New examples for GAB force fields (restrained, unrestrained, CLUSTER,

[unres.git] / examples / unres / CSA / GAB / CSA / global / unrestrained / 1l2y_csa.CSA.rbank

 jlee =  1   nbank = 200   nstep =     200    102409 0     1768.73465
 #   1 total E   -6.92484E+01 rmsd from N    0.000 %NC  0.00
 118.354-162.358 145.304 -13.888
 114.157-101.348 146.200 -34.371
  91.721  71.868 175.514-169.866
  90.165  37.738 145.060-110.614
  90.732  54.522 102.732-103.432
  92.227  71.948 136.645  47.304
  91.078 102.903 140.716-142.029
  93.075 -67.906 108.039-121.036
 117.292 -66.933 150.842 -18.999
 128.199-168.095   0.000   0.000
 124.639 -43.646   0.000   0.000
  93.484  82.175 131.765-155.109
 128.760-101.204 119.932 -79.944
 122.685 -79.787 120.347 -79.433
 118.974-174.983   0.000   0.000
 129.284 -82.703 109.832-125.859
 117.132-109.107 122.625-131.520
 121.780-147.643 111.208-110.021
 108.416   3.018  95.718 -80.016
  93.346   0.000 113.414 -78.701
 #   2 total E   -6.72687E+01 rmsd from N    0.000 %NC  0.00
 118.874-146.725 108.740 -79.158
 115.193 174.001 160.980 -15.044
 132.775 -77.384 154.796-145.909
  92.080  62.248 172.053 173.131
  90.305  39.362 123.209 -80.421
  90.937  61.112 100.825-124.330
  90.643  69.964 151.758-129.692
  91.252 149.264 126.644-132.637
  92.447 -64.658 144.766-139.896
  95.207  41.641   0.000   0.000
 126.881 -93.820   0.000   0.000
  93.219  64.808 100.847-101.436
 128.799 159.528 150.332-126.346
  99.771 -66.494 116.550 -75.723
  95.412  65.246   0.000   0.000
 131.105 -82.250 151.278 -35.422
 122.787-145.336 111.292-110.688
 105.413 132.246 120.836-131.721
 121.677  64.148 118.767-122.667
  93.317   0.000 115.190 -77.680
 #   3 total E   -6.21341E+01 rmsd from N    0.000 %NC  0.00
  93.601  44.833 143.230-128.549
  92.919 110.664 155.761-154.586
 130.319 -97.285 144.756  -9.966
 118.056-154.791 130.473 -73.641
  91.668  71.035 118.408-123.720
  97.327 156.625 101.649-139.625
  91.908  79.291 148.356-104.736
  92.059  84.415 121.640-140.442
  92.373 -86.419 107.739 -86.064
  95.008 115.732   0.000   0.000
 138.261 -33.807   0.000   0.000
 120.745-145.570 108.996-108.418
 125.801 176.473 121.502 -80.309
 110.866 -46.250 137.945-102.767
 108.866 -11.127   0.000   0.000
 119.455 -88.367  99.438 -58.463
 118.026-112.490 122.811-130.656
 119.599-116.256 103.586-100.327
 109.451 115.218 128.050-142.112
  93.450   0.000 111.361 -80.164
 #   4 total E   -6.14904E+01 rmsd from N    0.000 %NC  0.00
  93.782  36.667 145.679 -30.684
  92.629 159.351 139.145 -51.442
 125.033 163.229 134.408-123.685
 122.530 179.950 176.442-162.702
  90.975  71.666 149.340 169.707
  88.661 164.615 141.900  16.597
  91.670  64.652 136.738-164.636
  91.480  75.633 111.180-116.078
  92.672 -71.784  98.684 -81.321
  95.297 174.495   0.000   0.000
 139.430 -40.197   0.000   0.000
 111.366 175.995 125.302-133.213
  93.254  92.706 133.440-119.837
  93.801-104.377 110.933 -79.629
  95.047 158.505   0.000   0.000
 128.317-119.570 135.872 -22.511
 118.799 121.054 120.764-128.457
  92.407  49.579 105.138-104.526
  92.785  86.691 103.362-111.087
  93.419   0.000 128.043-124.416
 #   5 total E   -6.13242E+01 rmsd from N    0.000 %NC  0.00
 117.492-112.959 153.876-151.778
 123.740 -94.504 154.406-109.448
 121.895-168.224 157.774  10.208
  93.564  95.757 146.041 -92.009
  90.883 -56.556 101.936 -51.995
  94.375 107.342 166.489 157.670
  92.943-109.621 138.220 -36.550
 125.497 169.373 162.178 -86.043
 117.161 167.106 144.037-141.177
 134.693 -87.489   0.000   0.000
  94.447  30.192   0.000   0.000
  92.475  54.862 131.888-155.749
  92.069 -65.852 121.659 -33.450
 126.138 -62.630 119.063 -77.074
 130.077  73.365   0.000   0.000
 129.474 -89.464 111.890-126.791
 118.776-110.774 114.708-119.748
 118.027-138.970 140.726-154.671
 119.837-116.722 111.924-110.826
 121.012   0.000 149.529 -87.515
 #   6 total E   -6.10313E+01 rmsd from N    0.000 %NC  0.00
 118.522-158.559 106.506 -77.991
 121.009 169.160 176.453-159.601
  90.959  82.718 106.065-120.498
  92.095  98.651 129.203 -90.329
  90.927  39.721  91.630 -69.818
  92.841  49.483  94.467 -72.923
  93.446 -91.377 143.023 -96.331
 118.233 -94.212 124.223-131.300
 134.151  47.382 154.026  -9.539
  97.354 106.003   0.000   0.000
 139.484 -67.662   0.000   0.000
  94.575  70.822  99.216 -95.566
  93.090 119.939 148.199-105.192
  95.557   5.117 113.499 -79.616
  98.461  81.813   0.000   0.000
 133.108 -97.487 113.997-130.507
 120.288-168.991 115.262-119.564
 128.885-157.171 112.775-106.891
 110.769 129.409 129.884-143.217
  93.609   0.000 114.029 -80.207
 #   7 total E   -6.03899E+01 rmsd from N    0.000 %NC  0.00
 115.941 -68.165 147.712 -33.546
  92.444  88.276 151.309 -28.267
  92.379 109.112 113.347-129.487
 115.811 -95.210 126.210-119.282
 119.319 160.935 157.829 101.773
 111.905 165.197  88.388-134.979
 118.429-175.511 171.911  -4.366
 125.855 -73.288 123.615 136.300
  93.630  44.025 148.506 -23.260
 122.934 -57.049   0.000   0.000
 128.280 -57.627   0.000   0.000
 115.998-179.575 137.157-150.210
  94.059  90.532 114.287 -77.035
 113.570-100.742 111.500 -80.122
  95.084  50.614   0.000   0.000
 127.718 -97.688 100.793 -67.058
 118.141-168.363 112.338-116.431
 119.518-168.089 127.553-133.596
  93.697 109.424 101.826 -94.669
 118.948   0.000 116.936 -82.251
 #   8 total E   -6.00680E+01 rmsd from N    0.000 %NC  0.00
  93.828 100.990 148.549 -13.955
  91.664  81.336 140.160 -32.715
  90.849  52.587 131.676 -99.965
  90.661  56.155 139.320 -96.403
  90.743  87.594 109.934 -35.184
 107.086 -47.520 147.330-133.402
  91.353  83.037 154.145 -21.416
  90.822  28.066 107.712-131.152
  93.243 168.393 138.675-129.584
 124.351 171.996   0.000   0.000
 132.431 -62.581   0.000   0.000
 116.630 -80.680 109.311-110.048
  90.200  76.761 114.441 -76.239
  93.234  26.227 110.541 -78.253
  96.522 169.899   0.000   0.000
 125.190-106.133 114.569 -43.904
 121.455-165.855 135.807-146.269
 106.603-139.564  98.876 -88.847
 119.704-104.122 122.540-128.306
 119.673   0.000 137.769-114.234
 #   9 total E   -6.00184E+01 rmsd from N    0.000 %NC  0.00
  93.612  17.118 144.230-131.822
 114.659 175.658 148.665 -27.024
 114.370 170.552 111.841 -73.595
  92.367  62.947 137.939-113.895
  90.729  36.961 107.539 -39.763
  93.061  70.853 151.487 109.938
  92.104 -77.630 144.635 -52.787
 123.380 171.472 132.339-132.954
 117.069 -72.596 150.808 -20.957
  95.537  63.485   0.000   0.000
 132.720 -55.386   0.000   0.000
 126.206 173.166  98.438 -89.800
 129.396 165.055 150.592-114.429
 108.771 -81.292 110.262 -79.515
  94.407  61.322   0.000   0.000
 123.778 -77.005 110.350 -81.861
 119.100 134.705 114.577-120.169
  91.976  48.017  99.137-106.238
  92.452 104.963 100.038-104.170
 121.220   0.000 120.859 -84.589
 #  10 total E   -5.90693E+01 rmsd from N    0.000 %NC  0.00
  93.680  15.849 108.379 -79.883
 115.710 176.369 154.089 -17.158
 111.781 110.654 171.808-178.270
 124.009-104.414 115.039 -69.503
  90.711  67.692 131.830-176.565
  92.281  83.423 139.895   1.183
  92.058 -67.646 112.040 -83.543
 111.090-168.227 125.372-136.039
 123.404-176.734 152.723 -14.268
 126.001-165.978   0.000   0.000
 107.710  -2.962   0.000   0.000
  92.672  97.748 101.589 -99.076
  93.635 -77.756 113.852 -75.050
  95.889  73.075 115.529 -76.415
 137.878-150.467   0.000   0.000
 131.255 -82.981 130.082 143.289
 118.619-108.201 119.613-127.502
 118.109-119.159 114.092-113.947
  93.747  91.644  99.193-102.912
 116.982   0.000 113.099 -80.809
 #  11 total E   -5.89864E+01 rmsd from N    0.000 %NC  0.00
 116.618-139.378 152.367-149.145
 117.425 173.705 162.987 -18.081
  95.390  83.702 173.989 179.222
 108.211 178.785 133.322 -75.717
 119.707-178.743 134.717 144.402
 128.674 171.431  99.437-129.923
  92.430  90.719 144.470 -41.317
 126.994-104.710 126.614-137.869
 122.721-177.232 150.471 -18.383
 136.541 -73.183   0.000   0.000
 128.584 -46.210   0.000   0.000
 110.502 178.220 130.701-144.203
 129.940 176.278 160.390-108.314
  94.110  28.254 115.788 -76.348
 126.160 -19.378   0.000   0.000
 119.793 -77.186 148.698 -24.680
 115.873-111.559  90.133 -87.590
 116.196-147.492 113.450-116.000
 115.898-112.405 137.393-154.255
  94.626   0.000 116.308 -77.329
 #  12 total E   -5.86180E+01 rmsd from N    0.000 %NC  0.00
 116.797-140.085 152.573-149.765
 117.822 176.435 159.417 -17.089
  92.608  77.075 120.339 -52.204
  92.493  99.350 142.060 -88.127
  90.511 -76.986 115.549-107.726
  93.567 146.992 126.926 -30.238
  92.059 103.598 148.554-117.881
 114.588 -92.377 118.048-136.038
 120.716 178.187 150.317 -18.048
 131.278-172.086   0.000   0.000
  93.250  36.695   0.000   0.000
  94.187 168.944 130.955-153.374
 132.890 164.354 127.359 -82.481
 118.953-100.638 120.005 -78.984
 120.043 176.323   0.000   0.000
 129.781-107.992 105.614 -59.249
 117.657-167.321 114.202-118.984
 121.522-111.784 119.951-121.078
 119.120-116.639 118.587-121.114
 120.783   0.000 146.770-111.262
 #  13 total E   -5.85817E+01 rmsd from N    0.000 %NC  0.00
 119.411 -95.326 107.979 -75.586
 124.581 -97.844 176.439-155.701
 132.313 -70.677  96.541 -99.130
  93.562  59.968 164.023-140.409
  91.189  79.549 103.999 -41.605
 108.702 -35.538  92.408 -84.353
  93.378  95.692 146.162 -38.618
 115.972-157.576 159.800-151.292
 133.906 -66.662 105.831 -80.378
  96.338  69.946   0.000   0.000
  92.755  38.308   0.000   0.000
  91.498-179.279  95.837-103.005
 136.981 122.758 125.835 -84.032
 116.653-112.882 119.470 -77.338
 124.531 174.295   0.000   0.000
 131.872 -82.000 139.010-159.064
 117.643-106.960 116.438-123.483
 118.816-140.590 109.923-109.256
 115.584   5.758 129.896-140.573
  93.361   0.000 115.608 -77.142
 #  14 total E   -5.82315E+01 rmsd from N    0.000 %NC  0.00
 119.629-115.223 109.493 -78.497
 117.294-179.025 154.571 -17.051
 117.347 157.870 176.430 171.912
  91.129  42.426 146.228-116.163
  90.517  48.177  92.634 -57.759
  91.639  54.263 140.143  93.144
  91.179  63.076 135.852-129.039
  94.314 -92.722 131.350-128.395
 123.261 166.678 111.069 -79.439
 135.333 -74.184   0.000   0.000
 119.891 -42.073   0.000   0.000
 111.067 172.209 129.532-141.265
  93.983  94.069 118.891 -76.656
 120.815 171.140 119.557 -80.425
 120.909  71.247   0.000   0.000
 127.628 -80.540 142.074-174.011
 118.587-109.656 116.712-122.888
 119.290-139.976 111.285-111.131
 115.991   5.978 128.903-138.393
  93.374   0.000 115.585 -77.055
 #  15 total E   -5.78833E+01 rmsd from N    0.000 %NC  0.00
  93.601 103.858 143.733-133.175
 117.865-172.251 154.476  -9.211
 135.076 -56.008 166.545 146.734
  91.735  78.584 135.430-105.943
  90.553  -4.389  85.808 -70.446
 110.045-132.681 175.797 141.380
 119.794-166.621 120.234  65.109
 131.808 177.134 110.139 -74.109
 120.755 -65.390 109.984 -82.047
 126.484-164.268   0.000   0.000
 111.744 -30.247   0.000   0.000
  95.148 -53.498  95.850 -91.798
  92.456  86.076 114.221 -76.158
 127.168-116.028 120.013 -81.593
 125.443 173.771   0.000   0.000
 126.245-115.738 115.810 -43.965
 117.625-110.736 118.805-124.771
 118.473-137.795 114.854-116.188
 118.315-124.075 121.950-125.421
 120.878   0.000 148.271-130.319
 #  16 total E   -5.77295E+01 rmsd from N    0.000 %NC  0.00
 118.449-170.216 142.461 -14.700
 117.090-114.378 131.935 -62.795
  91.406  61.484  98.442 -81.802
  91.083  34.754 163.980-133.812
  90.544  53.798 104.127 -61.641
  92.352  87.510 129.853  91.094
  91.624 -37.687 147.056-156.815
 116.734-178.393 119.556-120.173
 116.181 177.440 150.772-143.351
 141.429 -70.316   0.000   0.000
  94.887  10.075   0.000   0.000
 103.594-146.242 130.810-148.270
 136.159-166.872 166.073 -83.905
 116.503-165.684 145.204 -68.731
 134.654-177.756   0.000   0.000
 125.751 -82.107 100.761 -66.710
 117.116 136.396 118.287-125.568
 121.875-169.037 107.636-104.525
 119.281-120.647 121.540-126.848
 120.603   0.000 144.029-134.118
 #  17 total E   -5.76912E+01 rmsd from N    0.000 %NC  0.00
  93.770  19.616 148.741 -27.456
 122.826-179.135 164.045-153.888
 117.242 175.545 158.792   1.970
 128.409-178.732 163.537 -84.657
 107.376-179.821 129.861  -2.673
 129.153 177.862 164.413 147.996
 108.782 -70.213 163.168-154.742
  92.495  84.320 133.712-128.596
  93.828  29.938 141.776-123.754
 128.964-157.929   0.000   0.000
 123.993 -35.144   0.000   0.000
 118.986 172.157 114.881-116.020
 122.252-178.747 119.879 -81.830
 126.816 178.847 123.479 -78.971
 120.886 175.558   0.000   0.000
 130.873 -87.922 133.067-151.493
 120.501-161.759 117.021-122.488
 121.385-112.757 110.717-108.145
 117.484-118.749 125.717-133.328
 121.845   0.000 121.581 -80.873
 #  18 total E   -5.73437E+01 rmsd from N    0.000 %NC  0.00
  93.826 112.186 146.070 -22.580
 109.037 177.938 158.245 -22.314
  93.544  80.607 174.239 173.499
  92.789  53.411 142.128 -98.845
  91.409 -96.965 109.053 -84.552
 109.488 172.742 126.388 -36.029
  92.206  87.698 139.148-133.137
  93.597-175.178 113.414-128.388
 118.441-172.774 154.024-147.895
 130.025 -64.078   0.000   0.000
 101.761 -29.689   0.000   0.000
  92.552  90.933 101.500-100.033
 138.621-121.122 115.223 -82.486
 120.705 -68.186 116.644 -78.058
 120.168 -17.529   0.000   0.000
 112.773 -67.208 144.223 -39.070
 118.406-156.044 111.313-114.268
 119.288-168.105 122.701-127.615
 107.568 -11.776  98.856 -88.100
 118.957   0.000 119.787 -80.132
 #  19 total E   -5.71579E+01 rmsd from N    0.000 %NC  0.00
 119.889 -97.959 162.565-159.593
 121.142 177.275 157.345-104.486
  91.657  84.497 121.138 -43.046
  93.775  10.086 120.355 -86.350
  92.724 -99.486  91.090 -63.535
 109.340 163.659 138.349 131.366
  91.275  68.751 147.085 -34.393
  91.757 153.645 118.727-134.063
 116.687-177.158 144.259-171.493
 138.605 -68.450   0.000   0.000
 107.505  -9.933   0.000   0.000
  92.938 105.891 101.628-100.957
 115.224-175.460 130.356-112.907
 125.713-168.732 121.852 -80.185
 135.799-173.232   0.000   0.000
 124.419 -77.705 108.388 -66.018
 114.748 136.802 121.856-132.695
 118.272-110.886 117.673-121.676
 114.509-119.843  96.684 -87.741
 121.721   0.000 121.673 -80.723
 #  20 total E   -5.69130E+01 rmsd from N    0.000 %NC  0.00
 119.954-106.927 105.461 -73.078
 119.148 -84.812 167.607-162.962
 125.446-170.259 109.714 -70.867
 116.513 179.704 165.778-176.033
 116.518 -69.875 140.292 -94.689
  93.482 143.200 126.121 -17.286
 109.917-120.646 122.843-119.610
  92.824  71.882 129.363-151.489
  93.140 169.806 141.263-103.157
  95.677  85.436   0.000   0.000
 120.964 -55.776   0.000   0.000
  92.625  74.550 101.286-100.980
  92.220 132.174 131.793-120.253
 114.588 -74.220 121.300-164.132
  94.385  65.566   0.000   0.000
 125.358 -81.834  76.101 -86.913
 120.563-160.743 116.634-122.377
  92.960 117.897 113.574-118.721
  93.105  48.938  93.628 -98.361
  93.276   0.000 110.551 -78.766
 #  21 total E   -5.67653E+01 rmsd from N    0.000 %NC  0.00
  93.819 107.927 145.989 -25.617
 115.505 174.487 156.374 -17.405
 112.541 110.155 173.051 178.107
 123.168-105.016 110.871 -76.903
  90.771  69.603 128.208-151.213
  91.363  98.512 139.404 -21.815
  90.754 111.661 126.189 -93.682
  91.361 -42.953 116.224-141.101
  94.098  82.905 142.882-106.908
 143.050 -82.484   0.000   0.000
 153.509 -40.275   0.000   0.000
 109.645 -60.961  95.393 -90.768
  94.265  86.455 114.686 -76.281
 126.386 -87.567 118.768 -80.180
 126.652 -17.860   0.000   0.000
 116.422-109.344 108.300 -50.147
 116.776 132.398 130.999-147.621
 106.935-111.743  98.150 -81.920
 106.401 113.224 130.963-148.162
  93.472   0.000 112.328 -80.419
 #  22 total E   -5.65711E+01 rmsd from N    0.000 %NC  0.00
  93.582 104.350 142.883-130.633
 121.760 178.083 166.332-136.458
 111.688 166.792 160.004   4.582
 111.449 166.911 128.844-126.631
  92.036  97.392 145.178-139.407
 120.076 -70.409  84.282 -84.172
 104.085-164.017 153.510-168.293
 136.221-177.685 135.611-127.888
 125.724 -42.806 166.923-162.592
 132.977  91.952   0.000   0.000
  98.254 -31.452   0.000   0.000
  90.584 -50.312  96.159 -91.573
  91.131  90.722 110.752 -75.822
 136.507-175.311 113.144 -81.361
  94.021  70.714   0.000   0.000
 109.600 -86.013 119.484 -79.927
 103.700 126.419  99.769-122.697
  93.439-173.103 108.963-114.030
 118.089-127.386 129.875-142.458
 123.535   0.000 122.833 -83.222
 #  23 total E   -5.63652E+01 rmsd from N    0.000 %NC  0.00
  93.619  19.908 143.954-126.992
 118.979-176.443 158.627-152.919
 123.413-157.594 150.777  20.859
 127.250 -49.382 164.583-150.390
  91.658  89.518 111.906-108.006
  91.420 116.941 104.419-139.579
  90.152  52.711 134.374-113.875
  90.469  85.425 109.664-126.481
  91.005 -63.190 107.122 -86.249
  96.430 173.729   0.000   0.000
  92.504  45.388   0.000   0.000
  91.124  59.006  97.222 -97.916
  92.337 -64.787 113.001 -76.953
 125.342 -62.886 148.975 -65.482
 127.849 -20.181   0.000   0.000
 128.537 -84.354 135.607-145.701
 118.322-109.192 120.505-129.504
 119.321-137.924 110.165-109.244
 117.220-113.609 127.115-135.268
  94.648   0.000 116.537 -77.646
 #  24 total E   -5.63649E+01 rmsd from N    0.000 %NC  0.00
 116.011-145.120 150.312-148.728
 123.206 176.481 164.867 170.110
  91.886  71.707 169.457  -2.020
  92.295  94.837 114.135 -90.088
  90.667  -8.804  98.878-107.034
 105.009 -96.203 173.374 177.544
 106.718-173.607 152.204 -22.291
 137.078-172.820 141.863-162.297
 119.235 179.871 107.196 -73.144
 137.185 -63.725   0.000   0.000
  98.119 -18.883   0.000   0.000
  96.624 163.032 131.141-152.370
 131.482-177.122 126.039 -79.800
 116.071 177.139 120.867 -76.680
 127.301 174.363   0.000   0.000
 129.420 -92.779 128.508-148.013
 122.296-166.818 112.744-115.921
  92.949 116.250 107.876-114.176
  92.869 125.129 108.491-122.462
 120.760   0.000 119.935 -83.316
 #  25 total E   -5.51394E+01 rmsd from N    0.000 %NC  0.00
 116.793 162.200 140.811 -14.869
  92.332  90.691 138.809 -41.684
 135.312 -83.108 148.333 113.766
  93.804  79.479 149.350-103.947
  92.098 150.373 120.166-105.443
 118.300 162.866 160.378 178.141
  92.840 105.264 152.505 -87.375
 131.219 -91.698 141.516-139.939
 120.109-171.711 159.269-139.234
 130.879 178.524   0.000   0.000
 106.556 -15.619   0.000   0.000
  98.148-177.093 101.116 -97.450
 130.673-173.113 149.244-128.671
 118.308-174.576 143.269 -45.417
