ( resid  90  and name    HB#  )     3.320    1.520    1.520    !  4.840
assign ( resid   89  and name    HA  )  ( resid  89  and name    HD#  )     3.650    1.850    1.850    !  5.500
assign ( resid   89  and name    HN  )  ( resid  89  and name    HD#  )     2.545    0.745    0.745    !  3.290
assign ( resid   89  and name    HN  )  ( resid  90  and name     HN  )     3.185    1.385    1.385    !  4.570
assign ( resid   89  and name   HB1  )  ( resid  90  and name     HN  )     3.050    1.250    1.250    !  4.300
assign ( resid   89  and name   HB2  )  ( resid  90  and name     HN  )     3.050    1.250    1.250    !  4.300
assign ( resid   89  and name   HD#  )  ( resid  90  and name     HN  )     2.510    0.710    0.710    !  3.220
assign ( resid   89  and name   HD#  )  ( resid  108  and name     HN )     3.145    1.345    1.345    !  4.490
assign ( resid   89  and name    HA  )  ( resid  90  and name     HN  )     2.515    0.715    0.715    !  3.230
assign ( resid   89  and name   HD#  )  ( resid  91  and name     HN  )     3.380    1.580    1.580    !  4.960
assign ( resid   89  and name    HA  )  ( resid  108  and name     HN )     2.795    0.995    0.995    !  3.790
assign ( resid   89  and name    HA  )  ( resid  108  and name    HA# )     3.570    1.770    1.770    !  5.340
assign ( resid   89  and name   HB#  )  ( resid  90  and name     HN  )     2.650    0.850    0.850    !  3.500
assign ( resid   89  and name   HB#  )  ( resid  105  and name   HG2# )     3.465    1.665    1.665    !  5.130
assign ( resid   89  and name   HD#  )  ( resid  106  and name    HB# )     3.570    1.770    1.770    !  5.340

assign ( resid   90  and name   HB#  )  ( resid  107  and name     HA )     3.475    1.675    1.675    !  5.150
assign ( resid   90  and name   HB#  )  ( resid  107  and name    HD# )     3.595    1.795    1.795    !  5.390
assign ( resid   90  and name   HB#  )  ( resid  108  and name    HA2 )     2.870    1.070    1.070    !  3.940
assign ( resid   90  and name   HB#  )  ( resid  107  and name     HN )     3.145    1.345    1.345    !  4.490
assign ( resid   90  and name   HB#  )  ( resid  108  and name    HA1 )     2.870    1.070    1.070    !  3.940
assign ( resid   90  and name    HN  )  ( resid  90  and name    HB#  )     2.625    0.825    0.825    !  3.450
assign ( resid   90  and name    HN  )  ( resid  106  and name     HN )     3.125    1.325    1.325    !  4.450
assign ( resid   90  and name    HA  )  ( resid  91  and name     HN  )     2.525    0.725    0.725    !  3.250
assign ( resid   90  and name   HB#  )  ( resid  91  and name     HN  )     2.750    0.950    0.950    !  3.700
assign ( resid   90  and name   HB#  )  ( resid  108  and name     HN )     3.215    1.415    1.415    !  4.630
assign ( resid   90  and name    HN  )  ( resid  108  and name     HN )     3.080    1.280    1.280    !  4.360
assign ( resid   90  and name    HN  )  ( resid  107  and name     HA )     3.185    1.385    1.385    !  4.570
assign ( resid   90  and name    HN  )  ( resid  91  and name     HN  )     3.420    1.620    1.620    !  5.040
assign ( resid   90  and name    HN  )  ( resid  105  and name   HG2# )     3.650    1.850    1.850    !  5.500 ! originally 4.62 (9/28)
assign ( resid   90  and name    HN  )  ( resid  106  and name    HB# )     3.225    1.425    1.425    !  4.650
assign ( resid   90  and name   HB#  )  ( resid  108  and name    HA# )     2.600    0.800    0.800    !  3.400

assign ( resid   91  and name    HA  )  ( resid  105  and name     HA )     2.920    1.120    1.120    !  4.040
assign ( resid   91  and name    HA  )  ( resid  106  and name     HN )     3.110    1.310    1.310    !  4.420
assign ( resid   91  and name    HA  )  ( resid  91  and name    HG2  )     3.025    1.225    1.225    !  4.250
assign ( resid   91  and name    HA  )  ( resid  91  and name    HG1  )     3.025    1.225    1.225    !  4.250
assign ( resid   91  and name    HA  )  ( resid  105  and name   HG1# )     3.590    1.790    1.790    !  5.380
assign ( resid   91  and name    HA  )  ( resid  105  and name   HG2# )     3.590    1.790    1.790    !  5.380
assign ( resid   91  and name    HA  )  ( resid  92  and name     HN  )     2.625    0.825    0.825    !  3.450
assign ( resid   91  and name    HA  )  ( resid  104  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   91  and name    HN  )  ( resid  106  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   91  and name    HN  )  ( resid  91  and name    HB#  )     2.450    0.650    0.650    !  3.100
assign ( resid   91  and name    HN  )  ( resid  91  and name    HG#  )     2.615    0.815    0.815    !  3.430
assign ( resid   91  and name    HA  )  ( resid  91  and name    HG#  )     2.695    0.895    0.895    !  3.590
assign ( resid   91  and name    HA  )  ( resid  105  and name   HG2# )     3.115    1.315    1.315    !  4.430
assign ( resid   91  and name   HB#  )  ( resid  92  and name     HN  )     2.595    0.795    0.795    !  3.390
assign ( resid   91  and name   HB#  )  ( resid  103  and name    HB# )     2.745    0.945    0.945    !  3.690
assign ( resid   91  and name   HB#  )  ( resid  104  and name     HN )     3.515    1.715    1.715    !  5.230
assign ( resid   91  and name   HG#  )  ( resid  92  and name     HN  )     3.215    1.415    1.415    !  4.630

assign ( resid   92  and name    HA  )  ( resid  92  and name    HB#  )     2.245    0.445    0.445    !  2.690
assign ( resid   92  and name    HA  )  ( resid  93  and name     HN  )     2.595    0.795    0.795    !  3.390
assign ( resid   92  and name    HN  )  ( resid  104  and name     HN )     2.920    1.120    1.120    !  4.040
assign ( resid   92  and name    HN  )  ( resid  92  and name    HB#  )     2.745    0.945    0.945    !  3.690
assign ( resid   92  and name   HB#  )  ( resid  93  and name     HN  )     2.765    0.965    0.965    !  3.730
assign ( resid   92  and name   HB#  )  ( resid  104  and name     HN )     3.100    1.300    1.300    !  4.400
assign ( resid   92  and name    HN  )  ( resid  93  and name     HN  )     3.140    1.340    1.340    !  4.480
assign ( resid   92  and name    HN  )  ( resid  103  and name    HB# )     3.410    1.610    1.610    !  5.020
assign ( resid   92  and name    HN  )  ( resid  106  and name     HN )     3.650    1.850    1.850    !  5.500 
assign ( resid   92  and name    HN  )  ( resid  105  and name   HG2# )     3.620    1.820    1.820    !  5.440
assign ( resid   92  and name    HN  )  ( resid  106  and name    HG# )     3.270    1.470    1.470    !  4.740
assign ( resid   92  and name   HB#  )  ( resid  106  and name    HG# )     3.180    1.380    1.380    !  4.560

