jlee = 1 nbank = 200 nstep = 80270 100140098 0 2047.03459 nglob_csa = 115 eglob_csa = -7.37444E+02 # 1 total E -7.04619E+02 rmsd from N 0.000 %NC 0.00 1 91.566 47.198 119.818 -79.213 127.684 -77.037 133.750 -94.641 115.051-126.690 138.692-150.032 92.108 40.285 132.418 -77.877 94.062 40.478 134.566 -71.569 95.444 37.881 162.171 6.599 95.036 40.075 93.963 -64.870 95.212 33.957 141.272-109.765 94.007 39.815 119.614 64.510 92.533 46.370 145.299 -37.509 92.065 51.097 123.682 -97.709 91.910 45.896 133.448-135.872 93.561 66.207 115.664 -88.362 140.239 -48.269 119.878 -98.682 131.522-160.010 147.616 80.229 124.024-159.577 135.278 -82.269 115.525 -64.112 151.481-141.493 92.371 -19.855 103.820-117.328 94.964 93.424 0.000 0.000 123.368-144.454 139.021 -13.141 130.174-149.912 154.785 -98.398 125.933-167.773 143.793-122.159 130.184-147.377 170.908 -62.741 123.912 14.021 124.119-104.845 91.851 112.073 130.423 -76.996 93.526 -21.334 162.752-168.480 93.341 -63.123 146.968 163.247 92.060 7.952 130.886 -75.268 120.244-157.190 140.825 45.128 125.089-158.800 145.255 -14.115 118.729-161.463 139.943-109.239 128.114-162.303 148.992-157.618 94.193 -30.706 117.491-145.745 92.018 -81.191 128.541 -76.543 92.684 63.553 130.748-101.662 94.263 61.797 131.301-141.910 92.485 179.484 118.364-142.478 129.943-174.302 160.109 131.939 128.410-145.606 167.363 -90.607 121.776-149.956 134.792 167.288 92.962 48.733 155.819-162.493 92.579 38.075 176.425-143.885 93.841 47.928 0.000 0.000 92.447 42.178 123.251 -98.730 93.573 36.049 140.265 -22.837 96.245 38.040 0.000 0.000 94.440 39.984 128.334 -87.776 93.755 37.299 143.453-110.178 94.853 38.169 166.646-108.874 94.100 40.634 123.056 110.312 93.280 39.139 144.135-128.146 92.814 43.676 121.686 -75.403 91.231 43.175 138.180-105.994 92.805 44.017 126.207-100.108 91.559 41.603 141.519 81.660 93.794 42.416 116.065 -89.118 93.008 41.468 133.093-113.918 93.891 50.495 125.165-116.875 92.997 64.318 141.717 -74.318 94.685 81.470 122.564-128.453 118.018 0.000 132.081-155.813 # 2 total E -6.53414E+02 rmsd from N 0.000 %NC 0.00 1 91.571 54.568 129.824 -77.529 128.395-171.162 171.818 -31.729 93.071 28.777 142.873-169.768 104.041-151.934 132.435 -79.678 124.844-165.316 167.816 -75.296 94.731 35.516 106.570-108.950 117.975-178.564 129.244-100.542 135.533-138.604 141.164 33.240 129.637-111.887 167.132 17.400 121.187-163.063 150.077 18.987 95.992 78.779 124.826 -87.225 121.820 130.867 162.705-176.992 83.611 -54.223 133.603 -95.563 94.212 -32.733 0.000 0.000 93.492 88.719 126.248 84.570 126.427 -78.164 148.127 -96.574 124.270-167.303 161.856 -18.715 131.258 -75.190 155.589-112.765 132.810 -43.079 0.000 0.000 143.283-164.770 143.167 18.327 122.296-142.284 124.397 -56.050 95.281 46.728 105.637 -56.719 129.058 178.879 168.176 -49.083 131.516-165.845 41.466 -50.037 91.688 24.673 131.217 -77.931 122.908-127.984 120.849 -71.402 93.294 84.905 88.742 -85.958 117.387 -52.145 149.622 -80.566 129.955-138.735 142.950 59.509 128.601-139.668 125.686 -72.697 116.294 123.310 147.613 -91.259 119.676 -76.351 130.948-136.667 108.546 -59.828 120.768 142.789 120.816-172.507 112.359-107.594 136.002-154.685 105.292 -88.327 90.847 -12.526 147.371-162.684 118.172-161.675 151.789 -59.525 129.133-150.589 169.746 6.800 100.782 -53.883 127.992 -75.296 92.446 -67.536 112.638-128.650 91.299 84.537 120.884 -80.961 95.824 32.105 105.481 -90.742 122.952-165.987 0.000 0.000 121.782-153.918 168.163-115.195 93.127 -15.086 141.500 -15.940 120.038-141.990 0.000 0.000 121.523-140.399 138.299 -89.615 92.616 45.262 139.159-140.704 93.118 42.123 127.254-125.920 93.257 44.255 136.378 109.391 92.472 39.660 136.520-136.283 92.328 44.792 148.443-106.337 91.074 44.175 130.322 -77.992 92.622 43.497 126.759-106.840 91.541 41.369 140.828 82.249 93.777 43.310 141.615 -76.765 92.834 41.010 130.950-101.436 93.843 50.943 123.884-117.812 92.983 63.647 141.645 -75.004 94.702 81.255 125.945-128.131 117.999 0.000 132.312-155.871 # 3 total E -6.72161E+02 rmsd from N 0.000 %NC 0.00 1 126.086-132.105 148.024 -84.386 126.501 -83.310 132.142 -84.903 116.921 -98.842 134.845-142.092 91.286 53.660 132.528 -77.335 92.341 42.948 119.397 -76.541 93.263 43.482 168.841 -73.575 92.905 41.915 103.244 -50.806 93.638 40.623 139.184-108.432 92.630 43.706 117.949 45.252 92.532 43.472 148.986-102.781 92.006 52.103 118.633 -96.221 91.843 54.863 130.882-120.786 93.060 41.328 138.464 33.699 96.469 112.204 161.044 -8.437 94.451 48.547 101.736 104.015 97.343 176.439 144.121 95.697 119.857-179.190 122.424 -98.237 119.131 -88.993 118.614 120.395 95.620 11.443 144.010-122.091 94.319 72.551 121.457 -38.804 135.947-167.293 126.475 -54.872 118.034-167.875 120.417-106.795 134.203 -90.797 147.659-116.298 120.132 -69.490 148.030 -61.570 119.856-169.278 154.412 -98.351 124.950 179.325 170.751 -52.663 93.017 90.600 138.386-141.818 125.948 -69.089 127.056 -93.476 91.987 64.181 106.771 -57.804 93.419 42.208 144.663 -72.230 91.402 45.775 127.992 -74.128 91.860 40.357 125.912 -82.767 92.082 45.468 155.151-138.990 91.341 41.697 127.789 -76.543 92.630 43.461 156.290-127.935 91.549 45.058 136.727-142.912 91.065 45.995 122.524 -86.768 91.946 46.501 124.244-110.152 91.218 55.897 129.083 -76.914 93.194 72.226 127.606-149.683 93.487 -91.505 151.882 -36.032 94.649 164.631 147.871-103.324 124.018 166.046 0.000 0.000 92.613 55.279 136.996-110.299 93.271 35.876 90.055 -83.828 96.177 41.572 168.407-131.814 93.535 41.283 120.691 -99.148 92.854 39.566 144.308-116.294 93.714 40.184 163.715-111.552 93.316 41.629 126.380 116.102 92.398 42.197 142.796-128.537 91.991 44.785 148.373-100.797 90.972 44.925 133.588 -79.791 91.710 44.200 127.585-120.426 90.719 44.121 140.623 79.735 92.818 45.618 136.440 -68.746 92.613 40.613 131.182-102.176 93.980 44.210 118.709-124.068 93.606 62.822 142.165 -75.928 94.999 84.100 130.868-109.890 117.956 0.000 132.779-152.114 # 4 total E -7.03873E+02 rmsd from N 0.000 %NC 0.00 1 91.569 58.706 136.053 -76.722 121.745 -57.807 142.389-102.717 120.101-152.932 113.437-108.702 126.872-160.055 143.650 -80.580 125.744-173.330 159.192 175.169 94.621 36.208 109.376 -83.528 119.294-163.504 135.730 -97.765 128.816-171.959 153.291 9.643 92.621 40.109 126.646 -63.193 119.016-161.675 141.019-124.215 125.444-152.768 166.510 -82.843 119.517 145.642 164.319-137.030 103.889 -61.868 145.303-118.992 93.180 37.299 151.724 49.023 115.836 -85.593 105.921 -81.443 122.395-158.528 147.571 -88.653 134.296-132.817 159.597 153.027 118.384 21.240 123.571 122.021 121.067-171.256 0.000 0.000 127.260-166.110 144.644 -10.986 95.546 30.514 129.736 -90.250 123.277 173.614 128.332 -74.044 93.957 95.497 107.902-124.423 92.711 49.028 135.416-139.362 92.037 104.973 129.664 -77.132 93.421 -13.035 163.210 155.070 93.132 -77.575 137.876 158.841 92.409 -11.711 128.634 -75.671 94.721 102.210 131.341 -38.529 94.967 129.747 145.464 -73.195 91.948 49.815 127.236 -76.106 92.673 38.850 158.120 51.805 92.522 47.051 142.622-140.293 91.432 42.733 125.939 -78.501 92.029 50.808 124.205 -54.573 89.943 46.648 120.591 121.214 90.427 50.179 116.079 -73.904 91.900 42.150 130.549 -37.231 90.967 48.081 124.547 -71.996 91.711 44.650 127.230-147.110 92.012 46.704 150.844-133.444 93.377 35.579 121.243 -82.238 94.664 44.769 0.000 0.000 92.748 42.035 135.947-108.883 93.577 35.552 139.201 -22.717 96.259 37.957 0.000 0.000 94.628 39.057 121.901 -80.103 94.025 36.774 145.353-114.843 95.300 37.061 165.645-113.033 94.556 38.968 126.389 110.531 93.518 39.393 144.356-126.114 92.886 42.966 151.038 -28.892 91.177 44.575 131.706 -78.802 92.412 44.634 128.311-100.280 91.336 41.849 140.914 81.970 93.653 43.057 115.813 -83.066 92.958 40.995 132.950-108.752 93.950 50.413 124.149-118.062 93.047 64.098 141.777 -74.500 94.687 81.513 123.558-128.029 118.017 0.000 132.085-155.783 # 5 total E -6.47323E+02 rmsd from N 0.000 %NC 0.00 1 91.567 58.765 134.273 -80.461 129.607-106.999 124.790 -90.150 132.010 177.060 106.555 -94.873 127.921-138.615 140.518 -99.598 95.596 100.292 127.768 -90.253 124.385 -90.997 111.005 -97.095 128.253-156.299 171.481-103.870 124.794 178.727 158.053 -3.156 93.033 62.912 107.049 -49.901 92.960 115.077 139.651 -75.271 93.371 10.105 118.779 69.574 100.266 -82.507 159.308 138.983 93.425 0.532 135.555 123.203 95.747 104.423 0.000 0.000 118.671-101.931 161.374-162.282 134.623-166.324 148.758-103.621 126.396-166.350 158.826 -0.797 93.828 61.488 104.490-125.461 113.229 177.137 167.044-117.212 142.103-158.249 153.762 -25.356 114.740-170.259 162.036 -74.350 94.625 97.122 125.946-121.426 93.222 -9.757 115.697 -92.832 94.394 -78.845 92.937 -21.106 92.605 179.547 129.900 -74.495 129.341-151.017 167.617-167.081 117.988 -72.364 76.599 -84.132 124.513-129.448 143.359 -93.512 91.887 44.448 109.109 -85.603 92.378 47.291 163.273 -62.627 90.989 48.758 132.586 -78.298 91.352 42.291 137.760 71.760 91.665 41.817 143.481-135.935 90.874 48.805 127.589 -75.699 91.925 45.498 149.826-105.749 91.417 48.052 123.221 119.761 91.307 45.135 122.768 -84.546 91.885 56.475 93.747 -50.390 90.640 66.147 130.785 -76.882 92.851 41.546 124.984-149.475 93.434-105.608 142.954 -97.391 93.473 140.297 141.690-115.725 94.365 89.238 103.925 -93.065 92.950 50.310 132.104-100.691 94.382 30.203 90.235 -81.709 98.510 33.712 142.309 -10.696 97.020 33.727 122.475 -84.532 96.243 31.195 175.434 168.649 97.732 32.485 143.588 -74.676 97.068 34.206 119.705 115.871 95.891 33.214 147.878-148.608 94.795 40.959 153.860-160.953 91.762 43.058 129.427 -77.617 93.555 41.802 142.911 -73.200 91.745 42.459 144.260 -79.277 93.441 42.932 129.337-106.530 92.768 41.388 132.894-104.571 93.868 50.489 128.221-111.489 92.996 63.666 142.593 -75.697 94.712 80.815 123.701-130.542 117.996 0.000 132.483-156.322 # 6 total E -6.77759E+02 rmsd from N 0.000 %NC 0.00 1 91.568 59.795 135.361 -79.639 123.224-103.014 129.762 -88.577 92.838 67.553 106.171 -90.590 92.028 32.910 129.856 -76.792 110.682-160.047 140.271 -83.995 132.478-106.658 126.030 -84.880 131.803-159.899 154.394-114.529 125.980-147.283 141.971 -34.977 93.840 47.471 141.626 -79.350 125.887-168.329 158.195-129.498 118.873-145.665 147.419 -78.376 129.298-166.749 161.541-150.464 102.056 -88.205 159.396 -38.137 96.051 8.416 0.000 0.000 94.740 71.879 138.630 89.939 134.613-142.533 152.974 -98.982 118.574-177.278 176.440 -7.284 135.220 -81.441 144.737-117.633 126.496 -5.938 0.000 0.000 122.735-164.281 135.688 31.877 133.225-123.251 164.511 -23.733 119.011-169.172 119.755 -75.532 135.788 -97.294 155.464 171.094 119.960 -0.191 119.688 54.366 114.774-112.796 139.593 -95.560 133.504 159.092 166.750 -30.475 93.829 -64.968 136.630-143.130 120.682 -36.290 140.112 -80.830 123.357-131.591 147.448 -12.757 133.021-154.895 124.985-129.124 124.841-136.016 149.495 -77.762 124.183-118.879 153.884 49.043 118.267 -71.302 144.734-120.742 117.058-109.255 148.454 -86.322 93.573 39.740 176.453 3.270 92.461 49.115 132.016-136.660 91.535 43.843 135.382 -82.451 92.158 52.695 119.869-102.944 90.958 58.518 128.773 -75.897 93.549 74.920 128.870-151.120 92.423 -73.147 155.357-166.193 94.142 -53.407 143.270-103.120 94.014 156.439 164.220-142.818 92.437 51.913 104.476 -73.691 94.163 38.409 76.710 -85.492 97.847 30.892 0.000 0.000 98.011 34.759 130.070 -91.576 97.757 24.102 97.750 -54.513 98.242 38.629 146.486 75.064 95.426 36.532 115.752 130.709 94.050 38.531 154.561-136.945 93.486 40.050 151.045 -22.674 91.473 47.888 132.378 -76.973 91.992 45.665 127.190-101.376 91.307 40.067 140.629 85.040 94.192 41.828 107.712 -74.165 93.165 41.002 133.560-110.385 94.039 51.217 127.366-115.567 92.963 63.599 141.580 -73.734 94.720 81.265 122.716-127.570 118.029 0.000 131.952-156.320 # 7 total E -7.17367E+02 rmsd from N 0.000 %NC 0.00 0 91.630 112.385 137.942 -73.616 123.043 -69.307 141.735 -97.852 115.230-140.714 140.368-152.612 91.486 46.666 132.829 -77.740 92.184 42.780 115.343 -68.694 94.746 37.724 159.009 5.538 95.659 36.723 163.322 -58.587 96.210 33.344 137.968-109.805 94.515 40.565 122.072 62.437 92.618 46.796 159.198 -13.244 91.844 51.594 121.021 -91.723 92.530 42.826 132.233-133.269 94.112 96.030 116.057 -88.060 143.675 -71.215 151.724 49.023 125.859-148.306 156.720 88.336 126.719-162.150 138.695 -87.353 115.034 -63.663 153.935-133.489 92.500 -20.134 103.864-117.157 95.082 93.217 0.000 0.000 122.961-143.486 139.672 -13.218 127.694-155.584 147.826 -83.366 129.434-172.410 138.401-115.809 131.373-146.695 156.910 -98.334 124.573 17.325 122.503-100.061 92.152 112.656 128.772 -76.296 93.728 -22.828 164.206-137.218 92.680 -62.547 143.858 165.786 91.692 12.694 127.343 -75.947 121.204-158.573 146.439 51.026 123.313-163.457 152.414 23.711 124.581-161.052 162.327 -83.980 124.343-159.859 144.364 162.326 93.340 -31.348 174.101-111.628 91.564 -81.181 129.264 -77.045 91.911 66.699 135.691 -52.462 94.622 58.747 131.770-141.165 92.897-175.657 115.555-139.376 124.250-168.506 160.879-174.290 129.083-160.686 157.667 -77.568 128.415-152.457 140.058-157.567 117.969-173.508 153.698 12.526 103.508 -59.435 157.665-126.750 102.686 -23.279 0.000 0.000 93.972 90.167 127.933 -97.700 119.035-135.826 149.859 -6.031 132.461-166.220 0.000 0.000 123.500-158.150 166.936-127.445 131.219-159.895 151.532 43.485 120.317-165.112 146.938-121.146 135.030 -69.200 149.918 135.364 92.804 56.679 142.490-127.231 92.231 39.983 144.112-101.256 91.107 47.764 129.905 -76.435 92.057 53.634 110.513-140.396 90.118 44.059 139.465 78.292 92.364 44.148 116.366 -98.042 92.854 42.138 128.401-108.703 93.355 50.987 118.076-147.198 93.254 71.212 146.358 -78.375 94.466 106.513 126.526-139.218 117.468 0.000 128.315-111.023 # 8 total E -6.63288E+02 rmsd from N 0.000 %NC 0.00 1 91.566 61.968 133.208 -66.067 127.411 -99.930 169.425 -66.804 92.236 54.584 138.456-162.709 91.176 43.996 130.764 -76.725 92.880 42.811 136.931 -92.817 93.876 38.401 164.137 -88.482 93.824 40.110 101.492 -58.524 93.652 41.120 139.173-102.570 92.840 38.485 114.822 34.404 93.159 40.522 146.527-108.657 93.688 40.769 120.733 -82.131 93.906 41.410 136.721-113.329 94.505 33.765 110.874 138.296 95.556 45.176 166.868-143.670 93.625 35.871 133.749 -77.705 94.099 63.581 140.054 -69.164 92.066 86.684 153.309-165.458 92.832 -3.003 135.211 -93.217 120.129 -30.595 158.735 163.941 125.946-115.915 151.673 -1.915 125.125-152.002 163.402 11.476 95.786 94.999 98.770 -95.672 117.723 -86.160 140.716-126.622 125.768 121.466 150.802 33.029 91.718 -10.437 133.062 -78.016 98.581 -71.912 112.215-120.948 92.462 38.244 99.341 -83.366 121.350-139.253 148.864 -95.706 128.438-140.064 166.069 -96.136 125.352 -75.659 129.841-109.892 126.625 -83.509 153.700 -90.451 92.740 46.859 155.111-133.318 92.403 39.378 134.596-125.410 91.115 51.185 131.427 -80.057 91.689 46.038 140.665-105.719 91.869 42.748 142.185-152.025 92.234 36.303 119.902 -90.452 93.238 50.060 108.688 -58.480 91.254 63.179 126.484 -75.241 91.508 45.741 127.907-158.530 93.052 69.823 150.905-114.888 113.824 -42.591 127.882 -85.308 133.850-124.000 0.000 0.000 124.412 113.061 169.105 -85.301 90.673 -37.269 139.813-149.468 91.533 -41.372 0.000 0.000 114.505-128.887 135.514 -90.119 92.020 41.595 171.382-177.187 92.328 51.700 147.570 -31.837 92.311 40.830 129.095 116.406 92.640 39.401 140.075-135.712 92.524 45.079 147.959-102.980 90.841 46.464 132.810 -79.427 91.486 44.236 123.676-108.238 91.091 41.231 141.110 78.248 93.075 46.153 113.962 -58.490 92.554 39.516 136.939-113.502 93.534 48.983 119.666-118.327 92.931 74.175 142.220 -75.455 94.393 82.227 133.482-119.422 117.547 0.000 137.436-145.157 # 9 total E -6.66063E+02 rmsd from N 0.000 %NC 0.00 1 125.987-121.540 153.519 -68.284 123.978 -81.421 131.297 -90.420 116.049-100.141 113.501 -72.629 91.665 54.930 130.619 -77.937 93.484 41.859 136.511 -72.609 94.074 40.360 146.711 -74.054 94.059 40.215 137.505 -72.083 94.148 39.223 118.975-152.315 92.695 41.301 122.477 55.402 92.101 46.061 138.624 -86.261 91.478 50.870 121.252 -83.335 91.861 47.551 133.079-116.538 93.284 40.791 116.397 -86.331 94.547 61.669 151.724 49.023 97.101-110.836 142.238-116.254 124.710-150.046 164.424 4.144 121.548 179.621 148.415 147.979 135.571 -88.470 157.431-137.529 128.168 -11.825 0.000 0.000 125.735-129.520 143.323 -23.478 128.139-109.591 162.376 -49.585 93.868 55.107 140.711 -74.588 119.446-126.978 104.907 -99.944 92.552 81.758 134.611 -88.963 92.050 52.504 129.792 -76.824 121.360-169.911 150.426 93.181 94.442 41.265 142.614-174.151 133.299-143.599 176.416 -85.874 119.452-153.822 137.982 41.759 126.217-149.617 142.182 -77.311 122.238-160.872 147.829 -77.969 96.715 -35.954 116.683 150.820 93.945 -79.620 137.135 -60.027 91.031 72.718 129.421 -76.116 94.371 51.360 128.949-113.479 112.548-167.524 137.568-117.625 118.591-175.106 134.235 146.884 137.819-110.502 139.564-175.144 134.860-152.904 134.040-109.512 134.376-135.983 146.819-172.386 110.583 -28.762 157.033-146.728 94.149 -54.863 148.173-100.420 113.672 -18.413 0.000 0.000 93.228 103.417 160.705-138.268 93.270 -3.866 144.118 -9.456 118.304-164.275 0.000 0.000 120.772-130.685 164.653-149.111 93.238 31.217 168.974-154.540 93.539 53.548 141.464 -65.579 91.774 49.861 117.259-155.903 90.948 45.174 138.561-123.133 91.338 44.746 147.960 -25.511 90.866 46.091 127.669 -74.773 92.278 45.295 121.128-121.222 91.187 42.444 140.638 82.041 93.619 43.446 142.090 -76.470 92.833 41.198 127.605 -95.965 93.858 49.803 123.766-124.985 93.086 60.184 141.497 -75.381 94.778 81.991 126.857-125.736 118.066 0.000 131.536-156.253 # 10 total E -6.64323E+02 rmsd from N 0.000 %NC 0.00 1 91.569 57.038 137.210 -86.833 120.115-179.582 121.194-100.104 93.473 73.869 141.466-168.872 105.249 -41.279 145.253 -92.058 120.525-136.929 168.808 7.214 127.833-159.546 111.285-122.808 95.522 28.559 101.514 -74.258 122.363-165.572 150.468-111.572 92.332 28.012 118.526 50.755 112.476-164.462 161.167 178.994 137.850 -79.520 129.112 -94.630 133.142 179.082 139.608 -93.967 100.503 -63.289 132.111-114.934 98.098 -21.698 0.000 0.000 93.643 85.518 142.002 -93.719 126.438-108.436 147.677-103.331 122.709 179.141 176.465 2.038 133.087 -71.824 128.923 -85.216 128.106 -9.378 167.044-117.212 126.645-137.760 141.675 -65.133 134.850 -74.694 69.695-108.668 134.864 -40.811 172.215 -42.208 130.132-117.556 128.459-111.470 160.610 162.808 100.090 -45.114 90.967 60.857 131.337 -77.919 130.350-109.668 139.998 -79.093 93.387 -32.569 99.087 -82.953 125.080-146.991 138.354 -79.860 129.411-101.467 136.898 -58.246 135.368 -42.734 107.187 -93.269 116.210-110.747 127.024 -80.397 90.493 47.410 137.572 -8.521 90.698 43.725 131.436-124.900 90.362 54.707 128.850 -76.482 90.810 50.307 114.705 -45.130 91.260 40.873 162.104-131.680 91.766 40.233 117.584 -95.582 92.576 51.892 103.962 -44.666 90.975 66.878 122.835 -73.179 91.831 44.053 123.727-139.347 93.547 75.562 150.767-115.913 112.655 -25.858 126.333 -80.915 125.050-129.017 0.000 0.000 123.291 110.626 169.320 -86.944 90.367 -40.730 139.947-156.691 91.069 -38.773 0.000 0.000 115.962-124.424 135.895 -90.238 92.598 38.087 169.484 160.549 92.045 53.245 145.676 -74.403 92.309 45.366 137.879 100.977 92.267 38.685 145.305-140.445 93.188 41.043 144.755 -95.842 91.445 45.158 130.323 -77.407 92.233 45.141 142.521 -75.663 90.657 43.582 141.100 -78.398 92.713 43.888 106.665 -59.862 92.993 39.466 135.307 -83.786 94.320 47.433 125.647-113.258 93.212 60.654 142.730 -75.687 94.786 79.736 132.004-122.025 118.053 0.000 131.684-158.525 # 11 total E -7.07822E+02 rmsd from N 0.000 %NC 0.00 1 91.602 108.535 131.754 -79.259 125.093 -77.685 136.938 -90.101 115.085-140.304 138.078-149.172 91.510 46.378 131.351 -77.711 92.769 41.343 135.341 -72.271 93.979 41.383 152.979 32.969 93.636 40.756 116.465 -78.248 94.269 37.252 134.475-118.653 93.341 39.508 119.578 55.428 92.385 47.996 156.734 -15.387 91.728 53.695 121.458 -95.935 92.039 47.152 131.045-127.303 93.621 77.089 117.825 -87.915 141.846 -58.586 171.212 -76.272 129.537-154.244 149.023 90.494 126.060-161.973 139.479 -81.611 115.780 -63.926 151.157-146.125 92.414 -20.547 103.746-117.259 95.185 92.827 167.044-117.212 121.356-147.557 158.206 -82.742 129.383-151.264 154.063-110.212 127.308-167.889 139.732-118.021 131.052-145.657 166.900 -42.514 128.064 9.549 121.271-101.099 92.065 111.318 129.484 -76.921 93.784 -18.614 166.765-151.125 93.504 -65.974 155.871 15.199 91.845 8.803 126.190 -73.972 121.540-156.171 135.957 30.640 125.853-157.425 175.071 -24.781 122.526-162.925 153.584 -75.882 129.874-160.148 143.262-155.000 92.900 -30.733 116.918-145.017 91.756 -82.710 128.462 -76.574 92.278 66.426 117.307 -77.572 93.657 57.559 134.724-140.610 92.030 176.784 115.866-139.747 132.020-170.313 157.097 20.283 129.536-154.703 155.442 -86.333 128.409-148.968 144.557-166.710 131.588-147.277 131.892 -72.886 120.186 -53.697 149.443-117.322 133.816 -19.476 0.000 0.000 93.664 56.094 134.999-106.411 94.075 25.885 92.112 -85.945 96.240 50.045 0.000 0.000 92.117 43.587 135.894-100.142 92.060 40.740 146.245-118.595 93.175 40.443 161.158-106.817 93.072 42.811 134.933 90.491 92.055 41.838 140.134-121.992 91.944 44.147 148.518 -28.043 91.058 44.293 129.914 -76.974 92.716 42.917 130.659 -99.553 91.651 41.223 139.481 85.667 93.921 42.682 141.575 -75.877 92.968 40.556 132.074 -99.310 93.932 50.414 126.112-127.616 93.016 63.786 141.064 -74.683 94.685 83.311 126.863-126.916 118.034 0.000 131.844-154.048 # 12 total E -6.61814E+02 rmsd from N 0.000 %NC 0.00 1 91.567 57.235 130.705 -71.309 128.318 -72.187 167.330-105.679 121.038-155.977 110.045-103.302 123.182-170.835 176.431 -87.672 127.116-166.385 165.942 -99.880 94.187 -35.652 167.577 -16.147 91.820 -82.162 112.007-118.044 90.718 76.298 122.432 -44.733 93.720 50.173 122.826 -62.886 94.979-178.394 147.001 -14.406 116.909-167.062 128.845 -95.185 127.299-170.462 161.882-136.256 109.500 -94.921 108.153 146.160 94.904 13.686 111.470 -82.115 93.847 70.243 138.208 -90.095 130.153-163.634 132.411 -77.131 113.453-171.371 149.955 -32.262 129.383-138.328 150.199 116.643 94.972 33.765 147.834 41.530 127.290-167.366 137.345 65.179 129.065-174.789 153.346 31.993 127.346-156.073 175.468 -24.961 122.648 -97.691 123.017 -64.328 91.722 44.520 104.635 -55.949 91.093 58.154 130.575 -77.398 92.396 84.889 141.535 -78.219 91.755 122.716 93.525 -79.201 117.069 -82.635 136.069-110.032 92.397 56.923 108.854 -55.159 94.186 38.267 143.458 -74.278 91.674 46.872 127.767 -74.959 91.515 45.752 138.990 115.429 91.317 45.169 144.845 -62.188 91.053 43.336 127.731 -75.786 92.773 42.980 160.451-127.316 91.400 53.399 143.754-157.303 90.888 45.301 127.836 -85.130 92.291 44.813 105.698 -58.317 91.211 68.581 128.774 -77.275 92.599 73.511 126.859-143.972 92.512-162.284 141.476 -33.500 93.550 65.365 141.656-110.911 94.476 85.075 142.019 -87.228 115.465-113.203 110.556 -78.034 110.228-175.957 100.629 -78.886 131.748 161.686 0.000 0.000 113.848-164.565 134.806-100.427 135.114-159.384 159.698-136.811 125.743-163.672 155.208 42.750 125.031-154.777 133.486 150.558 124.496-167.641 151.723 -25.104 118.064 -61.547 152.107 -12.359 91.982 -22.277 129.775 -76.535 96.447 92.866 166.296 -38.457 122.956-145.126 173.764-135.982 130.988-163.693 148.495 45.710 123.881-151.652 136.127 -47.976 126.133-164.750 148.098-127.331 124.932-178.812 167.446-132.060 95.276 63.855 128.854 -91.276 117.421 0.000 138.975-167.585 # 13 total E -6.52244E+02 rmsd from N 0.000 %NC 0.00 1 125.314-114.768 158.594 49.974 123.181 -78.398 120.220-101.299 115.491-151.076 101.464 -78.574 135.796-144.038 132.898-102.661 126.282-145.778 139.787 -78.764 128.358-127.469 170.616 -82.078 131.010-131.323 134.090-131.042 124.781-172.504 97.321 -50.632 94.574 25.363 113.088 54.111 120.895-145.840 163.500-163.769 125.760-165.646 164.164 -55.745 108.522 -52.555 160.086 150.119 92.637 -29.183 138.781-108.138 94.915 94.464 0.000 0.000 123.391-117.315 130.231 -73.989 123.550-163.767 155.039-171.670 94.080 26.815 153.947 -27.126 129.736-125.545 161.549-150.925 133.298 177.679 0.000 0.000 121.707-138.852 137.716 9.030 128.039-114.487 132.823 -71.246 123.042 -61.296 160.156 157.966 97.019 -19.711 97.609 -95.346 93.458 97.736 134.115-122.375 139.559 164.525 130.504-104.603 114.907 114.650 141.722-103.481 117.964 9.257 114.494 -66.334 125.005-105.504 135.154 -86.975 135.706-166.120 141.010 55.067 126.933-151.987 135.214-108.242 130.441 -86.936 138.465 -96.926 91.433 49.107 168.760 152.313 91.276 46.582 132.033-126.669 90.938 46.285 126.835 -74.984 91.781 44.103 125.167-109.762 91.057 46.085 141.667-141.671 91.075 43.702 124.667 -91.376 91.771 48.863 118.175 -65.738 91.212 46.399 129.029 -76.064 94.269 86.508 127.658-147.635 92.408 -61.885 159.740 8.731 94.345 -55.927 146.899 -94.372 94.395 172.234 141.674 -98.339 92.066 51.280 133.716 -97.182 93.618 33.028 134.350 -35.952 98.153 32.940 0.000 0.000 96.926 33.434 119.717 -86.987 95.739 33.105 150.514 -98.371 97.332 32.066 162.565 -58.254 97.186 32.860 118.071 114.669 96.350 32.368 148.670-142.949 94.661 41.506 154.308-140.238 91.664 42.839 129.646 -77.832 93.380 40.924 140.422 -72.913 92.067 38.590 138.212 84.944 94.016 44.874 129.467-102.239 92.711 39.519 137.924-101.894 94.017 48.167 129.111-114.108 93.099 62.904 141.435 -74.330 94.689 80.884 125.781-122.256 118.062 0.000 131.556-157.178 # 14 total E -6.59096E+02 rmsd from N 0.000 %NC 0.00 1 91.570 50.214 123.970 -83.253 128.501-101.421 126.685 -89.684 92.041 69.131 104.869 -88.073 90.945 64.102 130.059 -77.880 92.147 55.266 140.655 -76.136 92.441 58.166 140.248 -73.376 93.145 73.322 165.015-119.359 92.334 93.416 95.095 -75.565 92.133 34.556 78.610 -84.837 92.791 -94.002 163.600-126.059 124.136-104.374 135.137 -83.976 130.066-178.614 159.018-135.592 100.705 -58.846 125.507-113.175 96.675 -26.967 164.396-123.999 93.228 89.481 118.903 91.236 123.188-110.336 164.711 -77.684 128.303-177.959 146.638 96.069 126.864 -61.889 153.538 -98.421 130.972 -31.509 151.550 -22.359 131.399 173.430 146.967 -15.627 94.744 71.180 123.102 -80.917 94.380 119.199 141.379 -73.780 96.341 3.301 100.986 -98.898 130.153-111.073 155.951 -52.074 90.880 53.611 130.255 -76.842 91.375 45.011 124.908 -90.058 90.513 49.725 141.248-157.206 90.944 45.287 127.759 -76.085 91.884 38.167 112.630 -53.469 94.032 41.654 139.392-113.787 91.401 45.261 129.961 -76.999 91.624 42.838 137.297-179.020 91.596 41.390 143.976-131.789 91.103 45.490 127.111 -74.835 92.387 44.000 150.428-133.108 91.856 43.537 132.312-106.642 91.514 45.378 121.125 -92.108 93.180 43.488 112.122 -55.145 91.132 71.093 131.794 -78.546 93.382 28.481 132.093 177.135 94.289-106.310 113.779 -76.606 93.307 146.907 131.826 108.020 94.022 99.352 0.000 0.000 92.857 71.786 138.287-112.507 93.560 25.938 92.641 -82.391 96.489 88.867 0.000 0.000 122.518-165.305 162.678-146.752 130.641-159.969 165.339 8.886 122.863-166.131 152.809 7.391 129.971-145.873 141.035-131.485 127.426-166.011 116.745 -75.446 114.993 -66.152 149.707 -1.849 92.056 -18.414 130.353 -76.928 96.522 90.430 159.249 42.473 124.079-142.732 174.027 -96.672 129.962-164.278 147.807 -66.062 126.894-148.511 166.269 22.394 128.155-161.633 175.129 -83.233 123.231-177.509 165.013 -52.615 95.301 65.056 129.383 -93.816 117.489 0.000 138.010-164.602 # 15 total E -6.77923E+02 rmsd from N 0.000 %NC 0.00 1 126.107-130.957 148.428 -80.945 125.939 -77.457 129.996 -82.092 116.779-132.692 102.040 -74.890 128.520-155.129 134.937 -95.780 128.339-168.255 173.039 -83.337 93.929 40.027 132.033 34.885 114.443 174.024 135.449 -88.766 133.696-117.235 160.506 32.169 121.299-126.961 117.799 -56.051 114.781 174.885 176.473 -3.811 93.726 73.230 142.472 -72.159 114.805 141.667 158.853-179.106 88.120 -52.131 131.533 -89.041 95.152 -33.137 171.212 -76.272 94.100 82.012 170.834-138.469 131.404 -84.229 144.775 -78.652 123.736-171.551 157.896-171.684 131.642 -89.593 159.506 -79.932 129.823 -30.016 0.000 0.000 130.927-151.663 138.173 -17.920 123.860-141.399 139.129 -99.121 95.570 51.480 110.117-115.097 127.882 178.614 87.470 -93.558 136.742-169.880 55.623 -46.076 91.396 -33.717 154.017-104.892 122.810-126.511 133.607 -64.278 92.035 43.694 90.367 -81.364 90.976 55.288 128.001 -75.555 91.723 40.602 116.546 -47.777 93.361 44.659 128.764 -40.449 91.809 40.361 127.518 -76.294 93.321 39.416 157.416 157.012 92.403 45.832 139.447 -47.878 91.358 44.216 128.239 -78.488 92.284 43.761 121.141 -45.576 91.331 45.113 147.593-143.189 91.093 50.806 122.763 -90.658 92.577 47.588 130.522 -75.489 91.934 84.228 129.433 -76.587 106.845 -50.873 137.221-166.860 94.418 -70.361 146.548-108.735 93.949 165.026 147.055-104.637 94.176 127.681 153.032-115.937 93.161 67.768 130.578-111.361 92.963 54.666 89.708 -84.688 95.710 109.019 0.000 0.000 113.193-159.892 115.173 -94.201 93.058 55.312 144.036 -92.234 93.612 42.658 162.997 -31.564 93.411 40.750 120.649-173.632 92.523 41.012 139.701-116.833 92.168 46.951 152.078 -27.742 91.232 40.559 129.840 -77.144 92.790 44.456 117.456-123.479 91.339 42.780 143.038 79.503 93.137 44.199 111.954 -76.586 92.917 40.114 133.914-110.548 94.042 49.113 122.775-119.339 93.082 64.286 142.099 -74.704 94.661 81.652 125.233-122.857 118.053 0.000 131.624-156.071 # 16 total E -6.91380E+02 rmsd from N 0.000 %NC 0.00 1 91.569 60.126 136.232 -76.596 124.195 -73.210 134.560 -89.480 115.574-143.663 140.155-152.360 91.482 50.024 131.207 -76.563 92.205 46.163 112.833 -91.023 93.297 44.882 158.618 -8.921 92.954 59.976 162.446 -83.420 92.792 102.684 102.672 123.491 91.780 16.144 140.145 -57.954 108.172-148.403 147.022-114.320 123.053-111.779 124.044-101.808 127.133-167.495 146.076 -83.703 107.496 -59.278 131.633-113.619 98.070 -21.451 0.000 0.000 93.529 82.281 108.952 96.181 131.359-114.625 149.957 -87.114 125.429-174.154 161.769-143.743 128.679 -89.436 145.452 -89.306 123.256 -13.816 0.000 0.000 121.865 -96.031 125.238 41.639 127.702-118.220 133.296 -77.489 124.022 172.887 169.872 -73.996 94.957 96.123 141.842 -75.514 93.697 -2.362 90.501 37.133 92.058 -85.523 131.147 -78.427 110.254 170.084 168.168 -97.048 91.341 61.305 143.263 -9.486 90.960 50.190 127.872 -75.234 92.066 41.857 111.588 -49.265 93.726 41.633 143.803 -74.667 91.333 45.646 131.675 -81.145 91.077 48.434 149.980-157.435 90.215 50.157 141.209 -47.219 90.412 47.715 126.401 -74.988 92.156 44.124 139.377 -87.383 91.929 46.947 136.809-136.486 91.617 56.991 119.686 -76.341 92.754 110.437 131.230-117.606 91.263 39.370 127.888 -75.082 106.552-163.001 138.735-155.947 117.678 -65.778 163.418 1.590 92.983 -19.258 159.809 -39.932 94.708 99.020 0.000 0.000 123.099-149.335 148.737 -74.332 93.157 45.817 95.591 -82.580 124.950-133.876 0.000 0.000 128.369 -78.247 111.377 -94.713 121.657 -20.658 135.563 123.463 93.072 77.140 135.943-108.522 92.529 44.553 113.471 126.130 92.270 41.105 156.186-127.309 92.241 44.479 146.712-109.006 90.986 47.490 162.979 -77.487 92.096 41.495 145.363 -75.709 91.563 41.161 132.497 84.543 94.120 44.620 139.704 -76.099 92.902 39.222 128.007 -91.167 93.845 66.654 125.149-136.218 92.399 78.059 140.138 -75.470 94.431 99.833 91.189 -94.538 117.663 0.000 130.650-122.697 # 17 total E -6.91664E+02 rmsd from N 0.000 %NC 0.00 1 91.568 55.564 137.910 -99.318 113.481-145.423 111.243 -87.316 92.751 -44.063 136.990-170.128 92.223 -77.454 131.740 -78.172 91.793 79.314 146.482 -78.127 94.144 39.026 140.910 -74.783 120.410-160.088 163.634-163.098 128.413-169.004 151.050 9.030 92.769 44.045 134.779-103.178 115.044-165.762 150.639 -42.060 116.123-147.748 144.215 -94.132 125.654-165.915 166.330 164.654 109.044 -65.665 156.390 -41.213 98.672 -14.656 164.396-123.999 93.749 86.319 139.792 -89.901 128.606-136.493 144.038 -89.802 123.240-174.195 153.987-125.090 131.230 -91.274 140.023-116.210 127.993 -7.470 167.044-117.212 121.254-156.833 126.554 30.662 130.189-162.932 161.056 -51.962 93.392 41.702 139.853 -76.209 117.253-102.866 107.166 -90.518 129.861 177.910 94.426 -66.865 91.084 85.147 129.821 -76.207 93.760 60.369 99.111-103.050 94.058 97.138 159.248 5.698 118.205-124.095 129.685 -93.963 92.088 47.450 111.048 -50.547 92.744 46.543 144.182 -75.475 90.918 47.427 132.292 -80.348 90.854 43.071 143.662 136.483 90.874 45.341 143.772 -63.266 90.839 45.458 125.565 -73.686 92.496 40.333 147.899-115.830 92.459 42.812 139.559-141.893 91.867 41.906 119.003 -72.918 93.086 41.904 119.674 -84.461 91.156 46.680 128.500 -76.333 91.973 43.532 125.821-145.710 91.995 47.328 151.887-146.703 93.249 35.290 121.688 -88.233 94.464 47.421 0.000 0.000 92.797 41.695 134.721-107.406 93.530 36.061 113.660 -63.173 96.306 37.126 0.000 0.000 94.771 39.083 122.031 -80.699 94.177 36.474 145.518-113.309 95.100 37.398 144.609 -75.020 94.570 38.802 126.012 111.921 93.550 39.394 144.396-126.108 92.920 42.837 151.347 -28.066 91.202 44.536 131.724 -78.819 92.419 44.630 128.325-100.828 91.334 41.845 140.883 81.973 93.644 43.088 115.991 -83.040 92.955 40.968 132.862-108.627 93.949 50.424 124.092-118.148 93.048 64.096 141.772 -74.505 94.687 81.524 123.590-128.048 118.017 0.000 132.088-155.775 # 18 total E -6.69007E+02 rmsd from N 0.000 %NC 0.00 1 125.983-128.095 154.449 -83.530 126.430 -71.645 145.554 -79.321 116.402-137.079 143.611-158.123 90.994 57.738 131.076 -77.016 91.530 47.009 129.842-110.312 92.582 47.030 114.821 -53.185 92.768 50.921 134.135-122.620 92.373 51.536 126.797-114.746 91.538 67.792 108.350 -62.397 92.116 -54.506 165.994-156.996 131.083-175.838 143.811 -75.888 92.463 -37.423 129.430-123.403 92.208 -58.318 114.693 -89.021 100.421 -40.554 151.724 49.023 91.831 111.422 135.738 85.669 94.967 76.124 151.914 51.564 92.044 146.641 150.630 5.077 91.060 -54.030 124.222-101.269 93.355 4.600 124.355 -63.640 129.625 -96.276 117.151 58.866 122.282-168.950 168.283-143.360 95.883 107.676 145.068 -74.632 126.062 -88.935 123.693-105.751 125.203 -82.674 126.811 -61.701 91.238 48.960 130.483 -77.234 91.936 42.137 141.693 -78.272 91.338 48.492 141.383-160.833 90.943 44.091 127.410 -75.848 91.731 38.670 111.451 -48.358 92.712 47.048 143.201 -74.473 90.740 51.126 105.483-104.803 90.604 45.839 141.379-169.187 91.160 59.536 139.047 24.521 91.076 74.234 126.848 -73.649 104.378-136.951 136.160-157.972 93.110 -16.585 146.058 94.066 127.957-143.919 137.049 10.522 121.189-127.657 176.452 159.417 116.597 -64.208 134.563-100.660 93.331 -47.620 115.646-132.056 92.403 84.721 153.093 -29.390 120.331 -13.253 107.505 -97.318 138.679-105.264 0.000 0.000 125.472-143.722 122.726 -78.907 94.334 -10.748 112.630 -66.253 131.013-134.719 0.000 0.000 129.728-102.707 128.513 -84.816 93.937 29.956 133.917 121.842 92.834 63.325 142.639 -72.210 92.252 50.967 137.097 85.892 92.501 34.449 140.291-151.124 93.393 44.982 116.260 -78.796 91.390 44.181 129.883 -78.764 92.874 45.065 143.473 -75.338 91.531 39.135 134.288 93.726 94.558 42.281 112.987 -86.382 93.560 39.103 132.249-104.190 94.302 51.078 132.465-132.999 93.077 63.080 140.797 -74.107 94.687 83.839 123.572-126.668 118.089 0.000 131.168-154.208 # 19 total E -6.97644E+02 rmsd from N 0.000 %NC 0.00 1 91.568 56.467 133.114 -83.490 120.928 -83.850 129.838 -98.782 117.853-100.891 121.445-120.270 91.154 57.228 131.418 -77.283 92.541 44.057 120.188 -80.153 95.323 34.057 149.820 -26.045 97.496 31.058 163.212 -89.303 97.382 34.972 126.247 112.401 95.132 37.911 122.455 -50.085 93.495 40.148 162.067-174.034 107.276 139.578 144.871 -65.400 121.518-143.393 128.297-102.964 122.151 154.447 149.457 124.061 126.240 33.454 164.396-123.999 129.652-107.943 164.167 -90.603 130.609-162.308 144.563 -90.223 111.288 -57.387 143.094-104.400 92.493 -25.254 103.802-115.518 95.301 90.502 167.044-117.212 125.799-119.959 136.632 7.336 124.951-137.311 135.290 -84.508 127.575-108.312 162.686-121.462 128.286-164.393 161.196-162.818 92.469 48.272 144.277 -70.412 91.375 70.062 128.897 -78.562 92.819 70.433 162.443-126.322 93.529 72.679 146.315 -27.235 114.354-137.801 138.798 -91.841 91.972 48.755 111.800 -49.560 92.232 51.180 143.045 -73.954 90.788 48.005 126.699 -72.449 91.999 41.366 154.226 13.896 92.370 37.823 141.720 -65.018 91.212 48.724 129.195 -77.090 92.088 44.799 143.597 -50.677 91.701 40.421 161.800-169.796 91.916 40.203 118.855 -83.439 93.079 44.624 100.953 -43.663 91.073 52.239 129.728 -77.644 91.744 43.335 129.324-152.423 92.423 65.426 150.832-120.450 102.344 -35.294 161.246 -50.859 120.681-156.664 0.000 0.000 118.616 110.889 140.434 -85.186 91.107 -27.650 93.691 -82.128 94.748 -53.331 0.000 0.000 116.993-142.069 163.967-113.842 92.663 44.991 172.929 177.783 93.492 41.815 139.438-119.455 92.886 43.570 142.643-140.958 91.820 47.253 135.146-134.667 92.612 41.489 140.835 -40.992 91.621 40.460 127.997 -69.814 93.976 42.439 116.701-119.724 92.227 41.993 144.072 87.326 94.209 39.321 110.077 -73.107 93.527 42.259 142.522-128.819 93.974 49.267 131.527-120.830 92.984 64.337 141.588 -73.906 94.668 82.822 122.411-123.981 118.077 0.000 131.316-155.064 # 20 total E -6.56362E+02 rmsd from N 0.000 %NC 0.00 1 91.561 67.041 137.093 -58.331 133.609 -85.077 171.981 -84.416 123.800 112.784 143.336-150.890 91.721 28.535 129.452 -77.297 115.035-159.229 159.929 143.310 96.002 30.786 114.750 -84.088 126.061-174.214 117.564 -48.202 117.810 177.628 105.771 46.455 94.333 20.538 129.903 -58.652 93.667-165.727 138.889 -39.683 128.266-143.949 134.706-103.754 115.047 155.572 162.222 146.336 97.964 -60.794 120.245 141.341 93.237 34.380 0.000 0.000 117.654 -76.595 107.225 -86.528 117.148-161.187 166.709 -32.133 130.179-136.454 155.532 166.711 114.148 7.287 137.189 116.850 113.407-172.171 167.044-117.212 126.439-170.527 139.567 -1.287 95.388 28.332 121.575 -80.415 122.107-165.245 141.688 -78.122 125.962 157.393 136.796-134.947 93.899 53.556 157.150 118.533 92.069 71.975 132.199 -79.270 93.189 43.787 131.545-142.366 93.852 101.394 151.868-137.329 115.828-121.408 121.549-103.705 91.678 53.578 107.994 -58.597 93.229 45.880 139.162-111.828 91.491 43.074 129.108 -76.745 92.286 40.100 152.687-113.060 91.852 44.861 143.642 -61.805 90.834 49.093 130.499 -79.274 91.930 39.917 150.885-115.629 91.210 52.861 131.308-158.610 90.755 54.024 127.534 -77.164 91.612 42.430 126.184 -98.206 91.291 67.560 129.539 -73.907 92.338 72.563 128.693-154.292 92.701-157.266 137.846 -40.870 93.394 72.491 142.108-110.976 94.524 87.659 0.000 0.000 115.941-123.073 121.488 -84.598 94.134 168.085 96.866 -81.123 133.663 166.629 174.518 -2.727 116.070-170.375 136.283 -84.993 126.198 172.842 149.313-145.573 126.125 175.932 147.217 7.232 129.227-151.538 156.849-129.996 116.667-156.487 176.488-177.005 113.913 -58.066 145.662 -0.108 91.422 -23.296 129.784 -76.054 95.978 91.115 138.653 -70.268 126.741-126.848 165.171-109.594 132.937-167.004 155.791 -7.899 111.333 178.203 171.649-161.384 129.915-179.209 167.058-102.038 116.238 168.661 164.464 16.287 126.276-141.795 132.141-148.571 117.872 0.000 132.234 99.119 # 21 total E -6.64550E+02 rmsd from N 0.000 %NC 0.00 1 125.791-142.161 138.666 -94.748 127.056-118.471 119.542 -79.623 92.446 74.413 104.444 -89.794 92.054 149.213 135.724 -82.872 92.910 65.749 139.219 -77.676 119.675-118.426 85.475 -83.555 117.777-147.877 160.745-153.658 127.934 -32.805 159.490 133.311 92.747-171.417 113.356 -35.250 124.319-165.210 176.460 -0.674 121.020-170.871 152.253 -77.400 122.186 -64.761 165.161-164.492 93.011 -19.507 127.671-122.775 95.282 95.007 151.724 49.023 121.535-154.249 148.534 -62.404 123.609-162.806 166.944 -49.175 120.781-170.427 155.116 173.057 121.379 -11.908 132.318-117.062 94.627-178.988 133.661 -68.716 130.371-130.225 149.570 -13.095 120.254 -71.212 133.319 -80.176 125.394-113.617 134.993 120.196 133.995-137.994 149.711-130.099 125.788 -83.845 125.253 -53.375 91.862 48.413 129.268 -75.909 92.365 38.247 142.428 -78.293 91.344 55.090 141.477-153.207 91.147 46.011 126.779 -75.256 92.766 31.704 109.500 -52.422 94.722 43.260 143.583 -74.799 91.496 47.493 125.299 -77.454 91.516 42.476 145.167 101.489 91.787 40.887 141.211 -61.587 91.249 47.047 126.079 -72.987 92.267 46.465 136.927-115.645 90.987 52.024 140.472 111.988 90.868 54.256 124.278 -82.340 92.273 46.019 118.019 -75.222 91.109 75.642 129.300 -72.975 93.473 23.571 127.953-152.000 94.191-108.157 143.951 -97.833 93.199 142.203 143.970-107.371 94.776 77.037 0.000 0.000 125.425 179.003 124.593 -82.256 93.589 69.008 130.638-133.966 143.616 -45.086 0.000 0.000 129.819-125.412 131.709 -64.746 131.737-132.292 127.573 82.423 125.025-167.014 147.260 62.397 133.448-114.413 113.985 -58.824 127.518-170.687 163.830-147.960 116.742 -63.659 140.673 5.536 91.961 -22.415 129.592 -76.324 96.602 86.007 160.591 -80.003 127.002-131.732 161.687 -97.729 121.808-171.713 150.753 29.035 132.458-107.659 162.477 137.187 135.981-158.229 139.597 -50.107 116.922-179.561 166.109-107.753 126.601-117.129 148.251-126.164 118.032 0.000 147.820-157.394 # 22 total E -7.06697E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.860 135.615 -74.426 124.793 -82.653 132.426 -85.223 116.918 -98.140 136.440-144.649 91.416 52.198 131.263 -77.006 92.417 44.338 113.762 -87.379 92.933 42.318 164.136 -91.095 92.644 42.714 102.706 -51.021 93.329 44.932 176.387 178.952 91.984 48.803 123.393 -49.552 91.895 84.874 142.798-128.119 113.649-126.164 145.109 -78.377 123.435-119.576 164.855 160.226 96.492 147.316 139.437 60.628 126.120 38.996 0.000 0.000 127.396-111.578 168.212-113.492 129.650-163.168 129.112 -95.037 110.592 -57.574 142.139-100.881 92.419 -25.466 103.957-115.101 95.189 90.553 0.000 0.000 125.557-118.079 136.387 27.661 123.999-144.083 175.407 -83.195 126.394 -95.483 141.615-116.699 129.332-168.515 162.245-135.340 127.090-129.821 134.406 -47.371 124.641 -98.817 135.349 -88.421 128.393-163.029 161.983 173.026 108.367-123.909 158.973-153.639 91.830 42.720 128.787 -75.781 92.440 43.180 111.817 -49.557 94.037 42.402 144.597 -75.784 91.674 43.497 124.240 -72.865 92.908 38.088 127.399 108.566 93.244 40.421 148.389-138.835 91.923 41.976 125.350 -74.664 93.539 41.972 143.499-150.447 92.644 43.985 127.902 123.961 91.612 45.527 117.378 -73.219 92.267 68.301 124.519-103.760 90.915 59.886 128.547 -75.511 93.558 75.971 132.495-164.307 92.768 -72.946 158.020 2.530 94.422 -51.505 159.353 -42.049 94.278 156.022 0.000 0.000 92.161 57.196 107.252 -76.452 94.733 36.630 77.886 -86.149 99.400 26.540 0.000 0.000 99.047 31.131 120.981 -88.587 97.610 28.585 147.490-100.956 98.824 31.862 122.716 -73.632 96.965 33.312 123.573 155.033 96.336 32.392 151.036 -39.106 93.995 43.011 152.081 -20.952 90.960 53.658 133.184 -79.760 91.449 43.762 133.922-109.026 91.103 39.881 135.986 80.594 94.052 44.586 120.267 -87.873 92.697 42.402 127.267 -97.112 92.833 45.317 125.567-127.682 92.823 62.625 141.576 -75.167 94.723 53.541 137.826-112.103 117.610 0.000 135.223-178.892 # 23 total E -7.14322E+02 rmsd from N 0.000 %NC 0.00 1 91.605 108.900 132.054 -79.584 125.624 -83.811 131.873 -83.936 116.692 -98.679 140.346-151.537 91.333 54.243 131.325 -77.134 92.512 42.102 120.720 -91.166 92.886 45.346 145.622-106.164 93.302 38.688 103.132 -57.365 94.734 38.568 176.490 171.550 93.870 36.258 120.888 -45.892 93.799 40.502 141.323-102.475 95.467 32.723 116.428 -78.264 95.565 40.387 156.515-144.521 94.601 37.226 143.641-114.743 95.238 47.584 0.000 0.000 93.584 92.912 144.047-100.415 96.501 -4.036 142.444-110.291 93.933 -81.728 157.763-164.610 92.743 -0.749 104.199-124.369 96.499 95.185 0.000 0.000 129.122-124.656 150.580 -8.562 111.358 162.130 164.123 -27.892 94.345 68.165 146.559 -77.829 93.594 124.905 142.313 -77.038 92.690 57.543 127.190 -68.627 92.073 116.187 131.350 -78.200 91.775 -30.371 168.834 -98.613 91.860 -58.327 147.546 -26.634 91.518 14.801 129.095 -76.013 123.680 -89.005 146.458 18.022 119.559-169.462 134.868-120.896 131.118-104.197 141.001 -78.771 91.583 49.185 136.631 153.858 91.020 48.541 134.294-129.771 90.773 46.602 127.834 -76.058 91.969 43.644 138.509-124.071 91.427 45.964 131.080-129.406 91.090 46.611 123.823 -90.772 91.627 52.414 109.266 -57.163 91.042 44.943 130.509 -77.660 94.286 86.763 129.670-145.990 92.818 -62.080 157.407-175.205 94.458 -56.431 141.839 -98.142 94.472 169.167 0.000 0.000 91.418 53.839 132.404 -97.890 93.132 35.259 79.841 -85.013 97.504 33.685 0.000 0.000 96.833 33.921 119.269 -91.680 96.006 31.138 101.263 -56.676 96.462 37.762 167.687-150.003 94.590 37.314 118.545 130.373 93.348 39.392 151.147-144.843 92.391 43.231 151.315 -22.489 90.768 47.531 133.933 -79.041 91.476 43.442 143.143 -77.693 90.862 43.367 138.216 83.207 93.152 44.492 110.521 -74.309 92.845 40.157 130.047 -99.517 94.071 49.206 125.525-119.626 93.256 63.051 141.863 -74.825 94.699 81.729 126.434-124.581 118.048 0.000 131.726-156.050 # 24 total E -6.79332E+02 rmsd from N 0.000 %NC 0.00 1 91.568 56.770 135.771 -86.322 121.162 169.037 116.917 -91.021 95.882 53.161 137.478-161.688 92.281 -93.688 176.417 -87.330 92.379 3.702 98.731 -54.867 95.612 83.940 114.396 -50.455 132.291-106.267 172.141 -40.205 114.858 -31.324 110.791 -67.080 93.148 178.798 132.267 -62.073 92.018 86.279 126.631 124.231 91.642 66.330 139.250 -71.920 93.299 58.118 96.492 -74.878 100.832 -83.614 136.364 -90.887 104.120 -28.372 164.396-123.999 115.328-160.470 155.560 -95.450 128.493 -53.431 157.981 37.489 127.432-162.348 116.776 -91.665 115.602 -4.129 116.369 113.502 94.969 89.814 167.044-117.212 127.279-121.993 125.154 -48.940 125.760-155.803 132.867 -80.630 122.196-104.110 165.920 -61.638 125.515-111.891 132.208 -62.739 92.226 45.004 137.509 -77.560 91.065 49.186 129.547 -76.719 92.242 42.878 149.239 -99.964 91.833 44.038 105.636 -63.401 91.452 42.537 127.566 -75.592 92.346 40.400 109.911 -48.243 93.609 42.076 110.492 -75.089 91.780 42.876 118.939 -75.452 91.930 44.107 124.056 140.494 91.434 46.149 165.458 -21.480 91.207 41.881 128.691 -76.305 92.792 42.331 152.256-125.830 91.996 44.229 123.442 136.819 91.581 42.737 113.301 -62.408 92.869 42.212 120.044 -71.413 91.116 46.915 128.301 -76.057 91.920 44.059 127.920-148.666 91.930 47.325 152.365-143.874 93.245 35.370 121.403 -87.062 94.475 47.474 0.000 0.000 92.808 41.690 135.641-109.563 93.516 36.057 113.275 -63.225 96.229 37.670 0.000 0.000 94.728 38.946 121.139 -79.739 94.157 36.554 145.035-119.147 95.269 36.992 142.331-122.148 94.561 39.033 127.110 110.551 93.444 39.752 144.580-125.680 92.787 43.071 148.710 -26.066 91.193 44.237 131.267 -78.462 92.624 43.605 126.983-100.975 91.545 41.490 141.401 82.569 93.787 42.797 141.593 -75.932 92.895 41.272 133.070-105.271 93.803 50.736 124.478-116.742 92.950 64.052 141.692 -74.985 94.691 81.200 125.317-127.163 118.007 0.000 132.228-155.992 # 25 total E -6.66862E+02 rmsd from N 0.000 %NC 0.00 1 91.566 48.276 133.100 -89.216 94.791 153.181 114.788 -88.147 118.528 148.804 107.205 -87.318 133.861 -84.272 157.295 -90.856 131.048-141.612 134.915-101.844 123.519-145.619 168.379 -79.426 133.155-153.019 150.447 -54.736 93.017 81.411 119.099-135.158 122.423 -85.944 136.518 57.770 128.987-119.870 153.210-114.941 123.610-146.618 166.058 -44.101 109.484 -47.984 148.633-106.896 92.868 -32.056 140.853-101.124 95.084 98.392 164.396-123.999 117.745-129.740 150.274 -81.531 130.037-108.410 171.792 -89.596 124.828-142.044 167.928 -15.866 125.836 48.117 117.503 121.552 95.459 94.431 151.550 -22.359 123.999 -85.767 134.663 8.176 128.061-125.610 173.179 -69.201 125.385-154.958 151.282 54.111 133.063 -71.874 146.254 -93.692 127.417 -30.670 77.341 -49.238 127.314 169.951 143.696 -92.400 133.461-102.671 112.540 -67.695 94.226 -12.851 101.748 -79.888 121.236 -46.847 148.265 -84.713 112.582-162.975 133.518 22.617 129.442-167.675 169.376 -69.294 126.741-108.891 135.543 -26.008 105.300 -11.401 101.394 -63.307 131.737-107.731 139.847 138.310 126.279-147.696 148.047 -60.100 92.123 48.218 149.210-116.490 90.959 43.358 122.514-166.269 91.198 45.857 114.746 -48.139 92.627 40.928 130.433-118.401 91.142 47.593 128.177 -76.010 91.771 43.719 127.024-147.699 92.017 47.104 147.453-129.786 93.396 35.146 122.085 -87.950 94.603 47.066 152.890-158.287 92.882 41.566 136.954-111.290 93.531 36.095 113.414 -63.474 96.206 37.760 133.125 -99.223 94.705 38.985 120.358 -78.973 94.137 36.616 145.107-120.191 95.231 37.084 142.245-122.281 94.525 39.122 127.267 110.270 93.415 39.807 144.452-125.714 92.771 43.095 148.707 -26.049 91.191 44.261 131.262 -78.454 92.618 43.623 126.964-101.021 91.544 41.495 141.394 82.548 93.785 42.800 141.593 -75.938 92.895 41.276 133.058-105.288 93.802 50.760 124.469-116.754 92.948 64.059 141.691 -74.989 94.689 81.232 125.297-127.206 118.006 0.000 132.242-156.022 # 26 total E -6.80242E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.673 135.421 -74.503 124.991 -82.392 132.192 -84.247 116.891 -98.455 135.402-143.131 91.347 52.087 131.625 -77.936 92.539 43.486 137.032 -73.682 93.031 43.943 169.524 -75.412 92.574 41.140 106.192 -63.598 93.154 42.346 130.952-117.698 92.281 39.861 113.185 32.175 92.463 43.512 148.036-108.706 92.032 49.142 120.647 -84.860 92.692 42.440 130.212-111.457 93.837 35.001 145.834 115.132 95.314 48.069 171.212 -76.272 92.429 44.799 134.068 -81.043 93.182 68.576 121.236 -64.449 91.714 82.690 150.577-159.507 92.893 3.149 127.616-100.359 120.256 -33.735 0.000 0.000 127.747-167.261 142.777 18.685 129.870-162.671 137.203 -58.002 119.215-167.494 169.002 -99.431 127.134-170.684 157.427-172.540 120.453-174.898 135.363 61.391 91.489 93.891 130.294 -77.242 93.202 -4.444 164.299-120.176 93.654 -84.708 112.395 -87.303 93.498 175.670 128.640 -75.670 127.486-173.945 149.058 -53.912 126.639-173.067 156.794 8.133 121.025-168.161 156.466 -72.093 125.047-161.930 133.618-144.256 92.127 53.514 166.959-166.339 91.322 44.725 128.670 -76.884 92.807 42.706 135.813-140.693 91.912 42.860 127.710 130.041 91.445 44.720 114.195 -63.867 92.545 41.923 124.772-102.010 91.139 46.846 128.215 -75.925 91.937 43.671 128.568-149.235 92.168 45.992 150.659-132.513 93.600 35.248 120.196 -86.991 94.730 44.527 0.000 0.000 92.785 41.964 135.885-109.252 93.592 35.525 139.173 -22.684 96.272 37.903 0.000 0.000 94.643 39.049 121.671 -79.780 94.039 36.639 145.417-114.969 95.318 37.024 165.368-112.997 94.555 39.024 126.840 111.134 93.470 39.632 144.583-125.763 92.841 43.021 148.669 -26.253 91.210 44.201 131.395 -78.573 92.632 43.609 127.155-100.932 91.546 41.475 141.354 82.619 93.789 42.787 141.566 -75.922 92.896 41.279 133.098-105.396 93.802 50.741 124.529-116.745 92.949 64.051 141.689 -74.984 94.691 81.206 125.283-127.149 118.007 0.000 132.223-155.991 # 27 total E -6.46589E+02 rmsd from N 0.000 %NC 0.00 1 91.568 61.211 136.721 -71.693 134.502 -48.278 141.689 -92.032 116.031-138.977 104.347 -70.132 127.404-143.319 132.056-128.059 128.745-134.771 139.857 -70.402 129.781 -64.080 175.355 -59.276 126.236 85.334 137.351-111.057 116.815 -4.230 150.001-104.566 123.048-104.441 135.646 55.498 127.831-127.785 143.488-100.303 125.029-157.071 172.547 -52.958 124.215-164.352 167.237-153.460 108.326 -64.052 142.060-113.101 98.287 -17.300 151.724 49.023 93.530 86.073 140.526 -90.458 128.610-130.806 149.479 -99.103 125.749-166.531 166.603 -11.618 126.533 -84.266 147.989-107.840 123.203 -36.770 152.191-110.805 133.102-133.687 149.475 102.881 96.514 88.598 143.782 -75.099 123.908 -16.247 124.227 -56.339 120.072-118.016 136.407-103.276 130.391-152.264 161.198 105.072 131.149-117.766 153.735-106.054 125.435 -17.727 171.814 -64.386 117.958-101.784 155.935 -19.516 90.917 47.156 128.988 -75.995 91.053 46.992 113.904 -46.103 92.041 47.519 143.232 -73.834 90.997 43.959 128.093 -75.939 91.729 40.522 131.057 101.436 91.752 44.629 153.446-138.998 91.115 44.697 127.444 -75.809 93.057 38.180 176.442-169.248 93.128 41.355 121.498 131.847 92.085 41.992 116.561 -68.391 93.263 42.969 119.362 -56.817 91.402 47.191 129.784 -77.870 92.875 52.896 129.387-166.465 92.661 74.984 153.529-118.489 106.967 -84.546 133.878-104.745 118.470 -9.413 144.358 -91.955 123.318-113.663 112.424 -75.274 94.095 52.406 95.886 -79.704 122.550 -3.679 104.286 -52.421 93.948 47.363 123.039 -90.342 95.708 26.812 152.886-110.240 97.736 37.017 144.448-109.127 96.318 30.972 112.243 111.328 96.500 34.474 149.247-135.052 94.627 40.466 153.405 -16.032 91.420 45.281 131.250 -81.951 91.829 46.823 141.612 -73.985 90.881 42.836 136.116 87.498 93.645 40.486 138.546 -74.415 92.801 42.511 126.654-120.548 94.176 55.481 134.004-132.143 92.839 77.335 138.783 -74.003 94.486 49.867 124.130-142.368 115.993 0.000 159.363 -65.033 # 28 total E -6.51158E+02 rmsd from N 0.000 %NC 0.00 1 91.568 48.895 133.046 -85.289 95.102 153.330 131.295 -91.878 93.641 75.851 116.018 -98.983 91.499 -52.688 129.650 -75.814 126.908-113.061 150.847 -82.783 121.513-154.461 100.270 -72.139 94.190 16.368 123.170-106.466 134.692-165.402 146.276 23.769 91.995 24.291 110.066 40.233 116.153-152.367 152.402-101.980 122.266-154.508 168.200 -26.971 126.303-168.608 156.097-118.998 114.404 -63.454 152.843-102.133 98.574 -15.767 151.724 49.023 93.776 88.021 139.131 -90.410 128.662-142.266 148.743 -93.761 124.542-169.753 165.370 -12.941 132.430-105.525 158.649-120.167 119.362 -7.830 133.130 -61.013 121.981-140.023 123.503 24.953 124.286 -69.133 129.435 -49.960 136.431 -67.093 176.437 -54.909 142.101-167.990 120.122-107.345 125.790-149.597 162.733 -60.799 91.713 68.244 131.180 -77.255 126.936-113.510 128.785 -76.073 94.600 125.562 104.372 -85.403 132.124-109.233 135.930 -68.635 126.813-134.835 122.208 58.160 136.905-166.984 137.281 -22.949 124.860-159.205 149.232 -91.249 132.519-164.743 149.294 -31.225 105.747 -42.325 147.365 -84.959 92.431 -79.299 127.947 -74.912 92.434 75.058 135.812 -82.416 92.406 47.291 128.049 138.308 110.087 173.618 137.155 119.241 122.329-165.770 159.862 156.011 126.523-154.243 157.405 -84.841 120.648-151.103 153.808 148.916 117.409-178.662 156.887 12.866 104.751 -58.707 169.671 -34.802 102.784 -25.026 0.000 0.000 93.965 90.738 124.957 -94.157 119.587-134.895 152.625-162.100 130.265-167.946 0.000 0.000 128.847-127.914 141.234-109.316 117.960-162.307 133.827 66.571 94.496 90.881 145.252 -76.370 93.227 41.890 120.730 115.228 94.408 34.681 147.980-130.481 94.511 43.857 148.621-117.423 91.405 44.643 135.453 -81.470 92.543 41.485 125.533 -92.698 92.014 39.046 141.914 85.499 94.408 41.905 117.442 -77.789 93.189 40.809 140.186-109.544 93.987 50.584 127.894-112.884 92.836 64.088 141.795 -74.071 94.695 80.848 124.011-128.197 118.009 0.000 132.188-156.421 # 29 total E -6.86534E+02 rmsd from N 0.000 %NC 0.00 1 91.568 49.674 119.462 -71.378 128.741 -90.831 114.199 -91.585 111.836 168.141 96.958 -91.090 132.568-168.581 134.866 -88.642 94.707 27.682 119.423-120.714 132.746-141.338 146.541 -91.533 129.289 -80.583 165.816 -46.062 94.218 44.775 169.861 -2.597 91.607 47.141 125.739 -52.255 91.702 44.025 121.242-116.232 91.889 49.659 116.783 -95.371 92.504 70.273 153.551-153.814 92.273 12.545 132.868-113.215 107.573 -97.908 151.724 49.023 109.369 153.544 131.803 72.101 94.361 82.869 143.249 -73.505 92.380 138.407 138.603-155.261 104.420 -64.940 105.719 106.877 94.137 20.192 0.000 0.000 124.354-142.390 144.650 -12.333 127.861 -81.844 173.794 -59.159 123.163-160.665 126.556-123.692 127.136-154.118 122.469 -68.435 115.763 -65.386 162.093 128.167 92.035 -19.900 130.515 -77.246 95.168 88.864 142.488 -76.778 128.030-129.812 156.482 -22.367 128.479-149.600 145.572 -86.231 92.214 40.399 142.897 11.134 123.608-164.057 75.638-126.988 90.934 65.603 130.143 -77.342 92.130 39.934 117.604 0.540 92.834 43.278 160.564 152.904 91.599 43.355 128.927 -77.082 93.009 42.813 109.198 -83.440 92.047 41.737 161.782-165.325 91.481 43.090 117.593 -73.236 92.886 42.792 132.757-136.373 91.052 46.742 127.886 -75.883 91.898 42.890 128.223-150.188 92.262 45.878 150.155-130.842 93.660 35.147 122.477 -86.459 94.790 44.380 164.220-142.818 92.811 41.929 136.681-109.894 93.594 35.548 139.159 -22.646 96.251 37.986 0.000 0.000 94.621 39.091 121.357 -79.505 94.025 36.675 145.478-115.396 95.300 37.059 165.304-113.253 94.537 39.077 126.924 111.025 93.455 39.662 144.535-125.794 92.834 43.029 148.663 -26.270 91.209 44.203 131.391 -78.566 92.630 43.622 127.165-100.984 91.545 41.476 141.331 82.628 93.788 42.790 141.567 -75.926 92.896 41.278 133.081-105.387 93.801 50.760 124.533-116.789 92.949 64.062 141.687 -74.986 94.690 81.201 125.276-127.195 118.008 0.000 132.224-155.942 # 30 total E -6.55145E+02 rmsd from N 0.000 %NC 0.00 1 125.316-128.616 163.496 58.309 130.595 -72.650 142.390 -91.777 117.505-145.476 99.243 -77.895 121.094-150.458 176.430 -92.087 95.234 45.801 142.759 -77.406 137.086 173.036 143.210 -82.799 125.406-174.084 164.219 -4.260 107.362 24.196 125.024-153.987 111.559-167.279 124.354 51.590 123.379-163.735 158.290 -2.204 118.793-169.022 127.857 -92.403 118.749 -62.047 162.954 166.672 92.787 -22.040 139.777-109.109 95.112 96.990 164.396-123.999 121.513-145.448 143.080 -67.399 122.926-161.846 128.629-108.148 129.802-150.194 156.787 142.241 112.021 13.682 109.886-120.170 120.400-166.928 151.550 -22.359 118.109-169.533 138.493 -9.201 95.355 42.693 119.868 -79.936 122.002-172.599 159.927 -77.978 129.240-161.349 144.386-122.943 125.765-101.713 149.236 61.195 91.750 44.113 128.512 -76.223 92.498 42.384 146.315 -98.020 91.728 46.145 137.324-145.413 91.348 44.329 128.484 -76.536 92.661 36.997 111.435 -49.136 94.158 40.718 143.354 -74.524 91.246 49.810 135.903 -80.264 90.755 44.916 128.441 171.218 91.094 41.865 137.841 -50.764 90.800 47.468 127.890 -74.717 91.636 44.820 139.892 -51.486 91.856 43.432 157.936-138.008 91.908 39.162 118.944 -78.693 92.530 51.765 103.977 -51.185 90.942 68.406 121.904 -72.648 91.675 43.999 121.964-133.690 93.257 77.622 151.429-118.036 110.567 -25.580 138.460 -93.504 122.052-134.361 0.000 0.000 124.039 108.547 168.669 -84.130 90.649 -36.275 101.293 -81.036 92.148 -43.834 0.000 0.000 115.622-131.661 141.719 -93.702 92.938 36.825 170.533-161.979 92.531 53.444 144.331 -71.120 92.724 44.231 130.851 107.861 92.674 36.885 138.852-157.534 93.639 41.200 147.305 -31.181 91.462 46.033 132.099 -78.407 92.325 45.721 142.497 -75.171 90.771 42.529 141.499 -78.563 92.881 44.037 110.838 -79.974 92.977 38.999 136.897-112.583 94.316 46.621 126.592-112.266 93.362 63.218 143.012 -75.820 94.711 80.370 125.170-115.067 118.090 0.000 131.190-158.020 # 31 total E -7.15194E+02 rmsd from N 0.000 %NC 0.00 0 91.568 60.069 134.887 -75.180 125.089 -82.675 131.959 -83.809 116.867 -99.469 135.965-144.204 91.334 53.156 130.991 -76.950 92.313 45.037 118.232 -92.154 92.886 41.159 164.741 -86.341 92.660 42.599 123.031 -88.578 93.277 41.432 144.265 57.784 91.665 44.542 124.875 105.940 91.440 45.850 146.287-107.283 91.574 43.201 134.340 -67.937 92.397 46.133 150.358 125.238 92.522 40.549 176.432-150.197 94.119 52.235 0.000 0.000 92.854 97.427 143.971-101.755 95.777 -3.058 140.640-104.117 93.585 -82.141 148.130 162.524 92.903 -0.695 106.213-126.569 96.364 97.641 0.000 0.000 128.911-146.450 142.429 -23.925 121.433-164.988 139.345 -61.181 126.459 -76.725 125.919-123.219 123.091 -82.339 128.819 -79.978 92.484 49.210 138.975 -77.619 91.248 46.455 129.787 -76.850 92.320 44.978 150.737-106.100 91.420 44.223 107.068 -64.651 91.248 42.906 127.687 -75.764 92.336 40.475 110.434 -49.461 93.872 41.018 144.381 -74.786 91.437 44.453 128.919 -77.895 91.688 42.815 141.395 138.873 91.414 45.456 144.492 -59.997 91.049 43.580 127.426 -76.142 92.653 41.216 134.179-129.400 92.218 43.204 139.657-142.039 91.587 43.055 118.616 -72.650 92.767 42.020 122.094 -96.546 91.124 46.862 128.417 -76.191 91.904 43.881 125.787-145.475 92.120 46.147 160.169 -20.903 93.378 36.194 120.035 -86.986 94.456 45.420 0.000 0.000 92.639 42.119 136.363-109.502 93.544 35.593 137.942 -17.351 96.242 38.018 0.000 0.000 94.614 39.161 121.670 -80.147 94.030 36.618 145.376-115.162 95.323 37.046 165.832-112.656 94.553 39.001 126.793 111.239 93.479 39.616 144.587-125.741 92.847 43.005 148.677 -26.247 91.212 44.195 131.400 -78.580 92.636 43.605 127.159-100.924 91.549 41.466 141.361 82.633 93.790 42.784 141.566 -75.923 92.900 41.284 133.100-105.374 93.797 50.729 124.543-116.744 92.951 64.039 141.680 -74.980 94.692 81.204 125.292-127.120 118.004 0.000 132.222-155.998 # 32 total E -6.47735E+02 rmsd from N 0.000 %NC 0.00 0 91.576 52.377 129.934 -86.175 121.390 -59.000 138.897 -75.121 114.927-131.783 146.846-164.628 91.332 50.207 130.961 -76.856 92.739 44.993 117.215 -86.120 94.680 33.061 118.443 -33.823 94.756 51.843 170.657-139.042 92.700 68.189 91.648 116.548 91.335 44.557 149.328 -74.835 118.266-160.777 108.410 -88.713 123.752-106.286 128.996 -97.700 132.557-174.069 160.290 -95.568 99.872 -59.677 130.891-121.612 98.841 -23.573 151.724 49.023 93.566 83.031 127.984 80.326 123.324-118.796 139.917 -86.089 132.123-174.018 162.794-173.693 126.076 -81.791 138.408 -90.902 124.333 -12.037 0.000 0.000 122.816 -98.105 123.122 48.975 127.961-110.360 140.976 -90.630 124.949 175.540 169.078 -56.880 95.000 96.015 141.649 -75.554 93.726 -2.426 90.488 36.326 92.098 -85.130 131.271 -78.479 109.769 169.248 167.770 -96.708 91.262 64.270 144.013 -9.978 90.912 49.743 126.980 -74.946 92.114 41.453 109.821 -52.783 93.996 40.897 143.841 -74.610 91.448 44.974 131.640 -80.525 91.150 47.675 145.548 138.445 90.336 49.184 143.569 -55.947 90.405 47.402 128.194 -76.822 91.846 44.907 149.081-122.316 91.431 53.137 138.072-152.846 90.914 66.486 126.111 -85.373 92.243 125.646 134.193-120.175 91.271 40.551 128.326 -75.218 101.619-166.839 134.851-152.489 121.020 -74.130 167.203 -18.687 92.765 -14.772 159.521 -42.154 94.403 99.552 0.000 0.000 122.348-155.451 166.887 -70.472 92.844 27.252 92.092 -79.792 125.076 -91.755 0.000 0.000 131.651-154.107 146.401-124.593 127.822-163.849 159.744 -35.224 126.874-144.398 135.392-128.004 126.149-162.199 131.731 -44.383 115.657 -67.106 145.236 -34.331 93.459 -17.415 146.605 -16.646 92.976 91.007 129.644 -76.414 128.659-137.810 169.621 -37.736 130.207-165.965 161.570-135.021 122.760-156.015 145.756 10.385 126.354-156.435 174.570 176.399 92.256 60.567 126.321-134.211 92.231 95.131 142.318 -78.358 95.065 59.631 97.154 -98.078 117.184 0.000 140.203-168.600 # 33 total E -6.45688E+02 rmsd from N 0.000 %NC 0.00 1 91.569 61.266 136.024 -75.699 124.045 -92.514 133.025 -91.444 112.081 113.287 101.571 -76.340 91.903 10.079 129.858 -76.786 123.216-163.126 134.372 -76.853 129.218-159.811 155.985 -44.646 126.644-167.234 141.362 -76.859 135.295-151.169 149.375 179.773 122.704 10.094 56.944 -92.274 93.014 175.868 133.104 -46.495 128.808-165.039 148.824 76.878 122.067-160.182 162.446 133.601 101.259 -55.969 110.762 -94.130 104.924 -32.295 171.212 -76.272 93.214 84.061 128.906 84.576 127.704 160.520 167.821-119.105 124.556-168.585 149.419 33.765 122.702 -75.487 113.341-110.070 94.172 17.005 112.685 -60.578 124.131-154.491 154.357 -48.061 123.718-166.014 157.494 -7.162 121.876-172.540 164.854 -66.418 128.300-151.881 149.852 153.284 119.650 20.162 151.406 -79.519 92.208 106.639 130.903 -77.736 93.711 -17.935 169.788-107.562 93.224 -68.387 146.559 158.080 91.458 10.267 127.792 -76.024 117.091-162.976 135.036 29.267 127.692-163.228 139.635 -46.691 122.866-165.233 143.548 -82.551 128.407-148.076 151.833-166.818 118.032 -46.816 106.639 -20.253 138.941-105.894 166.470 -80.774 125.913 167.051 87.083 -73.417 93.114 80.341 131.150-142.588 92.131 71.468 