 129.644-179.336   0.000   0.000
 127.537 -80.248 135.050-163.084
 119.115-111.028 110.433-112.305
 117.105-138.014 128.129-136.947
 113.281-107.844  97.764 -85.569
  94.532   0.000 116.241 -76.928
 #  26 total E   -5.50478E+01 rmsd from N    0.000 %NC  0.00
 119.408-129.949 109.536 -78.920
 117.624-179.010 150.062 -16.756
 132.955-110.608 161.213 162.353
  93.767  88.428 132.530-108.447
  90.924 -85.936 105.612-102.577
  93.863 146.667 127.408 -32.839
  91.468  92.633 142.993 -81.299
 112.000 -99.110 110.078-128.947
 118.374 119.943 109.754 -82.102
 129.210  21.432   0.000   0.000
  93.525  44.362   0.000   0.000
  91.891  50.219  94.100 -99.064
  94.177 -70.186 110.585 -77.368
 129.664-174.179 151.158 -52.445
 125.374 174.751   0.000   0.000
 129.534 -84.441 139.521-168.003
 121.167-163.521 113.258-116.132
 120.328-140.584 117.393-118.601
 113.014-118.211  98.938 -92.741
 121.507   0.000 121.306 -80.328
 #  27 total E   -5.50042E+01 rmsd from N    0.000 %NC  0.00
  93.804  15.278 145.744 -28.109
 114.018 175.181 162.599 -21.179
 114.384 155.480 172.225  11.139
 108.305 157.726 139.284-106.675
  91.136  79.490 139.960-165.572
  91.529  41.351  88.891 -83.410
  91.837  66.421 137.253 -90.868
  95.400 -64.440 129.056 145.037
 117.488-164.771 158.533-150.606
 136.182 -60.302   0.000   0.000
 111.642 -32.025   0.000   0.000
  95.800 -50.064  95.706 -95.250
  92.280  92.779 114.226 -76.110
 128.012-107.826 118.158 -82.281
 126.435-178.238   0.000   0.000
 127.069 -80.193 136.042-169.866
 120.205-162.206 114.040-116.849
 102.511-170.530 103.236-100.507
 116.899 -11.070 129.287-141.893
 118.177   0.000 144.000-101.964
 #  28 total E   -5.49672E+01 rmsd from N    0.000 %NC  0.00
 117.305 168.527 142.613  -9.438
  90.920  85.896 131.761  18.175
  93.099  36.567 175.482-176.321
  93.057  66.059 137.374-103.247
  91.793 -71.656 127.360-157.694
 130.581-177.165 134.671 -39.694
 120.147-160.234 175.691-157.973
 126.345 -90.871 123.453-119.039
 122.103-175.140 152.584 -14.184
 138.497 -70.481   0.000   0.000
 110.771 -11.659   0.000   0.000
  93.372 104.140 101.429 -99.875
 121.137-110.675 116.529 -81.761
 134.171 -91.705 153.119 -59.841
 129.444-118.589   0.000   0.000
 130.041 -81.531 123.557 -48.916
 113.763-142.213 100.344 -85.000
 112.268 136.069 119.294-126.912
 106.265 -29.650  99.173-101.391
 118.802   0.000 144.876-105.124
 #  29 total E   -5.48290E+01 rmsd from N    0.000 %NC  0.00
 119.728-161.225 139.150 -12.808
 119.492-104.869 142.233 -85.489
  94.339 113.525 136.512-111.123
 123.778 -97.247 166.219-116.706
 113.571 139.397 134.613 106.769
 131.228-103.204  93.063-122.215
 109.227 120.679 149.728-126.566
 121.877 -96.432 129.488-135.790
 113.669   8.498 149.941 -19.770
  96.391  92.174   0.000   0.000
 116.624 -46.784   0.000   0.000
  92.876  72.413 132.192-153.576
  93.530 114.363 118.126 -80.484
  90.478 -38.148 118.141 -78.082
  97.096 -67.866   0.000   0.000
 103.522-169.586 113.515 -22.445
 121.050-113.218 116.999-121.930
 118.562-147.985 114.359-115.354
 115.040-111.752 138.779-155.637
  94.649   0.000 116.381 -77.303
 #  30 total E   -5.47545E+01 rmsd from N    0.000 %NC  0.00
 118.472 -72.310 104.837 -71.763
 110.384 -87.531 127.155 -65.671
 110.749-174.320 119.431 -69.530
 123.470-170.070 140.685 -97.821
 103.415 178.583 139.516-131.819
 131.057-172.312 163.973 178.714
 115.667-179.102 168.870-144.654
 127.786-172.722 149.357 160.896
 121.209 -64.701 150.185 -20.452
  95.911  67.337   0.000   0.000
  93.883  34.719   0.000   0.000
  98.384 169.905 126.960-144.136
 116.365 172.139 119.872 -79.798
 131.741-176.873 126.553 -79.173
  94.693  65.345   0.000   0.000
 113.909 -74.210 110.522 -59.097
 115.710-110.706 121.675-131.467
 113.571-145.583 100.911 -90.458
 117.029-120.858 128.616-138.817
  94.775   0.000 117.514 -78.160
 #  31 total E   -5.46121E+01 rmsd from N    0.000 %NC  0.00
  93.708  19.632 106.128 -80.813
  93.372 153.817 135.641 -29.189
 105.360 167.381 125.048-121.474
 126.892 -55.645 166.685-134.950
  91.856 117.150 124.206-124.818
 117.648 -73.798  82.379 -83.524
 109.501-168.402 151.564-165.931
 135.364-177.181 138.035-123.697
  92.475 -32.256 106.565 -80.329
 109.470 -82.709   0.000   0.000
 128.473 -52.744   0.000   0.000
 121.665 178.023 118.677-120.165
  93.949  87.466 114.182 -77.257
 117.757-115.783 117.081 -79.015
  95.817  76.912   0.000   0.000
 136.021 -82.418 133.871 -54.849
 120.320-161.474 117.817-123.270
  92.681  50.223  99.159 -95.019
  92.916 121.357 132.948-158.831
 119.542   0.000 118.960 -81.485
 #  32 total E   -5.42310E+01 rmsd from N    0.000 %NC  0.00
  93.826 116.318 146.384 -24.540
 118.384-176.765 151.759 -15.934
 118.778-179.829 169.767 169.138
 123.453-168.132 172.250 178.499
 120.285-160.809 113.947 -47.324
 124.727-112.944 126.611 131.232
 124.376-179.052 152.453-138.026
 112.704 176.262 112.181-122.901
 128.009-178.226 116.290 -78.722
 123.184   8.853   0.000   0.000
 119.789 -43.038   0.000   0.000
 110.507 110.871 130.214-143.573
 132.346-100.646 151.945 -79.956
 129.275-161.203 122.640 -80.610
 136.156-106.218   0.000   0.000
 127.340 -86.755 113.436-121.584
 118.668-107.930 118.353-125.092
 118.563-137.846 111.140-111.465
 118.342-117.828 118.823-123.321
 121.157   0.000 121.935 -79.568
 #  33 total E   -5.40913E+01 rmsd from N    0.000 %NC  0.00
 119.117-135.064 110.907 -81.132
 117.225 172.867 144.894 -26.050
 114.572 154.316 136.403-122.848
 125.208-129.764 161.184-103.582
  91.334 118.340 129.862-131.374
  93.096  63.543 122.215  30.247
  91.200  36.443 152.064-143.518
  92.754  74.745 126.839-136.728
  94.033  15.942 145.496 -32.588
 135.967 -77.745   0.000   0.000
 109.502 -22.756   0.000   0.000
 105.898-174.448 130.062-145.892
 123.075-175.084 141.338 -50.079
  94.011 124.090 115.579 -76.242
 134.129 -69.044   0.000   0.000
  93.221  83.302 115.676 -58.708
 131.070-169.762 104.426 -98.576
 127.127-170.914 104.915-100.123
 116.887-118.629 132.995-150.575
 121.831   0.000 121.844 -80.682
 #  34 total E   -5.39917E+01 rmsd from N    0.000 %NC  0.00
 116.615-139.819 152.026-149.461
 128.209-176.478 176.455-156.464
 121.635 171.111 166.803 160.509
 113.149-177.737 167.849-112.819
  92.745  79.963 132.862-112.050
 119.279 -93.774 112.364-115.884
  93.482 105.564 151.173-154.299
 135.057-105.915 140.290 -97.792
 127.836-162.183 108.626 -78.679
 126.977 172.514   0.000   0.000
 113.966  -5.092   0.000   0.000
 119.014-143.605 108.247-107.788
  93.935 110.170 136.746 -49.463
  92.095  -9.612 111.881 -78.478
 103.369 -89.732   0.000   0.000
 110.514-116.775 135.749  57.610
 118.350-109.990 119.687-128.124
 118.884-148.029 113.083-113.129
 112.580 133.565 137.725-155.279
 119.712   0.000 120.144 -80.521
 #  35 total E   -5.37926E+01 rmsd from N    0.000 %NC  0.00
 112.605 156.048 149.072 -38.704
  91.703  89.257 132.706   4.223
  91.394  45.358 106.566 -91.689
  91.369  52.721 145.559-100.676
  91.401 -77.559 130.211-146.123
 129.228-179.646 137.327 -56.124
  92.817 105.983 142.840-104.895
 120.726 -85.546 128.529-140.846
 119.720 -61.758 149.867 -19.979
 125.011-166.713   0.000   0.000
 132.115 -51.542   0.000   0.000
 107.116 175.446  98.431 -90.547
 125.170-178.823 121.174 -80.346
 125.434-173.973 121.909 -80.003
 135.684-102.177   0.000   0.000
 126.398-101.640 125.226 -52.009
 120.768 133.177 118.047-123.752
 122.809-173.051 119.420-121.520
  93.651  58.677 101.166 -97.820
  93.322   0.000 114.380 -77.708
 #  36 total E   -5.36540E+01 rmsd from N    0.000 %NC  0.00
 124.430-126.977 175.183-165.913
 116.547 177.136 151.513 -21.881
 113.004 107.631 169.236 168.423
 121.057 -98.817 111.919 -70.972
  90.534  69.582 130.972-164.862
  92.156 107.102 129.323  -6.690
  92.362 -70.309 123.927 -98.963
 122.319-169.024 136.485 137.889
 118.063-178.373 156.615-137.222
  96.747  74.624   0.000   0.000
 132.133 -75.305   0.000   0.000
  99.946 -36.809  96.561 -91.649
  93.289 138.478 114.325 -76.371
 117.107-178.345 134.868-126.744
 130.212 176.769   0.000   0.000
 129.487 -99.456 106.085 -55.740
 117.782-108.448 115.622-120.541
 119.352-141.899 109.433-109.800
 118.586  -2.524 126.485-133.542
 118.844   0.000 120.277 -80.284
 #  37 total E   -5.35677E+01 rmsd from N    0.000 %NC  0.00
 119.910 -96.896 143.427 -11.831
 120.000 -88.900 132.372 -70.921
  95.900 156.571 128.169-111.536
  93.050  58.088 138.870-103.248
  90.939  87.609 110.658 -68.391
 102.496  -0.053 128.597 -48.725
  93.827 -85.263 154.839-145.691
 127.229 -77.431 124.085 117.841
 125.488-171.151 114.614 -81.914
 141.275 -62.654   0.000   0.000
  95.515  12.769   0.000   0.000
 104.660 -80.999 130.554-147.596
 123.977 -43.301 122.775 -78.198
 138.365-173.180 128.794 -86.790
  95.946 150.643   0.000   0.000
 134.364 -84.392 147.377-124.311
 118.492-109.027 112.539-119.840
 119.104-141.061 109.231-108.140
 114.874 132.262 129.695-141.156
 119.623   0.000 119.460 -80.948
 #  38 total E   -5.34003E+01 rmsd from N    0.000 %NC  0.00
  93.863  92.228 142.465 -26.784
 118.531 179.691 157.041  -8.472
 110.199 140.237 169.678-167.463
 127.504 -67.508 135.145 -74.533
  91.622 -74.707  95.411 -54.891
  93.392 104.855 103.640 136.048
  92.060 151.440 144.360 -26.666
  92.187  80.012 145.910-141.214
  92.503 117.107 142.250-120.040
 131.936 -81.865   0.000   0.000
 105.837 -34.614   0.000   0.000
  95.214 164.086 103.308-102.126
  94.215  99.392 124.101-148.455
 122.881 166.400 122.302 -80.137
  95.297  98.626   0.000   0.000
 127.750 -85.214 116.221-134.258
 119.378-111.123 116.282-121.750
 119.473-141.388 111.089-110.745
 113.734 134.544 131.325-143.428
 118.720   0.000 142.296-110.556
 #  39 total E   -5.33164E+01 rmsd from N    0.000 %NC  0.00
  93.755  11.744 107.939 -79.565
 117.763 173.480 151.299 -33.366
  93.020  81.857 134.543-107.076
  91.212  70.213 137.901-110.488
  90.342 140.340 104.127 -81.320
  91.463 105.725 119.554  24.960
  92.241 125.155 127.812-127.997
 118.835 -75.353 136.963-122.586
 111.524 -54.447 105.187 -81.016
 127.760  -3.427   0.000   0.000
  95.585 169.663   0.000   0.000
 116.906 161.477 127.120-135.391
 124.149 172.974 120.602 -80.410
 126.270 -65.441 121.752 -79.999
 126.052  70.587   0.000   0.000
 130.167 -81.002 141.268-164.634
 118.290-109.238 120.419-128.957
 113.305-141.528  96.689 -92.592
 110.582-135.349 101.408 -97.774
 120.630   0.000 143.041-147.087
 #  40 total E   -5.31372E+01 rmsd from N    0.000 %NC  0.00
 116.789-179.768 114.308 -81.038
  91.379  84.882 127.071   7.739
  91.907  32.126  91.970 -81.390
  93.628  70.091 140.363-101.548
  91.856 -38.201 131.078-152.303
 124.498-163.465 140.996 -35.343
 118.375-175.704 139.707-132.688
 126.069-176.787 128.023-119.731
 115.839-179.137 150.632 -19.636
 140.118-173.927   0.000   0.000
  92.578  42.422   0.000   0.000
  95.908-145.570 129.860-150.979
 127.259-166.849 122.207 -80.179
 125.799-175.367 121.895 -78.434
  95.111  85.402   0.000   0.000
 124.337 -72.870 142.497 176.309
 118.653 140.181 119.001-126.280
  99.530-172.332 101.486-101.637
 117.570-111.084 126.852-138.269
 120.212   0.000 143.489-109.077
 #  41 total E   -5.25109E+01 rmsd from N    0.000 %NC  0.00
 117.638-152.023 149.161 -22.004
 115.891 169.069 150.670 -25.612
 127.168  52.321 163.551 163.843
 128.565 -76.412 156.075 -65.536
  92.192 177.827  95.473 -56.473
 126.828 173.274 152.192-154.654
  91.802  95.713 147.234 -83.031
  91.518 103.652 103.257 -80.523
  91.925 -80.906 135.718-143.787
  95.599 164.917   0.000   0.000
 130.123-133.472   0.000   0.000
  92.400  57.964 103.801-102.438
  92.349 178.161 112.928 -77.001
 122.365 148.072 133.807 179.320
 131.300 -81.041   0.000   0.000
 118.927-130.475 116.141 -34.808
 118.465-105.677 141.847-158.872
 119.008-136.288 105.821-105.987
 117.994-123.850 121.671-126.895
 120.838   0.000 147.644-132.222
 #  42 total E   -5.22017E+01 rmsd from N    0.000 %NC  0.00
 119.413-119.278 110.713 -80.411
 117.421 179.006 142.632 -33.580
 129.004 166.968 162.769 167.308
 116.715 102.221 174.023-161.335
 125.868-109.706 138.333 -91.895
  93.590  96.444 100.164-138.913
  93.186 -83.274 142.379 -99.965
 123.706-169.097 134.900 146.217
 122.391 179.618 144.477 -35.126
 132.193  30.140   0.000   0.000
  95.316  30.497   0.000   0.000
 102.801 167.047  97.677 -77.832
 115.633 173.821 143.788-149.405
 121.018-178.251 124.684 -88.128
  96.171  85.559   0.000   0.000
 122.554 -83.669  99.970-112.640
 105.947 132.623 117.514-130.845
 125.603-171.105 112.914-111.377
 117.292  -6.462 124.742-131.737
  93.415   0.000 115.837 -76.957
 #  43 total E   -5.19579E+01 rmsd from N    0.000 %NC  0.00
 119.560-119.687 110.156 -79.317
 121.191-178.506 161.987-143.747
 129.489 174.278 160.502-174.670
 122.745 166.376 159.430 -53.133
  91.807 -63.302 120.323-120.205
  92.843 148.265  91.344 -77.113
  92.100 119.033 134.384-120.204
  89.911 -34.564 117.215-131.111
  90.836 -61.318 143.846-129.758
  94.082  13.022   0.000   0.000
 120.794 -59.801   0.000   0.000
 105.219 166.740 131.294-148.554
 122.391 175.884 150.769-116.905
 125.963 -91.707 121.917 -80.234
 125.556-176.403   0.000   0.000
 128.750 -88.706 118.962 -54.701
 117.883-108.487 118.470-124.836
 119.065-141.604 110.839-110.486
 115.961  -2.037 129.364-139.754
 118.817   0.000 120.321 -80.147
 #  44 total E   -5.19180E+01 rmsd from N    0.000 %NC  0.00
 117.411-159.266 148.434 -24.255
 118.705 178.962 159.076 -13.181
 128.278 118.042 162.633 175.178
 123.175-122.985 121.726 -70.908
  91.722  73.431 117.714 -61.672
 121.586 -70.260 145.600 132.449
 107.327-172.238 153.492 -23.816
 128.327-174.769 111.983-118.944
 117.749-178.947 150.933 -18.468
 135.807 -68.915   0.000   0.000
 127.617 -38.058   0.000   0.000
 130.375 174.598 100.651 -90.960
  93.250  89.333 114.794 -76.617
  94.316 -10.556 113.810 -77.242
 127.656 -30.099   0.000   0.000
 128.212 -79.395 142.976 175.060
 118.883-110.935 112.400-116.565
 118.859-138.186 114.438-115.757
 116.965-118.668 128.568-136.540
 121.824   0.000 121.637 -80.958
 #  45 total E   -5.18518E+01 rmsd from N    0.000 %NC  0.00
  93.627  49.901 143.974-128.499
  92.955 173.771 157.648 -21.178
  95.459  91.386 176.417 179.932
 116.585 -98.651 112.453 -60.558
  91.477 174.420 145.717  65.105
  93.730  84.662 128.215 -18.954
  91.758 113.957 131.330-102.795
  91.649 -49.285 121.481-144.231
  92.142 -49.075 147.171 -24.136
 112.558-166.540   0.000   0.000
 124.064 -34.003   0.000   0.000
  92.416  66.763  96.458 -85.810
  91.149  87.786 135.445 158.568
  92.498  -1.212 114.707 -81.990
 112.559 -46.383   0.000   0.000
 130.019  83.476 136.901-145.385
 129.287-168.930 110.025-107.365
 120.330-112.514 110.629-109.954
 122.192 113.604 115.551-117.734
  93.442   0.000 114.753 -77.642
 #  46 total E   -5.17725E+01 rmsd from N    0.000 %NC  0.00
  93.798 101.874 145.279 -27.430
 116.316 173.602 151.613 -28.687
 115.800 174.419 116.839 -65.223
  93.761  75.160 133.138-118.949
 113.767 -87.589 131.426 -20.168
 117.985-168.935 140.385-132.889
 119.250 179.564 153.560 -25.786
 116.425-179.328 118.160-131.089
 121.982 -56.037 159.595-161.110
 130.145 -10.312   0.000   0.000
 123.625 -35.329   0.000   0.000
  94.190  91.875 131.439-154.230
 131.915-125.178 120.634 -81.658
 130.392-175.452 124.817 -79.066
  95.000  77.825   0.000   0.000
 123.805 -82.702  95.904-103.549
 114.534 133.263 116.541-125.240
  92.427 126.044 105.555-118.599
  92.769 130.560 101.008-115.822
 118.323   0.000 130.532-139.593
 #  47 total E   -5.14256E+01 rmsd from N    0.000 %NC  0.00
  93.723  37.683 107.391 -79.845
  92.175  87.789 140.434 -97.202
  93.541 106.484 176.444 177.772
  93.549  -3.640 167.862-160.090
  92.187 -85.990 125.210 -49.080
  92.724 169.617 126.427 -27.330
  91.121  91.023 119.495-132.041
  91.505 100.339 133.646-109.558
  93.284 -12.768 109.596 -92.257
  96.386 173.901   0.000   0.000
 133.702 -54.067   0.000   0.000
  94.513 -34.052  99.023-102.940
  93.231 107.567 114.261 -76.480
 122.520-149.435 120.163 -84.978
 133.294-108.346   0.000   0.000
 134.901 -87.833 150.110 -79.094
 108.834-168.120  96.906-126.104
  93.029  51.726 124.745-145.262
  93.366  44.940 129.295-152.179
  93.318   0.000 115.696 -76.445
 #  48 total E   -5.13673E+01 rmsd from N    0.000 %NC  0.00
  93.857 126.320 149.332 -15.058
 127.678 -59.380 157.003-130.903
 117.856  84.923  98.037 -86.217
 129.352 -99.384 166.033-172.785
  92.356  81.696 129.710-131.128
  93.304  98.548 100.305 -94.964
 110.353-105.403 142.989-136.080
 124.193-177.626 134.429-135.839
 122.571-179.854 152.773 -16.954
 129.281  14.506   0.000   0.000
 122.565 -36.523   0.000   0.000
 110.140 112.688 130.469-144.100
 128.662 -99.154 120.094 -80.657
 127.257 -62.148 121.882 -80.135
 129.718 -22.549   0.000   0.000
 133.955 -80.879 145.406 146.084
 119.308-118.027 102.755-104.313
 105.804-167.574 102.689-102.036
 115.905-118.593 133.841-147.735
 120.977   0.000 149.320-102.883
 #  49 total E   -5.11815E+01 rmsd from N    0.000 %NC  0.00
 116.652-142.162 152.323-148.909
 121.908-175.620 158.368-154.843
 130.334 -95.919 150.464   3.336
 122.226-168.557 121.952 -69.962
  91.010  91.794 119.614 -88.237
  92.488  62.488 114.466 138.483
  92.081 142.014 149.955 -30.544
  91.581  77.529 135.566-112.442
  94.211  33.359 101.713 -82.193
 146.697 -69.631   0.000   0.000
 118.176 -13.682   0.000   0.000
 108.506-144.030  93.809 -77.406
 132.063-166.590 120.802 -86.838
 132.128 -61.343 119.689 -82.526
  96.168  62.534   0.000   0.000
 129.664-150.102  78.685 -67.624
  94.088 116.268 130.784-154.908
 109.076-175.489 120.049-127.116
 114.128 144.199 135.466-151.270
 119.164   0.000 144.950-103.517
 #  50 total E   -5.07800E+01 rmsd from N    0.000 %NC  0.00
  93.605  44.449 143.609-132.137
  92.551 155.491 139.605 -45.545
  94.167  70.948 176.407-176.782
  93.732  -5.693 122.675 -63.504
 122.948-101.114 132.473-111.779
 142.830   1.670 124.312 141.795
  94.706  90.374 141.160 -48.772
 128.340-110.845 149.578 157.429
 126.351 -78.279 114.000 -78.957
  96.475  58.144   0.000   0.000
  94.276  37.713   0.000   0.000
  90.727  61.901 101.207 -99.275
  90.470 134.121 118.054 -75.736
  92.933 -63.290 114.853-149.274
  95.323  78.051   0.000   0.000
