--- /dev/null
+ jlee = 1 nbank = 200 nstep = 40600 12736259 2 353.74693
+ nglob_csa = 46 eglob_csa = -9.25429E+01
+ # 1 total E -8.81150E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.990 118.584 140.326 -7.307
+ 91.447 79.488 147.399 -18.868
+ 89.250 52.101 115.986 -64.212
+ 89.454 42.823 166.971-160.578
+ 89.375 48.178 133.527-105.287
+ 89.322 58.803 120.573 29.222
+ 89.262 58.460 142.194-136.251
+ 88.646 47.455 116.823-126.356
+ 91.012 170.968 137.578-112.669
+ 95.592 99.745 0.000 0.000
+ 130.936 -52.670 0.000 0.000
+ 93.989 81.424 132.410-155.639
+ 94.658 -58.171 118.772 -76.349
+ 134.616-159.400 126.317 -80.337
+ 116.750 174.153 0.000 0.000
+ 131.456 -83.154 111.847-127.276
+ 118.942-109.491 115.303-120.605
+ 119.281-138.861 109.907-109.156
+ 93.135 79.732 104.378-114.504
+ 93.299 0.000 111.237 -78.065
+ # 2 total E -8.67267E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.826 104.792 146.988 -19.144
+ 93.135 126.135 140.527 -27.567
+ 123.723 -90.073 90.173 -93.684
+ 91.194 54.643 146.338-117.578
+ 90.307 38.839 122.346 -96.930
+ 90.864 63.979 119.179 -19.508
+ 90.004 49.209 144.424 -56.551
+ 89.892 79.206 83.959 -79.055
+ 91.589 0.004 137.710-123.700
+ 108.600 -88.987 0.000 0.000
+ 116.395 -53.390 0.000 0.000
+ 92.339 74.412 100.283 -95.978
+ 93.112 143.227 113.018 -76.987
+ 93.170 -74.286 124.754-139.596
+ 94.396 52.975 0.000 0.000
+ 131.643 -78.650 128.072-125.852
+ 116.879-106.359 116.292-123.194
+ 119.989-152.756 116.905-117.910
+ 93.942 32.843 92.493 -98.618
+ 93.458 0.000 114.090 -82.928
+ # 3 total E -9.08499E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.857 122.312 148.545 -9.450
+ 91.447 83.359 127.929 -32.555
+ 91.864 44.212 92.850 -82.744
+ 91.052 43.889 147.668 -99.646
+ 90.003 42.858 119.542-113.378
+ 90.967 52.580 164.372 10.804
+ 90.463 46.072 131.717-166.475
+ 91.611 74.437 108.090-102.993
+ 90.419 -65.214 129.812-137.858
+ 103.314 -66.291 0.000 0.000
+ 98.761 -31.870 0.000 0.000
+ 92.857 104.217 139.924-168.549
+ 94.389 102.541 113.487 -77.138
+ 122.736 -95.184 119.902 -77.610
+ 94.723 81.064 0.000 0.000
+ 130.876 -69.062 129.418 -94.972
+ 118.974-107.764 109.607-113.858
+ 118.418-139.267 110.478-111.527
+ 117.211-118.166 127.230-136.658
+ 121.767 0.000 121.486 -80.867
+ # 4 total E -8.65042E+01 rmsd from N 0.000 %NC 0.00 1
+ 118.428-106.794 152.114 -14.469
+ 122.382 170.385 157.117 -10.511
+ 92.460 75.536 141.704 88.121
+ 90.578 43.539 150.217 -94.604
+ 90.230 48.428 117.743 -67.271
+ 91.412 48.732 133.010 41.830
+ 90.895 39.526 137.836-125.943
+ 92.340 59.516 130.951-132.106
+ 92.555 -77.681 131.884-129.215
+ 122.042 -63.536 0.000 0.000
+ 130.483 -38.758 0.000 0.000
+ 105.708 -30.484 91.554 -80.720
+ 91.808 100.160 114.551 -75.927
+ 92.775 10.821 105.654 -79.981
+ 123.856 -11.381 0.000 0.000
+ 116.976 -74.517 91.422 -59.109
+ 115.774-108.128 118.183-121.748
+ 119.086-140.941 131.557-140.705
+ 92.995 71.190 98.857 -98.071
+ 93.410 0.000 126.050-130.920
+ # 5 total E -8.59012E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.932 110.439 142.804 -9.286
+ 91.715 77.780 134.227 -21.411
+ 91.890 44.767 99.879 -71.423
+ 91.628 38.409 147.988-107.986
+ 90.922 44.790 116.429-110.364
+ 92.056 45.976 132.489 100.979
+ 90.958 76.656 135.785-121.384
+ 91.159 18.904 136.023-122.257
+ 94.111-112.708 107.102 -79.232
+ 93.623 149.374 0.000 0.000
+ 140.389 -36.626 0.000 0.000
+ 94.078 87.058 88.009 -85.406
+ 128.861-114.237 125.172 -82.874
+ 128.836 -83.459 122.056 -80.224
+ 95.371 166.545 0.000 0.000
+ 129.744 -83.473 130.101-124.926
+ 118.608-109.641 119.001-126.397
+ 120.700-137.121 108.403-106.069
+ 93.582 73.662 124.993-145.411
+ 93.314 0.000 111.270 -79.006
+ # 6 total E -8.41265E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.724 96.090 150.832 -27.321
+ 92.828 124.386 140.890 -44.174
+ 130.287 -94.037 91.611 -98.538
+ 92.257 53.660 148.853-109.656
+ 91.334 38.215 113.941 -82.030
+ 92.370 50.164 155.271 95.129
+ 90.971 43.812 139.950-108.147
+ 91.978 68.744 140.094-134.528
+ 92.657-117.310 139.127-133.677
+ 135.826 -69.534 0.000 0.000
+ 92.521 49.373 0.000 0.000
+ 89.508 49.371 98.578-100.079
+ 88.453 59.496 108.564 -76.458
+ 91.137 37.770 116.071 -76.656
+ 94.401 70.368 0.000 0.000
+ 112.305 -58.797 131.589-111.779
+ 118.376-106.622 117.876-125.665
+ 120.029-140.656 112.646-112.922
+ 93.105 54.997 93.909-102.059
+ 93.359 0.000 111.800 -80.950
+ # 7 total E -8.52861E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.707 46.555 109.267 -80.906
+ 92.879 168.664 142.601 -25.672
+ 91.119 85.177 131.719 -95.468
+ 89.602 52.764 146.624-101.648
+ 89.285 45.899 109.099 -74.668
+ 90.110 54.687 125.904 42.568
+ 90.307 39.701 134.877-155.270
+ 92.268 63.058 128.723-135.762
+ 91.899 -66.383 139.893-124.016
+ 115.292 -57.637 0.000 0.000
+ 117.459 -55.311 0.000 0.000
+ 110.430 164.422 130.941-142.699
+ 93.424 72.491 114.598 -77.877
+ 93.816 -99.227 110.725 -77.446
+ 93.906 148.111 0.000 0.000
+ 130.652-111.314 126.208 -70.281
+ 117.925-110.280 119.362-126.708
+ 120.188-142.334 116.014-116.337
+ 93.409 67.219 103.319 -95.018
+ 93.321 0.000 112.907 -78.443
+ # 8 total E -8.92623E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.952 125.444 144.327 -3.866
+ 91.304 86.281 127.537 -23.910
+ 91.553 44.715 123.659 89.875
+ 90.894 43.749 150.495 -94.584
+ 90.639 45.223 118.407-120.101
+ 91.937 50.447 134.948 32.353
+ 90.851 37.650 141.074 -90.929
+ 92.295 60.561 131.004-133.228
+ 92.822 -75.844 129.379-134.452
+ 126.296 -67.647 0.000 0.000
+ 136.127 -32.305 0.000 0.000
+ 109.063 -30.724 91.807 -81.320
+ 90.635 93.773 129.778 141.142
+ 91.586 2.122 103.728 -80.081
+ 118.857 -12.339 0.000 0.000
+ 129.510 -73.276 127.423 -59.160
+ 121.190-147.800 110.218-110.301
+ 121.373-108.804 112.773-113.211
+ 118.296-118.579 116.846-120.919
+ 121.884 0.000 121.496 -81.088
+ # 9 total E -8.39389E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.711 46.092 108.921 -80.657
+ 93.139 168.374 139.385 -37.084
+ 105.938 170.994 116.181 -75.527
+ 91.797 61.518 140.587-106.775
+ 90.064 43.113 114.813-108.066
+ 91.752 53.535 132.991 34.884
+ 90.671 37.185 144.854-119.617
+ 92.304 63.011 129.981-134.205
+ 91.960 -72.153 130.485-131.621
+ 119.384 -66.571 0.000 0.000
+ 130.960 -41.850 0.000 0.000
+ 106.175 -28.903 92.475 -83.908
+ 91.470 97.554 130.149 135.334
+ 91.780 5.977 106.718 -79.293
+ 119.572 -12.186 0.000 0.000
+ 128.212 -77.123 100.271 -58.050
+ 116.744-106.447 119.043-123.478
+ 118.135-115.438 141.533-154.397
+ 118.398-118.579 116.663-121.276
+ 121.887 0.000 121.492 -81.096
+ # 10 total E -8.41036E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.788 52.862 146.966 -26.610
+ 92.888 170.368 140.973 -22.873
+ 91.569 84.978 132.859 109.571
+ 88.007 49.057 147.128 -93.165
+ 88.590 51.527 84.848 -66.453
+ 89.061 47.227 159.797 103.262
+ 90.010 62.773 142.246 -98.528
+ 90.256 31.941 135.058-131.795
+ 92.845-115.848 106.586 -79.756
+ 94.435 149.839 0.000 0.000
+ 132.921 -52.010 0.000 0.000
+ 92.201 66.163 96.882 -97.485
+ 91.320 97.185 107.810 -76.727
+ 92.544 40.840 115.779 -81.473
+ 95.663 80.774 0.000 0.000
+ 122.019 -89.066 84.051 -64.410
+ 118.516-109.710 120.131-126.347
+ 118.662-138.240 112.223-112.437
+ 93.112 81.195 103.492-103.496
+ 93.296 0.000 110.570 -78.366
+ # 11 total E -8.37064E+01 rmsd from N 0.000 %NC 0.00 1
+ 118.290-161.337 146.504 -15.550
+ 117.578-108.173 144.812 -35.218
+ 91.326 58.748 134.008 113.471
+ 90.163 45.113 142.087 -95.092
+ 89.483 44.365 118.161 -90.607
+ 90.314 57.180 149.147 7.729
+ 90.350 41.765 137.257 164.479
+ 91.775 69.763 100.860-103.098
+ 92.344 -85.962 135.794-117.650
+ 94.350 166.995 0.000 0.000
+ 150.614 -39.605 0.000 0.000
+ 89.702 52.560 131.605-161.232
+ 90.120 49.493 109.679 -79.640
+ 93.605-106.868 110.214 -78.529
+ 96.585 142.254 0.000 0.000
+ 124.046 -82.831 132.523 -56.934
+ 118.046-109.974 118.708-125.697
+ 118.910-140.324 109.727-110.159
+ 93.221 71.451 102.522-103.323
+ 93.314 0.000 112.272 -78.417
+ # 12 total E -8.49507E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.895 123.668 145.574 -14.488
+ 112.209 178.104 149.267 -19.621
+ 123.036 -82.256 122.837-126.809
+ 90.614 65.598 147.079 -95.027
+ 89.652 41.487 98.754 -83.886
+ 89.836 60.689 124.760-128.590
+ 89.973 46.077 141.602 -46.354
+ 91.706 97.515 131.373-139.123
+ 91.686 -12.586 145.182-113.300
+ 103.758 -72.133 0.000 0.000
+ 99.376 -18.023 0.000 0.000
+ 93.528 95.682 99.353 -96.000
+ 117.974 132.123 121.383 -79.571
+ 94.836 -78.979 111.953 -79.344
+ 93.958 65.732 0.000 0.000
+ 133.094 -78.025 133.936-117.904
+ 119.814-107.799 114.041-119.052
+ 119.215-139.303 117.325-118.453
+ 93.179 78.574 102.529-111.031
+ 93.303 0.000 111.143 -78.372
+ # 13 total E -8.61962E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.874 120.821 147.156 -10.236
+ 91.299 84.402 124.145 -17.509
+ 90.909 48.166 94.047 -89.577
+ 90.378 42.993 150.530 -96.450
+ 90.245 45.374 116.856-125.734
+ 90.941 51.919 128.555 54.552
+ 89.945 52.198 132.345-150.179
+ 90.155 42.557 134.067-135.109
+ 92.070 168.023 141.057-123.531
+ 96.424 102.166 0.000 0.000
+ 137.342 -73.878 0.000 0.000
+ 123.841 -69.503 107.567-103.615
+ 89.992 82.396 124.036 157.194
+ 92.262 16.941 111.396 -78.839
+ 114.558 -27.351 0.000 0.000
+ 126.891 -82.665 153.950 -29.277
+ 119.419-113.260 109.547-111.270
+ 116.476-140.159 130.824-141.262
+ 114.633-117.619 141.823-155.715
+ 121.561 0.000 121.392 -80.514
+ # 14 total E -8.52436E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.883 122.050 146.930 -9.714
+ 91.321 87.283 128.797 -15.102
+ 90.790 47.492 95.638 -88.502
+ 89.923 44.077 147.152 -95.649
+ 90.435 43.596 122.415-126.954
+ 91.312 44.758 126.769 81.408
+ 90.694 48.305 129.499-153.869
+ 90.623 57.157 141.260-133.356
+ 90.961-156.897 143.160-147.317
+ 95.044 100.573 0.000 0.000
+ 93.496 44.007 0.000 0.000
+ 90.080 47.214 101.727 -65.158
+ 90.334 93.359 134.296-117.684
+ 94.558 -45.288 114.273 -80.404
+ 97.360 90.337 0.000 0.000
+ 127.981 -82.262 124.882-123.972
+ 119.686-109.495 122.237-131.321
+ 113.511-116.064 97.529 -85.226
+ 92.853 69.967 102.152-107.744
+ 93.411 0.000 123.667-133.604
+ # 15 total E -8.51081E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.959 109.532 139.719 -15.705
+ 93.194 102.217 146.898 -28.249
+ 125.593-111.237 95.667 -96.037
+ 92.779 61.075 146.810-116.795
+ 90.788 32.217 108.131 -39.468
+ 91.719 57.909 149.443 105.126
+ 90.797 70.613 153.900-171.075
+ 89.344 89.778 125.294-118.928
+ 92.392 -44.745 106.981 -95.044
+ 97.569 83.923 0.000 0.000
+ 133.198 -56.072 0.000 0.000
+ 134.042 166.838 99.544 -86.068
+ 129.414 161.049 121.452 -80.654
+ 118.396 -80.302 113.013 -79.220
+ 94.470 61.178 0.000 0.000
+ 124.669 -78.877 84.317 -66.290
+ 116.276-110.084 118.558-125.414
+ 120.845-141.437 110.585-109.005
+ 92.586 96.550 103.073-110.540
+ 93.342 0.000 111.377-110.157
+ # 16 total E -8.64422E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.857 102.597 146.716 -11.570
+ 91.514 76.925 142.818 -32.151
+ 91.716 43.960 167.472 14.798
+ 90.699 48.451 138.747 -80.886
+ 89.842 43.372 115.481-127.593
+ 89.927 53.804 121.638 -72.050
+ 89.715 53.754 146.798 175.612
+ 90.159 68.109 135.148-133.759
+ 91.755-149.096 140.207-127.626
+ 95.481 74.219 0.000 0.000
+ 92.749 45.421 0.000 0.000
+ 89.940 58.147 83.973 -89.577
+ 90.399 156.129 113.685 -76.057
+ 92.348 -62.502 117.298-161.159
+ 94.989 64.761 0.000 0.000
+ 132.839 -98.723 66.683 -80.440
+ 120.659-160.263 111.171-113.561
+ 116.463-169.199 114.799-118.079
+ 93.807 35.473 101.188 -96.405
+ 93.379 0.000 116.051 -78.691
+ # 17 total E -8.59539E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.820 104.433 146.539 -22.230
+ 93.178 114.369 143.882 -27.965
+ 128.961 -98.599 92.548 -95.293
+ 91.430 62.844 145.211-110.755
+ 89.986 40.947 117.934 -99.447
+ 90.059 61.569 127.344 37.158
+ 89.585 42.015 142.583-161.067
+ 91.335 65.440 128.133-138.078
+ 91.140 -63.655 142.067-136.611
+ 113.556-174.360 0.000 0.000
+ 92.942 49.676 0.000 0.000
+ 89.416 55.459 96.975 -97.350
+ 88.861 37.180 112.091 -80.002
+ 93.893-131.376 108.557 -73.385
+ 94.339 152.302 0.000 0.000
+ 134.378-107.166 145.199 -76.307
+ 119.005-110.472 114.401-120.098
+ 121.673-162.868 115.199-115.147
+ 93.850 50.256 98.597 -99.695
+ 93.409 0.000 130.714-136.207
+ # 18 total E -8.45210E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.953 127.191 144.969 -1.089
+ 91.167 86.647 130.454 -2.872
+ 89.814 51.649 100.272 -86.348
+ 90.195 44.262 159.196 -98.332
+ 90.282 42.493 127.898-133.920
+ 92.095 55.901 126.800 92.808
+ 91.791 176.571 137.226-138.467
+ 93.399 100.005 129.314-115.182
+ 120.345-113.776 110.476 -81.914
+ 95.981 77.603 0.000 0.000
+ 93.519 45.885 0.000 0.000
+ 90.425 60.157 88.620 -86.690
+ 90.373 139.876 113.694 -77.491
+ 91.776 -72.920 115.687-150.684
+ 94.486 52.111 0.000 0.000
+ 129.378 -97.473 110.923 -52.863
+ 117.196-111.000 116.391-121.205
+ 117.284-119.430 116.366-116.842
+ 93.277 86.087 132.259-155.901
+ 93.206 0.000 107.610 -76.511
+ # 19 total E -8.61206E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.898 123.071 146.459 -8.052
+ 91.257 86.247 126.609 -15.821
+ 90.816 47.288 97.119 -90.113
+ 89.868 44.624 150.273 -97.572
+ 90.350 45.515 122.731-125.381
+ 91.480 46.071 124.856 68.781
+ 91.064 43.687 127.436-144.731
+ 91.771 48.766 137.212-133.376
+ 93.023-142.626 136.256-127.949
+ 128.925 -71.833 0.000 0.000
+ 107.791 -17.034 0.000 0.000
+ 91.825 87.093 100.956 -96.613
+ 91.338 14.445 109.293 -77.127
+ 95.538-125.737 106.249 -76.511
+ 94.776 146.046 0.000 0.000
+ 126.530 -82.524 154.949 -18.589
+ 117.771-108.928 112.437-116.521
+ 119.258-139.831 111.768-112.072
+ 116.714-118.093 130.733-141.216
+ 121.730 0.000 121.490 -80.782
+ # 20 total E -8.63547E+01 rmsd from N 0.000 %NC 0.00 1
+ 117.661-172.276 145.473 -17.583
+ 117.422-109.496 147.783 -37.913
+ 91.420 54.836 131.249 95.347
+ 90.722 41.093 146.410 -93.652
+ 90.675 48.516 123.271-123.577
+ 91.523 47.830 135.391 34.031
+ 91.011 39.280 141.615-113.785
+ 92.487 58.276 130.747-131.573
+ 93.095 -76.040 134.179-137.607
+ 126.707 -66.732 0.000 0.000
+ 136.309 -31.927 0.000 0.000
+ 107.805 -31.703 91.131 -79.308
+ 91.158 95.913 114.031 -75.218
+ 92.697 7.197 103.021 -80.950
+ 123.434 -10.079 0.000 0.000
+ 122.001 -67.929 115.460 -61.290
+ 118.810-138.300 108.440-108.331
+ 126.303-169.905 120.350-121.900
+ 93.332 56.964 93.798 -94.616
+ 93.341 0.000 112.040 -80.041
+ # 21 total E -8.59369E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.848 109.625 147.243 -13.346
+ 91.654 82.672 132.367 -21.970
+ 93.047 37.996 174.353 177.918
+ 90.948 52.415 131.914 -82.427
+ 89.603 47.506 117.017-130.821
+ 89.436 54.674 111.613 -56.948
+ 89.868 42.952 154.044-173.639
+ 92.704 69.222 129.596-135.205
+ 91.791 -58.793 151.529-130.368
+ 109.995 -68.968 0.000 0.000
+ 102.409 -26.438 0.000 0.000
+ 93.132 104.760 135.531-161.843
+ 94.002 78.711 113.220 -77.149
+ 94.285 -89.174 110.519 -76.410
+ 93.200 163.412 0.000 0.000
+ 141.506 -92.841 72.488 -68.762
+ 114.435-103.235 117.713-129.123
+ 120.513-141.428 106.870-103.901
+ 116.737-118.907 131.172-143.857
+ 121.820 0.000 121.697 -80.854
+ # 22 total E -8.68956E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.979 115.212 140.619 -8.075
+ 91.572 78.292 143.327 -17.987
+ 89.764 52.198 112.994 -68.621
+ 89.868 38.660 163.550-148.364
+ 89.506 49.015 114.211 -22.560
+ 89.399 53.284 137.279 89.834
+ 89.958 56.059 139.749-121.695
+ 91.091 65.921 130.449-135.485
+ 92.653 -99.175 147.334-157.131
+ 142.007 -76.252 0.000 0.000
+ 93.668 44.200 0.000 0.000
+ 91.992 55.713 97.251 -96.767
+ 93.025 -60.356 112.255 -72.986
+ 129.702-158.464 124.373 -81.182
+ 119.374 164.538 0.000 0.000
+ 127.014 -83.118 116.382-128.382
+ 118.642-110.413 114.745-119.950
+ 119.364-139.567 110.879-110.475
+ 93.164 76.853 104.021-113.698
+ 93.304 0.000 111.645 -78.204
+ # 23 total E -8.66679E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.971 121.646 142.995 -8.512
+ 91.591 89.447 139.002 -15.870
+ 91.192 44.779 140.001 112.131
+ 90.529 46.423 144.078 -93.172
+ 89.748 47.941 122.980-128.489
+ 89.976 42.962 151.719 -27.151
+ 90.405 54.839 136.223-150.218
+ 90.726 43.143 125.385-103.749
+ 91.234-116.725 101.957 -81.557
+ 93.848 153.226 0.000 0.000
+ 92.910 46.664 0.000 0.000
+ 89.702 48.391 125.633-148.767
+ 90.738 53.979 111.923 -76.833
+ 93.177-113.394 111.737 -76.793
+ 95.061 154.472 0.000 0.000
+ 126.044 -84.231 136.627 -61.123
+ 117.399-111.561 115.310-121.696
+ 118.946-162.011 111.512-112.694
+ 93.293 72.257 101.314-106.832
+ 93.416 0.000 124.566-136.341
+ # 24 total E -9.07614E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.954 125.226 144.117 -4.171
+ 91.301 86.551 128.224 -22.545
+ 91.425 44.851 126.145 93.962
+ 90.397 45.103 149.883 -93.022
+ 90.336 45.461 117.915-125.861
+ 91.588 49.328 134.193 29.824
+ 90.985 38.452 142.868-108.960
+ 92.506 59.038 132.639-132.987
+ 92.889 -71.960 135.325-141.960
+ 126.946 -68.369 0.000 0.000
+ 136.328 -32.214 0.000 0.000
+ 107.422 -31.464 90.962 -80.483
+ 91.370 96.173 112.965 -74.544
+ 92.311 9.814 104.566 -80.295
+ 124.422 -8.787 0.000 0.000
+ 127.393 -66.660 117.710 -65.682
+ 109.608-164.060 95.932 -90.230
+ 129.298-142.739 111.611-109.082
+ 92.417 85.253 95.798 -99.108
+ 93.306 0.000 107.012 -81.019
+ # 25 total E -8.76398E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.796 113.543 147.996 -23.951
+ 114.224 173.463 143.452 -32.067
+ 119.432 165.476 103.125 -76.377
+ 91.030 54.170 132.973-112.628
+ 89.723 48.840 89.127 -69.534
+ 90.336 68.341 154.736 -93.286
+ 90.302 49.575 144.679 -48.297
+ 91.407 99.289 107.656-123.032
+ 91.651 -26.784 144.221-125.422
+ 102.074 -72.110 0.000 0.000
+ 98.697 -23.154 0.000 0.000
+ 93.613 104.815 133.774-157.428
+ 93.874 111.698 118.455 -75.336
+ 125.521 -99.197 117.118 -88.846
+ 96.154 63.126 0.000 0.000
+ 129.990 -78.036 151.785 -14.287
+ 115.115-112.324 91.363 -88.129
+ 117.898-145.786 117.673-120.859