147.287 168.024 118.153-109.373 149.197-108.297 124.899-174.860 165.768 -85.889 93.954 56.848 118.984-145.198 93.736 99.800 150.492-113.802 111.740 -11.225 115.212 -91.268 121.214-125.113 0.000 0.000 122.316 107.903 169.347 -89.542 90.603 -40.209 140.948-158.217 91.925 -39.021 0.000 0.000 115.895-130.068 131.468 -83.276 91.833 46.014 167.906 175.710 92.053 44.504 112.686 -51.349 93.015 42.711 129.097 120.701 92.674 39.478 143.476-136.725 92.157 44.983 152.303-109.218 90.776 47.599 133.546 -81.479 91.114 47.139 124.618-113.266 90.367 45.154 142.597 84.032 93.058 43.688 136.491 -70.734 92.626 42.346 125.807-119.557 93.649 46.301 120.423-123.043 93.159 64.817 127.313 -86.075 94.607 82.542 127.659-117.930 118.081 0.000 131.271-155.431 # 34 total E -6.74559E+02 rmsd from N 0.000 %NC 0.00 1 91.564 65.674 137.786 -67.890 128.186 -98.283 133.204 -82.782 118.571 -99.334 132.213-136.457 91.191 54.348 132.205 -77.506 91.616 45.013 114.137 -88.298 91.496 45.714 158.187 -71.665 92.574 40.731 119.688 -82.761 93.932 40.452 176.450-171.697 93.380 38.745 116.657 116.299 93.076 40.144 137.039 -82.591 93.322 42.859 115.058 -95.010 93.316 43.285 155.099-171.841 93.607 38.986 173.191-149.858 95.023 52.043 0.000 0.000 93.174 97.713 156.582-101.187 96.044 -5.746 139.433-108.367 93.685 -78.908 145.291-148.551 92.967 -4.733 105.417-124.041 96.214 94.565 0.000 0.000 130.504-127.358 144.141 7.549 122.065-154.051 165.324 -58.522 127.494 -84.027 138.057-115.830 123.601 -85.911 127.948 -81.053 92.392 48.385 138.889 -77.225 91.204 47.193 129.721 -76.800 92.404 43.366 148.663-104.935 91.403 45.077 113.522 -71.286 91.206 42.795 127.649 -75.725 92.208 41.645 110.262 -49.432 93.957 38.967 138.484 -75.250 91.422 47.863 129.711 -78.944 91.420 44.693 142.433 138.197 91.151 44.880 144.061 -55.351 90.915 44.994 127.415 -76.641 92.291 45.983 132.655-133.678 91.514 43.468 138.910-140.791 91.114 46.543 118.477 -79.463 91.648 59.328 125.087-110.347 90.724 50.496 128.919 -75.953 93.328 79.323 130.359-154.109 92.759 -66.775 159.030-151.918 94.882 -57.428 138.687-103.577 94.683 164.972 0.000 0.000 92.489 66.536 121.707 -84.545 93.265 60.106 84.523 -87.452 95.506 44.321 0.000 0.000 111.962 167.355 169.366-143.408 131.309-170.587 160.100 25.542 125.617-155.439 131.533-129.125 133.876-165.582 144.927 27.943 116.888 -65.684 160.351 -10.515 94.264 -17.254 145.585 -19.244 92.858 96.224 129.821 -76.249 123.671-148.981 167.421 -43.083 130.871-169.038 137.290 -79.020 125.684-148.852 164.733 3.424 126.593-114.395 155.738-172.644 93.666 68.989 151.081 120.024 92.237 83.778 141.119 -76.729 94.583 81.599 91.107 -98.677 117.354 0.000 139.279-139.942 # 35 total E -6.92537E+02 rmsd from N 0.000 %NC 0.00 1 91.569 60.285 135.925 -75.889 123.148 -77.325 131.038 -90.194 116.875-140.606 99.329 -74.905 128.767-158.304 142.317 -93.083 128.538-168.365 176.471 -95.665 94.499 23.949 118.081 -93.008 117.103-154.413 113.688-101.035 130.561-118.885 162.109 29.565 131.050-128.579 114.046 -60.863 115.978-176.212 137.172 98.202 94.740 73.749 146.216 -70.233 117.553 136.838 145.118 -83.313 85.828 -54.587 134.850 -98.495 95.256 -33.210 164.396-123.999 93.688 86.195 149.004-100.999 127.802 -84.194 139.741 -88.890 122.239-158.713 154.652 -5.900 129.926 -87.006 147.301 -98.453 129.053 -41.283 151.550 -22.359 129.145-165.598 138.341 -27.323 130.769 -82.602 120.014 -69.587 131.988 -19.216 126.628 -75.651 121.878-150.586 115.867 -83.713 134.398 177.358 54.574 -47.287 90.938 1.931 162.836 -86.222 111.551-119.385 119.066 -66.486 92.411 43.631 100.013 -91.324 91.304 68.239 130.050 -76.609 92.112 40.407 108.897 -42.311 92.935 46.362 162.552 -25.253 90.958 45.078 131.042 -79.725 91.783 41.950 157.593-169.120 91.522 44.296 142.546-136.909 90.624 49.654 127.647 -76.900 91.998 41.887 129.510-109.368 92.101 44.226 136.833-142.673 92.087 40.383 122.714 -89.715 93.580 41.510 112.610 -66.247 91.250 46.624 130.229 -78.693 92.014 44.166 125.767-147.287 92.021 46.551 154.173-148.909 93.399 35.567 119.930 -85.662 94.610 44.831 0.000 0.000 92.727 42.037 135.476-108.102 93.579 35.521 139.136 -22.462 96.266 37.948 0.000 0.000 94.628 39.067 122.239 -80.330 94.030 36.745 145.337-114.594 95.318 37.008 165.574-113.676 94.569 38.953 126.335 110.600 93.525 39.383 144.426-126.120 92.891 42.949 151.038 -28.884 91.179 44.562 131.715 -78.807 92.414 44.643 128.324-100.256 91.334 41.848 140.912 81.985 93.654 43.051 115.810 -83.066 92.960 40.993 132.946-108.761 93.949 50.424 124.157-118.054 93.046 64.100 141.776 -74.497 94.687 81.513 123.550-128.045 118.017 0.000 132.087-155.781 # 36 total E -6.53510E+02 rmsd from N 0.000 %NC 0.00 1 126.154-140.622 132.463 -65.741 122.965-160.446 122.112 -85.322 92.601 105.341 142.057-172.362 91.989 111.425 133.028 -78.790 93.114 8.996 141.133 -77.634 124.644-129.233 147.177-107.802 126.139-100.616 162.397 -14.168 121.234-150.918 170.810 7.225 125.594-159.349 105.445-106.388 92.636 -7.017 136.068 141.106 126.007-131.986 174.476 -41.738 123.971-163.292 167.203-120.277 102.451 -63.444 123.386-129.617 97.131 -19.265 0.000 0.000 93.276 89.738 114.469 72.915 122.276-128.708 163.181 -63.256 123.880-150.916 154.418 171.960 94.626 3.075 153.815-103.540 117.189-145.702 145.635 -33.281 123.440-153.281 143.136 42.440 131.015 -99.343 162.863 -57.533 125.942-138.653 126.257-100.658 130.769 -88.487 174.897 -39.874 128.722 177.469 160.167 -68.790 91.062 -24.380 131.248 -78.048 112.990-110.175 125.271 -68.445 92.247 44.639 94.440 -76.996 91.281 49.959 127.493 -75.501 91.822 40.960 153.418 -70.688 93.828 44.301 151.267 -1.957 91.757 39.072 127.476 -75.775 93.596 38.632 135.147 -69.343 93.412 42.687 144.543 -67.892 91.769 41.793 132.552 -79.827 92.974 40.454 122.607-163.570 92.293 42.732 143.578-143.041 91.351 45.563 119.445 -74.141 91.840 48.911 131.593-107.882 91.126 46.023 128.987 -76.034 93.787 84.316 128.570-149.821 92.730 -64.937 152.754-162.878 94.877 -56.045 143.604-104.401 94.845 165.451 0.000 0.000 91.975 84.153 127.979 -89.824 93.156 52.694 89.033 -89.120 95.089 102.003 0.000 0.000 117.143-112.147 109.617 -87.368 92.633 50.348 149.840-107.756 93.196 41.796 144.571 20.457 93.195 43.961 118.940 131.433 92.367 39.190 143.217-114.288 92.315 45.778 152.107 -21.806 91.147 44.163 135.054-106.072 91.683 44.909 129.131-133.448 90.944 42.041 139.073 83.825 93.244 44.591 106.139 -65.047 92.841 39.045 127.206-105.824 94.244 50.505 121.801-122.753 93.200 63.863 141.821 -74.320 94.690 82.088 126.070-121.707 118.092 0.000 131.131-156.159 # 37 total E -6.55183E+02 rmsd from N 0.000 %NC 0.00 1 125.246-131.682 164.285 53.645 129.697 -63.755 142.241 -92.587 115.623-148.055 99.656 -77.423 123.829-162.518 169.688 -91.766 93.643 37.345 142.362 -78.176 125.611-174.024 136.488 -85.858 123.257-165.411 151.670 -47.002 93.874 50.067 118.487-155.710 125.449 170.487 114.593 60.555 124.881-165.904 162.060 9.172 118.275-170.610 134.428 -84.506 121.564 -59.968 153.493 138.050 92.398 -25.401 157.244 -38.240 94.106 99.492 0.000 0.000 120.124-146.426 140.557 -80.699 122.572-158.793 116.473-106.669 121.795-163.325 148.957 156.535 93.709 47.980 108.555-121.007 125.480 179.802 0.000 0.000 121.048-163.628 133.181 6.863 95.566 34.419 139.601 -75.144 126.237-171.861 151.130-118.467 128.989-173.499 159.105 -22.307 125.061-179.503 150.511 78.673 91.976 70.828 130.661 -76.944 95.657 60.860 130.058 -98.481 92.579 -78.851 138.923-177.407 90.576 -29.913 129.969 -76.899 105.611-166.195 146.924 10.562 126.939-171.497 147.639 -28.060 132.251-155.999 128.979-129.468 127.192-156.586 144.899 160.436 96.388 -37.083 140.860 -76.875 91.802 -80.600 129.025 -76.284 91.961 71.510 114.265 -39.983 93.422 49.782 151.579-147.523 105.113 179.058 132.629 81.490 129.184-168.314 151.980-150.202 132.032-160.433 137.455 -37.166 126.342-153.542 158.997-179.615 116.619-177.855 152.745 11.764 101.814 -57.944 155.850-121.922 103.868 -26.265 102.580 -55.005 93.841 91.017 124.782 -94.990 118.575-128.672 151.610-162.110 132.465-164.796 149.051 -85.907 128.137-145.307 166.334-123.389 123.067-165.334 161.489 34.395 93.896 84.897 141.414-119.811 93.093 44.514 123.885 113.382 93.539 37.116 147.605-121.139 93.625 44.828 151.397 -32.311 91.260 45.687 132.512-112.214 92.407 44.047 123.911-100.680 91.707 40.687 142.087 83.603 94.312 41.777 115.190 -83.504 93.119 41.419 131.538-118.467 93.946 50.361 126.497-115.054 92.984 64.467 141.874 -74.194 94.684 81.330 122.405-127.224 118.027 0.000 131.978-156.054 # 38 total E -6.96717E+02 rmsd from N 0.000 %NC 0.00 1 91.612 113.184 133.256 -58.595 125.244-157.781 172.104-129.274 94.473 63.055 115.207-110.183 92.115 164.027 155.279-102.337 93.565 14.813 147.890 -81.248 97.443-167.030 114.433 -41.730 127.343-162.271 113.752-121.216 115.666 7.301 139.716-133.507 103.407-159.455 101.708 -53.239 125.636-159.591 141.188-152.074 124.337-170.531 148.955 -86.077 114.798 -62.466 164.165 144.390 92.610 -22.383 123.032-124.500 95.221 97.196 0.000 0.000 119.909-143.047 140.419 -67.429 125.360-164.085 167.376 -45.810 129.025-146.422 157.618 160.325 130.461 -8.236 119.684-124.481 96.843-176.164 0.000 0.000 125.375-153.576 130.324 45.790 95.598 24.921 102.839 -79.362 120.433 169.108 117.625 -96.643 136.891-120.033 133.342 110.965 113.087 -11.819 149.546 46.992 124.276-130.543 128.209-111.901 134.826-160.898 112.020 -54.574 93.859 14.829 139.924-167.814 124.810-153.476 134.273 -91.844 130.455-155.322 98.488 -82.744 99.965 -37.460 170.480 -92.740 92.122 -80.818 129.416 -76.157 91.444 71.794 115.827 -52.977 93.294 50.801 155.560-147.108 116.409-163.755 146.413-105.939 129.534-159.823 139.240 136.492 113.474 8.410 148.269-140.897 106.709-159.733 120.502-119.859 128.780-150.970 109.942 -29.658 129.706-164.322 130.811-110.184 94.692 92.712 132.242 -32.798 120.135-100.816 108.030 -80.616 93.341 119.295 141.947-108.259 94.430 135.483 0.000 0.000 92.936 61.738 138.537-120.024 93.293 42.103 93.298 -82.626 96.413 107.409 0.000 0.000 116.903-127.337 130.141 -77.070 93.201 42.782 159.014 122.915 93.845 46.182 156.493 63.403 93.483 39.607 113.295 142.236 94.243 34.873 141.022-110.129 93.724 43.487 151.673-104.518 91.283 46.655 132.798 -80.401 92.039 43.192 125.369-105.122 91.452 40.189 140.761 81.400 93.980 43.584 113.888 -88.527 92.907 40.479 133.050-109.996 93.987 51.012 124.634-117.110 93.001 64.448 141.724 -74.230 94.680 81.438 123.011-128.716 118.010 0.000 132.178-155.722 # 39 total E -6.75463E+02 rmsd from N 0.000 %NC 0.00 1 91.602 108.410 131.203 -79.081 124.656 -85.668 128.815 -91.653 116.183 -93.922 111.561 -82.798 91.406 55.664 153.951 -89.342 92.606 41.820 122.164 -74.694 93.294 45.281 170.457 -75.921 92.857 40.277 106.659 -61.370 93.246 42.237 133.703-119.632 92.224 40.429 113.632 33.892 92.466 43.486 149.225-105.464 91.952 48.255 119.019 -83.283 92.532 47.204 129.974-111.701 93.986 35.037 96.640 154.969 94.958 69.804 0.000 0.000 115.099 -75.404 161.691-111.337 94.844 93.442 130.104-104.778 92.317 60.556 159.768-122.061 93.320 48.607 138.435 -93.231 121.914 -1.996 167.044-117.212 123.879 -58.806 139.094 -15.483 124.077-142.476 165.943 -1.608 127.834 1.113 114.145-104.138 125.591-116.339 130.785 -92.200 130.403 30.556 147.493 -77.779 92.141 108.558 129.730 -76.782 93.559 -27.425 162.702 154.517 92.931 -59.662 147.294 -26.171 91.552 4.672 129.159 -76.049 122.470-118.581 138.412 29.447 124.614-165.798 153.234 -29.822 128.000 -95.959 145.621 -85.660 92.169 45.784 142.753-122.532 91.451 49.418 134.527-134.622 90.555 58.349 126.822 -74.619 91.994 46.981 110.943 -67.448 91.874 57.999 147.622-136.809 91.691 63.607 128.940-103.971 92.933 109.537 114.516 -79.432 91.356 49.540 128.483 -75.788 94.564 92.599 130.990-154.086 92.639 -64.721 151.594-147.670 93.873 -52.950 141.641-101.014 94.000 160.281 0.000 0.000 91.690 58.660 146.752-112.453 93.834 34.475 91.268 -79.255 98.352 30.284 0.000 0.000 97.738 31.887 109.721 -87.883 95.797 35.693 157.824-100.380 96.229 36.495 153.156 142.119 95.812 32.353 121.913 115.313 95.373 35.667 146.657-127.017 93.118 49.649 160.681 -5.627 90.572 47.471 130.024 -77.526 91.470 40.707 122.191-105.383 91.456 43.347 144.116 79.616 93.400 42.135 137.296 -74.683 92.879 42.929 134.147-110.398 93.559 45.151 123.777-116.103 93.327 60.566 142.032 -75.301 94.824 79.207 126.023-113.195 118.136 0.000 130.610-159.984 # 40 total E -6.56318E+02 rmsd from N 0.000 %NC 0.00 1 91.571 40.052 110.330 -69.878 128.124 -98.121 108.588 -91.069 116.457 -99.790 143.779-156.355 91.437 51.663 132.462 -77.559 92.761 53.841 142.954 -76.953 93.414 71.937 137.559 -67.484 92.641 108.296 81.438 -79.198 92.862 50.997 129.715-118.113 93.024 160.268 110.335 -74.905 93.464 44.583 135.997 -38.408 122.522-159.398 163.205 54.520 119.211-166.464 156.296-145.081 110.308 -69.304 165.772 -32.843 97.253 -13.421 160.903-134.825 93.606 87.077 139.368 -90.639 127.744-138.428 144.130 -83.242 126.939-154.530 160.271-169.011 129.604 -58.125 157.632-145.883 140.831 -45.351 148.792-124.477 139.799-160.115 144.502 28.901 94.030 57.514 144.633 -73.547 93.960 83.164 142.978 -75.119 117.193 -59.541 102.028 -92.134 91.830 74.739 150.758-124.879 91.153 44.008 129.313 -75.286 92.932 50.952 144.021 -77.851 92.996 52.279 139.720-150.120 92.341 -75.634 123.230 -76.140 117.683-167.112 134.696 40.725 131.072-165.034 169.055 -46.604 124.329-176.163 159.268 -85.487 118.467-175.580 170.082-177.241 109.774 -29.751 127.508 127.399 91.336 -82.823 128.111 -76.203 92.659 62.345 158.338-171.811 93.661 64.890 147.026-137.118 92.241 165.482 125.081-139.336 118.414-178.453 159.659-178.383 131.756-163.868 162.121 -85.910 119.111-152.259 157.060 169.647 92.642 56.364 152.879-174.743 92.752 36.291 176.423-143.353 94.225 51.263 0.000 0.000 92.672 41.839 133.202-101.570 93.469 36.612 113.963 -66.880 96.148 37.764 0.000 0.000 94.653 39.314 124.228 -83.711 94.093 36.571 144.312-115.962 95.238 37.112 142.414-121.728 94.550 39.019 126.709 110.885 93.466 39.731 144.519-125.481 92.825 42.979 148.695 -26.059 91.205 44.248 131.408 -78.554 92.629 43.625 126.878-100.824 91.552 41.478 141.425 82.573 93.793 42.758 141.580 -75.936 92.899 41.308 133.187-105.544 93.797 50.754 124.552-116.663 92.948 64.053 141.694 -74.988 94.687 81.194 125.227-127.158 118.007 0.000 132.225-156.003 # 41 total E -6.60336E+02 rmsd from N 0.000 %NC 0.00 1 91.568 56.402 128.373 -68.141 126.309 -72.378 134.740 -87.430 116.838-157.914 133.450-139.565 130.433-143.607 176.427 -87.614 121.873-179.124 150.943 -92.281 98.802 -10.851 161.302 0.958 96.418 -93.591 114.906-135.446 92.929 48.805 144.006-107.661 92.946 75.174 87.237 -87.132 92.882-172.854 157.066 -34.757 118.829-150.014 165.217 -73.878 125.824-162.936 163.118-119.389 103.547 -56.946 124.273-119.373 98.051 -22.947 151.724 49.023 93.816 86.371 125.904 94.023 127.234-114.091 147.144-106.392 130.412-169.085 170.348 -3.381 125.074 -6.491 157.312 -97.506 95.504-177.192 124.355 -63.640 109.181 167.107 135.181 -9.460 94.356 88.420 137.347-106.558 93.519 -2.929 139.985 -79.108 95.557 -81.987 112.725-118.991 112.869 165.589 169.324-139.616 126.939-175.554 165.847 -74.059 107.973 -17.387 167.915-114.650 93.430-158.688 135.078-142.583 90.932 71.970 168.987 -77.760 91.688 67.542 130.208 -24.755 94.448 74.097 144.711 -73.852 90.934 123.336 134.079 -77.483 91.740 76.646 145.618-137.349 92.638 77.493 133.937 -36.486 91.645 177.868 130.732 -78.650 127.236-154.410 97.298 -69.820 92.169 -12.590 136.758 115.184 115.590-176.301 155.830 -46.198 128.307-172.852 159.727 113.388 91.581 -55.077 126.483 -73.867 93.290 -66.251 117.131-125.693 91.426 82.900 152.364 -13.317 95.355 34.944 106.195 -93.079 95.410 169.671 157.364 -43.896 115.501-167.816 138.727 -80.344 93.736 -31.047 142.559 -20.948 129.243-140.439 0.000 0.000 120.054-117.660 150.951-109.654 92.713 38.587 155.385 128.441 92.860 47.718 115.155 -75.953 92.899 42.392 132.163-161.899 93.102 38.569 140.602-106.574 92.559 44.583 149.054 -23.190 91.169 44.731 123.979 -76.713 92.516 46.206 123.791-120.107 91.893 38.611 140.600 84.858 94.352 44.177 129.233 -45.509 92.893 40.324 127.369 -98.225 93.637 49.346 125.880-117.252 92.751 64.625 141.999 -75.726 94.658 82.154 135.840-113.884 117.962 0.000 132.509-154.557 # 42 total E -7.06003E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.616 134.225 -71.525 124.056 -84.298 124.830 -88.129 116.829 -98.586 142.986-155.581 91.343 55.031 131.688 -77.830 92.667 44.468 137.682 -74.100 93.316 41.210 136.472-101.797 92.814 44.516 102.627 -64.810 92.918 40.819 134.858-111.909 91.734 42.214 116.359 47.979 91.808 47.236 145.090 174.657 91.434 52.101 125.652 -87.818 92.563 85.904 128.685-126.334 88.683 -71.959 149.918 -51.137 108.539 -39.927 164.396-123.999 93.586 147.666 123.479 74.447 95.169 49.875 137.287 -69.053 93.536 112.958 147.046-166.529 92.287 -80.145 130.456 -64.528 93.061 15.465 151.550 -22.359 121.665 -79.226 137.077 -4.798 125.208-167.254 172.201-105.119 94.993 99.748 144.028 -73.289 126.485 -82.273 130.006 -98.572 124.312 -90.076 133.825 -60.406 91.385 47.824 130.483 -77.241 92.006 42.615 141.627 -78.021 91.268 49.013 137.948-164.378 90.996 45.148 126.953 -75.614 91.997 36.909 110.466 -49.954 93.377 44.260 164.134 -96.210 90.943 49.610 125.752 -77.683 91.017 41.303 157.138 168.078 91.398 42.526 141.850-135.238 90.966 47.949 127.369 -75.936 92.013 42.271 138.897 -86.976 91.737 44.142 140.912-144.449 91.542 43.084 122.239 -83.249 92.741 43.229 106.023 -53.933 91.001 46.848 128.183 -76.239 91.837 43.021 125.512-145.673 92.053 46.772 153.056-144.049 93.386 35.388 124.690 -83.239 94.664 44.689 0.000 0.000 92.747 41.949 136.016-108.483 93.606 35.513 138.722 -23.255 96.343 37.597 0.000 0.000 94.711 38.976 121.565 -79.672 94.059 36.584 145.764-114.330 95.324 37.062 165.393-112.733 94.567 38.939 126.816 111.183 93.485 39.626 144.571-125.764 92.839 43.035 148.670 -26.270 91.209 44.217 131.367 -78.558 92.634 43.582 127.157-100.955 91.548 41.478 141.357 82.600 93.786 42.799 141.567 -75.921 92.894 41.281 133.099-105.349 93.803 50.716 124.511-116.761 92.952 64.047 141.691 -74.988 94.690 81.207 125.311-127.114 118.007 0.000 132.220-155.995 # 43 total E -6.62389E+02 rmsd from N 0.000 %NC 0.00 1 91.566 62.812 135.424 -65.981 124.359 -78.300 134.116 -85.463 116.422 -97.507 133.359-140.158 91.506 49.721 131.822 -77.431 92.951 43.292 121.945 -76.285 94.410 40.156 153.636 58.109 94.435 36.694 100.266 -69.504 93.722 43.114 132.972-100.220 91.757 43.729 141.103 -88.080 92.235 40.110 144.325 -51.205 93.140 47.143 136.997 -71.820 92.638 53.126 134.071-117.334 93.506 141.566 119.600-113.574 94.357 108.578 171.212 -76.272 120.731-122.528 115.475 -78.614 127.186-150.217 176.406 -60.578 116.040 -57.016 153.090 177.793 93.051 -26.481 107.173 118.799 94.795 90.359 0.000 0.000 124.203-135.002 124.780 -44.526 116.647 -81.839 142.551-112.599 95.593 -15.813 77.895 -83.139 94.328 99.833 113.918 -89.150 92.839 117.358 135.513 95.813 91.310 111.557 129.502 -75.858 93.356 -28.169 102.459 -72.696 109.142-124.779 151.207-166.617 91.097 45.273 129.021 -75.911 91.516 51.239 111.023 -51.414 92.805 41.839 144.802 -73.938 91.241 45.938 127.806 -76.573 91.424 42.476 140.537 102.263 91.492 46.300 154.485-141.378 91.115 42.349 127.047 -75.761 92.722 42.617 145.233-126.154 91.424 45.483 125.068 133.760 91.117 45.729 118.143 -68.078 92.098 47.409 108.341 -53.594 91.489 45.356 129.621 -77.306 93.013 97.518 125.747-150.864 94.923 -10.297 163.439 -8.527 98.021 -59.716 135.606-104.003 146.954-106.018 164.220-142.818 127.543 110.034 170.831 -97.157 90.784 -23.200 139.387-134.016 92.363 -62.186 0.000 0.000 113.595-153.429 142.970-102.294 92.266 43.242 144.840-124.068 92.927 44.496 102.711 -56.257 93.717 40.451 134.786 110.087 93.483 37.153 134.153-137.692 93.288 43.509 153.189 -19.894 91.243 44.844 128.944 -76.160 93.099 42.022 140.241 -95.973 92.078 39.094 135.428 96.140 94.707 41.760 142.532 -75.385 93.455 39.410 127.494 -71.214 94.244 50.741 128.282-134.794 93.107 60.764 140.559 -75.093 94.759 83.454 129.875-129.872 117.999 0.000 132.338-153.671 # 44 total E -6.47531E+02 rmsd from N 0.000 %NC 0.00 1 91.595 105.481 126.521 -77.718 129.313 -96.774 151.431 -92.158 92.224 52.574 115.795-109.049 91.275 44.203 130.118 -76.682 93.212 43.985 166.329-147.283 93.945 36.461 128.781-110.550 94.263 40.796 132.626 -94.382 93.166 41.654 113.420 -47.510 92.042 42.392 130.789 60.394 91.956 43.531 139.412-110.214 92.205 43.392 137.913 -66.611 93.609 42.418 137.842-100.236 95.099 30.129 120.347 117.415 96.113 44.920 171.212 -76.272 93.208 43.455 118.436 -61.251 93.389 59.350 145.568 -71.719 91.943 64.520 150.897 173.840 93.094 20.269 140.192-109.812 123.730 -56.937 0.000 0.000 128.861-151.356 141.729 14.181 118.404 164.656 164.917-106.636 95.089 99.966 140.688 -74.469 126.767 -90.706 115.142-116.329 125.810 179.604 171.138 7.024 91.408 94.001 131.941 -78.580 93.897 6.803 142.474 -77.766 93.424 -90.831 107.598 -86.304 91.958 161.209 128.373 -74.563 90.672 61.484 116.776 -35.902 93.927 43.624 136.489 -71.388 92.416 40.274 128.755 -76.548 94.567 34.398 137.678 150.120 93.475 45.534 161.014-156.166 91.317 44.556 131.583 -81.220 92.771 41.453 117.144 -36.313 92.836 38.165 151.258-138.451 92.010 43.178 117.044 -89.740 92.851 48.921 135.726-118.549 91.045 49.964 129.250 -76.550 93.392 75.969 129.331-152.834 92.737 -71.678 149.390 172.738 94.985 -53.628 141.607-103.288 94.712 167.084 153.032-115.937 92.285 74.386 126.173 -93.927 92.666 47.283 87.019 -86.780 93.881 44.373 0.000 0.000 98.682 -95.705 126.634-107.310 123.050-154.012 165.932 1.372 121.803-165.264 163.792 -29.244 135.071-133.264 147.104 143.280 122.622-166.940 121.497 -89.695 116.116 -58.383 149.162 2.862 91.699 -24.970 129.680 -76.404 96.215 90.282 165.845 -64.601 126.898-125.736 163.815 -73.631 127.772-163.995 158.966 29.118 131.094-138.877 126.232 106.179 127.801-161.702 127.436 -66.928 122.068 176.558 168.432 -59.323 95.233 68.185 121.862-139.548 117.472 0.000 137.793-155.438 # 45 total E -7.10088E+02 rmsd from N 0.000 %NC 0.00 0 91.567 60.848 136.071 -75.850 123.934 -83.450 132.857 -91.196 116.907-128.568 102.106 -69.961 128.133-133.155 139.403 -92.866 127.835-158.674 144.777 -92.311 129.713-153.127 148.686 -22.525 112.579-176.276 110.263-102.832 147.978-159.282 171.040 24.167 109.625-155.149 144.732-100.790 93.430 -2.510 149.309 124.981 128.410-143.723 175.819 -37.800 120.783-162.254 142.304-105.644 110.096 -65.292 131.097-132.017 97.766 -15.786 0.000 0.000 93.538 85.692 139.745 -90.847 128.353-133.981 147.518 -98.880 127.332-151.866 146.350 -92.723 109.650 -2.479 160.541-117.260 113.497-146.473 0.000 0.000 121.050-163.818 129.722 33.150 135.140-170.395 162.171 -91.111 97.639-176.906 160.146 -79.775 137.316-137.432 154.339-108.237 118.885 -92.262 161.025 111.603 91.233 50.630 130.541 -78.068 91.790 40.559 144.214 -78.274 90.848 56.387 137.233-144.166 90.432 50.291 126.685 -75.970 91.056 39.556 108.398 -53.665 93.129 42.362 143.504 -74.606 90.877 50.670 130.644 -77.336 90.731 46.239 160.616 106.787 91.067 42.008 141.777 -57.115 90.877 45.622 127.247 -75.526 91.703 48.804 141.878 -50.173 90.731 45.333 153.894-143.250 91.259 41.660 120.043 -84.361 92.767 44.189 105.401 -50.806 91.197 59.432 129.558 -75.669 91.771 53.041 128.218-152.357 92.328 70.891 152.704-123.498 113.239 -99.599 135.786-118.026 137.062 -69.554 0.000 0.000 92.551 53.007 136.799-108.040 92.511 36.055 89.794 -84.087 95.142 43.718 0.000 0.000 92.819 43.878 126.731-106.208 91.912 40.941 142.587-119.282 92.115 44.085 145.068 -80.846 91.722 48.266 151.687 95.057 90.699 45.477 138.839-118.936 90.572 46.647 148.658 -24.015 90.459 51.900 126.442 -72.132 91.935 41.624 120.951-117.806 92.053 41.017 140.099 87.199 94.636 42.331 143.102 -76.296 93.047 40.513 120.470 -80.525 93.961 51.468 127.782-130.534 93.026 70.661 140.564 -74.825 94.829 100.650 133.647-145.241 117.414 0.000 132.478-116.124 # 46 total E -6.59371E+02 rmsd from N 0.000 %NC 0.00 1 91.570 57.831 131.436 -75.393 127.425 -90.967 131.474 -89.528 91.558 63.300 107.166 -90.674 90.814 47.246 130.309 -78.192 91.986 49.274 142.374 76.188 92.611 37.137 174.062 -50.796 93.263 40.679 103.658 -65.425 92.420 45.323 129.439-111.452 91.334 41.598 135.975 54.300 92.195 41.857 147.980-136.098 92.100 46.186 122.839 -82.292 92.137 43.586 125.091-104.434 93.309 38.564 146.344 113.106 94.857 46.807 166.936 174.261 92.696 41.227 135.582 -90.031 93.485 81.446 119.677 -52.151 92.039 87.590 145.787 -44.110 92.171 3.103 113.694 111.437 101.518-126.533 149.111 95.275 128.343-179.727 125.512 50.932 94.944 32.763 112.200 -98.586 135.020-129.836 124.421-112.562 131.543 136.006 141.381 -62.393 92.828 -2.088 151.629 142.129 115.383-154.875 152.490-108.575 130.636-166.385 127.671 -58.446 93.068 -10.523 135.980-178.189 114.975-164.769 154.609 -74.057 130.834-147.953 155.037 -14.458 109.367 -38.224 166.602 -76.924 91.746 -80.604 129.215 -75.969 91.568 75.077 106.257 -12.234 93.392 45.012 141.134-118.478 129.603-167.886 150.995-101.240 141.274-159.308 61.702-103.843 93.350 -3.147 89.422 -49.765 114.863-170.800 133.544 -11.213 126.997-145.097 163.380 118.952 109.853 151.840 164.781 -87.917 92.355 75.826 133.270-160.703 91.750 57.725 147.220-141.233 92.325 37.406 123.997-106.933 94.920 46.723 0.000 0.000 93.302 39.752 129.871 -91.151 94.473 33.312 111.950 -65.249 98.046 31.564 0.000 0.000 97.330 33.649 129.417 -80.971 96.429 30.834 151.300 -88.844 97.573 34.343 123.771-140.723 95.747 36.437 125.266 106.304 94.400 36.697 150.005-139.153 93.718 41.117 147.865 -28.184 91.436 44.000 129.764 -77.587 92.628 44.584 141.500 -76.956 91.221 41.879 138.232 84.333 93.543 43.515 114.053 -81.276 92.983 40.525 132.766-107.220 94.017 50.754 128.709-116.774 93.038 64.081 141.745 -74.518 94.685 81.732 123.657-127.947 118.019 0.000 131.952-155.668 # 47 total E -6.81959E+02 rmsd from N 0.000 %NC 0.00 1 126.112-135.170 142.962 -77.917 125.624-153.826 128.337 -80.158 91.949 102.267 141.352-168.712 91.442 53.864 129.829 -76.919 92.764 49.464 151.840 84.058 94.569 29.870 137.276 -66.400 95.006 46.872 170.939 -93.157 91.716 44.311 111.381 139.299 91.613 40.805 166.170 -46.621 92.388 40.175 126.609-102.877 93.148 75.124 147.871 68.969 91.113 74.278 137.208-110.955 91.479 12.669 114.714-123.139 101.785 -96.303 136.447 -98.093 112.987 155.915 139.275 95.441 94.425 72.759 159.798 8.801 92.269 68.777 121.297 -99.252 93.234 24.589 132.133-101.119 121.662 -6.892 0.000 0.000 127.862-111.903 97.270 -68.514 112.474 173.554 115.257 -61.396 94.075 91.365 129.184-104.159 137.580-111.320 134.756 -99.049 128.022 176.951 168.013-125.331 91.044 -10.362 131.808 -78.010 111.705-114.815 123.421 -67.441 92.280 46.281 94.987 -79.216 91.430 53.426 128.274 -75.834 92.704 35.983 145.558 -43.488 94.936 42.285 153.615 -0.913 92.284 39.188 127.084 -75.729 94.127 37.318 132.055 -59.844 93.844 41.272 146.149 -63.572 92.258 40.252 130.206 -79.111 93.888 39.615 128.295-157.429 92.957 41.928 141.105-145.251 91.667 44.494 115.929 -67.312 92.305 50.175 126.551-103.390 90.982 46.885 129.017 -76.134 93.560 80.350 127.643-148.457 92.786 -68.750 152.427-168.533 95.104 -54.558 143.680-104.561 95.026 166.506 0.000 0.000 92.197 89.847 128.588 -90.117 93.224 53.042 89.340 -88.620 94.809 102.515 0.000 0.000 117.861-109.123 105.719 -87.987 92.580 51.710 149.358-111.903 93.102 42.052 144.456 36.049 92.863 44.581 117.929 127.488 91.718 40.234 142.070-121.116 91.638 48.038 149.398 -24.395 90.788 46.151 149.103-111.502 91.380 42.505 125.226-130.834 91.087 43.765 142.186 88.669 93.470 45.073 109.958 -66.493 93.149 36.522 125.195 -99.158 95.034 46.869 118.200-123.949 93.871 64.109 141.892 -73.804 94.844 75.853 130.245-111.779 118.268 0.000 128.675-164.081 # 48 total E -6.57232E+02 rmsd from N 0.000 %NC 0.00 1 124.743-108.106 157.120 99.096 126.973 -96.607 121.758 -91.800 120.945 -47.533 110.674-105.766 91.454 90.203 156.111 -80.998 116.156-129.249 121.079 -88.986 126.726-164.869 160.460 -61.173 124.894-167.967 163.813 -51.255 131.263 172.463 146.426 171.943 95.979 -71.247 124.278 -61.392 91.591 57.002 89.587 92.104 112.494 -94.201 119.599 -96.976 130.966-150.119 99.500 -66.432 93.911 11.371 151.942 -51.312 134.164 -92.316 0.000 0.000 92.901 89.604 111.851 72.336 93.656 88.845 128.538-101.546 92.122 69.176 147.474 -37.092 92.949 43.239 116.737 113.599 95.665 91.025 0.000 0.000 120.370-169.812 138.511 -48.041 93.755 68.141 142.073 -77.150 93.145 99.380 113.845 -49.491 94.180 42.884 95.419 -90.587 92.415 83.144 119.592 90.144 91.226 61.749 129.463 -77.099 126.969 170.926 121.590 -54.095 93.012 48.123 149.126-139.344 108.931 -44.249 166.969 -87.342 128.886-145.874 147.107 22.871 128.127-160.780 153.945 -35.701 125.453-168.654 153.108 -79.293 128.188-163.424 144.124 156.374 94.490 -36.525 144.960 137.781 91.694 -79.591 128.062 -76.021 92.226 69.314 141.279-117.121 93.253 56.132 130.490-139.980 92.002 175.864 114.270-135.330 127.234-176.201 163.013-174.394 130.008-163.544 162.216 -87.054 116.437-154.361 148.439 178.099 94.332 7.176 154.422-125.313 124.403-134.359 176.441 -6.086 131.444-106.316 0.000 0.000 92.871 49.072 139.197-127.935 93.728 34.629 133.286-115.842 97.556 33.744 145.729 -29.470 95.878 36.752 115.952 -89.812 94.075 38.886 121.124 78.208 93.799 42.587 145.722 -75.104 92.628 42.776 128.558 87.596 92.443 40.384 139.009-145.846 92.760 42.503 139.179 -21.009 91.150 45.364 131.858 -78.689 92.545 46.008 143.978 -72.516 91.062 43.959 137.573 -60.342 93.161 42.343 112.870 -81.624 93.203 39.565 130.625-113.233 94.262 50.229 129.083-112.032 93.068 63.984 143.032 -77.634 94.691 81.013 123.447-124.900 118.035 0.000 131.886-156.604 # 49 total E -6.46385E+02 rmsd from N 0.000 %NC 0.00 1 91.568 57.743 134.636 -79.761 125.140-164.212 139.413 -83.246 94.428 50.469 139.238-161.907 92.467 161.487 164.056 -74.719 93.515 36.758 140.987 -76.954 97.254 173.228 126.682-102.913 133.045 -63.898 131.715 -80.491 132.656-164.100 146.116 44.410 119.674-165.531 150.642 -40.016 92.561 66.819 134.726 160.353 119.377 133.310 169.000 -70.586 92.667 -39.646 110.045 -69.711 93.069 -46.462 138.542-107.752 94.884 91.916 139.049-111.457 127.166 -87.216 167.503 -95.794 131.720-161.924 126.238 -82.670 128.451-169.905 176.490 144.161 93.692 76.177 105.425-126.670 96.983 117.806 118.346 62.818 128.747 -68.727 124.205 -40.940 135.255 -23.955 148.571 -81.808 136.825-169.219 113.975 -90.970 130.964-143.547 151.807 34.375 102.352 -29.360 92.745 25.854 91.730 -82.270 131.193 -78.146 92.389 62.752 146.635 -76.251 94.328 65.184 144.891-120.682 92.322 163.083 128.274 -76.545 124.389-101.172 136.550 -18.355 94.011 66.786 113.679 -95.675 91.283 137.930 124.829 -70.226 92.130 79.483 134.658-102.763 92.523 59.222 152.289-134.367 91.776 176.636 130.963 -79.432 129.130-158.130 101.744 -71.641 92.230 -19.953 133.550 109.715 124.218-170.663 129.089 -15.947 121.774-140.243 146.117 145.277 113.656 -67.966 138.457 -99.188 93.161 -50.441 115.327-131.165 91.891 89.440 149.881-115.049 115.672 -0.553 108.281 -96.532 131.662-135.220 0.000 0.000 125.608-155.776 129.237 -76.297 93.595 -32.922 141.109 -34.719 130.909-138.893 0.000 0.000 120.067-114.388 136.397 -98.496 93.391 33.798 152.795 124.728 92.669 54.127 149.019 -72.867 92.650 42.208 132.553 119.395 92.619 38.730 144.138-110.982 92.630 44.601 164.859 -12.963 91.103 46.164 130.527 -77.080 92.390 41.236 140.797 -78.638 91.553 41.315 138.969 83.123 93.621 45.088 141.089 -74.377 92.508 40.307 135.580 -96.851 93.689 45.481 125.319-117.456 93.233 63.502 141.548 -75.158 94.644 81.398 131.696-117.048 118.067 