 126.937 -86.318  89.213 -89.829
 124.221-170.675 114.806-116.426
  92.723  49.353 104.630-114.230
 106.042-108.143 127.756-144.244
  94.581   0.000 116.589 -77.451
 #  51 total E   -5.07600E+01 rmsd from N    0.000 %NC  0.00
  93.709  43.205 108.694 -80.445
  92.894 109.452 150.817 -37.092
 127.540 -95.771 154.527   3.863
 123.065-167.704 130.312 -60.503
  92.089 -65.163 104.280-110.542
 109.050-176.270 136.343 -31.271
 122.133-178.691 146.438-155.948
 117.611 178.947 148.991-105.567
 126.305-177.550 111.476 -82.536
 116.809  32.689   0.000   0.000
  92.240  48.240   0.000   0.000
  89.877  61.366  98.562-102.873
  89.881 142.049 112.132 -76.940
  94.523 -62.628 112.453 -80.132
  95.308  75.353   0.000   0.000
 127.100 -91.003  81.617 -73.280
 123.577-166.471 114.214-115.685
 120.429-112.387 117.538-118.901
 121.123 115.624 121.131-123.467
  93.392   0.000 114.806 -75.034
 #  52 total E   -5.07572E+01 rmsd from N    0.000 %NC  0.00
  93.747  85.994 147.506 -32.205
 117.541-179.356 152.290 -20.205
 112.749 174.383 116.118 -64.783
  92.008  79.864 124.851-112.098
  90.854   8.973  95.543 -90.793
 101.564 -98.319 159.910  19.977
 123.110 178.011 154.632-168.458
 121.681-179.734 150.008 -75.457
 119.806 -66.807 157.002-154.610
 125.234-168.909   0.000   0.000
 124.651 -56.757   0.000   0.000
 111.040  14.573  90.766 -80.100
  92.433 -64.513 113.587 -79.228
  90.041   2.145 114.499 -75.146
 120.042 -30.231   0.000   0.000
 123.617 -72.145 138.895 -34.754
 113.802-143.405  98.100 -83.165
 112.517 135.835 120.074-128.351
 106.445-119.670 101.115-102.294
 120.596   0.000 145.020-121.872
 #  53 total E   -5.07058E+01 rmsd from N    0.000 %NC  0.00
 118.475-151.143 146.891 -19.661
 121.284-178.639 160.178-150.516
 121.399 174.325 155.400   0.691
 119.021 174.284 164.056-110.999
  91.266  71.176 147.014-151.001
  91.620 130.765 142.137  11.957
  92.118  76.593 121.241-122.665
  91.912 132.652 119.877 152.660
 122.736 162.928 142.170 -40.935
 114.186 153.634   0.000   0.000
 134.724 -66.807   0.000   0.000
 108.410 -68.655 128.669-142.397
  91.521  75.294 114.888 -76.403
  93.890 132.445 113.148 -77.111
 139.376 -87.741   0.000   0.000
 123.783-105.467 118.499 -48.187
 119.146 131.908 120.688-128.332
  92.756 125.458 106.276-111.986
  92.612 131.436 101.229-116.787
 118.354   0.000 129.908-139.411
 #  54 total E   -5.06351E+01 rmsd from N    0.000 %NC  0.00
  93.788  16.227 146.195 -28.160
 117.927-174.790 149.996 -16.389
 129.845 -99.191 168.486 164.182
 124.435-169.885 137.215 -77.131
 113.363 179.077 131.382 -16.988
 122.416-178.674 148.655-117.450
 114.735 177.281 148.334-102.415
 128.082 179.826 137.935-130.846
 120.232 179.513 110.644 -75.659
 137.738 -62.033   0.000   0.000
  93.204  48.024   0.000   0.000
  91.011  38.977  96.242 -96.206
  92.756-103.087 110.656 -76.904
 124.236 -75.082 149.113 -66.143
 123.032  62.938   0.000   0.000
 125.910 -79.402 152.833 -30.982
 118.527-114.849 111.137-113.653
 116.239-137.693 131.804-142.971
 112.826-127.099 100.326 -87.331
 120.719   0.000 146.478-134.048
 #  55 total E   -5.06169E+01 rmsd from N    0.000 %NC  0.00
 117.290-132.829 153.560-150.529
 117.063 170.056 141.177 -29.427
  94.624  81.724 131.823 116.208
 129.546 -98.818 160.000 -43.630
  92.044 105.400  91.960 -75.642
 103.402   4.268 144.043-125.519
  93.161-102.275 145.992 -92.163
 109.987 166.539 129.619 146.108
 123.206 -80.941 149.118 -33.107
  95.621  81.352   0.000   0.000
 150.393 -27.593   0.000   0.000
 127.290-156.838 105.534-101.612
 108.206 165.576 117.760 -78.221
 123.009 -67.625 118.023 -81.444
 114.391 -18.617   0.000   0.000
 121.015 -93.534 138.272 159.133
 126.783 133.319 121.087-124.939
 127.144-173.411 113.824-109.802
 116.391-118.640 131.836-144.120
 120.935   0.000 148.977-105.056
 #  56 total E   -5.05302E+01 rmsd from N    0.000 %NC  0.00
  93.807  79.610 151.189-162.813
  91.857  92.011 153.977 -92.322
  93.739  63.141  82.883 -91.013
 113.793 -84.393 163.851-134.793
 102.401 179.838 137.187-132.296
 132.718-178.171 146.655-171.425
 119.291-177.111 153.630 -17.388
 118.900-178.382 119.180-123.852
 120.990-179.436 158.049-159.099
 136.636 -71.615   0.000   0.000
 131.201 -38.695   0.000   0.000
  91.900  63.036 103.058-104.338
  90.682  61.399 112.482 -76.664
  92.835  40.312 112.196 -80.247
  95.698  71.823   0.000   0.000
 121.426 -78.136 133.280-111.979
 119.348-159.547 118.743-126.348
  93.497 116.709 106.562-105.305
  92.760 131.020 100.561-106.435
 118.450   0.000 132.014-139.072
 #  57 total E   -5.04474E+01 rmsd from N    0.000 %NC  0.00
 116.751-175.166 108.308 -82.769
 123.750-178.821 152.382-141.584
 120.643 166.850 142.541 -33.660
  92.710  82.948 130.754-117.390
  91.200 -31.603 109.507 -36.594
 126.346-172.268 134.567 -49.882
 120.496 175.742 148.586-138.754
 121.494-171.248 163.922-120.398
  94.614  16.311 145.294-122.870
  96.897  90.444   0.000   0.000
 124.062 -39.101   0.000   0.000
  93.638  77.531  90.893 -82.953
 143.138-112.570 127.929 -81.269
 126.451 -58.006 120.446 -80.017
 119.555  -6.511   0.000   0.000
 107.840  90.350 120.963 -30.082
 121.456-107.317 108.862-111.689
 118.421-142.996 133.198-141.864
 135.477   0.231 104.366 -92.678
 117.333   0.000 131.438-122.686
 #  58 total E   -5.02974E+01 rmsd from N    0.000 %NC  0.00
 113.317 162.939 151.192-132.790
  91.490  75.354 143.973-118.552
  90.899  49.122 121.514 -38.958
  91.340  68.491 133.237 -96.761
  90.365  21.691 127.648 -71.592
 102.022 -95.272  96.192-115.229
 121.022-173.278 151.260-133.714
 120.087 177.846 137.474 151.653
  93.388 -57.625 103.510 -68.470
  95.774   7.550   0.000   0.000
 117.566 -52.239   0.000   0.000
  92.921 -32.933 134.573-160.320
  93.254 102.278 115.272 -76.617
 125.553 175.905 119.741 -81.115
 118.801  67.577   0.000   0.000
 123.701 -74.829 144.150 -44.272
 119.343-142.699 112.813-115.733
 101.162-172.666 103.521-101.387
 116.360 143.423 130.394-144.065
 119.084   0.000 144.139-106.381
 #  59 total E   -5.01221E+01 rmsd from N    0.000 %NC  0.00
  94.070 133.712 139.955  -1.196
 114.182 109.486 154.132-153.913
 132.279 -78.126 145.086  -3.625
 107.941 -49.304 160.060-111.035
 120.859-173.375 145.445-138.594
 118.404 169.782 107.948-138.553
  92.290 107.058 142.754 -43.451
  94.764 163.870 118.303-153.362
 119.319-174.537 151.668 -16.920
 137.429 -61.658   0.000   0.000
 109.170 -23.744   0.000   0.000
  97.137 166.578 101.683 -98.671
 125.027 179.792 141.367-135.088
 119.419 119.274 146.746 -72.427
 133.131-100.720   0.000   0.000
 119.999 -93.353 141.925  52.938
 119.271-109.898 119.052-121.573
 116.650-108.940 120.615-124.874
 111.540-147.174  95.800 -89.656
 124.513   0.000 123.524 -85.125
 #  60 total E   -5.00996E+01 rmsd from N    0.000 %NC  0.00
 117.790-157.110 148.333 -21.673
 111.568 165.482 145.829 -34.588
  93.409  75.407 108.141 -80.925
  93.653 159.954 141.651 -88.481
  92.269  79.480 140.278-133.057
 130.642 -63.616 106.232-106.170
  90.936  76.968 140.669 166.055
  91.578  11.838 132.459 -94.110
  95.789 -85.499 149.877 -24.274
 130.617 -53.345   0.000   0.000
  93.534 -32.095   0.000   0.000
  96.474 159.247 132.889-155.410
 121.335 174.622 119.325 -79.801
 128.926 178.897 160.004 -39.940
 121.998 172.598   0.000   0.000
 129.813 -85.454 135.739 165.960
 120.023-166.036 118.293-124.634
  92.564  54.230 127.296-147.990
  93.313  24.188  93.487 -94.869
  93.384   0.000 117.160 -77.600
 #  61 total E   -5.00770E+01 rmsd from N    0.000 %NC  0.00
  93.903  98.718 139.950 -24.078
 118.288 175.849 145.711  -8.513
 109.840 -67.211 139.307-118.985
 123.627  66.873 137.289-107.796
  89.552 -76.712  98.798 -50.520
  91.177   0.254 122.772 -53.899
 108.606  79.209 153.842 -19.289
 140.007 -84.472 151.620 135.040
 124.061-168.600 155.532 -11.564
 128.500-177.830   0.000   0.000
 126.156 -28.345   0.000   0.000
  92.274  69.699 102.301-101.072
  92.278 154.531 130.851-120.694
 136.157 154.480 123.035 -85.645
 131.873-106.443   0.000   0.000
 126.414-108.586 111.774 -46.936
 116.425-107.637 131.351-146.114
 113.499-137.296 101.288 -83.494
  93.521  84.126 128.832-152.076
  93.263   0.000 110.958 -77.193
 #  62 total E   -5.00379E+01 rmsd from N    0.000 %NC  0.00
 118.093-153.579 147.638 -20.979
 111.090 158.141 140.016 -38.831
  92.377  89.558 107.192 -70.577
  94.553   4.786 130.609 -86.843
  94.141 -94.444 108.984 -35.836
 114.431 -68.940 135.599 127.688
  91.565  84.408 145.535-134.036
  92.340  49.473 130.630-140.782
  93.524-174.505 144.320 -16.497
 116.980  28.050   0.000   0.000
 120.658-165.673   0.000   0.000
 115.557 169.053 131.344-143.178
 124.014 179.546 147.652 -91.835
 125.952-177.092 123.092 -78.854
 123.029 174.247   0.000   0.000
 129.987 -85.228 131.304-150.200
 118.666-109.251 115.738-120.957
 118.895-139.620 114.871-116.126
  93.367  71.121 102.048-102.793
  93.312   0.000 112.993 -77.821
 #  63 total E   -4.99582E+01 rmsd from N    0.000 %NC  0.00
  93.719  21.470 109.410 -80.493
 115.280 177.504 155.194-124.323
 104.422 161.374 128.301 -40.992
 129.268 -58.852 139.310-113.890
  91.668 -25.816 135.000-145.316
 117.271-174.539 142.296-111.854
 108.475  92.489 140.463 -93.086
 121.098 -92.487 133.116 130.552
  94.674  43.666 148.546 -23.309
 146.085 -74.696   0.000   0.000
 130.406 -28.295   0.000   0.000
 119.893 118.972 114.215-114.911
 138.870 -92.559 123.084 -83.014
 117.263  64.404 119.794 -78.884
  95.520  82.694   0.000   0.000
 122.445 -71.512 126.001 -92.020
 115.613-113.608  90.418 -86.127
 119.026-146.793 112.092-112.837
 114.979-126.467 137.281-155.770
 121.081   0.000 149.336-129.315
 #  64 total E   -4.98513E+01 rmsd from N    0.000 %NC  0.00
 118.324-148.471 147.535 -20.157
 117.553 170.292 134.895 -68.401
 128.612 103.898 161.687 157.412
  83.294 -58.496 133.353 -89.851
  89.472 -55.870 103.406 -51.175
  90.673 130.520  99.023 -60.718
  92.055  91.862 157.921-175.546
  91.899   8.107 146.286-157.273
  94.399-168.695 147.267 -28.077
 124.529 176.698   0.000   0.000
  92.974  51.058   0.000   0.000
  90.306  37.862  86.740 -83.982
  92.672-136.413 109.977 -77.315
  93.825  42.863 115.695 -76.060
 161.339 -52.807   0.000   0.000
  94.596 156.333 138.873 -64.646
  94.302 133.182  91.958-117.684
 125.695-171.814 111.912-110.216
 107.096  -6.678  95.511-100.890
  93.431   0.000 114.788 -77.237
 #  65 total E   -4.98488E+01 rmsd from N    0.000 %NC  0.00
 115.947 178.755 145.674 -28.729
 114.359 176.456 154.299 -13.612
 132.026 -84.690 165.724 178.582
  90.751  64.205 130.707 -97.843
  90.526  26.367 104.920-104.807
  98.458 -88.582  93.164-111.397
 132.053-175.931 157.489-151.384
 124.193-176.556 142.329-102.830
 121.720-178.014 151.284 -18.515
 126.291 172.116   0.000   0.000
 134.401 -57.134   0.000   0.000
 117.476 176.485 126.359-133.289
 124.243-179.638 147.223-101.416
 125.587-179.168 121.758 -80.093
 127.000 171.408   0.000   0.000
 128.973-102.515 140.403  78.172
 121.866 132.581 119.734-126.269
  92.854 128.020 104.028-104.413
 105.183-103.189 101.455-113.571
  94.629   0.000 134.146-131.425
 #  66 total E   -4.97802E+01 rmsd from N    0.000 %NC  0.00
 119.547-124.717 109.732 -79.172
 121.388-178.728 158.704-152.204
 123.157 175.484 153.996  -0.785
 119.479-178.595 165.552-128.658
 115.513-176.568 163.291-150.895
 130.895-178.166 150.853 177.301
 114.631 175.186 151.209 -28.896
 109.374 161.651 123.263 144.110
 118.561 -68.374 126.031 -92.413
 123.029   0.870   0.000   0.000
 116.840 -22.070   0.000   0.000
 115.395-142.575 126.540-134.526
  92.425  91.099 117.584 -76.798
  93.199  23.605 113.130 -77.604
  96.317  79.575   0.000   0.000
 124.923 -67.045 134.745-100.191
 122.078-147.589 105.382-104.149
 107.328 135.976 117.554-126.728
 121.993  67.472 118.494-122.663
  93.249   0.000 112.291 -76.362
 #  67 total E   -4.96815E+01 rmsd from N    0.000 %NC  0.00
  93.629  48.358 143.868-132.222
  93.089 169.600 136.352 -31.171
 109.350 170.522 141.392-113.101
 120.121 175.836 136.901 -88.267
 104.420 164.091 134.744-129.679
 120.528 166.970 147.241-146.350
  91.380  67.972 149.929 -35.670
  92.061  74.642  90.740-114.557
  92.289 -48.219 141.696-133.465
 114.943-159.989   0.000   0.000
 125.613 -36.000   0.000   0.000
  91.351  64.936 101.727-102.221
  91.561  12.157 111.624 -76.743
 106.151 -85.849 121.907 -77.352
 128.701 -73.381   0.000   0.000
 126.553-113.566 131.552 -38.529
 116.569 124.871 118.458-127.539
  92.367  47.694 106.813-113.444
  93.093  96.190 127.841-149.743
 121.260   0.000 120.604 -85.928
 #  68 total E   -4.93151E+01 rmsd from N    0.000 %NC  0.00
 116.556-142.250 152.091-147.184
 123.608-177.485 166.471-147.184
 128.572 177.278 165.142 167.624
 133.883 179.081 156.196 -17.379
  90.923  87.748 128.410-155.606
  92.505 116.114 134.959  12.013
  92.467 164.853 122.184-124.804
 126.023-174.234 159.562-128.695
 127.453 -51.884 171.148-165.130
 131.100  81.333   0.000   0.000
 123.344 -51.449   0.000   0.000
 110.174 103.099 130.678-144.543
 121.032 -96.705 145.300 -84.668
 121.196-176.299 121.812 -79.717
 135.348 174.810   0.000   0.000
 123.390 -93.573 124.764  84.829
 123.324 135.632 120.577-125.651
 126.661-170.593 108.461-103.564
 118.653-120.393 122.585-128.854
 121.105   0.000 150.013-104.317
 #  69 total E   -4.92621E+01 rmsd from N    0.000 %NC  0.00
 116.782-137.884 152.377-150.931
 120.393 176.604 134.733 -63.455
 122.473 171.272 114.647 -89.902
 119.514  85.109 125.897-117.688
  90.769 -75.585 115.592 -34.385
  93.414 151.168 124.821 -39.551
  91.640  88.388 129.786-132.866
 107.799-101.391 105.654-125.067
 124.544 155.101 112.313 -79.965
 122.885  10.744   0.000   0.000
 115.972 -29.334   0.000   0.000
 111.799-151.343 124.928-134.354
 121.040 174.615 144.300 148.332
  95.000 -60.782 113.782 -75.543
  95.001  63.557   0.000   0.000
 129.009 -98.903 114.381-124.377
 125.923-163.569 120.435-121.356
 120.863  53.851 111.607-109.013
 114.781 -18.948 125.727-134.531
  93.541   0.000 134.192 -97.319
 #  70 total E   -4.88548E+01 rmsd from N    0.000 %NC  0.00
  93.794  14.338 146.061 -28.236
 115.391 176.592 148.744 -26.299
 118.134-179.704 117.900 -75.137
 120.088 173.231 159.573-124.276
  92.572  95.437 133.620-104.629
 124.741-111.774  99.483 -72.053
 120.868 171.412 151.668-146.748
  93.006  88.915 143.709-102.697
  93.608 -74.809 103.084 -80.667
  94.712 170.602   0.000   0.000
 139.654 -52.989   0.000   0.000
 102.081 -34.929  93.983 -96.023
  93.216 125.954 135.696 -96.465
 120.369 -68.463 120.392 -83.320
 140.518 -22.833   0.000   0.000
 130.178 -82.864 141.562-175.698
 118.840-112.906 110.509-113.514
 118.013-138.962 122.492-128.283
 115.950-118.617 134.648-144.845
 120.964   0.000 149.141-103.893
 #  71 total E   -4.87146E+01 rmsd from N    0.000 %NC  0.00
  93.618  16.345 144.130-132.184
 115.761 175.869 152.779 -16.498
 110.704 110.867 169.806 178.092
 124.221 -97.390 123.159 -69.941
 119.530-157.978 129.895  26.128
 134.476-155.638 154.162 132.785
 122.815 -87.860 163.466-152.345
 129.414 173.506 149.963 177.467
  93.131 -53.305 147.850 -24.161
  95.078  71.524   0.000   0.000
 137.029 -67.848   0.000   0.000
 133.820 109.663 114.080-106.858
 129.051-104.184 119.886 -77.401
 127.808 -70.329 152.103 -69.522
 132.244 -67.012   0.000   0.000
 122.377-110.216 112.505  87.713
 118.180-107.794 126.951-136.846
 119.423-137.676 109.492-108.095
 117.528-118.569 125.585-132.732
 120.965   0.000 147.944-111.777
 #  72 total E   -4.86626E+01 rmsd from N    0.000 %NC  0.00
  93.728 127.874 148.301-123.860
 108.424 106.850 153.775-139.786
 123.524 -68.206 108.696 -81.096
 111.828 -36.156 166.849-172.227
 121.006-178.602 127.916 -21.448
 124.869-168.857 110.038-123.796
 121.574 -85.060 143.767 -98.829
 116.528-172.043 106.452-108.647
 127.521 175.611 154.888-174.689
 121.038  14.485   0.000   0.000
 112.781 -44.627   0.000   0.000
 112.657 -85.252 126.418-136.319
  91.371  84.336 116.459 -74.656
  94.510  34.500 112.836 -77.950
  96.819  66.060   0.000   0.000
 134.351-104.358 128.315-119.079
 107.783-171.306  93.697-109.450
 124.099-141.945 123.348-125.548
 127.290 134.313 110.093-104.036
 118.968   0.000 143.390-120.102
 #  73 total E   -4.85838E+01 rmsd from N    0.000 %NC  0.00
 117.402-110.800 156.005 -17.653
 121.907 165.123 151.143-131.585
  93.154  74.465 166.083   6.505
  94.050  99.896 137.217 -84.197
  91.761 161.558 114.002 -22.594
 113.349 165.398 144.508 127.600
  92.910  93.226 152.843-118.061
 126.671 -80.589 142.079 151.428
 118.555-161.267 147.115 -24.961
  95.810  60.629   0.000   0.000
  92.404  28.079   0.000   0.000
  95.094-145.172 128.181-148.586
 117.967 167.296 150.497-109.133
 121.869 -76.845 147.938 -75.467
 132.674 -71.945   0.000   0.000
 127.587-157.888 113.536 -81.405
  93.212 115.613  97.435-120.453
 127.132-105.084 128.149-128.830
  92.773  71.891  92.645 -98.731
  93.292   0.000 108.939 -80.122
 #  74 total E   -4.85699E+01 rmsd from N    0.000 %NC  0.00
 116.584-141.380 151.989-149.225
 113.395 163.292 148.452 -36.621
  94.573  88.157 119.476 -79.325
 103.108 -91.588 117.410 -63.575
 110.820 -58.739  86.301  94.334
 125.414 -79.415 133.318 -43.919
  91.455  63.156 141.825 155.408
  91.534  69.229 130.938-130.424
  92.182 -49.682 100.042 -88.937
 122.450 -80.169   0.000   0.000
 124.406 -35.632   0.000   0.000
 114.459-179.168 122.337-129.121
 130.160-101.623 120.604 -79.149
 108.208 -74.605 117.734 -77.569
 123.317 178.546   0.000   0.000
 124.559 -99.904  99.286 -78.963
 116.885-167.734 119.550-127.859
  93.351 120.407 127.617-148.419
 120.013-120.804 119.660-122.950
 121.972   0.000 121.455 -81.063
 #  75 total E   -4.85573E+01 rmsd from N    0.000 %NC  0.00
  93.617  19.274 144.009-127.055
 118.454-179.750 159.627-145.197
 127.459 174.451 162.166-177.514
 122.281 173.625 160.362 -66.633
  92.354 162.263 129.524-124.181
 104.783 163.475 144.583 -11.335
  92.757  95.499 130.313-153.510
 115.527 -88.140 127.142-132.956
 116.348 -72.826 107.607 -79.865
 129.641-173.974   0.000   0.000
 130.212 -68.532   0.000   0.000
 103.908 -35.765 125.648-139.568
  91.159  98.973 113.765 -75.947
  93.621   8.463 103.944 -77.385
 131.122 -46.796   0.000   0.000
  94.762 157.781 110.649-139.900