assign ( resid   93  and name    HA  )  ( resid  104  and name     HN )     3.040    1.240    1.240    !  4.280
assign ( resid   93  and name    HA  )  ( resid  93  and name    HD#  )     2.795    0.995    0.995    !  3.790
assign ( resid   93  and name    HA  )  ( resid  94  and name    HB#  )     3.170    1.370    1.370    !  4.540
assign ( resid   93  and name    HA  )  ( resid  103  and name     HA )     2.810    1.010    1.010    !  3.820
assign ( resid   93  and name   HD#  )  ( resid  103  and name     HA )     3.110    1.310    1.310    !  4.420
assign ( resid   93  and name   HB1  )  ( resid  93  and name    HD#  )     2.685    0.885    0.885    !  3.570
assign ( resid   93  and name   HB2  )  ( resid  93  and name    HD#  )     2.600    0.800    0.800    !  3.400
assign ( resid   93  and name    HA  )  ( resid  103  and name    HB# )     2.830    1.030    1.030    !  3.860
assign ( resid   93  and name   HD#  )  ( resid  103  and name    HB# )     2.645    0.845    0.845    !  3.490
assign ( resid   93  and name   HB2  )  ( resid  94  and name     HN  )     3.185    1.385    1.385    !  4.570
assign ( resid   93  and name    HA  )  ( resid  103  and name     HN )     3.650    1.850    1.850    !  5.500 ! originally 4.62 (10/1)
assign ( resid   93  and name    HN  )  ( resid  93  and name    HB2  )     2.585    0.785    0.785    !  3.370
assign ( resid   93  and name    HN  )  ( resid  93  and name     HG  )     2.780    0.980    0.980    !  3.760
assign ( resid   93  and name    HN  )  ( resid  93  and name    HB1  )     2.805    1.005    1.005    !  3.810
assign ( resid   93  and name   HD#  )  ( resid  104  and name     HN )     3.530    1.730    1.730    !  5.260
assign ( resid   93  and name    HA  )  ( resid  94  and name     HN  )     2.485    0.685    0.685    !  3.170
assign ( resid   93  and name   HD#  )  ( resid  94  and name     HN  )     3.175    1.375    1.375    !  4.550
assign ( resid   93  and name   HB1  )  ( resid  94  and name     HN  )     2.645    0.845    0.845    !  3.490
assign ( resid   93  and name    HN  )  ( resid  93  and name    HD#  )     2.850    1.050    1.050    !  3.900
assign ( resid   93  and name    HN  )  ( resid  94  and name     HN  )     3.280    1.480    1.480    !  4.760
assign ( resid   93  and name   HD#  )  ( resid  103  and name     HN )     3.050    1.250    1.250    !  4.300

assign ( resid   94  and name   HD#  )  ( resid  102  and name   HG2# )     3.520    1.720    1.720    !  5.240
 
assign ( resid   94  and name   HB#  )  ( resid  102  and name   HG2# )     3.490    1.690    1.690    !  5.180
assign ( resid   94  and name    HN  )  ( resid  102  and name     HN )     3.255    1.455    1.455    !  4.710
assign ( resid   94  and name    HN  )  ( resid  94  and name    HB#  )     2.705    0.905    0.905    !  3.610
assign ( resid   94  and name   HB#  )  ( resid  95  and name     HN  )     2.850    1.050    1.050    !  3.900
assign ( resid   94  and name    HN  )  ( resid  102  and name   HG2# )     3.650    1.850    1.850    !  5.500
assign ( resid   94  and name    HN  )  ( resid  94  and name    HD#  )     3.130    1.330    1.330    !  4.460
assign ( resid   94  and name    HN  )  ( resid  95  and name   HG2#  )     3.500    1.700    1.700    !  5.200
assign ( resid   94  and name    HN  )  ( resid  103  and name     HA )     3.000    1.200    1.200    !  4.200
assign ( resid   94  and name   HB#  )  ( resid  102  and name     HN )     2.995    1.195    1.195    !  4.190
assign ( resid   94  and name    HN  )  ( resid  103  and name    HB# )     3.125    1.325    1.325    !  4.450
assign ( resid   94  and name    HN  )  ( resid  95  and name     HN  )     3.030    1.230    1.230    !  4.260
assign ( resid   94  and name    HN  )  ( resid  104  and name     HN )     3.580    1.780    1.780    !  5.360
assign ( resid   94  and name    HN  )  ( resid  104  and name    HD# )     3.565    1.765    1.765    !  5.330
assign ( resid   94  and name    HN  )  ( resid  104  and name    HE# )     3.365    1.565    1.565    !  4.930
assign ( resid   94  and name   HB#  )  ( resid  104  and name    HD# )     3.045    1.245    1.245    !  4.290
assign ( resid   94  and name   HD#  )  ( resid  95  and name     HN  )     2.875    1.075    1.075    !  3.950
assign ( resid   94  and name   HD#  )  ( resid  102  and name     HA )     3.650    1.850    1.850    !  5.500
assign ( resid   94  and name   HB#  )  ( resid  104  and name    HE# )     2.500    0.700    0.700    !  3.200
assign ( resid   94  and name   HD#  )  ( resid  104  and name    HE# )     3.075    1.275    1.275    !  4.350

assign ( resid   95  and name    HA  )  ( resid  95  and name   HG2#  )     2.560    0.760    0.760    !  3.320
assign ( resid   95  and name  HG2#  )  ( resid  95  and name   HG12  )     2.800    1.000    1.000    !  3.800
assign ( resid   95  and name  HD1#  )  ( resid  101  and name     HA )     2.955    1.155    1.155    !  4.110
assign ( resid   95  and name    HA  )  ( resid  95  and name   HD1#  )     2.835    1.035    1.035    !  3.870
assign ( resid   95  and name    HB  )  ( resid  95  and name   HD1#  )     2.705    0.905    0.905    !  3.610
assign ( resid   95  and name  HG2#  )  ( resid  100  and name     HN )     3.240    1.440    1.440    !  4.680
assign ( resid   95  and name    HA  )  ( resid  101  and name    HB# )     3.065    1.265    1.265    !  4.330
assign ( resid   95  and name  HD1#  )  ( resid  101  and name    HB# )     2.500    0.700    0.900    !  3.400 originally 3.06 (08/29)
assign ( resid   95  and name    HA  )  ( resid  101  and name     HA )     3.050    1.250    1.250    !  4.300
assign ( resid   95  and name  HG2#  )  ( resid  99  and name     HA  )     2.595    0.795    0.795    !  3.390
assign ( resid   95  and name  HD1#  )  ( resid  102  and name     HN )     3.455    1.655    1.655    !  5.110
assign ( resid   95  and name    HN  )  ( resid  95  and name   HD1#  )     3.125    1.325    1.325    !  4.450
assign ( resid   95  and name  HG2#  )  ( resid  95  and name   HG11  )     2.800    1.000    1.000    !  3.800
assign ( resid   95  and name  HD1#  )  ( resid  96  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   95  and name  HD1#  )  ( resid  101  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   95  and name    HN  )  ( resid  95  and name   HG11  )     3.330    1.530    1.530    !  4.860
assign ( resid   95  and name    HN  )  ( resid  95  and name   HG12  )     3.330    1.530    1.530    !  4.860
assign ( resid   95  and name    HA  )  ( resid  96  and name     HN  )     2.445    0.645    0.645    !  3.090
assign ( resid   95  and name    HA  )  ( resid  102  and name     HN )     3.065    1.265    1.265    !  4.330
assign ( resid   95  and name    HN  )  ( resid  95  and name     HB  )     2.610    0.810    0.810    !  3.420
assign ( resid   95  and name    HN  )  ( resid  95  and name   HG2#  )     2.800    1.000    1.000    !  3.800
assign ( resid   95  and name    HA  )  ( resid  101  and name     HN )     3.650    1.850    1.850    !  5.500 ! originally 3.66 (10/1)
assign ( resid   95  and name  HG2#  )  ( resid  99  and name     HN  )     3.215    1.415    1.415    !  4.630
assign ( resid   95  and name    HN  )  ( resid  96  and name     HN  )     3.280    1.480    1.480    !  4.760
assign ( resid   95  and name  HG2#  )  ( resid  96  and name     HN  )     2.655    0.855    0.855    !  3.510
assign ( resid   95  and name  HG2#  )  ( resid  101  and name     HN )     3.650    1.850    1.850    !  5.500 originally 4.86 (08/29)
assign ( resid   95  and name    HN  )  ( resid  95  and name   HG1#  )     2.935    1.135    1.135    !  4.070
assign ( resid   95  and name    HA  )  ( resid  95  and name   HG1#  )     2.670    0.870    0.870    !  3.540
assign ( resid   95  and name  HG2#  )  ( resid  95  and name   HG1#  )     2.455    0.655    0.655    !  3.110
assign ( resid   95  and name  HG1#  )  ( resid  96  and name     HN  )     2.330    0.530    0.530    !  2.860
assign ( resid   95  and name  HG1#  )  ( resid  99  and name     HA  )     3.035    1.235    1.235    !  4.270
assign ( resid   95  and name  HG1#  )  ( resid  101  and name     HN )     2.580    0.780    0.780    !  3.360
assign ( resid   95  and name  HG1#  )  ( resid  101  and name    HB# )     2.795    0.995    0.995    !  3.790
assign ( resid   95  and name  HG1#  )  ( resid  102  and name     HN )     3.380    1.580    1.580    !  4.960
assign ( resid   95  and name  HD1#  )  ( resid  98  and name    HB#  )     3.570    1.770    1.770    !  5.340
assign ( resid   95  and name  HD1#  )  ( resid  99  and name    HB#  )     3.570    1.770    1.770    !  5.340