0.000 131.484-156.637 # 50 total E -6.94208E+02 rmsd from N 0.000 %NC 0.00 1 126.078-128.404 151.164 -81.557 126.437 -82.490 130.806 -82.113 116.778-102.389 139.964-150.949 91.434 50.722 131.672 -80.790 91.354 52.139 112.700 -89.136 91.131 50.948 163.991 -84.813 91.787 42.319 100.014 -46.058 93.273 41.047 156.982-108.155 92.449 39.707 131.040-110.638 92.207 46.926 145.240-111.025 92.229 49.283 121.229 -83.139 91.952 69.245 134.303-120.662 92.459 13.735 133.242-109.185 105.905 -91.752 0.000 0.000 109.301 145.008 128.497 88.251 93.885 89.600 144.689 -74.706 92.158 123.194 162.036-155.093 93.947 4.107 109.256-105.630 96.451-179.223 0.000 0.000 127.297-173.453 118.841 71.485 94.793 101.140 115.033 -31.441 93.138 -13.993 121.068-111.266 94.054 -72.817 121.426 -76.634 104.062-175.563 148.151 -85.345 122.499 171.770 151.315 -83.922 93.476 1.778 131.264 -95.334 120.883-115.135 115.328 -95.448 90.763 70.793 127.576 -76.549 90.459 44.934 120.324 -34.710 92.060 45.395 142.932 -73.428 91.032 45.389 126.372 -75.919 91.417 43.201 158.577 141.045 91.218 45.102 156.608-145.607 90.861 46.541 126.872 -74.917 92.497 41.038 132.196-112.925 92.273 46.371 140.535-141.936 91.345 53.011 123.287 -84.336 91.707 79.751 126.763 -87.542 90.995 41.395 128.932 -75.847 94.122 88.131 131.087-154.606 92.948 -60.746 152.590-163.124 94.860 -57.262 144.000-103.971 94.833 166.755 0.000 0.000 91.719 62.912 138.371-114.574 92.007 44.024 90.696 -82.684 113.363 7.166 0.000 0.000 95.133 44.067 116.712 -81.474 95.260 29.293 158.046 -99.638 95.947 43.025 165.790 -37.835 93.730 36.342 119.386 119.817 93.613 39.294 145.479-121.911 92.522 44.881 149.149 -22.858 90.785 47.028 146.047-102.251 91.402 44.650 122.527-106.474 91.456 42.146 143.140 86.062 94.105 38.965 114.086 -66.343 93.472 42.943 131.348-113.991 94.043 53.518 129.386-115.079 92.907 63.044 141.752 -74.321 94.772 81.500 119.458-131.069 118.048 0.000 131.726-156.301 # 51 total E -6.99400E+02 rmsd from N 0.000 %NC 0.00 1 91.568 61.586 135.902 -73.325 126.040 -85.229 135.310 -82.517 116.981-135.058 138.954-149.908 131.432-164.786 156.530 -82.534 122.474-161.917 157.640 137.007 95.273 42.969 121.185 -84.469 124.116-170.198 142.877 -97.091 128.781-172.950 151.012 19.913 92.871 33.334 117.848 -54.004 122.585-159.339 176.426 172.830 123.620-153.051 168.324 -62.427 119.396 146.652 157.780-129.868 102.574 -60.913 146.441-118.746 93.039 35.794 0.000 0.000 115.783 -86.258 105.963 -82.515 123.792-158.027 145.817 -69.728 128.971-133.008 153.781 162.726 122.050 18.927 147.517 121.379 117.122-169.061 167.044-117.212 127.427-166.171 143.543 -14.279 95.003 32.667 125.692 -89.984 125.626-179.644 133.620 -75.172 111.575 156.447 118.902-126.290 94.404 44.284 129.139 -69.440 92.673 100.889 131.727 -77.762 94.309 41.368 151.042 -77.066 94.148 112.737 134.794-166.994 112.446-120.443 132.797-101.513 91.982 44.614 110.259 -51.468 93.048 48.486 143.061 -74.328 91.241 43.962 129.013 -76.339 91.976 41.053 144.752 126.424 92.234 41.685 154.884-143.447 91.277 44.751 132.291 -79.085 92.266 42.874 145.207 -34.348 91.381 43.253 125.668 131.191 91.302 43.864 115.694 -66.120 92.385 42.969 111.415 -54.950 90.995 47.128 127.437 -75.960 91.658 43.990 127.699-149.253 91.812 48.103 151.999-146.435 93.076 35.386 122.055 -83.530 94.438 47.654 0.000 0.000 92.771 41.726 134.949-107.614 93.513 36.119 113.497 -63.002 96.301 37.120 0.000 0.000 94.776 39.090 121.871 -80.769 94.182 36.371 145.492-113.393 95.093 37.460 144.574 -75.003 94.548 38.867 126.461 112.505 93.500 39.609 144.525-125.732 92.878 42.913 148.927 -25.540 91.228 44.175 131.426 -78.602 92.644 43.604 127.219-101.449 91.547 41.454 141.305 82.602 93.783 42.824 141.606 -75.920 92.892 41.265 133.020-105.281 93.804 50.740 124.504-116.829 92.951 64.031 141.685 -74.987 94.691 81.216 125.312-127.139 118.007 0.000 132.219-155.987 # 52 total E -7.16881E+02 rmsd from N 0.000 %NC 0.00 1 126.122-129.338 149.080 -80.352 125.803 -84.551 128.112 -88.813 111.184 -53.501 131.338-139.819 91.359 93.190 131.517 -76.378 118.491-148.642 128.501 -89.375 129.275-137.291 150.601 -6.272 121.873-158.203 141.626-122.314 123.027-165.015 157.053 -0.908 92.986 38.690 138.983 -77.036 114.997-164.219 160.092-119.390 123.201-127.015 145.356 -87.180 126.001-168.827 168.287-173.979 102.810 -62.177 157.378 -50.704 97.848 -19.885 151.724 49.023 93.600 87.652 119.516 79.032 125.683-123.699 141.764 -89.173 124.118-174.411 160.848-133.917 130.864 -86.273 148.375-102.249 128.239 -12.148 0.000 0.000 119.763-165.549 128.875 29.081 134.433-146.578 136.824 -46.379 113.224-165.686 128.595 -81.960 137.200-130.084 141.217-129.171 121.129 -91.160 147.383 67.285 92.217 42.282 131.508 -78.359 93.074 45.014 143.695 -77.977 90.934 66.644 138.174-145.696 90.954 47.027 122.944 -75.449 92.304 35.807 109.460 -52.560 95.167 41.678 143.613 -74.638 91.847 44.476 129.620 -76.495 91.955 41.720 138.750 157.166 91.360 44.551 141.021 -48.477 90.749 47.210 127.865 -78.084 92.016 44.305 125.170 -34.893 91.835 42.896 145.741-144.198 91.982 40.502 115.070 -69.101 93.466 42.639 110.398 -60.050 91.061 47.076 129.833 -78.141 91.716 43.129 125.199-148.229 92.045 46.880 153.576-146.008 93.372 35.324 120.824 -83.844 94.634 44.917 0.000 0.000 92.723 41.999 135.661-108.238 93.580 35.564 139.086 -22.662 96.273 37.863 0.000 0.000 94.651 39.043 122.047 -80.236 94.046 36.610 145.391-114.520 95.327 37.022 165.424-112.719 94.564 38.990 126.773 111.241 93.482 39.607 144.612-125.744 92.849 43.011 148.670 -26.254 91.211 44.204 131.399 -78.578 92.633 43.601 127.153-100.902 91.548 41.470 141.358 82.620 93.789 42.785 141.565 -75.920 92.897 41.284 133.116-105.402 93.802 50.726 124.539-116.736 92.950 64.043 141.690 -74.986 94.691 81.204 125.287-127.119 118.007 0.000 132.219-155.998 # 53 total E -6.58567E+02 rmsd from N 0.000 %NC 0.00 1 91.570 60.267 135.103 -76.830 123.670 -96.198 105.625 -81.257 115.045 -94.090 139.586-151.431 91.597 52.217 131.737 -77.522 93.796 69.484 143.032 -76.068 95.591 121.272 159.532 -71.714 123.770 -61.517 134.789 -45.263 134.285-164.380 159.515 20.811 95.584 177.779 116.710 45.831 92.361 45.799 123.762 -97.900 108.912 146.855 161.526 45.865 96.930 -37.860 150.922 143.021 92.677 -48.835 134.569-109.541 94.102 90.895 0.000 0.000 127.750 -98.609 111.342 -87.973 122.724-160.858 172.060-100.921 131.015-147.647 141.706 108.166 93.359 92.044 108.233-125.894 127.677 -37.535 118.346 62.818 123.620 142.409 113.700 65.430 95.553 72.495 113.845 -83.695 93.641 96.416 144.930 -74.053 94.300 71.250 114.660-120.419 92.289 135.625 120.726 88.261 90.954 94.758 131.479 -78.443 93.380 3.356 142.502 -77.876 94.241 -90.402 138.488-141.051 92.417 170.117 128.606 -75.388 91.157 55.470 126.660 -44.497 93.699 45.619 145.441 -24.693 92.105 40.064 127.759 -75.984 94.110 36.277 133.877 -80.241 93.602 45.465 158.761-149.367 92.077 39.189 127.479 -77.953 93.814 41.372 134.327-139.833 92.496 42.804 135.306-144.124 91.563 46.362 119.835 -87.731 92.721 43.345 125.114-105.948 91.356 51.670 129.139 -76.176 93.961 80.081 126.743-146.605 92.393 -73.421 158.317 -3.340 94.344 -50.815 159.844 -42.294 94.697 168.590 164.220-142.818 92.339 88.138 123.139 -79.746 93.508 51.556 87.949 -89.486 96.123 102.715 0.000 0.000 118.750-115.806 126.351 -84.450 92.861 43.395 168.382-172.946 92.154 48.303 121.253 -43.432 91.848 49.637 139.917 149.400 91.235 39.920 148.638-128.240 91.624 44.540 147.344 -23.011 90.623 50.962 126.896-104.003 91.297 47.715 126.668-127.281 91.325 40.252 138.745 92.117 94.517 42.970 120.891 -41.151 93.322 38.900 120.360-101.065 94.129 49.917 124.126-132.224 92.776 59.241 141.555 -75.475 94.639 82.497 135.734-115.045 118.209 0.000 129.758-157.578 # 54 total E -6.59006E+02 rmsd from N 0.000 %NC 0.00 1 91.564 60.744 136.111 -75.339 124.588 -78.698 135.129 -93.022 116.948-137.404 98.820 -78.278 127.457-160.054 151.713 -88.939 134.197 -86.598 174.040 -72.281 130.685 -9.317 136.768 -76.419 120.715-164.897 129.954 -89.433 138.168-172.525 149.890 25.249 92.432 30.471 119.485 -56.572 123.258-157.895 162.665-109.616 117.153-161.213 165.817 -47.171 124.624 151.006 165.333-159.592 98.711 -61.335 133.099-109.075 92.826 44.011 171.212 -76.272 115.700 -93.374 106.598 -85.872 127.062-161.748 162.243 -35.276 125.111-133.782 152.113 169.624 127.433 14.469 140.082 120.461 115.471-167.415 0.000 0.000 134.322-174.696 145.613 16.628 94.016 32.204 126.212 -88.148 109.630-144.513 133.690 -91.756 126.506 152.207 143.357-117.146 130.625-157.192 163.572-131.073 113.346-176.968 157.244 -77.846 95.473 98.257 122.726-127.936 93.289 -13.229 99.645 -73.187 92.482 -76.826 131.257 -79.794 103.802-178.798 151.166 -12.095 127.204-167.691 155.836 4.235 130.387-143.536 137.510-129.693 131.763-167.851 147.310 158.266 94.781 -22.956 127.933-140.399 91.255 -87.707 129.506 -77.222 91.512 58.136 124.774 -34.411 93.877 65.113 147.029-145.180 92.446-174.359 130.185-138.910 132.503-159.375 157.097-172.125 122.916-159.657 154.825 -98.786 133.695-167.755 145.504-173.357 93.591 131.511 153.999 5.262 122.547 -77.856 128.815-122.126 123.844 -5.962 164.220-142.818 124.390-110.494 107.113 -76.963 94.242 57.294 97.365 -79.978 123.368 -9.759 0.000 0.000 93.476 49.418 118.506 -84.774 94.806 29.847 153.187-104.388 96.234 40.971 158.254 49.324 94.866 33.433 120.958 117.031 94.833 38.058 144.800-132.085 93.028 45.339 152.003-153.617 90.904 46.223 129.616 -76.680 91.652 42.799 125.825-103.751 91.206 42.946 135.844 72.065 93.442 42.881 118.990 -80.388 92.863 41.434 133.557-112.861 93.835 47.421 123.379-119.819 93.005 67.733 113.047 -58.157 94.747 83.628 128.776-124.528 117.868 0.000 133.759-150.555 # 55 total E -6.59375E+02 rmsd from N 0.000 %NC 0.00 1 91.604 109.138 132.404 -79.446 125.961 -82.944 135.780 -83.100 116.855 -99.846 137.821-147.208 91.524 48.636 131.370 -77.622 92.310 48.452 151.064 87.005 92.280 41.340 169.246 -52.368 92.052 41.549 98.579 -58.040 92.249 47.724 139.935 -94.019 91.749 39.874 113.174 31.469 92.931 41.246 140.850-110.735 93.346 47.614 120.837 -78.935 93.385 45.758 120.799 -94.575 94.548 35.165 143.728 126.666 96.936 45.107 0.000 0.000 94.817 94.054 141.304-101.630 96.849 -9.617 140.430 -71.308 93.503 -79.228 153.550 168.273 93.531 -3.277 151.518 96.250 97.206 112.293 0.000 0.000 129.243-144.311 139.881 -19.324 121.090 159.969 124.243 -50.609 96.199 73.518 121.414-118.560 128.483 170.115 131.459-126.420 95.406 52.218 125.414 -59.450 92.521 120.335 173.775 -88.726 93.824 40.908 146.520 -78.322 94.190 126.321 155.183 -5.685 124.375-103.726 126.033 -92.732 91.336 49.688 116.527 -54.203 92.448 47.737 108.532 -47.662 91.453 43.183 126.659 -74.935 92.377 40.494 125.663 77.125 92.367 43.595 149.977 -71.643 90.989 47.141 127.863 -75.741 92.162 48.656 141.173-132.595 91.022 42.618 117.375 108.148 91.346 59.371 118.831 -89.651 93.047 123.838 144.124-108.652 91.243 37.824 128.405 -75.697 103.617-166.905 133.831-148.486 121.298 -57.898 168.582 15.088 92.943 -26.335 133.577 -96.521 94.815 97.830 0.000 0.000 125.688-146.203 129.966 -64.053 93.437 57.330 96.317 -80.986 126.343-175.949 0.000 0.000 128.808-169.374 83.385 -95.451 126.179-179.692 160.957-176.638 119.378-175.273 132.511 -47.775 138.024-134.633 139.412-168.491 122.615-162.813 155.867 -11.728 113.531 -60.683 149.151 -6.211 91.565 -22.631 129.637 -76.429 96.436 88.730 162.816 -58.831 126.611-127.488 166.734-112.222 129.173-163.014 150.594 50.310 121.962-161.557 146.707 -47.174 127.388-167.779 176.470 -98.180 122.197-177.514 170.853 -71.339 95.383 59.396 160.827 -89.670 117.512 0.000 137.209 178.859 # 56 total E -7.01078E+02 rmsd from N 0.000 %NC 0.00 1 91.603 109.252 132.434 -78.630 124.618 -85.904 135.916 -93.970 127.135 162.930 99.567 -89.281 131.870-166.016 156.280 -92.317 128.016-145.557 159.912 69.353 95.045 44.438 140.120 -76.464 125.573-168.577 144.262 -95.233 124.971-169.873 158.005 8.962 93.202 40.890 145.238 -80.463 113.270-162.477 127.810 -77.896 123.005-120.453 143.156 -93.425 128.516-171.559 138.395-107.994 103.431 -62.516 158.002 -47.861 97.871 -20.494 0.000 0.000 93.554 86.965 143.682 -90.142 126.747-119.626 139.979 -87.852 125.417-176.810 166.870-157.719 130.413 -81.060 139.937-103.560 127.441 -10.181 118.346 62.818 122.221-157.014 129.932 35.557 130.780-154.408 150.831 -26.166 94.322 40.946 116.053 -82.505 119.940-177.679 131.923-100.740 134.832-148.761 139.077 -47.675 114.854-130.963 146.238 -81.916 92.395 42.577 135.217-147.409 91.325 52.630 105.381 -71.443 91.221 46.416 127.052 -74.751 91.668 41.552 157.118 -26.540 92.527 47.432 142.837 -73.586 90.749 49.156 128.767 -76.629 91.425 41.961 130.304-146.046 91.461 44.520 136.017 117.239 91.221 43.576 127.929 -76.082 92.514 42.874 111.708 -60.773 91.726 43.375 140.581 125.824 91.313 43.870 112.631 -59.432 92.623 42.376 134.276-132.614 91.099 46.576 127.475 -75.510 91.924 43.871 132.252-152.964 92.163 45.864 149.429-128.498 93.648 35.236 120.562 -86.414 94.787 44.346 0.000 0.000 92.820 41.911 136.530-110.125 93.603 35.506 139.216 -22.569 96.255 37.994 0.000 0.000 94.628 39.020 121.383 -79.400 94.036 36.754 145.437-115.482 95.308 37.042 165.571-113.549 94.552 39.003 126.467 110.450 93.508 39.403 144.389-126.165 92.882 42.964 151.036 -28.889 91.177 44.574 131.690 -78.789 92.411 44.647 128.336-100.281 91.333 41.846 140.905 81.983 93.652 43.054 115.817 -83.083 92.959 40.994 132.931-108.721 93.954 50.421 124.157-118.063 93.047 64.087 141.775 -74.498 94.688 81.512 123.553-128.040 118.017 0.000 132.086-155.784 # 57 total E -6.75365E+02 rmsd from N 0.000 %NC 0.00 1 91.567 58.484 131.098 -69.913 127.812 -81.555 132.123 -92.290 119.620-166.896 110.958-106.141 124.389-170.080 176.439 -86.645 93.865 55.289 141.776 -77.017 114.785 161.465 161.712 -97.103 134.507 -72.927 131.229 -81.438 118.981-171.769 108.096-129.895 108.946 -58.557 123.682 -46.407 91.947 -23.768 142.823 -54.976 94.885 95.581 130.556 -82.956 129.724-120.714 152.494 117.518 94.774 132.051 158.437 30.080 133.656 24.615 0.000 0.000 137.774 -56.666 116.059 68.620 129.062-153.107 133.883 -87.851 121.174 166.968 163.404 7.686 99.633 -54.128 149.892 102.625 92.845 25.209 0.000 0.000 117.761 -76.042 126.063 55.715 128.484-150.717 141.261 -95.759 92.883 63.195 176.432 -24.163 92.652 42.091 97.880 -79.769 92.078 46.185 92.868 -31.780 91.268 42.940 129.575 -76.904 92.394 43.085 144.153 -78.577 91.702 43.722 141.257-149.573 91.329 43.539 127.081 -75.375 91.943 41.185 111.717 -48.706 93.114 43.454 143.697 -74.611 91.232 44.049 127.965 -76.429 91.804 42.740 146.515 145.194 91.559 45.027 144.072 -57.099 91.017 44.580 127.710 -75.759 92.563 41.048 135.689-119.705 92.227 44.296 140.061-142.619 91.652 42.297 119.121 -71.931 92.913 42.273 118.549 -75.677 91.124 46.736 128.431 -76.205 92.003 43.800 125.692-145.339 92.093 46.337 153.653-143.374 93.463 35.500 120.142 -86.424 94.643 44.693 0.000 0.000 92.748 41.991 135.673-108.320 93.581 35.542 139.114 -22.634 96.280 37.866 0.000 0.000 94.648 39.043 121.995 -80.103 94.049 36.603 145.415-114.544 95.329 37.011 165.423-112.747 94.566 38.993 126.781 111.231 93.479 39.613 144.624-125.759 92.847 43.011 148.669 -26.255 91.212 44.200 131.398 -78.576 92.629 43.607 127.161-100.902 91.541 41.474 141.354 82.624 93.790 42.776 141.565 -75.921 92.898 41.280 133.113-105.394 93.803 50.730 124.540-116.736 92.950 64.042 141.689 -74.985 94.696 81.206 125.286-127.123 118.007 0.000 132.218-155.997 # 58 total E -6.48998E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.836 136.080 -75.825 124.008 -82.980 132.953 -91.276 116.950-129.673 101.797 -70.171 127.792-137.699 136.799 -94.402 126.856-167.707 140.053 -89.409 134.044-116.955 157.647 25.552 122.610-142.449 132.749-111.494 95.402 92.385 131.251-139.639 127.586 -18.629 93.507 73.201 119.706-122.640 160.794-104.473 127.309-160.263 169.768 -53.625 111.324 -52.948 161.445 140.136 92.544 -28.598 138.417-108.126 94.735 96.593 0.000 0.000 120.775-129.567 134.507 -85.122 127.142-131.918 160.455 -40.857 130.440-106.755 170.898 -0.986 136.708 63.382 115.603-105.847 95.919 78.507 134.259 -73.660 120.934 -66.398 130.377 -26.004 129.698 -87.062 174.194 -90.267 134.100-163.778 124.843 -65.836 121.462-151.366 137.254-106.152 114.541 -84.544 165.954 101.942 91.885 0.980 131.363 -78.555 96.120 77.394 142.509 -76.546 131.762-154.328 160.313 -5.196 126.760-159.895 149.747 -88.906 92.180 50.739 125.257 -31.500 93.053 45.646 145.156 -73.947 91.087 46.598 128.968 -75.844 91.900 40.959 99.339 -95.966 91.974 45.166 161.487-143.615 91.223 42.573 127.642 -75.844 92.776 43.073 145.236 127.554 91.810 43.150 138.651-146.464 91.248 45.424 119.591 -77.544 91.860 49.983 137.238 -25.424 91.123 47.301 128.846 -76.185 93.909 88.821 128.091-148.625 92.565 -62.069 150.720-156.765 94.408 -57.183 141.073 -99.479 94.149 165.932 164.220-142.818 91.648 57.133 140.590-116.773 93.042 34.955 88.033 -80.321 96.348 38.867 0.000 0.000 95.096 36.534 118.501 -94.010 94.629 37.625 147.040-113.363 95.352 35.970 130.903-128.574 94.776 39.022 126.529 108.697 93.571 39.233 145.763-127.735 92.858 43.136 151.149 -28.681 91.153 44.564 131.543 -78.699 92.413 44.655 128.552 -99.180 91.338 41.844 140.898 82.055 93.665 43.017 115.888 -83.193 92.961 41.015 133.090-108.986 93.948 50.411 124.278-117.929 93.043 64.123 141.771 -74.495 94.686 81.505 123.516-128.027 118.017 0.000 132.086-155.788 # 59 total E -6.80814E+02 rmsd from N 0.000 %NC 0.00 1 91.604 1.533 127.094 -74.478 125.349 -79.334 133.528 -92.337 116.800 -96.203 126.729-128.407 91.541 50.738 132.156 -78.314 92.261 43.867 141.322 -79.553 92.446 50.024 164.267 -89.306 92.375 42.644 93.388 -56.910 92.998 41.123 169.757 179.982 91.786 42.771 133.252-110.627 91.945 46.012 142.171-150.269 91.813 50.094 123.556 -83.898 92.520 69.399 132.743-116.838 92.218 -76.852 121.709 -80.625 110.539 -36.800 153.357-137.902 130.091-176.048 125.728 64.458 120.978-165.585 170.349 -68.067 122.024 -74.034 159.429 172.264 93.106 -12.366 105.613-117.518 95.345 91.758 156.391-120.170 118.978-165.795 143.151 -33.080 126.690-171.852 171.784 -44.318 93.317 73.278 112.054-131.124 125.034 -93.163 112.480-105.343 93.344 88.383 140.032 -96.898 135.577-118.401 130.433-101.631 121.030-115.679 124.523 -68.557 92.744 43.962 108.444 -86.290 91.299 45.966 128.474 -75.701 92.200 41.814 120.958 -33.547 93.622 41.696 141.439 -78.028 91.357 44.577 128.655 -76.269 91.716 42.933 150.058 155.286 91.648 45.160 158.516-147.133 91.101 44.485 129.602 -75.906 92.415 41.048 135.514-108.374 91.929 45.679 139.790-142.768 91.416 45.246 123.463 -84.937 92.588 43.509 121.704 -78.491 91.206 56.811 129.070 -76.365 92.998 84.899 126.926-148.230 93.002 -95.709 159.718 -22.937 123.518 -79.650 165.756 170.248 121.606 3.287 0.000 0.000 93.515 59.142 135.297-111.600 94.452 25.995 101.783 -89.670 97.185 43.233 0.000 0.000 92.915 43.194 123.897 -90.098 92.057 44.117 155.537-113.793 92.451 39.814 145.445 -75.120 93.268 40.708 134.612 72.099 92.528 41.543 133.923-149.559 92.238 45.704 148.750 -31.607 91.173 41.072 128.675 -75.788 93.342 43.185 165.017 -40.258 91.947 40.150 134.425 91.403 93.904 42.673 142.398 -75.600 92.856 40.795 123.143 -77.726 93.860 51.732 140.448-106.648 92.823 54.089 141.642 -75.181 94.787 78.696 125.120-129.041 118.042 0.000 131.874-159.965 # 60 total E -6.70239E+02 rmsd from N 0.000 %NC 0.00 1 91.568 59.920 135.170 -76.542 123.615 -83.477 119.722 -86.882 113.265-178.574 127.010-131.765 137.248-175.350 151.272 -83.756 131.220-120.814 147.508-134.337 124.699-156.697 122.919 -57.298 130.548-136.926 147.245-121.074 120.441 -10.604 149.880 141.991 103.828-163.573 114.372 -43.132 127.174-158.648 133.101 105.455 122.827-169.397 168.743 -69.374 118.333 -62.064 168.014 137.161 92.978 -21.520 138.698-108.678 95.242 97.320 137.795 -85.601 119.586-147.945 141.987 -68.902 123.779-162.009 163.737 -41.902 126.674-162.340 153.582-173.906 116.080 6.623 133.203-114.792 95.107-177.876 124.355 -63.640 127.978-121.180 150.534 -27.668 126.848-157.079 135.900-109.931 118.846-161.732 137.681-112.057 125.506-157.182 176.478 -31.960 114.474 20.322 138.847-105.453 92.309 108.241 131.243 -77.932 93.540 -21.715 176.425 -48.555 93.701 -64.953 147.231 169.588 91.971 7.923 129.440 -74.965 119.279-165.852 133.583 40.191 129.810-157.014 157.442 -34.408 117.162-164.910 150.235 -62.817 136.950-163.496 148.005-172.884 95.702 -28.379 117.164 34.117 92.415 -81.844 130.702 -77.904 92.989 62.003 158.464 -43.198 94.427 63.903 132.596-143.297 92.416 177.667 122.889-134.970 140.423-172.616 176.483 128.851 124.739-151.686 161.963 -75.564 128.889-154.975 142.066 168.531 93.156 73.678 157.241 -13.210 114.615 -51.297 162.309 -22.753 95.351 174.040 153.032-115.937 92.033 56.688 135.276 -93.862 92.569 35.575 87.436 -85.535 96.252 40.428 0.000 0.000 94.160 39.909 124.794 -87.372 93.774 38.035 146.657-106.372 94.651 37.968 144.870 -75.015 94.348 39.406 126.370 109.877 93.406 39.677 143.010-127.847 92.875 43.007 151.219 -28.379 91.189 44.524 132.026 -78.987 92.441 44.644 128.151-100.599 91.339 41.902 140.956 81.943 93.644 43.049 115.954 -83.067 92.961 41.000 133.015-109.202 93.949 50.446 124.075-118.083 93.042 64.225 141.780 -74.517 94.680 81.530 123.534-128.096 118.017 0.000 132.093-155.737 # 61 total E -6.65906E+02 rmsd from N 0.000 %NC 0.00 1 91.567 61.507 133.604 -68.493 126.417 -95.451 165.886 -88.104 91.934 56.531 107.362 -90.634 90.986 44.593 130.668 -77.343 92.323 48.778 146.397 83.450 92.749 36.751 167.421 -68.084 93.229 41.437 100.924 -61.352 92.701 44.794 134.171-101.681 91.835 41.385 137.573 60.322 92.408 41.588 145.302-126.375 92.385 47.123 123.158 -81.859 92.402 46.817 127.039-103.783 93.503 36.362 146.498 121.552 95.696 52.100 165.116 -90.732 94.210 96.597 139.374 -92.939 96.043 -7.933 154.704-118.362 93.207 -79.984 172.165-123.426 93.510 3.581 156.325 91.212 96.660 108.796 0.000 0.000 129.206-124.050 129.281 -23.335 128.197 -70.152 112.797 -83.089 94.255 80.570 104.820 -90.981 94.489 152.871 125.656-140.313 93.139 42.833 130.545 -81.456 92.112 106.134 130.261 -77.141 93.874 -27.738 167.753-157.336 92.987 -60.992 140.420-134.306 91.500 10.182 128.792 -74.592 132.174-148.467 128.324 -81.554 127.392-129.673 162.739 9.441 134.402 -99.928 146.276 -82.008 92.264 54.654 152.706 153.371 91.745 50.019 135.203-132.993 90.967 47.154 132.000 -79.975 92.187 46.665 123.685 -45.208 91.449 58.927 145.155-144.011 91.174 61.257 129.896 -97.731 92.280 105.593 128.762-128.190 91.384 42.942 127.659 -74.765 107.681-163.935 141.429-158.137 117.126 -70.992 161.117 -18.304 92.728 -14.979 159.658 -41.654 94.488 99.008 146.003-109.625 122.462-153.282 165.113 -71.241 93.028 37.764 96.241 -82.569 120.710-137.108 0.000 0.000 127.415 -97.851 109.050 -90.275 92.692 44.619 126.394 147.231 93.172 45.718 104.524 -62.253 93.262 42.829 140.703 91.540 93.071 37.939 141.600-136.971 92.886 45.546 152.248-123.574 91.312 44.041 125.476 -73.968 93.104 42.409 128.607 -91.582 92.271 39.323 141.003 86.537 94.870 39.985 115.600 -88.704 93.342 42.844 136.350-127.477 93.882 49.802 132.158-114.491 93.099 65.349 141.845 -74.012 94.909 83.406 121.834-128.084 118.168 0.000 130.087-155.477 # 62 total E -6.60202E+02 rmsd from N 0.000 %NC 0.00 1 125.086-117.539 159.382 121.253 132.046-101.981 175.324 -85.623 118.170 111.571 99.748 -78.786 91.861 26.367 129.733 -76.122 117.289-155.083 162.880 173.025 96.154 48.454 128.111 -91.491 129.111 179.835 145.545 -94.552 123.704-173.143 153.193 25.543 93.359 31.984 118.092 -52.325 112.474-155.981 176.491 -9.619 129.246-152.154 157.850-100.712 118.803 147.385 160.990-110.394 100.830 -59.988 141.194-122.547 92.880 35.067 139.049-111.457 116.133 -85.578 110.553 -86.931 121.616-160.015 163.428 -9.640 130.881-130.027 153.521 153.811 115.968 19.244 153.715 103.514 117.544-168.179 0.000 0.000 125.960-169.436 141.883 -16.525 94.781 39.273 124.921 -90.152 122.672-167.703 147.967 -87.979 123.376 109.251 139.265-128.797 92.796 117.880 160.230-114.567 90.861 -30.571 129.893 -77.439 94.790 -65.415 139.949 -73.399 108.693-115.680 149.085-157.202 90.760 49.581 128.391 -72.281 91.213 42.059 110.136 -53.071 93.375 41.621 144.222 -74.297 91.274 44.172 122.351 -75.134 91.423 44.363 157.332-148.347 91.517 44.856 151.385-142.026 91.174 41.192 126.965 -76.170 92.537 52.253 124.018 -99.922 91.227 79.632 137.100 135.809 91.319 57.064 114.209 -76.464 92.683 126.046 76.805 -84.458 91.615 99.296 128.382 -75.584 109.535 122.535 137.869-162.615 93.124 -22.756 161.758 -12.468 93.740 -59.673 167.791-134.521 102.988 -24.125 0.000 0.000 93.167 104.524 162.213-137.468 93.223 16.793 147.559-158.142 121.047-148.119 168.407-131.814 119.565-129.183 139.288 -77.714 92.785 37.949 160.583 119.991 93.429 47.790 167.883-101.349 93.673 40.285 126.640 133.481 93.944 35.233 148.846-147.186 93.718 41.914 148.093 -32.561 91.434 46.074 129.974 -77.751 92.682 43.980 144.211 -76.441 91.515 40.960 141.711 -83.756 93.620 45.087 111.317 -80.473 92.667 43.600 131.767-101.286 93.391 63.073 126.780-111.642 92.372 75.006 142.742 -74.626 94.381 86.326 103.983 -91.370 117.682 0.000 135.273-142.141 # 63 total E -6.72556E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.355 135.206 -75.076 124.840 -82.723 130.640 -83.332 116.979-100.468 136.402-144.727 91.326 53.741 131.284 -76.929 92.434 44.337 111.343 -80.740 93.354 39.829 162.999 -73.308 93.204 41.413 137.527 -74.211 93.447 42.900 163.707 -84.225 92.150 40.716 119.136 -40.164 92.732 39.257 136.495 -98.023 92.532 50.134 114.739 -88.772 92.421 54.502 155.779-153.450 92.666 46.417 123.401-108.774 95.846 87.560 0.000 0.000 125.645-170.868 149.464 -62.861 123.774-145.278 130.565 -87.909 127.166-136.494 156.229-145.561 120.776 166.902 115.815-120.658 125.889 -25.794 124.355 -63.640 99.409 -49.390 112.258 -58.696 94.370 85.438 120.081-103.839 123.182-113.640 130.422-119.768 127.663-156.715 168.376 -16.122 128.405-126.390 155.304 -76.158 126.451 -88.309 149.860-103.527 93.398 63.957 105.558-125.644 92.206 106.993 146.136 -27.055 93.341-103.967 126.624 -76.957 92.165 83.174 102.209 -64.781 94.109 44.284 142.403 -73.651 91.593 44.078 132.645 -76.760 92.173 42.707 155.401 85.454 91.767 47.482 158.645-143.845 90.997 43.975 127.517 -75.781 92.808 40.911 154.215-143.208 92.168 45.080 149.552-147.543 91.556 42.468 122.258 -81.724 92.847 42.348 119.076 -65.006 91.102 47.027 128.377 -76.243 91.869 44.314 125.932-145.793 91.858 47.690 152.423-150.154 93.116 35.582 121.478 -86.229 94.401 47.614 142.019 -87.228 92.772 41.724 134.601-107.204 93.515 36.116 113.623 -63.133 96.289 37.177 0.000 0.000 94.752 39.171 122.091 -80.927 94.169 36.372 145.430-113.277 95.096 37.438 144.576 -75.001 94.548 38.887 126.445 112.508 93.494 39.636 144.552-125.732 92.878 42.896 148.923 -25.535 91.229 44.159 131.444 -78.611 92.643 43.620 127.219-101.474 91.544 41.460 141.306 82.620 93.783 42.820 141.606 -75.921 92.894 41.256 132.997-105.302 93.804 50.769 124.498-116.830 92.950 64.044 141.684 -74.984 94.691 81.217 125.295-127.184 118.007 0.000 132.224-155.979 # 64 total E -6.47900E+02 rmsd from N 0.000 %NC 0.00 1 125.545-119.473 157.285 29.039 127.500 -90.553 138.507 -89.072 120.457 -53.354 107.629-101.949 91.404 75.661 131.039 -76.915 124.411-124.984 142.544 -93.531 132.407 -66.244 122.477 -61.190 123.720-163.896 128.168-114.705 119.170 167.508 139.777 53.309 92.587 57.182 112.170 -42.837 93.032 143.749 145.882-105.645 83.480 -49.135 119.609 -66.579 93.467 -44.577 125.470 -91.614 96.085 78.801 142.322-110.459 129.074 -81.003 151.724 49.023 127.350-174.949 127.978 -62.360 116.495 179.492 139.659-101.520 92.976 54.789 138.007 157.834 95.135 100.407 140.142-101.719 135.484 8.156 112.685 -60.578 136.859-101.298 131.724 -88.874 123.867-145.105 160.644 25.605 129.044 3.536 149.627 68.104 122.334-123.621 124.962-127.727 124.931 26.726 148.016 -68.526 91.864 109.336 130.219 -77.034 93.176 -25.387 162.056-171.156 93.055 -61.293 147.517 -24.976 91.592 3.069 129.076 -76.017 119.958-120.189 135.594 34.807 128.968-154.015 157.340 4.325 134.567 -94.200 148.204 -68.860 92.244 53.155 167.024-118.627 91.934 47.124 141.387-137.741 90.967 53.898 131.288 -78.466 91.946 60.594 117.642-116.491 91.372 61.684 164.794 121.363 91.464 64.603 125.311-109.170 93.062 120.848 128.078-120.523 91.471 46.136 128.679 -75.600 94.594 90.878 134.506-160.284 92.615 -61.691 152.014-163.738 94.101 -55.285 140.738 -99.713 94.428 170.087 0.000 0.000 91.512 57.637 142.983-110.457 93.596 34.362 86.878 -83.548 97.466 33.504 0.000 0.000 96.855 34.094 112.843 -86.915 95.857 33.653 146.427 -77.112 96.896 34.271 157.495 68.294 95.935 34.854 121.817 126.679 94.628 37.786 151.034-141.460 92.925 44.058 153.998-154.276 90.824 45.464 131.108 -77.124 91.943 42.905 141.659 -78.571 91.243 42.371 136.233 77.321 92.750 47.429 116.052 -72.418 92.562 39.745 135.583-108.562 93.465 53.585 121.754-120.966 92.945 75.987 142.621 -75.484 94.381 104.195 129.473-135.205 117.483 0.000 129.334-113.301 # 65 total E -6.61132E+02 rmsd from N 0.000 %NC 0.00 1 91.566 60.878 136.120 -75.644 124.103 -82.222 133.952 -92.446 116.788-130.356 99.439 -77.810 129.378-137.045 157.167 -96.378 125.806-158.293 170.498 -82.910 127.980-160.788 176.428-104.758 94.412 87.708 141.283 -75.103 115.743 9.753 176.416 17.917 123.709-100.978 111.338 110.812 127.407-113.087 105.406-102.716 118.879-161.912 174.375 -32.139 127.552-167.687 163.122-125.927 112.449 -67.269 176.281-162.280 98.749 -13.022 0.000 0.000 93.446 88.567 139.460 -91.927 126.516-147.484 137.156 -85.800 122.118-166.121 158.647 -18.436 128.666 -92.551 144.237-109.766 125.062 -15.214 0.000 0.000 121.691 -86.806 129.498 88.584 129.686-148.824 125.975-117.779 119.759-131.163 148.731 -95.412 92.877 43.073 149.470 -76.866 91.805 50.261 149.003-143.754 91.364 56.700 130.717 -74.276 92.618 51.544 167.243-102.319 93.069 100.988 105.161 -73.610 114.514-120.081 124.033-110.020 92.134 51.857 121.003 -58.454 93.512 43.767 117.790 -40.657 91.605 44.095 130.090 -78.407 92.401 40.708 136.068 138.049 92.268 42.272 144.709 -48.878 91.267 44.271 128.477 -83.167 91.302 51.631 159.426-130.322 90.252 54.243 143.954-141.339 90.871 42.191 101.830 -62.117 92.123 47.933 91.635 -49.557 91.386 74.550 123.460 -73.755 92.019 55.614 126.693-146.867 92.793 76.018 153.333-128.402 109.917 -30.842 134.852-131.331 118.596-138.448 0.000 0.000 124.721 106.656 169.734 -84.377 90.746 -32.295 138.822-134.362 93.701 -48.044 0.000 0.000 113.141-157.283 138.812 -98.944 92.779 43.903 153.813-106.996 92.467 51.601 117.970 -23.757 93.215 43.624 139.398 89.320 93.326 33.248 135.061-137.934 93.456 45.733 144.679-117.218 91.286 49.451 129.315 -75.448 92.499 41.315 144.094 -72.366 91.890 38.255 141.761 -76.835 94.103 46.083 112.252-104.205 93.136 36.876 136.704 -94.656 94.039 56.041 125.879-108.884 92.564 74.971 133.538-102.149 94.328 88.972 120.204 -91.402 117.610 0.000 135.502-136.753 # 66 total E -6.62983E+02 rmsd from N 0.000 %NC 0.00 1 91.614 111.161 135.219 -76.054 125.499-106.127 134.333 -89.164 92.997 80.087 103.987 -90.434 91.964 -19.198 129.789 -76.749 131.722-161.369 141.249 -93.106 129.160-122.328 137.219 -42.848 123.582-169.687 146.299-112.636 137.563-122.726 150.946 0.156 113.616-155.335 107.035-124.716 94.062 20.391 124.850 118.916 133.156-148.504 171.486-123.566 119.223-170.001 167.033-113.676 114.940 -62.548 152.642-108.454 97.410 -18.863 151.724 49.023 93.554 88.034 139.802 -90.175 129.599-136.523 147.619 -78.795 126.149-151.925 157.633-172.423 127.022 -4.592 162.150-139.149 119.744-115.574 150.759 -29.240 128.817-167.392 142.613 23.946 129.203-133.573 