 125.790-171.344 129.663-134.598
  93.649 123.054 105.299 -98.894
 125.288-120.087 109.839-107.099
 121.659   0.000 121.305 -80.868
 #  76 total E   -4.82754E+01 rmsd from N    0.000 %NC  0.00
 115.649-136.191 145.755 -99.344
 118.757 -91.881 168.070 -12.939
 118.734 170.976 155.094  29.081
  98.159 -48.075 160.822 149.902
  90.610 -16.932 115.677 -19.781
 123.343 170.057 176.464-161.586
  91.718  74.202 141.211-124.065
 121.118 -87.877 110.168 -92.859
 106.978 -61.785 107.189 -81.082
 121.676-166.613   0.000   0.000
 103.369 -17.510   0.000   0.000
  95.928 -64.017  86.478 -86.316
  92.293   6.532 113.421 -75.271
 121.168-102.927 148.742 -51.812
  95.565 163.141   0.000   0.000
 128.928 -88.727 131.564-129.677
 118.510-109.009 117.641-124.518
 119.288-137.753 110.572-110.143
 117.473-118.547 125.851-132.908
 120.892   0.000 148.038-111.712
 #  77 total E   -4.81874E+01 rmsd from N    0.000 %NC  0.00
  93.605 104.893 142.802-129.081
 121.442 179.713 163.500-157.503
 123.453 177.664 153.347  -4.323
 120.982 167.131 160.605-120.757
  91.802 172.550 143.746-130.987
  93.268  96.183 152.400-130.895
  91.650  -7.588 139.966 -42.502
  95.995 -84.610 135.440-127.591
 108.912 164.624 110.310 -80.313
 128.559  13.223   0.000   0.000
 120.579 -22.536   0.000   0.000
 112.043 -87.577  93.094 -87.666
 116.292 -34.147 114.528 -77.118
  93.039 -41.863 108.005 -77.991
 109.793 -18.348   0.000   0.000
 108.209 -65.185 128.644 123.584
  93.541 132.751 100.028-114.642
 104.953-112.350  93.000-101.649
 117.125-124.761 124.862-132.601
 121.219   0.000 150.888-119.781
 #  78 total E   -4.81467E+01 rmsd from N    0.000 %NC  0.00
  93.767  11.589 146.399 -29.860
 113.372 173.625 156.457-151.806
  94.456  93.842 165.130   7.726
 120.191 -93.278 109.679 -85.943
  90.627  77.358 124.537 136.930
  92.040 121.682 123.940 -33.560
  91.708 116.406 130.163-128.125
  93.896 -59.564 116.375-145.918
 109.417 -62.151 148.209 -20.015
 124.437-164.242   0.000   0.000
  94.200  45.013   0.000   0.000
 100.750 171.625 126.348-143.299
 124.744 179.962 121.438 -80.596
 124.733-179.479 149.252 -66.920
 126.894 170.925   0.000   0.000
 128.123-108.168 138.126 -40.075
 120.193 122.472 119.714-127.315
  92.881  50.660 124.514-144.838
  93.087  94.669 127.934-150.199
  93.430   0.000 127.998-115.482
 #  79 total E   -4.81136E+01 rmsd from N    0.000 %NC  0.00
  93.626  46.689 144.161-133.575
  92.748 158.779 126.368 -76.685
 118.387 117.829 109.403 -66.857
 131.215-114.159 162.600-119.189
  91.926  82.765 136.568-161.642
 112.127 -58.756 136.181   8.549
  91.816  90.433 143.782 -45.760
  95.926 -65.145 141.593-122.158
 126.086 -96.064 114.725 -75.737
  97.089 113.717   0.000   0.000
 133.649 -59.152   0.000   0.000
 125.571 173.660 115.122-112.309
  93.172  92.866 118.609 -79.449
  93.891  13.481 113.151 -77.364
 119.428  72.473   0.000   0.000
 124.299 -89.035 138.470-155.865
 105.963 133.904  99.573-109.545
 128.570-143.607 112.509-108.353
 117.916-121.284 126.872-134.092
 121.145   0.000 149.624-113.690
 #  80 total E   -4.80838E+01 rmsd from N    0.000 %NC  0.00
 117.416-164.558 147.721 -23.429
 117.165-178.795 147.377 -18.695
 121.793 173.465 163.726-177.374
 129.289 173.484 157.218 -43.209
  91.509  70.608 124.785-135.582
 112.924-158.645 136.332  30.107
 123.239-102.674 152.044 175.207
  93.055  93.101 126.081-135.396
  93.340   9.346 105.988 -83.248
 117.002-157.677   0.000   0.000
  96.185  41.717   0.000   0.000
 100.697 -82.924  96.629 -88.151
  93.513 -18.130 113.491 -75.695
 128.189-168.356 121.755 -80.479
 126.299 175.206   0.000   0.000
 128.582 -86.051 139.002 -47.828
 118.644-109.074 114.740-119.174
 118.371-138.607 117.625-120.465
 113.005-107.954  98.699 -91.720
  94.543   0.000 116.098 -77.254
 #  81 total E   -4.79163E+01 rmsd from N    0.000 %NC  0.00
  93.715 100.321 108.697 -80.327
 114.803 173.396 148.301 -28.887
 114.446 165.945 110.991 -73.297
  93.258  54.224 134.741-109.112
  91.451  66.946 115.824 -63.993
 124.515 -82.522 143.252 127.033
 113.771-171.452 149.605 -81.049
 122.133-178.507 111.673-125.585
 122.054 -71.347 151.649 -19.055
 132.323 -67.794   0.000   0.000
 121.147 -33.992   0.000   0.000
 112.988-179.596 128.240-138.917
 124.496 177.763 121.146 -80.504
 126.160 -90.577 121.941 -80.083
 125.736-175.153   0.000   0.000
 128.267 -80.618 142.283 -47.241
 119.642-160.520 117.970-124.007
 110.880-112.938 100.010 -92.732
 117.305-119.528 126.440-135.357
 120.961   0.000 148.622-112.669
 #  82 total E   -4.77877E+01 rmsd from N    0.000 %NC  0.00
  93.813  16.366 145.482 -27.973
 117.043-177.018 160.133 -16.344
 135.822 179.821 166.367 159.164
 123.713 170.865 124.417 -58.719
  91.289  84.519 112.597 -67.410
 109.672   3.619 140.863 132.127
 103.748 -99.295 143.352 -37.599
 120.940-169.762 116.249 126.150
 125.606 175.484 148.041 -38.998
 137.585 -79.315   0.000   0.000
  95.505  37.885   0.000   0.000
  91.797  50.749 131.653-155.756
  92.059-179.701 113.009 -74.328
  93.854 148.280 116.164 -76.690
 115.046 169.661   0.000   0.000
 134.634 -99.338 136.920  97.643
 116.804-165.744 115.979-125.186
  92.498  51.767 128.380-150.426
  92.680 117.355 130.363-153.525
 120.052   0.000 120.537 -81.768
 #  83 total E   -4.77243E+01 rmsd from N    0.000 %NC  0.00
  93.912  96.212 157.110-146.302
  91.449  66.099 143.190-126.944
  90.068  70.824 142.178 -91.403
  90.224  52.880 140.642-100.078
  90.709  41.102 111.870-100.716
  92.981  61.104 104.487-127.797
  92.205 -89.699 144.376-153.235
 122.475-178.144 136.616 140.016
 121.180 -71.210 111.907 -81.419
 131.838 -67.562   0.000   0.000
 120.855 -33.614   0.000   0.000
 112.953-178.486 128.353-139.108
 124.691 179.647 121.545 -79.649
 122.594 -66.023 118.459 -79.301
 127.267  -9.507   0.000   0.000
  94.649 155.889 147.881 114.524
  93.597 127.729 105.022-129.595
 123.398-173.951 114.833-115.312
 117.095 -13.995 128.397-137.660
 119.046   0.000 120.447 -80.096
 #  84 total E   -4.75638E+01 rmsd from N    0.000 %NC  0.00
  93.702   7.497 104.792 -82.686
  92.944  79.401 141.867-113.619
 131.366-107.241 176.409 154.359
 102.478 -50.186 172.303-170.817
  91.316  87.698 126.492 -94.705
 108.473 179.362 127.091 -26.693
 115.741 -79.968 147.081 165.766
 145.323 170.745 120.605 -77.077
  91.721 -43.010 148.090 -23.803
  94.099 162.862   0.000   0.000
 143.787 -56.306   0.000   0.000
 123.072 105.934 102.691-100.945
 135.777-101.612 120.388 -84.995
  93.707  13.609 115.377 -76.198
 125.315 -35.377   0.000   0.000
 125.532-107.343 104.827 -53.318
 118.144-105.951 131.225-142.046
 120.118-130.601 102.074 -98.391
 120.406 121.852 120.610-124.802
  93.445   0.000 110.939 -78.339
 #  85 total E   -4.73362E+01 rmsd from N    0.000 %NC  0.00
  93.583 105.663 143.005-130.083
 116.968-169.554 168.580  -7.290
  96.345  98.015 105.446 -91.230
 118.201-115.556 122.788 -62.415
  91.421  80.587 125.593 150.210
  92.463 118.432 139.748  21.028
  91.915  99.743 122.187-125.481
 117.732-107.345 118.189-131.780
  95.525 151.977 148.148 -21.798
 122.796 177.132   0.000   0.000
  93.936  44.437   0.000   0.000
  90.588  47.899  99.649 -99.100
  91.700-173.723 113.529 -77.666
 115.715 170.121 131.443-177.810
 133.339 -89.527   0.000   0.000
 124.895-123.551 118.524 -40.609
 116.007  12.161 122.745-132.711
 123.783-146.430 109.061-107.245
 121.274   2.449 123.991-129.810
  93.386   0.000 115.224 -78.790
 #  86 total E   -4.72466E+01 rmsd from N    0.000 %NC  0.00
  93.986 129.631 142.363 -11.081
 119.035-160.743 148.095 -10.578
 123.659 -85.944 158.867 133.561
  94.246  64.698 134.675-105.949
  92.300-113.735  99.231 -79.947
  92.794 107.114 116.396 -41.997
 130.090 -84.887 165.002  -6.430
 110.632 174.279 127.062-116.669
 125.578-172.728 161.601-161.225
 113.577 167.388   0.000   0.000
 134.574 -43.937   0.000   0.000
 118.082-158.310 112.944-115.236
 123.549 165.698 120.579 -80.103
  94.672 -71.583 112.676 -80.133
  94.059  40.908   0.000   0.000
 120.974 -77.962 140.929 -42.859
 115.251-167.744 114.541-121.004
  92.392  52.060 108.762-119.904
  92.853 101.701 103.707-111.835
  93.349   0.000 112.512 -76.648
 #  87 total E   -4.72101E+01 rmsd from N    0.000 %NC  0.00
 118.133-163.777 146.010 -16.721
 106.809 172.309 145.426 -30.606
  93.454  82.091 128.669-113.529
  92.334  59.069 139.363-100.731
  91.874 146.822  97.578 -72.559
 109.326 126.596 135.676 126.770
 126.472 -97.609 166.608  -4.989
 127.467-169.949 134.567-120.787
  94.267  43.338 108.001 -80.303
 125.386  79.746   0.000   0.000
 129.627 -49.419   0.000   0.000
 115.383 -77.771 126.679-135.231
 117.057  84.279 119.549 -79.203
 116.718 178.975 143.564 -40.567
 129.125 173.220   0.000   0.000
 129.911 -88.029 135.637-158.537
 121.440-165.420 114.383-117.719
 124.706-138.966 106.720-101.862
 116.948-137.775 123.516-130.810
 125.720   0.000 124.608 -86.810
 #  88 total E   -4.70265E+01 rmsd from N    0.000 %NC  0.00
 119.451-121.461 111.255 -81.042
 116.902 174.099 147.229 -17.520
 115.270 108.158 132.577-124.274
 130.729 -94.717 131.477 -81.750
  91.841 131.465 104.148 -39.668
 136.299-106.305  78.339-102.579
  92.014 133.002 148.671 -46.805
 130.544 -71.168 140.961-175.095
 117.456 -50.888 108.594 -79.940
  96.792  99.514   0.000   0.000
  95.449 154.876   0.000   0.000
 117.281 159.993 125.914-133.962
 126.212 174.109 122.765 -81.985
  94.427  58.359 115.802 -76.346
 137.109 -31.527   0.000   0.000
 118.302 -68.388 150.847-171.555
 111.700-160.552  97.731 -92.466
 102.162-169.891 102.909-106.985
 118.376 -12.580 125.364-133.973
 119.039   0.000 120.436 -80.332
 #  89 total E   -4.70188E+01 rmsd from N    0.000 %NC  0.00
  94.279 133.990 130.068  15.804
  91.912  88.104 156.008-136.735
 107.720-143.243 123.796 -42.580
  92.925  61.467 131.414-113.361
  90.875 158.626 157.440  -6.131
  92.258 105.248 119.041   3.732
  92.392 -87.832 133.405-110.460
  92.960 117.835 120.410-165.659
 114.499 -83.693 150.668 -17.729
 124.753 -63.773   0.000   0.000
 119.355-170.018   0.000   0.000
  93.386  85.249  97.243-105.411
 122.273 -96.108 143.146-144.758
 127.499-175.854 122.236 -80.320
 126.976 171.886   0.000   0.000
 128.989-103.751 108.744 -52.583
 116.802-108.314 124.252-134.687
 113.541-139.522  99.986 -87.115
  93.098  86.844 103.554-110.506
  93.381   0.000 121.695-114.743
 #  90 total E   -4.69375E+01 rmsd from N    0.000 %NC  0.00
  93.627  47.305 143.498-129.971
  93.097 166.184 164.899-147.527
 125.811 -88.017 150.615   3.560
 120.503-173.148 165.458-142.240
 125.984-171.495 145.689 -90.976
 114.032-167.999 130.009 -38.626
 117.588 178.077 140.884-154.458
  92.348 101.355 123.263 141.516
  93.918  21.282 103.947 -81.728
 124.265 -57.412   0.000   0.000
 109.000 -34.911   0.000   0.000
 104.066 174.814 129.408-145.977
 125.708-171.141 129.683 -84.954
 123.548-172.828 121.836 -79.429
 122.153  51.603   0.000   0.000
 125.039-100.631 119.791 -46.675
 120.944 132.412 116.365-120.493
 123.185-173.768 116.190-116.611
 116.788 -13.841 128.559-137.780
 119.129   0.000 120.443 -80.090
 #  91 total E   -4.69014E+01 rmsd from N    0.000 %NC  0.00
  93.685  89.095 110.004 -82.348
 117.092 177.605 159.432-151.718
 116.992 160.859 155.885  -3.146
  93.900  81.645 139.425-112.169
  91.933 -82.011 105.642 -36.322
 125.307-169.066 155.835 168.432
 117.649 176.122 152.651 -12.194
 105.799 -58.154 105.386  67.483
  92.844  37.976 142.391-136.082
 123.503-166.871   0.000   0.000
 138.077 -51.194   0.000   0.000
 120.675 177.163 119.666-122.940
 124.544 178.305 120.593 -80.739
 125.247 -64.594 120.968 -79.751
 126.963 -22.083   0.000   0.000
 126.486 -78.995 141.874 177.047
 120.383-162.889 114.653-118.756
 122.515-139.242 110.830-108.275
 117.594-118.702 125.666-132.798
 120.971   0.000 148.093-112.086
 #  92 total E   -4.68186E+01 rmsd from N    0.000 %NC  0.00
  93.615  48.468 144.125-132.751
  93.066 168.457 141.001 -39.511
 113.190 172.870 116.010 -67.389
 111.198 111.426 134.767-112.105
 122.875-100.186 115.390 -88.812
 114.767-173.335 134.405 -37.091
 121.250 177.474 143.488-145.674
 123.927 176.772 147.734 -89.492
  95.561 168.266 154.486 -27.322
 139.830  16.186   0.000   0.000
 116.984 -15.867   0.000   0.000
  91.067  75.510 102.329-101.702
  91.818 -57.900 108.491 -77.194
 131.931-162.790 127.974 -78.850
  94.735  96.648   0.000   0.000
 128.350 -80.376 102.233 -81.035
 104.842 137.329 100.742-119.018
  93.121 130.720 100.264-102.467
 104.759-104.755 103.614-116.001
 120.118   0.000 139.613-125.825
 #  93 total E   -4.65705E+01 rmsd from N    0.000 %NC  0.00
  93.751   8.977 148.133 -31.569
 118.521-101.750 150.501-135.213
 125.642-173.630 151.000  11.653
 117.146-165.630 164.550-147.750
 114.908-176.539 136.720  97.207
 130.555-174.354 147.864 164.969
 124.638 -92.512 154.486 -13.332
 123.629-149.093 135.639-121.895
  94.024  35.478 148.603 -23.171
  95.820  54.234   0.000   0.000
 122.355 -27.405   0.000   0.000
 119.284-151.802 111.881-112.598
  93.800 102.630 115.243 -77.209
 112.417-100.308 117.647 -79.693
 116.718 177.392   0.000   0.000
 131.188 -98.194 146.127-166.474
 104.907 142.571  99.100-115.049
 123.834-141.565 109.411-107.394
 118.844-113.520 125.309-131.730
 120.317   0.000 143.745-115.617
 #  94 total E   -4.65005E+01 rmsd from N    0.000 %NC  0.00
 116.995 161.075 140.591 -11.388
  92.438 110.103 152.529-142.063
 126.755 -86.203 151.635  -0.491
  91.794  62.315 143.284-100.370
  90.789  33.614 121.056 -43.778
  93.787  71.851 127.754 -42.211
  92.347 -51.883 147.474-168.041
 119.384 169.959 128.652-116.913
  94.888 -53.358 137.979-122.835
 140.362 -55.400   0.000   0.000
 121.015 -18.789   0.000   0.000
 102.127-174.816  99.648 -92.402
 132.063-175.610 119.903 -86.828
  94.309  72.665 115.783 -76.248
 130.613 -56.252   0.000   0.000
  92.600  81.639 122.819-148.764
 119.963-167.446 108.645-112.204
 128.590-138.798 108.130-102.431
 111.837 126.660 133.839-150.275
  93.422   0.000 110.263 -77.181
 #  95 total E   -4.63733E+01 rmsd from N    0.000 %NC  0.00
 116.468-143.082 151.866-150.403
 120.153-176.706 167.670 -13.095
 111.987-158.208 130.238 -45.974
 122.358-111.072 162.164-175.668
  92.961 125.139 121.634-111.363
 124.592-100.459 147.309-143.218
  93.505  24.734 159.443-147.943
  94.160  61.302 134.286-133.943
  93.863 -15.538 150.728-125.504
 117.194-145.077   0.000   0.000
  93.267  78.008   0.000   0.000
  91.360  64.744  91.130 -96.497
  92.411 178.340 108.643 -75.332
  94.131  64.445 115.850 -77.190
 129.692 -77.342   0.000   0.000
 115.390-177.765 136.596 -94.680
 122.220-134.943 119.158-124.318
 103.356 132.925 120.387-129.872
 120.555 158.182 118.524-122.322
 120.319   0.000 120.811 -80.325
 #  96 total E   -4.61206E+01 rmsd from N    0.000 %NC  0.00
 116.285-153.282 152.418-149.856
 123.485 -98.099 153.369 -16.685
 115.623-170.787 145.542 -41.808
  93.469  61.995 159.543-161.608
  91.228-160.696 111.595 -26.196
 120.705 175.248 150.139 152.942
 117.058-179.781 159.299 -20.310
 124.917 174.202 136.927 153.829
 124.062 -69.822 110.739 -78.570
 125.061  68.077   0.000   0.000
 138.321 -50.443   0.000   0.000
 118.342-147.351 124.844-130.699
 121.701-174.152 135.581 -31.149
  94.539  81.383 115.843 -76.342
 135.271 -78.943   0.000   0.000
 110.336 173.552 128.761 -84.862
  93.764 127.720 103.959-142.433
 102.129-110.715 100.615-101.173
 118.822-111.241 117.249-121.143
 120.096   0.000 137.353-132.659
 #  97 total E   -4.59482E+01 rmsd from N    0.000 %NC  0.00
 113.275 -40.414 151.437-148.250
  92.957 109.026 154.653-152.352
 125.082 -95.744 153.280   0.978
 129.394-174.767 154.280 -42.563
  91.976 -67.005 103.493-106.832
 110.482-176.715 133.687 -32.581
 118.099-178.481 146.770-160.150
 126.059 171.830 110.641-113.228
 124.813 176.515 151.902 -17.296
 133.566 -87.629   0.000   0.000
 137.491 -72.439   0.000   0.000
  92.744  55.718 131.626-155.210
  92.950  59.327 113.511 -76.334
 116.910 168.105 115.649 -81.695
 113.050  57.896   0.000   0.000
 123.048 -89.382  98.693 -59.042
 117.198-112.993 124.675-134.911
 113.516-113.893  99.229 -86.397
 111.290  15.439 127.053-139.527
  93.352   0.000 114.339 -77.372
 #  98 total E   -4.57249E+01 rmsd from N    0.000 %NC  0.00
  93.609  47.250 143.474-131.457
  93.381 -82.792 144.544 -35.391
 125.593-172.317 108.126 -88.800
 117.806 -91.165 135.079 -88.182
 115.029 174.221 135.427 -23.083
 114.963 169.025 102.371-141.802
  92.522  83.073 141.713 -96.692
 111.425 167.151 115.581-126.317
 117.113 -62.215 111.665 -73.836
 119.163 -22.973   0.000   0.000
  99.585 -48.746   0.000   0.000
  92.002  76.767 129.365-152.219
 141.997 -89.175 120.550 -81.431
 106.526 -49.874 116.118 -77.009
  95.846  76.895   0.000   0.000
 127.046 -90.730 120.586-131.322
 120.288-109.800 113.896-116.892
 116.951-137.998 129.523-137.586
 113.342-117.694  97.976 -86.396
 121.527   0.000 121.352 -80.359
 #  99 total E   -4.55946E+01 rmsd from N    0.000 %NC  0.00
 116.700-141.024 152.480-148.833
 122.033-178.874 157.920-153.689
 123.344 173.678 153.347  -2.329
 117.271 175.154 160.785-121.090
 121.325 172.789 159.255-106.698
 110.897 167.397 130.557 -33.015
 106.717  57.738 134.560-140.596
 108.658-108.819 124.745 146.830
 118.109 164.604 114.970 -73.863
 138.933 -82.123   0.000   0.000
 109.719 -22.217   0.000   0.000
 104.984-179.040 126.024-139.807
 125.498 -74.620 122.153 -83.761
  93.648  25.517 113.812 -76.275
 120.297 -66.989   0.000   0.000
 110.723-170.335 122.457 -35.937
 112.748-144.795 102.437 -88.352
 110.147 132.524 118.529-127.326
  93.325  84.445 104.139-111.633
  93.394   0.000 113.846 -78.852
 # 100 total E   -4.47249E+01 rmsd from N    0.000 %NC  0.00
 118.994 -93.074 112.006 -79.631
 114.876 166.233 143.350 -40.421
 126.077 102.257 162.265-172.815
 119.077 -83.124 167.247-157.615
  91.037  79.028 111.764 -25.654
  91.734  96.116  85.169 -83.636
  92.085 150.466 126.177 -94.832
  92.351  92.905 138.424-125.871
  91.311 -64.962 140.943-118.333
 105.963 -56.630   0.000   0.000
  98.665 -32.859   0.000   0.000
  92.427  90.541 133.733-158.627
 128.812-106.851 115.792 -80.897
 117.309 110.213 145.900 -66.216
 132.396 -91.096   0.000   0.000
 117.386 178.901 122.845 -73.606