assign ( resid   96  and name    HA  )  ( resid  97  and name    HB#  )     3.310    1.510    1.510    !  4.820
assign ( resid   96  and name   HB1  )  ( resid  97  and name    HB#  )     3.650    1.850    1.850    !  5.500
assign ( resid   96  and name   HB2  )  ( resid  97  and name    HB#  )     2.905    1.105    1.100    !  4.005
assign ( resid   96  and name   HB2  )  ( resid  97  and name     HN  )     2.325    0.525    0.525    !  2.850
assign ( resid   96  and name   HB1  )  ( resid  97  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid   96  and name    HN  )  ( resid  96  and name    HB1  )     2.945    1.145    1.145    !  4.090
assign ( resid   96  and name    HN  )  ( resid  96  and name    HB2  )     2.810    1.010    1.010    !  3.820
assign ( resid   96  and name   HB2  )  ( resid  96  and name   HD22  )     2.900    1.100    1.100    !  4.000
assign ( resid   96  and name    HN  )  ( resid  100  and name     HN )     3.125    1.325    1.325    !  4.450
assign ( resid   96  and name   HB1  )  ( resid  98  and name     HN  )     3.465    1.665    1.665    !  5.130
assign ( resid   96  and name    HN  )  ( resid  102  and name     HN )     3.650    1.850    1.850    !  5.500
assign ( resid   96  and name    HN  )  ( resid  100  and name    HB# )     3.255    1.455    1.455    !  4.710
assign ( resid   96  and name    HN  )  ( resid  101  and name     HN )     3.650    1.850    1.850    !  5.500 !originally 4.72 (10/2) 
assign ( resid   96  and name  HD22  )  ( resid  100  and name    HB# )     2.780    0.980    0.980    !  3.760
assign ( resid   96  and name   HB2  )  ( resid  96  and name   HD21  )     2.100    0.300    0.300    !  2.400
assign ( resid   96  and name  HD21  )  ( resid  100  and name    HB# )     3.085    1.285    1.285    !  4.370
assign ( resid   96  and name  HD21  )  ( resid  97  and name    HB#  )     3.650    1.850    1.850    !  5.500

assign ( resid   97  and name   HB#  )  ( resid  98  and name     HN  )     2.920    1.120    1.120    !  4.040
assign ( resid   97  and name    HN  )  ( resid  97  and name    HB#  )     2.865    1.065    1.065    !  3.930
assign ( resid   97  and name    HN  )  ( resid  98  and name     HN  )     2.835    1.035    1.035    !  3.870
assign ( resid   97  and name   HB#  )  ( resid  98  and name    HB#  )     3.310    1.510    1.510    !  4.820

assign ( resid   98  and name    HN  )  ( resid  98  and name    HB1  )     2.805    1.005    1.005    !  3.810
assign ( resid   98  and name   HB1  )  ( resid  99  and name     HN  )     3.325    1.525    1.525    !  4.850
assign ( resid   98  and name   HB2  )  ( resid  99  and name     HN  )     3.325    1.525    1.525    !  4.850
assign ( resid   98  and name    HN  )  ( resid  98  and name    HB2  )     2.805    1.005    1.005    !  3.810
assign ( resid   98  and name    HN  )  ( resid  99  and name     HN  )     3.045    1.245    1.245    !  4.290
assign ( resid   98  and name   HB1  )  ( resid  98  and name   HD21  )     2.810    1.010    1.010    !  3.820
assign ( resid   98  and name   HB2  )  ( resid  98  and name   HD21  )     2.810    1.010    1.010    !  3.820
assign ( resid   98  and name   HB1  )  ( resid  98  and name   HD22  )     2.810    1.010    1.010    !  3.820
assign ( resid   98  and name   HB2  )  ( resid  98  and name   HD22  )     2.810    1.010    1.010    !  3.820
assign ( resid   98  and name    HN  )  ( resid  98  and name    HB#  )     2.375    0.575    0.575    !  2.950
assign ( resid   98  and name   HB#  )  ( resid  98  and name   HD2#  )     2.345    0.545    0.545    !  2.890
assign ( resid   98  and name   HB#  )  ( resid  99  and name     HN  )     2.885    1.085    1.085    !  3.970
assign ( resid   98  and name   HB#  )  ( resid  100  and name    HB# )     3.215    1.415    1.415    !  4.630
assign ( resid   98  and name   HB#  )  ( resid  100  and name    HG# )     2.915    1.115    1.115    !  4.030
assign ( resid   98  and name   HB#  )  ( resid  100  and name   HE2# )     2.905    1.105    1.105    !  4.010
 
assign ( resid   98  and name  HD2#  )  ( resid  100  and name    HG# )     3.145    1.345    1.345    !  4.490
 

assign ( resid   99  and name    HN  )  ( resid  99  and name    HB2  )     2.980    1.180    1.180    !  4.160
assign ( resid   99  and name    HA  )  ( resid  100  and name     HN )     2.625    0.825    0.825    !  3.450
assign ( resid   99  and name    HN  )  ( resid  99  and name    HB1  )     2.980    1.180    1.180    !  4.160
assign ( resid   99  and name    HN  )  ( resid  100  and name     HN )     2.470    0.670    0.670    !  3.140
assign ( resid   99  and name    HN  )  ( resid  100  and name    HB# )     3.245    1.445    1.445    !  4.690
assign ( resid   99  and name    HN  )  ( resid  100  and name    HG# )     3.185    1.385    1.385    !  4.570
assign ( resid   99  and name    HN  )  ( resid  99  and name    HB#  )     2.690    0.890    0.890    !  3.580