+ 93.529 65.175 128.875-152.569
+ 93.335 0.000 111.119 -80.300
+ # 26 total E -8.64394E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.813 77.555 147.303 -20.785
+ 91.893 82.737 152.028-138.335
+ 90.234 85.262 128.963 -40.604
+ 89.501 61.229 136.409-101.428
+ 89.638 43.901 98.370 -99.837
+ 90.415 60.153 146.523 35.995
+ 90.134 61.053 138.122 -51.356
+ 90.561 106.686 130.283-141.555
+ 91.166 -21.269 144.934 -47.496
+ 100.268 -73.700 0.000 0.000
+ 99.253 -21.311 0.000 0.000
+ 93.218 102.143 133.423-156.326
+ 93.847 120.410 119.112 -75.154
+ 121.598 -95.001 117.213 -87.529
+ 95.544 52.727 0.000 0.000
+ 129.973 -81.432 93.752 -79.127
+ 118.345-114.254 112.755-117.103
+ 122.434-144.749 114.740-114.370
+ 92.528 77.221 100.732 -97.401
+ 93.325 0.000 108.834 -80.935
+ # 27 total E -8.43986E+01 rmsd from N 0.000 %NC 0.00 1
+ 94.008 120.465 140.440 10.548
+ 92.140 154.481 144.746 -31.568
+ 91.793 99.781 140.938-107.331
+ 90.872 50.122 130.488 -83.416
+ 88.866 48.803 134.382-140.749
+ 88.351 56.724 91.246-144.787
+ 89.050 59.420 147.303 -33.884
+ 88.754 33.340 130.252-140.624
+ 91.562-118.445 102.855 -76.968
+ 94.991 128.097 0.000 0.000
+ 95.150 40.680 0.000 0.000
+ 91.077 66.852 108.677-104.516
+ 89.307 108.432 121.349-126.386
+ 92.648 -56.896 109.597-136.709
+ 96.207 89.211 0.000 0.000
+ 134.051 -84.495 114.798 -61.579
+ 126.013-162.289 113.343-112.700
+ 120.349-129.432 125.601-129.550
+ 93.803 55.021 92.068 -89.026
+ 93.364 0.000 113.405 -79.896
+ # 28 total E -8.61493E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.706 90.844 151.163 -29.594
+ 92.962 125.351 144.622 -34.058
+ 125.737-100.584 93.117-100.918
+ 91.668 60.926 144.607-104.366
+ 89.960 43.183 113.931 -60.615
+ 90.272 50.931 116.827 -42.034
+ 90.372 51.681 149.148-132.850
+ 90.748 44.333 87.718 -65.817
+ 92.549-113.475 107.817 -81.600
+ 94.592 157.723 0.000 0.000
+ 128.206 -41.079 0.000 0.000
+ 113.070-172.235 125.341-134.265
+ 94.765 176.103 134.691 162.591
+ 127.323 -49.846 125.052-156.499
+ 96.332 87.500 0.000 0.000
+ 126.598 -86.962 99.814-107.899
+ 119.926-110.740 114.954-119.975
+ 117.079-148.067 114.688-117.168
+ 93.707 61.946 94.501 -97.451
+ 93.408 0.000 128.609-134.008
+ # 29 total E -8.57427E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.935 124.681 144.506 -10.110
+ 109.881 171.332 143.261 -29.604
+ 118.124 167.671 102.137 -74.412
+ 90.735 67.204 129.329-113.339
+ 89.890 56.656 123.032-126.095
+ 89.776 62.046 117.064 4.121
+ 90.391 28.430 148.340-134.407
+ 93.140 68.876 132.207-135.024
+ 92.874 -39.553 137.010-115.338
+ 126.315 -87.254 0.000 0.000
+ 142.399 -28.355 0.000 0.000
+ 107.439 -23.798 95.345 -88.007
+ 91.668 96.596 121.895 152.159
+ 91.553 0.621 106.035 -78.005
+ 115.036 -17.096 0.000 0.000
+ 131.499 -74.202 139.985 -71.357
+ 119.462-117.746 108.701-109.607
+ 119.795-165.534 125.091-131.017
+ 93.439 58.070 103.735 -97.921
+ 93.340 0.000 112.883 -79.222
+ # 30 total E -8.62317E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.880 115.627 146.040 -11.383
+ 91.511 81.220 135.017 -26.610
+ 91.670 41.766 130.617 111.411
+ 90.653 45.837 144.373 -90.546
+ 89.913 43.106 118.160-123.590
+ 90.655 54.852 124.272 27.014
+ 90.392 36.677 148.030-174.179
+ 92.013 62.162 128.613-131.629
+ 92.467 -56.715 131.868-126.843
+ 125.513 -53.187 0.000 0.000
+ 121.100 -16.521 0.000 0.000
+ 112.435-149.437 90.253 -70.281
+ 92.440 99.553 138.876 -50.595
+ 94.059 26.162 113.688 -76.537
+ 96.412 61.862 0.000 0.000
+ 121.755 -83.589 108.576 -53.057
+ 115.056-105.666 123.163-132.293
+ 118.820-144.186 108.468-107.002
+ 93.266 47.931 102.081-114.953
+ 93.372 0.000 113.626 -80.224
+ # 31 total E -8.37314E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.846 108.752 147.798 -11.677
+ 91.501 76.992 138.489 -41.269
+ 92.748 40.151 176.461-174.611
+ 92.270 57.746 139.656 -88.455
+ 91.162 34.564 119.154-133.059
+ 91.954 60.157 107.972 -80.653
+ 90.339 49.288 143.858-173.076
+ 91.315 75.931 134.754-129.485
+ 91.475 -78.349 104.775 -73.670
+ 95.736 168.567 0.000 0.000
+ 137.459 -60.004 0.000 0.000
+ 131.202 159.640 102.172 -92.917
+ 93.714 97.544 114.774 -76.513
+ 94.749 -17.350 114.331 -77.384
+ 127.949 -31.111 0.000 0.000
+ 125.151 -83.731 104.898 -54.993
+ 116.557-107.382 116.980-121.984
+ 117.514-142.774 110.847-112.668
+ 93.549 82.194 106.390-106.906
+ 93.289 0.000 112.647 -76.536
+ # 32 total E -8.62107E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.998 125.263 141.615 -3.521
+ 91.458 91.404 135.707 -13.205
+ 90.130 50.606 129.866 108.321
+ 89.714 42.637 149.129 -94.492
+ 89.729 49.829 123.954-132.365
+ 90.409 45.971 125.297 18.975
+ 90.390 51.686 136.521-127.512
+ 90.753 44.010 136.332-134.197
+ 92.403-159.045 113.041 -85.097
+ 95.141 70.430 0.000 0.000
+ 121.029 -72.548 0.000 0.000
+ 115.646 144.526 129.784-139.671
+ 94.144 74.966 108.783 -76.737
+ 138.928-113.050 123.718 -86.121
+ 94.676 73.078 0.000 0.000
+ 125.796 -70.065 116.014-107.112
+ 116.706-107.681 118.830-127.521
+ 121.431-145.495 108.273-105.902
+ 92.519 57.802 102.778-114.190
+ 93.362 0.000 108.440 -83.496
+ # 33 total E -8.62294E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.951 124.326 143.876 -5.723
+ 91.476 89.515 132.076 -19.674
+ 91.771 46.747 128.668 84.715
+ 89.692 45.361 145.253 -94.798
+ 89.726 53.684 119.709-127.543
+ 90.179 59.903 116.992 22.694
+ 89.896 34.096 147.295-134.438
+ 92.897 75.791 130.986-134.761
+ 92.868 -49.944 141.605-126.928
+ 119.740 -72.082 0.000 0.000
+ 120.747 -69.240 0.000 0.000
+ 93.276 58.860 135.567-164.830
+ 95.241 57.804 112.634 -75.820
+ 95.282 -10.137 143.295 -57.500
+ 139.692 -21.560 0.000 0.000
+ 133.179 -69.416 129.550 -67.587
+ 118.887-107.244 117.933-124.203
+ 123.308-146.806 106.799-104.258
+ 92.839 65.222 97.600-104.090
+ 93.342 0.000 109.510 -81.722
+ # 34 total E -8.53515E+01 rmsd from N 0.000 %NC 0.00 1
+ 119.864-104.474 104.477 -73.602
+ 113.912-110.774 142.341 -35.519
+ 91.406 61.594 128.343 111.029
+ 90.138 43.542 146.977 -95.678
+ 90.136 47.469 120.643-113.835
+ 90.872 47.143 137.754 26.129
+ 90.617 45.104 136.385-141.886
+ 91.678 66.723 134.501-133.275
+ 91.635 -79.588 132.127-131.354
+ 122.149 -89.802 0.000 0.000
+ 119.321 -38.396 0.000 0.000
+ 92.858 73.126 135.350-161.639
+ 92.960 92.184 112.144 -76.367
+ 129.123-105.083 118.648 -85.363
+ 94.896 77.359 0.000 0.000
+ 130.771 -62.545 146.403 -58.342
+ 117.580-106.495 108.457-111.913
+ 121.627-144.872 115.155-114.924
+ 93.117 63.099 102.245-114.124
+ 93.341 0.000 111.581 -80.103
+ # 35 total E -8.62363E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.857 91.617 145.834 -15.505
+ 91.835 89.636 136.525 -18.213
+ 90.375 50.003 106.996 -76.269
+ 90.395 39.273 168.848-137.608
+ 90.202 46.285 128.938-112.560
+ 91.096 45.836 136.090 84.443
+ 90.943 45.446 133.233-111.193
+ 91.462 47.504 139.630-142.504
+ 93.210-169.678 146.769 -21.043
+ 93.984 135.587 0.000 0.000
+ 130.730 -37.289 0.000 0.000
+ 93.654 84.035 98.879-100.476
+ 126.051-107.370 121.072 -77.053
+ 128.355 -85.614 121.689 -80.185
+ 119.731-173.408 0.000 0.000
+ 129.115 -84.386 113.721-125.380
+ 119.552-109.125 116.859-122.445
+ 118.892-137.968 110.583-110.105
+ 93.185 83.247 105.807-114.856
+ 93.285 0.000 111.023 -77.438
+ # 36 total E -8.82155E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.893 121.676 146.288 -9.589
+ 91.312 86.598 128.216 -13.784
+ 90.560 49.253 95.647 -90.393
+ 89.743 44.143 150.273 -96.920
+ 89.909 46.458 121.446-127.631
+ 90.813 50.178 124.503 48.542
+ 90.034 46.027 127.721-154.448
+ 90.872 57.152 133.311-135.710
+ 92.002 170.640 140.869-122.160
+ 95.418 103.463 0.000 0.000
+ 125.937 -51.261 0.000 0.000
+ 110.438 173.432 132.091-145.769
+ 121.561 177.417 119.051 -80.685
+ 94.646 30.656 115.909 -76.364
+ 96.371 70.306 0.000 0.000
+ 123.068 -79.000 146.904 -94.639
+ 118.529-111.540 108.932-111.227
+ 118.358-143.350 115.929-118.114
+ 93.529 74.585 133.452-159.000
+ 93.305 0.000 113.149 -77.299
+ # 37 total E -8.66981E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.762 106.272 150.735 -20.794
+ 93.104 126.658 139.362 -30.883
+ 124.821 -95.707 93.202 -94.342
+ 91.393 55.713 144.424-109.867
+ 89.938 42.645 121.311 -83.615
+ 90.247 55.016 118.065 -28.598
+ 89.921 47.928 154.308-118.267
+ 90.904 60.084 83.225 -67.556
+ 91.959-109.207 113.052 -80.344
+ 95.748 157.073 0.000 0.000
+ 130.541 -67.859 0.000 0.000
+ 110.833 148.652 129.778-142.457
+ 92.930 103.813 138.113-168.915
+ 94.585 29.570 114.119 -77.825
+ 97.034 66.848 0.000 0.000
+ 128.851-105.962 140.669-122.501
+ 118.159-109.059 117.121-123.954
+ 117.239-148.458 112.145-113.422
+ 93.819 51.041 100.676-105.681
+ 93.416 0.000 128.399-144.273
+ # 38 total E -8.72171E+01 rmsd from N 0.000 %NC 0.00 1
+ 94.001 128.321 142.765 1.864
+ 91.339 90.290 135.081 -14.242
+ 89.891 51.176 104.040 -79.096
+ 90.058 41.196 155.301-101.821
+ 90.407 41.846 126.083-124.781
+ 91.305 49.386 130.567 96.934
+ 90.586 69.539 139.256-130.863
+ 89.893 92.457 131.044-116.233
+ 92.140 -45.284 106.095 -87.565
+ 97.079 82.069 0.000 0.000
+ 132.766 -59.275 0.000 0.000
+ 136.704 162.199 96.428 -80.276
+ 126.181 173.873 122.917 -78.649
+ 118.816 -74.655 117.382 -79.601
+ 95.265 59.563 0.000 0.000
+ 125.529 -81.953 148.139 -39.824
+ 120.845-166.554 112.058-115.094
+ 120.321-162.305 115.985-114.458
+ 93.321 98.289 103.719-104.096
+ 93.293 0.000 109.473 -77.457
+ # 39 total E -8.37159E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.889 119.345 146.036 -10.398
+ 91.562 82.840 137.222 -27.813
+ 91.527 46.293 132.570 113.911
+ 91.177 42.403 149.137 -97.664
+ 90.322 47.951 119.174-114.579
+ 91.132 42.705 157.213 -6.798
+ 90.782 61.309 134.812-118.834
+ 90.782 35.044 124.075-105.839
+ 92.762-120.772 94.759 -82.736
+ 93.131 152.612 0.000 0.000
+ 93.069 53.275 0.000 0.000
+ 89.272 43.271 108.834-118.694
+ 91.253 54.797 108.573 -78.240
+ 95.358 -49.305 117.554 -76.372
+ 137.263 -16.168 0.000 0.000
+ 134.009 -83.461 92.437 -63.142
+ 117.640-109.296 117.102-123.623
+ 121.219-137.618 107.313-103.825
+ 92.452 91.292 104.162-112.646
+ 93.246 0.000 107.611 -77.647
+ # 40 total E -9.03375E+01 rmsd from N 0.000 %NC 0.00 1
+ 115.829 -50.889 110.339 -82.046
+ 91.789 80.805 132.645 -28.639
+ 91.977 42.237 99.992 -82.546
+ 91.072 43.930 147.085 -94.071
+ 90.179 42.542 117.753-118.615
+ 90.776 49.703 163.238 36.050
+ 90.607 46.296 133.272-167.349
+ 92.044 75.509 136.221-130.407
+ 90.252 -65.111 132.343-135.801
+ 102.209 -65.611 0.000 0.000
+ 97.978 -33.380 0.000 0.000
+ 92.855 104.739 140.375-169.682
+ 94.441 103.959 113.281 -77.217
+ 121.991 -96.530 118.692 -77.573
+ 94.678 79.454 0.000 0.000
+ 130.376 -69.142 126.610 -88.898
+ 118.887-109.939 107.334-110.730
+ 118.109-160.511 112.245-114.143
+ 93.732 57.949 103.340-113.714
+ 93.417 0.000 125.573-142.713
+ # 41 total E -8.73809E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.898 120.518 145.604 -10.702
+ 91.523 88.209 132.106 -16.465
+ 90.440 49.166 91.885 -84.250
+ 89.886 43.007 148.211 -97.039
+ 90.395 44.911 121.351-127.179
+ 91.089 47.117 150.137 40.606
+ 90.726 43.827 131.356-145.875
+ 92.164 70.690 136.126-134.791
+ 90.853 -67.216 137.666-114.958
+ 111.042 -62.759 0.000 0.000
+ 116.300 -60.789 0.000 0.000
+ 92.710 66.430 135.045-161.942
+ 93.066 96.022 113.387 -76.399
+ 93.587 -36.997 111.018 -80.866
+ 114.997 -24.401 0.000 0.000
+ 125.841 -84.773 79.669 -67.252
+ 117.080-111.192 118.051-124.334
+ 120.614-107.357 114.539-111.383
+ 92.932 79.797 92.291-103.345
+ 93.237 0.000 106.924 -78.667
+ # 42 total E -8.56434E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.705 33.886 108.026 -81.090
+ 92.849 163.363 140.949 -19.080
+ 91.497 80.745 142.207 95.533
+ 90.944 40.553 150.689 -96.526
+ 90.007 49.516 127.359 -60.563
+ 90.996 51.978 129.011 35.504
+ 90.405 40.867 138.949-134.641
+ 91.923 61.511 127.710-132.786
+ 92.111 -70.951 131.837-132.793
+ 118.705 -60.816 0.000 0.000
+ 129.077 -44.932 0.000 0.000
+ 104.792 -31.169 93.431 -86.838
+ 91.624 99.180 122.340 142.828
+ 92.361 9.589 107.933 -79.652
+ 118.326 -7.429 0.000 0.000
+ 129.293 -76.653 96.448 -56.950
+ 117.197-105.071 124.519-131.343
+ 119.437-111.191 109.365-109.132
+ 117.966-118.961 115.747-121.489
+ 121.952 0.000 121.546 -81.211
+ # 43 total E -8.68702E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.879 121.836 147.046 -10.353
+ 91.278 90.015 128.837 -9.684
+ 90.698 48.248 97.358 -90.005
+ 88.335 49.039 142.643 -95.840
+ 88.797 57.443 125.954-141.500
+ 89.102 49.789 116.187 51.825
+ 90.094 45.338 140.471 -89.840
+ 91.753 64.526 127.847-137.028
+ 93.072-165.064 142.578-141.636
+ 138.051 -55.339 0.000 0.000
+ 94.017 48.135 0.000 0.000
+ 92.086 52.925 96.011 -96.038
+ 93.624 -61.935 109.494 -77.090
+ 122.818-100.826 118.557 -79.664
+ 115.969 170.362 0.000 0.000
+ 129.792-104.609 114.996 -49.470
+ 115.901-109.286 120.015-127.789
+ 120.727-152.100 111.041-109.985
+ 93.133 56.108 101.807-105.465
+ 93.352 0.000 111.350 -80.973
+ # 44 total E -8.75454E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.855 113.203 145.230 -14.656
+ 91.719 89.291 136.959 -12.075
+ 91.524 44.020 176.063 173.500
+ 89.289 47.372 133.118 -84.344
+ 88.905 51.080 119.269-136.192
+ 88.432 52.328 117.008 -46.766
+ 89.620 44.101 158.330-171.107
+ 92.075 71.509 127.991-135.529
+ 91.153 -57.364 145.026-122.566
+ 110.095 -70.280 0.000 0.000
+ 102.230 -24.296 0.000 0.000
+ 93.142 105.315 135.764-161.036
+ 93.592 91.040 114.342 -76.431
+ 94.875 -95.180 116.268 -72.354
+ 95.022 114.494 0.000 0.000
+ 131.940 -75.841 154.612 -16.292
+ 119.183-106.938 105.009-104.012
+ 118.652-138.345 108.752-108.387
+ 93.733 77.975 124.405-146.970
+ 93.314 0.000 111.814 -78.084
+ # 45 total E -8.56921E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.899 122.696 146.282 -8.542
+ 91.249 88.708 130.281 -6.081
+ 90.068 51.218 96.724 -88.866
+ 89.315 44.177 149.904-100.292
+ 90.081 44.975 126.871-135.649
+ 90.721 51.101 128.141 74.614
+ 90.710 38.290 134.616-145.044
+ 92.730 64.553 130.731-134.350
+ 92.475 -43.776 142.915-149.617
+ 116.571-156.035 0.000 0.000
+ 92.937 46.052 0.000 0.000
+ 89.791 48.845 97.780 -97.378
+ 89.650 45.372 112.644 -78.727
+ 93.545-172.202 116.129 -78.344
+ 94.648 120.950 0.000 0.000
+ 127.684 -80.342 115.410 -98.733
+ 118.148-108.271 116.945-123.906
+ 119.431-141.199 111.192-110.730
+ 93.226 72.826 103.365-113.231
+ 93.312 0.000 112.463 -78.141
+ # 46 total E -8.68119E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.895 121.881 146.236 -9.380
+ 91.319 86.744 128.446 -14.539
+ 90.593 48.930 95.963 -90.455
+ 89.721 44.179 149.982 -96.628
+ 89.893 46.518 121.451-127.483
+ 90.782 49.870 123.663 50.046
+ 90.057 46.580 127.718-155.094
+ 90.879 56.978 133.757-135.688
+ 91.970 169.542 141.697-123.394
+ 95.459 104.145 0.000 0.000
+ 124.969 -51.122 0.000 0.000
+ 110.185 172.632 132.141-145.985
+ 121.203 177.524 119.579 -79.927
+ 94.521 31.766 115.891 -76.354
+ 96.431 71.500 0.000 0.000
+ 124.278 -80.753 149.849 -96.911
+ 118.918-112.454 108.285-110.450
+ 118.833-142.310 112.797-114.083
+ 116.024-118.315 134.739-147.966
+ 121.710 0.000 121.568 -80.707
+ # 47 total E -8.78005E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.841 119.047 148.369 -13.733
+ 91.422 89.552 130.868 -10.770
+ 91.600 39.455 90.599 -81.314
+ 90.357 54.549 130.669 -82.400
+ 88.987 52.039 125.408-139.698
+ 88.838 48.503 111.448 -45.234
+ 89.817 47.501 165.791-154.072
+ 90.242 52.390 133.649-134.689
+ 91.666-175.132 137.614-123.670
+ 94.795 70.833 0.000 0.000
+ 93.418 44.184 0.000 0.000
+ 89.703 49.272 96.332 -80.787
+ 89.961 77.330 117.398 -79.391
+ 92.967 24.137 113.173 -78.331
+ 96.696 65.718 0.000 0.000
+ 128.244 -89.699 131.208 -87.182
+ 117.762-108.211 119.773-127.564
+ 118.149-144.770 110.707-111.377
+ 93.232 59.387 102.737-103.232
+ 93.343 0.000 112.280 -79.911
+ # 48 total E -8.76999E+01 rmsd from N 0.000 %NC 0.00 1
+ 118.691 -89.252 110.039 -80.098
+ 112.145-167.168 153.295 -15.898
+ 93.557 68.973 139.713 116.130
+ 90.215 47.367 146.790 -96.075
+ 89.607 45.910 116.434 -74.996
+ 90.622 51.187 157.535 -10.051
+ 90.595 41.224 133.572-167.562
+ 91.892 72.519 102.280 -97.704
+ 90.953 -60.455 130.600-136.470
+ 108.952 -69.937 0.000 0.000
+ 101.372 -26.246 0.000 0.000
+ 93.101 100.133 137.536-164.084
+ 93.144 104.357 115.168 -78.645
+ 125.856 -88.196 131.443-155.545
+ 95.579 77.340 0.000 0.000
+ 125.794 -76.601 135.821 -87.823
+ 120.286-112.145 112.045-116.974
+ 119.373-135.065 109.832-109.922
+ 118.304-118.703 119.470-123.466
+ 121.891 0.000 121.549 -81.072
+ # 49 total E -8.37705E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.948 108.646 141.660 -9.876
+ 91.745 81.152 141.362 -14.151
+ 90.108 48.764 112.200 -70.338
+ 89.566 41.580 151.186-109.619
+ 90.061 49.449 121.812-123.337
+ 91.358 70.868 118.305 50.193
+ 90.885 78.079 146.108-142.266
+ 95.462-114.135 93.294-102.329
+ 128.177 175.700 150.218 1.029
+ 133.253 -65.889 0.000 0.000
+ 93.655 41.583 0.000 0.000
+ 101.038-142.885 86.326 -73.862
+ 117.353 175.149 120.765 -79.461
+ 120.928-165.967 120.866 -78.566
+ 120.087 166.299 0.000 0.000
+ 126.214 -87.802 111.806-126.900
+ 119.034-110.920 114.275-118.841
+ 118.759-141.426 113.069-113.817
+ 93.167 72.335 104.763-113.535
+ 93.316 0.000 111.998 -78.620
+ # 50 total E -8.51112E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.895 122.231 146.358 -9.124
+ 91.388 87.442 130.074 -15.109
+ 90.493 49.615 95.386 -87.516
+ 89.942 42.876 149.924 -98.379
+ 90.397 44.925 126.839-119.025
+ 90.615 51.052 149.724 44.629
+ 90.523 40.089 133.301-149.722
+ 92.146 92.070 131.445-136.213
+ 91.739 -16.117 145.870 -42.216
+ 105.068 -73.121 0.000 0.000
+ 94.841 -13.262 0.000 0.000
+ 95.357 159.317 98.221 -95.891
+ 94.361 149.059 109.855 -80.508
+ 92.542 43.864 115.944 -77.647
+ 95.179 80.118 0.000 0.000
+ 110.566 -65.479 122.626 -56.691
+ 119.477-108.317 118.553-124.078
+ 119.438-135.266 111.909-112.135
+ 93.520 56.212 95.096-103.228
+ 93.342 0.000 114.558 -78.396