  93.789 117.850 103.590-135.502
  92.448  51.745 109.212-119.599
 112.925-119.486 118.778-127.270
 120.754   0.000 146.821-116.819
 # 101 total E   -4.46613E+01 rmsd from N    0.000 %NC  0.00
 118.349-148.446 148.369 -19.689
 116.984 177.961 157.263 -18.595
  94.012  73.527 144.117-106.608
  93.077  62.918 136.773 -83.690
  91.849  58.042 131.267 -84.994
 111.790 -85.855 110.106-140.067
 118.809-163.109 157.403 -12.502
 123.193 -72.787 122.999 143.732
 125.784  60.731 113.186 -80.250
 122.041 -45.694   0.000   0.000
  93.632 -41.975   0.000   0.000
  93.118 156.217 132.253-155.964
 120.900 164.476 147.307-110.742
 132.526 -98.181 159.297 -98.996
  95.929 166.376   0.000   0.000
 128.144-113.434 120.159 -48.904
 118.991 131.335 122.318-132.773
 106.115-111.917 101.433 -96.771
 117.449-119.448 126.071-134.647
 120.841   0.000 148.224-112.967
 # 102 total E   -4.45928E+01 rmsd from N    0.000 %NC  0.00
  93.635 123.020 144.142-135.028
 120.952-106.918 144.164 -90.512
  91.372  73.349 126.509 -44.790
  90.436  60.501 134.574-101.015
  90.342  38.006  94.532 -87.179
 105.660 -72.482 148.044  36.681
 126.114-159.487 163.520-175.642
 131.119 -98.667 131.998 -74.781
 123.981 179.388 111.209 -88.817
 138.839 -60.367   0.000   0.000
  94.980  14.737   0.000   0.000
 102.705 -79.433 130.390-148.373
 114.000  64.921 145.539 -92.602
 124.836 144.366 121.273 -79.946
 124.210  25.281   0.000   0.000
 116.499-160.011 106.568 -44.910
 125.512-168.942 115.022-115.079
  98.430-170.982 105.408-104.756
 116.237 142.172 130.723-145.119
 119.772   0.000 120.009 -80.586
 # 103 total E   -4.45841E+01 rmsd from N    0.000 %NC  0.00
 117.280-163.278 147.984 -23.507
 117.708-178.204 148.167 -18.195
 124.876 175.528 163.853 174.471
 135.073 177.064 155.471 -18.856
  91.224  77.837 126.893-147.042
 106.193 172.787 130.750 -11.748
 118.683 179.036 146.446-157.497
 124.046-177.283 135.265 129.564
 122.105-178.057 111.325 -81.325
 126.421 172.199   0.000   0.000
 134.438 -57.252   0.000   0.000
 117.944 176.158 125.297-131.506
 125.532-179.374 120.977 -80.709
 125.674-177.687 122.060 -77.752
 121.412 169.337   0.000   0.000
 129.533-103.174 116.451-127.165
 100.305 134.072 101.140-118.609
 121.370-173.340 118.282-122.270
  93.946  25.715 130.474-153.770
 117.907   0.000 146.673 -98.035
 # 104 total E   -4.44967E+01 rmsd from N    0.000 %NC  0.00
 116.275-147.231 151.669-144.332
 118.446 173.712 150.193 -24.365
 110.831 158.351 121.022-119.479
  95.549  86.222 161.915-147.762
  91.617 -79.513 120.917 -18.089
  94.129 144.696 132.187 -45.257
 118.192 -94.641 141.975-137.692
 126.230-173.639 135.653-139.857
 123.084-174.230 148.843 -19.277
  95.130  97.382   0.000   0.000
  98.072  47.970   0.000   0.000
  96.534 -77.162 126.207-144.863
  92.998 -25.492 114.583 -76.317
  96.136  79.413 115.481 -76.729
 136.237-158.575   0.000   0.000
 132.466 -85.522 124.847 -46.400
 117.494-160.143 123.318-133.075
  92.083  50.766 107.896-103.832
  92.451 117.771 130.026-152.702
 120.699   0.000 119.183 -83.920
 # 105 total E   -4.44806E+01 rmsd from N    0.000 %NC  0.00
  93.632  17.502 144.059-132.716
 117.661-178.125 151.940 -16.500
 113.751 171.568 170.101 175.485
  92.809  86.038 136.923-109.001
  91.048 -47.882  95.531 -73.578
 114.094 173.746 137.486 -45.156
  91.559  71.020 129.033-112.383
  92.807 178.985  99.061-117.280
 117.827 177.388 113.393 -85.331
 137.803 -59.584   0.000   0.000
  92.048  53.462   0.000   0.000
  90.819  48.493  80.846 -82.165
  92.819 178.335 112.527 -74.490
 109.980 -83.112 118.029 -78.358
 123.392-178.878   0.000   0.000
 125.297 -97.442 133.057 154.342
 113.921  38.437 122.600-134.205
  92.938 115.721 104.450-113.893
  93.000 122.421 105.248-119.432
 121.075   0.000 120.287 -84.015
 # 106 total E   -4.44270E+01 rmsd from N    0.000 %NC  0.00
 119.558-135.395 107.105 -75.916
 117.570 173.321 156.552-149.564
 129.592 -77.634 150.856  -2.389
 113.495 -32.846 171.042-161.843
 105.098-173.648 136.991-137.977
 124.329-175.664 140.571-127.025
 112.590 176.335 155.327 -91.190
  93.749  98.471 123.666-147.775
 112.968 -87.431 150.564 -19.866
 122.728  -0.246   0.000   0.000
 113.620 -42.472   0.000   0.000
 101.109 160.024  96.839 -91.297
  94.659 154.469 113.134 -76.808
 116.505 -80.631 115.238 -82.379
  95.019  61.150   0.000   0.000
 126.925 -86.425 101.738 -84.165
 113.959 136.959 118.406-128.329
 128.327-172.671 110.344-106.310
 104.736 158.288 100.584 -97.206
 120.613   0.000 118.318 -82.338
 # 107 total E   -4.44239E+01 rmsd from N    0.000 %NC  0.00
  93.596   0.165 143.682-131.029
 111.034 113.390 146.527 -33.139
 135.288 -89.671 114.487 -78.471
 109.810 -57.278 159.145 156.603
  91.234  -8.558 107.569 -40.687
 117.165 100.020 176.485 160.444
 131.179-102.516 128.881 -86.180
 127.893-168.614 121.007-119.615
 118.389 -69.665 154.808-145.494
 138.604 -68.769   0.000   0.000
  95.770   2.186   0.000   0.000
 110.096-149.721 129.299-142.198
 125.610-166.332 154.010-104.648
 122.129   0.024 148.499 -70.435
 129.163 -73.916   0.000   0.000
 126.041-112.739 147.393 159.643
 117.997-107.356 124.131-135.657
 114.021-140.221  98.891 -89.160
 113.827 132.821 128.750-140.669
 119.897   0.000 118.851 -81.796
 # 108 total E   -4.43683E+01 rmsd from N    0.000 %NC  0.00
 119.143-118.576 112.166 -82.843
 117.333 114.560 157.758-136.564
 124.120 -77.378 128.638-123.957
 105.979 -46.152 169.945-144.390
 124.776-175.380 145.848-132.214
 119.444 171.353 103.117-132.632
  91.202  72.033 144.331 -40.712
  91.113  64.863 105.004-130.759
  92.826 162.082 103.093 -90.453
 131.292 -62.441   0.000   0.000
 104.839 -15.621   0.000   0.000
  98.581 -47.009  89.241 -76.530
  93.432 -12.866 108.939 -73.424
 111.724 -48.380 113.478 -79.819
 110.974  -6.771   0.000   0.000
 115.616 -59.929 136.375 153.796
 118.334-145.970 109.444-111.852
 119.331-167.674 122.079-127.801
 107.628  -4.958  99.054 -88.274
  93.485   0.000 134.864-104.511
 # 109 total E   -4.43265E+01 rmsd from N    0.000 %NC  0.00
 118.793-142.428 111.310 -82.280
 120.418 178.929 148.444 -18.210
 127.634-107.164 137.396-127.850
  93.992  86.981 139.795 -99.983
  91.708 -84.748  97.360 -83.627
 105.437-171.920 139.746 -50.161
 121.104 -59.500 163.141 -10.197
  91.628  81.998 130.380-116.956
  92.539  20.957  98.334 -81.423
  96.200 179.876   0.000   0.000
 119.703 -30.392   0.000   0.000
 108.259 178.751 128.512-141.757
 125.750 177.497 121.143 -84.605
 126.147 -94.196 121.134 -79.722
 124.073-178.376   0.000   0.000
 129.375 -97.957 138.849 165.911
 122.793 134.484 117.641-122.188
 123.820-172.109 117.013-117.667
 110.624-107.546  98.597 -91.485
  94.560   0.000 116.245 -77.166
 # 110 total E   -4.42798E+01 rmsd from N    0.000 %NC  0.00
  93.605  45.198 143.472-131.351
  92.951 109.398 144.303 -34.944
 130.975-100.136 162.786 168.939
 122.231-171.868 143.877 -93.496
 118.894-178.431 147.494-128.241
 135.855-174.059 116.196-131.750
 106.703 102.958 144.148 -84.711
 123.683 -96.706 123.811-134.019
 122.197 176.869 151.277 -16.603
 137.985 -74.693   0.000   0.000
 126.550 -30.428   0.000   0.000
  93.328  89.047 131.712-155.057
 124.982 -73.722 121.055 -80.436
 121.482 -59.377 119.487 -79.308
  96.114  20.512   0.000   0.000
 138.387-179.759 134.915-118.338
 124.102 130.428 117.225-121.570
  99.879-171.992 131.450-152.557
 104.966 -13.290 100.653 -78.629
 118.664   0.000 119.664 -79.643
 # 111 total E   -4.38980E+01 rmsd from N    0.000 %NC  0.00
  93.724  34.236 107.568 -80.232
  92.783 157.044 138.409 -37.745
  93.193  88.330  99.212 -87.697
 126.361 -87.837 164.044-164.322
 123.733-160.563 150.885 -42.146
 115.633 172.220 176.488  26.354
  94.080 118.968 148.414-148.743
 116.547 -83.050 142.172-140.927
 122.902 -64.820 150.488 -19.651
  96.134  67.035   0.000   0.000
  94.631  71.412   0.000   0.000
 128.498  72.041  95.921 -87.859
 120.281 170.496 155.370-112.459
  94.096  62.715 112.234 -76.323
 145.274 -62.894   0.000   0.000
  93.644  71.144  87.122-118.876
 122.803-170.030 117.833-123.110
 129.154-169.000 109.010-101.981
  93.409  83.875 103.239-115.461
 117.915   0.000 141.101-145.858
 # 112 total E   -4.38276E+01 rmsd from N    0.000 %NC  0.00
 116.963-170.513 146.859 -25.774
 115.011 173.711 148.134 -19.694
 114.406 118.173 152.384-126.889
 120.046-106.652 132.882 -85.965
 129.462-174.082 153.919-136.350
 111.761 178.713 139.603 -20.970
 121.992-178.327 144.496-161.001
 122.071-176.830 143.309-105.260
 121.667 175.906 160.893-151.832
 131.771 -68.057   0.000   0.000
 131.968 -39.476   0.000   0.000
 105.460 -32.548 124.782-137.402
  91.107  99.910 134.472-157.481
  91.704  -5.602 108.352 -78.087
 103.417 -80.712   0.000   0.000
 123.857-118.402 121.600 -44.484
 117.607-169.870 127.007-140.319
  92.726  51.385 130.921-151.717
  93.321  35.636 130.150-153.112
  93.346   0.000 116.291 -77.017
 # 113 total E   -4.38165E+01 rmsd from N    0.000 %NC  0.00
 114.538 174.492 147.952 -36.788
 119.286 167.334 148.361 -18.945
 110.477 -64.445 121.370-122.125
  93.408   3.721 142.563 -91.342
 127.417-106.193 131.496 -55.138
  91.873  94.782 146.885 116.630
  91.043  65.772 147.345 -36.026
  91.111  47.093 132.707-137.885
  92.507 118.543 139.167-106.061
 129.090  20.670   0.000   0.000
 105.092 -34.122   0.000   0.000
  94.048 -44.442 126.248-146.435
  92.306  95.747 115.375 -76.182
 127.797-110.309 116.566 -82.946
  97.187 152.925   0.000   0.000
  92.064  74.059 137.858-119.961
 126.123-167.897 115.574-120.023
 105.956-168.496 101.289 -93.458
  93.440  70.657 104.285-109.160
  93.405   0.000 129.065-126.974
 # 114 total E   -4.34932E+01 rmsd from N    0.000 %NC  0.00
 116.457-151.175 152.635-149.080
 123.980 -95.741 157.512-143.452
 126.706-172.333 116.960 -85.540
 115.794-178.134 136.574 -84.441
  92.361 -61.677 126.511-127.896
 115.487-164.107 103.321 -75.841
 123.460 -76.352 135.099-122.872
 104.958 -39.076 124.748-138.616
  94.204  86.786 109.302 -84.259
 131.355  16.237   0.000   0.000
  93.290  44.440   0.000   0.000
  91.912  59.444 101.084-104.381
  92.628 -70.739 111.042 -75.788
 116.979 -56.000 118.199 -78.901
 108.810 -17.158   0.000   0.000
 117.558-108.738 107.078 -47.351
 116.908-107.485 134.635-151.231
 119.429-139.521 110.035-108.286
  93.240  75.765 102.610-106.775
  93.303   0.000 112.141 -77.916
 # 115 total E   -4.32963E+01 rmsd from N    0.000 %NC  0.00
 115.641-163.062 151.608-148.168
 123.233-106.680 142.790 -99.872
  95.391 118.535 176.472 172.732
 122.379-178.976 143.687 -81.806
 125.903-168.643 141.865 -98.665
 115.978-177.043 134.149 -37.590
 123.990-176.018 144.864-147.891
  93.520 151.667 134.842-118.745
 114.817 -68.337 151.341-143.481
 114.416   3.517   0.000   0.000
 116.406 -35.892   0.000   0.000
 113.483 171.032 128.490-139.021
 122.260-177.649 118.795 -77.149
 119.658 174.224 147.272 -68.701
 130.622 175.651   0.000   0.000
 125.025-122.400 117.447 -40.648
 116.564-171.005 120.289-131.529
  93.040  50.155 110.880-107.940
 108.887 -18.005 131.821-147.735
  93.468   0.000 115.167 -76.066
 # 116 total E   -4.32873E+01 rmsd from N    0.000 %NC  0.00
  93.793 126.143 148.903 -25.795
 119.805-123.962 157.985 -24.317
  94.007  60.144 175.252-178.448
  92.251  64.712 129.715 -90.575
  90.823  23.592 117.758 -91.917
 101.352 -94.699  88.778-111.100
 120.127 -78.879 149.403-147.181
  92.999  87.076 119.969-147.633
  93.268 -83.002 104.371 -82.835
 118.877-167.284   0.000   0.000
  95.119  85.169   0.000   0.000
 103.594 -41.902 131.775-152.470
  93.908  74.069 115.109 -76.478
  94.588-178.492 120.486 -79.009
 113.574 157.579   0.000   0.000
  93.420  82.412 104.700  35.650
 132.487-165.517 116.505-111.940
 105.739 139.338 118.406-128.872
 121.570 157.503 119.076-123.443
 120.384   0.000 119.823 -80.793
 # 117 total E   -4.31390E+01 rmsd from N    0.000 %NC  0.00
  93.850  92.378 154.077-131.087
  92.166  77.495 146.347-113.026
  93.017 110.972 164.363   7.138
 114.822 -95.229 153.521-137.812
 116.419 174.424 152.325-109.917
 121.328 179.205 106.658-143.912
 111.465 177.469 140.644 -33.568
 106.571 169.499 122.597 144.768
 122.593 172.716  96.196 -85.413
  96.512  63.349   0.000   0.000
  94.886  25.932   0.000   0.000
  97.921-166.223  99.771 -64.043
  91.752  82.223 136.689-166.200
  93.852 124.049 110.186 -76.588
 131.107 -74.499   0.000   0.000
  93.045  70.271 118.835 -55.850
 104.923-107.460  91.773-117.359
 117.646-144.249 113.640-115.750
 113.427  -3.535 133.835-148.378
 118.304   0.000 146.051-103.176
 # 118 total E   -4.28641E+01 rmsd from N    0.000 %NC  0.00
  93.714  17.893 108.691 -80.003
 114.480 174.962 148.700 -27.542
 112.760 164.002 146.501-105.668
  92.649  59.383 139.692-106.565
  91.065 166.211 123.897 -49.923
 109.156 176.500 126.128  26.642
 116.070 -82.402 150.382-169.676
 128.191-171.588 139.854-128.809
 121.554-177.539 109.686 -79.112
 126.369 172.307   0.000   0.000
 134.356 -57.002   0.000   0.000
 117.388 176.934 126.287-133.242
 124.220-179.374 147.062-101.365
 124.802-176.831 123.039 -78.007
  95.294  83.583   0.000   0.000
 123.084 -80.653 106.646-122.458
 117.980-166.925 118.579-126.605
  92.978  52.079 128.349-149.825
  93.381  26.039 130.274-153.359
  93.368   0.000 117.313 -76.908
 # 119 total E   -4.28261E+01 rmsd from N    0.000 %NC  0.00
 112.807 -38.183 150.767-148.185
  94.521 172.578 134.738 -27.122
 104.535 172.530 137.366-116.786
 126.108 177.513 127.724 -61.475
  91.352  70.917 118.442-130.532
 119.840 -91.267 105.553-138.035
 118.887-174.911 158.619 -19.783
 124.605-176.075 135.479 148.495
 121.717-177.952 150.236 -20.232
 125.904 172.273   0.000   0.000
 130.855 -48.751   0.000   0.000
  93.387  79.879 131.566-154.882
 122.561 -93.072 118.773 -79.890
 125.854-173.191 147.393 -43.344
  95.801 144.880   0.000   0.000
 128.877 -82.041 137.590 -46.556
 114.387-142.187  98.932 -88.047
 113.755 138.663 117.790-124.295
 120.851 157.762 120.233-125.088
 120.366   0.000 119.947 -80.834
 # 120 total E   -4.27276E+01 rmsd from N    0.000 %NC  0.00
  93.556  56.012 138.548-103.618
 121.889 -94.067 153.596-169.953
 131.456-179.445 110.729 -77.253
  91.390  74.092 124.049-105.897
  90.672  17.806  92.309 -94.437
 103.123 -89.335 156.314  30.627
 129.024-169.050 156.241-164.762
 122.838-171.798 121.818 -99.069
 114.920  18.582 150.776 -19.775
 117.743-162.551   0.000   0.000
 136.861 -44.661   0.000   0.000
  93.471  79.524 128.806-151.959
 122.082 -94.483 118.834 -79.361
 123.688 -63.687 116.846 -77.548
 120.920 -17.073   0.000   0.000
 110.114 -64.361 141.417 -41.002
  95.888 136.975 101.012-107.303
 105.931-111.996  92.419-102.146
 117.197-123.423 125.910-134.491
 122.441   0.000 122.686 -81.526
 # 121 total E   -4.24863E+01 rmsd from N    0.000 %NC  0.00
 116.303-172.531 150.436 -23.176
 120.068 114.950 159.389-137.045
 130.924-102.429 101.391 -92.063
 123.812-174.027 167.083-120.687
 113.952-179.142 127.907  -5.098
 124.501-178.719 153.223-173.450
 119.646-177.530 158.700 -16.499
 123.826-177.027 118.482-120.160
 122.081-177.932 113.214 -77.780
 126.351 171.850   0.000   0.000
 134.133 -59.079   0.000   0.000
 115.311 106.667 128.560-138.026
 127.478-100.165 120.846 -80.509
 127.294-175.456 122.039 -80.219
 127.346 174.726   0.000   0.000
 128.492 -84.203 140.633 -46.049
 119.588-161.745 119.062-125.686
  93.800 119.352 106.928-104.449
 120.189 155.919 119.274-123.738
  93.790   0.000 114.985 -77.559
 # 122 total E   -4.23029E+01 rmsd from N    0.000 %NC  0.00
  93.640 106.286 144.488-135.009
 109.290 161.951 122.304 -66.353
  94.401  89.887 105.847 -87.158
 123.539 -78.069 161.312-176.253
  92.012 108.868 113.974  -7.997
 138.813  33.426 126.605-109.687
 129.028 -78.211 164.440  -5.429
 127.429 179.416 145.499 143.105
  93.994  25.520 139.049-110.770
 134.716-140.168   0.000   0.000
  93.058  43.901   0.000   0.000
  92.019 102.171 131.431-155.315
 125.441 -88.283 118.564 -77.695
 125.579 -60.843 117.018 -79.516
 128.790  -3.092   0.000   0.000
  94.190 157.494 151.948  52.274
 132.048 142.188 122.579-122.913
 134.225-171.176 106.153 -94.003
 122.966 -13.675 116.932-119.016
 119.144   0.000 120.300 -80.378
 # 123 total E   -4.22409E+01 rmsd from N    0.000 %NC  0.00
 114.971 -40.724 107.557 -81.518
  93.216 161.465 135.049 -79.614
 127.915 105.696 162.519 163.744
  91.310 -50.695 166.720 167.470
  90.551 -30.866 118.134 -78.111
 111.561-166.478 138.305 -23.888
 124.817-179.364 174.811  -7.904
 119.541 178.940 123.033-128.765
 120.732 -66.249 159.718-158.666
 126.294-166.631   0.000   0.000
 106.437 -19.149   0.000   0.000
  95.705 -54.179 126.187-143.727
  92.895  -1.642 114.647 -76.248
 120.196 -56.941 120.025 -79.567
 130.113  74.445   0.000   0.000
 126.309 -85.746 113.658 -57.475
 118.009-109.414 116.140-120.517
 118.680-138.705 113.575-114.745
 116.898-118.662 129.408-138.566
 121.778   0.000 121.664 -80.806
 # 124 total E   -4.22304E+01 rmsd from N    0.000 %NC  0.00
 115.647-110.318 145.332 -99.546
 122.609 -93.706 149.967-139.626
 126.824 178.197 148.891  27.191
 127.727 -18.586 163.035 166.087
  90.697 -53.766  97.320 -57.976
  92.242 112.281 150.054 -87.101
 118.821-128.488 121.277 -79.653
  93.168  96.766 116.361-159.084
 132.090  13.088 168.850-169.530
 139.014-159.653   0.000   0.000
  94.730  44.623   0.000   0.000
 113.267 172.047 128.683-139.305
 123.395 179.883 119.989 -77.314
 124.714-178.903 149.299 -66.439
 127.423 175.264   0.000   0.000
 128.484 -78.746 142.492 -47.454
 118.942-143.522 117.901-123.841
 101.717 141.284 104.857-100.673
 120.685-113.114 119.625-125.304
  94.770   0.000 135.743-126.329
 # 125 total E   -4.19310E+01 rmsd from N    0.000 %NC  0.00
 116.949-137.548 153.290-150.211
 122.503-171.517 148.517 -10.845
 107.705-173.977 139.295-116.378
 133.392 177.863 150.932 -50.651
  91.670 -74.185 115.615 -61.072
  92.860  95.947 151.043 104.349
  92.917  22.907 141.453 -91.984
 124.807-108.993 119.640-113.277
 120.078-177.901 108.808 -76.693
 141.079-170.385   0.000   0.000
  92.441  47.618   0.000   0.000
  91.499  41.734  90.091 -87.028
  95.533 -96.209 127.716-106.099
 117.652-178.196 141.874 -36.845
 136.062 179.645   0.000   0.000
  92.725  84.735 115.139-168.535
 108.189-162.562  93.732 -98.044