assign ( resid  100  and name    HA  )  ( resid  100  and name    HG# )     2.775    0.975    0.975    !  3.750
assign ( resid  100  and name   HB#  )  ( resid  101  and name     HN )     2.635    0.835    0.835    !  3.470
assign ( resid  100  and name    HN  )  ( resid  101  and name     HN )     2.980    1.180    1.180    !  4.160
assign ( resid  100  and name    HN  )  ( resid  100  and name    HG# )     2.620    0.820    0.820    !  3.440
assign ( resid  100  and name    HN  )  ( resid  100  and name    HB# )     2.445    0.645    0.645    !  3.090

assign ( resid  101  and name   HB#  )  ( resid  102  and name     HA )     3.170    1.370    1.370    !  4.540
assign ( resid  101  and name    HA  )  ( resid  102  and name   HG2# )     3.650    1.850    1.850    !  5.500
assign ( resid  101  and name    HN  )  ( resid  101  and name    HB# )     2.485    0.685    0.685    !  3.170
assign ( resid  101  and name   HB#  )  ( resid  102  and name     HN )     2.715    0.915    0.915    !  3.630
assign ( resid  101  and name    HA  )  ( resid  102  and name     HN )     2.530    0.730    0.730    !  3.260
assign ( resid  101  and name    HN  )  ( resid  102  and name     HN )     3.170    1.370    1.370    !  4.540

assign ( resid  102  and name    HA  )  ( resid  102  and name   HD1# )     2.810    1.010    1.010    !  3.820
assign ( resid  102  and name  HG2#  )  ( resid  102  and name   HG12 )     2.800    1.000    1.000    !  3.800
assign ( resid  102  and name  HG2#  )  ( resid  102  and name   HD1# )     2.455    0.655    0.655    !  3.110
assign ( resid  102  and name  HG2#  )  ( resid  102  and name   HG11 )     2.800    1.000    1.000    !  3.800
assign ( resid  102  and name    HA  )  ( resid  102  and name   HG2# )     2.790    0.990    0.990    !  3.780
assign ( resid  102  and name    HN  )  ( resid  102  and name   HG2# )     2.430    0.630    0.630    !  3.060
assign ( resid  102  and name  HG2#  )  ( resid  104  and name    HD# )     3.555    1.755    1.755    !  5.310
assign ( resid  102  and name    HB  )  ( resid  102  and name   HD1# )     2.550    0.750    0.750    !  3.300
assign ( resid  102  and name    HA  )  ( resid  102  and name   HG12 )     2.965    1.165    1.165    !  4.130
assign ( resid  102  and name    HA  )  ( resid  102  and name   HG11 )     2.965    1.165    1.165    !  4.130
assign ( resid  102  and name  HG11  )  ( resid  103  and name     HN )     3.440    1.640    1.640    !  5.080
assign ( resid  102  and name    HA  )  ( resid  103  and name    HB# )     3.125    1.325    1.325    !  4.450
assign ( resid  102  and name  HG2#  )  ( resid  104  and name    HB# )     3.650    1.850    1.850    !  5.500
assign ( resid  102  and name    HN  )  ( resid  102  and name   HD1# )     3.340    1.540    1.540    !  4.880
assign ( resid  102  and name    HN  )  ( resid  102  and name     HB )     2.825    1.025    1.025    !  3.850
assign ( resid  102  and name    HB  )  ( resid  103  and name     HN )     3.115    1.315    1.315    !  4.430
assign ( resid  102  and name  HG2#  )  ( resid  103  and name     HN )     2.700    0.900    0.900    !  3.600
assign ( resid  102  and name    HN  )  ( resid  103  and name     HN )     3.140    1.340    1.340    !  4.480
assign ( resid  102  and name    HA  )  ( resid  103  and name     HN )     2.505    0.705    0.705    !  3.210
assign ( resid  102  and name  HG12  )  ( resid  103  and name     HN )     3.440    1.640    1.640    !  5.080
assign ( resid  102  and name  HD1#  )  ( resid  103  and name     HN )     3.160    1.360    1.360    !  4.520
assign ( resid  102  and name  HG2#  )  ( resid  104  and name    HE# )     2.355    0.555    0.555    !  2.910
assign ( resid  102  and name    HN  )  ( resid  102  and name   HG1# )     3.185    1.385    1.385    !  4.570
assign ( resid  102  and name    HA  )  ( resid  102  and name   HG1# )     2.670    0.870    0.870    !  3.540
assign ( resid  102  and name  HG2#  )  ( resid  102  and name   HG1# )     2.545    0.745    0.745    !  3.290
assign ( resid  102  and name  HG1#  )  ( resid  103  and name     HN )     3.090    1.290    1.290    !  4.380

assign ( resid  103  and name    HA  )  ( resid  104  and name     HN  )     2.430    0.630    0.630    !  3.060
assign ( resid  103  and name   HB#  )  ( resid  104  and name     HN  )     2.705    0.905    0.905    !  3.610
assign ( resid  103  and name    HN  )  ( resid  103  and name    HB#  )     2.460    0.660    0.660    !  3.120
assign ( resid  103  and name    HN  )  ( resid  104  and name     HN  )     3.280    1.480    1.480    !  4.760

assign ( resid  104  and name    HA  )  ( resid  105  and name     HB  )     3.345    1.545    1.545    !  4.890
assign ( resid  104  and name    HA  )  ( resid  104  and name    HB#  )     2.235    0.435    0.435    !  2.670
assign ( resid  104  and name    HN  )  ( resid  104  and name    HB#  )     2.740    0.940    0.940    !  3.680
assign ( resid  104  and name   HD#  )  ( resid  105  and name     HN  )     3.160    1.360    1.360    !  4.520
assign ( resid  104  and name    HN  )  ( resid  104  and name    HE#  )     3.580    1.780    1.780    !  5.360
assign ( resid  104  and name   HB#  )  ( resid  105  and name     HN  )     2.690    0.890    0.890    !  3.580
assign ( resid  104  and name    HA  )  ( resid  104  and name    HD#  )     2.810    1.010    1.010    !  3.820
assign ( resid  104  and name    HN  )  ( resid  104  and name    HD#  )     2.845    1.045    1.045    !  3.890
assign ( resid  104  and name    HA  )  ( resid  105  and name   HG2#  )     3.445    1.645    1.645    !  5.090

assign ( resid  105  and name    HN  )  ( resid  105  and name     HB  )     2.645    0.845    0.845    !  3.490
assign ( resid  105  and name    HA  )  ( resid  106  and name     HN  )     2.370    0.570    0.570    !  2.940
assign ( resid  105  and name    HN  )  ( resid  105  and name   HG2#  )     2.320    0.520    0.520    !  2.840
assign ( resid  105  and name  HG2#  )  ( resid  106  and name     HN  )     2.505    0.705    0.705    !  3.210