+ # 51 total E -8.68763E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.695 96.048 153.568 -25.164
+ 92.930 136.981 145.358 -25.029
+ 125.142 -90.958 90.092-102.489
+ 91.354 55.856 148.014-109.756
+ 89.856 42.852 111.189 -33.048
+ 90.752 46.721 163.523 114.732
+ 90.844 58.989 135.785 -56.858
+ 91.423 35.866 140.044-125.974
+ 93.048-114.936 105.243 -79.449
+ 93.347 150.619 0.000 0.000
+ 125.372 -22.136 0.000 0.000
+ 92.665 77.876 82.827 -86.715
+ 92.157 108.584 113.591 -76.917
+ 93.520 21.093 114.443 -78.741
+ 96.999 77.860 0.000 0.000
+ 128.662 -85.729 135.177 -98.295
+ 119.257-111.622 113.191-118.212
+ 118.803-146.747 113.264-114.511
+ 93.738 39.999 94.733 -98.990
+ 93.414 0.000 113.706 -81.685
+ # 52 total E -8.60856E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.807 115.922 149.528 -16.379
+ 93.046 112.704 138.357 -34.288
+ 133.122-107.606 96.125 -88.655
+ 92.891 69.748 132.763-123.010
+ 90.881 53.558 119.219 -23.240
+ 91.218 71.822 96.779 -64.292
+ 91.659 155.883 160.962-115.370
+ 92.148 93.835 130.846-125.268
+ 91.778 -68.566 104.335 -83.121
+ 94.673 165.089 0.000 0.000
+ 136.045 -53.208 0.000 0.000
+ 113.938 178.555 121.506-128.164
+ 93.964 113.365 114.688 -77.273
+ 114.788 -94.289 115.966 -80.121
+ 96.102 86.948 0.000 0.000
+ 132.530 -82.382 88.309 -64.037
+ 116.894-107.645 119.114-124.983
+ 120.812-117.737 111.018-109.956
+ 93.102 76.004 95.420-111.367
+ 93.286 0.000 109.635 -78.935
+ # 53 total E -8.50248E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.889 121.171 146.502 -9.910
+ 91.341 86.258 128.368 -14.903
+ 90.968 47.555 94.718 -89.383
+ 90.140 43.898 148.483 -95.782
+ 89.976 45.810 119.571-126.282
+ 90.659 52.132 131.779 46.450
+ 89.789 44.783 129.348-161.848
+ 90.614 57.350 131.421-134.669
+ 92.189 177.323 139.615-121.059
+ 95.854 150.526 0.000 0.000
+ 126.932 -32.374 0.000 0.000
+ 93.609 84.720 93.316 -86.094
+ 135.847-105.387 119.238 -77.609
+ 115.558 -59.094 116.436 -79.091
+ 95.049 72.540 0.000 0.000
+ 122.290 -94.060 74.264 -72.570
+ 122.749-165.213 126.500-133.695
+ 97.050-171.632 101.622 -92.512
+ 93.793 80.343 130.878-158.022
+ 93.314 0.000 113.185 -77.229
+ # 54 total E -8.42727E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.958 127.909 144.987 0.285
+ 91.399 87.448 137.923 -32.702
+ 91.891 44.588 118.861 101.591
+ 90.333 45.293 147.114 -93.351
+ 90.519 42.812 118.287-124.659
+ 92.496 97.297 155.458 114.270
+ 92.358 -54.566 144.051 -50.745
+ 92.948 93.853 126.682-108.734
+ 93.025 10.003 89.418 -94.888
+ 119.943-150.277 0.000 0.000
+ 134.844 -39.162 0.000 0.000
+ 105.265 -29.065 95.428 -84.086
+ 91.468 98.431 115.059 -76.049
+ 92.409 -1.074 108.498 -78.722
+ 117.771 -24.447 0.000 0.000
+ 125.009 -81.847 96.182-114.118
+ 118.820-116.536 112.783-116.424
+ 118.322-162.014 120.993-125.345
+ 93.210 62.640 103.809-100.625
+ 93.335 0.000 111.841 -79.850
+ # 55 total E -8.54389E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.712 47.568 108.980 -80.546
+ 93.133 168.290 139.675 -37.639
+ 105.224 172.189 116.526 -75.493
+ 91.955 62.570 140.735-106.526
+ 90.126 41.953 115.847-111.808
+ 91.819 54.026 133.508 34.840
+ 90.660 37.077 144.970-123.734
+ 92.251 62.618 130.681-134.330
+ 91.873 -72.616 130.614-130.888
+ 119.325 -66.575 0.000 0.000
+ 130.317 -43.136 0.000 0.000
+ 105.883 -27.956 92.220 -83.249
+ 91.620 97.780 133.033 137.913
+ 91.841 5.667 106.546 -79.120
+ 119.705 -12.891 0.000 0.000
+ 126.351 -76.948 98.419 -58.510
+ 116.400-105.254 118.431-122.565
+ 118.475-138.207 137.764-147.934
+ 93.382 69.209 95.287-104.066
+ 93.409 0.000 126.878-130.758
+ # 56 total E -8.55081E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.892 123.281 145.115 -16.794
+ 122.130 178.110 160.550 -9.996
+ 93.108 77.065 153.157 107.323
+ 91.045 44.341 146.821 -92.360
+ 89.591 47.211 129.842 -92.102
+ 90.608 54.526 128.659 30.141
+ 90.250 36.740 139.907-170.299
+ 92.113 59.960 127.482-132.164
+ 92.392 -61.107 134.815-112.019
+ 123.459 -56.676 0.000 0.000
+ 120.933 -17.473 0.000 0.000
+ 112.842-142.115 92.609 -81.805
+ 128.026-146.235 116.106 -78.250
+ 93.981 38.993 115.805 -76.394
+ 95.783 61.270 0.000 0.000
+ 111.892 -72.235 143.694 -20.841
+ 117.965-109.938 110.563-111.798
+ 119.322-142.736 113.837-114.620
+ 93.157 72.136 107.425-114.639
+ 93.308 0.000 112.713 -77.943
+ # 57 total E -8.52103E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.767 100.497 148.835 -25.323
+ 93.188 118.016 142.956 -27.899
+ 129.529-102.903 89.815 -96.449
+ 91.689 62.568 142.915-109.076
+ 90.607 41.486 113.087 -91.018
+ 90.659 55.519 141.316 42.779
+ 90.127 40.364 140.092-145.567
+ 91.659 69.992 131.411-137.674
+ 91.800 -40.664 141.374-129.711
+ 115.543-156.067 0.000 0.000
+ 92.661 47.365 0.000 0.000
+ 89.703 49.264 97.785 -97.569
+ 89.449 45.569 110.050 -74.224
+ 94.225-176.726 112.952 -77.495
+ 94.128 116.733 0.000 0.000
+ 130.286 -78.457 111.369-100.459
+ 118.520-107.707 115.900-122.531
+ 120.085-136.848 111.313-110.682
+ 118.833-118.460 117.626-121.772
+ 121.885 0.000 121.446 -81.117
+ # 58 total E -8.42973E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.724 89.608 150.350 -28.966
+ 92.998 126.165 143.961 -30.711
+ 126.054-100.539 93.705-101.437
+ 91.662 60.241 145.812-107.294
+ 90.039 42.549 113.055 -61.448
+ 90.457 50.720 116.465 -41.041
+ 90.404 51.616 150.728-130.790
+ 90.776 44.551 87.368 -66.078
+ 92.489-113.841 107.729 -81.559
+ 94.566 156.963 0.000 0.000
+ 127.009 -41.008 0.000 0.000
+ 111.628-172.625 125.242-134.914
+ 94.545 173.262 134.672 168.945
+ 126.628 -48.897 125.154-156.548
+ 96.387 93.318 0.000 0.000
+ 127.767 -87.110 105.697-112.289
+ 120.651-110.243 117.272-122.942
+ 118.032-136.920 111.654-112.526
+ 120.940-104.188 111.232-111.744
+ 120.244 0.000 118.431 -79.662
+ # 59 total E -8.82703E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.706 45.329 109.227 -81.103
+ 92.967 173.029 144.820 -19.942
+ 92.023 78.528 149.886 108.663
+ 89.859 49.155 144.871 -96.738
+ 89.334 45.183 115.344 -69.292
+ 90.553 52.024 154.847 -13.609
+ 90.507 41.641 135.072-166.601
+ 91.745 72.778 102.467 -97.533
+ 90.892 -59.344 131.008-136.815
+ 109.237 -70.240 0.000 0.000
+ 101.546 -26.236 0.000 0.000
+ 93.001 99.907 138.905-166.144
+ 93.081 104.484 115.082 -78.607
+ 124.975 -86.532 131.748-156.701
+ 95.669 76.273 0.000 0.000
+ 125.586 -79.712 136.899 -89.941
+ 119.820-110.997 116.167-121.915
+ 119.578-134.491 109.393-109.103
+ 118.361-118.711 118.899-123.177
+ 121.892 0.000 121.547 -81.076
+ # 60 total E -8.72372E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.885 122.078 146.969 -9.101
+ 91.278 84.684 124.449 -19.065
+ 91.071 47.239 95.442 -89.469
+ 90.376 43.063 150.580 -96.104
+ 90.309 45.417 117.200-125.264
+ 91.033 50.372 126.611 59.468
+ 90.137 50.676 131.875-147.814
+ 90.430 43.763 135.253-134.536
+ 92.154 165.539 141.275-129.529
+ 96.280 102.531 0.000 0.000
+ 137.665 -74.019 0.000 0.000
+ 123.667 -71.274 107.672-103.897
+ 89.976 82.099 123.519 156.160
+ 92.244 17.687 111.490 -78.672
+ 114.360 -27.439 0.000 0.000
+ 127.893 -82.511 151.005 -30.423
+ 119.434-116.969 107.452-107.916
+ 109.996-170.488 129.841-144.404
+ 93.329 51.283 112.901-107.551
+ 93.347 0.000 114.040 -78.713
+ # 61 total E -8.60141E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.892 121.658 146.334 -9.549
+ 91.335 86.256 128.704 -14.810
+ 90.571 49.258 95.201 -89.727
+ 89.583 43.703 150.694 -96.902
+ 89.793 47.672 121.417-126.726
+ 90.790 51.297 121.438 50.469
+ 90.256 44.395 127.952-154.100
+ 91.616 61.496 131.216-136.033
+ 93.074 168.504 145.289-126.512
+ 94.896 111.737 0.000 0.000
+ 115.048 -24.757 0.000 0.000
+ 101.995 177.331 135.175-156.138
+ 94.754 123.448 139.105 -37.805
+ 94.293 22.141 115.116 -77.550
+ 96.065 63.226 0.000 0.000
+ 119.943 -61.524 151.411 -80.690
+ 116.851-104.910 108.756-111.039
+ 118.595-139.972 112.907-114.121
+ 93.610 76.467 129.483-153.191
+ 93.301 0.000 112.567 -77.454
+ # 62 total E -8.45738E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.794 55.410 146.976 -25.939
+ 92.057 101.665 132.038 -25.938
+ 90.851 51.133 93.173 -83.218
+ 89.454 42.291 148.512-103.578
+ 89.470 51.108 122.392-131.214
+ 90.276 45.863 123.705 22.442
+ 90.690 51.582 137.770-106.711
+ 91.342 39.149 134.643-135.492
+ 93.426-174.205 109.942 -85.671
+ 120.236 162.314 0.000 0.000
+ 100.119 -21.542 0.000 0.000
+ 98.632 179.698 133.345-154.642
+ 133.463-175.753 164.813 -72.263
+ 119.058 -85.263 119.542 -79.028
+ 124.863-177.164 0.000 0.000
+ 128.382 -81.426 122.839-123.416
+ 117.435-108.512 120.225-128.783
+ 120.455-143.427 108.012-105.782
+ 93.015 73.389 106.853-117.243
+ 93.317 0.000 111.744 -78.803
+ # 63 total E -8.56771E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.930 122.904 144.639 -7.747
+ 91.553 88.567 135.027 -18.675
+ 90.452 47.726 126.468 115.801
+ 90.136 44.527 147.412 -94.268
+ 89.683 46.188 121.635-128.355
+ 89.744 52.127 156.128 20.180
+ 89.796 53.569 140.011-155.092
+ 90.657 77.788 131.867-131.953
+ 91.868 -87.894 139.316-125.650
+ 140.301 -64.338 0.000 0.000
+ 92.842 50.510 0.000 0.000
+ 89.455 49.221 98.403 -99.894
+ 89.106 64.941 106.345 -75.244
+ 92.603 31.103 116.276 -77.288
+ 96.026 78.305 0.000 0.000
+ 134.629 -75.364 138.607 -96.608
+ 119.929-103.016 118.311-125.083
+ 118.240-138.511 111.496-111.560
+ 93.306 73.579 103.744-117.839
+ 93.306 0.000 112.953 -77.487
+ # 64 total E -8.52672E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.716 6.998 101.259 -81.300
+ 92.682 174.362 139.566 -26.553
+ 91.902 68.191 121.360 120.425
+ 90.882 38.225 155.096 -96.423
+ 90.621 49.590 115.591 -30.041
+ 90.523 48.884 156.368 85.384
+ 90.677 44.738 135.544-128.630
+ 92.699 66.066 132.157-137.358
+ 91.830 -71.789 143.754-103.052
+ 108.947 -48.980 0.000 0.000
+ 116.337 -66.106 0.000 0.000
+ 92.709 71.966 132.184-158.739
+ 92.698 125.350 113.657 -76.825
+ 92.627 -61.870 120.443-146.896
+ 105.223 -18.707 0.000 0.000
+ 129.368 -81.890 91.435 -64.297
+ 116.382-108.603 116.072-123.083
+ 119.962-148.318 109.947-108.520
+ 93.455 83.399 102.597-106.391
+ 93.303 0.000 111.079 -78.112
+ # 65 total E -8.49421E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.712 98.533 151.536 -27.723
+ 93.147 122.437 138.587 -33.804
+ 128.427-100.814 95.347-100.163
+ 92.625 53.147 160.700-137.682
+ 90.699 42.690 107.637 -38.831
+ 91.670 51.507 144.678 80.686
+ 91.090 37.977 138.122-114.069
+ 92.345 56.363 133.996-143.522
+ 94.039-172.782 145.184 -23.483
+ 93.707 126.381 0.000 0.000
+ 121.608 -20.858 0.000 0.000
+ 93.461 93.961 131.625-154.706
+ 123.454-103.336 114.390 -76.579
+ 131.051 -86.058 120.178 -80.545
+ 95.834 171.689 0.000 0.000
+ 130.106 -83.981 118.027-113.036
+ 119.633-107.761 115.013-120.720
+ 117.410-138.734 112.386-113.449
+ 93.786 74.822 125.936-148.416
+ 93.307 0.000 112.450 -77.841
+ # 66 total E -8.44673E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.791 107.396 150.588 -14.208
+ 92.035 137.206 116.154 -45.358
+ 91.287 56.951 91.267 -93.359
+ 89.927 44.170 145.994 -97.760
+ 89.610 61.858 125.682-150.003
+ 89.786 88.587 137.900 37.233
+ 89.881 95.995 150.033-108.529
+ 90.914 11.959 105.979-126.285
+ 93.231-108.551 115.175 -81.237
+ 95.226 145.319 0.000 0.000
+ 94.367 40.946 0.000 0.000
+ 93.072 129.517 100.275 -99.253
+ 92.231 113.701 130.952 160.929
+ 95.790 -91.752 116.395-135.890
+ 95.478 166.638 0.000 0.000
+ 130.578 -96.257 97.046 -88.201
+ 118.668-108.204 121.714-130.103
+ 120.288-140.567 109.439-108.269
+ 93.537 66.842 103.516-106.128
+ 93.313 0.000 113.963 -77.440
+ # 67 total E -9.10421E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.851 100.773 147.054 -11.935
+ 91.386 71.418 138.804 -41.349
+ 91.307 45.403 121.983 121.772
+ 90.239 46.384 143.105 -91.967
+ 89.698 43.861 118.088-123.292
+ 90.482 48.279 159.695 8.064
+ 90.761 44.348 136.919-173.491
+ 91.940 72.699 135.872-130.505
+ 90.573 -63.222 131.012-134.224
+ 107.480 -68.543 0.000 0.000
+ 100.341 -27.913 0.000 0.000
+ 92.978 100.244 136.653-162.074
+ 92.929 101.505 114.612 -78.147
+ 124.300 -91.143 123.320-139.244
+ 94.540 80.781 0.000 0.000
+ 129.019 -69.421 132.553-118.943
+ 120.080-121.382 107.254-112.217
+ 121.406-168.662 112.536-112.468
+ 93.311 52.291 100.042-101.097
+ 93.353 0.000 110.882 -81.396
+ # 68 total E -8.36728E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.734 31.532 103.778 -77.635
+ 93.282 170.667 145.514 -30.857
+ 93.235 93.012 136.534-103.674
+ 104.748 -49.053 133.746 -83.467
+ 91.084 81.962 119.388-110.200
+ 91.781 42.646 134.586 87.689
+ 90.996 48.915 149.835-149.673
+ 92.679 60.237 125.280-141.516
+ 92.416 -75.218 143.877-124.548
+ 111.280 -45.693 0.000 0.000
+ 116.029 -73.152 0.000 0.000
+ 93.186 64.163 128.211-150.599
+ 93.646 127.111 114.786 -77.401
+ 115.845 -84.474 128.166-155.018
+ 96.051 66.279 0.000 0.000
+ 127.096-102.099 110.457 -50.922
+ 117.626-105.945 119.031-124.776
+ 115.109-137.889 142.811-158.848
+ 94.227 40.430 96.488 -99.267
+ 93.414 0.000 118.085 -78.861
+ # 69 total E -8.37775E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.867 77.153 144.984 -16.517
+ 92.995 167.417 139.113 -39.190
+ 110.820 170.347 120.345 -71.387
+ 91.335 69.653 131.187-107.898
+ 90.401 42.541 100.434 -99.783
+ 91.535 49.438 145.826 35.802
+ 91.201 42.792 143.553-140.071
+ 92.664 75.876 136.400-134.913
+ 92.475-110.610 139.014-123.240
+ 94.552 122.265 0.000 0.000
+ 134.085 -49.203 0.000 0.000
+ 119.283 176.472 117.517-120.446
+ 92.891 86.848 134.149-116.240
+ 94.591 24.492 113.920 -77.311
+ 97.316 73.395 0.000 0.000
+ 126.110 -85.439 129.264 -97.795
+ 119.086-116.321 101.138 -98.587
+ 112.086-166.653 119.380-126.896
+ 93.824 68.302 132.129-158.659
+ 93.314 0.000 114.091 -77.336
+ # 70 total E -8.55390E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.676 103.354 154.476 -26.137
+ 93.195 127.034 138.927 -27.918
+ 130.191-101.175 94.864 -97.742
+ 92.972 54.804 157.665-141.304
+ 90.467 43.260 110.084 -35.374
+ 90.831 53.739 150.336 93.284
+ 90.674 53.358 139.789-118.360
+ 92.249 84.775 133.503-133.431
+ 93.874-107.902 148.326-156.507
+ 140.026 -71.205 0.000 0.000
+ 94.271 38.628 0.000 0.000
+ 92.446 51.307 97.790 -96.686
+ 93.332 -56.175 113.273 -74.485
+ 129.767-167.001 119.872 -78.450
+ 114.190 161.614 0.000 0.000
+ 129.379 -72.098 118.141-118.448
+ 115.768-104.747 115.035-122.899
+ 119.970-148.147 111.263-110.583
+ 93.332 47.388 103.185-117.031
+ 93.369 0.000 113.929 -79.825
+ # 71 total E -8.48249E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.666 68.456 153.195 -31.574
+ 92.882 111.656 142.003 -42.587
+ 129.904 -98.055 90.207-102.346
+ 91.851 55.710 145.274-101.319
+ 90.425 39.084 109.313 -71.375
+ 90.972 58.464 150.696 39.525
+ 90.311 40.846 148.661-151.339
+ 91.977 68.953 130.984-137.593
+ 91.721 -87.920 139.513-125.377
+ 94.802 160.489 0.000 0.000
+ 140.980 -35.854 0.000 0.000
+ 90.061 58.997 96.725-101.118
+ 90.199 34.941 110.272 -80.606
+ 94.547-115.554 108.776 -75.217
+ 95.827 157.963 0.000 0.000
+ 130.679 -81.135 131.854 -53.350
+ 118.248-107.604 117.630-123.461
+ 119.399-138.173 110.704-111.018
+ 93.307 72.299 100.091-105.172
+ 93.311 0.000 112.468 -78.115
+ # 72 total E -8.55969E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.803 106.885 148.885 -17.779
+ 93.113 129.207 138.841 -26.120
+ 124.465 -96.264 94.095 -93.926
+ 91.591 55.019 143.974-108.623
+ 89.938 42.473 119.108 -87.544
+ 90.722 64.988 116.964 -27.451
+ 90.172 38.692 160.543-120.269
+ 91.864 76.581 80.593 -74.382
+ 92.783 -73.767 142.143-114.124
+ 96.139 177.657 0.000 0.000
+ 141.979 -29.861 0.000 0.000
+ 121.257 163.828 116.307-119.695
+ 93.441 97.035 132.024-121.350
+ 93.585 -88.771 112.461 -77.390
+ 94.681 158.627 0.000 0.000
+ 125.372 -79.695 144.583 -50.208
+ 116.687-144.974 114.358-120.733
+ 126.532-171.378 110.813-106.366
+ 93.467 71.396 92.529 -98.251
+ 93.410 0.000 127.056-130.369
+ # 73 total E -8.37512E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.952 106.605 142.229 -3.405
+ 92.450 152.829 138.803 -22.733
+ 90.340 90.007 99.279 -97.145
+ 88.903 43.180 146.160-114.312
+ 89.444 48.228 95.646 -58.402
+ 90.621 48.130 129.328 64.153
+ 90.211 48.453 137.639-113.578
+ 90.615 49.890 132.718-136.310
+ 92.114 175.864 141.494-123.946
+ 94.918 136.606 0.000 0.000
+ 126.357 -32.418 0.000 0.000
+ 93.900 83.920 97.756 -98.883
+ 125.956-106.401 121.254 -76.017
+ 128.702 -92.583 122.154 -80.334
+ 128.074-174.732 0.000 0.000
+ 126.178 -87.845 104.281-112.328
+ 118.307-109.274 124.942-134.244
+ 121.575-141.686 109.222-106.912
+ 117.114-119.241 116.609-119.588
+ 121.867 0.000 121.722 -80.947
+ # 74 total E -8.57684E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.838 95.141 147.282 -14.482
+ 91.367 69.886 139.739 -53.418
+ 90.438 60.465 123.374 106.589
+ 89.337 47.926 149.520 -91.414
+ 90.527 43.910 109.673 -61.065
+ 90.532 51.688 152.964 57.384
+ 90.412 42.939 138.354-141.791
+ 92.108 67.388 134.445-136.575
+ 91.010 -67.294 140.602-118.306
+ 110.043 -62.941 0.000 0.000
+ 112.421 -67.870 0.000 0.000
+ 92.233 67.297 131.843-157.724
+ 93.206 110.856 113.393 -76.464
+ 92.507 -55.667 116.755 -81.769
+ 111.007 -25.500 0.000 0.000
+ 129.192 -84.467 93.735 -62.720
+ 116.096-110.303 116.284-123.575
+ 120.389-148.593 109.638-108.518
+ 93.611 67.969 103.815-108.283
+ 93.315 0.000 114.080 -77.353
+ # 75 total E -8.66237E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.868 118.596 146.863 -12.525
+ 91.287 86.682 131.303 -3.453
+ 89.782 50.964 92.818 -90.893
+ 89.093 44.359 149.197 -98.825
+ 89.388 47.894 126.272-137.448
+ 90.390 48.903 130.462 18.888
+ 90.117 42.880 133.001-145.221
+ 92.306 83.700 132.171-135.430
+ 91.411 -91.990 141.495-130.549
+ 96.180 53.168 0.000 0.000
+ 147.702 -86.501 0.000 0.000
+ 119.150 -81.708 109.080-108.713
+ 91.016 90.585 133.852-143.210
+ 94.187 33.768 107.663 -78.261
+ 96.124 72.160 0.000 0.000
+ 125.820 -84.019 103.963 -58.479
+ 117.150-108.304 115.265-120.010
+ 119.085-139.190 113.829-114.188
+ 93.548 76.691 131.609-155.083