 118.999 136.983 116.991-120.413
 106.460 157.996  98.203 -99.161
 120.554   0.000 120.473 -80.762
 # 126 total E   -4.19147E+01 rmsd from N    0.000 %NC  0.00
 117.107-135.878 153.102-148.607
 121.404 -63.047 160.994 -13.189
 113.448  76.014  98.972 -92.725
 100.210 156.221 146.201 -84.162
  91.837  74.135 133.768-134.847
 102.757 154.408 176.436 150.136
  91.728  66.757 157.152-140.529
  92.799  79.950 128.309-131.254
 108.038 -88.968 120.756 -89.495
 128.928  10.009   0.000   0.000
  95.102 165.367   0.000   0.000
  95.272 136.101 125.363-145.891
 110.496 173.614 117.901 -78.936
 126.606-177.018 124.098 -80.884
 118.578  59.847   0.000   0.000
 120.046 -99.873 106.878 -53.260
 118.196-107.833 116.310-121.073
 119.116-139.729 110.481-110.787
 115.247 123.178 129.851-140.814
  93.523   0.000 114.647 -77.518
 # 127 total E   -4.17925E+01 rmsd from N    0.000 %NC  0.00
 119.440-103.377 146.685 -13.829
 122.272 -87.208 131.303 -92.341
  93.251 113.663 176.464 176.446
 124.817 -78.632 106.240 -68.073
  90.074  75.389 130.052-128.512
  91.898  63.319 176.456-170.612
  91.361 154.052 147.052-114.127
  91.569  92.440 128.331-153.143
  94.120 -50.312 149.047 -25.086
  96.746  87.567   0.000   0.000
  93.374  35.971   0.000   0.000
  94.308 172.111 132.187-155.713
 123.173 179.430 121.897 -80.295
 125.075-179.267 123.943 -79.475
 131.248 -67.498   0.000   0.000
  92.330  77.844 124.099-146.685
 115.995-106.096 111.505-118.686
 118.278-142.297 112.339-113.325
 114.629  -2.520 131.839-144.301
 118.842   0.000 120.353 -80.097
 # 128 total E   -4.17182E+01 rmsd from N    0.000 %NC  0.00
  93.688  25.183 111.594 -82.856
 117.078-103.917 150.265-131.762
 125.507 177.465 151.011   2.273
 111.359 179.094 159.884-160.706
 128.870-178.675 162.821 -25.836
  92.262  89.198 172.250 175.798
  91.264  46.020 137.548 -52.611
  91.991  67.771 137.158-135.972
  92.873 165.891 143.064-126.449
 121.996 169.397   0.000   0.000
 134.422 -57.392   0.000   0.000
 122.566 175.738 118.469-118.602
  93.589  91.508 114.373 -77.118
 115.035-105.195 117.657 -79.514
 118.038 176.514   0.000   0.000
 129.143-107.420 115.888 -95.185
 115.319 132.170 118.479-128.157
 123.798-172.006 115.676-115.621
 117.233-118.965 127.765-136.358
 121.763   0.000 121.630 -80.873
 # 129 total E   -4.16921E+01 rmsd from N    0.000 %NC  0.00
 110.345 158.022 141.797-126.247
  92.079  76.571 142.519 128.669
  91.688  28.972 121.230-115.479
  99.941 -90.495 165.405 160.733
 115.806 174.580 139.857  24.762
 123.487 167.839 161.880 101.305
 110.144 -77.136 158.315-177.833
  93.199  72.365 132.924-133.306
  94.059 120.816 142.632-123.636
 142.380 -90.744   0.000   0.000
 121.007 -33.444   0.000   0.000
 112.532 112.295 131.708-144.140
 126.671-101.058 120.711 -81.094
 128.206 179.041 122.291 -80.178
 122.733  69.235   0.000   0.000
 126.526 -85.194 116.481 -56.128
 117.876-108.534 118.387-124.638
 118.959-141.708 110.978-110.699
 115.879  -2.608 129.405-139.938
 118.462   0.000 146.257-106.173
 # 130 total E   -4.15865E+01 rmsd from N    0.000 %NC  0.00
 119.261 -95.790 110.745 -78.362
 118.716 179.104 148.417 -19.230
 115.189 164.626 165.662 177.118
 121.931 170.626 162.029 -64.845
  90.929  70.398 117.528 -48.544
  93.148  25.670 135.322 123.910
  92.939-108.574 146.072 -36.389
  94.350 153.442 128.675-130.754
 118.903 179.679 163.447-150.649
 122.484 169.775   0.000   0.000
 133.408 -48.666   0.000   0.000
 124.152 174.685 112.966-111.331
  93.465  90.210 129.704-135.324
  94.233 153.037 114.280 -76.832
 118.255  64.685   0.000   0.000
 125.544 -74.714 140.970-173.177
 119.747-142.504 111.866-113.659
 106.584 139.837 119.304-128.529
 120.010-112.118 121.219-127.539
  94.610   0.000 116.330 -77.576
 # 131 total E   -4.12410E+01 rmsd from N    0.000 %NC  0.00
 116.987 172.019 104.956 -70.555
  92.017  76.402 156.421-141.779
  91.157  30.908 119.748 -35.782
 102.233-126.149 165.543 179.147
  92.372  62.824 118.386 -95.968
 129.162-119.586 101.856-120.045
  91.800  62.701 143.256-126.585
 111.448-106.815  94.567-109.713
 116.775 150.744 166.116-155.474
 124.148 165.873   0.000   0.000
 134.726 -70.031   0.000   0.000
 113.007 -90.642  88.963 -93.376
  92.835  75.211 136.625-109.164
 125.904  -2.692 122.692 -78.993
 146.187 -62.636   0.000   0.000
  95.267 152.965 107.382 -43.440
  93.037 124.791 107.095-121.393
 130.046-171.640 116.771-112.736
  93.872  25.453 100.650-104.546
 118.708   0.000 120.112 -80.979
 # 132 total E   -4.11228E+01 rmsd from N    0.000 %NC  0.00
  93.812 112.613 148.645 -17.953
  92.989 116.521 140.623 -34.005
 128.968-103.583  97.686 -91.250
 117.862 167.932 161.083-108.535
  92.528  80.651 142.685-132.121
 127.137 -99.585 111.105-122.325
 123.564 178.428 171.043-142.751
  92.999  92.007 132.436 -76.799
  92.925 -49.160 108.364 -81.441
 117.224 -50.423   0.000   0.000
 110.875 -30.747   0.000   0.000
 104.588 171.415 129.792-146.385
  93.777  95.667 114.012 -77.981
 120.473 147.676 119.399 -81.156
 135.809 -95.271   0.000   0.000
 126.429-103.866 128.512 -49.072
 121.075 133.018 117.916-123.397
 121.201-173.486 121.272-125.337
 107.775 -13.693  98.549 -88.222
 118.897   0.000 119.743 -80.073
 # 133 total E   -4.10542E+01 rmsd from N    0.000 %NC  0.00
  93.767   5.628 147.115 -30.984
 120.123-107.796 149.927-123.365
 127.605 178.115 164.576 163.087
 119.616-178.593 167.052-120.183
 125.583-176.342 155.344-101.475
 114.420-179.680 139.419 -32.591
 122.650-177.389 144.305-156.135
 123.480-176.874 147.705-104.374
 121.295-178.694 151.121 -18.074
 136.269 -63.716   0.000   0.000
 107.561 -20.364   0.000   0.000
  96.907 -56.473  94.585 -88.756
  93.099  77.169 108.389 -76.278
 131.430 -91.602 115.993 -77.048
 110.222 -51.363   0.000   0.000
  92.879  81.452  83.140  64.860
 120.745-110.565 112.588-118.065
 114.755-141.110  99.471 -88.491
  92.950  97.829 105.050-110.141
 118.429   0.000 115.411 -82.380
 # 134 total E   -4.10409E+01 rmsd from N    0.000 %NC  0.00
  93.819 124.023 150.575-131.765
 119.941-174.236 176.430-168.187
 132.804 -73.015 157.065 131.023
  94.198  79.961 164.736-135.700
  91.066  66.387 136.996-108.310
  91.922 126.080  88.023 -82.960
  92.113 115.334 141.280-112.818
 121.583 -82.402 141.569-143.940
  94.900 -54.005 143.808-117.819
 126.904-161.837   0.000   0.000
 130.008 -55.390   0.000   0.000
 119.266 -86.958 108.502-107.603
  93.261  90.987 114.824 -76.492
 128.540-107.669 118.135 -83.093
 127.765-179.848   0.000   0.000
 120.629  64.505  85.197-107.411
 126.431-107.658 116.520-115.881
 120.022-141.905 113.597-115.160
  93.243  73.275 106.873-110.678
  93.285   0.000 112.686 -77.819
 # 135 total E   -4.09868E+01 rmsd from N    0.000 %NC  0.00
  93.769   9.328 146.208 -30.741
 116.619 176.968 150.125-121.299
 127.813 178.896 114.780-102.009
 122.615-179.668 124.080 -62.495
  91.650  71.870 119.715-129.528
 120.049 -87.170 136.991 132.679
 118.920-175.102 154.703 -22.772
 118.111-175.488 124.850 137.271
 123.727-179.759 159.134-153.590
 128.353  22.578   0.000   0.000
 112.700 -25.010   0.000   0.000
  98.187 176.271 101.769 -98.494
 130.607-171.553 143.500-145.549
 119.847-174.784 146.635 -68.173
 128.817 179.519   0.000   0.000
  93.228  85.166 107.433  30.896
 122.812-168.979 108.148-109.574
 122.437-144.610 112.223-111.593
 118.106-100.627 127.792-136.336
  94.370   0.000 114.823 -76.187
 # 136 total E   -4.09544E+01 rmsd from N    0.000 %NC  0.00
 118.248-154.782 146.252 -20.249
 119.812-179.189 157.224-157.763
 129.771 -82.542 150.325  -1.325
 117.430 -51.520 134.509 -76.571
  92.439 170.929 106.080 -36.489
  93.431  97.772  92.502-121.200
 121.448 -98.401 149.739-146.194
 126.060-176.057 134.963-137.919
 121.618 -71.006 150.931 -18.004
 132.429 -67.896   0.000   0.000
 120.902 -33.891   0.000   0.000
 111.980-179.698 129.950-142.369
 122.109 177.169 134.313 -16.949
  94.322  90.437 115.877 -76.110
 137.576-104.214   0.000   0.000
 127.928 -90.376 121.413 -53.454
 117.652-109.333 121.363-130.177
 113.162-139.286 100.617 -93.385
 117.278-119.048 126.889-136.560
 121.861   0.000 121.761 -81.022
 # 137 total E   -4.09505E+01 rmsd from N    0.000 %NC  0.00
  93.630  48.385 144.513-142.193
  92.589 104.761 149.169 -96.997
 130.016-104.277  91.938 -97.255
 115.045 173.458 145.895 -93.368
  92.516  94.915 136.471-130.499
 124.004-110.926  98.254 -73.803
 121.649 171.274 154.372-155.138
  92.670  95.119 142.452-105.763
  93.815  21.634 106.236 -83.935
 122.723-165.977   0.000   0.000
 132.444 -52.352   0.000   0.000
 116.599 177.706 127.217-135.149
 123.572 178.679 147.487 -99.584
 127.044 -60.899 122.094 -80.301
 127.376  72.111   0.000   0.000
 127.315 -76.101 141.820-170.723
 118.970-143.924 118.108-124.556
 101.546 141.147 105.178-101.055
 120.646-118.904 119.889-125.668
 120.683   0.000 146.719-115.743
 # 138 total E   -4.07029E+01 rmsd from N    0.000 %NC  0.00
  93.828  87.804 149.710 -13.128
  93.117 173.881 139.062 -32.431
 130.339-104.360  96.024 -86.058
 116.562 115.646 157.285-129.240
 129.147 -91.100 126.627 -78.236
 129.071 -30.545 160.941  -6.085
 118.497 -98.265 156.964 -18.812
 126.732 165.612 156.859-123.266
 118.403 -79.282 105.950 -80.430
  95.859  62.408   0.000   0.000
  94.641  39.129   0.000   0.000
  90.504  58.156 106.411 -99.233
  91.038 142.226 115.886 -75.047
  90.899 -71.180 114.686 -77.996
  94.111  24.705   0.000   0.000
 128.793  85.182 129.777-133.468
 109.044-169.519  86.962-104.085
 123.060-123.128 110.907-109.815
 117.047-129.345 141.150-155.717
 124.732   0.000 122.428 -86.088
 # 139 total E   -4.05869E+01 rmsd from N    0.000 %NC  0.00
 114.216-165.466 146.034-126.069
 119.121 174.618 150.092 -21.636
 111.682 166.354 154.084-121.200
  92.798  75.907 139.414 -96.824
  91.149 115.844  86.589 -69.539
 125.661-125.403 176.504  19.128
 117.351  85.805 147.864-146.631
 131.091 -98.697 148.114-169.338
 115.266-173.127 150.073 -20.304
 136.744 177.460   0.000   0.000
 103.006 -10.953   0.000   0.000
 108.451-145.603 129.626-143.627
 129.363-167.104 154.539 -96.670
 126.557 -41.778 122.091 -80.221
 132.369 106.463   0.000   0.000
 114.972 174.368 120.274 -44.884
  94.228 127.031 100.596-124.277
 106.291-106.362 133.526-151.977
 114.124-127.611  95.094 -85.862
 123.905   0.000 121.421 -84.857
 # 140 total E   -4.03479E+01 rmsd from N    0.000 %NC  0.00
  93.595  99.372 142.549-129.668
 118.168 178.130 156.992-151.066
 120.243 168.290 154.073  -9.792
 120.628 175.587 144.551 -96.937
 124.670 -70.646 156.461-141.737
 123.864 -55.630  96.941 -73.925
 123.069 -59.851 161.784-174.668
  93.238  88.479 133.835-133.673
  93.234   7.178 140.406-113.812
 116.242-163.541   0.000   0.000
 131.441 -60.993   0.000   0.000
 114.738 170.436 138.706-154.895
 118.372 176.956 119.699 -79.444
 123.669-179.372 142.497-157.190
 127.421 175.282   0.000   0.000
 128.266 -77.896 144.922 -45.799
 119.942-142.782 109.877-110.129
 105.840 133.673 119.063-129.068
  93.278 124.033 103.404-114.232
 120.072   0.000 119.780 -82.522
 # 141 total E   -4.02830E+01 rmsd from N    0.000 %NC  0.00
 116.524-138.994 151.708-151.252
 129.055-176.740 176.423-162.792
 120.057 171.111 147.927-126.516
  92.849  71.861 138.646 -95.475
  90.628  19.132 123.743-115.036
 100.782-102.312 123.234-103.420
 115.148 -73.551 161.112-175.120
  93.098  70.695 136.777-141.154
  93.356 136.393 142.950-121.768
 144.549 -83.936   0.000   0.000
 114.582 -23.985   0.000   0.000
 116.408 -91.070 117.876-122.274
 128.589  79.487 140.855  15.700
 113.447 148.618 118.774 -78.344
 130.685 167.544   0.000   0.000
 127.820-112.672 104.098 102.717
 119.574 133.128 123.748-134.110
 126.298-172.593 112.377-108.394
 117.701 136.632 127.080-135.645
  93.604   0.000 114.776 -77.489
 # 142 total E   -4.02608E+01 rmsd from N    0.000 %NC  0.00
 118.060-146.054 149.627 -20.805
 119.104 175.986 147.813 -26.985
 115.530 177.439 116.831 -76.787
 120.141-176.826 138.194 -97.006
 120.818 178.847 147.281-127.376
  93.753  99.090 127.714 -14.719
 116.149 -97.969 156.344 -24.011
 125.535-174.510 129.867-116.254
 120.493-177.921 159.822-155.020
 126.448 172.156   0.000   0.000
 134.458 -57.521   0.000   0.000
 117.850 175.529 125.402-131.716
 124.511 177.262 120.774 -80.508
 125.662 -90.342 149.462 -67.303
 125.685-174.692   0.000   0.000
 128.926 -76.793 148.707  69.957
 118.950-143.657 118.594-125.324
 101.472 140.582 105.142-100.691
 120.466 152.252 120.473-126.519
  93.744   0.000 114.929 -77.515
 # 143 total E   -4.02220E+01 rmsd from N    0.000 %NC  0.00
  93.601  98.513 143.456-129.936
 114.300 176.701 159.221 -14.699
  93.414  84.219 102.879 -77.333
  92.338 113.388 139.755 -93.286
  91.621 130.569 128.534-129.903
 124.662  33.545  87.027-101.387
  92.298 -59.176 132.655-106.562
  91.868 -18.635 133.560-115.450
 109.739 158.192 152.158-139.271
 117.601 160.849   0.000   0.000
 144.039-145.514   0.000   0.000
 121.446 -84.907 111.925-111.445
  92.478  85.491 121.978 145.179
  94.322  34.131 110.421 -78.483
 137.714 -57.379   0.000   0.000
  93.239  95.245 120.453-155.581
 130.414-163.340 105.557 -99.900
  99.929-167.701 101.969-100.037
  94.052  64.554 124.617-146.818
  93.380   0.000 132.226-115.799
 # 144 total E   -3.98291E+01 rmsd from N    0.000 %NC  0.00
  93.820 106.211 144.882 -26.761
 117.014 167.471 160.288-136.133
 123.660  48.790 157.981   8.164
 119.824-108.526 125.773 -65.041
  90.648  62.516 104.034 -49.769
  91.679  51.745 151.421-116.429
  91.038  63.195 135.696 -91.445
  92.767 160.328 128.659-144.926
 117.133-179.624 153.192 -16.345
 125.569 171.941   0.000   0.000
 134.156 -60.492   0.000   0.000
 116.909 -85.839 124.534-131.158
 116.789  83.994 146.174-108.396
 123.101-178.083 147.601 -53.450
 124.809 175.712   0.000   0.000
 129.314 -78.311 138.276-164.046
 119.880-142.375 111.678-113.274
 107.029 138.153 118.525-127.116
 120.745 -29.161 120.307-125.946
 118.976   0.000 145.990-110.928
 # 145 total E   -3.98074E+01 rmsd from N    0.000 %NC  0.00
 116.633 170.927 141.467 -25.022
 109.045 156.083 112.191 -69.635
 129.500  90.913  97.373 -93.127
 118.402-112.138 163.384 175.875
  91.020  36.677 113.663 -72.289
  93.384  65.842 156.794  33.498
  92.215 -82.542 137.411 -49.995
 122.234-174.995 126.177-123.215
  95.328 -58.449 149.854-133.714
 124.026-165.975   0.000   0.000
 132.930 -52.488   0.000   0.000
 116.832 177.845 126.721-134.258
 124.361-179.611 147.337-102.279
 125.581-179.398 121.827 -80.090
 126.976 171.153   0.000   0.000
 128.887-103.746 106.120 -55.056
 116.870-167.895 121.254-129.779
  92.169  54.208 107.747-105.009
  93.205  29.405  92.026 -96.868
  93.371   0.000 116.684 -77.589
 # 146 total E   -3.95831E+01 rmsd from N    0.000 %NC  0.00
  93.619  19.989 144.094-127.310
 118.242-177.107 160.138-146.562
 131.202-106.529 164.298 168.635
 123.375-173.539 142.611 -76.946
  91.829 -59.972 122.743-124.809
  93.579 153.334 131.532 -13.916
  91.519  88.640 138.169-137.285
  92.149  94.339 121.735-103.131
  93.424  21.263 150.356 -25.201
 121.628-166.711   0.000   0.000
 132.291 -55.368   0.000   0.000
 114.700 106.938 129.052-139.188
 127.463-100.634 120.775 -80.571
 126.712-175.290 149.992 -62.788
 127.402 176.093   0.000   0.000
 128.287 -77.629 145.298 -45.673
 120.012-142.749 109.188-109.099
 106.498 134.677 118.739-128.239
 105.829-119.579 103.943-110.865
 120.625   0.000 144.566-123.404
 # 147 total E   -3.95213E+01 rmsd from N    0.000 %NC  0.00
 118.586-148.894 147.673 -16.986
 116.278-168.593 152.721 -16.820
 132.338 167.625 160.323 156.125
  96.781 -66.971 140.257 -81.021
  91.237  49.132 106.389-101.543
 120.039 -88.869 102.507-114.228
  92.680 107.896 150.259-170.678
 128.970 -83.799 133.948 -69.732
 124.483-172.815 103.198 -81.827
  96.067 145.477   0.000   0.000
 121.111 -36.387   0.000   0.000
 111.168 112.604 129.840-142.598
 121.146-170.081 125.737 -82.752
  95.129  62.798 115.702 -76.324
 134.316 -64.378   0.000   0.000
  92.544  87.700  95.888  53.245
 120.454-164.193 109.271-113.067
 109.628-112.579 100.741 -95.013
 117.516-118.826 126.528-136.389
 121.853   0.000 121.734 -80.936
 # 148 total E   -3.94696E+01 rmsd from N    0.000 %NC  0.00
 117.037-173.075 144.828 -26.424
 118.997 177.969 154.644-113.348
 122.217 175.564 135.275-125.875
 123.702 178.732 127.514 -59.258
  91.650  72.748 118.172 -65.113
 120.399 -94.619 146.740 142.998
 119.457-178.013 158.581-124.485
 125.577-176.760 170.309-128.531
 120.478-178.132 161.680-149.861
 126.454 172.190   0.000   0.000
 134.367 -57.128   0.000   0.000
 117.271 176.644 126.665-133.889
 124.469-179.581 147.324 -99.324
 125.180-178.606 148.315 -48.628
 124.551 171.272   0.000   0.000
 129.980-103.053 137.785-153.316
 122.340 133.818 117.485-122.081
 118.130 152.454 116.589-120.127
 118.407 -24.973 126.141-134.822
 119.426   0.000 120.435 -80.264
 # 149 total E   -3.94635E+01 rmsd from N    0.000 %NC  0.00
  93.599 103.249 142.767-130.635
 120.768 177.748 168.488-169.567
 123.681 -43.965 156.316   6.882
  91.343  82.146 132.389-106.961
  90.731 -28.735  90.339 -84.782
 124.663-172.287 140.724 -33.215
 120.881-175.706 157.023-163.903
 123.858-176.738 131.671-112.438
 122.011-178.000 111.724 -79.879
 126.336 172.146   0.000   0.000
 134.412 -57.407   0.000   0.000
 118.030 176.270 125.275-131.417
 125.624-178.771 121.036 -80.786
 125.442-174.666 121.903 -79.963
 135.780 -98.335   0.000   0.000
 125.414-106.288 127.911 -47.822
 119.877 122.374 119.291-126.299
  92.481  50.896 108.355-117.770
 107.958 -18.545 124.927-138.343
  93.472   0.000 115.301 -77.078
 # 150 total E   -3.94183E+01 rmsd from N    0.000 %NC  0.00
 116.755-138.274 152.637-148.254
 122.622 -66.671 152.588-131.347
 114.128  79.799 133.654 117.891
 102.700 163.050 144.269 -76.911
  92.345  91.915 130.953-135.143
 122.228 -50.488  93.556 -75.016
  95.208 -89.338 146.239 -40.022
 122.487 174.273 113.821 132.029
 118.080 -74.746 149.363 -27.443
  95.487 166.561   0.000   0.000
 142.699 -51.372   0.000   0.000
 106.520 176.600  95.139 -93.111
 125.180-179.876 121.053 -80.694
 124.413-178.301 147.117 -57.359
 124.052 171.534   0.000   0.000
 130.053-102.686 135.300-148.947
 123.058 134.155 117.432-121.230
 125.225-173.441 115.588-114.616