assign ( resid  106  and name    HA  )  ( resid  107  and name    HD#  )     3.075    1.275    1.275    !  4.350
assign ( resid  106  and name    HN  )  ( resid  106  and name    HG1  )     3.150    1.350    1.350    !  4.500
assign ( resid  106  and name    HN  )  ( resid  106  and name    HG2  )     3.150    1.350    1.350    !  4.500
assign ( resid  106  and name    HA  )  ( resid  107  and name     HG  )     3.635    1.835    1.835    !  5.470
assign ( resid  106  and name    HA  )  ( resid  107  and name     HN  )     2.680    0.880    0.880    !  3.560
assign ( resid  106  and name    HN  )  ( resid  107  and name     HN  )     3.530    1.730    1.730    !  5.260
assign ( resid  106  and name    HN  )  ( resid  106  and name    HB#  )     2.665    0.865    0.865    !  3.530
assign ( resid  106  and name    HN  )  ( resid  106  and name    HG#  )     2.770    0.970    0.970    !  3.740
assign ( resid  106  and name   HB#  )  ( resid  106  and name    HG#  )     2.015    0.215    0.215    !  2.230
assign ( resid  106  and name   HB#  )  ( resid  107  and name     HN  )     2.510    0.710    0.710    !  3.220
assign ( resid  106  and name   HB#  )  ( resid  107  and name     HA  )     3.290    1.490    1.490    !  4.780
assign ( resid  106  and name   HB#  )  ( resid  107  and name    HD#  )     3.130    1.330    1.330    !  4.460
assign ( resid  106  and name   HG#  )  ( resid  107  and name     HN  )     3.075    1.275    1.275    !  4.350

assign ( resid  107  and name    HA  )  ( resid  107  and name    HD#  )     2.900    1.100    1.100    !  4.000
assign ( resid  107  and name    HA  )  ( resid  107  and name    HB#  )     2.245    0.445    0.445    !  2.690
assign ( resid  107  and name   HD#  )  ( resid  111  and name    HB#  )     2.340    0.540    0.540    !  2.880
assign ( resid  107  and name    HG  )  ( resid  111  and name    HB#  )     2.805    1.005    1.005    !  3.810
assign ( resid  107  and name    HA  )  ( resid  111  and name    HB#  )     3.215    1.415    1.415    !  4.630
assign ( resid  107  and name    HN  )  ( resid  107  and name    HB#  )     2.435    0.635    0.635    !  3.070
assign ( resid  107  and name    HN  )  ( resid  108  and name     HN  )     3.380    1.580    1.580    !  4.960
assign ( resid  107  and name   HD#  )  ( resid  108  and name     HN  )     3.315    1.515    1.515    !  4.830
assign ( resid  107  and name   HD#  )  ( resid  112  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid  107  and name    HN  )  ( resid  107  and name    HD#  )     2.790    0.990    0.990    !  3.780
assign ( resid  107  and name    HN  )  ( resid  107  and name     HG  )     3.005    1.205    1.205    !  4.210
assign ( resid  107  and name    HG  )  ( resid  108  and name     HN  )     3.320    1.520    1.520    !  4.840
assign ( resid  107  and name   HB#  )  ( resid  108  and name     HN  )     2.900    1.100    1.100    !  4.000

assign ( resid  108  and name    HN  )  ( resid  109  and name     HN  )     3.300    1.500    1.500    !  4.800
assign ( resid  108  and name    HN  )  ( resid  111  and name    HB#  )     3.050    1.250    1.250    !  4.300

assign ( resid  109  and name    HN  )  ( resid  110  and name     HN  )     3.065    1.265    1.265    !  4.330
assign ( resid  109  and name    HN  )  ( resid  111  and name    HB#  )     3.405    1.605    1.605    !  5.010
assign ( resid  109  and name   HB#  )  ( resid  109  and name   HD2#  )     2.465    0.665    0.665    !  3.130
assign ( resid  109  and name   HB#  )  ( resid  110  and name     HN  )     3.100    1.300    1.300    !  4.400
assign ( resid  109  and name   HB#  )  ( resid  111  and name     HN  )     3.570    1.770    1.770    !  5.340
assign ( resid  109  and name  HD2#  )  ( resid  110  and name     HN  )     3.515    1.715    1.715    !  5.230
assign ( resid  109  and name  HD2#  )  ( resid  110  and name    HG2  )     3.570    1.770    1.770    !  5.340

assign ( resid  110  and name    HN  )  ( resid  110  and name    HG1  )     3.040    1.240    1.240    !  4.280
assign ( resid  110  and name   HB1  )  ( resid  113  and name     HB  )     3.410    1.610    1.610    !  5.020
assign ( resid  110  and name   HG2  )  ( resid  110  and name    HE#  )     2.880    1.080    1.080    !  3.960
assign ( resid  110  and name    HA  )  ( resid  110  and name    HG2  )     3.025    1.225    1.225    !  4.250
assign ( resid  110  and name    HA  )  ( resid  110  and name    HB1  )     2.295    0.495    0.495    !  2.790
assign ( resid  110  and name   HG1  )  ( resid  110  and name    HE#  )     2.100    0.300    0.300    !  2.400
assign ( resid  110  and name    HA  )  ( resid  110  and name    HG1  )     2.915    1.115    1.115    !  4.030
assign ( resid  110  and name   HB2  )  ( resid  110  and name    HE#  )     3.585    1.785    1.785    !  5.370
assign ( resid  110  and name    HN  )  ( resid  110  and name    HB2  )     2.535    0.735    0.735    !  3.270
assign ( resid  110  and name   HB2  )  ( resid  111  and name     HN  )     2.915    1.115    1.115    !  4.030
assign ( resid  110  and name    HN  )  ( resid  111  and name     HN  )     2.635    0.835    0.835    !  3.470
assign ( resid  110  and name    HN  )  ( resid  110  and name    HB1  )     2.745    0.945    0.945    !  3.690
assign ( resid  110  and name   HB1  )  ( resid  113  and name     HN  )     3.205    1.405    1.405    !  4.610
assign ( resid  110  and name    HN  )  ( resid  110  and name    HG2  )     2.595    0.795    0.795    !  3.390
assign ( resid  110  and name    HN  )  ( resid  111  and name     HA  )     3.310    1.510    1.510    !  4.820

assign ( resid  111  and name   HB#  )  ( resid  114  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid  111  and name    HA  )  ( resid  114  and name     HB  )     3.515    1.715    1.715    !  5.230
assign ( resid  111  and name    HA  )  ( resid  114  and name     HN  )     3.500    1.700    1.700    !  5.200
assign ( resid  111  and name   HB#  )  ( resid  112  and name     HN  )     2.800    1.000    1.000    !  3.800
assign ( resid  111  and name    HA  )  ( resid  113  and name     HN  )     3.120    1.320    1.320    !  4.440
assign ( resid  111  and name    HN  )  ( resid  111  and name    HB#  )     2.445    0.645    0.645    !  3.090
assign ( resid  111  and name    HN  )  ( resid  112  and name     HN  )     2.810    1.010    1.010    !  3.820
assign ( resid  111  and name   HB#  )  ( resid  113  and name     HN  )     3.455    1.655    1.655    !  5.110
assign ( resid  111  and name    HN  )  ( resid  112  and name    HG#  )     3.465    1.665    1.665    !  5.130
assign ( resid  111  and name    HN  )  ( resid  112  and name    HB#  )     3.405    1.605    1.605    !  5.010
assign ( resid  111  and name   HB#  )  ( resid  112  and name    HB#  )     3.145    1.345    1.345    !  4.490