+ 93.300 0.000 112.554 -77.411
+ # 76 total E -8.70516E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.899 122.586 146.187 -8.327
+ 91.533 85.209 138.050 -28.021
+ 91.271 47.736 127.570 112.688
+ 90.410 41.875 149.675 -95.761
+ 90.054 49.617 120.186 -29.848
+ 90.283 44.236 164.547 39.702
+ 90.270 55.644 135.327-127.560
+ 90.704 45.004 136.020-123.570
+ 92.051-119.461 110.010 -80.104
+ 95.306 154.693 0.000 0.000
+ 130.718 -60.943 0.000 0.000
+ 101.732 168.601 106.547 -96.565
+ 93.803 131.689 129.993-160.396
+ 115.829 -73.738 115.551 -80.759
+ 95.409 74.619 0.000 0.000
+ 129.576 -83.467 92.809 -63.747
+ 117.638-107.023 121.097-128.585
+ 120.414-136.176 110.718-108.307
+ 92.774 88.737 100.629-112.411
+ 93.258 0.000 108.367 -77.927
+ # 77 total E -8.49045E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.733 -7.086 96.264 -84.073
+ 92.345 169.721 141.466 -25.073
+ 91.926 68.568 118.152 124.115
+ 91.283 35.549 153.289 -99.080
+ 90.501 51.658 110.862 -28.208
+ 90.882 41.275 156.001 105.941
+ 90.653 65.663 132.382-101.488
+ 90.827 28.523 138.570-121.376
+ 92.671-118.372 101.556 -75.142
+ 92.912 145.987 0.000 0.000
+ 93.453 47.810 0.000 0.000
+ 89.252 50.389 103.673-115.957
+ 90.082 44.404 111.367 -77.614
+ 94.351-117.249 110.077 -76.888
+ 94.443 152.917 0.000 0.000
+ 130.241 -74.860 138.160 -65.195
+ 116.194-105.112 127.009-138.481
+ 120.862-119.157 107.810-105.555
+ 93.069 78.136 99.054-106.605
+ 93.271 0.000 110.361 -77.679
+ # 78 total E -8.55860E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.920 120.365 144.535 -9.128
+ 91.545 83.356 132.339 -21.629
+ 92.285 40.258 135.668 113.231
+ 91.428 46.583 145.596 -93.910
+ 90.478 48.201 117.641-123.966
+ 92.354 67.830 133.209 -13.302
+ 91.334 118.948 144.555-160.119
+ 95.989 -64.104 129.573-139.151
+ 128.699 -60.773 107.707 -78.391
+ 95.749 69.040 0.000 0.000
+ 92.767 42.580 0.000 0.000
+ 89.449 51.514 92.253 -68.474
+ 89.725 70.387 117.985 -75.231
+ 93.688 20.513 112.900 -78.723
+ 96.827 74.497 0.000 0.000
+ 137.330 -65.405 160.273-127.363
+ 116.948-104.074 111.271-119.698
+ 119.594-139.861 116.165-116.247
+ 93.597 76.573 129.745-153.238
+ 93.300 0.000 112.509 -77.507
+ # 79 total E -8.96055E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.982 125.734 142.700 -3.072
+ 91.457 89.683 135.875 -17.850
+ 91.199 46.635 126.464 96.977
+ 89.930 44.917 146.889 -90.327
+ 89.976 47.172 121.549-129.261
+ 90.161 50.310 157.901 41.014
+ 90.383 41.726 145.747-133.742
+ 92.107 68.966 131.452-135.199
+ 91.137 -60.725 136.877-118.272
+ 113.734 -63.728 0.000 0.000
+ 101.064 -21.838 0.000 0.000
+ 93.296 95.146 95.974 -84.512
+ 122.477 144.333 118.343 -80.670
+ 95.125 -75.612 113.909 -77.063
+ 93.531 63.584 0.000 0.000
+ 128.159 -77.976 86.930 -64.275
+ 117.412-104.577 124.989-133.256
+ 122.475-141.438 109.014-107.966
+ 93.065 60.002 92.396 -99.340
+ 93.348 0.000 111.131 -80.942
+ # 80 total E -8.56106E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.946 123.159 143.776 -6.906
+ 91.517 87.153 134.945 -16.514
+ 91.255 42.372 131.612 116.233
+ 90.603 47.029 146.416 -92.102
+ 89.879 46.847 121.907-129.335
+ 90.542 48.668 133.695 -9.668
+ 90.142 45.343 138.906-142.407
+ 90.650 66.244 134.414-133.590
+ 91.659-175.166 131.377-123.881
+ 94.872 71.318 0.000 0.000
+ 92.808 41.013 0.000 0.000
+ 89.890 65.106 106.110 -98.476
+ 89.395 125.028 133.350-104.762
+ 91.500 -65.188 112.188-143.980
+ 95.259 77.662 0.000 0.000
+ 137.978 -89.388 89.443 -64.069
+ 118.254-106.645 118.313-125.675
+ 120.670-138.927 107.225-103.315
+ 92.915 85.077 101.518-112.576
+ 93.287 0.000 109.520 -78.466
+ # 81 total E -8.72116E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.986 126.027 142.596 -2.558
+ 91.454 89.544 135.738 -18.000
+ 91.160 46.914 126.101 98.377
+ 90.054 44.708 147.820 -91.056
+ 90.078 46.652 121.596-128.520
+ 90.282 50.511 158.744 39.976
+ 90.408 41.776 145.227-129.856
+ 92.070 68.780 131.676-135.349
+ 91.124 -60.944 136.498-118.479
+ 113.747 -63.514 0.000 0.000
+ 101.076 -21.981 0.000 0.000
+ 93.262 94.969 95.818 -83.435
+ 122.118 144.220 118.158 -80.580
+ 94.864 -75.326 113.543 -77.412
+ 93.408 64.553 0.000 0.000
+ 129.294 -76.934 88.601 -63.991
+ 118.027-105.257 125.045-132.907
+ 120.417-115.943 109.285-109.230
+ 118.484-118.554 114.375-118.523
+ 121.873 0.000 121.495 -81.066
+ # 82 total E -8.63785E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.969 125.801 143.529 -3.243
+ 91.460 89.967 135.288 -17.491
+ 91.086 45.306 124.616 105.992
+ 89.398 45.029 143.365 -87.900
+ 89.696 48.678 121.268-131.419
+ 89.592 54.133 133.561 57.041
+ 90.159 36.648 140.611-172.632
+ 92.482 58.279 127.331-131.281
+ 92.531 -52.857 142.178-119.414
+ 123.347 -65.164 0.000 0.000
+ 123.421 -21.607 0.000 0.000
+ 94.729 86.128 83.927 -83.086
+ 135.652 -91.985 151.042 -0.716
+ 123.781 -58.329 118.747 -80.001
+ 95.504 72.064 0.000 0.000
+ 117.568 -79.587 84.769 -64.445
+ 116.456-112.316 112.500-114.624
+ 120.565-145.401 134.123-143.900
+ 92.693 74.697 101.138-100.896
+ 93.322 0.000 110.121 -80.015
+ # 83 total E -8.50909E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.888 121.407 146.511 -9.659
+ 91.320 85.109 128.980 -15.483
+ 90.928 44.302 93.501 -87.665
+ 90.218 45.916 148.747 -97.597
+ 90.001 42.460 122.228-127.391
+ 91.351 51.691 134.235 21.887
+ 90.589 36.326 132.235-158.679
+ 92.484 67.018 131.418-134.183
+ 92.456 -76.750 135.034-114.515
+ 122.427 -2.382 0.000 0.000
+ 135.758 -32.701 0.000 0.000
+ 127.931-176.279 106.508-102.083
+ 126.160 168.016 117.991 -81.329
+ 119.747 -64.889 118.788 -78.252
+ 94.757 71.672 0.000 0.000
+ 120.985 -67.404 118.260-131.234
+ 117.920-109.437 115.584-121.561
+ 118.641-136.859 143.231-157.996
+ 93.793 54.110 92.484 -93.436
+ 93.347 0.000 114.972 -78.338
+ # 84 total E -9.09006E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.914 124.016 145.895 -6.834
+ 91.533 88.174 134.537 -24.718
+ 91.776 44.265 123.685 104.099
+ 90.119 45.809 141.339 -86.981
+ 90.044 45.523 119.334-126.568
+ 90.227 47.766 156.387 48.963
+ 90.677 47.080 141.958 175.760
+ 92.139 74.909 137.099-131.503
+ 90.505 -66.679 136.265-130.355
+ 103.078 -66.412 0.000 0.000
+ 99.036 -33.117 0.000 0.000
+ 92.643 102.122 133.645-159.189
+ 94.186 126.709 113.390 -78.509
+ 107.224 -87.543 120.683-155.640
+ 94.934 59.926 0.000 0.000
+ 128.258 -82.602 102.272 -59.633
+ 116.489-106.780 125.233-134.345
+ 122.138-149.685 110.050-108.685
+ 92.887 56.951 99.878-105.312
+ 93.346 0.000 112.023 -80.255
+ # 85 total E -8.59238E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.944 108.769 140.336 -16.530
+ 92.999 104.756 141.601 -36.337
+ 129.110-112.754 96.388 -93.402
+ 92.960 66.159 141.995-107.635
+ 91.201 34.651 112.625 -91.661
+ 92.226 55.383 131.957 41.387
+ 90.992 36.906 133.187-160.575
+ 92.206 62.729 136.856-133.583
+ 91.389 -74.972 131.617-133.286
+ 117.646 -64.074 0.000 0.000
+ 125.529 -48.909 0.000 0.000
+ 103.361 -27.388 96.161 -92.426
+ 92.182 101.181 128.526 138.192
+ 92.276 9.889 108.333 -77.942
+ 119.394 -14.564 0.000 0.000
+ 126.053 -82.534 85.835 -62.146
+ 116.078-108.183 117.827-122.872
+ 117.023-142.491 141.458-155.825
+ 93.242 54.249 94.775 -95.460
+ 93.359 0.000 111.797 -80.981
+ # 86 total E -8.92478E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.867 120.776 147.399 -11.441
+ 91.446 88.621 130.134 -16.332
+ 90.554 47.980 93.538 -85.786
+ 89.270 46.027 143.807 -95.423
+ 89.255 50.171 122.453-131.939
+ 89.325 49.465 154.914 37.303
+ 90.703 63.885 130.792 -54.193
+ 91.632 102.849 133.590-133.256
+ 91.165 -24.542 145.745-130.361
+ 101.275 -71.579 0.000 0.000
+ 98.682 -21.782 0.000 0.000
+ 93.334 102.681 134.275-157.495
+ 94.173 113.219 119.595 -75.258
+ 120.902-100.098 118.069 -84.237
+ 95.353 64.009 0.000 0.000
+ 126.789 -87.504 99.219 -62.449
+ 116.862-110.625 119.580-126.938
+ 121.349-147.136 111.613-109.778
+ 92.289 77.983 104.702-112.238
+ 93.326 0.000 108.159 -81.506
+ # 87 total E -8.34793E+01 rmsd from N 0.000 %NC 0.00 1
+ 94.022 128.330 141.543 2.030
+ 91.302 91.264 132.471 -13.605
+ 90.543 49.696 127.241 102.810
+ 89.812 44.168 148.879 -97.124
+ 89.604 49.952 121.680-132.252
+ 89.818 68.772 130.870 31.748
+ 89.358 59.170 142.223-174.092
+ 89.893 37.659 78.661 -86.795
+ 93.440 -98.199 137.730-114.503
+ 122.695 -68.677 0.000 0.000
+ 105.694 -32.787 0.000 0.000
+ 92.105 -47.911 93.634 -81.365
+ 92.444 92.927 114.497 -75.320
+ 132.726-105.182 119.271 -82.784
+ 97.088 168.271 0.000 0.000
+ 129.464 -81.939 122.891 -63.039
+ 119.459-108.217 115.413-120.281
+ 119.011-142.149 115.251-116.733
+ 93.586 49.287 98.764-101.318
+ 93.364 0.000 114.376 -79.419
+ # 88 total E -8.80504E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.905 122.961 146.040 -7.973
+ 91.271 86.112 128.127 -14.459
+ 90.838 47.729 96.785 -90.203
+ 89.753 44.556 151.208 -97.054
+ 90.122 46.985 123.243-125.633
+ 91.237 48.287 120.576 63.229
+ 90.816 43.402 128.057-145.428
+ 91.854 56.058 134.141-134.553
+ 93.176-177.056 141.738-133.864
+ 133.936 -69.778 0.000 0.000
+ 111.414 -6.370 0.000 0.000
+ 91.016 72.469 100.952 -97.126
+ 90.200 -0.320 107.600 -76.380
+ 107.942-135.295 103.641 -75.604
+ 94.724 122.635 0.000 0.000
+ 120.236 -71.273 140.725 -43.524
+ 114.733-132.017 90.828 -82.932
+ 106.792-172.656 130.361-146.446
+ 93.303 50.053 108.697-108.201
+ 93.346 0.000 113.343 -79.371
+ # 89 total E -8.78989E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.851 106.272 146.668 -11.934
+ 91.529 80.012 138.697 -27.518
+ 90.826 44.583 134.310 115.328
+ 89.973 49.287 140.603 -88.113
+ 89.596 42.873 120.888-129.608
+ 90.056 49.663 138.681 -14.460
+ 90.291 43.422 140.998 179.413
+ 91.454 72.150 136.199-132.501
+ 90.659 -55.542 134.280-129.189
+ 115.673 -70.218 0.000 0.000
+ 107.946 -20.841 0.000 0.000
+ 108.984-144.747 95.027 -77.941
+ 126.217-139.950 122.025 -79.279
+ 93.762 36.100 115.717 -76.258
+ 95.170 64.070 0.000 0.000
+ 111.363 -63.300 154.692 -9.958
+ 118.356-112.224 109.614-114.025
+ 121.748-141.770 113.806-112.853
+ 116.202-118.271 133.108-144.714
+ 121.709 0.000 121.560 -80.712
+ # 90 total E -8.70078E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.883 121.298 146.750 -10.069
+ 91.354 85.953 128.597 -17.018
+ 91.029 45.502 93.859 -87.743
+ 90.389 44.786 147.544 -96.760
+ 90.148 43.254 119.931-126.069
+ 91.180 48.625 141.457 27.515
+ 90.318 44.393 130.678-159.186
+ 91.849 75.511 136.490-133.878
+ 90.925 -97.103 138.690-123.685
+ 95.869 56.145 0.000 0.000
+ 150.847 -70.371 0.000 0.000
+ 128.312 172.298 108.805-103.788
+ 124.880 165.721 122.112 -80.349
+ 118.474 -63.002 117.783 -79.689
+ 94.529 73.865 0.000 0.000
+ 121.758 -71.929 69.438 -75.052
+ 117.176-109.106 116.805-122.689
+ 118.755-136.468 143.539-158.114
+ 93.559 62.869 91.793 -94.369
+ 93.332 0.000 112.892 -79.007
+ # 91 total E -8.58632E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.698 85.927 151.179 -31.160
+ 93.028 125.252 142.799 -39.619
+ 128.750 -97.135 95.895-105.205
+ 92.021 52.139 149.659-103.249
+ 90.482 39.264 104.513 -45.075
+ 91.946 52.187 162.122 112.787
+ 90.671 44.459 145.908-106.275
+ 92.178 77.103 137.862-136.986
+ 91.607 -68.398 144.314-133.971
+ 118.919 -22.016 0.000 0.000
+ 117.315 -45.905 0.000 0.000
+ 96.094 -41.673 91.511 -87.741
+ 90.965 111.918 138.915 -34.319
+ 95.197 24.034 112.600 -80.418
+ 96.497 68.980 0.000 0.000
+ 126.857 -83.720 116.743-126.651
+ 116.125-107.300 122.571-133.558
+ 112.987-135.226 100.488 -84.239
+ 93.492 83.208 127.956-149.956
+ 93.280 0.000 110.974 -77.249
+ # 92 total E -8.74439E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.931 109.234 143.828 -0.531
+ 92.493 157.230 137.042 -24.708
+ 90.568 93.124 116.262-105.925
+ 89.420 48.740 145.447-114.543
+ 89.003 47.398 108.446 -70.144
+ 90.014 54.045 123.733 43.602
+ 89.627 53.078 134.087-151.356
+ 89.750 48.101 129.623-134.111
+ 91.580 166.562 140.278-118.185
+ 95.435 97.677 0.000 0.000
+ 132.938 -52.809 0.000 0.000
+ 93.982 79.887 132.263-155.194
+ 94.577 -57.815 118.710 -76.151
+ 135.543-158.887 125.813 -80.209
+ 115.614 171.103 0.000 0.000
+ 132.014 -79.661 106.448-110.867
+ 117.007-105.382 121.696-130.530
+ 121.283-146.218 109.584-107.629
+ 93.377 49.876 99.287-106.517
+ 93.362 0.000 113.350 -80.026
+ # 93 total E -8.40798E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.725 -2.430 105.196 -81.914
+ 108.344 178.809 161.713 -21.697
+ 93.809 85.139 176.393 179.418
+ 91.647 46.527 137.750 -83.643
+ 90.436 46.674 121.805-108.615
+ 90.478 48.270 98.511-134.765
+ 90.372 42.304 141.640-170.178
+ 91.888 50.235 134.485-126.914
+ 92.687 -77.743 116.327 -78.718
+ 130.138 -3.251 0.000 0.000
+ 138.764 -28.711 0.000 0.000
+ 112.520-147.612 89.323 -66.650
+ 92.303 89.933 142.334 -17.033
+ 93.071 24.147 114.884 -75.301
+ 96.301 65.400 0.000 0.000
+ 120.392 -86.729 125.893 -87.388
+ 117.510-110.602 117.150-124.450
+ 118.872-144.392 111.505-110.387
+ 93.617 52.985 128.352-150.410
+ 93.361 0.000 112.094 -80.821
+ # 94 total E -8.47179E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.890 121.509 144.490 -18.295
+ 116.553-177.965 144.181 -17.904
+ 108.131-164.943 104.217 -94.216
+ 90.905 61.191 140.727-101.708
+ 89.394 41.543 121.102-120.288
+ 90.665 59.286 127.289 25.663
+ 90.200 34.963 145.079-162.186
+ 92.241 64.272 126.930-136.068
+ 92.134 -56.119 136.877-117.297
+ 119.677 -56.280 0.000 0.000
+ 123.974 -37.222 0.000 0.000
+ 110.745 160.628 90.739 -78.163
+ 93.037 80.765 136.180 135.172
+ 120.560 -42.883 116.165 -75.865
+ 94.662 86.995 0.000 0.000
+ 115.484 -65.662 122.880-120.974
+ 118.331-109.283 116.977-124.003
+ 119.915-143.194 107.368-105.374
+ 93.100 73.547 103.537-119.099
+ 93.312 0.000 112.087 -78.365
+ # 95 total E -8.52294E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.884 124.564 147.801 -6.928
+ 91.300 91.872 130.879 -1.742
+ 90.583 45.233 95.551 -79.642
+ 90.526 57.248 142.180-116.115
+ 90.203 60.782 129.200 8.488
+ 90.148 73.603 95.456 -64.144
+ 91.415 161.581 154.031-106.159
+ 92.295 96.482 126.997-128.655
+ 91.612 -69.179 104.077 -83.220
+ 94.712 164.956 0.000 0.000
+ 136.642 -55.820 0.000 0.000
+ 118.895-175.674 118.677-121.570
+ 93.767 108.913 114.752 -77.298
+ 122.263-100.118 114.323 -80.586
+ 95.751 92.461 0.000 0.000
+ 128.160 -80.036 89.892 -63.469
+ 116.723-108.422 120.345-127.868
+ 120.767-120.140 109.080-105.283
+ 92.688 77.751 98.298-114.417
+ 93.282 0.000 109.232 -78.948
+ # 96 total E -8.93164E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.712 97.000 108.556 -80.349
+ 113.444 178.271 152.910 -16.909
+ 92.827 74.404 142.660 112.251
+ 89.878 48.480 146.991 -97.835
+ 89.335 45.125 111.820 -68.347
+ 90.423 51.941 157.269 -7.009
+ 90.526 42.301 135.800-162.753
+ 91.658 72.492 103.381 -98.843
+ 90.794 -60.005 130.531-136.438
+ 108.716 -69.573 0.000 0.000
+ 101.033 -26.796 0.000 0.000
+ 92.990 100.198 138.666-165.246
+ 93.335 107.388 115.435 -78.730
+ 124.001 -87.506 130.890-159.357
+ 95.583 73.720 0.000 0.000
+ 124.991 -80.160 132.077 -85.010
+ 118.760-110.863 116.459-122.613
+ 120.408-147.158 110.876-110.718
+ 93.050 85.724 101.135-108.093
+ 93.428 0.000 119.474-131.425
+ # 97 total E -8.72107E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.710 9.902 103.488 -81.511
+ 92.973 161.860 144.433 -14.048
+ 91.413 78.279 142.948 87.045
+ 90.848 41.793 149.424 -95.189
+ 90.409 48.555 120.318 -59.343
+ 91.438 48.894 132.564 44.154
+ 90.718 41.127 138.746-122.503
+ 91.964 57.055 130.946-132.838
+ 92.672 -82.915 133.058-127.112
+ 123.618 -63.531 0.000 0.000
+ 129.748 -40.594 0.000 0.000
+ 106.505 -28.470 92.792 -82.331
+ 91.577 98.633 134.592 148.552
+ 92.236 4.893 104.603 -79.671
+ 120.777 -14.180 0.000 0.000
+ 120.063 -78.661 93.759 -56.115
+ 116.233-107.426 121.226-125.570
+ 119.333-132.752 124.302-127.780
+ 92.805 58.936 97.256-102.383
+ 93.349 0.000 111.949 -80.411
+ # 98 total E -8.61917E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.782 101.065 149.559 -19.438
+ 92.065 134.836 120.335 -43.488
+ 90.638 56.876 83.602 -94.611
+ 90.650 42.665 143.475 -93.620
+ 89.675 48.924 127.156-149.837
+ 89.865 50.840 131.766 -8.994
+ 90.314 44.407 149.360-125.741
+ 91.724 71.708 129.794-136.255
+ 91.662 -95.570 133.456-121.861
+ 94.372 129.873 0.000 0.000
+ 134.075 -22.417 0.000 0.000
+ 111.037-145.774 92.268 -84.043
+ 93.793 113.337 115.608 -76.596
+ 113.560-108.131 112.663 -80.569
+ 124.367 176.849 0.000 0.000
+ 127.446 -79.895 130.484-114.547
+ 116.466-107.519 122.923-133.259
+ 121.874-146.344 107.996-105.152
+ 92.881 71.990 107.000-113.694
+ 93.318 0.000 111.074 -79.601
+ # 99 total E -8.69653E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.904 117.551 144.318 -9.729
+ 91.464 81.855 130.757 -18.735
+ 92.240 38.318 140.017 112.411
+ 91.468 49.424 143.832 -87.807
+ 90.264 41.440 119.180-126.024
+ 91.145 51.539 124.469 -23.089
+ 91.100 34.777 149.807-146.107
+ 93.078 60.113 132.826-132.225
+ 92.895 -61.881 134.636-126.374
+ 121.875-127.720 0.000 0.000
+ 119.088 -28.882 0.000 0.000
+ 92.485 67.613 134.207-160.104
+ 92.875 63.099 111.630 -76.162
+ 97.081-102.623 110.961 -78.461
+ 94.361 133.477 0.000 0.000
+ 132.045 -65.696 176.452-170.133
+ 115.541-102.803 111.025-119.428
+ 119.036-140.113 112.949-112.330
+ 93.757 76.840 126.822-150.578
+ 93.328 0.000 111.932 -77.861
+ # 100 total E -8.84151E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.922 124.508 145.616 -5.901
+ 91.276 86.155 128.396 -17.751
+ 91.269 45.127 98.510 -88.806
+ 90.226 44.750 150.731 -96.493
+ 90.410 44.646 121.929-123.675
+ 91.935 50.518 124.508 71.969
+ 91.438 38.915 130.800-147.335
+ 93.734 79.176 132.431-131.912
+ 121.842-102.282 155.912-165.997
+ 136.181 -64.176 0.000 0.000
+ 140.525 -30.026 0.000 0.000
+ 104.774 -32.089 94.391 -85.230
+ 90.970 99.892 113.955 -75.894
+ 91.979 -16.949 106.674 -79.081
+ 117.696 -30.753 0.000 0.000
+ 127.428 -70.785 138.989 -58.809
+ 118.902-121.686 102.518-102.476
+ 115.093-170.177 126.526-136.136
+ 93.437 65.604 106.089-105.678
+ 93.414 0.000 126.192-136.617