126.876 -56.067 115.290-168.100 134.029 -91.567 135.259-133.100 146.070-121.408 120.339 -93.468 157.691 106.322 91.793 45.805 130.041 -77.090 92.424 42.761 143.829 -77.998 90.770 66.941 135.589-143.317 90.710 53.488 124.791 -75.584 92.270 32.173 124.284 -76.337 94.808 44.152 110.518 -11.695 92.008 41.778 125.745 -80.263 91.997 45.315 136.569 154.186 91.337 44.084 152.540-136.919 91.057 46.220 127.260 -75.031 92.716 45.231 144.442 128.040 91.567 48.873 114.993 109.245 91.185 63.900 124.236-103.313 93.147 113.406 160.168-120.050 91.555 1.585 129.074 -75.850 106.516-140.487 130.822-141.150 118.122 -57.101 160.567 37.561 93.228 -28.576 134.322 -92.435 94.911 99.926 0.000 0.000 125.810-161.355 123.315 -64.477 93.317 79.413 107.354 -68.853 109.828 178.096 0.000 0.000 132.919-166.404 147.337-151.397 136.026-159.113 162.272 -54.327 117.752-161.763 139.622 35.153 133.816-121.903 110.459 122.043 125.432-169.211 118.599 -87.261 116.079 -64.237 147.680 2.863 91.982 -21.037 129.617 -76.388 96.442 87.754 163.977 -62.021 127.704-128.855 159.674 -51.388 123.271-161.768 172.259 -2.667 132.339-123.985 120.603 104.911 129.479-168.794 151.583-105.814 126.180-175.514 161.775 166.235 95.335 60.137 140.147 -74.694 117.303 0.000 140.048-178.581 # 67 total E -6.69805E+02 rmsd from N 0.000 %NC 0.00 1 91.561 63.658 126.314 -40.768 130.013 -94.852 108.308 -96.335 116.931 -99.006 144.287-156.124 91.495 51.123 131.613 -77.391 92.637 51.513 142.155 -76.216 93.031 73.308 138.472 -67.660 92.825 103.821 91.734 -73.554 92.883 52.800 122.755-113.369 92.890 158.174 122.310 -77.450 93.568 46.991 117.578 -60.547 121.641-165.759 166.456 50.633 120.580-168.856 158.062-142.147 108.459 -69.057 167.860 -22.983 97.316 -14.524 139.049-111.457 93.473 91.272 114.767 75.722 121.076-146.460 144.255 -77.943 126.623-156.286 155.044-167.807 132.165 -60.985 156.276-150.557 140.364 -40.045 0.000 0.000 137.722-153.813 144.599 28.707 94.105 61.580 146.972 -75.181 93.940 77.628 141.362 -80.223 122.615 -93.121 98.593 -91.719 91.968 76.545 149.364-133.359 91.229 69.656 131.503 -77.182 92.443 68.225 116.033 -71.122 92.241 94.732 141.893-138.671 108.051-132.291 116.411 -97.290 92.215 56.836 112.430 -47.129 93.791 50.670 163.523 -85.247 91.624 39.522 130.232 -75.621 92.277 54.294 125.095 116.397 91.494 58.638 105.174 130.137 90.743 92.680 131.024 -75.176 92.434 120.249 111.591 -64.865 92.367 50.284 126.227-126.285 91.537 44.677 133.697 81.283 92.613 43.812 123.195 -72.697 90.990 49.513 126.945 -73.985 91.637 42.313 125.028-142.859 92.146 46.305 152.648-144.544 93.584 34.987 121.517 -85.521 94.666 46.772 0.000 0.000 92.905 41.547 137.462-110.963 93.551 35.975 113.477 -62.672 96.297 37.421 0.000 0.000 94.801 38.787 120.056 -78.442 94.184 36.511 145.605-119.663 95.258 37.081 142.347-122.189 94.551 38.998 127.241 110.325 93.439 39.762 144.510-125.739 92.771 43.117 148.713 -26.080 91.186 44.275 131.212 -78.425 92.621 43.580 127.003-100.982 91.548 41.492 141.394 82.535 93.785 42.812 141.593 -75.935 92.892 41.279 133.070-105.198 93.803 50.704 124.460-116.759 92.952 64.044 141.692 -74.993 94.691 81.201 125.354-127.129 118.005 0.000 132.225-155.997 # 68 total E -6.91388E+02 rmsd from N 0.000 %NC 0.00 1 91.568 56.353 134.384 -83.492 123.363-168.755 131.665 -81.910 94.665 54.354 136.547-158.104 93.270 170.900 169.877 -82.890 92.817 37.664 141.384 -77.033 93.925 168.922 127.399-101.835 146.769 -55.485 98.094 -73.769 126.288-170.342 156.391 175.793 104.122 174.402 122.994 47.095 91.872 46.403 129.698 166.799 109.565 145.725 167.910 -28.328 94.812 -37.724 151.433 145.600 92.617 -49.321 134.593-109.166 93.973 91.561 164.396-123.999 127.225 -99.023 109.950 -89.045 126.922-165.241 131.917 -69.316 122.541-179.133 139.048 128.176 93.874 67.106 103.053-118.100 97.034 122.239 151.550 -22.359 131.927 -74.729 135.918 -28.644 126.029 -11.681 140.418 -89.966 130.969-161.884 123.700 -87.469 128.281-140.511 163.855 61.731 99.104 -35.086 94.611 26.287 91.686 -79.538 130.964 -77.922 91.960 70.757 139.898 -72.410 93.745 55.518 137.019-139.197 108.674-172.665 131.300 -88.857 127.018-121.906 142.573 -25.444 94.410 71.206 109.501 -39.162 91.208 132.518 130.346 -74.405 91.601 61.712 128.345-131.090 91.593 43.671 135.258-126.699 91.019 49.313 126.335 -74.280 92.068 46.038 134.236-133.204 91.395 50.504 133.359-142.487 91.181 49.533 125.712-100.782 91.627 78.431 121.489 -81.520 90.957 53.084 127.824 -75.232 93.828 83.727 131.255-155.937 92.637 -65.742 153.040-169.690 94.392 -55.055 142.656-100.602 94.262 163.027 0.000 0.000 92.117 52.910 125.744 -86.715 94.190 34.983 82.273 -82.774 98.826 29.882 0.000 0.000 98.697 29.767 119.685 -87.154 96.524 32.755 109.701 -48.575 97.248 33.291 137.477 -75.745 96.936 32.075 106.212 124.193 96.758 31.100 149.044-145.372 95.797 39.504 154.479 -27.172 91.884 43.653 135.300 -80.905 92.945 42.462 138.639 -72.997 91.702 38.734 138.776 86.174 94.078 43.042 114.476 -79.173 93.061 40.204 148.020-106.059 93.999 51.059 131.680-111.969 92.926 64.568 141.602 -74.040 94.681 81.380 122.189-125.888 118.030 0.000 131.923-156.040 # 69 total E -6.69064E+02 rmsd from N 0.000 %NC 0.00 1 91.565 57.915 158.287 -22.570 123.989 -83.862 135.529 -94.993 124.830 178.521 104.353 -95.942 128.459-164.014 152.500 -66.630 125.260-162.080 166.383-160.910 94.825 101.428 129.529-105.390 95.667 29.066 107.441 -82.226 109.221 -65.262 98.097 -46.555 91.256 -25.148 118.739 -59.503 114.356-171.418 156.119 13.606 126.085-139.081 153.635 -83.044 123.109-127.952 157.003-128.139 95.406 143.753 140.853 70.316 130.376 41.124 0.000 0.000 128.136-114.768 173.896-110.535 130.371-162.890 141.543 -96.768 111.993 -57.703 152.402-113.092 92.549 -24.856 105.518 121.502 95.266 91.097 158.735 163.941 125.601-122.896 136.972 -14.280 125.248-141.961 141.610 -87.002 128.105-107.078 149.222-115.052 127.210-168.446 176.442 -70.416 127.645-121.404 150.385 -42.908 125.089-107.278 132.350-102.217 124.971 -99.737 118.082 -73.874 92.360 49.747 144.949 -19.951 91.175 45.762 128.997 -76.145 92.022 41.267 124.263 1.632 93.100 44.004 136.105-113.445 91.191 44.497 127.824 -75.994 92.007 41.053 140.536 -69.389 92.221 44.014 163.546 145.295 91.421 42.485 127.927 -75.979 92.866 42.138 110.425 -79.887 91.947 43.477 143.172-144.328 91.391 43.587 118.424 -72.622 92.754 41.874 133.677-128.528 91.142 46.906 128.152 -75.935 91.870 43.662 127.706-149.029 92.028 47.012 149.256-134.603 93.374 35.220 122.154 -87.651 94.589 46.976 0.000 0.000 92.869 41.590 136.415-109.338 93.542 36.060 113.797 -63.159 96.285 37.223 0.000 0.000 94.754 39.093 121.077 -79.727 94.167 36.531 145.717-114.289 95.071 37.462 144.605 -75.058 94.535 38.904 126.224 111.656 93.517 39.438 144.306-126.148 92.904 42.859 151.336 -28.083 91.192 44.556 131.702 -78.799 92.418 44.649 128.326-100.883 91.332 41.842 140.872 81.962 93.647 43.092 116.003 -83.084 92.955 40.971 132.836-108.597 93.951 50.439 124.086-118.162 93.048 64.087 141.770 -74.505 94.687 81.523 123.581-128.077 118.017 0.000 132.088-155.769 # 70 total E -6.49814E+02 rmsd from N 0.000 %NC 0.00 1 125.884-138.455 144.290 -95.536 127.966-155.555 136.415 -67.240 113.119 163.437 147.420-167.108 127.518-177.468 85.344 -97.831 111.488 -24.401 176.394 -80.388 93.440 -87.360 119.635 -83.522 92.300 64.224 138.980 -70.983 95.752 59.982 116.667 -77.032 92.789 166.782 164.443 -75.736 131.634-174.543 176.536 -2.174 121.408-167.659 171.708 -53.116 114.876 -68.933 151.894 119.103 93.445 -14.899 112.770-163.925 95.502 94.722 0.000 0.000 113.966-162.587 140.008 -66.474 123.391-161.875 164.679 -51.492 119.654 174.783 153.073-178.262 119.794 -68.697 122.094-116.828 95.115 155.849 124.355 -63.640 120.900-153.550 134.429 35.205 94.932 74.446 127.516-103.808 112.293 -43.506 132.281 -86.492 93.279 77.495 141.933 -75.062 91.612 46.865 154.470-142.927 91.051 47.189 129.985 -77.318 92.207 40.055 144.161 -78.400 91.887 45.183 139.735-155.410 91.046 45.579 126.404 -75.460 90.910 44.948 129.063 64.992 92.187 46.068 142.754 -72.217 91.155 40.805 123.402 -73.820 91.559 49.612 135.379 74.970 90.866 50.354 150.717 36.920 90.674 45.036 127.887 -76.047 92.398 47.811 133.772-141.096 92.310 69.646 89.908 48.924 91.632 52.122 127.495 -84.513 122.201 -91.881 115.703-129.349 121.504-104.595 159.687 -87.665 94.869 22.577 153.810 -13.475 93.265 69.292 145.251 -99.430 109.901 -28.634 156.063-118.052 95.734 72.840 0.000 0.000 92.781 49.907 136.063-108.152 92.986 41.665 137.028 -11.460 94.665 42.100 0.000 0.000 104.026 -94.128 127.684-111.150 120.759-155.171 153.699 103.659 129.033 -92.015 158.861 -29.471 126.385-118.183 125.130 142.968 92.532 36.675 140.759-129.253 91.647 53.962 152.452-148.170 91.025 41.950 127.440 -74.561 93.136 43.376 113.443-115.281 91.715 41.337 142.825 78.002 93.689 43.024 117.626 -94.173 92.906 41.925 137.308-111.426 93.817 49.758 126.824-117.738 93.028 63.755 141.742 -74.772 94.712 81.718 122.777-127.644 118.033 0.000 131.896-155.798 # 71 total E -6.91022E+02 rmsd from N 0.000 %NC 0.00 1 91.568 61.389 136.465 -72.779 124.142 -74.187 141.983 -88.629 116.194-150.298 142.425-155.885 91.012 63.636 131.463 -77.417 91.910 47.698 143.445 -78.724 92.516 55.683 138.999 -69.699 93.525 39.592 121.796-137.629 93.863 55.507 107.732 -78.323 92.264 73.248 85.181 91.931 92.086 -60.071 134.732-123.999 123.160-148.769 172.966 -45.222 123.537-166.830 162.649-120.323 107.829 -60.580 120.915-127.414 98.967 -19.980 0.000 0.000 93.825 83.338 141.539 -91.660 128.919-122.891 145.825 -88.941 131.937-152.531 165.223 158.020 116.247 5.831 163.562-130.758 94.524 178.895 167.044-117.212 137.230-144.811 138.147 11.269 94.624 48.977 120.686 -81.278 132.700 -93.339 150.068-118.995 95.585 78.446 176.420 -79.477 92.378 94.734 126.578 -71.137 138.325-127.285 141.746 -50.970 94.797 20.276 138.946 -97.369 96.319-170.329 138.338-129.415 121.833-152.038 159.300 -82.191 92.979 41.476 128.447 -51.989 92.896 50.733 122.303-136.658 91.410 41.701 127.084 -74.145 92.430 42.041 131.832 104.575 92.330 43.468 144.547-137.838 91.550 42.065 128.600 -76.941 92.934 41.660 128.894-146.898 91.981 43.657 130.938 126.741 91.397 44.146 115.850 -65.185 92.524 42.357 125.508-100.741 91.122 46.526 128.011 -75.763 91.966 43.733 129.851-149.822 92.161 45.967 150.733-132.542 93.606 35.231 120.135 -86.977 94.740 44.480 0.000 0.000 92.791 41.958 135.839-109.252 93.593 35.518 139.195 -22.586 96.269 37.923 0.000 0.000 94.643 39.009 121.747 -79.791 94.037 36.754 145.368-114.968 95.310 37.038 165.657-113.127 94.562 38.960 126.402 110.519 93.520 39.383 144.384-126.143 92.885 42.972 151.042 -28.883 91.177 44.572 131.696 -78.795 92.413 44.632 128.330-100.268 91.336 41.848 140.909 81.972 93.652 43.060 115.811 -83.058 92.957 40.993 132.949-108.734 93.950 50.409 124.148-118.065 93.047 64.097 141.776 -74.500 94.687 81.507 123.564-128.024 118.017 0.000 132.083-155.774 # 72 total E -6.63565E+02 rmsd from N 0.000 %NC 0.00 1 91.563 47.973 122.695 -83.637 127.853 -65.756 138.922 -89.248 115.457-157.177 144.758-160.622 129.205-164.652 175.863 -86.498 123.220-171.097 147.686 -82.126 97.926 -25.363 155.333 43.265 94.663 -85.683 118.434-143.573 92.882 58.348 147.656-106.776 93.134 65.919 123.619 -64.809 92.795 175.718 139.670-156.013 125.138-164.711 168.544 -39.662 125.092 179.472 164.838-139.428 121.648 170.358 169.055 3.293 94.926 71.533 0.000 0.000 130.847-167.912 130.867 -77.214 118.819-165.224 163.385 -70.658 128.927-107.122 157.453-138.922 116.654 -57.230 107.641-114.906 94.765 164.680 0.000 0.000 126.175-159.245 125.998 53.172 95.566 102.729 133.514 -98.247 125.291 -93.182 133.956 -97.902 93.931 51.864 142.446 -73.977 91.783 45.202 129.283 -82.333 91.120 47.925 129.754 -75.995 91.281 46.018 144.233 -79.084 90.914 43.332 144.601 -20.096 90.889 47.370 127.910 -74.040 90.812 44.008 111.891 -48.334 91.860 44.390 143.753 -74.294 90.810 45.590 128.670 -75.362 91.231 43.638 138.788 116.263 90.920 44.082 143.721 -61.471 90.472 47.569 130.406 -77.927 91.746 43.392 158.487 -6.520 91.333 43.393 127.989 123.081 91.311 43.864 118.282 -70.907 92.104 44.300 109.194 -43.308 90.953 48.871 127.332 -75.230 92.455 45.999 124.972-131.440 92.565 47.996 151.646-119.096 105.152 -82.369 118.694 -81.936 113.125-161.831 0.000 0.000 111.065 120.174 141.544 -91.956 93.642 -96.728 102.638 -82.946 94.829 56.190 0.000 0.000 94.507 48.559 119.220 -89.252 94.806 28.174 106.026 114.319 96.507 39.708 159.647 21.373 95.290 33.986 109.357 124.715 95.420 36.717 145.702-148.731 95.130 36.107 148.657 -16.327 91.811 45.124 137.554 -80.159 92.521 45.319 142.034 -74.692 91.025 41.025 141.289 -75.460 93.004 43.862 109.941 -82.427 93.055 38.987 135.933-119.264 94.205 48.611 128.456-111.017 93.069 66.129 143.102 -75.934 94.671 82.592 126.596-119.688 117.902 0.000 133.417-153.079 # 73 total E -7.03773E+02 rmsd from N 0.000 %NC 0.00 1 91.568 57.724 132.548 -77.789 123.561 -86.726 114.232 -72.458 102.907-176.763 138.407-159.367 91.583 52.305 130.642 -77.352 93.422 38.914 138.310 -72.661 96.163 34.537 145.298 -74.738 95.982 36.873 136.465 -71.217 95.073 38.124 116.837-151.723 92.978 41.098 113.224 37.392 92.061 44.931 149.009 -99.452 91.735 50.843 120.525 -83.040 92.835 39.200 131.725-102.270 94.123 42.100 93.634 138.486 94.495 52.527 162.751-120.528 94.005-111.654 138.095 -91.536 94.359 149.953 127.738-123.744 92.612 40.843 162.003-162.153 95.174 94.321 135.025 -99.433 107.637 -11.132 156.391-120.170 90.681 -69.360 92.370 -66.104 92.740 5.612 114.056 -54.585 115.053-179.721 163.393-134.881 94.872 42.592 176.443 -59.075 93.875 107.309 90.446 -38.724 91.348 -32.867 173.096 -85.129 94.148 -56.203 142.307 -75.908 92.659 18.958 99.911 -85.357 126.437-172.342 142.604 -92.788 119.544 -28.052 136.133 -6.423 135.375-140.236 171.538 -26.418 126.272 -84.050 144.268 -82.557 92.922 47.760 140.473 -92.882 92.271 44.536 134.095-128.071 90.994 51.028 135.214-116.218 91.588 47.510 117.739 -99.620 91.137 46.285 137.490-141.646 91.111 45.032 121.840 -90.313 91.487 63.426 125.570 -67.836 90.626 48.507 128.778 -75.902 93.263 80.630 129.458-152.456 92.544 -64.115 153.133-155.515 94.833 -59.789 142.168 -99.027 94.576 168.265 0.000 0.000 92.276 50.570 134.201-101.380 93.662 35.231 84.533 -82.325 97.729 34.389 0.000 0.000 96.781 34.230 117.808 -87.435 95.822 32.203 146.872-106.578 95.864 39.526 147.753-108.634 94.015 40.379 108.482 124.523 93.251 39.402 149.365-122.290 93.594 39.637 148.272 -23.020 91.365 46.119 164.508 -98.099 92.100 47.231 122.932 -98.771 90.999 41.826 139.328 75.424 93.766 40.892 142.879 -76.990 92.763 45.107 133.824-121.389 92.502 57.832 127.305-114.729 91.865 79.389 142.248 -74.598 94.191 102.157 95.246 -80.662 117.766 0.000 128.438-122.189 # 74 total E -6.62322E+02 rmsd from N 0.000 %NC 0.00 1 91.604 109.068 132.107 -77.894 124.009 -93.092 131.494 -96.800 118.305-101.578 113.749-110.516 91.430 77.908 133.992 -78.812 93.052 81.986 141.019 -76.267 94.242 86.378 105.809 -50.560 124.231-152.118 176.442 -77.983 129.873-145.801 148.577 -23.656 126.477-171.530 113.579-110.437 92.789 6.044 143.952 161.546 127.706-146.432 173.960 -57.098 124.811-166.268 166.074-111.609 104.247 -64.278 120.074-129.018 95.970 -20.414 151.724 49.023 92.483 96.376 116.459 82.690 115.286-143.915 154.322 27.177 123.624-157.963 159.869-176.572 113.925 12.720 153.309-118.139 93.879-169.632 118.346 62.818 119.516-156.916 134.212 27.434 126.258-162.920 161.563-123.663 119.650 -70.548 150.031 -38.623 93.777 -11.887 107.060-104.181 94.347 88.255 146.345-125.618 132.428-145.570 148.719-105.668 130.666-162.218 172.182 -70.795 123.051-152.509 101.339 -54.882 91.893 14.279 128.287 -76.291 123.771-167.425 145.068 39.057 127.868-161.896 157.796 59.902 132.683 175.342 142.916 -59.594 92.452 78.456 165.895-120.823 93.188 79.941 137.952 -45.401 91.467-179.605 120.212-118.717 130.617-159.272 88.113 -77.798 92.174 -11.520 139.912-143.147 119.114-172.863 128.546 -6.679 116.909-151.746 144.311 133.336 91.649 -57.356 125.889 -73.678 92.800 -65.004 116.709-125.460 91.567 85.284 149.171-113.498 95.496 29.907 105.615 -92.460 120.458-161.972 164.220-142.818 123.730-165.216 133.769 -70.847 93.443 -34.384 141.374 -34.830 132.170-129.668 0.000 0.000 117.694-136.111 139.065-114.736 94.504 38.016 137.325-131.175 95.407 41.000 158.961 -93.402 94.444 37.181 112.924-155.274 94.335 37.825 141.635-149.871 93.834 40.728 147.885 -33.097 91.876 39.840 127.693 -75.777 94.303 41.596 133.084-111.452 92.633 38.054 135.719 88.417 94.851 40.592 142.776 -75.395 93.358 41.656 139.362 -99.483 93.852 51.660 132.875-132.566 92.808 63.495 118.912 -77.098 94.687 83.798 123.778-128.180 118.060 0.000 131.515-153.803 # 75 total E -6.95479E+02 rmsd from N 0.000 %NC 0.00 1 126.089-130.108 149.721 -82.946 126.514 -82.398 132.124 -84.411 116.824 -99.161 135.956-144.098 91.390 51.243 131.393 -78.054 92.327 45.450 142.759 -77.544 92.524 46.029 169.636 -65.479 92.111 42.769 106.364 -65.177 92.783 41.885 125.667-115.660 91.872 43.684 116.583 41.568 91.953 43.483 152.339-118.900 91.044 51.659 121.685 -86.091 91.350 46.714 131.078-122.140 92.042 45.388 132.756 57.784 93.079 53.935 0.000 0.000 92.990 -76.659 134.806-107.896 130.505-177.873 138.696-100.497 115.962 178.443 161.273 163.811 111.615 -58.954 106.196 113.972 93.000 33.608 0.000 0.000 117.229-105.084 135.268 -6.541 128.298-109.979 138.436 -87.419 124.415 -90.337 117.442-118.074 93.710 45.427 142.492 -74.012 91.472 47.868 132.998 -86.247 91.170 45.289 129.935 -78.812 91.968 42.254 143.003 -77.530 91.394 44.565 143.320-148.385 91.145 44.393 126.676 -75.371 91.796 40.905 113.867 -44.131 92.875 43.884 143.951 -74.417 90.936 45.827 127.700 -75.920 91.736 41.321 97.020 -67.668 92.076 43.885 149.898 122.401 91.382 42.453 127.926 -76.057 92.649 43.061 106.075 -83.078 91.720 43.347 125.441 140.400 91.399 43.693 112.112 -60.113 92.765 41.798 133.315-127.789 91.148 46.788 128.276 -75.995 91.914 43.694 128.209-151.275 92.177 45.945 149.588-129.656 93.629 35.236 120.564 -86.499 94.762 44.453 164.220-142.818 92.804 41.933 136.454-109.861 93.602 35.523 139.192 -22.692 96.264 37.933 0.000 0.000 94.634 39.075 121.375 -79.495 94.033 36.647 145.508-115.301 95.316 37.037 165.319-113.194 94.547 39.043 126.889 111.069 93.462 39.656 144.563-125.765 92.835 43.023 148.668 -26.254 91.209 44.202 131.391 -78.568 92.630 43.611 127.152-100.962 91.545 41.480 141.355 82.619 93.785 42.788 141.566 -75.922 92.896 41.276 133.083-105.384 93.801 50.745 124.520-116.752 92.945 64.055 141.689 -74.984 94.695 81.207 125.285-127.157 118.006 0.000 132.225-155.989 # 76 total E -6.80542E+02 rmsd from N 0.000 %NC 0.00 1 91.567 55.755 128.366 -72.582 132.625 -90.442 128.601 -98.205 115.691 -68.748 105.545 -69.165 92.066 82.734 130.978 -77.085 94.762 155.556 139.512-125.217 95.696 51.755 124.180 -87.868 125.124-168.628 143.025-108.185 137.727-153.803 145.640 12.743 93.805 37.873 111.350 -52.720 118.790-168.853 152.187 -36.851 135.978-137.228 142.887-105.543 119.809 146.792 157.849-109.569 101.468 -62.129 154.533-142.120 93.023 32.787 125.287 85.132 116.087 -78.753 104.608 -84.362 119.202-157.678 164.253 -60.091 133.680-126.473 161.088 144.405 115.045 26.413 128.876 122.146 112.164-159.622 167.044-117.212 133.294-154.308 138.405 -28.207 97.066 41.571 99.793-102.758 118.351 176.093 122.038-120.671 96.325 35.036 121.745-110.633 93.752 110.125 94.045 -21.003 91.063 -29.261 163.967 -91.604 94.471 -57.146 138.804 -73.915 92.775 14.346 109.562 -85.697 120.602-164.056 131.310 -93.759 138.887 -42.640 120.697 63.675 137.503-105.666 176.460 -56.405 125.011 -87.307 129.141-108.158 92.151 46.880 133.515 94.724 91.320 54.319 137.348 -80.822 90.752 48.378 121.827-120.426 91.744 45.349 176.433 157.054 91.542 41.285 143.131-141.871 91.702 42.821 118.614 -83.693 92.768 42.998 128.662 -79.528 91.033 46.885 128.892 -76.586 91.776 42.967 126.123-147.060 92.147 46.588 152.346-137.898 93.479 35.166 119.945 -85.673 94.674 44.882 0.000 0.000 92.732 42.031 135.581-108.544 93.582 35.587 139.178 -22.560 96.269 37.950 0.000 0.000 94.563 39.347 121.774 -80.090 93.932 36.960 145.411-114.597 95.112 37.601 165.629-113.388 94.334 39.689 127.007 109.904 93.416 39.290 144.019-131.304 92.813 43.371 150.973-112.417 91.210 43.860 131.909 -79.046 92.625 43.864 128.195-100.652 91.443 41.847 140.748 81.067 93.661 43.084 117.320 -92.404 92.909 41.162 132.984-107.762 93.894 50.761 124.159-118.190 93.023 64.029 141.560 -74.389 94.691 81.542 123.105-129.605 118.008 0.000 132.218-155.641 # 77 total E -6.72751E+02 rmsd from N 0.000 %NC 0.00 1 91.569 61.778 138.675 -79.332 122.251 -82.036 134.931 -86.667 116.751-100.349 137.600-146.660 91.431 47.913 131.360 -78.048 92.515 45.604 136.505 -72.684 93.668 40.608 163.084 -64.154 94.479 37.626 102.935 -69.712 96.038 34.096 128.328-114.985 94.457 38.634 120.310 48.214 92.481 50.095 142.787 -60.574 91.550 56.839 123.950 -86.131 92.244 43.055 130.340-123.866 93.664 123.861 109.228 -93.336 143.613-105.392 145.570 51.587 131.708-118.349 176.405 176.934 125.717-160.703 137.359 -94.995 112.324 -60.240 154.279-118.926 92.250 -24.055 103.615-116.517 95.152 90.972 167.044-117.212 126.154-122.767 134.754 -11.232 123.280-150.356 141.108 -90.569 131.226-138.439 139.016-102.654 129.536-137.678 168.546 -3.300 126.075 23.046 130.291 -89.468 91.675 112.202 133.149 -78.095 93.200 -21.299 162.109-137.327 93.137 -62.261 101.464 -73.420 91.645 7.496 129.113 -76.023 119.485-146.393 134.584 28.982 92.067 77.071 145.401 -69.870 90.767 51.911 128.039 -73.537 91.447 42.837 149.408 165.202 91.680 46.389 152.834 -17.920 91.179 43.081 125.884 -74.407 92.573 42.832 131.287-109.208 91.821 43.168 139.080-140.368 91.321 44.169 114.779 -64.592 92.605 41.884 126.700 -96.782 91.148 46.820 128.429 -76.129 91.961 43.577 126.613-146.867 92.160 46.105 151.106-134.036 93.557 35.325 120.223 -87.078 94.702 44.584 0.000 0.000 92.772 41.988 135.863-108.981 93.584 35.554 139.174 -22.696 96.264 37.920 0.000 0.000 94.632 39.087 121.774 -79.944 94.028 36.665 145.395-114.894 95.308 37.043 165.367-113.033 94.551 39.027 126.825 111.107 93.470 39.639 144.539-125.697 92.841 43.020 148.669 -26.257 91.210 44.199 131.407 -78.581 92.632 43.609 127.152-100.921 91.547 41.475 141.358 82.615 93.788 42.789 141.568 -75.927 92.896 41.278 133.110-105.415 93.802 50.743 124.525-116.737 92.949 64.061 141.674 -74.990 94.690 81.205 125.282-127.155 118.008 0.000 132.222-155.992 # 78 total E -6.52818E+02 rmsd from N 0.000 %NC 0.00 1 91.568 56.592 131.487 -79.429 127.707 -87.547 125.284 -87.408 117.030-100.853 139.838-149.927 91.370 53.720 133.835 -80.380 91.835 47.324 135.645-109.486 91.488 50.586 146.643 -77.277 91.462 44.408 135.226 -69.387 93.163 43.191 158.566-105.610 92.058 38.587 106.133 46.516 92.403 46.028 133.871-106.141 92.578 83.875 143.360 65.318 90.940 69.001 149.549-153.747 91.649 12.570 105.367-123.882 105.617 -86.240 151.724 49.023 122.067 156.918 128.943 89.784 94.349 87.801 141.759 -72.073 92.437 157.588 144.228-107.762 95.160 -52.507 100.236 108.879 94.271 12.230 0.000 0.000 124.881-101.740 106.795 86.688 130.099-118.550 144.350 14.245 128.682-167.767 111.531 -76.868 126.722 -12.696 139.633-109.250 118.315 -86.938 167.777-134.052 92.060 76.268 130.586 -77.062 123.182 -56.456 172.887 -49.508 94.576 147.191 136.983 -98.110 118.888-173.167 114.958-115.735 127.584-159.590 134.964 33.817 132.706-163.497 147.390-118.472 124.990-161.417 154.499 -83.377 130.473-167.727 124.971 -61.675 96.559 -28.806 115.009-142.180 92.306 -83.805 128.480 -76.134 92.703 60.331 152.197-110.266 93.807 63.266 130.516-151.751 92.067 174.602 124.113-138.991 135.109-168.495 153.988 87.561 126.134-161.985 162.896 -87.705 129.967-166.609 153.605 148.599 112.979-178.839 164.386-145.317 133.955 171.270 160.931 147.167 93.064 93.081 0.000 0.000 92.759 65.216 125.489-110.525 93.297 33.784 88.729 -84.247 96.329 42.333 0.000 0.000 94.257 40.341 125.288 -92.841 93.646 38.502 143.270-118.959 94.703 37.540 140.445-123.248 94.277 39.905 127.308 108.488 93.261 40.107 142.428-121.655 92.757 43.168 148.644 -26.408 91.191 44.261 131.746 -78.751 92.635 43.650 126.422-100.657 91.553 41.547 141.580 82.494 93.788 42.722 141.555 -75.940 92.906 41.327 133.382-106.221 93.799 50.759 124.486-116.571 92.942 64.184 141.715 -75.002 94.684 81.191 125.141-127.164 118.006 0.000 132.230-155.979 # 79 total E -7.00380E+02 rmsd from N 0.000 %NC 0.00 0 91.560 58.877 134.290 -79.143 122.243 -95.444 108.099 -98.331 115.342 -86.829 104.416 -82.979 91.400 84.114 131.574 -78.142 93.038 28.707 141.839 -76.743 111.435-129.704 124.834 -92.208 127.192-117.747 142.646-123.147 127.250 -32.923 69.105 -70.267 98.360-158.835 137.762 -88.865 120.880-179.664 169.923 -5.672 112.924-176.727 144.344 -77.288 125.988 -62.622 161.220 144.944 92.968 -19.995 105.451-160.241 95.397 97.223 164.396-123.999 120.882-161.118 142.777 -68.774 122.645-174.099 124.409 -97.154 128.347-165.966 152.132 161.276 114.131 -1.732 148.095 -70.123 94.409-175.695 151.550 -22.359 135.751 -90.728 139.997 -6.126 126.115 -10.325 128.009 -76.261 121.063-121.212 127.063 -94.893 92.917 75.456 170.495-119.159 91.202 67.762 134.797 -67.689 90.976 50.052 127.105 -74.805 92.995 68.395 134.770 -71.621 92.901 122.473 142.192-141.656 112.690-109.325 127.627-111.450 92.287 44.401 109.347 -53.282 92.942 48.952 143.619 -73.249 91.441 42.825 124.907 -75.152 91.955 43.039 135.056 131.560 91.689 44.243 146.314-137.297 91.300 43.658 126.794 -74.370 93.005 40.074 138.820-135.284 92.742 43.498 139.536-142.023 91.532 44.678 120.761 -82.697 91.795 56.692 122.522 -98.114 90.821 54.620 128.336 -75.591 93.510 78.287 129.753-153.060 92.558 -70.369 160.095 -2.231 94.363 -53.271 147.677 -97.534 94.226 159.742 0.000 0.000 92.117 53.988 114.341 -78.113 94.106 36.586 82.300 -83.580 98.909 27.592 0.000 0.000 98.354 33.171 124.254 -87.982 96.984 27.960 88.396 -44.490 97.763 37.927 162.356 57.532 95.092 35.195 112.969 143.355 94.558 36.278 153.460-116.850 93.259 42.802 149.976 -22.940 90.959 49.189 131.435 -77.908 91.387 43.899 125.594-105.597 91.151 40.455 140.769 79.948 93.591 44.588 111.535 -75.877 92.713 40.343 133.709-105.817 93.984 49.659 122.549-116.304 93.121 64.238 142.120 -74.607 94.683 81.037 125.106-124.931 118.010 0.000 132.050-156.344 # 80 total E -7.37444E+02 rmsd from N 0.000 %NC 0.00 1 91.567 60.841 136.081 -75.839 123.937 -83.174 132.928 -91.398 116.885-130.244 101.589 -71.229 128.760-127.674 138.380 -93.636 126.461-161.970 144.347 -92.061 131.289-137.255 149.787 0.778 121.476-165.688 125.185 -97.647 128.390-171.767 158.503 22.382 92.403 42.091 144.880 -72.116 110.530-165.231 136.142 -66.437 118.844-131.849 139.283 -93.187 126.383-166.430 166.631-161.206 103.775 -61.492 128.902-113.286 97.448 -20.844 0.000 0.000 93.502 87.893 120.998 90.689 125.037-125.023 166.510 -70.768 126.398-174.228 161.312-144.773 130.178 -88.782 148.003-105.152 127.626 -10.652 0.000 0.000 120.139-164.284 126.458 29.973 136.678-157.030 145.208 -55.408 106.720-168.720 131.775 -75.573 136.280-131.348 135.938-120.995 117.706 -95.861 155.867 111.304 91.539 47.959 130.697 -78.223 92.496 38.925 144.344 -78.186 91.373 54.860 137.651-142.328 90.786 48.133 124.839 -75.450 91.963 36.796 108.766 -53.194 95.598 37.253 143.639 -74.718 92.109 44.123 129.852 -75.762 91.924 44.055 147.522 170.270 91.673 41.715 146.063 -40.446 91.010 43.767 128.864 -77.351 92.177 46.557 117.999 -37.154 91.927 46.250 135.452-113.788 92.326 36.924 117.810 -77.839 94.811 40.328 104.381 -59.458 91.632 55.767 132.174 -79.719 92.374 58.783 123.154-166.566 92.500 80.740 158.706 -13.280 115.267 -94.389 137.818-126.997 138.085 -56.816 0.000 0.000 92.787 50.311 138.923-108.812 92.694 34.508 90.595 -83.651 95.362 43.740 0.000 0.000 93.061 42.046 126.801 -94.554 92.723 38.264 143.571-118.177 93.036 43.405 144.907 -75.176 92.696 44.077 130.630 110.604 92.066 41.091 139.423-103.096 92.304 42.287 148.164 -25.751 91.054 48.938 133.268 -78.444 92.621 40.908 125.714-105.693 92.474 39.641 139.640 89.729 94.924 41.332 143.672 -75.878 93.326 40.738 120.667 -68.926 93.893 51.980 130.873-124.578 92.928 70.495 140.548 -74.222 94.775 101.263 133.046-146.783 117.476 0.000 131.868-116.955 # 81 total E -6.73136E+02 rmsd from N 0.000 %NC 0.00 1 91.567 57.176 131.541 -73.369 129.863 -69.478 139.612 -98.414 117.457-156.132 101.884 -78.606 122.675-152.456 162.303 -93.932 128.745-172.252 144.159 -91.291 95.665 -21.857 168.317 -46.532 95.706 -87.604 135.350-132.092 93.307 56.389 146.393-108.152 93.295 68.248 96.734 -92.391 93.078-176.443 142.265-141.467 125.564-163.866 167.701 -37.978 126.262-159.316 164.238-154.473 107.123 -68.273 149.311 42.881 96.607 -18.199 0.000 0.000 93.053 90.168 109.527 85.941 122.348-136.444 128.966 -79.120 123.068-115.190 149.748 179.145 127.482 -74.699 152.477 122.437 122.437 -11.433 158.735 163.941 127.391-147.325 141.107 -41.128 115.895-171.212 171.662-120.259 94.901 93.611 144.415 -75.974 93.465 -5.214 102.338 -85.328 94.717 -82.645 120.750 -86.544 92.812-178.257 131.087 -77.171 127.024-168.948 167.322-103.151 122.854 -82.743 151.050 -18.401 91.520 53.435 130.183 -76.474 91.465 36.074 112.012 -48.514 91.993 55.746 140.305 -98.048 90.311 52.644 126.026 -75.684 91.510 36.613 110.948 -87.223 92.157 43.401 141.476-132.046 91.089 50.570 129.187 -79.250 91.724 42.109 145.512-125.902 92.322 39.630 128.658-122.282 92.292 40.998 119.087 -88.904 93.191 42.770 118.825 -93.446 91.077 46.355 129.996 -78.063 91.869 42.076 125.162-146.613 92.156 47.417 151.370-144.833 93.338 34.728 121.352 -88.655 94.547 47.450 153.032-115.937 92.807 41.628 134.785-107.597 93.550 35.997 113.606 -63.117 96.348 36.986 0.000 0.000 94.807 39.016 121.842 -80.374 94.192 36.433 145.707-113.225 95.119 37.378 144.603 -75.017 94.583 38.766 126.013 111.946 93.554 39.387 144.435-126.131 92.920 42.839 151.352 -28.057 91.197 44.539 131.706 -78.808 92.424 44.625 128.341-100.836 91.333 41.842 140.878 81.974 93.646 43.091 115.994 -83.037 92.954 40.967 132.852-108.595 93.952 50.425 124.085-118.155 93.047 64.093 141.772 -74.505 94.688 81.523 123.595-128.049 118.017 0.000 132.086-155.771 # 82 total E -6.97552E+02 rmsd from N 0.000 %NC 0.00 1 91.570 62.188 140.005 -80.115 124.721 -73.812 134.865 -84.337 114.689-143.332 143.060-158.700 91.531 55.058 131.296 -77.360 93.020 40.335 145.346 -79.724 94.627 42.414 162.702 -72.293 93.916 48.414 116.323 -93.104 93.105 45.916 124.135 -91.724 92.243 55.620 121.303 -57.344 92.703 -63.873 145.886 127.919 127.447-154.425 165.962 -61.271 117.520 158.465 148.167 -94.768 98.318 -55.900 146.577-107.018 92.908 23.324 0.000 0.000 119.380 -71.812 125.376 85.125 136.976-165.821 133.450 -58.441 129.536 146.562 161.703-174.289 115.304 -89.023 77.411 90.860 95.953 12.759 0.000 0.000 94.119 71.225 126.459 -15.433 95.522 154.930 152.675 36.973 93.892 177.419 137.903 -99.608 92.512 71.528 165.341-155.381 91.410 45.663 125.930 -67.618 91.195 55.669 130.497 -77.619 92.426 79.942 148.270 -80.109 92.697 120.674 94.051 -75.520 112.720-105.645 131.869-107.982 92.564 43.376 112.170 -48.855 92.910 46.937 143.125 -74.285 90.960 49.505 129.257 -80.996 90.784 43.960 150.270 128.796 90.918 44.052 142.447 -59.399 90.937 47.709 128.481 -76.540 92.290 41.217 146.520 -43.150 91.693 53.274 145.142-145.366 91.155 68.906 125.831 -78.302 91.627 93.102 99.533 -65.048 91.166 44.846 128.484 -75.770 94.368 91.390 129.853-150.712 92.642 -58.755 153.336-157.519 94.221 -58.203 142.018 -98.309 94.320 166.889 0.000 0.000 91.632 53.754 139.298-113.465 93.589 31.171 85.199 -80.029 97.546 34.190 0.000 0.000 97.031 33.768 123.255 -91.733 95.690 31.695 96.439 -28.788 97.452 33.266 169.294 -13.741 96.692 33.257 115.690 116.771 95.951 33.148 149.648-139.204 94.519 40.281 155.700 -19.741 91.422 45.382 130.705 -77.466 92.507 43.267 138.681 -73.789 91.608 38.628 137.084 84.346 93.797 44.631 108.329 -70.281 93.105 39.151 140.359-112.659 94.134 56.626 129.700-115.954 92.699 71.165 142.108 -74.358 94.593 87.172 121.193-136.176 117.706 0.000 135.043-142.151 # 83 total E -6.50246E+02 rmsd from N 0.000 %NC 0.00 1 126.109-131.445 147.908 -80.378 125.912 -75.277 120.803 -83.024 114.832-153.079 121.893-125.768 138.180-166.657 156.162 -96.812 122.504-151.675 160.522 74.187 96.072 40.306 139.217 -77.505 119.835-177.717 134.624-108.104 142.053-137.826 142.790 2.654 114.683-115.177 118.990 -50.145 116.159-178.107 135.804 103.016 93.184 70.180 109.527 -99.068 119.754 137.459 153.366-137.881 85.904 -54.911 135.128 -97.797 94.994 -32.454 153.357-137.902 93.758 85.921 152.029-102.729 128.546 -83.467 142.056 -89.471 123.395-163.270 156.302-120.108 132.545 -88.035 144.474-101.531 128.547 -38.791 156.391-120.170 127.920-156.111 137.754 23.408 127.852-138.776 131.364 -43.843 96.612 34.730 104.864 -58.187 127.339-172.512 171.116-109.509 125.890-167.053 145.484 -39.862 121.604-165.664 176.410 -83.960 112.802 95.141 127.893-137.638 93.700 -8.982 161.189 -4.927 92.394 -78.268 128.749 -76.799 112.097-172.567 151.665 6.705 124.399-170.397 168.007-102.249 133.280-154.820 132.305-119.218 125.374-162.705 150.885 161.664 95.917 -22.846 121.483-128.272 91.399 -85.012 129.310 -76.642 92.529 57.895 126.542 -41.210 94.752 67.431 137.804-147.759 92.385-175.317 124.563-152.622 130.997-168.473 154.015-177.326 127.156-165.668 164.315 -84.446 126.697-164.879 142.303 178.867 119.773-179.538 154.820 16.987 107.637 -60.145 159.738-141.814 103.350 -22.724 0.000 0.000 93.752 91.888 126.494 -96.068 116.853-147.114 150.285-161.722 132.346-165.395 168.407-131.814 123.060-162.943 165.653 -83.973 128.399-162.023 158.824-172.479 125.763-169.551 168.052 -42.718 133.477-131.228 130.255-125.013 124.942-165.727 107.856 -87.930 115.824 -65.105 145.833 2.000 91.966 -19.901 129.612 -76.374 96.393 87.899 162.856 -58.992 127.732-131.747 169.308-101.377 126.216-160.019 156.170 30.468 126.015-146.529 144.522 117.683 130.922-164.886 129.118 -69.731 117.819-179.006 166.395 -49.379 95.329 70.320 124.603-139.515 117.506 0.000 136.707-150.070 # 84 total E -6.70776E+02 rmsd from N 0.000 %NC 0.00 1 91.567 60.838 136.086 -75.818 123.963 -82.933 132.970 -91.442 116.882-130.827 101.433 -71.351 128.755-124.694 139.134 -94.459 127.154-161.617 144.839 -88.084 129.538-136.926 155.686 -14.753 125.541-164.255 124.845 -72.825 130.993-130.885 170.372 13.744 123.659-166.410 137.839 -89.489 92.845 9.815 147.039-119.323 132.848-139.189 176.443 -56.482 121.964-166.037 138.963 -99.032 107.042 -63.005 131.473-126.392 97.622 -19.209 0.000 0.000 93.430 86.660 140.943 -91.985 128.031-123.293 147.060 -98.725 127.790-154.434 145.841 -92.400 115.188 0.385 162.692-119.494 111.521-139.912 0.000 0.000 131.305-157.642 150.226 3.681 123.728-139.958 142.342-111.583 122.046-170.619 163.276 -56.594 134.358-128.454 140.817-119.322 117.465 -99.354 153.129 109.529 91.726 43.100 130.650 -78.282 92.531 42.913 143.775 -77.908 91.337 72.103 137.830-143.072 90.968 48.773 125.406 -76.120 92.008 34.975 111.399 -48.912 94.707 44.736 143.460 -74.821 91.607 48.800 127.566 -75.884 91.841 40.583 157.869 179.122 91.893 68.587 90.668 -19.988 92.019 -9.189 132.375 -80.453 126.900-155.954 115.220 -71.169 107.696 -40.296 161.917 152.023 130.940-136.409 124.441-112.826 126.425-125.572 144.551-127.562 121.321 -67.382 142.216 -79.453 93.203 -48.535 107.245 -98.017 92.615 83.761 152.272-135.364 119.463 -11.784 114.631 -92.337 138.768-114.549 155.041-136.808 125.090-135.224 133.033-101.567 93.499 -15.889 136.659 -4.373 125.475-163.754 172.439 -21.201 123.588-155.527 119.806 -70.262 119.441 -17.130 140.574 174.549 118.118-114.912 164.301-134.810 93.294 48.996 121.834 102.751 92.302 40.926 144.321-120.984 92.894 45.427 161.497 -8.146 91.278 43.263 138.080-131.501 92.671 46.813 120.294-101.887 92.428 37.348 143.997 95.949 94.984 41.606 142.623 -61.305 93.706 38.583 132.802-122.974 94.779 44.301 127.035-105.955 93.476 58.054 142.133 -73.568 95.040 75.171 122.929-100.659 118.073 0.000 131.267-163.353 # 85 total E -6.77675E+02 rmsd from N 0.000 %NC 0.00 1 91.559 68.231 137.501 -50.195 125.266-173.305 163.713 -74.566 94.301 48.493 101.261 -72.769 92.621 162.725 176.407 -87.580 92.741 8.137 142.377 -77.443 109.716-138.655 113.021 -62.712 119.486-158.070 132.124-145.538 123.747 -11.441 168.161 154.763 94.285-164.299 112.989 -41.556 121.704-161.873 175.014 -9.734 122.959-169.008 147.505 -85.901 120.078 -61.315 157.589-111.952 92.648 -22.885 127.401-120.440 95.250 95.592 164.396-123.999 121.957-145.972 159.893 -76.427 127.742-163.552 172.443 -63.695 122.618-160.405 162.853 156.909 121.172 -3.647 131.884-116.546 95.185-172.946 151.550 -22.359 129.669-123.375 145.234 8.699 126.937 -12.327 111.354 -79.063 130.283-166.553 108.726 -73.839 126.682-147.687 162.979 147.353 117.466 -41.235 167.004 -19.080 91.526 2.194 130.324 -76.722 134.827 -92.082 126.783 -75.060 92.097 90.111 97.794 -80.527 90.947 52.340 128.533 -76.638 91.734 41.033 106.348 -43.827 93.256 48.036 172.510 -75.371 91.022 43.028 125.851 -75.700 91.965 41.519 133.615 -81.112 92.025 45.119 142.609 -39.589 91.181 43.253 129.117 -76.161 92.782 40.967 134.196-106.686 92.316 42.914 138.389-141.710 91.552 43.343 111.630 -59.522 92.720 42.094 124.508 -95.929 91.130 46.743 128.507 -76.204 91.905 43.825 126.426-147.105 92.171 45.677 160.346 -23.303 93.561 36.032 119.754 -86.966 94.680 44.223 0.000 0.000 93.144 40.017 112.391 -82.867 94.649 33.285 137.697 -17.340 97.896 32.314 0.000 0.000 96.723 35.425 136.178 -89.687 95.607 31.617 106.185 -52.135 97.350 33.830 167.129 -44.760 96.226 34.758 120.318 112.163 95.156 35.603 147.025-145.510 94.231 40.551 151.733 -26.604 91.576 43.424 130.539 -78.169 92.776 44.396 141.135 -76.427 91.289 41.719 138.416 84.588 93.575 43.260 113.417 -80.495 93.008 40.662 133.506-109.030 93.998 50.648 129.247-116.189 93.028 64.015 141.735 -74.444 94.690 81.694 123.351-127.323 118.032 0.000 131.896-155.789 # 86 total E -6.85380E+02 rmsd from N 0.000 %NC 0.00 1 91.569 60.506 136.801 -75.627 131.414 -69.862 138.378 -91.655 117.589-149.384 100.281 -78.023 120.874-154.492 176.446 -93.948 95.186 45.297 142.661 -77.488 133.127 179.783 140.820 -80.948 124.837-172.176 163.681 -20.422 109.119 23.021 124.090-146.631 112.078-163.169 125.585 49.857 122.161-160.927 167.151 -21.696 122.261-168.060 145.729 -87.240 118.480 -61.649 163.133-123.250 92.539 -22.431 124.776-128.860 95.225 95.706 0.000 0.000 123.001-142.496 155.222 -71.184 126.352-163.838 132.846-114.678 129.407-142.722 166.396 132.666 115.637 13.019 111.538-120.346 122.076-162.922 118.346 62.818 121.913-164.039 135.101 -4.265 97.329 33.032 94.327 -84.342 124.871-173.609 164.792 -55.949 130.212-162.522 134.647-121.457 116.106 -72.576 157.429 65.378 92.041 -15.051 130.372 -77.197 95.276 88.963 142.580 -76.696 125.622-145.977 157.048 -9.046 131.225-147.264 123.757-121.622 91.590 52.611 116.686 -20.496 92.136 53.352 149.013 -78.883 90.861 45.067 126.531 -74.290 91.648 41.073 118.248 -82.291 91.448 47.808 140.253 -41.418 90.915 43.992 126.506 -76.420 92.488 41.636 141.602 -91.354 92.179 42.758 138.536-141.280 91.557 43.762 112.871 -61.316 92.673 41.938 124.978-103.443 91.143 46.802 128.480 -76.182 91.931 43.636 126.769-147.624 92.150 46.106 150.487-132.756 93.550 35.379 120.313 -86.941 94.701 44.610 164.220-142.818 92.762 42.102 136.224-108.905 93.575 35.538 139.245 -28.691 96.187 38.262 0.000 0.000 94.404 40.248 121.962 -80.271 93.952 36.556 145.899-114.653 94.898 37.968 145.430 -74.037 94.419 39.026 126.569 111.983 93.437 39.785 143.936-125.412 92.856 42.906 148.902 -25.620 91.229 44.183 131.514 -78.655 92.644 43.613 127.100-101.508 91.547 41.469 141.338 82.592 93.782 42.809 141.602 -75.923 92.895 41.270 133.047-105.414 93.802 50.748 124.496-116.813 92.950 64.048 141.688 -74.987 94.691 81.215 125.285-127.146 118.007 0.000 132.220-155.985 # 87 total E -6.54985E+02 rmsd from N 0.000 %NC 0.00 1 91.554 42.301 127.372-107.872 95.192-175.829 126.135 -87.871 93.147 92.591 139.051-162.134 91.891 0.786 130.610 -77.132 122.548-135.426 167.504 -26.973 126.726 -71.473 129.060 -93.360 93.534 147.786 99.948 -81.098 94.373 70.081 133.094-117.699 92.861 69.279 101.986 56.508 92.921 -52.719 130.809-122.349 113.051-152.741 128.731 -85.619 127.323-166.242 135.086-100.371 114.114 175.998 106.197 -96.234 132.745 162.855 0.000 0.000 92.831 80.126 126.955 89.443 94.514 127.473 94.991 -79.182 92.085 154.077 126.847 -92.703 96.174 -54.987 104.783 109.013 93.759 21.833 0.000 0.000 123.039 -84.085 140.578 -9.585 124.500-155.481 150.309 -33.317 93.186 69.284 141.030 -75.491 93.763 97.986 138.962 -72.443 93.072 51.536 167.135 170.851 92.842-151.705 131.956 -79.335 93.590 72.190 138.109 -78.419 93.470 115.138 138.854-142.325 117.153-111.109 129.350-107.631 92.450 47.462 113.344 -51.111 93.031 46.269 96.614 -52.176 91.455 47.312 127.601 -77.760 92.600 39.899 127.229 105.407 93.297 38.378 145.940 -62.076 91.569 46.562 130.181 -77.899 92.272 49.491 122.975 152.423 91.669 41.282 150.873 111.268 91.775 39.736 110.056 -68.785 92.784 51.373 136.574 -29.734 90.688 56.447 128.243 -76.543 91.710 44.538 127.831-137.257 92.746 50.242 150.189-112.848 107.501 -86.473 118.526 -86.528 112.640-173.977 0.000 0.000 116.947 128.585 130.627 -90.340 94.738 -97.856 101.983 -81.736 94.466 56.234 0.000 0.000 94.621 47.142 122.948 -88.679 95.615 26.036 104.571 115.825 98.217 37.427 175.194 -69.638 95.799 34.221 124.800 119.456 95.603 35.349 149.134-148.825 95.007 37.542 145.672 -13.709 92.081 42.232 130.559 -77.117 93.380 44.547 144.972 -75.791 91.791 40.786 138.806 -67.974 95.095 38.190 106.997 -73.005 94.777 35.912 121.622 -71.984 95.334 49.518 132.627-130.766 93.501 60.076 142.265 -77.960 94.795 83.498 130.844-126.385 118.036 0.000 132.022-155.069 # 88 total E -6.93238E+02 rmsd from N 0.000 %NC 0.00 1 91.570 62.850 138.757 -79.736 126.267-112.200 117.381 -88.977 93.120 60.274 97.969 -76.656 119.355-122.673 137.073 -75.831 119.606-160.759 134.035 165.355 99.011 21.305 113.284-117.190 136.208-164.214 144.964-110.941 140.169-165.482 139.692 22.857 94.844 19.361 116.786 -46.639 115.196-147.265 159.293 -21.512 122.227-158.429 155.224 -83.924 117.085 152.392 154.773-152.612 98.054 -62.339 114.010 -90.760 92.490 37.383 145.570 51.587 115.244 -88.846 107.997 -81.905 129.284-164.483 148.623 -75.841 131.763-128.941 149.701 135.241 121.498 11.054 150.227 120.703 111.815-162.031 167.044-117.212 132.879-173.287 140.129 -19.998 96.287 38.428 123.571 -87.266 128.636-175.335 124.904 -60.381 127.570-166.999 138.772-130.408 92.752 2.210 132.201 79.460 129.738-133.080 132.530-119.521 132.425-165.079 118.560 -52.087 94.135 2.623 137.061 163.971 123.866-144.404 131.944-107.705 131.039-151.991 103.288 -81.835 105.364 -38.200 171.327 -74.158 91.614 -80.086 129.389 -76.089 91.499 74.238 111.139 -26.378 93.451 47.294 127.658-106.375 129.445-151.958 152.046 -82.787 126.937-157.731 123.621 133.344 93.558 5.118 117.641-125.289 115.023-167.584 126.195-114.154 129.186-145.554 101.225 -47.679 129.640-158.814 137.625-121.988 94.270 85.182 138.156 99.747 117.742-101.292 159.272-132.990 94.128 132.110 145.050-105.538 94.588 136.982 0.000 0.000 93.387 59.968 148.394-124.358 93.759 42.179 97.449 -79.518 96.942 106.139 0.000 0.000 121.294-128.937 135.746 -78.289 93.981 39.555 157.437 111.965 94.415 45.647 161.999 13.831 92.837 42.569 114.603 157.853 92.753 37.799 137.479-106.470 92.676 43.884 148.657 -24.712 91.172 45.295 129.125 -78.120 92.210 44.135 123.744-112.476 91.312 40.325 140.805 82.016 93.843 43.903 141.631 -76.165 92.818 40.338 130.698-102.423 93.888 51.446 124.010-117.428 92.945 64.052 141.646 -74.965 94.693 81.260 125.887-127.935 117.998 0.000 132.346-155.798 # 89 total E -6.51273E+02 rmsd from N 0.000 %NC 0.00 1 91.561 66.633 135.593 -51.534 128.591-165.935 130.158 -85.020 93.755 62.984 122.078-104.397 92.579 160.952 158.472 -80.376 93.205 34.017 141.978 -77.917 94.514-177.099 124.638 -97.522 142.842 -63.217 116.219 -80.384 127.480-163.516 164.904 6.019 93.979 175.474 122.305 51.607 92.159 47.492 120.986-113.776 108.850 146.005 138.481 -74.230 95.174 -39.716 149.621 141.191 92.387 -48.403 134.657-109.383 93.766 90.405 151.724 49.023 126.799-100.156 110.218 -86.990 127.811-165.252 167.767 -36.955 121.835-170.297 141.442 127.287 94.247 80.475 105.560-122.311 98.090 117.475 0.000 0.000 131.515 -79.100 136.971 -33.502 129.833 -26.459 125.875 -75.311 125.451-163.925 104.414 -71.851 132.130-110.303 159.149 64.196 132.371 -32.785 154.885 61.134 91.929 -5.365 130.773 -77.108 124.407-138.539 136.640 -69.907 92.441 57.657 87.631 -75.175 91.552 46.172 127.342 -75.146 94.078 31.609 122.772 -52.081 96.189 42.864 132.381 -36.530 92.040 42.510 127.813 -77.544 92.793 38.816 144.581 155.803 92.516 43.298 149.010-139.631 91.578 43.259 127.425 -75.405 93.348 41.399 130.098 -46.745 93.100 38.820 146.876-151.027 91.815 47.154 129.655 53.150 93.144 44.001 104.758 -44.641 91.217 75.039 129.010 -76.787 93.857 19.314 128.547-150.924 95.461-105.897 143.326-105.221 93.170 152.621 145.236-106.766 95.241 128.829 0.000 0.000 92.769 63.415 135.021 -91.760 92.884 67.393 87.675 -86.162 95.222 115.756 0.000 0.000 113.526-164.538 164.810-146.863 131.267-168.984 163.552 27.587 123.882-171.341 160.693 -58.127 135.443-167.123 151.756 179.239 118.095-168.196 155.759-118.145 118.337 -69.587 150.029 2.027 92.128 -16.063 129.560 -76.304 96.054 91.097 142.008 -73.068 125.034-149.603 174.723-125.508 127.798-169.643 132.992 -86.893 130.393-167.799 158.044 -13.355 123.091-166.793 115.078 -60.110 117.719 171.205 165.996-134.997 95.120 64.512 130.722-134.411 117.426 0.000 138.891-165.623 # 90 total E -6.49402E+02 rmsd from N 0.000 %NC 0.00 1 91.564 46.767 133.793 -99.613 95.303 169.812 121.314 -63.547 93.452 85.402 112.925-108.443 91.805 -6.169 129.959 -75.099 106.247 -85.399 144.161-130.022 129.893-175.483 133.587 -84.848 123.117-150.789 167.825 3.792 132.540-166.916 157.735 22.589 120.920-166.971 113.618-102.739 92.798 0.408 142.955 159.174 132.132-144.384 176.425 -77.958 121.717-163.056 173.259-152.309 107.473 -64.722 126.408-128.087 96.471 -17.883 119.878 -98.682 92.863 92.218 117.225 92.010 123.968-138.019 161.043 -7.908 126.159-159.075 176.457-160.017 116.172 8.801 151.322-120.239 94.272-173.166 118.346 62.818 119.566-168.181 126.231 23.043 126.857-167.680 144.129-122.157 120.648 -83.909 140.942 -65.730 93.994 0.888 108.715-134.328 94.590 78.678 148.977-126.552 135.373-158.861 173.281 -84.569 129.572-164.285 144.108-101.159 122.270-161.097 146.583 22.939 91.880 9.455 129.540 -76.225 118.224-166.305 144.046 27.330 127.380-163.766 171.667 -5.351 128.927 -95.215 141.074 -81.691 91.810 44.210 132.697 -97.148 91.439 47.746 134.511-131.071 91.170 43.500 126.511 -74.619 92.525 41.401 110.681 -93.481 92.134 40.751 135.904-142.953 91.510 43.552 119.859 -80.913 92.571 41.081 127.648 -47.808 91.175 47.364 129.332 -77.079 91.673 45.934 125.961-153.288 91.559 48.530 152.547-143.062 92.721 37.401 114.826 -76.310 94.522 47.588 0.000 0.000 93.061 43.529 121.279 -96.650 94.173 38.360 140.292 -15.918 95.583 72.733 0.000 0.000 118.377-156.031 163.620-149.433 124.781-160.064 164.579 33.512 125.169-165.419 159.522 -1.384 133.557-147.218 143.105 152.874 121.620-167.928 118.454 -87.153 117.357 -66.712 148.300 3.129 92.038 -18.526 129.622 -76.385 96.495 89.017 163.260 -58.791 126.941-138.365 164.596 -54.581 125.727-162.454 155.692 33.275 129.265-149.923 130.239 113.720 128.423-163.918 127.103 -66.548 120.250-178.032 167.589 -75.481 95.269 67.644 124.226-140.634 117.398 0.000 138.741-156.276 # 91 total E -6.59273E+02 rmsd from N 0.000 %NC 0.00 1 91.574 61.007 135.781 -75.349 124.089 -88.495 129.991 -87.981 115.619 -63.149 120.538-121.078 91.464 82.628 131.307 -76.608 117.848-142.010 127.404 -88.714 125.249-162.873 124.040 -39.672 108.065-179.680 123.958-119.458 138.956-110.141 147.554 -13.428 120.294-151.502 105.396-106.968 93.648 1.560 150.824 149.198 131.833-133.345 170.513 -61.110 121.051-162.774 160.104-126.522 108.641 -64.509 136.990-127.760 97.584 -16.809 0.000 0.000 93.553 84.643 140.411 -90.193 129.154-129.092 147.880 -86.581 127.441-150.009 159.498-154.008 117.364 -4.454 159.311-121.231 120.044-119.564 167.044-117.212 125.305-163.013 138.006 14.103 126.815-145.013 121.093 -57.960 117.896-173.355 131.881-111.740 131.727-139.439 154.867 133.665 95.886 -26.800 147.805 109.480 123.060-167.589 155.120 -96.667 123.243-150.218 132.144 -90.403 93.335 -15.919 140.294-177.734 123.737-163.514 147.673 -84.552 127.852-163.722 108.783 -88.136 112.291 -43.918 158.754 -59.480 92.659 -78.350 134.157 -75.474 91.830 73.611 136.220 6.051 92.678 50.918 126.258-144.084 114.532 174.070 176.365 -86.765 117.928-162.397 145.955 111.948 94.214 -17.372 122.834 59.618 129.782-155.322 154.152 -76.879 121.516-168.551 169.591-177.760 91.966 46.420 133.309 -79.267 95.843 84.504 126.924-167.428 92.044 -65.578 164.397-179.063 93.244 -51.398 139.651 -99.803 94.469 177.816 0.000 0.000 91.222 72.879 146.024 -95.388 91.928 34.313 90.986 -84.076 95.257 44.081 0.000 0.000 93.276 42.448 124.910 -90.154 92.878 40.027 141.185 -82.726 94.537 37.914 168.311 -71.245 94.437 39.934 124.854 103.355 93.916 36.709 143.421-136.275 93.720 42.044 152.597-128.167 91.492 42.875 131.606 -79.073 92.972 43.908 141.029 -76.788 91.419 41.739 138.210 83.768 93.611 43.165 114.888 -89.981 92.977 40.941 133.806-109.791 93.924 50.994 129.285-116.285 93.003 64.038 141.472 -74.284 94.691 81.731 122.578-128.897 118.022 0.000 131.989-155.602 # 92 total E -6.66904E+02 rmsd from N 0.000 %NC 0.00 1 126.128-129.940 148.492 -79.075 125.948 -80.293 134.194 -92.681 116.808-138.028 101.873 -79.924 127.363-162.278 143.631 -94.141 122.470-178.552 134.894 -84.088 94.426 70.746 143.664 -73.784 94.855 98.619 139.698 -73.448 137.415 -87.021 146.313 18.221 131.728-151.443 74.373 -78.165 92.539 22.858 155.273-151.616 126.391-148.060 174.636 -54.213 121.448-164.615 171.089-176.465 104.326 -65.609 164.492 -33.211 97.531 -17.195 139.049-111.457 93.419 90.788 113.342 71.768 121.584-137.380 142.879 -87.674 126.814-154.273 162.206-161.014 121.187 -2.865 156.774-134.555 118.116-115.265 0.000 0.000 125.584-120.313 142.285 8.978 93.510 44.945 118.433-101.500 92.593 44.335 108.949-119.858 93.870 40.109 110.495-113.855 92.476 43.579 164.726-176.489 91.328 43.532 130.329 -78.074 92.408 41.943 143.760 -78.132 91.782 44.016 142.009-149.194 91.320 43.224 126.981 -75.558 91.945 41.433 111.680 -48.693 93.104 43.256 143.678 -74.603 91.240 44.148 128.058 -76.186 91.868 42.326 147.373 147.419 91.682 44.549 143.954 -56.646 91.014 45.008 127.708 -75.802 92.507 41.478 137.638-115.123 92.030 45.357 140.134-143.183 91.479 42.912 120.134 -73.412 92.201 49.515 111.827 -61.764 91.077 47.332 129.252 -76.299 93.961 82.202 126.863-146.589 92.366 -66.257 154.682 178.853 94.604 -55.263 143.321-103.334 94.641 174.820 0.000 0.000 91.841 53.490 134.531-100.783 93.197 33.726 85.821 -84.820 97.016 38.402 0.000 0.000 95.038 37.557 122.059 -91.907 94.362 37.247 147.779-108.966 95.132 36.818 144.657 -76.012 94.684 38.828 125.748 111.877 93.611 39.176 144.789-126.536 92.966 42.880 151.312 -28.112 91.200 44.484 131.815 -78.878 92.440 44.611 128.420-100.333 91.340 41.824 140.883 82.018 93.652 43.067 115.889 -82.907 92.958 40.987 133.014-108.859 93.952 50.400 124.172-118.062 93.046 64.117 141.777 -74.504 94.686 81.519 123.576-127.965 118.018 0.000 132.080-155.782 # 93 total E -6.62711E+02 rmsd from N 0.000 %NC 0.00 0 91.566 60.860 135.587 -73.221 125.309 -78.388 133.473 -85.673 116.893-101.053 136.726-145.478 91.505 51.066 131.553 -77.884 92.660 44.666 137.900 -72.728 93.774 39.517 163.862 -56.743 93.412 44.121 141.970 -78.112 93.644 41.426 133.210-105.671 92.053 44.414 121.567 -76.826 91.618 83.920 139.875-155.228 93.214 98.833 139.716 -72.790 102.826-177.727 134.660-112.540 122.738 159.374 148.548 115.693 125.577 31.682 151.724 49.023 131.110-108.164 164.621 -90.145 129.270-160.899 149.458 -91.306 111.333 -57.535 145.826-106.504 92.466 -26.104 104.930 121.713 95.102 90.989 0.000 0.000 126.200-116.680 146.075 -5.973 125.547-133.881 119.304 -85.726 127.076-113.752 172.253-110.214 129.747-161.839 134.383-138.034 92.177 56.857 135.148 -61.591 91.323 84.868 130.334 -78.502 92.812 60.686 143.724 -77.694 93.522 87.438 147.444 -25.251 118.927-128.664 126.889-102.351 92.040 50.465 111.895 -49.347 92.400 50.237 143.026 -74.604 90.737 50.280 129.147 -76.120 91.058 40.407 151.860 134.749 91.316 43.648 142.272 -64.431 90.859 47.911 124.955 -74.160 92.053 43.403 141.829 -41.543 92.013 40.434 144.187-141.836 91.773 42.448 120.428 -88.688 92.839 44.867 106.547 -49.633 91.343 46.018 126.257 -76.119 93.378 41.399 126.347-146.404 93.194 47.670 153.016-128.978 109.657 -91.739 147.534-121.531 122.159-172.008 164.220-142.818 123.994-169.446 172.593 -28.765 94.061 -64.243 91.145 -81.807 94.463 32.246 0.000 0.000 125.894-160.957 176.067 -83.788 124.693-164.587 154.178 55.613 126.022-169.485 151.060 47.735 130.784-145.060 165.084 12.646 121.283-165.886 157.399-142.456 117.452 -66.346 147.456 6.116 92.018 -18.718 129.609 -76.426 96.273 90.035 162.907 -60.460 127.498-138.269 166.623 -95.541 125.274-163.761 161.865 -37.208 126.457-154.662 148.871 -43.523 131.875-162.550 145.252 -59.125 111.836 176.860 163.138-112.763 95.539 64.772 125.899-132.660 117.743 0.000 134.555-168.096 # 94 total E -6.97041E+02 rmsd from N 0.000 %NC 0.00 1 91.567 57.552 131.923 -76.377 124.768 -84.622 128.590 -89.066 117.026 -96.754 129.673-133.460 91.362 54.245 131.750 -77.789 92.541 47.352 139.132 -73.595 93.413 51.050 167.871 -22.897 92.358 70.914 111.327 -36.149 92.899 49.583 66.120 -69.956 115.650 164.779 117.442 -64.829 92.726 42.678 138.019 -48.457 122.709-159.867 172.587 -34.074 119.105-166.313 139.628-100.406 107.744 -68.349 166.779 -27.207 97.207 -15.565 163.802 -42.767 93.403 90.643 112.691 70.515 121.888-142.351 144.468 -86.056 127.096-151.488 159.084-160.650 129.395 -53.189 162.369-178.873 140.423 -34.270 0.000 0.000 135.391-170.642 146.793 36.812 95.203 87.109 142.692 -71.503 94.022 120.762 142.671 -75.737 117.799 -57.363 116.184-114.574 125.259 -77.626 123.719 -68.608 91.118 53.362 130.608 -77.321 91.717 41.895 141.557 -78.406 91.040 50.635 137.114-168.120 90.906 45.284 126.950 -75.482 91.691 38.378 110.372 -50.543 92.484 48.360 143.178 -74.099 90.854 49.774 123.397 -77.550 90.629 41.605 149.389 167.841 90.972 46.886 144.053 -68.931 91.033 45.392 125.725 -74.440 92.675 39.588 160.420-114.714 92.859 42.157 139.579-140.318 92.189 41.333 118.222 -72.797 93.632 40.710 118.946 -89.713 91.263 46.672 128.934 -76.733 92.008 43.994 126.077-147.593 92.074 46.168 152.408-139.813 93.526 35.299 119.839 -86.452 94.684 44.698 0.000 0.000 92.766 41.958 135.596-108.556 93.597 35.479 139.129 -22.679 96.300 37.796 0.000 0.000 94.685 38.939 121.909 -79.898 94.070 36.561 145.477-114.526 95.338 37.031 165.477-112.880 94.569 38.958 126.748 111.174 93.491 39.604 144.624-125.769 92.851 43.006 148.669 -26.252 91.210 44.216 131.387 -78.571 92.633 43.595 127.175-100.854 91.552 41.467 141.352 82.618 93.789 42.780 141.564 -75.922 92.896 41.297 133.131-105.399 93.801 50.717 124.563-116.737 92.952 64.038 141.690 -74.986 94.692 81.129 125.288-127.117 118.005 0.000 132.181-155.878 # 95 total E -6.56145E+02 rmsd from N 0.000 %NC 0.00 1 91.603 107.916 130.989 -69.223 123.894-173.385 123.752 -98.085 93.689 22.692 96.946 -78.233 125.077-171.888 151.232 -82.074 126.108-164.623 176.446 -96.828 96.545 -38.778 152.424 65.523 92.884 -77.644 114.710-126.382 92.121 67.648 130.931-119.023 93.216 56.293 112.236 -52.779 92.403 169.310 176.436-137.148 125.432-160.021 167.064 -72.607 123.450-170.015 160.948 116.861 128.494 -66.109 165.345-177.181 95.649 101.231 164.396-123.999 123.148-106.842 151.062 108.391 138.146 178.273 156.461 -95.442 113.814 151.016 163.665 -93.177 115.497 -88.023 115.504 122.817 95.304 12.113 151.550 -22.359 94.026 73.562 121.785 -38.200 95.309 154.129 142.265 -69.498 94.165 159.881 142.236 -76.010 95.090 70.528 142.334 -73.453 129.873 -86.637 162.314 -11.538 122.344 -77.419 140.183 -92.504 92.153 55.371 142.793-105.322 91.265 45.359 100.453 -85.291 91.093 47.238 166.737 -82.963 91.245 40.607 118.741 -56.774 92.113 49.346 145.114 -73.320 90.957 44.710 128.152 -77.438 91.260 44.188 129.502 53.905 91.010 44.124 130.786-144.415 90.807 45.952 124.462 -73.555 92.404 43.379 137.157-122.613 92.015 49.614 145.484 122.151 91.424 53.582 119.185 -68.272 92.764 118.752 125.382-112.548 91.487 53.943 128.571 -76.114 94.113 106.735 133.989-164.789 93.337 -51.865 157.990-149.487 94.091 -48.820 150.201-111.887 125.380 -89.254 0.000 0.000 92.509 56.068 134.457-110.690 93.081 38.145 89.793 -84.122 95.622 49.656 0.000 0.000 93.466 18.778 122.280 -71.747 130.927-113.259 122.736 -99.854 124.347-157.208 138.414-104.169 125.917 -79.624 142.615 164.690 92.838 48.542 142.068 -97.099 92.241 43.495 108.728 -74.418 91.264 46.060 128.161 -75.426 92.660 45.486 116.327-114.284 91.762 38.201 141.239 84.353 94.361 41.221 143.324 -76.262 93.156 41.992 127.019 -52.927 93.733 52.515 130.885-111.568 92.657 56.404 141.385 -74.371 94.675 76.132 123.153-130.556 118.049 0.000 131.629-162.301 # 96 total E -6.90875E+02 rmsd from N 0.000 %NC 0.00 1 91.566 54.563 131.526 -86.256 121.611 -79.732 132.688 -81.173 116.684-103.789 137.823-147.423 91.462 52.131 131.126 -76.917 92.813 46.063 114.778 -85.957 94.459 34.447 158.091 -39.038 93.863 44.725 140.926 -73.166 93.062 46.989 99.062 124.731 91.583 63.897 141.198 -69.697 91.983 -19.891 145.856-134.364 121.580-160.999 115.643 -93.056 127.305-161.321 166.165-143.138 104.906 147.776 163.003 35.481 131.360 30.020 137.795 -85.601 136.249-134.356 176.445-105.491 124.622-156.443 134.405 -79.530 115.073 -62.144 150.422-140.047 92.379 -20.911 103.910-117.451 94.663 93.083 124.355 -63.640 125.484-139.114 148.937 -24.435 129.896-134.296 133.406 -60.857 124.058-165.339 165.422-137.389 129.540-157.674 148.384-115.798 131.380-173.689 156.947 -27.616 122.060-174.198 155.858 -73.535 110.301 97.165 138.197-139.914 93.034 -9.940 108.639 -74.852 92.475 -78.669 129.820 -76.477 117.438 178.303 153.113 -52.790 128.806-171.841 151.670 -6.909 120.791-171.093 146.242 -79.602 132.164-149.933 165.105 175.039 115.759-162.390 159.881-151.918 138.787-146.931 163.592 -86.391 126.135 -88.314 108.723 -74.347 93.380 38.606 130.463 -97.655 91.427 52.557 140.383 -94.288 91.277 60.926 135.403 -16.534 90.630 49.990 127.671 -75.935 91.357 41.750 127.294-151.870 91.486 53.947 150.607-126.508 92.581 42.358 118.783 -70.456 95.072 38.395 153.032-115.937 94.282 36.619 141.449-110.379 94.240 38.442 140.453 -20.460 95.930 40.501 0.000 0.000 93.422 41.106 119.020 -77.058 92.874 36.497 140.701-119.236 93.092 44.652 165.081-103.312 92.458 43.934 138.855 112.955 91.965 40.064 140.290-126.607 92.205 43.529 148.278 -26.706 90.959 47.857 129.150 -75.918 92.477 42.424 128.751-106.335 92.187 39.288 135.230 92.435 94.949 41.799 143.183 -76.065 93.387 39.760 122.815 -74.147 94.153 51.679 128.934-129.761 93.094 60.828 140.026 -73.419 94.758 83.090 129.374-133.949 117.944 0.000 133.036-153.271 # 97 total E -7.07704E+02 rmsd from N 0.000 %NC 0.00 1 91.569 62.402 138.215 -74.961 120.623 -80.337 128.241-106.205 109.744 -40.851 100.213 -77.880 91.554 94.401 131.042 -77.203 121.224-123.232 170.498 -64.583 129.656 -90.279 166.122-154.404 130.765-157.859 133.642-123.599 122.120-149.352 142.490 -32.055 93.649 44.890 141.337 -77.420 123.107-168.068 144.815-151.663 122.671-118.532 148.979 -83.631 126.498-173.023 161.687-163.093 102.669 -60.253 129.602-117.973 97.528 -23.179 151.724 49.023 93.548 86.193 119.069 90.484 126.138-116.170 149.645 -93.615 126.243-177.677 161.758 120.372 129.671 -74.195 140.648 -87.257 127.468 -11.798 0.000 0.000 122.587-169.493 136.827 29.819 134.704-110.133 138.471 -38.639 117.708-172.703 134.343-114.978 134.973-121.830 118.700 -91.957 96.244 -47.652 157.752-143.579 124.057 159.788 157.579 -95.841 95.575 -51.832 165.231-115.321 92.476 -64.511 138.893-135.782 91.538 51.197 128.713 -75.749 130.978-154.666 142.099 31.970 128.543-166.916 158.767 -55.986 123.237 -97.456 143.336 -83.522 91.668 46.468 146.189 74.421 90.894 52.279 100.609-139.308 90.487 54.092 129.083 -77.918 91.602 45.304 140.675 -35.782 91.530 62.696 141.029-139.244 91.387 68.865 132.677 -94.656 91.847 103.613 123.972 -95.859 91.287 63.902 128.259 -75.464 94.560 76.059 134.495-172.717 92.432 -70.426 157.451 7.133 93.638 -52.207 157.200 -44.213 94.022 162.211 0.000 0.000 92.536 49.159 120.831 -79.411 94.950 32.424 76.918 -85.827 98.877 29.921 0.000 0.000 98.535 30.867 125.839 -88.489 97.099 29.784 103.954 -43.309 97.819 33.299 172.675 -18.461 96.977 32.841 119.149 125.154 95.488 35.291 151.409-140.851 93.549 44.409 157.439 20.405 91.150 44.752 131.917 -77.915 92.434 40.873 127.554-100.139 91.734 40.958 141.077 78.500 93.360 45.998 112.328 -81.423 92.463 39.958 139.167-100.191 93.828 45.370 120.934-119.533 93.377 64.188 141.995 -74.845 94.625 81.784 128.010-115.774 118.075 0.000 131.356-156.219 # 98 total E -6.55335E+02 rmsd from N 0.000 %NC 0.00 1 125.201-133.048 164.673 72.644 128.263 -53.446 147.906 -72.930 118.042-133.273 100.921 -75.503 128.356-146.913 150.665 -63.532 121.160-173.180 159.233-153.002 95.214 89.936 122.253 -94.897 96.035 41.476 166.880-107.602 105.861 -69.464 101.926 -33.059 90.169 -31.771 139.408-102.345 114.097-167.760 159.948 18.111 124.712-164.989 173.596 -61.815 131.530-135.980 160.166-110.254 94.429 140.198 171.581 -12.538 136.720 39.929 151.724 49.023 130.248-113.677 164.516 -84.705 131.600-161.541 144.517 -89.798 111.806 -56.882 155.615-123.010 92.643 -25.001 106.229 121.182 95.273 91.071 0.000 0.000 125.280-122.259 145.948 -38.208 126.911-139.791 144.137 -71.238 126.701-120.396 166.598 -93.589 123.879-154.000 147.585 139.647 123.394-161.074 176.535-117.794 125.096-156.097 138.258-130.605 124.755-171.814 161.581-152.953 93.175 9.904 135.615-117.705 120.240-170.313 139.964 -97.467 125.448-163.648 152.113 6.342 113.117 -39.591 172.355 -68.378 91.760 -79.249 129.350 -76.105 91.837 70.848 130.837 -12.540 93.357 56.001 115.963 49.863 111.018 173.818 165.286 -81.380 117.764-169.273 131.665-145.696 121.163 13.096 154.197 137.678 92.552-171.388 117.859-154.501 122.981-168.100 155.657 16.133 132.507-148.267 159.082 -96.175 121.573-168.977 142.642 24.143 127.857-176.403 170.622-176.292 94.101 59.864 140.307-123.777 95.372 71.619 0.000 0.000 92.200 48.637 142.243-102.175 93.758 34.885 87.360 -80.795 97.348 32.882 0.000 0.000 97.287 31.959 116.458 -82.856 96.403 33.632 147.987 -82.416 96.749 34.124 126.546-134.402 95.631 37.436 124.803 104.618 94.414 36.339 150.074-145.447 93.653 41.859 154.248-124.580 91.434 43.253 130.234 -78.071 92.832 43.944 141.458 -76.521 91.362 41.752 137.971 83.551 93.591 43.361 115.373 -90.877 92.940 40.859 133.128-107.472 93.936 51.062 129.130-116.646 93.010 63.768 141.422 -74.307 94.699 81.731 122.779-129.276 118.022 0.000 132.034-155.633 # 99 total E -6.75465E+02 rmsd from N 0.000 %NC 0.00 1 91.557 41.174 119.288 -96.868 124.481-101.706 121.844 -79.611 91.959 64.103 106.776 -89.073 