assign ( resid  112  and name    HA  )  ( resid  115  and name    HD#  )     2.635    0.835    0.835    !  3.470
assign ( resid  112  and name    HA  )  ( resid  112  and name    HG#  )     2.880    1.080    1.080    !  3.960
assign ( resid  112  and name   HG#  )  ( resid  112  and name   HE22  )     2.945    1.145    1.145    !  4.090
assign ( resid  112  and name   HG#  )  ( resid  112  and name   HE21  )     2.945    1.145    1.145    !  4.090
assign ( resid  112  and name    HA  )  ( resid  115  and name     HN  )     3.080    1.280    1.280    !  4.360
assign ( resid  112  and name    HA  )  ( resid  114  and name     HB  )     3.260    1.460    1.460    !  4.720
assign ( resid  112  and name    HA  )  ( resid  116  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid  112  and name  HE21  )  ( resid  116  and name    HB#  )     2.775    0.975    0.975    !  3.750
assign ( resid  112  and name   HG#  )  ( resid  115  and name    HD#  )     3.650    1.850    1.850    !  5.500
assign ( resid  112  and name   HG#  )  ( resid  113  and name   HG2#  )     3.650    1.850    1.850    !  5.500
assign ( resid  112  and name    HN  )  ( resid  113  and name     HN  )     2.905    1.105    1.105    !  4.010
assign ( resid  112  and name   HG#  )  ( resid  113  and name     HN  )     3.045    1.245    1.245    !  4.290
assign ( resid  112  and name    HN  )  ( resid  115  and name    HD#  )     3.650    1.850    1.850    !  5.500
assign ( resid  112  and name    HN  )  ( resid  114  and name     HN  )     3.380    1.580    1.580    !  4.960
assign ( resid  112  and name  HE22  )  ( resid  116  and name     HN  )     3.315    1.515    1.515    !  4.830
assign ( resid  112  and name  HE21  )  ( resid  116  and name     HN  )     3.315    1.515    1.515    !  4.830
assign ( resid  112  and name    HN  )  ( resid  112  and name    HG#  )     2.985    1.185    1.185    !  4.170
assign ( resid  112  and name  HE22  )  ( resid  116  and name    HB#  )     2.775    0.975    0.975    !  3.750
assign ( resid  112  and name   HG#  )  ( resid  116  and name     HN  )     3.650    1.850    1.850    !  5.500
assign ( resid  112  and name    HN  )  ( resid  112  and name    HB#  )     2.545    0.745    0.745    !  3.290
assign ( resid  112  and name   HB#  )  ( resid  112  and name   HE2#  )     3.145    1.345    1.345    !  4.490
assign ( resid  112  and name   HB#  )  ( resid  113  and name     HN  )     2.905    1.105    1.105    !  4.010
assign ( resid  112  and name   HB#  )  ( resid  115  and name    HD#  )     2.745    0.945    0.945    !  3.690
assign ( resid  112  and name  HE2#  )  ( resid  113  and name     HA  )     2.915    1.115    1.115    !  4.030
assign ( resid  112  and name  HE2#  )  ( resid  116  and name     HN  )     2.985    1.185    1.185    !  4.170
assign ( resid  112  and name  HE2#  )  ( resid  116  and name    HB#  )     2.475    0.675    0.675    !  3.150

assign ( resid  113  and name  HG2#  )  ( resid  119  and name     HN  )     3.025    1.225    1.225    !  4.250
assign ( resid  113  and name    HA  )  ( resid  113  and name   HG2#  )     2.625    0.825    0.825    !  3.450
assign ( resid  113  and name  HG2#  )  ( resid  118  and name    HB1  )     2.750    0.950    0.950    !  3.700
assign ( resid  113  and name  HG2#  )  ( resid  118  and name    HB2  )     2.750    0.950    0.950    !  3.700
assign ( resid  113  and name    HA  )  ( resid  116  and name    HB#  )     2.995    1.195    1.195    !  4.190
assign ( resid  113  and name  HG2#  )  ( resid  118  and name     HA  )     3.325    1.525    1.525    !  4.850
assign ( resid  113  and name    HN  )  ( resid  113  and name     HB  )     2.650    0.850    0.850    !  3.500
assign ( resid  113  and name    HB  )  ( resid  119  and name    HB1  )     2.695    0.895    0.895    !  3.590
assign ( resid  113  and name    HB  )  ( resid  114  and name     HN  )     2.745    0.945    0.945    !  3.690
assign ( resid  113  and name  HG2#  )  ( resid  118  and name     HN  )     3.065    1.265    1.265    !  4.330
assign ( resid  113  and name    HN  )  ( resid  116  and name    HB#  )     3.585    1.785    1.785    !  5.370
assign ( resid  113  and name    HN  )  ( resid  113  and name   HG2#  )     2.835    1.035    1.035    !  3.870
assign ( resid  113  and name  HG2#  )  ( resid  114  and name     HN  )     2.875    1.075    1.075    !  3.950
assign ( resid  113  and name    HA  )  ( resid  116  and name     HN  )     2.920    1.120    1.120    !  4.040
assign ( resid  113  and name    HN  )  ( resid  115  and name     HN  )     3.225    1.425    1.425    !  4.650
assign ( resid  113  and name    HN  )  ( resid  116  and name     HN  )     3.500    1.700    1.700    !  5.200
assign ( resid  113  and name  HG2#  )  ( resid  117  and name     HN  )     3.300    1.500    1.500    !  4.800
assign ( resid  113  and name    HN  )  ( resid  114  and name   HG2#  )     3.015    1.215    1.215    !  4.230
assign ( resid  113  and name    HA  )  ( resid  114  and name   HG2#  )     3.620    1.820    1.820    !  5.440
assign ( resid  113  and name    HA  )  ( resid  118  and name    HB#  )     3.180    1.380    1.380    !  4.560
assign ( resid  113  and name    HB  )  ( resid  114  and name   HG2#  )     2.925    1.125    1.125    !  4.050
assign ( resid  113  and name    HB  )  ( resid  119  and name   HD1#  )     3.510    1.710    1.710    !  5.220
assign ( resid  113  and name  HG2#  )  ( resid  119  and name   HD1#  )     3.140    1.340    1.340    !  4.480