+ # 101 total E -8.82070E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.980 125.945 142.922 -2.802
+ 91.442 91.279 134.988 -16.128
+ 90.891 45.583 124.288 98.825
+ 89.618 47.837 143.150 -90.310
+ 89.549 44.832 122.696-135.317
+ 89.773 55.277 126.410 24.431
+ 89.940 35.242 144.470 176.132
+ 92.158 62.699 127.554-132.386
+ 92.075 -52.920 135.099-113.753
+ 121.467 -68.268 0.000 0.000
+ 119.721 -22.159 0.000 0.000
+ 110.757 162.269 83.731 -78.812
+ 93.879 82.040 124.260 74.048
+ 116.607 -40.319 119.942 -76.732
+ 94.678 85.754 0.000 0.000
+ 115.728 -72.467 114.669-115.612
+ 119.589-110.493 118.240-124.722
+ 119.143-140.127 109.008-108.394
+ 93.222 73.452 99.484-104.723
+ 93.311 0.000 112.143 -78.304
+ # 102 total E -8.64347E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.864 108.793 146.639 -10.547
+ 91.469 75.051 139.558 -34.014
+ 91.396 45.808 123.461 121.551
+ 90.931 42.658 148.747 -98.077
+ 89.951 46.915 118.218-114.792
+ 90.629 59.356 176.417 18.024
+ 89.994 43.399 143.522-144.945
+ 91.619 79.931 102.654-110.901
+ 92.193 -61.752 143.580-127.171
+ 120.062 -22.806 0.000 0.000
+ 117.515 -47.395 0.000 0.000
+ 95.981 -40.247 93.427 -91.626
+ 91.062 112.414 138.017 -48.284
+ 95.190 25.685 113.576 -80.081
+ 96.359 64.674 0.000 0.000
+ 122.523 -83.143 111.174-126.881
+ 115.690-106.874 123.557-134.674
+ 113.110-138.939 100.031 -90.546
+ 117.154-113.763 126.949-135.373
+ 94.641 0.000 116.391 -77.619
+ # 103 total E -8.90087E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.921 122.241 144.701 -8.287
+ 91.227 87.065 127.833 -10.059
+ 90.584 48.947 132.489 103.403
+ 89.603 47.041 149.024 -92.128
+ 89.798 44.744 122.818-133.071
+ 90.427 51.673 128.855 37.064
+ 90.305 39.378 143.337-144.041
+ 91.853 60.743 131.780-134.008
+ 91.452 -70.562 132.030-126.589
+ 118.134 -64.638 0.000 0.000
+ 126.656 -48.406 0.000 0.000
+ 103.153 -27.153 94.054 -90.746
+ 92.104 101.048 129.905 148.244
+ 92.369 12.758 109.021 -78.015
+ 119.749 -15.137 0.000 0.000
+ 122.155 -89.749 86.172 -63.947
+ 117.944-113.168 114.495-117.781
+ 115.298-142.492 136.916-151.975
+ 93.423 51.250 100.424 -92.053
+ 93.360 0.000 113.131 -80.212
+ # 104 total E -9.25429E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.868 122.259 147.957 -9.469
+ 91.469 84.908 129.430 -27.498
+ 91.434 44.740 94.034 -85.011
+ 90.719 43.936 146.648 -93.647
+ 90.159 42.706 119.402-119.119
+ 90.717 49.343 161.170 38.454
+ 90.569 47.062 132.123-168.167
+ 91.972 75.985 136.666-130.329
+ 90.071 -65.210 133.269-134.812
+ 101.909 -65.766 0.000 0.000
+ 97.789 -33.575 0.000 0.000
+ 92.787 104.702 140.532-169.918
+ 94.360 105.051 113.362 -77.188
+ 120.538 -95.347 118.685 -77.337
+ 94.738 80.524 0.000 0.000
+ 131.474 -71.209 127.282 -90.872
+ 115.613-109.737 85.196 -96.046
+ 117.449-155.705 113.820-116.793
+ 93.687 59.051 104.767-112.380
+ 93.418 0.000 125.420-142.743
+ # 105 total E -8.63354E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.739 112.177 153.137 -18.182
+ 93.040 125.265 134.677 -36.340
+ 126.417 -97.091 94.957 -91.019
+ 91.689 55.352 144.226-116.164
+ 89.939 43.115 123.228 -89.250
+ 90.323 65.991 118.225 -28.633
+ 90.075 43.858 152.940-142.401
+ 91.176 75.447 84.010 -77.397
+ 91.805 -79.214 138.032-120.490
+ 95.303 169.762 0.000 0.000
+ 146.631 -45.986 0.000 0.000
+ 133.480 170.323 103.814 -95.585
+ 93.925 155.080 114.819 -76.873
+ 120.874 -69.990 118.957 -81.970
+ 95.188 61.702 0.000 0.000
+ 119.991 -96.696 78.882 -74.160
+ 118.500-117.154 115.350-120.311
+ 115.352-114.076 140.267-156.981
+ 93.916 49.328 87.725 -77.700
+ 93.421 0.000 116.892 -79.975
+ # 106 total E -8.39662E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.852 92.379 146.166 -15.461
+ 91.478 65.298 119.307 -75.493
+ 90.920 59.676 122.608-101.442
+ 90.231 44.468 147.558-101.692
+ 89.759 45.986 97.215 -65.516
+ 90.411 53.598 131.669-111.158
+ 89.415 52.051 128.456-161.581
+ 90.589 42.940 128.633-129.034
+ 92.396-108.860 107.689 -78.599
+ 94.958 136.970 0.000 0.000
+ 117.812 -23.680 0.000 0.000
+ 119.359-140.912 107.597-103.972
+ 93.756 156.208 115.369 -76.983
+ 127.437-166.793 120.903 -82.514
+ 94.535 64.703 0.000 0.000
+ 114.970 -82.132 143.990 60.754
+ 118.183-166.412 115.801-122.031
+ 131.634-158.804 111.449-100.800
+ 92.640 102.561 105.064-105.711
+ 93.253 0.000 107.318 -76.925
+ # 107 total E -8.92852E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.862 108.516 146.516 -12.125
+ 91.537 80.500 138.153 -27.022
+ 90.911 44.177 135.205 115.309
+ 90.117 49.358 141.526 -88.248
+ 89.632 42.952 120.856-129.399
+ 90.075 50.018 137.198 -16.191
+ 90.291 43.216 142.122-173.243
+ 91.478 71.963 135.891-132.839
+ 90.764 -55.324 134.374-130.266
+ 116.123 -69.999 0.000 0.000
+ 109.304 -22.154 0.000 0.000
+ 109.376-145.185 95.457 -77.118
+ 126.477-141.257 122.195 -79.519
+ 93.910 35.689 115.752 -76.279
+ 95.186 62.922 0.000 0.000
+ 109.830 -60.752 153.706 -12.429
+ 118.096-110.436 110.247-114.764
+ 121.336-141.428 116.272-115.999
+ 93.462 76.200 132.249-156.320
+ 93.303 0.000 112.586 -77.525
+ # 108 total E -8.63694E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.986 125.151 142.239 -3.931
+ 91.487 90.064 135.377 -16.007
+ 91.057 47.025 131.111 99.498
+ 90.349 42.545 148.566 -98.134
+ 90.401 51.354 122.224-126.375
+ 91.841 51.874 134.873 18.581
+ 91.621 117.450 138.185-123.253
+ 87.764 -38.677 111.247-121.196
+ 90.583 -55.795 141.672-123.693
+ 95.273 3.521 0.000 0.000
+ 114.873 -46.054 0.000 0.000
+ 92.409 -37.250 95.640 -95.940
+ 92.973 96.337 113.961 -76.433
+ 132.234-114.954 117.107 -84.620
+ 95.470 162.902 0.000 0.000
+ 127.799 -76.148 120.463 -61.769
+ 117.805-105.021 119.334-126.391
+ 118.212-136.588 109.348-110.220
+ 117.981-118.676 122.318-128.804
+ 121.886 0.000 121.577 -81.038
+ # 109 total E -8.50805E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.927 120.200 143.965 -9.764
+ 91.482 86.663 131.821 -16.265
+ 91.517 43.509 139.385 103.447
+ 91.002 46.711 144.313 -92.858
+ 90.341 43.450 120.319-127.605
+ 91.087 59.520 130.066 -11.666
+ 90.751 57.961 154.665-147.254
+ 90.969 99.300 84.535 -80.526
+ 91.667 -23.755 140.430-141.328
+ 99.990 -69.538 0.000 0.000
+ 96.057 -24.631 0.000 0.000
+ 92.572 104.507 109.495-111.480
+ 94.319 129.076 123.338-124.266
+ 127.748 -84.016 122.200-153.574
+ 116.278 39.180 0.000 0.000
+ 103.779 -74.257 107.854 -89.378
+ 116.904-114.985 119.988-127.716
+ 117.483-141.047 142.995-157.628
+ 92.537 80.450 101.034-100.738
+ 93.306 0.000 110.005 -79.189
+ # 110 total E -8.48303E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.705 16.895 104.860 -81.553
+ 92.973 168.398 150.675 -25.201
+ 92.607 80.788 174.698 169.318
+ 91.816 52.596 138.101 -85.512
+ 90.604 44.536 126.435 -80.183
+ 90.476 45.945 99.044-129.512
+ 90.650 51.981 130.703-167.435
+ 91.305 39.323 142.906-126.737
+ 92.077-109.769 108.063 -77.414
+ 94.165 147.572 0.000 0.000
+ 114.692 -21.408 0.000 0.000
+ 103.062 164.640 97.551-102.569
+ 94.450 83.999 114.377 -77.568
+ 93.132 -81.847 114.535 -77.058
+ 93.393 145.402 0.000 0.000
+ 129.772 -72.783 146.991-104.298
+ 115.958-101.805 120.253-130.179
+ 120.289-138.683 106.904-103.717
+ 93.904 48.287 103.257-119.973
+ 93.351 0.000 117.627 -76.828
+ # 111 total E -8.56247E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.772 93.826 148.307 -25.367
+ 92.933 127.402 141.504 -42.275
+ 129.916 -97.119 96.940-102.441
+ 92.324 50.175 150.786-105.523
+ 90.724 42.468 106.697 -65.667
+ 91.817 46.324 153.033 102.655
+ 90.676 68.811 137.576-106.698
+ 91.122 26.519 135.834-116.903
+ 92.676-115.778 102.241 -75.402
+ 92.571 148.361 0.000 0.000
+ 93.522 47.905 0.000 0.000
+ 88.982 50.388 107.353-119.415
+ 89.764 41.495 111.437 -77.462
+ 94.600-120.563 109.969 -76.602
+ 94.561 152.822 0.000 0.000
+ 130.383 -82.544 137.041 -72.119
+ 117.441-107.828 119.574-127.310
+ 120.614-146.741 111.389-111.001
+ 92.849 84.961 97.733-102.305
+ 93.423 0.000 120.381-130.281
+ # 112 total E -8.66879E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.939 107.306 143.198 -1.988
+ 92.518 157.735 137.793 -24.439
+ 90.460 89.222 116.815-109.565
+ 89.508 45.466 145.185-109.619
+ 89.343 45.942 97.959 -60.895
+ 90.238 57.821 127.382 61.673
+ 90.237 39.800 140.404-152.502
+ 92.178 64.345 129.399-133.345
+ 92.672 -39.967 143.018-155.894
+ 114.277-158.979 0.000 0.000
+ 94.064 45.873 0.000 0.000
+ 90.402 48.164 97.858 -96.939
+ 90.489 43.040 112.326 -81.411
+ 94.452 179.024 113.728 -76.546
+ 94.746 122.728 0.000 0.000
+ 128.640 -94.794 111.437 -96.032
+ 119.029-108.365 122.799-130.941
+ 119.856-143.444 110.851-110.029
+ 93.396 56.536 99.493-102.715
+ 93.344 0.000 113.269 -79.349
+ # 113 total E -8.51203E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.988 125.093 142.078 -3.921
+ 91.383 90.873 133.391 -11.247
+ 90.362 51.996 129.908 104.388
+ 89.685 40.729 148.665 -91.137
+ 89.926 52.773 121.302-130.807
+ 89.867 56.799 136.449 47.096
+ 89.465 52.721 139.990-142.702
+ 89.635 52.231 124.399-137.515
+ 91.690-170.919 140.451-121.611
+ 95.859 117.682 0.000 0.000
+ 107.595 -16.288 0.000 0.000
+ 92.791 106.852 95.699 -56.272
+ 92.339 107.647 117.230 -76.419
+ 92.337 -38.582 114.448 -77.754
+ 96.295 89.099 0.000 0.000
+ 134.870 -80.344 122.884-117.234
+ 120.933-105.701 116.903-122.031
+ 119.616-144.690 108.778-107.924
+ 92.579 82.227 107.017-122.081
+ 93.317 0.000 109.071 -79.947
+ # 114 total E -8.40939E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.857 117.328 147.120 -13.751
+ 91.357 88.176 130.107 -3.359
+ 90.185 52.794 93.020 -91.743
+ 88.943 45.150 145.523 -95.920
+ 88.900 54.996 123.919-139.895
+ 89.184 61.490 125.521 36.626
+ 89.163 46.862 132.183 -66.887
+ 90.570 58.927 133.225-136.583
+ 91.882 176.727 142.691-132.051
+ 141.592 -46.705 0.000 0.000
+ 92.568 51.161 0.000 0.000
+ 91.021 53.416 95.610 -96.362
+ 92.491 -68.440 108.607 -76.420
+ 123.064 -70.272 116.094 -78.658
+ 117.870 -33.664 0.000 0.000
+ 108.080-105.585 126.554 37.253
+ 115.532-114.692 94.579 -84.761
+ 113.404-166.332 124.574-133.927
+ 93.447 69.888 139.974-167.874
+ 93.311 0.000 114.249 -77.043
+ # 115 total E -8.49170E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.711 27.198 105.910 -80.498
+ 92.964 170.204 152.440 -23.300
+ 92.359 79.010 175.613-177.540
+ 91.803 51.263 139.286 -86.024
+ 90.500 43.615 125.640 -79.797
+ 90.680 50.667 100.208-128.555
+ 90.082 47.156 140.507-161.544
+ 90.764 70.436 137.241-131.913
+ 91.977-158.238 138.105-124.714
+ 95.043 74.815 0.000 0.000
+ 92.674 42.711 0.000 0.000
+ 90.229 74.791 101.642-100.103
+ 90.933 147.483 125.391-142.397
+ 93.353 -61.399 114.702 -78.459
+ 95.217 60.470 0.000 0.000
+ 124.707-102.278 123.062 -42.776
+ 118.069-109.369 112.363-114.470
+ 116.661-138.075 115.914-119.138
+ 93.247 94.717 130.906-154.949
+ 93.212 0.000 106.725 -76.591
+ # 116 total E -8.95271E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.999 125.577 141.728 -3.040
+ 91.444 90.359 137.312 -13.757
+ 90.214 48.346 127.784 113.218
+ 89.380 43.582 149.646 -92.999
+ 89.735 48.472 123.743-132.955
+ 89.839 49.333 155.974 34.951
+ 90.379 43.091 137.467-137.268
+ 92.365 72.852 131.775-135.788
+ 91.149 -65.988 138.161-117.806
+ 108.043 -56.522 0.000 0.000
+ 115.317 -52.664 0.000 0.000
+ 93.187 83.225 139.009-166.206
+ 92.696 112.405 112.639 -76.768
+ 93.749 -72.035 134.804-160.094
+ 96.904 82.799 0.000 0.000
+ 131.750 -88.511 136.934 -39.912
+ 120.439-108.756 118.678-122.547
+ 120.213-139.963 113.201-113.642
+ 93.296 68.677 99.153-103.732
+ 93.320 0.000 112.444 -78.654
+ # 117 total E -9.14048E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.863 103.676 146.554 -11.014
+ 91.405 72.158 139.082 -38.499
+ 91.182 46.208 122.960 120.890
+ 90.144 45.178 146.912 -94.508
+ 89.923 46.666 117.442-122.476
+ 91.018 45.676 156.348 14.811
+ 90.953 46.055 135.285-139.496
+ 92.206 74.468 137.004-129.642
+ 90.319 -68.674 129.317-137.116
+ 106.187 -70.513 0.000 0.000
+ 99.211 -24.370 0.000 0.000
+ 93.643 104.005 133.626-156.024
+ 93.827 90.389 116.712 -75.960
+ 125.108 -93.776 119.410 -77.698
+ 94.953 86.670 0.000 0.000
+ 132.835 -70.055 138.084-112.499
+ 119.469-111.935 107.682-112.989
+ 121.007-149.264 112.933-112.572
+ 93.012 86.829 103.407-110.075
+ 93.432 0.000 118.757-132.497
+ # 118 total E -8.53196E+01 rmsd from N 0.000 %NC 0.00 1
+ 118.441 -80.488 109.243 -78.001
+ 116.630-105.688 144.790 -36.176
+ 91.146 56.989 129.298 102.576
+ 89.888 44.013 141.543 -92.725
+ 89.761 47.261 122.717-103.447
+ 90.012 53.653 128.783 30.013
+ 90.062 35.726 139.695 175.787
+ 92.293 61.404 128.300-130.993
+ 92.144 -57.397 134.982-112.382
+ 121.419 -65.841 0.000 0.000
+ 119.429 -21.614 0.000 0.000
+ 111.263 163.571 82.956 -77.558
+ 93.952 82.406 124.799 71.496
+ 116.761 -39.669 120.365 -76.486
+ 94.727 85.314 0.000 0.000
+ 115.458 -73.312 114.147-116.536
+ 119.580-110.907 118.254-124.778
+ 119.044-139.940 108.719-107.994
+ 93.216 73.582 99.141-105.393
+ 93.323 0.000 112.084 -78.382
+ # 119 total E -8.85579E+01 rmsd from N 0.000 %NC 0.00 1
+ 115.830 -50.712 110.294 -81.901
+ 91.776 80.585 131.050 -28.868
+ 91.845 43.069 98.113 -81.716
+ 91.059 43.729 148.195 -95.921
+ 90.116 42.869 117.454-118.644
+ 90.808 50.174 163.777 28.450
+ 90.620 46.303 132.061-163.111
+ 92.007 74.854 135.232-130.505
+ 90.408 -64.668 131.096-136.847
+ 102.769 -65.729 0.000 0.000
+ 98.517 -32.923 0.000 0.000
+ 92.825 104.282 139.839-168.804
+ 94.488 102.978 113.080 -77.249
+ 123.186 -95.598 119.261 -77.380
+ 94.697 80.124 0.000 0.000
+ 129.943 -69.706 128.755 -91.980
+ 119.018-108.612 109.768-113.961
+ 118.889-138.749 110.719-111.582
+ 117.323-118.171 126.214-134.457
+ 121.787 0.000 121.468 -80.915
+ # 120 total E -8.35052E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.861 122.334 148.377 -9.380
+ 91.365 83.495 125.954 -18.445
+ 90.924 47.159 92.426 -87.592
+ 90.883 41.918 151.799-102.728
+ 90.135 45.639 120.426-117.695
+ 90.776 50.877 126.746 97.181
+ 90.116 61.582 138.365-131.120
+ 90.760 32.523 135.186-132.456
+ 93.345-113.225 144.029-124.393
+ 94.315 132.111 0.000 0.000
+ 107.138 5.181 0.000 0.000
+ 99.463-176.190 93.107 -94.104
+ 122.256 179.948 144.221-156.159
+ 121.834 -60.421 115.646 -82.174
+ 113.791 -12.079 0.000 0.000
+ 112.771 -80.875 109.407 -54.431
+ 117.618-110.383 115.553-119.348
+ 117.837-135.781 117.330-121.389
+ 93.325 89.969 130.674-153.520
+ 93.246 0.000 108.759 -76.920
+ # 121 total E -8.45512E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.757 -9.903 101.149 -82.671
+ 116.403 174.142 152.159 -13.585
+ 92.405 66.585 133.596 119.424
+ 90.669 42.371 152.454 -98.017
+ 90.269 49.894 103.746 -43.446
+ 90.854 40.172 149.013 96.804
+ 91.029 64.729 131.680-113.622
+ 91.228 31.770 134.782-109.808
+ 93.143-119.764 106.886 -80.433
+ 93.909 145.438 0.000 0.000
+ 128.337 -38.169 0.000 0.000
+ 98.903 168.939 96.376 -94.570
+ 93.476 126.884 130.992 173.437
+ 113.483 -69.169 115.367 -80.540
+ 95.459 82.501 0.000 0.000
+ 132.427 -82.883 100.547 -62.443
+ 119.508-105.002 119.529-124.642
+ 119.202-141.494 110.249-110.247
+ 93.275 75.355 101.940-113.974
+ 93.315 0.000 111.057 -79.112
+ # 122 total E -8.81043E+01 rmsd from N 0.000 %NC 0.00 1
+ 118.986 -91.150 108.811 -78.042
+ 112.584-169.313 152.400 -16.691
+ 93.048 70.652 133.679 113.207
+ 89.865 41.794 151.441 -93.682
+ 90.160 48.812 99.893 -65.236
+ 90.591 49.313 156.137 43.191
+ 90.513 44.099 135.048-138.302
+ 92.269 69.136 131.878-135.540
+ 91.459 -71.639 137.923-112.910
+ 109.614 -50.620 0.000 0.000
+ 120.318 -58.929 0.000 0.000
+ 93.410 76.404 139.485-167.024
+ 93.208 111.422 113.322 -76.566
+ 94.296 -74.225 135.823-160.234
+ 97.045 86.136 0.000 0.000
+ 131.141 -83.757 139.333 -53.147
+ 120.881-112.444 108.840-110.212
+ 119.097-140.964 117.255-120.340
+ 93.375 66.655 101.255-100.961
+ 93.321 0.000 112.968 -78.428
+ # 123 total E -8.52616E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.718 22.806 104.068 -79.755
+ 92.889 173.369 144.180 -27.919
+ 91.797 84.973 144.414-103.818
+ 90.910 47.251 142.493-116.235
+ 90.338 46.049 124.194 -84.121
+ 89.758 54.673 101.841-131.920
+ 89.881 52.640 141.251-140.923
+ 90.896 75.925 131.770-134.273
+ 92.214-103.423 138.189-114.585
+ 137.204 -76.025 0.000 0.000
+ 94.365 37.461 0.000 0.000
+ 92.328 53.425 97.995 -96.865
+ 92.967 -49.704 114.246 -76.210
+ 130.724-173.937 116.312 -78.053
+ 114.055 156.044 0.000 0.000
+ 127.544 -80.086 122.675-123.153
+ 114.615-104.024 125.967-137.414
+ 120.560-143.591 108.611-105.983
+ 93.227 63.200 101.953-112.828
+ 93.332 0.000 112.725 -79.082
+ # 124 total E -8.83930E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.869 107.558 146.470 -10.744
+ 91.420 74.989 141.948 -36.150
+ 90.985 45.564 124.697 122.857
+ 90.636 47.459 148.092 -98.364
+ 89.963 42.807 121.550-120.515
+ 91.012 61.731 167.105-112.250
+ 89.935 38.267 145.910-148.302
+ 91.951 78.569 100.007-107.037
+ 92.565 -59.689 142.833-120.107
+ 121.710 -23.250 0.000 0.000
+ 119.019 -47.520 0.000 0.000
+ 96.636 -39.991 94.286 -92.149
+ 91.107 111.990 140.832 -38.123
+ 94.867 24.532 113.050 -80.088
+ 96.170 66.149 0.000 0.000
+ 122.627 -81.436 112.595-129.108
+ 116.546-108.799 123.225-133.937
+ 114.163-134.649 100.674 -83.285
+ 93.492 82.172 128.838-150.767
+ 93.281 0.000 111.339 -77.125
+ # 125 total E -8.37792E+01 rmsd from N 0.000 %NC 0.00 1
+ 116.484-171.050 151.050 -20.943
+ 118.120-111.344 142.000 -26.169
+ 91.234 65.327 119.881 122.493
+ 88.849 44.930 149.382 -96.001
+ 88.951 52.332 110.644 -87.725
+ 88.946 45.822 160.051 102.841
+ 90.101 61.607 139.319 -94.364
+ 90.339 33.132 136.149-133.668
+ 92.721-116.333 107.280 -79.939
+ 94.416 150.156 0.000 0.000
+ 132.385 -51.453 0.000 0.000
+ 92.130 67.452 98.969-100.947
+ 91.281 100.074 108.377 -77.446
+ 92.518 41.792 115.214 -80.911
+ 95.739 83.931 0.000 0.000
+ 122.768 -88.964 88.773 -62.355
+ 118.048-108.727 121.304-128.413
+ 118.691-141.850 109.498-108.892
+ 93.126 72.054 105.320-113.852
+ 93.316 0.000 111.801 -78.797