91.117 59.482 131.038 -78.050 92.177 60.986 165.503-117.028 92.550 68.998 144.228 -74.688 92.949 134.020 98.664 -64.852 93.109 84.392 132.577-129.845 91.823 153.264 99.955 -58.132 93.436 55.341 165.159-167.184 123.993-156.196 172.617 -39.318 122.133-164.720 168.744-161.399 103.982 -64.695 164.218 -30.358 97.340 -18.588 164.396-123.999 93.446 91.016 112.597 72.715 121.682-132.591 141.216 -81.251 125.908-159.943 156.854-179.443 128.415 -77.649 158.448-134.550 139.756 -63.147 151.550 -22.359 118.558-170.548 153.456 69.527 94.651 78.140 141.572 -73.673 94.145 44.739 100.115 -79.235 94.447 167.172 166.364 -97.800 93.557 52.541 132.880 -72.635 92.821 106.003 131.186 -78.086 93.303 -36.971 176.441 -48.172 92.415 -54.117 147.621 -25.944 91.696 9.937 129.338 -76.118 125.797 -99.981 149.657 -22.644 124.683-162.496 136.017 -77.094 132.197-103.763 142.991 -83.614 91.426 51.154 138.254-136.714 91.067 53.179 139.060-134.567 90.736 48.468 127.485 -73.765 92.598 39.708 154.635-102.190 92.689 59.965 141.846-142.317 91.645 55.744 132.578 -98.381 92.223 95.292 117.686 -91.745 91.151 55.728 128.170 -75.381 94.274 80.293 132.620-160.326 92.418 -68.494 152.811-167.201 93.892 -54.252 142.724-100.549 94.057 162.065 0.000 0.000 92.200 49.421 126.155 -82.570 94.163 34.909 81.437 -81.877 99.266 27.538 168.407-131.814 99.032 30.775 120.348 -88.446 96.666 30.507 100.659 -40.057 96.619 40.548 163.780 7.183 94.537 35.982 113.273 133.918 94.709 35.112 150.023-135.197 93.955 43.156 152.628-116.148 91.168 47.573 134.334 -79.239 91.312 43.696 129.799-106.776 91.085 40.805 140.200 84.174 93.646 43.079 108.375 -65.478 93.029 40.476 139.331-109.818 93.927 50.110 124.877-118.258 93.003 64.849 141.971 -74.432 94.643 81.619 124.848-122.185 118.046 0.000 131.754-155.914 # 100 total E -7.07050E+02 rmsd from N 0.000 %NC 0.00 1 91.566 45.966 125.780 -78.327 96.365 173.767 121.407 -61.350 93.220 88.781 141.075-166.667 91.697 -11.819 128.190 -74.760 107.729 -85.943 129.714 -79.143 121.912-172.044 126.492 -90.454 131.191-156.033 158.984 28.218 128.976-161.879 164.331 7.076 122.834-168.441 112.424-105.001 92.763 2.408 134.732 158.942 130.055-143.992 174.516 -59.644 122.546-163.526 167.141-120.675 107.325 -64.319 125.118-128.874 96.495 -18.602 145.570 51.587 92.827 92.150 115.150 95.168 122.712-137.287 159.846 -8.576 124.809-157.605 155.166-167.639 114.319 10.392 154.363-117.617 93.486-172.423 167.044-117.212 121.347-165.917 132.910 33.527 128.427-166.074 149.254-117.085 118.570 -81.188 154.703 -48.060 93.620 -3.185 95.804 -95.163 94.339 83.671 144.231-115.619 131.130-157.854 153.947-101.774 130.585-164.519 147.391-101.433 123.510-159.791 146.795 21.226 91.806 10.987 129.545 -76.227 115.715-166.643 149.173 23.161 127.547-167.482 164.481 4.199 125.632-101.715 140.607 -80.619 91.616 42.398 140.641 149.411 91.148 51.793 135.010-134.229 90.636 47.549 127.431 -75.490 91.624 43.323 121.078 -45.271 91.504 41.791 144.756-141.428 91.339 44.624 121.084 -83.228 92.426 41.725 116.211 -51.424 91.240 46.559 127.435 -76.964 91.425 48.266 126.588 169.752 91.312 50.384 154.076-138.155 92.536 36.312 149.426 -52.349 94.306 46.298 0.000 0.000 92.506 42.752 134.568-107.771 93.410 35.918 139.064 -24.058 96.060 38.629 0.000 0.000 94.443 39.432 123.673 -83.755 93.905 37.171 144.218-115.123 95.187 37.165 165.514-113.129 94.510 39.104 126.244 110.354 93.505 39.428 143.981-125.885 92.896 42.982 151.028 -28.941 91.180 44.566 131.850 -78.895 92.420 44.636 128.161-100.221 91.341 41.865 140.965 81.937 93.654 43.037 115.797 -83.065 92.960 41.012 133.033-109.021 93.949 50.416 124.147-118.017 93.045 64.150 141.782 -74.503 94.685 81.513 123.531-128.037 118.017 0.000 132.088-155.773 # 101 total E -6.85970E+02 rmsd from N 0.000 %NC 0.00 1 91.616 112.187 156.347 16.429 127.613-117.578 164.774-123.520 92.589 61.456 105.173 -80.692 90.535 60.776 129.527 -77.931 92.376 44.730 118.596 -58.734 95.383 32.564 168.820 -69.796 95.701 37.485 108.941 -65.628 93.411 48.607 133.733-128.875 91.025 43.273 114.359 31.801 91.924 40.737 144.825-121.191 91.896 54.700 117.090 -87.606 91.432 54.051 130.434-112.133 92.244 37.673 146.847 30.980 94.344 55.010 151.724 49.023 92.744 105.288 142.214-104.884 95.484 -13.267 144.828-104.871 93.599 -73.138 147.329 176.254 92.867 -9.602 105.325-126.130 95.927 96.293 118.346 62.818 129.756-156.680 141.005 -24.961 122.787-176.326 135.954 -73.646 94.329 73.778 120.738 -94.052 94.793 138.020 103.064-117.135 92.318 64.199 126.557 -63.845 92.249 119.938 131.981 -79.228 92.085 -28.203 169.837 -66.611 91.150 -60.716 135.112-136.330 91.097 30.355 129.001 -75.909 124.732 -72.002 133.759 28.285 123.019-143.215 169.005 -57.461 127.834 172.720 135.680 -91.181 92.166 72.320 124.790 29.402 92.227 76.379 126.916 57.392 91.363 160.595 129.311 -77.475 121.590-148.846 126.709 -78.008 93.881 -29.422 120.848 122.191 129.546 178.429 149.015-115.058 124.386-152.238 154.605 156.086 135.779 -80.228 140.141-101.573 93.714 -48.696 123.449 170.026 92.756 89.689 150.223-117.255 117.966 -5.210 112.583 -96.372 132.214-152.850 0.000 0.000 122.237-166.215 139.816 -69.562 109.915 -52.961 149.010 -11.508 132.654-142.915 0.000 0.000 123.425-110.046 127.245 -68.270 92.019 36.048 122.020 144.835 92.677 55.072 112.677 -42.030 92.009 46.097 140.889 118.550 91.631 39.966 146.556-139.940 91.634 49.274 141.279-100.823 90.877 46.102 129.495 -76.765 92.080 42.960 121.314-119.304 91.477 41.538 140.857 77.755 93.532 46.355 120.256 -89.995 92.498 39.760 130.561-102.376 93.896 46.822 120.630-120.684 93.285 63.037 141.916 -74.995 94.671 81.650 127.654-119.751 118.081 0.000 131.306-156.571 # 102 total E -6.47958E+02 rmsd from N 0.000 %NC 0.00 0 91.608 111.273 133.812 -71.956 127.766-151.905 164.290 -30.182 93.081 61.375 103.221 -86.784 92.357 164.774 127.416 -74.643 93.785 17.406 113.886-108.312 114.978-148.793 143.829 -82.567 128.359-154.922 121.857-116.136 119.326 -1.840 154.775-138.580 110.845-162.914 108.416 -47.405 122.545-155.141 150.719-143.446 117.623-165.420 142.147 -73.826 110.742 -62.879 135.101 130.655 92.681 -22.590 122.599-154.318 94.863 94.588 164.396-123.999 120.545-137.561 149.996 -81.463 126.372-165.209 170.205 -56.112 123.162-153.582 160.905 160.852 134.355 -1.651 131.596-122.480 95.755-175.340 151.550 -22.359 133.058-131.291 112.827 75.546 126.465 -5.182 103.852 -82.967 96.307 140.433 163.768 -91.934 136.912 -93.018 168.832 -19.571 111.354-155.055 117.203-104.670 139.814-153.632 125.649 -99.564 94.274 18.145 132.861 -88.394 128.046-144.990 150.089 146.537 130.017-152.601 150.728 -70.643 96.892 -40.779 174.880 -67.942 95.313 -79.338 139.209 -73.536 90.636 77.185 129.095 -74.829 92.928 39.255 115.344 -99.434 122.034-157.711 163.590 -96.565 123.960-148.211 146.135 -83.553 120.618 0.694 153.311-146.316 120.731-161.164 134.315-140.620 132.135-163.917 119.624 -14.911 127.423-170.842 129.411-122.624 91.936 99.028 110.351 -0.502 93.597 65.521 168.280 -26.832 93.519-108.869 112.327 -79.196 93.550 124.083 141.002-108.670 95.060 107.871 0.000 0.000 93.117 63.758 147.461-101.762 93.507 47.072 92.434 -82.072 96.342 91.566 0.000 0.000 119.508-142.453 139.358 -86.558 92.304 46.972 164.724-117.713 91.880 55.107 119.441 -34.462 91.988 44.256 135.208 90.825 91.767 40.063 137.229-129.161 92.135 45.796 150.617-120.194 90.993 44.805 132.071 -77.985 92.423 43.868 130.678 -99.559 91.397 41.300 139.706 81.399 93.718 43.552 116.258 -93.140 92.875 40.879 132.964-106.137 93.913 50.951 124.368-118.629 93.032 63.948 141.499 -74.355 94.693 81.586 123.202-129.770 117.998 0.000 132.204-155.537 # 103 total E -6.54103E+02 rmsd from N 0.000 %NC 0.00 1 125.829-134.691 151.961-109.337 127.920 -71.272 126.175 -98.204 99.738 -35.467 136.587-154.986 91.308 98.455 130.920 -80.241 115.732-165.152 166.248 -57.685 97.039 -37.456 119.423 -36.983 94.104 -78.065 127.041 -95.149 91.900 77.927 126.226-117.953 92.470 49.967 118.004 -52.642 92.014 163.992 160.362 -20.001 110.381 169.721 134.667 -75.676 93.629 59.106 128.574-125.716 93.971 36.943 133.791-107.105 94.520 56.408 0.000 0.000 95.028 -79.517 139.853-114.575 120.384 123.776 118.948 -85.498 92.159 83.149 144.084-165.425 93.199 18.883 118.222-109.092 116.511 -62.348 0.000 0.000 124.909-172.347 136.845 -50.408 124.086 -87.527 122.945 -60.320 94.870 10.556 127.787-101.748 95.085 82.975 125.677 -96.927 92.098 122.081 98.066 -21.967 90.779 22.447 130.863 -77.523 108.389-136.902 126.913 -68.360 91.881 66.430 97.108 -79.965 91.537 52.602 128.166 -75.572 94.229 27.360 109.581 -47.855 96.735 43.963 168.429 -57.825 92.512 38.644 128.575 -77.030 93.832 40.118 128.584 123.696 93.224 39.036 160.706-131.408 91.757 47.435 135.722 -80.297 93.220 39.280 169.548-147.540 92.794 46.496 146.886-147.098 91.604 60.898 130.553-129.790 92.671 73.331 88.393 -51.808 91.594 116.746 129.115 -76.194 86.189 -62.238 126.260-171.951 91.902 -56.753 146.172-104.400 93.022 139.662 175.619-155.036 94.375 136.705 0.000 0.000 93.419 63.647 128.751-118.897 94.282 33.596 90.551 -84.346 97.721 107.681 0.000 0.000 120.886-121.642 128.095 -68.070 92.703 44.158 89.873 -46.455 93.343 47.699 149.725 67.674 92.724 40.166 131.907 107.332 92.647 37.759 140.323-135.156 92.628 45.719 155.230 -17.532 90.975 43.942 132.861 -78.259 92.211 42.562 128.471-101.817 91.408 40.915 140.994 81.482 93.496 44.096 103.746 -64.894 92.946 40.445 135.413-105.457 94.196 49.799 123.390-117.479 93.227 60.999 141.971 -74.582 94.778 80.026 123.013-118.903 118.131 0.000 130.686-159.078 # 104 total E -6.85157E+02 rmsd from N 0.000 %NC 0.00 1 126.083-129.823 150.188 -83.152 126.583 -81.985 134.087 -83.692 116.785 -99.424 137.380-146.571 91.478 49.315 131.796 -78.063 92.318 47.434 147.366 -76.858 92.485 42.619 169.854 -64.160 92.341 41.937 103.077 -64.020 92.793 41.983 126.146-108.169 91.950 44.997 123.368 47.476 92.276 38.520 152.413-116.343 91.571 51.640 121.572 -90.865 90.983 63.135 136.591-142.167 91.053 46.614 119.383 -79.880 93.116 48.203 171.212 -76.272 93.581 -91.351 130.609 -88.096 125.787-173.028 167.074-102.107 120.448 -97.019 176.519-168.461 124.132 -75.823 112.850-112.441 128.989 -25.739 0.000 0.000 125.243-152.247 145.414 -6.893 127.343 -87.385 166.625 -71.849 124.786 -27.198 121.564-108.710 124.287 -89.839 124.862 -84.806 91.963 47.876 137.719 -76.550 90.957 47.645 129.554 -76.705 91.759 46.373 146.375-118.610 91.215 44.463 111.050 -64.842 91.234 41.714 127.813 -75.864 91.916 41.839 111.967 -52.196 92.800 45.093 124.486-103.213 91.145 43.269 125.816 -73.917 91.927 42.048 126.862 67.408 91.904 43.578 164.634-174.245 91.177 43.976 128.273 -75.933 92.503 42.221 133.350-151.421 91.784 43.431 130.882 108.673 91.488 43.231 120.526 -78.049 92.670 42.677 125.896 -75.892 91.052 46.853 128.121 -76.236 91.887 44.179 137.744-140.183 91.941 47.199 151.652-140.451 93.291 35.228 121.278 -87.516 94.517 47.459 164.220-142.818 92.827 41.680 135.487-110.103 93.524 36.054 113.158 -63.384 96.227 37.669 0.000 0.000 94.732 38.952 121.007 -79.611 94.161 36.539 145.010-119.319 95.273 36.974 142.122-122.319 94.561 39.043 127.118 110.580 93.444 39.763 144.625-126.694 92.786 43.062 148.820 -25.955 91.198 44.218 131.258 -78.447 92.622 43.597 127.005-101.009 91.546 41.488 141.386 82.570 93.780 42.797 141.592 -75.934 92.900 41.260 133.047-105.269 93.800 50.750 124.476-116.753 92.950 64.054 141.691 -74.988 94.685 81.202 125.312-127.187 118.005 0.000 132.232-155.987 # 105 total E -6.61658E+02 rmsd from N 0.000 %NC 0.00 1 91.566 52.564 127.099 -78.457 127.873 172.365 143.789-103.260 93.656 32.680 146.671-176.155 92.150-148.589 129.422 -76.204 126.008-166.733 141.708-109.879 132.539-177.000 93.424-108.794 129.739-161.702 138.603 91.462 124.132-166.913 115.584 -45.611 130.437-158.882 122.175 56.003 91.825 13.324 147.836-122.698 114.329-174.474 168.695 -36.985 130.794-172.519 165.149 99.826 93.774 25.522 136.902-102.816 120.497-168.585 149.787 -84.835 124.734-163.943 167.131 20.770 122.749-170.518 138.503 -72.377 122.546 -64.138 135.246 131.663 93.197 -18.245 105.860-120.219 95.221 94.626 118.346 62.818 124.369-153.558 127.758 -50.702 122.542-162.332 137.792 -82.083 131.500-142.828 143.419-135.991 117.292 11.751 163.261 -60.665 115.815-170.686 133.312 56.032 123.800-179.247 166.485-103.504 94.733 20.825 141.443 -77.831 95.469-164.449 105.739 -93.081 133.258-168.634 102.161-146.491 128.064-169.986 137.081 32.692 126.072-164.947 118.134 -37.431 123.722-165.348 126.969 -97.531 127.261-151.055 149.832 120.959 94.628 -6.731 101.682 -6.319 136.055-143.183 176.422 -82.388 127.925-156.156 106.071 -71.392 91.579 -15.676 120.005 130.038 104.201 170.253 155.637-139.376 125.148-175.832 160.089 28.871 91.968 -57.750 125.177 -73.560 93.615 -62.729 131.053 162.085 91.472 87.719 149.495 -16.405 95.285 27.639 103.981 -93.080 95.170 167.562 102.580 -55.005 118.298-178.671 130.113 -73.574 92.985 -32.186 143.961 -11.151 125.521-146.333 0.000 0.000 115.893-138.224 139.912-120.630 93.495 36.298 151.344-102.231 93.722 46.826 124.624 -36.389 93.564 39.269 123.945 120.550 93.460 39.895 144.803-134.900 92.937 42.853 150.059-115.017 91.292 44.324 132.548 -79.979 92.555 43.982 126.147-106.833 91.390 41.872 140.791 80.493 93.637 43.450 117.741 -93.458 92.880 40.932 131.501-107.696 93.917 50.893 123.384-118.914 93.032 63.955 141.564 -74.432 94.692 81.579 123.165-129.679 118.009 0.000 132.194-155.624 # 106 total E -6.54706E+02 rmsd from N 0.000 %NC 0.00 1 91.559 47.041 123.124 -91.370 123.664 -81.407 131.357 -86.195 115.895 -98.064 112.572 -84.640 91.683 56.629 131.211 -77.214 93.323 42.148 119.243 -86.615 94.245 39.181 166.773 -44.291 93.118 47.933 143.569 -77.774 92.955 50.602 132.935 78.914 91.919 66.953 123.983 -67.107 92.285 153.265 136.463-143.412 122.926-154.014 148.250 -70.773 110.239 -52.793 156.687-151.883 92.871 -29.850 157.395 -34.432 94.297 97.124 145.570 51.587 120.323-137.081 138.973 -90.239 126.207 -78.353 157.325 -17.243 116.524-154.784 158.518 82.769 123.354 -49.010 101.326-109.481 93.414 76.399 118.346 62.818 91.340 104.205 109.036 -51.964 93.487 62.432 145.959 -80.548 92.795 154.282 137.716 -71.996 97.007 51.456 122.223-128.276 93.375 161.952 117.033 69.015 91.524 94.008 149.423 -91.201 93.320 -9.400 165.410-115.761 93.328 -77.498 102.790 -83.666 115.446-179.953 140.711 -77.890 125.624-131.423 151.188 12.448 131.969 -66.637 143.240 67.188 91.796 113.353 130.093 -74.915 91.899 42.381 140.477 151.714 92.108 44.366 140.677-131.094 90.955 54.955 122.451 -69.857 92.227 45.892 150.636 151.814 91.842 43.723 135.251-107.984 91.780 65.139 120.283 -97.150 93.325 119.531 144.764-134.258 91.105 28.739 129.810 -75.661 103.180-167.848 131.739-144.364 120.147 -75.905 164.895 -13.246 92.612 -12.816 149.023 -97.991 94.799 97.080 102.580 -55.005 117.267-168.958 166.634 -97.119 93.584 24.648 135.825-123.814 136.496-144.706 0.000 0.000 119.975-115.764 122.948-120.235 92.385 37.829 156.230 97.076 92.211 50.909 142.311 -70.097 92.880 41.610 123.233 134.326 93.179 37.490 149.277-120.452 93.141 42.984 148.984-101.836 91.257 45.680 131.772 -80.024 92.254 43.887 127.366-110.614 91.366 40.635 138.955 80.453 93.744 44.425 117.678 -93.647 92.891 40.207 130.844-103.833 94.369 54.343 123.639-120.624 93.137 67.223 141.008 -74.225 121.038-116.653 131.016-129.539 117.649 0.000 152.824-141.259 # 107 total E -6.83578E+02 rmsd from N 0.000 %NC 0.00 1 91.563 64.384 134.740 -55.797 129.932-164.915 130.068 -80.044 93.674 64.987 118.802-102.861 92.654 158.217 123.157-137.308 92.966 33.473 141.018 -76.143 94.986-173.131 125.956-100.982 140.456 -67.642 120.434 -82.165 129.406-165.260 165.043 5.943 94.080 173.765 120.512 48.857 92.304 45.242 119.348-108.979 109.220 147.034 161.211 55.674 96.607 -40.205 153.834 144.713 92.458 -47.628 134.818-109.214 94.078 91.198 0.000 0.000 127.606-103.289 113.367 -87.831 126.736-165.382 165.498 -20.975 121.936-173.255 141.414 129.280 93.994 80.811 105.419-122.400 97.967 119.018 0.000 0.000 129.413 -80.557 137.624 -28.755 131.634 -25.732 131.165 -78.299 123.670-166.519 118.497 -89.248 133.753-111.789 161.724 31.122 132.927 -31.822 155.681 77.006 92.068 -6.922 130.805 -77.146 125.735-140.083 137.136 -69.655 92.376 58.447 92.720 -77.633 91.333 45.470 127.458 -75.305 93.056 36.796 112.772 -47.117 94.836 42.862 141.766 -73.600 91.688 44.154 126.352 -77.868 91.855 42.361 135.404 164.090 91.556 46.314 143.226 -53.001 91.061 44.345 129.463 -76.971 92.267 42.848 141.558 -78.971 91.643 43.163 139.783-144.331 91.405 43.943 117.794 -71.290 92.747 41.548 115.849 -59.376 91.129 47.172 128.505 -76.337 91.802 44.954 126.102-146.329 91.906 46.702 159.942 -20.640 93.225 36.561 119.742 -84.899 94.403 45.491 0.000 0.000 92.620 42.184 136.718-109.409 93.535 35.613 137.960 -17.502 96.238 38.046 0.000 0.000 94.597 39.213 121.656 -80.271 94.012 36.675 145.441-115.157 95.305 37.068 165.802-112.741 94.544 39.027 126.819 111.169 93.468 39.642 144.519-125.712 92.842 43.019 148.675 -26.254 91.214 44.193 131.407 -78.582 92.634 43.601 127.140-100.958 91.546 41.478 141.360 82.618 93.788 42.788 141.565 -75.921 92.897 41.274 133.096-105.405 93.801 50.738 124.522-116.746 92.946 64.056 141.690 -74.985 94.691 81.206 125.287-127.142 118.007 0.000 132.222-155.991 # 108 total E -6.91764E+02 rmsd from N 0.000 %NC 0.00 1 91.565 52.653 129.592 -90.092 122.992 -86.051 142.362 -77.420 116.370-155.258 139.595-151.265 91.316 49.464 131.755 -77.769 92.306 45.216 134.130 -71.734 93.904 39.136 153.426 30.156 94.146 39.509 167.085 -94.861 94.920 36.393 133.987-123.735 93.756 42.129 121.607 57.216 92.447 46.365 154.536 -9.104 91.844 53.118 115.568 -97.924 92.072 47.068 131.117-130.413 93.705 72.217 118.071 -87.648 141.487 -54.022 0.000 0.000 129.676-154.083 151.292 83.305 124.861-160.755 135.855 -84.210 114.910 -63.445 149.465-132.602 92.381 -20.479 103.572-117.269 95.002 93.083 0.000 0.000 123.353-142.006 140.451 -7.270 130.448-152.738 157.324 -90.958 126.647-170.411 141.872-120.512 132.515-146.777 166.280 -82.854 123.976 14.007 122.436-100.974 92.045 112.877 129.323 -76.679 93.643 -21.562 162.694-162.274 93.082 -62.856 160.807 20.281 91.822 10.034 127.243 -75.827 120.122-157.290 144.920 45.309 123.849-163.589 154.281 8.359 120.170-158.959 161.114 -82.487 130.577-161.745 150.015-172.284 93.789 -25.886 167.258-113.182 91.863 -85.642 128.681 -76.467 92.716 63.133 116.393 -80.968 94.738 59.666 128.068-144.985 92.879-178.691 120.473-133.792 134.604-163.128 157.694 170.817 122.658-159.441 155.407 -83.669 127.450-147.773 151.256-156.449 117.302-173.948 154.110 5.315 99.713 -59.093 142.855-104.285 102.910 -24.554 0.000 0.000 93.946 90.361 126.321 -95.333 118.567-128.445 151.790-173.235 132.096-167.056 0.000 0.000 125.089-143.287 168.007-125.434 127.319-153.877 138.153 55.525 126.233-168.533 168.312-115.883 133.219-116.649 155.204 137.622 128.681-167.470 139.635 -51.503 112.729 -61.491 149.052 -3.335 91.937 -23.733 129.522 -76.306 95.682 89.539 143.226 -70.174 125.306-128.624 169.674-114.290 128.590-161.337 158.050 -28.823 125.224-136.216 127.568 -68.354 129.656-163.607 164.312 164.860 123.442-172.002 142.913-103.978 95.313 60.891 142.249 -74.207 117.350 0.000 139.708-176.474 # 109 total E -6.47783E+02 rmsd from N 0.000 %NC 0.00 1 91.620 113.167 154.744 24.325 123.899 -92.042 120.383 -90.813 116.592 -92.146 118.928-118.118 91.657 69.358 132.245 -78.143 93.699 53.390 141.240 -75.890 124.000-113.239 155.152 -25.199 122.291-147.032 135.197-116.190 94.266 66.926 76.075 -64.389 93.878 164.427 96.881 -67.332 93.805 59.834 135.360-172.220 117.233-156.270 170.929 1.447 122.670-165.575 159.631-137.466 104.941 -61.415 162.736-115.437 97.833 -20.747 151.724 49.023 93.797 88.914 166.092-111.782 125.402-121.807 135.305 -79.690 132.844-164.509 135.716-103.914 126.396 -63.615 162.211-134.059 140.930 -37.741 124.355 -63.640 146.583 -89.041 141.490 52.679 130.129-136.466 126.744 -94.209 94.295 97.621 140.226 -74.677 93.653 10.662 120.808 -93.341 102.324 -90.512 96.435 -56.510 125.202-176.760 152.485 -97.930 127.066-133.453 168.893 -45.686 93.727 40.480 146.867 -25.771 91.881 157.262 128.272 -75.498 145.910-161.395 145.353 -62.863 130.983 -91.861 116.791 -52.606 135.272-108.668 144.350 -83.440 92.794 52.010 126.247-126.663 91.891 57.227 128.831 -54.022 90.809 53.043 134.744 -81.208 91.895 47.746 112.197-111.323 91.219 42.338 120.546 152.867 91.171 49.044 108.266 -60.963 91.989 50.903 130.548-118.183 91.200 41.595 129.660 -76.754 93.376 44.006 129.006-154.089 92.997 86.048 151.619 -45.188 94.778 77.697 141.581-107.418 129.832 -68.057 0.000 0.000 93.012 63.071 126.872 -94.770 92.956 5.899 142.578 -22.897 121.137 -10.396 0.000 0.000 126.855-171.734 163.589-132.428 92.598 75.232 174.397-159.017 92.130 54.305 134.772 -65.914 93.000 45.571 120.506-164.024 93.826 34.599 143.063 -92.256 94.676 39.003 117.314 -72.648 92.233 40.817 127.695 -77.288 94.922 40.245 128.801 -86.959 93.217 36.232 141.834 102.010 96.164 35.668 140.427 -75.949 94.379 42.543 141.037-125.444 94.034 47.885 143.118-112.251 92.921 63.447 141.686 -73.143 94.705 82.920 123.851-121.223 118.089 0.000 131.166-155.226 # 110 total E -6.87370E+02 rmsd from N 0.000 %NC 0.00 0 91.572 59.606 134.831 -76.644 123.373 -83.355 114.950 -78.119 115.189-144.631 141.029-155.125 91.196 49.750 132.837 -77.841 92.001 46.193 137.786 -73.688 93.226 42.173 167.928 -53.544 92.472 44.398 120.462 -57.299 93.494 39.586 132.701-116.456 92.655 43.066 115.189 44.703 92.304 45.221 149.707-106.587 92.100 55.414 118.806 -88.957 92.550 72.493 131.124-126.204 92.887 6.373 116.970 -87.638 109.255 -92.944 137.795 -85.601 109.482 167.848 158.093 -85.409 129.803-170.420 142.462 -71.742 115.024 173.598 156.407-122.885 120.725 -69.349 112.953 120.899 126.606 -41.797 124.355 -63.640 92.451 61.024 137.092 83.690 95.126 32.158 148.740 -12.397 94.666 44.461 143.217 -71.854 94.110 37.645 162.795-141.292 92.130 46.934 95.693 -21.384 91.187 41.933 128.977 -76.787 92.570 42.108 162.635-110.251 91.707 44.705 143.120-141.361 91.189 44.127 127.134 -75.615 91.813 40.932 118.290 -26.321 93.200 43.368 137.517-104.271 91.255 43.905 127.833 -76.238 91.870 42.494 146.266 123.331 91.753 44.296 160.029-151.989 91.118 43.825 127.866 -75.841 92.611 41.425 137.092-121.271 92.090 44.337 122.805 134.144 91.616 42.632 117.613 -68.304 92.851 42.451 118.685 -74.602 91.113 46.663 128.399 -76.060 92.012 43.887 128.248-148.979 92.097 46.247 153.670-141.724 93.481 35.455 120.022 -86.309 94.656 44.701 153.032-115.937 92.743 42.080 135.454-108.479 93.586 35.396 139.102 -22.758 96.232 38.307 0.000 0.000 94.641 38.560 122.500 -80.272 94.097 37.639 144.729-114.937 95.514 36.046 166.055-113.218 94.906 38.510 124.830 104.069 94.136 36.724 143.049-131.600 93.777 41.512 148.117 -32.513 91.464 44.075 130.930 -78.336 92.804 45.030 143.416 -74.145 91.199 43.345 141.435 -77.572 93.173 42.887 112.994 -82.686 92.975 40.797 131.724-111.463 94.084 49.922 128.290-112.301 93.078 64.070 143.082 -75.862 94.697 80.965 123.558-126.507 118.023 0.000 132.019-156.475 # 111 total E -6.74109E+02 rmsd from N 0.000 %NC 0.00 1 91.570 60.860 135.686 -77.124 125.101-102.495 130.383 -88.202 92.120 57.049 106.115 -90.256 91.145 45.411 130.381 -77.079 92.880 42.844 144.781 -77.103 94.093 38.256 168.276 -73.546 94.085 39.699 103.604 -60.755 93.539 41.377 135.864-112.707 91.884 43.412 118.532 42.515 91.944 42.669 153.728-117.076 91.113 50.165 120.063 -87.392 91.384 46.585 132.670-124.285 92.120 45.145 132.947 57.110 93.139 52.613 166.847 -66.420 92.922 -75.184 135.257-108.909 131.270 175.428 142.199-100.416 119.959-155.677 163.756-179.717 104.478 -35.685 104.628 114.387 121.283-161.542 0.000 0.000 117.950-165.263 167.272-120.869 126.745-171.117 159.288 5.709 94.070 93.872 140.127 -74.112 93.681 -6.854 139.929 -74.049 94.257 -82.181 91.726 -20.689 93.025-179.504 151.010 -77.632 126.399-175.615 168.585-107.062 117.302-169.086 137.325 -54.060 91.802 -35.064 129.703 -76.125 132.083-164.598 136.025 27.795 122.373-104.921 146.211 -98.741 122.247 -99.592 116.921-116.127 92.329 44.870 144.580-113.618 92.282 46.717 137.109-136.734 91.848 40.483 127.630 -75.979 93.807 39.352 112.785 -91.391 92.858 42.058 137.429-139.955 91.750 44.232 114.737 -66.641 93.032 42.644 136.117 -93.358 91.571 48.044 129.163 -76.175 94.303 78.963 129.354-150.578 92.105 -72.806 150.540-165.986 94.191 -51.324 144.345-106.095 94.544 176.972 0.000 0.000 92.042 53.625 135.080 -86.557 93.654 32.036 85.731 -86.097 98.175 34.569 0.000 0.000 96.150 36.011 120.026 -86.971 95.079 34.068 154.264 -98.654 96.387 33.791 161.182 -8.576 96.289 34.177 114.944 124.957 95.347 35.684 149.196-129.137 94.187 40.428 151.022 -26.740 91.556 43.410 129.318 -77.734 92.422 44.208 140.089 -78.880 91.063 42.839 139.453 84.978 93.338 42.895 107.866 -70.134 93.087 40.617 134.205-108.763 94.010 50.274 127.714-116.967 93.073 64.601 142.075 -74.627 94.667 81.725 124.488-125.006 118.039 0.000 131.794-155.780 # 112 total E -6.48393E+02 rmsd from N 0.000 %NC 0.00 1 91.569 60.647 135.374 -74.530 124.870 -82.808 133.841 -85.600 116.812 -97.385 134.631-141.787 91.429 50.898 131.596 -77.940 92.535 44.579 142.709 -75.000 93.038 46.544 171.914 -62.899 92.745 41.052 105.852 -64.812 92.801 50.839 122.226-107.842 91.866 85.329 142.453 -97.114 91.603 -44.380 146.910 156.577 118.969-159.253 172.459 -1.511 123.805-166.370 174.241-163.260 107.341 -59.907 125.458-117.041 98.039 -20.760 0.000 0.000 93.505 89.994 122.522 81.992 125.364-132.269 166.150 -84.963 126.865-156.917 148.350 6.704 125.169 -81.450 154.035-123.175 135.984-115.430 133.661 -68.716 125.690-108.951 138.363 -32.844 127.454-127.102 143.782 -93.844 95.827 114.418 165.537 -86.252 121.672 -23.931 132.883 -88.865 114.847 173.974 176.451-124.033 91.728 99.877 130.971 -77.325 93.033 -5.192 115.096 -77.847 92.415 -83.559 103.595 -84.414 105.200 169.750 144.698 -83.352 91.364 53.057 123.199 -2.140 93.149 50.799 124.575 -94.786 91.463 41.192 129.352 -77.287 92.563 43.054 141.154 115.793 92.020 45.623 142.684 123.705 91.291 44.129 126.012 -72.981 93.704 37.715 131.341-132.634 93.519 43.948 137.269 135.402 92.170 43.516 106.449 -49.603 93.181 48.313 117.297 -76.586 90.995 71.635 126.392 -74.086 93.761 23.261 127.926-147.768 95.823-106.348 145.015-101.035 93.558 158.078 138.047-105.288 95.378 74.605 0.000 0.000 118.103-177.921 170.937 -83.910 93.623 45.405 138.393-118.384 122.074 0.441 0.000 0.000 93.886 47.080 128.909 -96.172 95.963 24.599 163.864 147.045 97.798 39.560 166.198-117.539 95.358 33.459 117.449 113.461 95.221 36.858 150.670-135.462 94.352 39.259 151.055 -25.740 91.686 43.709 131.043 -78.681 92.813 44.181 140.688 -76.697 91.349 41.667 138.658 84.811 93.609 42.931 113.246 -80.425 93.034 40.867 134.050-110.050 93.978 50.524 129.610-115.819 93.024 63.827 141.730 -74.406 94.703 81.656 123.092-126.975 118.036 0.000 131.859-155.906 # 113 total E -6.53174E+02 rmsd from N 0.000 %NC 0.00 0 91.613 -4.499 113.186 -72.820 127.872 -68.554 143.225 -89.914 115.679-146.732 140.099-152.443 91.297 55.415 131.157 -78.180 91.946 45.138 136.241 -72.557 93.117 42.532 165.368 -53.338 93.219 41.757 118.087-114.010 92.945 40.658 116.142-154.384 92.153 42.644 118.723 46.437 91.725 47.699 127.403 -66.778 92.046 49.907 123.958 -84.430 92.979 65.982 130.076-113.553 93.492 1.431 119.917 -84.716 114.316 -94.412 151.724 49.023 116.470 173.611 155.297 -62.470 115.163 168.473 135.180 -79.653 116.759 160.795 138.105-124.825 122.807 -60.053 110.167 114.170 126.234 -19.144 164.278-149.183 140.269 -75.702 146.411 -9.569 125.857-151.379 166.773 -12.173 131.370-161.658 121.625-127.199 123.264-164.817 162.854 -71.374 119.825 -70.376 144.143 62.465 92.004 -15.711 130.568 -77.101 95.342 89.218 142.522 -77.251 128.968-144.016 160.286-175.065 132.428-158.975 140.447 -77.419 117.292-161.410 145.276 132.926 96.782 35.251 137.123 -76.754 117.899-162.166 160.794 -84.621 92.583 46.600 146.054 29.850 92.459 46.704 161.926 139.665 91.449 43.313 134.639 -80.668 92.449 43.264 117.983-159.260 91.642 41.748 140.098 109.116 91.309 44.242 118.996 -76.882 92.063 44.637 133.978-102.373 90.961 46.131 128.322 -75.998 92.000 42.334 135.260-149.387 92.402 45.676 151.015-132.368 93.732 34.829 119.551 -88.273 94.809 44.567 164.220-142.818 92.783 42.044 135.699-110.181 93.594 35.413 139.178 -22.693 96.212 38.409 0.000 0.000 94.601 38.610 121.718 -79.548 94.065 37.843 144.663-115.812 95.411 36.232 165.879-113.579 94.820 38.748 125.150 103.301 94.062 36.838 142.731-131.556 93.721 41.612 148.124 -32.607 91.471 44.017 130.997 -78.253 92.829 45.024 143.413 -74.129 91.209 43.344 141.412 -77.527 93.186 42.902 112.822 -82.561 92.979 40.744 131.735-111.233 94.099 50.036 128.162-112.107 93.072 64.101 143.115 -75.742 94.692 80.824 123.530-126.660 117.944 0.000 131.890-156.615 # 114 total E -6.67713E+02 rmsd from N 0.000 %NC 0.00 1 91.569 60.808 136.150 -75.806 123.248 -82.168 127.477 -92.663 115.465-148.951 138.188-147.230 91.375 60.077 132.276 -76.196 93.092 37.352 138.837 -72.740 95.155 56.248 164.516 -25.095 92.748 108.001 176.466 -76.090 92.502 76.954 104.050 -99.486 91.910 49.942 119.641 -49.586 92.561 -75.670 164.079 177.073 127.646-171.328 171.545 -83.024 94.791 42.421 143.510-100.201 95.389 147.531 144.412 63.719 132.128 44.100 0.000 0.000 123.266-113.597 170.033-115.220 130.584-162.302 138.816 -93.049 111.063 -58.447 152.501-112.946 92.542 -24.526 104.016-116.250 95.250 91.724 159.450 152.733 125.861-118.075 137.230 -12.796 124.605-143.925 146.826 -96.233 135.144 -67.426 156.309-100.890 136.343 -25.466 127.206 -89.356 118.474-169.349 157.778 161.255 90.686 60.209 136.655 -78.511 92.293 39.961 114.190-104.539 92.653 43.057 107.334 -66.484 91.458 44.146 127.846 -75.925 92.475 42.571 106.574 -41.416 95.670 38.879 135.909 -99.432 92.568 66.767 128.790 -76.086 139.661 -77.805 152.084 -34.606 92.080 70.512 139.698 -79.935 91.147 41.424 131.486 -77.691 93.286 43.137 151.736 -19.752 92.725 39.525 132.158 152.252 91.890 42.062 121.995 55.791 91.780 48.339 122.345 -74.204 91.205 46.517 121.931 -73.299 93.325 43.218 150.738 -42.325 93.277 54.014 160.949 -18.552 113.334 -75.399 165.617-161.560 125.634 -14.625 0.000 0.000 125.684 -94.852 169.805-146.742 94.011 29.631 94.602 -84.055 96.415 64.040 0.000 0.000 94.018 88.966 137.861 -76.575 139.800 -74.805 99.331 -94.131 94.577 46.589 122.242-107.983 94.158 38.169 132.421 107.481 94.272 37.527 147.974 -3.735 93.498 41.079 150.204 -40.807 91.809 40.998 128.698 -76.739 93.683 43.021 146.580 -99.227 92.072 38.627 132.533 94.011 94.318 41.898 113.993 -79.740 93.331 39.372 127.552 -91.345 94.194 56.275 126.510-145.687 92.668 68.478 140.458 -75.222 94.629 101.026 123.392-143.548 117.347 0.000 132.889-113.665 # 115 total E -7.09425E+02 rmsd from N 0.000 %NC 0.00 1 91.567 59.866 134.984 -77.804 124.554 -90.283 110.979 -74.401 100.740-179.352 136.100-155.496 91.722 49.331 130.388 -79.280 92.946 39.494 135.927 -71.928 95.437 37.210 170.013 -76.666 95.630 37.270 101.974 -55.985 96.654 32.012 130.686-100.178 94.710 39.507 122.425 68.845 92.844 46.136 145.405 -48.113 93.276 47.337 139.622 -75.939 93.369 50.350 131.014-125.230 93.882 123.259 116.198 -90.500 145.011 -95.988 164.396-123.999 129.639-110.599 171.123 -94.383 127.277-163.785 136.897 -94.777 109.015 -57.605 130.070 -68.981 92.023 -26.394 101.921 125.663 95.066 88.910 167.044-117.212 127.441-109.986 113.808 54.374 129.661-160.539 131.431 -75.849 124.551-138.038 141.179-124.938 128.316-104.531 165.546 -42.052 92.986 33.994 139.345-131.558 91.557 66.221 129.661 -78.393 92.779 84.980 139.507-109.959 92.387 114.492 