assign ( resid  114  and name    HA  )  ( resid  114  and name   HG2#  )     2.815    1.015    1.015    !  3.830
assign ( resid  114  and name    HA  )  ( resid  114  and name   HG1#  )     2.815    1.015    1.015    !  3.830
assign ( resid  114  and name    HN  )  ( resid  114  and name   HG1#  )     2.855    1.055    1.055    !  3.910
assign ( resid  114  and name    HA  )  ( resid  119  and name    HB1  )     2.745    0.945    0.945    !  3.690
assign ( resid  114  and name    HB  )  ( resid  115  and name     HN  )     2.490    0.690    0.690    !  3.180
assign ( resid  114  and name  HG2#  )  ( resid  119  and name    HB1  )     2.855    1.055    1.055    !  3.910
assign ( resid  114  and name    HA  )  ( resid  119  and name    HB2  )     3.350    1.550    1.550    !  4.900
assign ( resid  114  and name    HB  )  ( resid  115  and name     HA  )     3.410    1.610    1.610    !  5.020
assign ( resid  114  and name  HG1#  )  ( resid  119  and name    HB1  )     2.855    1.055    1.055    !  3.910
assign ( resid  114  and name    HA  )  ( resid  119  and name     HN  )     2.885    1.085    1.085    !  3.970
assign ( resid  114  and name    HN  )  ( resid  115  and name     HG  )     3.140    1.340    1.340    !  4.480
assign ( resid  114  and name    HN  )  ( resid  114  and name     HB  )     2.625    0.825    0.825    !  3.450
assign ( resid  114  and name    HN  )  ( resid  115  and name     HN  )     2.730    0.930    0.930    !  3.660
assign ( resid  114  and name    HN  )  ( resid  116  and name     HN  )     3.120    1.320    1.320    !  4.440
assign ( resid  114  and name    HN  )  ( resid  114  and name   HG2#  )     2.855    1.055    1.055    !  3.910
assign ( resid  114  and name    HA  )  ( resid  114  and name   HG2#  )     2.465    0.665    0.665    !  3.130
assign ( resid  114  and name    HA  )  ( resid  119  and name   HD1#  )     3.035    1.235    1.235    !  4.270
assign ( resid  114  and name  HG2#  )  ( resid  115  and name     HN  )     2.855    1.055    1.055    !  3.910
assign ( resid  114  and name  HG2#  )  ( resid  119  and name    HB1  )     2.565    0.765    0.765    !  3.330
assign ( resid  114  and name  HG2#  )  ( resid  119  and name     HG  )     2.755    0.955    0.955    !  3.710
assign ( resid  114  and name  HG1#  )  ( resid  119  and name   HD1#  )     2.360    0.560    0.560    !  2.920

assign ( resid  115  and name    HA  )  ( resid  115  and name    HD#  )     2.565    0.765    0.765    !  3.330
assign ( resid  115  and name   HB1  )  ( resid  115  and name    HD#  )     2.580    0.780    0.780    !  3.360
assign ( resid  115  and name    HN  )  ( resid  115  and name    HB2  )     2.945    1.145    1.145    !  4.090
assign ( resid  115  and name    HA  )  ( resid  116  and name     HA  )     3.480    1.680    1.680    !  5.160
assign ( resid  115  and name   HB2  )  ( resid  115  and name    HD#  )     2.650    0.850    0.850    !  3.500
assign ( resid  115  and name   HB2  )  ( resid  116  and name     HN  )     2.670    0.870    0.870    !  3.540
assign ( resid  115  and name   HD#  )  ( resid  116  and name     HN  )     3.030    1.230    1.230    !  4.260
assign ( resid  115  and name    HG  )  ( resid  117  and name     HN  )     3.630    1.830    1.830    !  5.460
assign ( resid  115  and name    HN  )  ( resid  115  and name     HG  )     2.325    0.525    0.525    !  2.850
assign ( resid  115  and name    HN  )  ( resid  115  and name    HB1  )     2.845    1.045    1.045    !  3.890
assign ( resid  115  and name    HN  )  ( resid  116  and name     HN  )     2.745    0.945    0.945    !  3.690
assign ( resid  115  and name    HA  )  ( resid  116  and name     HN  )     2.685    0.885    0.885    !  3.570
assign ( resid  115  and name   HB1  )  ( resid  116  and name     HN  )     2.940    1.140    1.140    !  4.080
assign ( resid  115  and name   HD#  )  ( resid  117  and name     HN  )     3.510    1.710    1.710    !  5.220
assign ( resid  115  and name    HN  )  ( resid  115  and name    HD#  )     2.450    0.650    0.650    !  3.100

assign ( resid  116  and name    HA  )  ( resid  116  and name    HB#  )     2.180    0.380    0.380    !  2.560
assign ( resid  116  and name    HA  )  ( resid  118  and name     HN  )     3.190    1.390    1.390    !  4.580
assign ( resid  116  and name    HA  )  ( resid  117  and name    HA1  )     3.635    1.835    1.835    !  5.470
assign ( resid  116  and name    HA  )  ( resid  117  and name    HA2  )     3.635    1.835    1.835    !  5.470
assign ( resid  116  and name   HB#  )  ( resid  118  and name     HN  )     2.735    0.935    0.935    !  3.670
assign ( resid  116  and name   HB#  )  ( resid  117  and name     HN  )     2.805    1.005    1.005    !  3.810
assign ( resid  116  and name    HN  )  ( resid  117  and name     HN  )     2.565    0.765    0.765    !  3.330
assign ( resid  116  and name    HN  )  ( resid  116  and name    HB#  )     2.495    0.695    0.695    !  3.190
assign ( resid  116  and name    HN  )  ( resid  118  and name     HN  )     3.365    1.565    1.565    !  4.930
assign ( resid  116  and name    HN  )  ( resid  118  and name    HB#  )     3.505    1.705    1.705    !  5.210
assign ( resid  116  and name    HA  )  ( resid  117  and name    HA#  )     3.255    1.455    1.455    !  4.710
assign ( resid  116  and name   HB#  )  ( resid  117  and name    HA#  )     3.150    1.350    1.350    !  4.500

assign ( resid  117  and name    HN  )  ( resid  118  and name     HN  )     2.685    0.885    0.885    !  3.570
assign ( resid  117  and name   HA#  )  ( resid  119  and name     HN  )     2.900    1.100    1.100    !  4.000
assign ( resid  117  and name   HA#  )  ( resid  119  and name   HD1#  )     2.635    0.835    0.835    !  3.470

assign ( resid  118  and name    HN  )  ( resid  119  and name     HA  )     3.450    1.650    1.650    !  5.100
assign ( resid  118  and name   HB1  )  ( resid  119  and name     HN  )     3.185    1.385    1.385    !  4.570
assign ( resid  118  and name    HN  )  ( resid  119  and name     HN  )     2.675    0.875    0.875    !  3.550
assign ( resid  118  and name   HB2  )  ( resid  119  and name     HN  )     3.185    1.385    1.385    !  4.570
assign ( resid  118  and name    HN  )  ( resid  118  and name    HB1  )     2.830    1.030    1.030    !  3.860
assign ( resid  118  and name    HA  )  ( resid  119  and name     HN  )     2.645    0.845    0.845    !  3.490
assign ( resid  118  and name    HN  )  ( resid  118  and name    HB2  )     2.830    1.030    1.030    !  3.860
assign ( resid  118  and name    HN  )  ( resid  118  and name    HB#  )     2.570    0.770    0.770    !  3.340
assign ( resid  118  and name   HB#  )  ( resid  119  and name     HN  )     2.880    1.080    1.080    !  3.960

assign ( resid  119  and name    HA  )  ( resid  119  and name   HD2#  )     2.945    1.145    1.145    !  4.090
assign ( resid  119  and name    HA  )  ( resid  120  and name     HN  )     2.610    0.810    0.810    !  3.420
assign ( resid  119  and name   HB2  )  ( resid  119  and name   HD1#  )     2.935    1.135    1.135    !  4.070
assign ( resid  119  and name   HB2  )  ( resid  119  and name   HD2#  )     2.935    1.135    1.135    !  4.070
assign ( resid  119  and name   HB2  )  ( resid  120  and name     HN  )     3.310    1.510    1.510    !  4.820
assign ( resid  119  and name    HA  )  ( resid  119  and name   HD1#  )     2.945    1.145    1.145    !  4.090
assign ( resid  119  and name  HD2#  )  ( resid  120  and name     HN  )     3.140    1.340    1.340    !  4.480
assign ( resid  119  and name    HN  )  ( resid  120  and name     HN  )     3.010    1.210    1.210    !  4.220
assign ( resid  119  and name    HN  )  ( resid  119  and name   HD1#  )     2.985    1.185    1.185    !  4.170
assign ( resid  119  and name    HN  )  ( resid  119  and name   HD2#  )     2.985    1.185    1.185    !  4.170
assign ( resid  119  and name    HN  )  ( resid  120  and name    HG#  )     3.210    1.410    1.410    !  4.620
assign ( resid  119  and name  HD1#  )  ( resid  120  and name     HN  )     3.140    1.340    1.340    !  4.480
assign ( resid  119  and name    HN  )  ( resid  119  and name    HB1  )     2.415    0.615    0.615    !  3.030
assign ( resid  119  and name    HA  )  ( resid  119  and name   HD1#  )     2.595    0.795    0.795    !  3.390
assign ( resid  119  and name   HB1  )  ( resid  119  and name   HD1#  )     2.350    0.550    0.550    !  2.900
assign ( resid  119  and name  HD1#  )  ( resid  120  and name     HN  )     2.775    0.975    0.975    !  3.750
assign ( resid  119  and name  HD1#  )  ( resid  120  and name     HA  )     3.275    1.475    1.475    !  4.750
assign ( resid  119  and name  HD2#  )  ( resid  120  and name    HB#  )     3.540    1.740    1.740    !  5.280