+ # 126 total E -8.54077E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.863 126.903 149.860 -3.665
+ 91.447 89.994 131.650 -12.094
+ 89.712 52.594 96.661 -81.746
+ 89.953 41.600 148.258-106.856
+ 90.205 44.045 126.124-127.125
+ 91.047 48.547 130.109 92.551
+ 90.565 67.879 134.970-136.572
+ 90.434 92.398 132.670-121.062
+ 92.144 -49.308 104.120 -82.981
+ 96.468 91.396 0.000 0.000
+ 128.200 -26.707 0.000 0.000
+ 113.570-144.952 95.837 -72.212
+ 96.868 164.818 116.343 -76.465
+ 128.045-161.425 122.051 -79.979
+ 94.726 63.878 0.000 0.000
+ 118.682 -84.966 142.620 -36.614
+ 119.673-165.244 111.521-113.743
+ 117.213-149.344 115.815-115.942
+ 93.722 85.133 131.196-155.286
+ 93.294 0.000 111.880 -77.043
+ # 127 total E -8.42402E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.757 101.086 149.589 -24.998
+ 92.998 121.303 149.120 -38.845
+ 131.700 -93.797 91.885 -96.599
+ 92.056 57.013 142.504-102.942
+ 89.895 41.954 122.561 -64.386
+ 90.328 73.414 118.518 -37.288
+ 90.525 41.112 143.293 -48.614
+ 91.721 73.792 84.667 -82.782
+ 92.650 -97.819 137.482-124.095
+ 94.304 119.445 0.000 0.000
+ 119.799 -8.293 0.000 0.000
+ 91.756 67.330 96.307 -79.980
+ 90.268 92.484 110.957 -78.725
+ 94.263 -42.068 118.426-134.781
+ 97.160 92.115 0.000 0.000
+ 125.037 -79.712 116.819-133.072
+ 120.254-112.656 115.674-120.459
+ 120.344-140.405 112.299-112.469
+ 93.179 60.678 95.322 -92.058
+ 93.345 0.000 111.329 -80.646
+ # 128 total E -8.61186E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.871 120.261 147.135 -11.118
+ 91.362 85.718 128.629 -15.343
+ 90.817 45.692 92.722 -87.738
+ 90.284 45.612 146.932 -97.119
+ 90.077 42.771 120.936-127.905
+ 90.982 48.499 144.801 23.272
+ 90.346 44.075 131.660-159.717
+ 91.876 75.029 136.855-133.668
+ 90.582 -95.747 137.600-122.512
+ 95.628 53.595 0.000 0.000
+ 151.573 -71.397 0.000 0.000
+ 129.261 161.817 104.761 -96.369
+ 93.913 78.891 111.360 -79.094
+ 120.329 -47.059 123.894 -79.636
+ 95.746 93.845 0.000 0.000
+ 125.020 -80.236 117.891-114.887
+ 120.879-111.142 115.754-120.926
+ 118.391-138.517 106.176-105.860
+ 117.548-118.919 125.424-134.720
+ 121.863 0.000 121.668 -80.953
+ # 129 total E -8.49815E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.909 123.636 146.077 -7.006
+ 91.491 85.202 133.280 -22.194
+ 90.443 48.292 95.975 -90.452
+ 88.862 45.490 154.086-101.368
+ 89.095 50.218 125.259-124.937
+ 89.101 47.473 153.465 98.504
+ 90.106 64.799 140.960-110.875
+ 90.428 30.921 135.107-131.630
+ 92.982-115.641 109.481 -80.483
+ 94.412 148.070 0.000 0.000
+ 134.980 -50.213 0.000 0.000
+ 91.793 59.752 97.909-102.332
+ 90.308 72.847 111.699 -78.088
+ 92.012 47.231 114.394 -83.451
+ 94.239 71.068 0.000 0.000
+ 112.024 -68.849 81.340 -71.158
+ 116.688-107.433 119.976-127.499
+ 119.842-145.838 110.191-109.451
+ 93.882 51.193 94.916-105.605
+ 93.414 0.000 129.578-142.473
+ # 130 total E -8.55634E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.856 117.782 147.444 -12.821
+ 91.359 85.318 127.283 -11.820
+ 90.660 47.441 91.894 -90.836
+ 90.361 45.350 146.149 -95.970
+ 89.929 42.965 121.233-128.906
+ 90.856 48.391 134.057 25.564
+ 90.754 47.216 132.810-165.372
+ 91.457 41.472 137.591-132.616
+ 93.302-173.075 114.282 -86.618
+ 122.876 169.237 0.000 0.000
+ 122.845 -39.698 0.000 0.000
+ 92.466 65.377 86.031 -86.615
+ 93.363 146.077 112.219 -80.098
+ 95.734 18.596 121.809-174.997
+ 97.110 67.517 0.000 0.000
+ 126.608 -66.740 117.291 -66.160
+ 113.975-100.934 116.795-124.802
+ 122.972-152.113 112.668-110.711
+ 92.984 65.752 97.235-108.845
+ 93.345 0.000 108.392 -82.700
+ # 131 total E -8.55765E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.784 101.033 149.518 -19.354
+ 92.059 134.474 118.310 -45.213
+ 90.771 57.085 86.218 -95.417
+ 89.450 41.961 147.766 -96.906
+ 89.363 52.173 124.518-147.134
+ 89.992 46.832 139.236 28.055
+ 90.522 45.476 139.487-108.590
+ 92.096 76.027 131.525-136.575
+ 92.539-111.694 137.663-124.570
+ 95.029 112.360 0.000 0.000
+ 132.034 -42.567 0.000 0.000
+ 115.436-152.042 130.427-140.776
+ 126.795 178.658 151.915-103.257
+ 121.947 -91.633 116.898 -79.717
+ 95.503 164.038 0.000 0.000
+ 129.100 -98.751 130.693-109.162
+ 117.554-107.216 124.193-134.442
+ 121.013-144.024 108.196-105.881
+ 93.060 73.249 107.078-112.672
+ 93.316 0.000 111.797 -78.727
+ # 132 total E -8.58396E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.918 121.578 144.817 -9.220
+ 91.544 87.950 134.254 -18.215
+ 91.099 43.644 131.798 110.418
+ 90.444 46.144 142.832 -89.498
+ 89.704 42.771 121.225-129.607
+ 90.176 55.650 139.866 -0.085
+ 90.292 40.195 143.710 165.133
+ 91.950 73.081 129.398-134.048
+ 92.351 -79.865 135.769-124.913
+ 95.200 169.932 0.000 0.000
+ 147.961 -38.232 0.000 0.000
+ 89.961 53.361 132.775-162.228
+ 90.235 48.933 111.314 -77.557
+ 93.260-107.212 109.094 -77.936
+ 96.499 144.779 0.000 0.000
+ 123.554 -86.178 135.262 -55.469
+ 118.716-112.591 116.755-122.637
+ 118.558-132.957 111.731-113.022
+ 119.359-118.221 112.698-111.713
+ 121.802 0.000 121.412 -80.973
+ # 133 total E -8.43407E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.931 122.910 144.527 -7.528
+ 91.495 87.354 133.908 -18.305
+ 91.436 41.993 129.029 110.470
+ 90.154 47.633 143.970 -90.523
+ 89.728 43.627 119.576-130.614
+ 90.280 53.575 132.020 30.676
+ 90.289 34.863 140.507 176.703
+ 92.354 58.689 129.201-131.580
+ 92.222 -59.062 133.553-109.130
+ 123.603 -64.145 0.000 0.000
+ 123.380 -7.767 0.000 0.000
+ 115.630 176.960 81.886 -80.610
+ 92.766 89.676 111.756 -71.817
+ 93.854 5.733 115.129 -76.193
+ 120.957 -22.479 0.000 0.000
+ 128.040 -85.761 88.707 -63.481
+ 116.910-106.965 113.975-117.892
+ 119.263-139.900 111.184-113.459
+ 93.189 79.418 102.989-108.973
+ 93.300 0.000 111.316 -78.079
+ # 134 total E -8.64118E+01 rmsd from N 0.000 %NC 0.00 1
+ 94.008 127.675 142.108 0.693
+ 91.403 88.912 136.589 -18.957
+ 90.807 46.644 121.162 107.014
+ 90.157 43.667 151.146 -94.073
+ 90.202 48.144 119.775-127.178
+ 90.791 52.801 125.305 33.357
+ 90.015 41.122 141.355-120.067
+ 91.251 61.890 128.548-136.531
+ 93.151-176.871 137.749-115.828
+ 94.864 153.988 0.000 0.000
+ 120.255 -3.314 0.000 0.000
+ 100.726-158.280 98.454-106.331
+ 125.065 175.736 134.068 138.396
+ 96.690 -66.502 112.631 -79.813
+ 94.634 41.018 0.000 0.000
+ 116.438 -84.208 136.968 48.530
+ 120.697-168.297 108.358-106.544
+ 123.586-143.810 117.851-119.500
+ 93.517 74.199 133.038-156.456
+ 93.306 0.000 112.981 -77.495
+ # 135 total E -8.70395E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.973 125.828 143.276 -3.123
+ 91.469 91.253 135.379 -17.612
+ 90.951 45.986 124.104 97.835
+ 89.628 47.332 142.610 -89.955
+ 89.543 45.035 121.978-133.860
+ 89.741 55.346 123.537 25.117
+ 89.919 36.770 146.997 173.569
+ 91.954 63.350 127.719-133.087
+ 92.201 -55.102 135.781-115.595
+ 122.199 -63.133 0.000 0.000
+ 121.795 -32.836 0.000 0.000
+ 111.720 161.085 89.465 -77.672
+ 93.285 81.487 135.131 122.635
+ 120.003 -42.885 117.738 -77.300
+ 94.632 87.574 0.000 0.000
+ 116.160 -64.740 120.735-113.888
+ 118.960-109.914 116.289-122.742
+ 119.933-135.840 107.904-106.427
+ 118.430-118.867 118.980-124.833
+ 121.916 0.000 121.574 -81.105
+ # 136 total E -8.44319E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.840 98.163 148.397 -7.151
+ 93.026 168.608 129.481 -32.010
+ 111.489 172.701 124.492-120.323
+ 124.940 168.172 159.966 -86.843
+ 91.774 72.284 132.225-127.282
+ 92.189 125.360 98.549 -74.391
+ 91.149 74.105 145.710 -95.770
+ 90.874 107.618 105.771-122.578
+ 91.323 -19.557 134.634-131.352
+ 98.335 -73.022 0.000 0.000
+ 96.275 -18.324 0.000 0.000
+ 92.998 105.162 133.816-157.969
+ 93.364 128.772 134.718-116.292
+ 121.020 -89.959 115.298 -89.429
+ 95.617 48.003 0.000 0.000
+ 124.341 -86.573 145.616 -47.695
+ 117.595-110.544 121.501-130.451
+ 124.099-152.181 113.828-110.963
+ 92.911 73.711 106.691-113.439
+ 93.328 0.000 110.187 -80.313
+ # 137 total E -8.55201E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.906 124.535 146.491 -6.030
+ 91.319 85.584 127.548 -19.417
+ 91.089 47.608 95.765 -83.359
+ 91.330 41.254 153.028-102.342
+ 90.630 43.940 120.048-116.538
+ 91.438 52.035 126.277 93.887
+ 90.224 67.069 136.276-133.511
+ 90.553 28.746 134.424-130.905
+ 93.273-113.456 142.288-115.387
+ 94.036 133.107 0.000 0.000
+ 110.322 5.123 0.000 0.000
+ 93.405 113.061 89.120 -87.307
+ 92.461 87.410 109.470 -78.351
+ 94.875 14.590 114.015 -78.035
+ 98.637 80.339 0.000 0.000
+ 133.155 -87.404 164.065 -95.069
+ 119.712-113.620 109.534-113.020
+ 119.033-141.984 114.235-115.485
+ 93.330 70.833 104.322-103.770
+ 93.313 0.000 112.958 -77.923
+ # 138 total E -8.43578E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.924 117.154 144.942 5.781
+ 92.335 153.426 136.728 -25.006
+ 90.996 96.175 129.812-111.659
+ 91.043 47.136 144.645-104.072
+ 89.952 43.225 88.682 -68.498
+ 91.305 75.401 110.169 -57.393
+ 90.533 50.522 154.206-159.010
+ 91.015 70.459 91.057 -88.975
+ 92.366 -80.916 106.513 -81.176
+ 95.711 170.361 0.000 0.000
+ 143.907 -53.983 0.000 0.000
+ 135.531 157.762 104.964 -94.519
+ 92.515 125.793 114.169 -76.397
+ 125.356 -67.664 128.602-131.682
+ 95.185 78.030 0.000 0.000
+ 120.162 -78.695 101.387 -74.114
+ 125.017-166.925 111.338-111.009
+ 110.287-147.376 132.038-146.760
+ 93.790 45.780 99.332 -90.439
+ 93.373 0.000 114.361 -79.756
+ # 139 total E -8.83592E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.898 122.210 146.215 -8.928
+ 91.281 86.418 128.067 -12.877
+ 90.562 49.577 96.311 -90.753
+ 89.543 44.378 151.337 -97.434
+ 90.003 46.941 123.145-127.576
+ 91.145 48.919 121.467 54.718
+ 90.632 43.383 128.446-146.363
+ 91.662 58.350 133.471-134.525
+ 92.680 166.609 139.716-132.252
+ 132.419 -84.532 0.000 0.000
+ 96.380 23.215 0.000 0.000
+ 93.831 58.337 99.120 -96.695
+ 92.468 -34.636 117.914 -75.438
+ 119.301-112.533 114.937 -78.818
+ 95.562 152.259 0.000 0.000
+ 118.956 -72.311 147.792 -20.822
+ 114.722-113.409 88.032 -86.446
+ 116.655-144.643 119.136-123.426
+ 93.540 71.929 134.173-159.838
+ 93.309 0.000 113.433 -77.374
+ # 140 total E -8.66918E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.939 93.308 139.425 -19.504
+ 93.189 112.407 152.634 -29.975
+ 132.711 -97.600 89.364 -98.406
+ 91.301 59.292 142.653-102.215
+ 89.478 42.293 113.898 -29.167
+ 89.079 55.523 148.579 110.063
+ 89.424 51.108 147.505 -35.731
+ 89.568 41.632 133.738-142.175
+ 91.163-118.937 141.130-111.142
+ 95.002 123.747 0.000 0.000
+ 94.506 40.339 0.000 0.000
+ 89.914 54.204 114.407-114.510
+ 88.992 92.553 125.950-168.710
+ 93.788 -41.608 112.082 -82.394
+ 97.913 86.927 0.000 0.000
+ 128.980 -85.916 141.386 -69.858
+ 121.066-111.673 109.469-111.790
+ 117.608-143.702 115.417-117.975
+ 93.792 52.914 102.244-108.484
+ 93.414 0.000 128.944-142.367
+ # 141 total E -8.56952E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.940 121.134 143.358 -8.941
+ 91.598 88.034 139.292 -17.710
+ 91.425 43.702 140.846 113.439
+ 90.721 47.036 144.354 -92.741
+ 89.759 47.525 122.249-126.931
+ 90.012 43.517 150.478 -35.191
+ 90.341 54.381 136.018-149.581
+ 90.771 42.158 124.046-102.838
+ 91.339-115.398 101.798 -81.753
+ 93.771 154.472 0.000 0.000
+ 92.833 47.016 0.000 0.000
+ 89.478 47.942 126.270-149.858
+ 90.544 52.589 111.896 -76.754
+ 93.205-112.634 112.433 -76.602
+ 95.424 157.758 0.000 0.000
+ 125.229 -85.909 140.722 -58.960
+ 118.459-111.092 115.702-121.912
+ 118.395-137.363 109.623-110.340
+ 117.753-118.707 124.101-130.347
+ 121.859 0.000 121.578 -80.993
+ # 142 total E -8.40226E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.727 108.637 153.291 -20.001
+ 93.020 128.531 137.708 -30.856
+ 123.516 -99.009 96.337 -93.815
+ 91.718 54.864 145.835-106.044
+ 90.192 44.302 121.534 -74.544
+ 91.038 46.179 115.775 -28.501
+ 90.997 46.849 143.772-102.277
+ 92.035 47.292 139.782-134.802
+ 93.150-114.470 110.122 -79.914
+ 94.467 161.435 0.000 0.000
+ 132.145 -37.517 0.000 0.000
+ 115.496 177.724 118.550-123.797
+ 122.391 179.942 121.689 -79.436
+ 96.395 -61.886 114.734 -77.313
+ 94.958 165.943 0.000 0.000
+ 129.558-108.560 105.553 -90.165
+ 117.984-109.629 115.701-122.420
+ 118.244-149.256 111.400-111.795
+ 93.964 34.617 95.074-104.414
+ 93.449 0.000 115.329 -81.806
+ # 143 total E -8.52114E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.876 123.863 147.903 -7.594
+ 91.436 84.145 128.650 -31.281
+ 91.664 45.416 94.473 -81.978
+ 90.930 42.869 149.809 -99.217
+ 90.443 45.267 118.661-115.453
+ 91.207 44.914 162.746 34.158
+ 90.470 54.951 128.927-143.432
+ 91.062 48.950 126.751-106.280
+ 92.311-116.730 111.959 -81.899
+ 95.316 157.540 0.000 0.000
+ 132.807 -56.842 0.000 0.000
+ 105.349 173.707 98.703 -91.179
+ 94.371 146.577 129.550 154.051
+ 112.958 -69.700 114.569 -80.676
+ 94.777 67.471 0.000 0.000
+ 122.398 -79.173 87.825 -66.817
+ 116.610-109.828 120.060-127.677
+ 122.258-141.325 112.043-109.174
+ 117.678-126.379 118.033-122.202
+ 122.843 0.000 123.397 -81.916
+ # 144 total E -8.59758E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.889 122.860 146.814 -8.607
+ 91.344 87.078 126.746 -22.724
+ 91.376 46.952 96.317 -87.763
+ 90.316 41.643 147.174 -97.286
+ 90.575 46.861 116.297-122.753
+ 90.863 48.028 136.496 61.818
+ 90.099 49.907 129.253-151.632
+ 90.809 41.576 135.558-134.142
+ 92.566-110.851 136.217-108.202
+ 123.864 -82.207 0.000 0.000
+ 109.364 -24.860 0.000 0.000
+ 91.374 87.513 104.025-105.741
+ 92.459 39.543 106.582 -77.683
+ 94.510-123.648 114.778 -79.280
+ 95.548 123.248 0.000 0.000
+ 122.517 -84.416 133.559 -42.590
+ 117.572-161.266 112.698-115.412
+ 121.002-166.434 128.554-133.683
+ 93.617 52.587 94.883 -90.161
+ 93.346 0.000 112.916 -79.693
+ # 145 total E -8.53606E+01 rmsd from N 0.000 %NC 0.00 1
+ 116.786 -84.105 147.540 -34.709
+ 91.386 83.545 128.228 -11.292
+ 91.047 47.237 98.322 -91.932
+ 89.782 45.126 152.509 -96.624
+ 90.113 46.715 123.728-125.248
+ 91.196 48.585 120.904 62.718
+ 90.799 43.292 128.186-144.625
+ 91.828 56.131 134.462-134.955
+ 93.136-176.759 141.750-133.321
+ 133.916 -69.749 0.000 0.000
+ 111.410 -6.467 0.000 0.000
+ 91.019 72.539 100.938 -97.099
+ 90.204 -0.091 107.595 -76.385
+ 107.766-135.210 103.607 -75.616
+ 94.733 122.598 0.000 0.000
+ 120.300 -71.698 140.822 -43.429
+ 114.804-131.495 90.694 -82.949
+ 106.845-172.561 130.529-146.682
+ 93.312 49.825 108.510-107.599
+ 93.346 0.000 113.351 -79.388
+ # 146 total E -8.43396E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.874 114.231 145.199 -16.007
+ 91.761 109.065 132.310 -28.555
+ 90.493 55.304 95.882 -89.192
+ 89.897 42.413 146.760 -95.878
+ 90.259 44.341 128.994-135.204
+ 90.883 47.192 144.964 111.949
+ 90.829 54.042 136.682 -55.206
+ 90.872 97.479 134.526-118.000
+ 91.850 -57.673 103.760 -83.906
+ 96.278 91.984 0.000 0.000
+ 138.996 -39.441 0.000 0.000
+ 123.026-151.994 116.436-116.694
+ 119.126 172.628 120.023 -80.035
+ 121.974 -86.133 117.023 -79.322
+ 95.011 160.516 0.000 0.000
+ 130.841 -80.095 156.509 -90.399
+ 117.507-107.245 114.433-120.926
+ 119.429-138.690 113.739-113.944
+ 93.545 76.905 130.744-153.746
+ 93.300 0.000 112.397 -77.491
+ # 147 total E -8.67136E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.774 86.457 147.647 -27.118
+ 92.850 117.706 146.352 -34.644
+ 134.096 -94.993 84.824 -98.686
+ 91.105 61.219 141.567-108.900
+ 89.972 41.762 115.228 -93.555
+ 90.564 55.801 152.715 21.456
+ 90.860 67.652 136.758 -47.399
+ 91.455 103.400 119.851-122.460
+ 91.305 -23.012 143.365-137.796
+ 99.690 -69.483 0.000 0.000
+ 98.639 -23.421 0.000 0.000
+ 93.057 102.821 103.938 -97.942
+ 93.765 113.616 119.067 -75.872
+ 118.404 -92.876 115.872 -85.273
+ 94.846 63.563 0.000 0.000
+ 130.287 -84.530 101.514 -64.793
+ 117.800-109.030 114.071-118.873
+ 119.876-137.916 116.737-116.740
+ 118.383-118.516 120.183-124.113
+ 121.915 0.000 121.453 -81.159
+ # 148 total E -8.72465E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.740 81.266 105.498 -76.817
+ 92.749 121.869 138.620 -45.518
+ 128.824 -93.478 90.864-102.201
+ 91.316 57.455 141.192-101.857
+ 89.958 36.915 116.246 -68.633
+ 91.124 55.011 147.464 -32.451
+ 90.544 43.835 133.510 156.712
+ 91.710 77.768 101.437 -93.869
+ 90.613 -61.454 133.036-139.440
+ 105.090 -63.669 0.000 0.000
+ 98.012 -33.222 0.000 0.000
+ 92.665 105.772 108.533 -96.023
+ 93.282 107.923 113.345 -77.379
+ 117.343 -75.277 118.703 -87.355
+ 95.137 80.719 0.000 0.000
+ 129.777 -70.124 121.463-124.042
+ 118.610-105.897 114.514-120.596
+ 118.775-153.224 107.440-106.747
+ 92.805 59.205 107.037-122.568
+ 93.347 0.000 110.763 -81.179
+ # 149 total E -8.61905E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.618 101.675 156.521 -31.283
+ 93.311 122.499 139.922 -45.305
+ 130.995 -99.317 90.619 -99.105
+ 92.513 56.832 147.652-107.616
+ 91.088 37.219 108.380 -87.398
+ 91.665 57.028 152.181 96.866
+ 90.484 39.437 145.586-127.057
+ 92.391 66.330 133.368-136.770
+ 91.108 -67.933 139.133-137.701
+ 109.884 -57.226 0.000 0.000
+ 107.130 -76.145 0.000 0.000
+ 92.321 65.971 134.226-161.606
+ 94.258 136.061 113.878 -76.522
+ 124.171 -96.191 119.006 -85.297
+ 95.513 67.595 0.000 0.000
+ 132.295 -86.773 109.898 -56.097
+ 117.898-102.096 124.865-133.080
+ 118.449-142.132 111.466-111.532
+ 93.208 54.908 99.924-112.140
+ 93.356 0.000 112.664 -80.211
+ # 150 total E -8.60309E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.916 129.593 147.499 -6.485
+ 107.835-175.994 139.298 -26.834
+ 109.772-167.205 116.209-124.875
+ 90.206 53.489 145.214-102.993
+ 89.242 43.014 113.722 -94.188
+ 90.852 56.489 146.185 -27.140
+ 90.130 40.260 137.307-161.065
+ 91.634 74.072 99.153 -97.285
+ 90.894 -55.089 133.635-138.517
+ 109.982 -72.235 0.000 0.000
+ 102.025 -26.289 0.000 0.000
+ 92.942 100.521 140.157-168.221
+ 93.169 103.058 114.616 -78.487
+ 122.991 -84.439 134.857-161.669
+ 96.045 77.335 0.000 0.000
+ 126.380 -79.811 139.553 -95.555
+ 119.418-111.854 114.984-120.221
+ 120.681-137.771 109.847-109.175
+ 117.655-118.713 123.410-128.042
+ 121.880 0.000 121.573 -81.040