  93.447 111.578 102.084-102.374
 118.015   0.000 135.592-125.470
 # 151 total E   -3.93867E+01 rmsd from N    0.000 %NC  0.00
 117.332-175.876 111.702 -77.431
  92.791  25.345 147.673 -41.647
 108.858  74.927 160.690   9.046
 113.618 -87.660 163.932-141.481
 114.045-176.114 154.585 -74.562
 117.018-179.100 144.569 -36.649
 121.881-177.825 144.482-155.913
 123.470-176.920 150.132-111.052
 121.338-178.882 151.224 -18.156
 134.782 -64.965   0.000   0.000
 106.872 -15.989   0.000   0.000
  96.401 -52.898 129.791-150.744
  93.020  -9.736 114.851 -76.081
 118.902-169.008 119.875 -79.313
 125.045 173.411   0.000   0.000
 128.928 -94.216 120.913 -52.464
 117.974-108.395 118.408-124.837
 119.146-140.412 110.733-110.316
 116.251   5.663 128.820-138.585
  93.463   0.000 135.528-114.137
 # 152 total E   -3.91883E+01 rmsd from N    0.000 %NC  0.00
  93.968 129.679 144.971  -0.728
 107.547 170.128 142.915 -28.540
 108.613 111.033 132.834-122.441
 121.139-104.110 113.741 -68.012
  90.983  79.564 125.355 149.609
  91.883 111.661 148.122   6.027
  91.889 -50.359 120.367-118.045
  96.898 179.188 127.116-114.049
 118.224-178.336 151.296-155.536
 126.424 172.577   0.000   0.000
 133.156 -53.394   0.000   0.000
 112.262-177.967 130.577-143.098
 135.427-178.051 176.435 -75.477
 121.244 -38.009 119.965 -79.111
 122.552 -16.263   0.000   0.000
  94.241  91.033 107.432  29.240
 117.359-168.812 110.275-115.990
 111.586-112.423 101.629-100.107
 117.954-118.936 120.819-125.855
 121.965   0.000 121.582 -81.145
 # 153 total E   -3.87318E+01 rmsd from N    0.000 %NC  0.00
  93.746  74.327 148.576-151.696
  92.923 152.133 140.566 -23.152
 131.821-120.536 132.391-128.144
  93.694  98.046 138.387 -93.417
  90.298 -63.959  94.325 -79.498
  92.638 103.680 129.335 -48.596
 103.669 -85.324 152.887 -28.106
 128.527-171.808 118.137-104.121
 120.134 -64.986 118.232 -86.276
 123.307  58.297   0.000   0.000
 123.982 -66.362   0.000   0.000
 110.871 164.251 129.469-142.038
 127.082 169.908 121.685 -80.460
 123.688 159.496 148.618 -65.010
 136.453 -86.256   0.000   0.000
  93.476  84.036 122.137-150.478
 129.353-166.650 111.365-110.716
 129.240 139.728 116.909-113.176
 109.769 -21.830  94.149 -74.255
  93.468   0.000 114.022 -76.942
 # 154 total E   -3.84581E+01 rmsd from N    0.000 %NC  0.00
  93.605  99.659 142.898-130.117
 118.226 177.848 157.619-148.215
 117.672 165.728 153.037  13.156
 102.268 -58.936 159.507-165.180
  91.786 149.609 115.599 -11.776
  93.251  98.041 126.878-132.970
 112.932-101.161 154.404 -28.311
 125.578-177.670 128.866-121.526
 120.711 -71.146 161.366-156.489
 132.633 -68.935   0.000   0.000
 124.314 -34.779   0.000   0.000
 123.547-174.934 113.167-110.954
 117.936 172.767 119.493 -79.599
 121.797 -62.121 115.808 -78.624
 119.529 -37.884   0.000   0.000
  93.582  84.243 123.733-148.915
 124.876-110.349 107.816-109.165
 120.200-141.570 112.513-113.118
 117.970-103.161 126.201-132.547
  94.445   0.000 114.484 -77.170
 # 155 total E   -3.84063E+01 rmsd from N    0.000 %NC  0.00
 119.368-112.490 110.226 -80.160
 122.319 -97.652 166.234 -12.772
 126.961 177.366 155.626  -1.322
 116.184 178.232 163.862-135.026
 125.162-177.905 165.105-105.768
 114.192 179.319 139.071 -29.173
 122.208-177.989 144.762-157.714
 123.719-177.053 145.309-101.405
 120.733-177.001 159.334-153.632
 127.832-176.833   0.000   0.000
  94.166  45.081   0.000   0.000
  99.202 169.093 130.524-150.250
  93.617  98.583 115.286 -76.901
 120.726-106.957 117.548 -80.396
 119.448 178.681   0.000   0.000
 129.964 -99.330 135.185-150.393
 122.654 134.607 119.744-124.686
 100.042-174.522 102.222 -98.014
 117.139 144.107 129.196-141.834
 119.079   0.000 143.770-107.541
 # 156 total E   -3.81719E+01 rmsd from N    0.000 %NC  0.00
  93.734   6.605 106.868 -79.395
 123.825 -74.952 159.743-105.461
 128.787   6.451  88.672 -89.114
 122.759 -89.135 104.420 -79.462
  90.542  65.264 126.891 149.871
  98.214-168.908 133.046 -15.183
 124.339-171.546 147.746 165.323
 120.174-167.647 129.334-137.034
  94.203  57.808 151.065 -20.252
 125.114 -68.295   0.000   0.000
 118.209-164.745   0.000   0.000
  93.172  86.404 110.907-118.685
 122.151 -96.706 142.419-120.342
 127.847-173.666 123.324 -79.037
 123.297 174.916   0.000   0.000
 130.031 -84.859 132.493-151.393
 118.589-109.414 116.391-122.151
 119.275-140.030 111.234-111.164
 116.054   5.947 128.934-138.428
  93.383   0.000 115.620 -77.050
 # 157 total E   -3.80862E+01 rmsd from N    0.000 %NC  0.00
  93.617  18.943 143.687-125.851
 116.640 178.408 153.739-120.270
 120.836 174.864 138.025-124.247
 114.303 166.032 135.722 -71.385
  91.906  26.875 122.579-127.231
 115.477  79.836 162.809 166.111
 113.230 -92.105 155.359 -24.785
 122.043-176.763 132.863-132.137
 121.732 -70.427 151.015 -19.817
 130.588 -64.294   0.000   0.000
 102.756 -25.075   0.000   0.000
  98.784 171.438 130.170-149.741
  93.300  90.125 133.694-124.250
  94.369 157.571 114.087 -77.321
 123.826 170.372   0.000   0.000
 128.730 -85.962 139.752 -46.371
 119.771-162.316 118.129-124.143
 110.700-114.790 100.391 -92.814
 116.189  14.493 127.640-137.836
  93.445   0.000 135.298-114.801
 # 158 total E   -3.78875E+01 rmsd from N    0.000 %NC  0.00
 117.164-141.858 154.074-142.390
 121.218-176.712 160.753-157.736
 139.444 -67.143 152.601 137.183
 127.688 -41.984 157.932-116.814
  93.081 153.789 126.283-130.924
 127.159 -72.371 147.884-148.480
  93.861 -14.067 159.092-120.308
  95.294 103.598 133.596-134.375
 109.737-172.040 151.859 -20.285
 134.360 -71.296   0.000   0.000
  99.005 -30.048   0.000   0.000
  94.835 165.621 130.231-152.289
 124.066 178.934 123.990 -83.219
 125.301-178.701 122.376 -80.492
 127.399 175.423   0.000   0.000
 129.210 -79.020 148.399  70.454
 119.010-143.756 118.486-125.111
 101.549 141.180 104.996-100.519
 120.447-120.416 119.998-126.060
 121.888   0.000 121.527 -81.067
 # 159 total E   -3.77443E+01 rmsd from N    0.000 %NC  0.00
  93.615  22.568 143.356-123.450
 120.088 -95.644 152.936-144.869
 125.102-167.044 118.232 -77.058
 119.630 -84.354 163.349-135.692
 117.221 177.666 135.112 -35.089
 117.106 177.649  97.778-136.920
 112.691-176.097 134.830-100.149
 126.190 164.535 119.295-118.578
 110.275 -71.461 108.855 -79.921
  94.711  60.746   0.000   0.000
 130.455 -48.289   0.000   0.000
 118.034 -84.754 111.791-113.604
 124.451  72.405 138.684  12.804
  95.198 -65.548 114.583 -76.172
 113.606 -24.548   0.000   0.000
 122.678 -93.855 133.664-114.233
  99.025 133.750 104.083-139.134
 117.527-173.489 120.295-126.661
  93.797  70.383 131.513-155.480
  93.312   0.000 114.064 -77.159
 # 160 total E   -3.75246E+01 rmsd from N    0.000 %NC  0.00
  93.625  19.340 144.079-126.934
 118.346 179.889 159.058-143.133
 126.720 173.561 162.393-169.148
 118.008 178.287 143.604 -85.020
 124.497 177.495 147.563-131.238
 126.863-176.552 110.713-131.208
 115.987-179.217 143.255 -84.187
 123.486-179.297 130.273 145.783
 122.415 -71.193 111.241 -80.489
 132.011 -67.332   0.000   0.000
 121.078 -34.055   0.000   0.000
 113.039-179.488 128.209-138.828
 124.364 177.835 121.101 -80.475
 125.668 -90.851 149.522 -68.565
 125.638-175.405   0.000   0.000
 128.985 -82.116 147.378  72.935
 119.848-165.256 119.366-126.586
  92.661  55.751 108.903-106.698
  93.053 128.543 128.830-151.303
 117.444   0.000 132.216-109.406
 # 161 total E   -3.72084E+01 rmsd from N    0.000 %NC  0.00
 117.729 -93.473 145.836 -32.198
  92.357  89.005 153.221-133.142
  93.714 109.419 104.497 -91.626
 121.478-110.803 113.569 -56.941
 117.824 -87.143 121.941 -52.072
 109.361-174.621 129.200 -43.751
 121.639-177.896 142.441-151.613
 114.950 169.018 143.615-102.796
  92.801 -50.758 146.173 -29.454
 100.698 -20.558   0.000   0.000
 112.105 -26.007   0.000   0.000
  95.499 -48.716  93.721 -99.837
  92.456  80.185 114.522 -76.328
 134.514 -95.835 117.162 -82.299
 116.259 -23.816   0.000   0.000
 114.008 175.244 135.222 -91.813
  93.815 126.016 105.539-131.317
 125.151-111.938 112.641-111.040
 117.643-118.887 125.033-132.015
 121.869   0.000 121.632 -80.962
 # 162 total E   -3.68846E+01 rmsd from N    0.000 %NC  0.00
  93.674 109.990 145.666-155.579
 108.530 -54.181 156.949 -23.779
 111.058  83.415 160.886   5.611
 119.642 -94.046 160.716 -77.083
 118.650 177.773 146.208 145.783
 126.583-176.650 107.571-143.880
 117.155-177.418 150.659 -27.180
 122.952-176.540 121.392-118.275
 122.643-176.245 113.092 -78.358
 130.520 -59.514   0.000   0.000
 103.816 -35.595   0.000   0.000
  93.110  80.509 131.918-155.722
 136.085-109.952 144.301  -3.873
 121.336 -56.557 116.797 -80.505
 118.018  -9.499   0.000   0.000
 113.417 -79.808 142.973 159.099
 116.493 124.392 119.001-128.238
  91.352  49.763 124.098-145.211
  92.497  60.345  90.933 -93.254
  93.327   0.000 111.303 -80.115
 # 163 total E   -3.68283E+01 rmsd from N    0.000 %NC  0.00
 117.965 168.830 139.049  -9.045
  91.464  80.294 151.403-145.633
  92.191  73.077 176.448 177.824
  86.145 148.622 130.636 -77.329
  90.818  71.534 129.005-151.732
  91.888 112.367 131.120  18.335
  91.397  84.024 148.988 -39.023
  93.346 132.318  99.873-125.044
 119.427  43.624 115.062 -83.220
 130.047 -60.356   0.000   0.000
 110.251 -32.714   0.000   0.000
  92.768  87.940 131.493-155.053
 130.915-111.046 118.421 -81.253
 118.926 129.483 146.278 -52.892
 140.011 -98.674   0.000   0.000
 119.975 -93.119 127.476  74.849
 112.431  45.355 123.859-135.778
  93.043 122.859 104.557-112.170
 120.581  64.091 118.320-121.931
  93.411   0.000 131.167-132.136
 # 164 total E   -3.67819E+01 rmsd from N    0.000 %NC  0.00
  93.729   8.864 105.131 -79.390
  92.810 111.518 131.898 -93.045
 137.596-102.703 156.781 136.503
 116.387 171.960 124.836-107.587
  92.077  85.975 120.434 -99.368
 121.603 -66.723 127.327  48.740
  92.849 110.921 149.851 -99.536
 124.858 -96.069 122.495-126.153
 124.881 -61.725 149.504 -22.516
 120.892 -59.308   0.000   0.000
  95.375 174.683   0.000   0.000
  92.959  66.382 125.565-148.645
 113.376-101.206 115.666 -78.436
 123.847 141.637 121.058 -79.656
 134.493 -77.033   0.000   0.000
  92.952  75.420  85.945-106.508
 125.299-166.584 115.878-118.263
 122.034-139.868 111.650-108.931
 117.236-114.612 127.384-134.883
  94.757   0.000 137.395-121.601
 # 165 total E   -3.61293E+01 rmsd from N    0.000 %NC  0.00
 121.514 -89.718 168.310-160.683
 120.807-168.111 151.305 -13.832
 133.967 -80.871 150.030  99.051
 121.383-176.435 126.254-108.509
 120.460 118.375 145.543-117.598
 118.320 -88.069 132.989 -21.493
  92.802  77.540 143.865 -46.852
 124.467-124.366 146.809-153.670
 121.204 172.034 110.989 -79.913
 135.716 -81.325   0.000   0.000
 126.162 -57.744   0.000   0.000
 113.610 169.997 124.025-131.773
 122.855-179.584 118.274 -78.691
 120.623-176.590 129.386  51.863
 136.318 -75.538   0.000   0.000
  93.781 149.477 112.122-146.495
  93.302 126.718 101.005-120.746
 124.496-111.570 115.100-116.172
 117.762-118.673 123.914-129.715
 121.800   0.000 121.575 -81.011
 # 166 total E   -3.59816E+01 rmsd from N    0.000 %NC  0.00
  93.711  11.041 105.220 -80.520
  92.753 101.010 141.863-127.175
 130.361 -85.873 150.459   9.609
 123.447 -72.392 119.169 -66.274
  92.101   4.728 108.932 -81.888
 127.594  83.370  96.344 -96.575
 126.435-108.770 162.300-161.115
 133.340-179.291 127.299-125.773
 122.217 -78.126 168.908-147.516
 134.843 -78.174   0.000   0.000
 130.063 -41.272   0.000   0.000
 124.175 112.238 114.512-113.558
 132.146-105.473 148.772 -48.786
  94.593  34.462 114.642 -76.729
  95.634  61.849   0.000   0.000
 105.775 -67.786 135.656-135.403
 117.916 135.389 113.901-119.592
 130.285-170.890 117.854-115.423
 122.169 136.105 117.035-117.576
  93.586   0.000 114.756 -77.473
 # 167 total E   -3.53508E+01 rmsd from N    0.000 %NC  0.00
 114.779-174.776 149.373-114.990
 109.881 121.714 148.338 -23.435
 132.239 -98.247  95.978-102.472
 121.536-167.294 163.875 -73.282
 118.056-168.450 153.318-179.769
 123.379 173.686 153.891 165.561
 103.709 -46.461 154.201 -24.837
  93.324 115.396 129.545-116.924
 115.145 -94.316 107.913 -83.262
 142.972 -62.403   0.000   0.000
 108.451 -12.030   0.000   0.000
  92.620  92.097 128.490-149.728
  91.809 119.533 111.078 -76.580
 132.059 -96.668 118.345 -81.954
 109.042-177.148   0.000   0.000
 125.791  80.922 139.318-153.680
 123.668-162.651 112.212-112.035
 113.594 133.095 117.240-123.488
 119.048  64.350 121.648-128.751
  93.344   0.000 114.971 -77.271
 # 168 total E   -3.52133E+01 rmsd from N    0.000 %NC  0.00
  93.626  20.047 144.150-132.275
 114.304 179.679 162.182 -19.634
 117.777 175.531 172.922  15.008
 125.322-178.443 161.116-156.591
 111.085 179.272 125.557  -4.803
 126.757-178.795 150.966-169.496
 118.615-178.395 157.594 -18.322
 123.952-177.192 128.510-140.661
 121.887-178.078 151.416 -16.600
 126.139 172.176   0.000   0.000
 133.642 -56.593   0.000   0.000
 106.804 174.093  98.865 -90.978
 124.118 179.996 147.069-111.238
 125.605-179.098 121.783 -80.199
 127.252 173.856   0.000   0.000
 129.178 -85.629 148.330  65.919
 121.167-165.463 113.539-116.654
 114.730  52.205 123.202-129.772
 115.490-119.609 124.070-133.474
 120.858   0.000 147.932-111.880
 # 169 total E   -3.52127E+01 rmsd from N    0.000 %NC  0.00
 117.648-116.687 154.387-157.913
 118.238 169.319 152.272-119.117
 118.679  52.409 155.552 -11.001
 125.412 -69.791 165.125-153.231
  92.175 103.311 129.474-130.492
 108.828 161.731  92.057 -92.494
  92.239  91.200 133.652-140.734
  92.863 151.367 112.270-135.425
 119.263 -63.643 152.342 -19.438
 127.346-145.517   0.000   0.000
  94.471  85.388   0.000   0.000
 107.426 -39.707 122.197-133.467
  93.676  79.643 114.853 -76.510
  93.562 134.944 119.855 -76.396
 126.496  31.327   0.000   0.000
 128.763  83.870 135.611-145.520
 126.815-170.187 113.200-112.603
 127.843-142.102 110.020-105.305
 118.936-117.989 114.913-117.364
 121.744   0.000 121.425 -81.100
 # 170 total E   -3.51166E+01 rmsd from N    0.000 %NC  0.00
 113.380 -40.556 151.822-146.476
  92.943 109.621 150.267-139.737
 130.547-100.922 160.689 175.193
 122.127-174.082 165.952-138.480
 125.334-172.932 155.027 -93.935
 120.931-161.216 138.081  25.286
 126.851 -72.033 166.418  -5.681
  94.360 115.289 129.448-122.560
 113.663 -87.480 116.686 -83.898
 131.816 -59.169   0.000   0.000
 119.527-138.875   0.000   0.000
 116.471 174.547 129.884-140.822
 123.540 177.413 147.256 -95.086
 125.406 -64.367 121.582 -79.894
 127.244 -22.957   0.000   0.000
 127.110 -76.152 142.272 177.579
 118.845-144.004 118.211-124.829
 101.520 141.131 105.073-100.968
 120.510-112.120 119.973-125.941
  94.623   0.000 116.384 -77.749
 # 171 total E   -3.49986E+01 rmsd from N    0.000 %NC  0.00
  93.595  45.245 142.594-125.276
  92.809  92.727 148.875-144.516
 122.594 170.537 167.794 169.609
 119.352-179.221 166.007-113.153
 125.674-176.352 155.543-104.538
 114.210-179.814 140.518 -30.959
 122.626-177.700 144.306-156.995
 122.625-179.159 148.278-106.222
 121.620 -69.976 152.245 -18.356
 131.425 -66.568   0.000   0.000
 101.132 -26.784   0.000   0.000
  96.121 169.154 101.431 -98.196
 126.341 175.912 123.977 -84.122
 125.515 -93.941 149.409 -67.398
 125.323-179.106   0.000   0.000
 128.016-108.819 127.386 -48.619
 120.540 122.850 119.573-126.041
  91.952  48.248 106.999-113.717
  92.585 102.663 127.946-150.656
 121.349   0.000 120.721 -85.204
 # 172 total E   -3.45721E+01 rmsd from N    0.000 %NC  0.00
 116.711-137.749 152.343-149.328
 121.486 175.165 160.221-150.131
 113.706 109.784 158.112   6.003
 110.527 -96.778 131.508 -84.314
 115.210 173.821 141.072 134.741
 123.864-177.381 105.881-139.776
 119.630 -70.467 152.180 -81.006
 115.479 -32.587 129.706-132.701
  93.741 -40.402 143.143-122.600
 120.911-164.868   0.000   0.000
 145.224 -26.444   0.000   0.000
 106.429 -27.708 114.771-123.996
  90.043  97.345 129.566 152.332
  95.044 -23.657 111.129 -77.330
  99.869  67.313   0.000   0.000
 126.217-172.588 125.012 -78.368
  94.277 114.639 100.347-128.642
  91.492  49.454 110.651-120.793
  92.742  84.444  93.467-107.518
  93.436   0.000 126.041-133.003
 # 173 total E   -3.42746E+01 rmsd from N    0.000 %NC  0.00
 119.557-114.331 109.686 -78.619
 113.850 173.308 170.694 -15.545
  93.437  81.395 176.440  16.385
  91.278  83.305 129.681-102.783
  90.998 -37.736  97.250-101.897
 124.956-165.740 140.775 -26.826
 113.225-174.504 141.185-136.206
 133.046-177.521 128.053-110.817
  93.890  42.617 143.896-126.111
 133.801 -66.862   0.000   0.000
 111.460 -16.855   0.000   0.000
  94.811 -53.271 105.367-110.883
  93.390 -15.407 114.956 -77.506
 110.911-165.283 118.004 -78.344
 142.699-176.578   0.000   0.000
 112.357 -59.725 139.356 -40.044
 109.810-153.588  99.916 -96.807
 109.757  16.257 128.853-143.166
 108.936 144.211 127.559-141.238
 119.024   0.000 142.369-115.585
 # 174 total E   -3.39265E+01 rmsd from N    0.000 %NC  0.00
 117.571 156.226 131.776 -20.699
  92.345  94.259 151.785 162.018
 120.634 -82.516 133.062-112.962
  91.572  82.029 138.084-106.493
  90.826  -8.188 115.242-105.451
 106.215 165.581 151.068 -14.515
  91.947  69.889 163.688 -34.619
  92.426 104.214 100.336-121.567
 119.891-101.998 119.150 -85.120
 134.238-173.146   0.000   0.000
 122.976 -39.400   0.000   0.000
  91.470  66.238 100.964 -96.838
  91.760  13.141 111.456 -76.766
 104.175 -86.864 121.275 -70.544
 128.477 -92.511   0.000   0.000
 118.489  26.480 148.625 176.358
  94.207 127.043 102.802-115.777
 101.091-173.417 103.509-105.905
  94.077  51.586  96.991-100.513
  93.331   0.000 114.665 -77.941
 # 175 total E   -3.37114E+01 rmsd from N    0.000 %NC  0.00
  93.712  95.076 109.124 -81.375
 118.200 178.539 165.069-162.605
 123.137 -56.298 152.887  -0.756
 128.075-151.385 130.445 -74.380
 119.493 -90.733 144.151-152.296
  92.535  73.189 116.022 136.042
  91.289  51.491 149.938 -41.650
  92.769 165.543 116.139-129.911
 119.394-178.262 119.702 -82.059
 139.216 -66.891   0.000   0.000
  95.769   7.684   0.000   0.000
 105.605-148.348  96.703 -88.962
 130.265-171.621 125.236 -81.419
 120.678-170.137 116.536 -78.042
 139.911 168.218   0.000   0.000
 114.646  42.632 119.576 -66.868
  93.825 117.392 101.773-118.245
  92.118  51.312 130.712-155.044
 101.673-126.151  92.613 -92.965