assign ( resid  120  and name    HN  )  ( resid  120  and name    HG#  )     2.490    0.690    0.690    !  3.180
assign ( resid  120  and name    HN  )  ( resid  121  and name     HN  )     3.275    1.475    1.475    !  4.750
assign ( resid  120  and name    HA  )  ( resid  121  and name     HN  )     2.535    0.735    0.735    !  3.270
assign ( resid  120  and name    HA  )  ( resid  121  and name   HG2#  )     3.450    1.650    1.650    !  5.100
assign ( resid  120  and name   HB#  )  ( resid  121  and name     HN  )     2.645    0.845    0.845    !  3.490

assign ( resid  121  and name    HA  )  ( resid  122  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid  121  and name    HA  )  ( resid  122  and name     HN  )     2.665    0.865    0.865    !  3.530
assign ( resid  121  and name    HA  )  ( resid  121  and name   HG2#  )     2.710    0.910    0.910    !  3.620
assign ( resid  121  and name    HA  )  ( resid  121  and name   HG1#  )     2.710    0.910    0.910    !  3.620
assign ( resid  121  and name    HN  )  ( resid  121  and name     HB  )     2.795    0.995    0.995    !  3.790
assign ( resid  121  and name    HB  )  ( resid  122  and name     HN  )     3.020    1.220    1.220    !  4.240
assign ( resid  121  and name    HN  )  ( resid  122  and name     HN  )     3.165    1.365    1.365    !  4.530
assign ( resid  121  and name  HG1#  )  ( resid  122  and name     HN  )     2.720    0.920    0.920    !  3.640
assign ( resid  121  and name  HG2#  )  ( resid  122  and name     HN  )     2.720    0.920    0.920    !  3.640
assign ( resid  121  and name    HN  )  ( resid  121  and name   HG2#  )     2.625    0.825    0.825    !  3.450
assign ( resid  121  and name    HA  )  ( resid  121  and name   HG2#  )     2.440    0.640    0.640    !  3.080
assign ( resid  121  and name  HG2#  )  ( resid  122  and name     HN  )     2.430    0.630    0.630    !  3.060
assign ( resid  121  and name  HG2#  )  ( resid  122  and name    HB#  )     2.990    1.190    1.190    !  4.180

assign ( resid  122  and name    HA  )  ( resid  123  and name     HN  )     2.605    0.805    0.805    !  3.410
assign ( resid  122  and name    HN  )  ( resid  122  and name    HB#  )     2.595    0.795    0.795    !  3.390
assign ( resid  122  and name    HN  )  ( resid  123  and name     HN  )     3.305    1.505    1.505    !  4.810
assign ( resid  122  and name   HB#  )  ( resid  123  and name     HN  )     2.980    1.180    1.180    !  4.160

assign ( resid  123  and name    HN  )  ( resid  124  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid  123  and name    HN  )  ( resid  123  and name    HB1  )     2.890    1.090    1.090    !  3.980
assign ( resid  123  and name    HN  )  ( resid  123  and name    HD#  )     3.195    1.395    1.395    !  4.590
assign ( resid  123  and name   HD#  )  ( resid  124  and name     HN  )     2.970    1.170    1.170    !  4.140
assign ( resid  123  and name   HD#  )  ( resid  125  and name     HN  )     3.540    1.740    1.740    !  5.280
assign ( resid  123  and name    HN  )  ( resid  123  and name    HB2  )     2.890    1.090    1.090    !  3.980
assign ( resid  123  and name    HA  )  ( resid  123  and name    HD#  )     2.665    0.865    0.865    !  3.530
assign ( resid  123  and name   HD#  )  ( resid  124  and name     HA  )     3.650    1.850    1.850    !  5.500
assign ( resid  123  and name   HB#  )  ( resid  124  and name     HN  )     3.035    1.235    1.235    !  4.270

assign ( resid  124  and name    HA  )  ( resid  124  and name    HG#  )     2.765    0.965    0.965    !  3.730
assign ( resid  124  and name    HA  )  ( resid  125  and name     HA  )     3.505    1.705    1.705    !  5.210
assign ( resid  124  and name    HN  )  ( resid  124  and name    HB#  )     2.730    0.930    0.930    !  3.660
assign ( resid  124  and name    HN  )  ( resid  124  and name    HG#  )     3.190    1.390    1.390    !  4.580
assign ( resid  124  and name    HN  )  ( resid  125  and name     HN  )     3.270    1.470    1.470    !  4.740
assign ( resid  124  and name   HG#  )  ( resid  125  and name     HN  )     3.235    1.435    1.435    !  4.670

assign ( resid  125  and name    HN  )  ( resid  125  and name    HG2  )     3.570    1.770    1.770    !  5.340
assign ( resid  125  and name    HN  )  ( resid  125  and name    HG1  )     3.570    1.770    1.770    !  5.340
assign ( resid  125  and name   HB#  )  ( resid  126  and name     HB  )     3.170    1.370    1.370    !  4.540
assign ( resid  125  and name    HA  )  ( resid  126  and name     HN  )     2.650    0.850    0.850    !  3.500
assign ( resid  125  and name    HN  )  ( resid  125  and name    HB#  )     2.715    0.915    0.915    !  3.630
 
assign ( resid  125  and name   HB#  )  ( resid  126  and name     HN  )     2.775    0.975    0.975    !  3.750
assign ( resid  125  and name    HN  )  ( resid  125  and name    HG#  )     3.185    1.385    1.385    !  4.570
assign ( resid  125  and name   HG#  )  ( resid  126  and name     HN  )     3.120    1.320    1.320    !  4.440
 

assign ( resid  126  and name    HA  )  ( resid  126  and name   HG2#  )     2.760    0.960    0.960    !  3.720
assign ( resid  126  and name    HN  )  ( resid  126  and name   HG2#  )     2.945    1.145    1.145    !  4.090
assign ( resid  126  and name  HG2#  )  ( resid  127  and name     HN  )     3.650    1.850    1.850    !  5.500 ! originally 4.38 (08/28)
assign ( resid  126  and name    HB  )  ( resid  127  and name     HN  )     3.650    1.850    1.850    !  5.500 ! originally 4.36 (08/28)

assign ( resid  127  and name    HA  )  ( resid  127  and name    HB#  )     2.375    0.575    0.575    !  2.950


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