+ # 151 total E -8.33415E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.920 124.689 145.772 -5.564
+ 91.401 86.143 129.038 -22.836
+ 91.833 46.244 98.033 -86.384
+ 90.900 40.491 150.513 -96.741
+ 90.474 48.793 116.851-116.717
+ 91.478 50.676 128.669 57.780
+ 90.366 45.966 130.309-145.000
+ 91.371 50.410 131.130-134.971
+ 93.176 166.123 141.254-116.820
+ 95.315 60.336 0.000 0.000
+ 125.855 -39.461 0.000 0.000
+ 114.057-149.714 126.649-135.011
+ 131.191-171.029 151.859-109.103
+ 93.816 62.343 115.702 -76.241
+ 124.122 -12.480 0.000 0.000
+ 112.918 -68.789 149.386 -35.523
+ 118.924-117.505 110.210-114.001
+ 122.335-162.749 117.986-117.338
+ 93.398 57.913 99.662-104.686
+ 93.340 0.000 112.256 -79.858
+ # 152 total E -8.99950E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.705 44.941 109.235 -81.158
+ 92.957 172.481 143.155 -20.332
+ 91.921 77.116 143.856 110.895
+ 89.829 48.527 145.785 -97.749
+ 89.338 44.951 112.805 -63.322
+ 90.504 51.858 157.926 -6.077
+ 90.550 42.334 135.846-163.971
+ 91.673 72.326 103.641 -98.625
+ 90.812 -60.308 130.568-136.080
+ 108.699 -69.471 0.000 0.000
+ 101.025 -26.830 0.000 0.000
+ 92.996 100.183 138.684-165.270
+ 93.335 107.437 115.443 -78.752
+ 124.189 -87.723 130.776-159.192
+ 95.583 73.611 0.000 0.000
+ 124.880 -80.122 131.723 -84.672
+ 118.781-110.959 116.390-122.495
+ 120.444-147.018 110.950-110.808
+ 93.056 85.452 101.032-107.819
+ 93.427 0.000 119.546-131.229
+ # 153 total E -8.80552E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.926 126.189 146.045 -3.409
+ 91.292 88.235 126.574 -19.268
+ 91.300 50.627 101.855 -91.767
+ 89.842 41.098 151.478-104.721
+ 90.012 49.057 119.003-120.791
+ 90.371 59.384 130.707 35.447
+ 90.041 39.283 131.261-156.787
+ 91.887 60.292 129.320-133.069
+ 92.318 -69.704 138.268-119.697
+ 118.773 -47.789 0.000 0.000
+ 119.608 -57.261 0.000 0.000
+ 111.508 152.075 131.351-143.868
+ 93.612 86.704 114.194 -76.735
+ 131.462-104.794 125.099 -84.508
+ 95.843 95.577 0.000 0.000
+ 132.472 -79.935 84.227 -78.682
+ 119.074-143.066 110.712-113.731
+ 127.435-167.230 114.685-110.373
+ 92.548 81.732 100.561-101.302
+ 93.332 0.000 108.932 -80.909
+ # 154 total E -8.58736E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.867 112.969 145.905 -15.417
+ 92.931 117.934 140.257 -32.125
+ 123.016 -90.561 92.670 -87.832
+ 90.473 60.329 143.424-116.109
+ 89.599 41.805 130.483-122.562
+ 89.359 60.677 123.338 16.697
+ 89.648 38.580 153.169-144.155
+ 91.419 63.528 126.140-138.922
+ 91.526 -54.228 136.216-115.799
+ 117.040 -85.441 0.000 0.000
+ 121.469 -58.910 0.000 0.000
+ 108.576 175.837 131.876-145.613
+ 94.031 74.353 114.941 -78.559
+ 93.296 -94.981 118.583 -76.471
+ 94.621 152.238 0.000 0.000
+ 131.282-109.082 139.572-106.216
+ 117.976-112.729 115.024-120.868
+ 119.230-168.758 116.811-118.795
+ 93.866 29.632 91.302 -79.431
+ 93.440 0.000 113.488 -82.330
+ # 155 total E -8.37963E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.862 92.147 145.608 -15.060
+ 91.448 67.185 132.262 -52.651
+ 90.835 53.078 171.933 17.596
+ 89.263 50.875 142.193 -84.418
+ 89.356 46.959 116.594-129.614
+ 89.607 50.366 126.022 -99.310
+ 90.018 55.804 141.711-152.379
+ 90.105 64.343 136.133-133.148
+ 91.543-154.089 136.821-132.262
+ 94.744 68.730 0.000 0.000
+ 91.573 49.085 0.000 0.000
+ 89.190 49.892 80.900 -82.422
+ 89.372 82.931 115.004 -78.019
+ 91.731 5.380 112.874 -78.799
+ 107.595 -75.876 0.000 0.000
+ 122.862-145.147 118.574 -33.662
+ 119.088-108.984 116.446-120.153
+ 117.502-112.649 110.501-110.710
+ 92.721 78.675 99.788-104.570
+ 93.266 0.000 107.139 -79.693
+ # 156 total E -8.42474E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.774 48.068 147.076 -28.653
+ 92.897 172.161 143.606 -20.703
+ 91.765 76.256 141.624 96.422
+ 89.354 43.865 143.969 -91.539
+ 89.718 48.783 102.676 -56.793
+ 89.891 54.072 131.388 58.393
+ 90.327 38.350 137.351-171.498
+ 92.438 57.121 128.341-131.918
+ 92.688 -56.185 144.149-121.317
+ 122.438 -62.012 0.000 0.000
+ 122.371 -23.432 0.000 0.000
+ 94.716 85.674 83.534 -82.557
+ 135.456 -89.946 149.801 2.535
+ 124.639 -59.017 118.064 -80.297
+ 95.412 71.187 0.000 0.000
+ 116.749 -79.880 83.447 -64.930
+ 116.570-112.397 112.458-114.634
+ 120.608-145.005 134.215-144.146
+ 92.689 75.372 100.888-100.662
+ 93.321 0.000 110.158 -79.995
+ # 157 total E -8.69597E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.791 98.566 147.372 -24.703
+ 93.145 118.224 146.855 -28.082
+ 129.014-103.246 89.484 -97.035
+ 91.775 62.434 144.951-111.352
+ 90.700 42.248 113.257 -85.566
+ 90.787 55.320 141.740 42.097
+ 90.156 40.467 136.930-142.651
+ 91.657 69.913 131.115-137.867
+ 91.787 -40.731 141.210-128.683
+ 116.092-155.332 0.000 0.000
+ 92.538 47.628 0.000 0.000
+ 89.554 49.344 97.805 -97.820
+ 89.343 46.998 110.315 -74.794
+ 93.822 179.981 114.095 -77.974
+ 94.421 113.209 0.000 0.000
+ 128.891 -78.830 106.068 -99.004
+ 118.016-108.697 114.617-120.829
+ 120.708-146.467 113.164-112.700
+ 93.649 58.104 98.088-108.210
+ 93.412 0.000 128.713-137.766
+ # 158 total E -8.43022E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.855 118.674 147.543 -13.125
+ 91.639 88.030 132.929 -18.112
+ 91.038 45.348 90.958 -86.166
+ 90.234 44.274 140.995 -96.096
+ 89.612 50.090 122.201-125.136
+ 90.433 49.743 116.313 -4.235
+ 90.894 75.485 151.099-125.360
+ 91.560 9.429 85.870 -84.158
+ 98.869-111.494 97.813 -79.483
+ 93.544 154.874 0.000 0.000
+ 122.895 -21.663 0.000 0.000
+ 113.350-152.978 86.452 -83.366
+ 137.686 164.922 121.536 -81.138
+ 96.256 -1.932 113.891 -77.330
+ 97.294 85.082 0.000 0.000
+ 126.636 -63.942 117.524-117.221
+ 113.547-109.616 89.817-106.780
+ 120.570-136.889 111.762-110.750
+ 93.698 78.277 125.887-147.983
+ 93.297 0.000 111.812 -77.703
+ # 159 total E -8.50387E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.851 110.749 147.249 -12.421
+ 91.613 80.945 136.528 -28.271
+ 91.498 45.022 136.097 -91.639
+ 91.326 46.594 142.760 -97.015
+ 90.699 44.210 117.650-123.628
+ 91.182 51.643 109.734 -66.192
+ 90.436 64.329 145.066-135.468
+ 90.295 26.834 92.046 -75.007
+ 94.244-110.645 99.587 -85.839
+ 93.657 157.206 0.000 0.000
+ 146.931 -32.669 0.000 0.000
+ 115.146-140.139 88.951 -80.409
+ 109.381-161.440 118.515 -77.245
+ 133.004 -65.627 125.527-141.979
+ 96.317 68.111 0.000 0.000
+ 120.584 -90.677 83.396 -92.848
+ 117.939-111.684 118.905-126.310
+ 114.870-132.351 146.326-166.469
+ 93.872 56.342 98.839-100.368
+ 93.330 0.000 116.242 -76.876
+ # 160 total E -8.38550E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.870 120.543 147.314 -10.584
+ 91.407 85.745 127.607 -19.112
+ 91.056 46.589 92.947 -86.972
+ 90.741 44.482 147.045 -95.545
+ 90.487 43.193 120.079-122.469
+ 91.199 53.101 152.731 43.994
+ 91.533 77.991 131.750-164.827
+ 92.600 -60.924 131.759-131.057
+ 112.763 173.440 149.647 -15.517
+ 135.244 -70.598 0.000 0.000
+ 97.496 -14.142 0.000 0.000
+ 92.224 98.914 98.926 -98.055
+ 93.230 144.321 136.260 -13.285
+ 94.808 -28.051 118.276-159.492
+ 97.401 93.041 0.000 0.000
+ 129.246 -77.750 98.803 -60.900
+ 116.232-104.078 119.372-125.524
+ 120.282-139.806 116.753-116.641
+ 93.447 75.076 99.182-108.506
+ 93.308 0.000 111.968 -78.218
+ # 161 total E -8.90750E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.797 83.696 146.442 -26.280
+ 92.944 118.291 148.790 -31.794
+ 134.466 -96.570 86.772-100.326
+ 91.612 59.473 143.078-105.496
+ 90.253 44.329 116.168 -58.211
+ 90.568 52.255 155.193 37.991
+ 90.908 65.050 131.360 -55.071
+ 91.821 102.831 134.107-130.656
+ 91.200 -24.914 146.321-131.863
+ 101.501 -71.329 0.000 0.000
+ 98.766 -21.598 0.000 0.000
+ 93.309 102.339 134.415-157.703
+ 94.090 112.110 119.581 -75.273
+ 120.965 -98.769 117.921 -83.727
+ 95.191 63.719 0.000 0.000
+ 129.910 -86.016 101.160 -62.397
+ 117.268-111.394 114.506-119.540
+ 122.497-149.126 113.213-111.411
+ 92.266 80.464 106.859-116.770
+ 93.323 0.000 108.306 -81.114
+ # 162 total E -8.71204E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.890 113.890 145.478 -10.296
+ 91.476 77.738 127.265 -29.804
+ 93.040 36.425 154.664 110.423
+ 92.899 51.306 141.743 -85.649
+ 90.689 38.874 117.849-123.911
+ 91.180 54.438 119.082 -46.107
+ 90.225 43.642 152.764-154.404
+ 91.338 57.618 136.423-135.382
+ 91.837 -87.133 136.946-112.052
+ 116.196 -60.005 0.000 0.000
+ 112.923 -60.735 0.000 0.000
+ 127.122 148.114 114.301-111.956
+ 94.560 76.808 114.067 -76.972
+ 94.547 -84.584 113.094 -77.560
+ 93.148 152.533 0.000 0.000
+ 131.914 -72.527 150.986-101.553
+ 114.554-104.961 110.377-117.943
+ 119.391-136.625 111.009-109.258
+ 93.608 79.831 125.961-147.694
+ 93.295 0.000 111.337 -77.856
+ # 163 total E -8.78942E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.708 92.822 151.257 -29.414
+ 92.946 123.956 141.529 -45.761
+ 135.752 -93.631 84.440 -99.885
+ 90.162 64.426 146.290-110.723
+ 88.983 55.934 118.995 -31.698
+ 88.219 61.664 95.550 -56.053
+ 89.110 49.078 152.971-107.960
+ 89.187 50.528 119.395-145.124
+ 91.494-166.706 139.454-117.657
+ 95.195 75.380 0.000 0.000
+ 93.873 44.418 0.000 0.000
+ 89.701 50.274 102.281 -94.950
+ 89.898 75.187 116.317 -79.719
+ 93.225 22.130 112.832 -78.707
+ 97.263 65.400 0.000 0.000
+ 130.741 -91.981 134.471 -88.095
+ 118.271-111.662 119.727-128.213
+ 108.812-160.388 98.287 -95.202
+ 94.242 27.471 93.442-104.300
+ 93.475 0.000 116.977 -81.394
+ # 164 total E -8.37097E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.859 79.891 145.937 -15.715
+ 92.979 167.992 139.060 -38.848
+ 107.555 168.970 116.907 -73.129
+ 91.654 68.123 136.239-108.323
+ 90.200 43.511 126.089-129.331
+ 91.240 54.591 124.928 16.487
+ 90.803 33.452 142.603-134.673
+ 92.715 62.474 127.919-134.892
+ 92.375 -48.521 132.578-108.910
+ 122.726-143.540 0.000 0.000
+ 110.875 -25.687 0.000 0.000
+ 91.443 76.731 102.007-100.985
+ 91.514 39.751 106.908 -76.666
+ 92.956-128.885 117.799 -78.382
+ 96.655 134.180 0.000 0.000
+ 117.514 -82.067 138.489 -26.707
+ 114.064-162.615 118.285-124.644
+ 112.359-165.846 135.438-150.540
+ 93.607 73.582 102.650 -98.890
+ 93.311 0.000 113.518 -77.392
+ # 165 total E -8.37996E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.717 97.886 151.193 -27.703
+ 93.108 121.962 140.604 -35.220
+ 129.498-100.230 95.190-100.104
+ 92.758 52.669 159.224-137.522
+ 90.835 43.987 107.751 -38.826
+ 91.564 51.403 144.084 78.463
+ 90.960 39.219 135.336-119.281
+ 92.115 55.266 132.877-143.082
+ 93.932-173.116 145.160 -23.452
+ 93.790 126.084 0.000 0.000
+ 122.197 -20.320 0.000 0.000
+ 93.508 95.315 131.656-154.732
+ 124.306-102.247 114.369 -77.420
+ 130.095 -88.091 119.636 -80.353
+ 95.898 169.295 0.000 0.000
+ 129.030 -85.555 114.931-112.878
+ 118.793-109.107 114.554-120.568
+ 118.309-146.471 110.905-111.421
+ 116.020-120.239 127.341-138.088
+ 121.832 0.000 122.148 -80.632
+ # 166 total E -8.55959E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.856 126.796 149.285 -12.622
+ 115.245 177.840 149.847 -21.101
+ 92.641 72.061 135.760 110.877
+ 90.011 40.144 151.246 -95.589
+ 89.533 50.816 118.727 -55.464
+ 89.982 52.464 118.191 41.244
+ 90.192 44.464 141.482-137.955
+ 91.991 64.112 128.553-135.977
+ 91.900 -68.150 141.261-126.017
+ 115.445 -53.303 0.000 0.000
+ 117.028 -51.872 0.000 0.000
+ 107.438 105.061 142.609-164.547
+ 92.662 117.023 117.957 -75.983
+ 126.039 -90.651 111.736 -81.435
+ 94.262 70.408 0.000 0.000
+ 123.172 -75.707 121.515 -83.205
+ 119.877-119.323 108.343-110.994
+ 120.609-162.442 117.331-119.072
+ 93.528 53.075 98.153 -98.830
+ 93.350 0.000 112.098 -80.391
+ # 167 total E -8.81473E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.702 40.181 108.962 -81.500
+ 92.992 173.043 143.241 -19.810
+ 91.658 77.455 140.539 105.050
+ 89.625 43.439 149.471 -93.620
+ 89.981 48.435 101.148 -59.697
+ 90.587 48.862 155.857 44.178
+ 90.610 44.468 135.457-138.416
+ 92.356 70.189 132.677-135.654
+ 91.414 -71.023 138.408-112.548
+ 109.016 -50.335 0.000 0.000
+ 118.984 -56.532 0.000 0.000
+ 93.428 78.164 139.743-167.395
+ 93.307 111.019 113.163 -76.533
+ 94.408 -74.145 138.391-157.839
+ 97.026 85.967 0.000 0.000
+ 130.478 -85.345 141.079 -53.209
+ 120.958-111.677 112.033-114.821
+ 119.355-141.398 115.819-117.912
+ 93.318 67.814 102.099-103.966
+ 93.321 0.000 112.770 -78.467
+ # 168 total E -8.94459E+01 rmsd from N 0.000 %NC 0.00 1
+ 118.448 -86.551 111.190 -81.218
+ 113.390-164.794 152.643 -15.987
+ 93.297 65.573 132.079 119.390
+ 90.142 46.417 148.152 -97.369
+ 89.674 45.737 112.485 -67.825
+ 90.574 51.155 160.484 -0.323
+ 90.604 42.124 134.483-161.799
+ 91.777 72.024 103.473 -98.997
+ 90.832 -61.617 130.338-135.551
+ 108.292 -69.236 0.000 0.000
+ 100.685 -26.926 0.000 0.000
+ 93.089 100.642 137.669-163.605
+ 93.422 107.600 115.627 -78.722
+ 124.439 -89.859 130.092-157.654
+ 95.490 74.248 0.000 0.000
+ 125.266 -76.873 129.250 -81.658
+ 119.338-112.100 111.499-116.175
+ 120.051-147.402 112.115-112.911
+ 93.105 84.414 101.207-105.682
+ 93.426 0.000 120.328-131.486
+ # 169 total E -8.46752E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.929 93.813 139.977 -19.735
+ 93.197 112.054 150.553 -30.900
+ 132.590 -98.965 89.365 -98.324
+ 91.241 60.279 146.133-113.974
+ 89.244 42.073 113.122 -28.573
+ 88.928 57.115 149.884 107.383
+ 89.235 51.455 144.567 -39.355
+ 89.410 41.709 131.323-142.204
+ 91.145-119.001 141.174-112.382
+ 95.131 123.113 0.000 0.000
+ 94.594 39.783 0.000 0.000
+ 90.009 55.005 114.504-114.527
+ 88.914 91.840 125.684-170.470
+ 93.809 -40.849 111.918 -82.448
+ 98.027 87.232 0.000 0.000
+ 129.027 -85.315 143.170 -72.469
+ 121.008-111.900 110.791-113.854
+ 118.602-141.471 112.599-113.719
+ 120.065-110.070 114.690-116.053
+ 120.668 0.000 119.753 -79.687
+ # 170 total E -8.40841E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.865 119.789 146.840 -10.621
+ 91.546 84.243 138.391 -27.199
+ 90.881 47.506 121.009 114.124
+ 89.825 43.235 148.077 -89.910
+ 90.208 49.795 119.249-123.055
+ 90.292 48.545 148.816 47.803
+ 90.103 54.778 135.382-140.732
+ 91.285 80.293 135.377-133.625
+ 91.725 -80.924 142.610-133.323
+ 130.870 -81.323 0.000 0.000
+ 111.061 -19.868 0.000 0.000
+ 92.352 95.004 102.180-102.929
+ 92.439 139.593 109.355 -78.304
+ 132.397 174.161 119.395 -89.966
+ 95.761 70.567 0.000 0.000
+ 112.109 -56.467 138.627 -71.056
+ 109.388-146.734 94.619 -98.057
+ 131.390-168.807 115.691-110.926
+ 93.389 67.722 98.116 -99.623
+ 93.302 0.000 114.308 -77.104
+ # 171 total E -8.54774E+01 rmsd from N 0.000 %NC 0.00 1
+ 115.917-174.807 152.433 -21.722
+ 116.867-120.494 144.083 -27.680
+ 91.864 54.928 124.957 118.350
+ 90.426 42.546 148.826 -95.797
+ 90.257 45.991 103.293 -61.471
+ 90.327 50.518 165.527 41.997
+ 90.364 46.103 140.106-141.732
+ 91.928 82.012 132.790-135.313
+ 91.813 -60.987 143.658-125.024
+ 118.778 -23.559 0.000 0.000
+ 118.162 -48.028 0.000 0.000
+ 96.365 -39.044 92.442 -90.728
+ 91.322 111.349 135.400 -41.348
+ 94.906 23.315 113.607 -79.913
+ 96.254 68.727 0.000 0.000
+ 122.726 -78.132 114.847-129.157
+ 116.111-107.444 120.079-130.277
+ 112.197-139.387 102.035 -83.369
+ 93.487 85.120 128.754-152.881
+ 93.282 0.000 110.692 -77.418
+ # 172 total E -8.48737E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.872 120.211 147.059 -11.079
+ 91.319 85.526 127.492 -14.662
+ 90.865 46.006 93.353 -89.314
+ 90.205 45.671 147.330 -96.703
+ 89.980 43.246 120.922-127.592
+ 91.017 49.439 136.566 28.747
+ 90.290 44.410 132.160-160.351
+ 92.136 79.141 135.947-134.047
+ 91.155 -96.927 141.031-126.742
+ 95.819 53.541 0.000 0.000
+ 146.920 -71.691 0.000 0.000
+ 126.714 166.091 111.788-108.501
+ 93.470 94.091 117.685 -75.258
+ 95.692 4.457 115.472 -80.059
+ 98.327 74.553 0.000 0.000
+ 133.585 -80.829 154.695 -65.791
+ 117.422-109.291 115.076-121.716
+ 120.098-145.753 113.671-113.893
+ 93.055 58.918 100.174-102.652
+ 93.348 0.000 111.386 -80.707
+ # 173 total E -8.33747E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.886 75.895 141.740 -23.231
+ 92.627 128.759 142.482 -39.407
+ 130.917-103.575 84.839-103.685
+ 91.581 64.508 144.627-104.283
+ 90.473 43.430 106.519 -89.381
+ 91.845 55.032 126.723 43.254
+ 90.706 36.127 132.622-146.063
+ 92.480 65.747 130.152-135.651
+ 93.364 161.307 138.206-130.439
+ 133.225 -82.728 0.000 0.000
+ 96.922 19.475 0.000 0.000
+ 94.058 61.114 99.480 -96.862
+ 92.277 -32.261 118.922 -75.519
+ 118.241-107.655 115.720 -79.086
+ 95.918 148.637 0.000 0.000
+ 121.116 -75.384 146.323 -18.430
+ 113.462-111.456 92.395 -88.187
+ 118.034-143.928 122.347-127.361
+ 93.363 72.776 136.692-162.733
+ 93.307 0.000 113.420 -77.282
+ # 174 total E -8.74112E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.990 124.836 141.906 -4.244
+ 91.500 90.534 136.517 -14.752
+ 90.987 47.442 131.926 96.629
+ 90.217 42.322 148.370 -97.762
+ 90.350 52.622 122.269-127.600
+ 91.688 51.071 132.154 21.211
+ 91.608 118.039 137.265-121.948
+ 87.867 -38.959 110.562-120.983
+ 90.534 -56.069 141.592-123.285
+ 95.223 3.907 0.000 0.000
+ 115.019 -46.398 0.000 0.000
+ 92.556 -37.249 95.539 -95.677
+ 93.018 97.011 113.995 -76.437
+ 131.240-116.676 116.897 -84.434
+ 95.431 160.314 0.000 0.000
+ 126.889 -77.039 116.997 -62.969
+ 116.895-104.997 119.716-127.290
+ 118.984-149.849 110.079-110.872
+ 93.065 77.738 102.577-113.526
+ 93.428 0.000 121.344-137.392
+ # 175 total E -8.36259E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.861 98.525 144.439 -19.686
+ 92.449 128.407 155.799-107.062
+ 130.151 -84.034 86.893 -94.916
+ 91.152 52.819 144.492-111.332
+ 90.330 38.542 120.003-103.067
+ 91.272 61.421 137.281 -21.625
+ 89.918 44.436 144.258-150.705
+ 90.612 71.944 87.782 -78.171
+ 91.000 -94.765 135.436-122.615
+ 95.265 128.149 0.000 0.000
+ 135.203 -57.345 0.000 0.000
+ 121.106-175.588 124.683-128.255
+ 93.692 107.878 114.947 -77.734
+ 125.782-100.924 112.961 -81.700
+ 95.606 88.407 0.000 0.000
+ 129.141 -80.054 89.350 -64.900
+ 117.128-106.843 121.770-129.478
+ 122.464-138.777 107.795-103.562
+ 92.832 75.003 93.354-106.179
+ 93.319 0.000 109.830 -80.155