 121.573   0.000 121.390 -80.564
 # 176 total E   -3.33259E+01 rmsd from N    0.000 %NC  0.00
  93.582  15.992 141.070-115.156
 120.200 -89.255 148.511-122.986
  92.175 124.314 127.847 -34.004
  92.029  39.103 120.490-101.331
  91.542  95.999  96.464 -89.075
 117.857  24.432 136.297 129.747
  92.447 -67.759 140.504 -46.588
  94.070 -10.844 133.382-125.014
  96.163 165.270 106.032 -80.785
 140.511 178.414   0.000   0.000
 118.352-169.767   0.000   0.000
 119.348 -81.828 110.745-111.912
  92.970  -8.575 114.658 -76.266
 115.807-155.578 144.223 -74.137
 141.511-117.031   0.000   0.000
 128.210 -72.320 139.341 -39.390
 114.543-141.087  99.763 -83.867
 118.342 135.017 116.243-119.857
 117.778  67.742 117.588-123.487
 117.374   0.000 136.204-132.657
 # 177 total E   -3.31198E+01 rmsd from N    0.000 %NC  0.00
 111.026 165.022 139.767-107.689
 116.810 122.519 154.986-177.081
 131.685-100.169 165.120 161.126
  94.730  88.291 138.054-103.009
  91.756 -84.227 106.719 -98.337
 114.704-177.102 129.675 -41.107
 124.867-177.358 148.047-158.235
 117.523 179.190 137.321-103.141
 120.363 -63.898 157.046-155.905
 125.242-158.410   0.000   0.000
  93.424  45.846   0.000   0.000
  90.520  55.906 132.985-159.014
  91.152 146.633 112.496 -76.527
 133.065 -72.011 124.546 -84.334
 119.120   1.789   0.000   0.000
 117.105 -85.454 112.370-121.200
 115.274  46.915 122.606-133.508
  92.894 121.831 104.708-112.855
 119.191 -23.453 121.171-126.097
  93.384   0.000 109.873 -76.307
 # 178 total E   -3.22168E+01 rmsd from N    0.000 %NC  0.00
  93.621  47.278 144.170-135.722
  91.674  88.376 134.170 -20.002
  91.246  45.075  95.082 -86.566
  90.609  43.212 173.025 178.593
  89.830  50.787 130.515-108.966
  92.944  74.541 144.989  22.052
  92.335 -75.403 152.822-103.078
  94.656 -50.913 137.901-103.970
  93.585  10.200 142.705-127.915
 151.036 -34.233   0.000   0.000
  96.129  91.940   0.000   0.000
 131.586  76.501 103.466 -97.029
 132.327-140.976 123.480 -78.775
  94.622  17.891 115.710 -76.229
 125.922 -76.465   0.000   0.000
 123.529-151.413 136.157 106.780
 118.721  20.941 117.022-127.520
 116.694  49.044 116.432-122.328
 111.160-121.807 123.029-134.091
 121.926   0.000 122.004 -80.907
 # 179 total E   -3.20985E+01 rmsd from N    0.000 %NC  0.00
 116.991 -74.682 151.273 -18.156
 115.432 116.763 153.425-132.379
 130.709 -99.174 150.698  -5.369
  93.362  79.329 148.789 -91.389
  92.563 155.730 123.022-127.153
 117.784 175.230 159.925 177.127
 112.707 170.494 162.995 -19.565
  94.057 127.585 120.253-148.407
  90.547 -40.881 143.957-100.100
  95.566 -43.734   0.000   0.000
 105.949 -11.480   0.000   0.000
  99.244 -42.055 124.559-140.602
  95.387 -26.223 121.445 -74.868
  97.884   1.326 112.911 -77.017
 145.002 -78.397   0.000   0.000
  93.685  42.586 132.725 -50.992
 112.829 138.414 117.486-128.267
 123.835-172.081 124.534-130.105
  93.435 112.058 132.521-156.085
 118.566   0.000 116.388 -81.542
 # 180 total E   -3.18608E+01 rmsd from N    0.000 %NC  0.00
  93.622 106.808 144.460-133.851
 109.781 161.344 134.324 -39.330
  93.831  86.347 125.485-115.355
 126.987-116.630 159.339-176.069
  93.128 121.503 113.283 -25.599
 124.922 -82.660 108.312 -98.992
  92.848  82.332 139.041-155.296
  93.247 142.938 138.922 -89.729
 111.992 -83.111 109.154 -82.782
  95.968  56.164   0.000   0.000
 135.332 -69.308   0.000   0.000
 111.286 168.969 129.371-141.637
 132.960-179.041 123.787 -81.363
 115.726 178.572 120.618 -76.512
 124.874 171.400   0.000   0.000
 119.833  44.193 121.433-143.642
  93.716 118.810 100.158-125.763
  91.172  49.035 108.765-121.295
  92.202  63.638  90.430 -99.895
  93.356   0.000 109.571 -81.841
 # 181 total E   -3.14474E+01 rmsd from N    0.000 %NC  0.00
 116.434-144.876 151.828-148.583
 120.763-176.676 168.081  -9.907
 130.988 -89.907 164.967  13.441
  93.461  77.782 133.079 -97.437
  91.729 -96.228  96.268 -94.766
 108.542-172.820 125.210  31.900
 122.838 -79.932 176.414  -4.909
 120.388-174.188 120.945-117.878
  94.264  42.982 141.922-117.622
 135.939 -69.199   0.000   0.000
 125.222-141.502   0.000   0.000
 114.897 174.102 132.506-145.017
 124.681-179.999 148.286 -88.759
 125.200-178.773 148.378 -48.473
 124.631 171.272   0.000   0.000
 129.959-102.920 137.842-153.967
 123.052 134.108 117.341-121.220
 123.777-172.136 117.028-117.773
 110.663-118.563  98.819 -91.954
 121.569   0.000 121.417 -80.514
 # 182 total E   -3.11219E+01 rmsd from N    0.000 %NC  0.00
  93.814 113.964 146.321 -24.560
 117.793-178.626 150.470 -17.149
 115.179 175.461 167.908-178.442
 124.399 178.060 164.878 -82.900
  92.100 -80.301 118.250-104.096
  92.694  92.200  96.237 -81.548
  92.559  77.286 135.431-107.369
 126.772 -93.630 143.859-172.676
 121.811-176.516 109.577 -79.963
 136.203 -68.944   0.000   0.000
 124.560 -36.490   0.000   0.000
 114.939-178.800 127.226-136.206
 124.383 179.745 121.200 -80.349
 129.612 -65.511 120.723 -79.815
 130.001  68.350   0.000   0.000
 122.650 -99.068 107.688-119.890
 117.644  39.627 122.993-132.635
  93.170 116.455 104.488-114.059
  92.605 131.661 104.878-116.586
 118.482   0.000 130.316-140.821
 # 183 total E   -3.08826E+01 rmsd from N    0.000 %NC  0.00
 116.705-141.155 152.423-148.389
 120.352 179.204 151.109 -18.991
 117.490 169.037 168.550-178.810
 119.626 177.747 145.431 -95.290
 123.736 176.499 147.633-119.173
 128.325-175.203 112.698-133.096
 117.382-177.334 143.398 -74.990
 122.586-177.172 126.836-138.695
 122.282 179.979 154.302 -19.542
 135.509 -75.536   0.000   0.000
 121.477-167.768   0.000   0.000
  96.451 -36.368 105.128-103.475
  93.223 -45.762 113.159 -76.079
  95.687  91.975 115.580 -76.626
 131.551 -95.786   0.000   0.000
 124.788-115.637 155.312 -41.179
  93.794  54.124 104.671-147.758
  93.899 130.562 105.414-116.326
 118.034-120.580 125.782-135.328
 121.811   0.000 121.602 -80.934
 # 184 total E   -3.08180E+01 rmsd from N    0.000 %NC  0.00
 116.728-147.597 153.001-148.598
 123.668 -94.310 156.994-146.757
 124.623-170.633 119.254 -72.406
 114.430-178.912 131.887 -98.804
 123.925 174.476 142.332-115.156
 130.325 -76.443 108.621-131.267
 111.194 113.011 174.809-157.390
 119.979 -73.599 123.839-123.776
  93.112  73.050 143.142-122.064
 131.081  -8.826   0.000   0.000
  94.330  47.402   0.000   0.000
 104.181 174.078 122.600-135.121
  93.423 100.951 114.522 -77.062
 124.124-100.890 115.321 -80.063
 130.192 -62.744   0.000   0.000
  94.252 154.383 116.339 -28.091
 121.097 141.962 118.389-125.425
 126.244-172.764 112.591-109.492
 117.790 143.077 126.816-135.079
 119.819   0.000 119.748 -80.675
 # 185 total E   -3.06609E+01 rmsd from N    0.000 %NC  0.00
  93.777  92.081 149.019 -20.441
  92.667 143.561 150.172-122.295
 123.115 -69.268 129.518-125.158
 107.624 -47.628 166.233-115.450
  91.861 168.827 117.030  79.320
  92.527  98.096  85.636-101.765
  92.211 -54.686 146.365-136.524
  93.120  89.977 129.246-125.328
  94.233-164.224 141.058-122.228
 128.342 -66.717   0.000   0.000
 121.433 -35.164   0.000   0.000
 113.040-178.867 129.072-140.405
 125.413-178.766 121.448 -80.514
 125.687-177.186 122.863 -78.406
 121.736 170.960   0.000   0.000
 120.922  45.758 124.305-141.846
  93.228 127.362 100.243-127.356
 121.779-172.587 118.694-123.140
 116.160-113.045 131.392-142.209
  94.635   0.000 116.408 -77.508
 # 186 total E   -2.99889E+01 rmsd from N    0.000 %NC  0.00
  93.771  32.881 144.821 -33.107
  92.896 169.318 151.101-112.967
 120.116 175.837 134.970-124.386
 120.023-178.022 134.214 -64.947
  92.055 -64.054 103.783-107.669
 109.278-174.794 134.390 -37.472
 122.080-176.957 145.758-158.478
 122.716-177.953 148.018-102.895
 121.806-179.678 107.697 -79.194
 122.714 165.704   0.000   0.000
 105.252 -19.240   0.000   0.000
  94.787 -62.021  95.015 -98.711
  92.408  78.656 135.883-107.320
 130.786 -75.792 117.011 -77.513
 126.711 -40.255   0.000   0.000
  94.466  91.740 124.547-152.106
 126.248-174.403 106.698-106.032
  92.757  56.195 132.087-158.443
  92.603 127.235  97.247 -95.232
 120.856   0.000 112.688 -88.082
 # 187 total E   -2.94995E+01 rmsd from N    0.000 %NC  0.00
  93.697  35.303 110.987 -81.811
 116.193-179.991 158.194-147.029
 123.037 173.780 153.066  -3.025
 118.266 175.868 160.290-122.495
 123.308 175.777 160.279-114.420
 127.846-176.221 113.837-140.587
 116.831-178.114 149.891 -28.272
 118.149 179.286 118.680-128.761
 121.119 -67.039 158.466-157.713
 126.299-168.164   0.000   0.000
 132.988 -55.736   0.000   0.000
 114.802 106.836 128.909-138.886
 127.856-100.923 121.183 -80.048
 125.452 -66.355 117.874 -79.167
 124.519 -40.575   0.000   0.000
  92.741  90.411 107.377  26.427
 123.492-135.772 106.208-106.015
 107.104 142.977 121.300-132.939
 124.287 -27.755 113.586-113.292
 119.430   0.000 120.050 -80.386
 # 188 total E   -2.90249E+01 rmsd from N    0.000 %NC  0.00
 118.151-160.450 107.844 -79.343
 122.014-176.009 142.418  -1.151
 121.700 -43.870 116.768 -98.240
 129.119-160.704 123.866 -63.629
  92.534-178.184 105.846-115.481
 111.590 -60.822 131.718 -38.996
  92.642 -36.885 147.876-174.426
  94.059  99.389 134.332-133.194
 126.255  14.660 149.684 -22.966
 139.308 -24.764   0.000   0.000
 140.212 -33.973   0.000   0.000
 122.717 -77.531 117.555-118.801
 137.234 -18.053 159.819 -79.858
 122.708 139.048 147.956 -74.008
 132.423 -61.042   0.000   0.000
  92.617  85.804 108.972  28.319
 119.415-169.372 106.006-105.522
 124.092-171.801 113.230-112.307
  93.973  17.941 100.741-111.591
 120.466   0.000 122.199 -83.438
 # 189 total E   -2.68726E+01 rmsd from N    0.000 %NC  0.00
 117.456-116.003 153.629-160.585
 117.709 161.869 143.277 -27.322
  92.461  82.178  93.942 -80.528
  94.965  11.191 167.957-154.879
  92.959 -95.479 108.713 -32.522
 120.892-171.306 123.988 -62.478
 111.030 170.597 144.720 -41.595
  92.861  88.070 124.951 -93.076
  93.844 152.359 138.640-122.294
 135.310 -74.018   0.000   0.000
 129.933-131.822   0.000   0.000
 119.001 174.745 125.010-130.566
 125.587-179.781 120.988 -80.622
 125.032-179.160 149.470 -66.031
 126.561 172.594   0.000   0.000
 116.571  76.150 128.690 -34.640
 126.555-170.888 116.572-117.865
  92.318  52.131 125.837-146.352
  93.012  17.199  93.959 -96.001
 117.949   0.000 118.913 -79.866
 # 190 total E   -2.63878E+01 rmsd from N    0.000 %NC  0.00
  93.730  95.255 109.534 -75.194
  93.294 164.879 135.538 -21.616
  93.432  74.556  91.098 -83.064
 130.208 159.445 156.247 -55.477
  91.580  61.600 128.575-148.851
 119.196-109.448 137.110  22.507
  93.792 145.613 144.121 122.756
 108.683 179.533 119.321-126.166
 128.048 173.894 164.120-167.125
 133.913 -63.425   0.000   0.000
  93.510  57.299   0.000   0.000
  93.954 143.493  90.888 -57.181
 117.468 165.256 146.838 -31.074
 136.910 -70.854 123.046 -82.019
 127.128   6.233   0.000   0.000
  94.320  41.634 128.007-138.902
 124.422  26.584 123.224-127.711
  92.578  48.414 113.590-100.903
  92.332  91.910 107.377-121.523
  93.353   0.000 105.290 -84.218
 # 191 total E   -2.58732E+01 rmsd from N    0.000 %NC  0.00
  93.613  43.108 142.895-133.368
  92.742 167.338 139.919 -56.895
 117.310 163.159 142.307  39.900
  92.771  71.421 120.267-125.734
  92.174 108.086 129.149-154.587
 109.988 -96.964 131.171-115.677
 120.577 100.773 171.249-154.114
 122.677-115.785 125.365-129.596
 120.705  96.508 110.819 -79.961
 135.128   8.227   0.000   0.000
 135.072 -35.283   0.000   0.000
 118.339-141.487 123.288-128.306
 120.154-169.904 147.725-108.736
 139.958 -56.310 124.062 -82.519
 132.655  -6.688   0.000   0.000
 126.732 -91.841 129.762 -46.768
 124.224  25.830 119.716-123.402
  93.411  52.100 104.523-115.161
 124.465 -17.356 113.559-113.584
  93.357   0.000 111.950 -75.286
 # 192 total E   -2.54224E+01 rmsd from N    0.000 %NC  0.00
  93.701  10.833 104.336 -81.505
  92.795 156.195 127.236 -91.055
 130.533 107.489 159.127 159.558
 123.443 -94.168 141.181 -80.441
  92.427 -20.762 130.131-143.988
 123.050  87.798 162.371 158.550
  93.131 165.329 161.272-162.561
 120.757 -72.225  92.452  89.171
 125.942 -59.170 155.642-156.849
 131.971  -4.672   0.000   0.000
 107.638 -32.112   0.000   0.000
 103.628 168.179 130.458-147.678
 118.282-178.033 121.420 -80.591
 132.402-174.489 124.344 -80.228
 117.954 172.718   0.000   0.000
 123.156  46.962 127.971-139.755
  93.198 126.703 100.138-127.729
 121.552-172.343 120.631-124.590
 113.013 144.482 132.305-144.555
 120.040   0.000 118.703 -81.536
 # 193 total E   -2.47448E+01 rmsd from N    0.000 %NC  0.00
 118.775 -86.458 110.406 -77.888
 121.348 -90.685 157.453 -13.201
 136.129 -69.606 159.099   7.067
  93.135  67.233 133.250 -92.386
  91.730  91.138  85.389 -72.162
 130.169-114.735 129.243 -58.613
 118.747 119.884 166.266 -10.711
  92.008 -23.969 145.251-105.780
  91.271 -66.610 137.167-100.283
  94.753  38.051   0.000   0.000
 119.711 -72.662   0.000   0.000
  90.769 -25.961 127.171-151.027
  93.648 115.392 115.200 -76.303
 116.294-104.702 136.799 -47.796
 132.883 -81.206   0.000   0.000
  93.110  36.280 151.568 127.197
 115.279  55.227 122.750-132.872
 127.478 145.678 105.603-103.092
 113.224 150.436 137.006-155.253
  93.746   0.000 116.456 -77.347
 # 194 total E   -2.39301E+01 rmsd from N    0.000 %NC  0.00
 112.051 -69.290 138.347-122.942
  92.711  90.438 137.385 -47.459
 141.580-103.432 101.337 -88.880
 118.880-171.075 167.544-141.661
 123.432-178.008 169.575-159.269
 127.588 -81.441 138.390 -20.053
  92.458 105.035 147.795 -97.333
 122.138 -54.081 141.191 163.076
 117.953 -37.960 150.911 -19.904
 133.847 -47.683   0.000   0.000
 136.308-132.103   0.000   0.000
 119.962-142.849 114.102-114.681
 105.722 168.701 138.157-124.202
 134.632-172.755 121.208 -79.626
 112.396 166.771   0.000   0.000
 117.855  47.079 127.503-131.602
  93.536 127.730  95.309-131.005
 121.121-173.556 118.937-123.704
 115.001 136.873 132.238-144.293
  93.614   0.000 115.137 -77.376
 # 195 total E   -2.13732E+01 rmsd from N    0.000 %NC  0.00
 116.651-141.964 152.349-147.446
 122.776-178.573 162.160-149.338
 124.387 168.457 166.443 165.790
  94.501  85.542 167.885-128.743
 124.016-103.281 116.172 -68.501
 120.503-179.820 176.448 151.422
 117.931-179.160 162.618-160.319
 126.160-176.813 152.285-173.574
 121.648-178.049 149.881 -18.364
 126.144 172.051   0.000   0.000
 134.449 -58.059   0.000   0.000
 116.209 172.508 126.842-134.879
  93.960  97.286 114.714 -76.916
 120.004 147.213 119.199 -80.342
 134.102-100.764   0.000   0.000
 123.176  26.290 136.622 -83.244
  94.115 124.417 101.129-126.079
 126.753-112.956 112.040-109.783
 114.777 114.693 128.394-138.580
  93.520   0.000 130.164-116.793
 # 196 total E   -2.06615E+01 rmsd from N    0.000 %NC  0.00
 119.876-128.750 106.643 -75.188
  91.766  74.648 146.260 -48.875
  93.155 118.656 162.168  19.023
  90.577 155.973 139.188 -91.876
  92.043  89.761 124.435-105.675
 115.348 -55.042 139.100   7.506
  93.855-178.239 144.361 -87.227
 133.806-178.331 119.541-123.681
 115.490-178.480 110.833 -76.308
 125.954 172.052   0.000   0.000
 134.142 -60.609   0.000   0.000
 116.951 -85.347 124.275-130.640
 114.962  84.307 119.076 -79.037
 123.829-179.521 123.340 -77.331
 115.895  74.899   0.000   0.000
 121.233 -92.621 137.076 144.213
 116.709  46.419 122.190-132.538
  93.292 126.434 104.766-112.976
 119.092-105.453 122.946-129.403
  94.538   0.000 115.895 -77.569
 # 197 total E   -2.06140E+01 rmsd from N    0.000 %NC  0.00
 115.869 163.364 145.015 -18.663
  92.035  73.186 143.202 -39.348
 121.923-174.722 168.647 165.221
 119.387 163.729 161.013-113.671
  92.951  87.026 121.000 -96.407
 123.166 -71.536 112.051-126.888
  92.705 100.560 158.614-146.977
 128.759 -92.512 135.821-128.692
 120.103 -74.657 157.907-136.799
  96.446  57.683   0.000   0.000
 130.243 -79.958   0.000   0.000
 110.368 113.942 133.931-151.445
 134.907-109.255 120.043 -82.807
 128.652 -78.080 116.396 -81.257
 129.147 -74.143   0.000   0.000
  93.024  36.286 117.622  30.188
 116.589  51.990 120.947-130.272
  93.862 126.642  96.331-106.192
  93.357   5.108 102.963-116.003
 118.522   0.000 119.336 -80.429
 # 198 total E   -1.76808E+01 rmsd from N    0.000 %NC  0.00
 115.986 175.323 146.326 -25.810
 126.884 140.273 176.429-164.365
 129.436-104.794 130.474-123.658
  92.994 103.665 152.072 -91.520
  92.130 -52.332 114.070 -92.028
  93.525  96.877  81.573-105.966
 116.586 108.393 144.002-111.545
  91.898 -47.610 150.456 140.919
  92.115 -34.675 110.236 -82.012
 116.111   4.340   0.000   0.000
 116.690-162.693   0.000   0.000
 123.358 175.684 121.811-128.286
 121.174-179.792 119.902 -80.189
 124.566-179.166 144.058-109.098
 125.996 170.553   0.000   0.000
 116.195  36.969 122.839 -90.759
 119.023  47.953 122.247-131.934
  93.126 126.117 104.761-113.955
 118.012 159.461 125.927-136.560
 120.439   0.000 120.253 -80.744
 # 199 total E   -1.24592E+01 rmsd from N    0.000 %NC  0.00
  93.569 101.626 142.550-130.038
 120.473-179.407 160.981-150.792
 130.161 179.361 169.119 153.426
 119.145-173.727 169.019-134.233
 130.954-163.117 155.191 103.253
 123.928 -96.297 139.639 -10.297
  93.569 102.893 144.932 -45.075
 129.160-100.258 148.665 161.228
 125.379-171.286 151.377 -14.303
 134.636 -69.418   0.000   0.000
 137.945 -38.250   0.000   0.000
 103.223 -34.738  92.681 -86.754
  91.356 101.429 111.506 -72.981
  93.840  32.231 110.631 -78.989
  96.164  46.355   0.000   0.000
 116.488  13.118 120.669-146.861
  94.558  33.125 101.421-124.209
 117.413  49.700 109.115-112.964
 103.465-108.935 128.964-148.498
 122.271   0.000 118.947 -83.390
 # 200 total E    3.19956E+01 rmsd from N    0.000 %NC  0.00
 124.750 111.605 159.530  -7.327
 126.208-107.708 135.441-138.991
 147.376 -30.773 148.712-148.055
 114.893 133.267 137.860 -81.465
 110.505   4.873 147.030 139.836
 135.016 -72.986 138.910-114.208
 133.198 -47.722 150.438-106.892
 140.754  31.072 159.894   8.552
 124.780 151.947 154.400   8.315
  96.671 -36.967   0.000   0.000
 120.369 -66.204   0.000   0.000
 130.572 -31.410 153.183 156.167
 108.641 -91.210 147.808-126.569
 133.266 161.518 144.937 -39.368
  95.802 139.229   0.000   0.000
 149.145-163.890 120.396 -78.163
 113.202 173.231 122.720-131.706
  88.961 119.814 103.362-110.884
  96.843  -4.282 101.069 -94.969
  91.912   0.000 109.516 -63.135