+ # 176 total E -8.64295E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.773 104.362 149.559 -21.690
+ 92.874 125.109 150.398 -40.822
+ 128.877 -91.264 91.085 -94.418
+ 91.463 55.096 147.736-115.004
+ 89.845 41.861 127.379 -73.855
+ 89.702 58.981 124.602 -30.951
+ 89.693 40.952 147.548-135.629
+ 91.053 65.473 127.106-138.831
+ 91.398 -52.973 136.359-120.401
+ 119.382 -70.277 0.000 0.000
+ 131.997 -56.155 0.000 0.000
+ 117.217 170.747 134.584-144.964
+ 93.057 90.292 112.807 -77.591
+ 125.001-106.370 119.594 -85.115
+ 96.653 87.909 0.000 0.000
+ 135.804 -91.185 126.731-111.309
+ 120.017-108.068 117.675-123.539
+ 118.613-151.235 113.430-114.865
+ 93.778 36.187 89.900 -86.501
+ 93.434 0.000 113.142 -82.784
+ # 177 total E -8.43578E+01 rmsd from N 0.000 %NC 0.00 1
+ 119.660-120.479 108.369 -77.877
+ 116.988-104.411 147.454 -37.404
+ 91.410 54.524 128.740 93.339
+ 91.206 40.647 147.986 -95.655
+ 90.972 47.369 117.726 -91.600
+ 91.615 48.882 134.969 38.237
+ 90.756 39.303 141.140-102.111
+ 92.036 59.075 130.616-132.795
+ 92.663 -80.266 129.045-127.447
+ 125.140 -67.320 0.000 0.000
+ 135.994 -33.147 0.000 0.000
+ 108.841 -30.139 92.554 -81.839
+ 90.570 93.290 129.877 151.142
+ 91.506 -0.564 102.319 -80.149
+ 116.537 -10.696 0.000 0.000
+ 130.445 -74.296 131.262 -54.930
+ 120.388-135.872 109.151-108.664
+ 119.813-112.158 114.713-116.504
+ 117.466-118.705 125.347-132.654
+ 121.845 0.000 121.597 -80.964
+ # 178 total E -8.42912E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.913 108.669 144.898 -0.061
+ 92.722 162.180 138.637 -29.498
+ 91.348 87.597 97.183 -76.252
+ 90.367 51.964 141.474-107.356
+ 90.373 46.066 86.505 -64.926
+ 92.052 67.247 105.295 -67.479
+ 91.609 151.983 152.033-135.914
+ 92.294 90.222 134.054-119.212
+ 91.919 -74.374 103.942 -82.787
+ 94.562 165.621 0.000 0.000
+ 134.335 -47.458 0.000 0.000
+ 109.156-164.649 95.222 -88.940
+ 93.302 90.665 114.528 -76.426
+ 112.719 -93.503 115.353 -79.595
+ 94.805 165.159 0.000 0.000
+ 134.113 -76.208 158.376-106.762
+ 117.982-105.622 116.314-123.149
+ 120.791-144.904 112.435-112.222
+ 92.727 59.480 96.063-105.645
+ 93.357 0.000 108.405 -83.297
+ # 179 total E -8.46944E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.968 126.356 143.791 -2.304
+ 91.430 92.451 135.906 -12.548
+ 90.484 46.409 99.389 -74.260
+ 90.302 47.697 146.150 -99.788
+ 89.649 49.664 124.436-137.222
+ 89.402 63.654 115.213 -45.713
+ 89.827 42.070 151.246-121.734
+ 91.280 63.869 86.081 -73.667
+ 92.055-102.522 138.864-115.489
+ 94.579 139.157 0.000 0.000
+ 115.776 -23.090 0.000 0.000
+ 92.141 78.926 88.879 -69.720
+ 90.678 97.144 111.983 -77.798
+ 93.477 -41.883 119.853-142.994
+ 96.802 93.235 0.000 0.000
+ 129.801 -78.781 116.765-128.289
+ 120.143-109.537 117.380-123.155
+ 120.433-142.509 112.096-111.972
+ 93.169 41.416 98.463 -96.837
+ 93.418 0.000 113.360 -82.108
+ # 180 total E -8.73086E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.877 120.767 146.918 -10.680
+ 91.354 86.240 128.971 -14.793
+ 90.801 45.914 93.614 -88.222
+ 90.173 45.697 147.008 -96.801
+ 90.128 42.918 120.999-128.759
+ 90.956 48.375 144.726 28.598
+ 90.398 43.792 131.376-158.960
+ 92.049 75.434 136.903-133.800
+ 90.632 -95.456 138.418-123.165
+ 95.529 51.309 0.000 0.000
+ 150.421 -71.173 0.000 0.000
+ 129.961 164.298 105.076 -96.212
+ 93.986 81.220 111.225 -80.021
+ 121.358 -47.797 124.855 -80.293
+ 95.703 89.106 0.000 0.000
+ 123.703 -75.833 113.257-111.785
+ 119.443-115.981 116.839-123.490
+ 107.220-172.557 95.987 -95.042
+ 92.396 52.852 98.083-105.927
+ 93.366 0.000 106.426 -85.293
+ # 181 total E -8.50602E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.968 125.597 143.452 -3.531
+ 91.492 89.321 136.100 -19.942
+ 90.901 48.130 127.125 100.207
+ 89.926 43.880 147.636 -91.602
+ 89.802 46.998 119.976-127.019
+ 90.205 57.298 117.382 25.896
+ 89.748 39.487 148.846-144.930
+ 91.583 66.578 125.753-135.737
+ 92.053 -57.264 138.587-122.497
+ 122.790 -61.263 0.000 0.000
+ 115.681 -16.206 0.000 0.000
+ 104.750 -39.208 92.699 -83.720
+ 94.854 -22.793 109.168 -73.497
+ 108.881 -60.619 115.310 -77.407
+ 95.097 75.587 0.000 0.000
+ 125.721 -81.732 88.959 -63.989
+ 116.963-109.313 114.483-118.192
+ 117.339-140.553 131.963-141.109
+ 93.414 67.910 102.472-101.722
+ 93.317 0.000 113.404 -77.901
+ # 182 total E -8.50551E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.767 96.296 148.666 -25.784
+ 93.059 122.469 142.783 -30.429
+ 129.281-100.409 94.700 -99.394
+ 92.800 53.669 159.672-141.602
+ 90.231 44.663 108.633 -36.779
+ 90.573 50.898 147.445 85.477
+ 90.402 66.454 138.045-123.276
+ 91.024 22.474 132.837-127.774
+ 94.284-105.974 110.136 -80.960
+ 116.166 -63.002 0.000 0.000
+ 99.438 -37.673 0.000 0.000
+ 92.224 -45.383 95.248 -89.319
+ 92.290 94.842 114.108 -76.244
+ 126.448-105.874 116.772 -83.392
+ 125.091-177.524 0.000 0.000
+ 130.615 -85.197 128.008 -97.020
+ 118.987-110.868 113.264-118.601
+ 120.275-150.364 114.187-114.486
+ 93.519 42.802 101.176-107.732
+ 93.382 0.000 114.443 -80.013
+ # 183 total E -8.76033E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.935 122.577 144.160 -8.037
+ 91.521 89.425 134.354 -16.316
+ 90.863 44.880 131.770 108.246
+ 90.194 45.858 142.875 -89.754
+ 89.637 43.312 122.571-131.659
+ 90.142 54.713 138.634 4.800
+ 90.365 41.265 144.425 165.757
+ 91.983 73.549 130.112-134.423
+ 92.298 -79.580 136.031-123.416
+ 95.025 170.504 0.000 0.000
+ 148.948 -39.665 0.000 0.000
+ 90.142 53.112 131.730-160.761
+ 90.363 50.803 111.311 -77.688
+ 93.330-107.441 109.665 -78.677
+ 96.263 141.796 0.000 0.000
+ 124.699 -85.139 133.084 -57.506
+ 118.085-110.211 116.797-122.877
+ 118.120-141.740 113.362-115.393
+ 93.325 66.637 103.043 -99.124
+ 93.323 0.000 112.821 -78.568
+ # 184 total E -9.01936E+01 rmsd from N 0.000 %NC 0.00 1
+ 94.019 116.823 138.396 -7.317
+ 91.485 79.857 147.000 -13.425
+ 89.270 49.659 114.820 -64.906
+ 89.567 43.136 168.546-161.036
+ 89.606 46.403 134.286-109.267
+ 89.709 56.911 112.099 23.707
+ 90.098 37.621 143.436-129.144
+ 92.025 69.586 126.811-141.065
+ 93.139 -46.200 139.187-121.507
+ 129.581-145.659 0.000 0.000
+ 92.151 45.053 0.000 0.000
+ 91.960 64.266 97.743 -96.662
+ 92.622 -46.464 134.218-121.280
+ 121.525-163.400 124.295 -77.674
+ 128.890-177.842 0.000 0.000
+ 129.267 -81.486 111.766-126.669
+ 119.326-110.198 116.014-121.388
+ 119.189-138.753 109.860-109.070
+ 93.143 80.276 104.539-115.074
+ 93.297 0.000 111.230 -77.975
+ # 185 total E -8.70595E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.806 79.843 147.785 -20.600
+ 91.791 80.247 149.284-132.116
+ 89.958 79.257 123.464 -34.131
+ 89.941 49.456 137.909 -97.957
+ 89.546 42.889 108.474-108.529
+ 90.117 60.614 103.701-133.448
+ 89.701 61.007 146.817 -32.597
+ 89.721 74.130 129.994-141.036
+ 91.252-153.219 134.975-114.676
+ 95.399 67.774 0.000 0.000
+ 92.937 42.679 0.000 0.000
+ 89.849 52.151 88.006 -68.907
+ 89.547 71.813 115.599 -74.122
+ 92.526 22.515 122.484-140.932
+ 97.168 71.194 0.000 0.000
+ 130.688 -88.909 126.968 -70.554
+ 118.961-123.707 110.493-114.261
+ 121.617-169.719 115.154-115.578
+ 93.241 53.203 102.331 -96.022
+ 93.350 0.000 111.321 -80.960
+ # 186 total E -8.40936E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.763 98.899 149.057 -25.252
+ 93.212 122.514 143.799 -29.221
+ 125.648-100.439 90.580 -99.038
+ 92.030 58.684 144.778-118.776
+ 90.249 41.650 110.961 -34.742
+ 90.640 50.532 147.707 102.636
+ 90.649 48.877 145.751-118.312
+ 91.413 48.087 137.279-141.549
+ 92.243-115.964 140.207-108.474
+ 93.675 125.558 0.000 0.000
+ 107.979 -0.981 0.000 0.000
+ 101.911-173.904 89.264 -93.448
+ 117.630 175.442 142.953-165.230
+ 121.696 -61.885 116.467 -83.097
+ 113.033 -11.768 0.000 0.000
+ 113.645 -81.066 97.877 -59.319
+ 117.433-112.819 119.049-124.052
+ 117.990-111.742 110.151-111.058
+ 92.376 89.611 130.483-154.215
+ 93.098 0.000 101.261 -76.751
+ # 187 total E -8.49276E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.831 94.614 147.484 -14.805
+ 91.380 71.029 141.462 -51.233
+ 90.321 61.327 125.122 103.938
+ 89.182 48.550 148.641 -91.140
+ 90.459 43.908 109.278 -58.827
+ 90.539 51.194 151.736 55.938
+ 90.466 43.156 138.238-142.858
+ 92.135 67.745 135.005-136.430
+ 90.975 -67.451 140.634-118.177
+ 109.964 -62.939 0.000 0.000
+ 112.505 -67.152 0.000 0.000
+ 92.280 67.331 131.835-157.670
+ 93.341 110.548 113.438 -76.472
+ 92.436 -53.773 117.514 -81.611
+ 110.413 -27.846 0.000 0.000
+ 128.520 -85.084 115.662 -57.239
+ 116.863-110.202 115.370-122.222
+ 119.419-140.632 110.136-109.074
+ 117.488-119.559 128.427-137.368
+ 121.751 0.000 121.986 -80.565
+ # 188 total E -8.41066E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.932 126.895 145.966 -1.907
+ 91.274 85.906 130.755 -1.293
+ 89.445 56.823 97.954 -85.836
+ 90.769 38.434 164.172-122.601
+ 90.718 48.939 129.578-121.820
+ 92.319 61.704 132.977 87.117
+ 91.331 134.195 136.642-130.707
+ 92.200 79.489 125.361-140.262
+ 92.511 -83.377 104.712 -82.274
+ 94.667 164.255 0.000 0.000
+ 132.537 -54.842 0.000 0.000
+ 93.138 83.739 92.526 -73.193
+ 139.709-171.939 119.894 -87.307
+ 117.275 -59.491 116.811 -77.431
+ 95.689 73.960 0.000 0.000
+ 123.815 -80.154 120.491-132.314
+ 121.641-161.474 113.417-116.592
+ 119.967-111.238 110.520-107.939
+ 93.139 82.829 131.816-155.488
+ 93.212 0.000 107.242 -77.205
+ # 189 total E -8.80260E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.887 121.734 146.737 -9.040
+ 91.314 84.322 126.215 -18.136
+ 91.132 47.284 94.443 -88.869
+ 90.447 43.021 151.442 -97.619
+ 90.059 45.720 118.323-121.051
+ 91.298 52.387 125.768 37.496
+ 90.344 42.288 133.147-147.812
+ 91.163 56.597 130.412-132.779
+ 92.703 178.475 130.513-130.288
+ 136.945 -69.357 0.000 0.000
+ 108.564 -8.374 0.000 0.000
+ 91.715 76.962 100.899 -96.962
+ 90.922 -7.710 109.809 -76.553
+ 106.660-119.572 110.672 -77.507
+ 95.274 142.371 0.000 0.000
+ 126.726 -84.553 152.131 -14.342
+ 114.583-112.116 91.337 -88.157
+ 117.169-141.903 122.451-128.097
+ 93.384 72.031 136.123-161.032
+ 93.308 0.000 113.416 -77.351
+ # 190 total E -8.40697E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.930 123.609 144.829 -7.004
+ 91.536 89.137 134.605 -16.711
+ 90.506 49.519 97.226 -86.515
+ 89.834 42.913 150.165 -99.127
+ 90.105 45.738 122.274-127.123
+ 90.992 51.869 123.027 54.802
+ 90.387 42.628 129.941-153.325
+ 92.275 65.058 131.252-134.836
+ 92.096 -62.052 142.774-139.270
+ 114.600-164.713 0.000 0.000
+ 94.058 45.291 0.000 0.000
+ 90.291 45.440 99.716 -99.565
+ 90.913-167.381 111.227 -77.854
+ 107.586 158.423 127.403-179.785
+ 95.351 83.457 0.000 0.000
+ 136.373 -85.253 108.494 -61.467
+ 117.204-107.197 108.216-111.067
+ 115.580-143.985 116.248-120.049
+ 93.713 73.297 132.263-158.339
+ 93.306 0.000 113.385 -77.248
+ # 191 total E -8.47248E+01 rmsd from N 0.000 %NC 0.00 1
+ 94.005 126.485 141.746 -1.692
+ 91.447 90.160 135.588 -16.701
+ 90.847 48.802 126.295 108.087
+ 90.106 42.793 149.403 -92.167
+ 90.200 48.608 121.111-127.929
+ 90.400 48.503 151.440 38.273
+ 90.108 49.012 138.333-129.350
+ 90.822 61.357 134.336-134.921
+ 91.673-124.751 134.137-110.836
+ 94.973 133.425 0.000 0.000
+ 133.777 -56.287 0.000 0.000
+ 100.877 174.938 97.416 -86.498
+ 93.687 100.935 130.689-179.565
+ 93.632 -16.319 113.406 -77.464
+ 124.258 -38.961 0.000 0.000
+ 123.917 -79.734 134.535 73.967
+ 118.411-110.347 120.000-126.873
+ 118.522-139.619 116.753-118.754
+ 93.505 76.491 132.327-156.205
+ 93.300 0.000 112.643 -77.360
+ # 192 total E -8.70654E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.905 114.571 144.286 -11.756
+ 91.603 84.628 134.336 -17.101
+ 91.691 41.591 147.381 109.429
+ 90.833 48.073 140.317 -92.095
+ 89.745 44.672 118.613-129.291
+ 90.294 46.111 150.060 7.137
+ 90.838 52.745 135.185 175.517
+ 91.916 58.879 129.309-108.359
+ 92.118-102.494 111.724 -80.346
+ 94.391 148.807 0.000 0.000
+ 137.699 -46.084 0.000 0.000
+ 106.844-178.191 92.476 -82.775
+ 93.302 112.681 115.411 -76.726
+ 120.867 -87.216 114.379 -81.334
+ 95.929 85.017 0.000 0.000
+ 132.303 -87.397 89.829 -62.702
+ 117.792-106.488 120.438-127.466
+ 121.048-140.002 107.483-104.914
+ 92.774 85.534 101.805-111.196
+ 93.291 0.000 108.665 -79.196
+ # 193 total E -8.79212E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.932 130.108 146.932 -4.958
+ 107.487-174.565 138.005 -26.879
+ 111.488-167.909 118.722-124.158
+ 90.035 53.838 145.397-104.036
+ 89.225 42.903 109.154 -92.508
+ 90.745 56.775 148.280 -25.855
+ 90.110 40.882 137.058-159.989
+ 91.519 73.991 99.472 -98.802
+ 90.774 -55.787 133.200-137.678
+ 109.340 -71.775 0.000 0.000
+ 101.510 -26.913 0.000 0.000
+ 92.917 101.089 140.676-168.800
+ 93.276 106.101 114.841 -78.444
+ 121.053 -86.330 133.308-162.111
+ 95.894 75.733 0.000 0.000
+ 127.149 -78.116 134.507 -88.451
+ 118.797-113.327 114.652-119.963
+ 123.654-164.970 112.110-110.830
+ 93.381 57.098 103.968-104.144
+ 93.342 0.000 111.948 -80.153
+ # 194 total E -8.43908E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.991 114.339 139.794 -7.703
+ 91.646 78.530 139.201 -12.687
+ 90.265 49.040 109.577 -72.181
+ 90.651 37.600 164.860-126.083
+ 90.421 46.976 125.045-107.117
+ 91.167 45.245 136.859 88.808
+ 90.964 45.981 133.166-107.757
+ 91.464 45.468 138.475-142.086
+ 93.484-165.712 145.637 -23.264
+ 93.814 134.934 0.000 0.000
+ 133.304 -38.443 0.000 0.000
+ 93.730 84.694 99.212-100.512
+ 124.303-105.997 121.220 -76.580
+ 127.489 -86.802 121.269 -80.003
+ 119.398-175.264 0.000 0.000
+ 127.209 -88.072 110.634-128.597
+ 119.400-112.046 117.307-122.799
+ 120.358-137.647 110.104-108.853
+ 117.748-118.805 120.825-126.110
+ 121.908 0.000 121.597 -81.080
+ # 195 total E -8.63792E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.723 98.982 151.755 -25.109
+ 92.951 129.609 136.729 -32.995
+ 132.187 -97.847 95.263 -97.769
+ 92.488 61.579 160.918-151.165
+ 90.378 43.980 119.891 -51.729
+ 90.377 54.945 122.326 43.373
+ 89.912 50.582 134.303-138.716
+ 90.329 53.934 131.491-134.283
+ 91.570 166.267 141.612-125.164
+ 95.405 100.310 0.000 0.000
+ 132.976 -52.377 0.000 0.000
+ 93.687 77.685 132.440-155.835
+ 93.978 -55.047 117.001 -75.851
+ 131.048-159.551 125.105 -79.569
+ 115.816 172.280 0.000 0.000
+ 133.306 -75.048 112.571-124.194
+ 117.340-103.948 114.353-121.167
+ 117.759-145.728 110.373-110.690
+ 93.113 61.215 108.223-126.354
+ 93.333 0.000 113.281 -78.792
+ # 196 total E -8.88714E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.809 55.187 146.296 -24.772
+ 93.495 177.120 138.178 -50.802
+ 111.668 166.363 110.684 -64.711
+ 90.162 75.017 124.935-113.996
+ 89.492 51.429 104.021-106.620
+ 89.732 55.312 123.889 37.407
+ 90.288 38.234 143.361-171.988
+ 92.218 65.539 129.310-132.683
+ 92.033 -65.781 136.619-127.006
+ 118.673 -55.476 0.000 0.000
+ 119.359 -46.723 0.000 0.000
+ 113.273 107.580 133.551-146.502
+ 93.068 109.186 115.714 -76.393
+ 130.554-101.932 113.771 -83.089
+ 95.201 70.871 0.000 0.000
+ 127.243 -85.038 113.794-106.642
+ 115.924-115.168 88.557 -87.255
+ 119.508-143.032 117.819-119.763
+ 92.681 71.849 131.943-154.581
+ 93.330 0.000 109.509 -80.977
+ # 197 total E -8.75237E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.937 121.105 143.601 -9.196
+ 91.550 88.593 134.566 -15.133
+ 91.216 43.449 138.069 109.774
+ 90.543 48.800 142.732 -90.197
+ 89.804 45.609 122.420-132.569
+ 90.052 46.978 143.574 -21.789
+ 90.726 45.017 138.939-161.916
+ 92.292 62.207 137.284-131.252
+ 91.751-104.512 112.112 -77.445
+ 94.515 135.985 0.000 0.000
+ 125.046 -40.547 0.000 0.000
+ 110.277-166.429 86.815 -69.364
+ 92.403 80.871 138.622-113.421
+ 92.317 -85.355 110.018 -76.907
+ 94.633 165.256 0.000 0.000
+ 125.920 -69.166 149.257 -33.937
+ 117.893-108.086 112.289-115.240
+ 119.015-139.128 120.081-123.072
+ 93.373 69.555 100.437-105.862
+ 93.319 0.000 112.718 -78.294
+ # 198 total E -8.55803E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.969 108.326 141.411 -2.340
+ 92.404 151.626 139.114 -21.930
+ 90.252 89.880 99.152 -94.253
+ 88.799 45.101 148.222-110.624
+ 89.406 47.715 95.577 -59.263
+ 90.563 48.085 127.466 63.513
+ 90.294 47.855 137.733-111.879
+ 90.750 50.975 133.516-136.901
+ 92.094 172.613 141.924-126.309
+ 94.915 136.356 0.000 0.000
+ 125.184 -31.439 0.000 0.000
+ 93.936 82.352 97.096 -98.334
+ 125.283-104.951 122.273 -75.326
+ 129.859 -89.462 122.490 -80.554
+ 127.715-172.190 0.000 0.000
+ 127.285 -88.415 110.809-109.052
+ 118.893-108.400 126.447-137.389
+ 113.466-136.516 98.521 -85.916
+ 93.051 86.202 104.301-112.916
+ 93.271 0.000 109.835 -77.491
+ # 199 total E -8.33463E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.892 122.435 146.593 -8.774
+ 91.301 85.712 128.232 -14.656
+ 90.786 46.817 94.124 -86.370
+ 90.389 44.385 150.499-100.134
+ 90.258 43.762 120.725-125.928
+ 91.335 49.363 134.375 29.902
+ 90.304 45.271 132.622-144.575
+ 92.155 79.759 135.892-133.304
+ 91.067 -96.142 140.659-130.780
+ 95.760 49.487 0.000 0.000
+ 145.863 -72.588 0.000 0.000
+ 127.952 165.038 113.462-110.010
+ 93.881 87.260 108.287 -74.771
+ 139.259-179.346 125.066 -84.257
+ 93.886 66.196 0.000 0.000
+ 107.576 -66.050 71.850 -73.386
+ 115.107-107.469 120.539-128.328
+ 119.446-140.505 113.472-113.291
+ 93.318 51.461 95.537-100.970
+ 93.370 0.000 111.790 -81.424
+ # 200 total E -8.80601E+01 rmsd from N 0.000 %NC 0.00 1
+ 93.739 111.582 152.847 -19.319
+ 93.056 123.646 131.754 -38.419
+ 127.474 -95.755 94.494 -91.283
+ 91.516 55.068 144.378-114.546
+ 89.842 41.917 123.896 -89.878
+ 90.079 66.563 117.540 -28.361
+ 89.985 43.830 154.443-150.333
+ 90.869 74.981 83.819 -77.727
+ 91.763 -77.116 138.277-120.542
+ 95.834 171.611 0.000 0.000
+ 142.218 -53.265 0.000 0.000
+ 132.254 157.147 107.496-101.272
+ 92.857 104.128 113.608 -76.082
+ 127.914 -55.589 119.930 -82.230
+ 95.565 82.115 0.000 0.000
+ 120.155 -81.154 117.612 -57.419
+ 122.416-163.352 116.362-119.533
+ 110.317-165.856 136.768-153.956
+ 94.195 29.163 90.577 -80.186
+ 93.431 0.000 116.281 -80.262
projects / unres.git / blobdiff