98.946 -78.378 115.380 -99.740 134.670-103.322 92.267 47.754 111.569 -50.184 92.755 45.949 143.097 -74.159 90.886 50.488 114.663-108.721 90.700 43.845 137.655 90.573 90.832 44.123 143.404 -71.707 90.712 48.876 127.313 -75.324 92.279 41.447 171.565-142.906 91.761 48.286 151.880-147.680 91.032 54.697 124.775 -82.914 91.583 63.793 91.293 -48.222 91.056 40.928 131.583 -79.059 94.532 92.108 127.716-149.419 93.379 -61.031 157.408-173.767 94.733 -55.318 142.713-101.963 94.703 162.787 0.000 0.000 90.851 65.526 132.050 -96.018 93.153 37.185 78.928 -86.564 97.066 31.241 0.000 0.000 97.593 33.248 120.888 -86.250 97.234 29.336 98.616 -48.578 98.129 31.729 144.099 -74.795 96.576 35.191 116.832 127.891 94.913 37.360 154.855-149.423 93.580 39.376 148.493 -18.662 91.306 44.780 130.900 -78.252 92.370 45.228 140.875 -79.822 90.855 41.344 136.425 77.583 92.608 46.263 114.187 -57.752 92.585 42.301 135.411-108.767 93.176 46.852 126.460-121.418 92.997 66.218 142.069 -76.332 94.821 84.724 130.646-112.477 117.845 0.000 133.986-148.961 # 116 total E -6.62926E+02 rmsd from N 0.000 %NC 0.00 1 125.090-114.505 159.213 93.827 127.487 -81.821 132.337 -94.433 116.691-100.710 144.155-157.201 91.892 45.309 130.752 -77.141 92.792 47.953 151.886 113.611 91.508 47.266 144.291 -71.475 92.113 49.653 111.355 -74.682 92.813 63.295 72.872 107.276 91.984 74.087 114.713 -65.019 91.926 -57.547 144.509-144.050 125.177-155.702 168.528 -63.714 123.213-164.235 161.318-119.167 112.463-174.437 130.450-153.564 127.252 170.723 151.724 49.023 120.064 -93.259 150.658 -83.947 96.101 16.342 142.849 -77.471 93.643 78.197 148.671 -43.524 132.845-175.974 128.884 109.183 113.980 170.744 124.355 -63.640 128.015-151.306 137.968 -17.095 129.657-154.532 153.064-132.675 122.509-167.567 165.065 -32.794 128.657-153.518 171.888 13.102 118.857 16.032 123.295-130.341 92.025 110.163 131.069 -78.026 93.492 -20.300 174.066 -91.665 93.849 -64.320 137.990 148.919 92.181 7.410 129.798 -75.322 118.411-157.706 136.004 37.575 127.614-158.791 159.462 -19.956 116.884-162.522 131.769-108.395 135.298-159.770 141.219-173.977 93.832 -32.157 118.132-147.754 92.750 -80.839 128.599 -76.648 92.691 66.151 169.369-136.489 93.916 58.118 133.037-140.941 92.272 176.528 113.962-140.930 132.040-172.579 175.930 150.039 127.603-142.297 167.059 -88.201 124.732-153.512 137.384 171.080 93.062 49.178 154.861-162.842 92.660 36.746 155.111 -43.056 94.072 50.104 0.000 0.000 92.629 41.783 125.192-102.375 93.511 36.566 111.793 -67.169 96.250 37.197 0.000 0.000 94.744 39.360 125.700 -85.285 94.163 36.313 143.731-111.451 95.124 37.443 144.567 -74.981 94.597 38.694 125.439 112.265 93.600 39.376 144.517-126.108 92.969 42.716 151.334 -28.054 91.211 44.536 131.880 -78.928 92.429 44.653 128.269-100.582 91.338 41.833 140.908 81.987 93.653 43.041 115.939 -83.049 92.960 41.002 132.968-108.938 93.947 50.459 124.175-118.058 93.043 64.119 141.774 -74.501 94.686 81.518 123.502-128.079 118.017 0.000 132.089-155.774 # 117 total E -6.63739E+02 rmsd from N 0.000 %NC 0.00 1 91.576 58.636 133.530 -76.551 127.753 -82.227 176.428 -72.648 119.940-172.498 98.575 -73.938 136.766 -64.461 141.247 -84.551 120.528-169.954 143.564-128.142 113.690 -12.006 157.138 -6.004 94.724 -93.386 139.431 -73.412 91.179 57.865 71.971 -97.037 92.592 69.969 114.317 -52.787 92.153 175.004 155.004 -23.325 93.049 51.778 138.335 -75.846 112.730 168.330 127.382 -94.267 130.085 -80.328 126.337 -84.022 126.034 -26.727 166.936 174.261 93.305 122.073 123.983 92.408 126.608 178.267 164.478 -85.155 116.280 85.560 165.833-116.097 114.908 -80.434 113.347-122.770 117.617 -11.587 0.000 0.000 129.616-147.389 137.961 -12.801 93.704 -0.310 145.750 -74.388 125.577-168.178 126.540-128.528 117.504 -60.575 142.675 -88.546 93.457 -22.995 146.622-133.311 92.534 93.503 130.836 -77.241 127.574-154.094 171.247 -65.378 120.262-179.674 94.757 -94.189 92.482 30.366 129.661 -76.150 93.066 59.204 139.331 -68.563 93.820 56.095 115.656-138.622 91.670 66.548 129.038 -76.113 121.564-113.766 155.382 -94.128 91.861 83.645 139.529 -92.073 91.338 47.401 130.275 -76.944 93.195 40.935 166.710 7.708 93.053 41.702 141.733 150.139 92.109 41.260 128.188 30.705 92.998 44.604 119.691 -72.854 91.252 47.036 130.090 -77.046 92.556 48.964 127.996-151.936 92.798 69.989 158.800 -18.902 109.205-104.250 134.496-108.774 134.763 -78.526 0.000 0.000 92.418 52.297 135.813-106.999 92.927 35.301 89.336 -84.354 95.852 40.585 141.102 -25.486 93.276 43.309 125.827-102.771 91.907 42.649 146.750-117.306 92.517 42.015 143.905 -74.544 92.895 42.603 134.318 56.498 92.135 41.227 135.748-131.360 91.120 48.794 149.066-112.966 90.673 47.352 128.714 -76.353 93.111 39.697 147.242 -71.701 93.006 37.792 131.597 93.684 95.447 42.852 128.239 -95.698 93.247 39.595 121.427 -75.162 94.463 54.954 155.562 137.548 92.921 58.396 140.949 -73.877 94.830 81.539 121.174-139.208 118.069 0.000 131.628-156.858 # 118 total E -6.55051E+02 rmsd from N 0.000 %NC 0.00 1 91.569 60.821 136.086 -75.826 123.967 -82.663 132.986 -91.505 116.870-131.544 101.281 -71.566 128.878-121.834 138.038 -94.462 126.455-162.748 145.476 -90.619 131.052-139.180 150.743 -16.724 119.864-160.117 148.056-101.687 127.830-165.146 157.268 3.226 92.630 39.231 141.125 -86.062 113.549-161.281 146.133 -94.996 124.120-140.329 148.868 -90.157 124.172-165.642 167.754-153.188 105.402 -63.241 140.929 -98.742 97.106 -18.641 164.396-123.999 93.654 89.567 116.968 90.412 124.819-130.972 164.327 -48.220 123.020-176.737 147.465-153.208 134.124 -92.241 146.253-105.024 126.476 -6.766 167.044-117.212 118.348-164.930 126.521 29.856 137.281-152.485 142.610 -50.136 109.324-170.580 130.903 -84.911 137.033-128.378 140.607-120.253 116.779 -98.571 154.931 111.625 91.612 46.064 130.663 -78.356 92.519 40.932 144.143 -78.097 91.308 56.847 137.709-142.502 90.899 47.202 122.324 -74.687 92.002 37.021 108.738 -53.372 95.276 39.520 143.658 -74.712 92.029 44.551 129.220 -75.557 92.047 43.174 147.866-177.041 91.563 47.158 137.217 -37.054 91.047 51.879 129.288 -77.713 92.656 77.091 118.405 -53.458 91.760 8.448 148.395-149.433 107.758-153.579 141.586 -84.024 127.730-142.538 176.414 134.784 129.325-167.871 156.924 -85.435 122.940-166.942 136.849 153.520 115.828-179.197 154.844 16.165 109.050 -58.236 157.834-136.955 105.700 -21.104 164.220-142.818 93.779 89.751 127.958 -98.121 118.808-147.585 151.705-161.220 127.360-167.331 0.000 0.000 125.834-156.613 167.823-124.453 121.061-161.691 156.563 50.946 132.563-150.862 144.004 -88.489 127.270 -86.577 144.673 153.857 92.461 50.047 134.040 -96.312 91.802 47.210 145.768 -39.141 91.163 45.717 128.014 -75.031 93.255 41.801 111.443-112.954 92.057 42.074 132.650 82.665 94.133 43.975 145.744 -96.827 92.829 41.438 126.925 -70.644 93.467 61.737 125.039-121.811 92.362 77.106 140.306 -75.114 94.338 88.582 95.043 -90.613 117.544 0.000 136.099-135.188 # 119 total E -6.59617E+02 rmsd from N 0.000 %NC 0.00 1 91.568 40.870 111.875 -72.291 129.685 -81.647 138.365 -93.427 116.868 -96.526 127.366-130.012 91.549 48.338 131.719 -77.698 92.448 43.843 139.148 -74.074 92.654 48.000 167.678 -34.497 91.975 43.785 106.217 -64.538 92.916 38.462 126.890-114.147 92.202 43.268 132.848-110.894 92.272 44.612 153.357-164.653 91.719 48.694 122.143 -88.596 92.382 65.337 128.830-120.958 90.610 -79.012 138.523 -95.174 114.336 -48.761 151.724 49.023 92.967 147.771 132.368 79.745 94.651 68.052 139.931 -74.763 92.612 136.803 125.723 -97.845 93.336 -69.166 129.518 -98.414 93.251 15.934 0.000 0.000 125.236-102.626 130.106 -50.750 118.827-170.432 176.449-115.132 94.978 95.941 167.179 -74.153 93.604 -6.434 108.900 -87.060 94.300 -81.038 91.565 -23.734 92.924-175.658 150.528 -86.799 125.781-177.885 171.678 -59.114 93.065 42.633 101.499 -84.946 115.806 -92.205 145.692 -82.810 121.399-120.539 157.657 171.816 93.422 43.672 108.618 -66.389 90.710 53.592 133.347 -80.194 91.311 41.863 154.976 97.189 91.622 44.436 159.315-148.127 91.022 44.980 127.694 -75.878 92.256 43.159 133.467-108.694 91.651 44.410 121.558 135.999 91.294 44.254 117.395 -68.860 91.818 52.686 113.117 -58.742 90.968 45.586 129.479 -76.308 93.944 83.861 126.630-147.309 92.671 -63.714 154.873-177.068 94.734 -56.117 142.167-100.057 94.638 171.874 164.220-142.818 91.659 54.813 135.668-103.226 93.207 33.748 85.737 -83.932 97.092 37.109 0.000 0.000 95.761 35.113 120.333 -92.086 94.939 37.019 148.388-111.114 95.576 35.658 129.389-127.715 94.848 39.030 123.220 109.540 93.504 39.096 146.447-127.948 92.813 43.430 151.216 -29.826 91.160 43.991 137.758-101.695 92.580 44.522 127.206 -99.045 91.451 41.637 141.408 82.338 93.766 42.548 115.026 -82.805 93.023 41.264 133.047-113.356 93.936 50.261 125.004-117.019 93.021 64.311 141.839 -74.425 94.685 81.464 123.059-127.442 118.023 0.000 132.015-155.884 # 120 total E -6.57985E+02 rmsd from N 0.000 %NC 0.00 1 91.562 49.143 124.184 -88.214 122.564-107.939 102.320 -78.009 114.063 -92.317 105.200 -84.614 91.355 82.821 151.668 -89.711 93.704 31.426 141.361 -75.925 123.144-139.036 114.253 -66.786 121.858-141.561 134.998-131.715 127.406 -29.446 166.534 169.781 91.802-167.610 138.163-109.483 124.686-162.238 176.490 -2.868 123.286-164.582 169.524 -59.426 112.820 -76.341 163.184 172.863 92.632 -8.798 126.618-141.070 95.859 88.315 109.206-139.309 123.022-152.704 151.239 -57.754 126.188-164.337 140.939 -96.859 121.323-166.704 159.794-175.317 117.760 -9.187 114.840-123.023 94.281-173.265 106.140-118.379 130.550-120.698 140.636 25.828 120.274 8.677 118.849 -79.176 122.940-115.858 136.217 -93.130 94.047 85.729 154.090 164.347 92.105 107.802 140.689 -74.479 91.035 43.262 129.416 -75.812 123.865-151.630 135.730-128.812 94.734 20.372 154.195 176.581 107.031-159.446 147.650 -83.283 135.374-162.272 135.685 11.824 123.412-147.515 130.655-125.134 128.798-160.441 149.833 -71.683 99.898 -38.263 144.992 120.715 94.360 -79.842 145.734-117.809 91.033 72.150 129.170 -76.015 93.934 50.575 89.463 -77.017 111.977-171.611 148.457 -66.161 123.982-164.294 137.412 150.366 129.724-143.213 153.225-161.138 135.763-168.340 112.444 -35.600 96.452 15.039 135.726-147.160 126.040-130.069 166.218 -4.762 114.799 177.462 136.219 155.104 94.770 66.792 0.000 0.000 92.981 47.012 130.157 -87.950 94.078 32.856 98.273 -74.782 97.586 35.426 0.000 0.000 96.094 35.461 126.364 -86.267 95.349 33.136 111.458 -58.271 97.101 34.070 166.931 -82.268 95.902 36.064 122.931 115.146 94.423 37.881 146.936-148.880 93.283 42.569 151.731 -27.321 91.250 44.311 131.192 -78.580 92.456 44.573 130.580 -98.205 91.325 41.755 140.373 82.462 93.656 43.143 115.386 -82.428 92.955 40.915 132.966-108.345 93.961 50.445 124.484-118.128 93.049 64.102 141.759 -74.489 94.687 81.552 123.635-127.968 118.018 0.000 132.070-155.755 # 121 total E -6.66278E+02 rmsd from N 0.000 %NC 0.00 0 91.613 111.112 134.059 -72.299 125.578-157.618 170.645-129.711 94.600 67.502 117.168-108.597 92.157 165.407 156.269-101.949 93.727 13.680 165.960-103.799 97.651-168.232 114.075 -43.799 128.117-162.354 114.500-121.332 116.892 5.725 140.131-135.978 103.659-159.462 101.276 -54.218 125.664-161.527 141.030-154.097 125.492-171.779 149.653 -86.000 115.501 -63.074 161.921 130.877 92.741 -22.093 121.938-124.339 95.123 97.681 0.000 0.000 119.072-145.635 139.825 -68.855 124.918-163.600 166.080 -43.058 127.650-147.757 156.343 172.446 130.605 -9.087 121.044-124.418 96.629-175.292 124.355 -63.640 125.487-155.558 131.945 45.721 95.415 22.965 101.764 -78.559 117.000 170.954 116.402 -93.491 136.299-114.986 134.554 98.411 111.320 -14.878 155.638-131.858 126.021-127.335 90.979-136.249 130.386-165.009 92.280 -48.800 93.786 15.815 151.356-147.442 120.787-157.203 132.884 -87.525 128.423-150.106 146.012-127.249 96.081 -32.169 162.361 -94.320 91.992 -82.120 129.218 -76.069 91.722 70.856 141.374-126.290 93.791 52.314 163.090 179.114 113.075-159.721 144.190-111.693 130.900-163.295 139.977 138.498 112.511 9.859 156.649-146.220 106.309-157.377 121.894-121.410 124.131-157.425 113.211 -23.744 131.966-167.760 133.553-134.544 95.685 98.895 136.328 -32.504 124.120-117.531 131.998 -77.999 94.725 58.050 141.553-108.352 94.599 67.652 164.220-142.818 92.606 66.083 87.214 -81.437 93.236 60.503 98.311 -76.898 95.322 62.275 0.000 0.000 115.159-177.879 117.907 -78.058 125.340-177.009 155.347 64.407 122.201-169.833 147.369 30.480 136.751-145.977 144.430-141.412 122.350-167.731 170.542-160.453 117.479 -63.903 145.628 4.265 92.016 -21.305 129.544 -76.290 96.020 90.520 141.952 -73.332 126.490-136.460 167.635-105.707 128.664-161.229 143.511 -50.929 126.268-160.010 167.738 154.604 129.527-168.932 149.118 -88.497 121.206 177.219 164.702 -83.474 94.921 61.660 141.285 -74.378 117.364 0.000 139.607-173.559 # 122 total E -6.61403E+02 rmsd from N 0.000 %NC 0.00 1 91.567 60.194 133.138 -69.911 125.005 -83.937 131.433 -83.799 116.785-106.047 136.083-144.204 91.286 61.554 131.540 -77.458 92.839 46.677 143.001 -78.302 93.565 42.192 145.751 -72.687 92.709 54.634 164.971 175.153 92.537 57.969 125.256 -71.496 91.706 73.974 105.885 -50.725 91.675 -71.530 116.237 -74.492 98.544 -62.028 122.180 -85.638 116.895-158.350 159.447 128.666 122.567 153.715 146.885 -62.241 94.656 46.859 164.396-123.999 114.943-170.031 169.886 -38.543 121.151-167.008 161.237 19.940 125.170-156.665 152.172 179.669 117.912 167.496 117.801-119.220 130.711 -36.529 151.550 -22.359 102.455 -37.685 110.062 -70.205 94.501 82.664 96.622 -81.601 126.252-134.625 129.297-110.944 127.253-152.313 160.326 1.472 123.714-165.818 158.221-123.438 123.601-159.117 152.519 -82.369 121.977 95.444 170.494-130.971 93.498 -11.135 153.179 -11.601 92.487 -75.156 128.133 -76.549 116.942-172.705 152.974 59.349 129.185-154.960 124.985 -2.552 121.300-162.126 153.472 -89.529 128.067-160.601 158.216-165.954 94.536 -32.587 120.783 17.537 91.732 -80.461 128.266 -76.371 92.574 66.830 139.411-128.125 93.955 58.066 125.283-134.918 92.553 178.152 112.794-142.825 125.504-170.240 159.625 171.882 130.769-143.098 159.515 -82.116 125.746-158.087 137.933 164.739 93.588 75.750 145.421 -29.051 94.456 40.687 120.008 -85.860 96.258 39.549 0.000 0.000 122.103-105.176 145.649 -86.372 115.424 -87.285 109.659 -79.990 95.163 48.544 0.000 0.000 92.753 53.891 116.189 -91.596 92.862 40.187 121.643 108.486 96.007 32.874 155.873 -19.200 95.520 38.115 125.213 105.364 94.698 36.105 168.456 -20.892 93.872 40.942 135.133 -31.616 91.455 43.428 131.607 -80.147 92.969 45.370 143.558 -73.741 91.351 43.302 138.065 -63.372 93.795 42.126 111.671 -80.581 93.812 36.964 127.734-109.966 94.709 51.551 128.217-124.552 93.070 62.066 142.986 -78.445 94.705 82.658 122.499-122.219 118.158 0.000 130.355-156.528 # 123 total E -6.49128E+02 rmsd from N 0.000 %NC 0.00 1 91.567 57.251 127.901 -64.111 127.519 -74.432 142.928 -92.846 115.558-145.291 143.020-157.304 91.437 57.151 131.450 -77.175 92.596 39.329 141.661 -76.405 93.691 48.139 148.861 1.946 94.111 40.141 131.570-102.943 94.485 46.997 117.823 -88.037 93.185 48.929 118.893 -53.263 93.233 -81.824 121.264 -75.016 123.675-150.096 146.384 -74.428 119.424 162.126 143.705 -96.207 96.061 -58.288 136.270-107.133 92.863 28.831 151.724 49.023 119.373 -77.583 142.619-123.817 137.717-168.209 152.376 -84.360 132.946 147.684 163.154-175.882 117.260 -88.152 74.667 90.610 95.719 11.215 0.000 0.000 93.634 73.993 129.439 -52.932 96.497 156.494 138.647 -1.937 95.347 178.422 134.780-104.885 92.980 82.812 168.767-127.418 91.835 45.834 124.428 -74.798 91.211 73.474 131.412 -77.980 92.969 86.531 141.515 -75.890 92.981 118.379 142.826 -9.955 117.380-105.223 134.445-106.188 92.442 43.404 111.994 -48.968 92.273 50.196 142.978 -74.322 90.661 52.554 127.715 -82.214 90.057 44.745 139.662 102.414 90.240 47.560 153.775-136.561 90.440 49.745 128.238 -76.316 91.506 42.236 162.427 -15.814 91.136 46.755 147.711-140.628 90.845 50.939 125.009 -83.788 91.101 51.243 110.083 -47.028 91.161 43.045 129.223 -76.199 94.490 89.309 128.070-147.893 92.934 -60.971 156.804-168.905 94.459 -56.211 142.062-102.021 94.584 164.275 0.000 0.000 91.161 70.042 134.177 -98.669 93.152 36.709 86.800 -84.234 95.784 63.111 0.000 0.000 94.105 78.001 136.680-100.150 126.106-145.407 146.477 168.612 128.934-162.219 165.625 -74.404 130.274-108.955 119.250 -93.094 131.873-168.717 173.643-176.720 113.306 -62.363 141.243 15.802 91.715 -23.700 129.646 -76.406 96.107 88.982 163.206 -61.798 126.989-122.130 162.784 -80.399 126.955-171.480 169.328 -98.889 132.530-105.216 168.017 94.036 122.578 -97.024 93.600 -63.888 124.889 165.081 133.033 -70.132 94.426 91.607 116.922-124.748 118.516 0.000 112.550-130.226 # 124 total E -6.64912E+02 rmsd from N 0.000 %NC 0.00 1 91.568 59.555 134.876 -74.610 128.506 -72.569 135.768 -93.565 119.767-160.094 116.930-113.742 130.985-143.161 168.699 -88.748 119.582-168.077 168.646 -86.640 135.108-155.604 157.118 -0.576 93.023 37.773 141.714 -76.882 110.739-172.446 103.542 -40.858 134.286-145.131 119.019 54.752 106.331 -73.191 167.484 162.260 124.000-154.803 169.931 -64.156 123.872-171.061 168.160-165.827 104.492 -58.639 128.138-114.202 98.197 -23.439 151.724 49.023 93.641 85.168 120.606 100.548 130.089-109.775 148.513 -93.209 126.052-171.741 151.696 90.422 135.484 -63.388 157.482 -83.810 129.197 -3.423 152.191-110.805 133.179 -51.729 111.403 63.427 139.688-161.129 141.700 -77.437 128.110-140.146 126.327-116.872 96.034 40.612 112.413 -91.369 116.908-174.537 152.641 -96.213 142.000-160.297 155.551 -84.236 114.677-158.340 134.630-123.490 131.041-176.369 143.342 -40.195 123.634 -91.557 132.729 -73.518 92.134 43.763 121.101 -62.624 92.360 53.164 114.769 -35.812 90.743 49.581 128.556 -77.870 91.290 41.767 115.933 -49.924 91.868 44.761 140.377 -55.968 91.070 45.531 131.862 -79.160 91.993 45.057 126.925 -38.537 91.305 42.663 145.357-146.564 91.481 42.068 118.204 -75.804 92.894 42.575 119.766 -64.033 91.030 47.298 129.267 -77.554 91.599 44.100 125.196-147.336 91.788 48.106 152.331-147.554 93.061 35.412 120.592 -84.344 94.408 47.752 105.353 -74.986 92.755 41.747 134.644-107.250 93.507 36.118 113.633 -62.987 96.301 37.117 0.000 0.000 94.777 39.102 122.047 -80.942 94.184 36.358 145.454-113.240 95.096 37.449 144.577 -74.997 94.553 38.854 126.425 112.546 93.504 39.609 144.543-125.726 92.879 42.903 148.927 -25.538 91.229 44.173 131.432 -78.606 92.645 43.603 127.217-101.446 91.547 41.456 141.308 82.604 93.784 42.819 141.606 -75.920 92.895 41.263 133.018-105.292 93.798 50.743 124.503-116.828 92.953 64.037 141.685 -74.987 94.690 81.217 125.309-127.149 118.007 0.000 132.220-155.985 # 125 total E -6.72373E+02 rmsd from N 0.000 %NC 0.00 1 91.569 61.417 136.176 -75.296 124.037 -90.178 133.477 -92.672 125.956 118.291 102.425 -90.434 92.163 23.246 129.989 -76.744 123.501-141.420 167.996 -55.916 122.573-140.861 153.559 -23.757 95.680 44.909 139.015 -70.514 127.021-176.507 110.455 -65.596 119.069-171.444 131.125 47.629 127.340-163.623 132.640-106.467 98.846 158.415 138.334 -71.356 94.064 56.727 128.906 -99.160 95.136 125.631 152.314 36.880 104.379 -7.434 151.724 49.023 92.289 -79.082 122.917 -75.571 92.281 63.797 120.880-103.616 118.814 -60.806 135.933-106.292 117.716 155.170 165.832 -99.800 123.915 34.593 0.000 0.000 133.930-172.088 149.591 27.205 118.487-163.689 176.432 -44.454 126.051-153.070 171.128 -64.735 95.642 44.796 112.694 -78.341 117.169-173.229 167.249 -60.179 138.506-103.160 160.807 -83.798 126.806 -15.309 109.137 -84.088 108.099-135.844 140.224 14.657 91.050 46.976 160.155 -93.856 91.882 39.070 134.952 -89.289 94.379 41.276 143.629 -73.810 91.667 43.716 126.753 -78.733 91.746 44.165 151.406 135.468 91.385 44.807 142.786 -56.663 90.920 44.797 127.542 -75.792 92.341 43.550 128.074-118.051 91.862 43.804 142.276-144.178 91.668 41.408 119.263 -76.285 93.069 43.882 111.297 -59.101 91.310 53.498 129.833 -76.274 92.479 52.961 125.678-146.341 92.868 73.324 154.569-127.205 117.005-101.916 136.957-120.623 136.230 -69.443 0.000 0.000 92.662 50.155 138.071-108.827 92.525 35.861 90.171 -83.816 95.036 44.243 0.000 0.000 92.639 44.079 127.659-100.290 92.192 38.216 142.525-123.748 92.611 43.150 140.819-123.717 92.118 45.933 132.526 118.613 91.196 43.707 141.645-118.291 91.512 41.992 149.123 -29.979 90.796 48.082 132.306 -77.326 91.514 45.663 124.724-110.338 90.799 42.189 135.751 70.368 93.146 45.143 134.751 -97.949 92.279 43.028 131.747 -98.819 92.962 64.480 121.686-122.914 92.183 80.805 141.080 -75.149 94.222 99.980 93.824 -92.907 117.741 0.000 129.657-124.039 # 126 total E -6.49892E+02 rmsd from N 0.000 %NC 0.00 1 91.601 2.868 132.892 -82.330 126.375 -97.823 131.828 -85.823 91.989 54.842 138.040-161.642 90.955 45.540 129.733 -76.355 92.309 49.098 148.886 94.222 92.714 37.563 167.522 -67.153 93.259 40.248 104.068 -51.925 92.902 46.521 137.835-110.498 91.704 37.624 110.757 25.530 93.471 38.916 139.974-107.032 95.182 41.639 118.914 -81.603 95.276 36.207 114.766 -82.944 96.116 37.810 165.041 174.073 96.901 45.273 149.787 -84.835 94.009 96.120 143.243 -93.234 96.643 -11.829 141.436-104.275 93.535 -75.686 140.626-146.655 92.973 -7.423 151.700 93.154 96.285 98.512 118.346 62.818 130.753-121.768 145.436 11.930 121.524 148.184 163.748 -34.553 94.421 125.618 93.446 -80.812 96.346 142.368 117.173 -94.361 92.370 53.299 131.861 -78.098 92.084 113.016 130.343 -77.577 92.342 -29.292 164.431 71.867 92.543 -59.506 147.798 -25.422 91.625 3.972 129.178 -76.009 124.285-118.796 137.507 16.595 125.798 172.260 112.598 -47.677 120.605-110.612 138.200 -85.963 91.648 43.553 129.759 144.849 91.325 52.108 139.666-135.210 90.882 49.433 127.684 -74.928 92.238 39.097 157.579 -96.247 92.088 55.431 144.218-150.369 91.172 52.637 130.975-108.955 92.089 45.509 94.000 -61.349 91.225 57.576 129.312 -73.351 93.737 79.298 131.788 171.747 92.218 -69.187 158.881-151.336 94.163 -57.990 143.854-103.824 94.524 161.517 102.580 -55.005 93.153 61.387 106.731 -79.367 93.862 147.370 81.864 -86.743 94.683 53.327 0.000 0.000 118.844-171.721 149.865 -84.875 124.380-169.120 153.578 179.925 126.638-171.505 157.979 27.537 133.161-136.069 135.929 136.661 125.371-167.044 159.261 -17.876 116.048 -65.189 144.670 -19.080 91.759 -21.049 129.530 -76.551 95.973 88.425 162.465 -57.316 127.718-130.436 173.910-122.652 129.017-158.587 168.629 -47.229 117.717-159.162 134.711 -50.680 127.109-165.834 138.407-100.323 122.072-176.205 140.224-139.564 95.323 81.160 139.462-108.146 116.397 0.000 134.038 -91.513 # 127 total E -6.59083E+02 rmsd from N 0.000 %NC 0.00 1 91.569 62.340 139.168 -74.469 136.374 -50.457 144.495 -92.413 117.017-136.352 103.098 -70.779 124.690-134.771 136.520-119.746 127.945-136.122 144.609 -84.212 129.421 -70.388 153.618 28.386 126.130 89.653 142.103-108.321 117.773 -3.969 129.438 -68.292 122.777-105.625 130.806 56.378 127.342-126.167 145.754 -90.084 124.205-150.308 171.420 -67.902 124.625-165.677 168.487-162.272 107.568 -62.451 132.573-120.089 98.460 -18.756 136.532 -81.507 93.558 85.347 141.229 -90.896 128.755-126.417 148.335 -97.773 126.385-166.232 171.746-161.835 126.090 -81.022 148.003-101.578 124.250 -34.292 133.067 -61.058 132.855-140.082 143.967 82.460 96.245 88.244 142.534 -74.647 124.148 -21.286 117.314 -58.238 124.279-113.867 112.255 -72.018 127.209-150.436 154.979 126.502 131.043 -99.009 149.822-100.906 127.669 -25.022 172.173 -52.643 114.960-111.389 157.233 -15.804 90.979 46.102 129.226 -75.781 91.536 45.951 114.888 -45.628 93.377 41.271 143.300 -73.626 91.346 44.835 131.362 -78.931 91.758 42.740 131.004 120.500 91.431 44.612 144.524 -60.556 90.919 44.411 127.023 -74.750 92.598 43.141 164.398-176.673 91.954 42.401 144.169-142.870 90.898 50.691 118.652 -77.235 91.667 57.516 101.430 -36.684 90.540 59.533 128.921 -76.216 92.575 59.616 127.180-149.332 93.419-149.645 149.454 -19.342 93.020 59.085 140.851-109.534 94.436 60.451 153.032-115.937 92.470 45.370 136.311-107.297 94.009 33.896 100.659 -72.464 97.880 30.936 0.000 0.000 98.299 31.775 121.884 -82.893 96.378 31.537 114.996 -48.379 97.142 34.768 155.157 50.048 96.096 33.720 118.887 127.266 94.649 37.767 148.592-148.871 92.969 44.689 150.009 -25.842 91.067 45.168 133.097 -76.156 92.717 41.511 143.873 -74.425 91.564 43.096 141.587 -85.948 92.794 47.311 105.877 -69.664 92.150 44.001 134.901-101.841 93.107 43.962 123.318-118.833 93.124 66.728 143.094 -75.612 94.775 85.643 135.170-125.216 117.527 0.000 137.486-140.862 # 128 total E -6.54782E+02 rmsd from N 0.000 %NC 0.00 1 91.569 59.964 134.758 -77.564 123.457-109.763 115.837 -86.493 91.898 60.014 130.090-147.539 90.867 54.071 133.456 -78.465 91.952 44.589 141.178 -75.588 93.122 39.985 144.350 -73.673 93.464 46.314 142.703 -75.529 92.863 63.612 125.128 -65.688 91.190 76.863 111.027 -48.136 91.527 148.818 118.867 -92.966 95.321 107.733 140.529 -75.776 117.738-107.765 162.431-139.274 94.763 35.305 140.910-109.868 95.080 64.602 139.049-111.457 94.568 -92.433 151.878-109.068 118.663 87.111 171.292 -67.075 92.274 80.148 160.772 178.692 92.518 12.204 107.558 126.343 111.990 -67.595 0.000 0.000 125.179-161.022 136.625 -22.984 126.494 -86.491 128.558 -83.763 94.460 57.402 168.889 -76.636 93.785 70.089 95.421 -68.890 92.361 53.820 156.198 135.490 91.993-167.557 134.543 -80.183 92.738 59.805 143.116 -78.076 92.607 110.694 134.987-128.412 128.888 -90.409 132.245 -97.111 92.131 51.622 100.893 -66.888 93.812 39.594 113.046 -49.164 91.629 46.910 125.937 -75.472 91.876 39.447 153.275 137.207 92.257 44.251 138.247 -44.404 91.385 42.578 128.488 -75.994 92.682 42.843 132.236-104.861 91.816 41.203 122.865 135.725 91.303 43.762 112.667 -62.345 92.350 45.383 129.062 -72.528 91.207 45.020 128.883 -74.929 92.562 48.148 126.266-148.638 92.370 51.770 151.624-118.717 105.322-134.960 117.004 -87.075 94.590 130.086 0.000 0.000 125.884-119.380 85.341 -61.722 119.215 -74.954 113.755 -76.835 94.776 54.771 0.000 0.000 92.213 49.034 115.210 -89.454 91.938 43.366 130.484 87.402 93.285 41.641 150.540 18.474 93.028 39.829 124.189 94.811 93.165 38.734 137.227-142.090 93.095 43.174 144.574 -21.660 91.157 43.182 133.666 -79.604 92.331 45.138 143.464 -72.028 90.956 43.254 138.373 -65.483 92.923 44.702 109.856 -74.099 93.254 36.719 133.275-118.006 94.486 52.648 124.205-109.307 92.945 72.779 144.680 -77.300 94.412 88.960 126.590-130.665 117.483 0.000 136.851-133.708 # 129 total E -6.57687E+02 rmsd from N 0.000 %NC 0.00 1 91.567 60.210 135.521 -76.674 123.445 -84.610 127.656 -92.095 116.257 -93.654 111.433 -82.751 91.428 55.563 154.896 -87.209 92.622 41.839 121.924 -74.164 93.308 44.826 170.709 -73.541 92.847 40.229 105.758 -60.303 93.143 43.004 135.435-117.389 92.044 40.918 113.690 33.127 92.296 43.591 148.614-106.886 91.740 53.262 119.768 -87.286 92.166 46.437 133.176-118.830 93.841 36.422 151.595 39.768 95.801 82.582 135.767 -96.570 96.258 -60.347 131.165 -72.623 94.496 102.573 117.266 -68.302 92.343 129.080 131.859-146.050 104.083 -73.284 121.307-107.399 94.219 15.277 0.000 0.000 123.685-162.708 138.542 28.922 132.047-136.236 130.095-136.757 119.403 109.369 164.464 -30.995 123.164 -96.478 119.934 -99.350 123.847 -95.138 133.762 -58.123 91.045 49.799 131.109 -77.806 92.107 37.981 141.463 -77.474 91.484 48.240 143.591-154.898 90.805 47.302 125.379 -76.316 91.154 39.538 111.739 -47.303 92.991 41.608 143.846 -74.953 91.136 45.936 126.831 -75.387 91.448 44.323 137.172-113.876 91.256 42.879 143.118 109.008 91.097 43.349 127.989 -76.093 92.012 58.551 118.769 -90.547 91.193 70.602 112.661 147.682 90.979 131.651 122.937 -92.794 97.885 80.987 136.418-136.721 91.675 -71.279 132.362 -78.429 92.232 -35.158 97.014 -94.433 92.379 96.158 158.813 -7.295 119.624 -61.673 143.773-121.214 129.067 -43.663 0.000 0.000 131.532 176.556 149.606 -64.887 92.526 19.622 140.047 -20.883 134.589 -14.204 0.000 0.000 134.433-124.351 134.660-110.895 122.270-150.733 133.751 62.459 130.892-165.790 158.367 30.422 129.984-144.132 135.952-133.544 132.203-171.709 121.237 -79.714 126.280 -78.579 151.099 -2.289 92.286 -6.703 132.739 -78.638 97.187 77.892 138.410 36.811 134.690-154.177 160.718 176.232 123.092-160.999 164.618 -9.084 129.173-142.976 166.014 5.634 129.847-159.884 137.406 -54.518 120.492-174.175 143.980 -83.116 126.677-118.839 155.036-167.918 118.020 0.000 148.452-161.349 # 130 total E -6.67110E+02 rmsd from N 0.000 %NC 0.00 1 91.568 51.319 133.074 -72.537 95.385 151.018 125.176 -88.731 93.262 74.372 141.575-167.753 91.945 -13.850 130.380 -76.756 119.798-124.520 142.629 -79.615 133.438 -11.554 139.400-103.100 129.293-115.980 122.641 -60.415 131.670-107.110 94.556 -59.836 135.080 168.652 104.107 -67.390 92.371 15.480 172.686-154.685 120.857-154.249 171.978 -45.336 128.286-156.642 156.633-113.150 94.086 3.907 176.401-142.474 128.565 -84.269 166.847 -66.420 93.018 115.497 142.497 97.792 94.766 91.811 100.391 -70.690 92.087 118.906 138.370 100.139 92.134 -9.852 107.214 120.761 116.846 -46.942 125.182-111.575 131.838 -84.821 163.636 -59.442 129.237-146.704 153.572 47.014 95.685 36.673 113.692 -55.520 121.405-156.521 169.135 -68.583 131.196-168.589 116.916 -71.995 116.693-174.486 164.487 -80.253 94.400 96.059 128.033-121.961 93.007 -8.495 105.371 -86.548 92.461 -81.766 124.919 -77.534 100.353 179.242 138.744 32.627 129.215-166.427 171.251 -42.934 129.219-157.366 148.672 -88.766 133.467-162.453 153.920-173.065 93.564 -30.825 148.503 44.427 91.651 -81.803 128.773 -76.240 92.724 62.908 136.988 -92.936 93.933 61.446 128.756-140.416 92.425-178.759 113.561-147.950 135.236-165.158 161.706 151.322 130.682-156.141 138.923-147.473 136.647-172.198 143.719 42.824 94.682 130.575 151.060 -23.027 132.509 -82.489 152.057 -69.207 124.521 -3.897 146.548-108.735 123.264-112.169 106.952 -75.270 94.426 62.377 99.375 -79.404 127.495 -17.737 0.000 0.000 93.457 49.444 110.672 -84.211 94.876 26.876 146.259 -82.830 97.734 38.202 168.304-115.601 97.137 28.300 110.578 129.961 97.795 30.974 148.591-137.339 95.937 40.588 150.270-162.245 92.175 42.207 129.137 -75.039 93.356 42.041 143.397 -78.007 92.057 39.798 133.893 84.728 93.981 46.369 110.389 -85.735 93.389 37.535 135.132-106.644 94.197 64.058 124.688-127.523 92.790 78.209 143.301 -75.996 94.259 96.458 117.163-150.425 117.687 0.000 131.995-127.563 # 131 total E -6.69436E+02 rmsd from N 0.000 %NC 0.00 1 91.571 60.949 136.102 -75.412 123.758 -82.982 132.569 -91.861 122.276 174.331 108.346-103.470 131.747-161.334 147.290-106.109 124.306-154.800 161.751 -55.397 94.168 21.987 128.044 -97.103 117.451-160.138 129.512 -76.174 117.503 167.881 117.144-127.927 91.987 95.128 115.502 -45.162 118.027-170.418 108.605-106.560 121.841-106.175 127.405 -90.321 103.299 -49.688 158.355-142.221 92.502 -33.262 110.991-165.045 94.505 94.684 151.724 49.023 122.790-114.779 133.811 -86.000 122.786 -80.119 161.956 10.399 119.749-143.036 140.893-123.786 93.406 46.457 125.770-108.261 94.802 123.824 124.355 -63.640 114.516-155.741 132.056 -64.223 95.193 16.325 153.133 41.025 128.702-159.545 121.364-125.260 128.818-164.999 130.533 -72.128 118.835 -70.973 162.158 135.864 92.334 -16.109 130.589 -77.275 95.639 88.095 142.757 -76.794 124.964-147.331 156.532 -17.282 130.317-156.157 134.628-157.486 121.616 14.005 131.968 41.444 95.583-176.884 140.095 -76.646 140.926-124.201 133.328 -21.884 120.305-141.525 153.866 -19.396 92.581 70.517 135.056-139.955 90.894 57.017 131.209 -75.640 92.701 39.195 131.113-154.908 92.068 49.869 126.642 102.931 91.217 45.566 126.454 -94.590 92.531 43.363 114.973 -66.860 91.107 46.333 130.695 -76.212 91.843 45.224 132.745-144.961 91.707 48.292 152.819-154.426 93.008 35.507 120.300 -84.951 94.403 47.733 0.000 0.000 92.758 41.784 133.806-106.953 93.492 36.165 113.705 -62.933 96.283 37.171 0.000 0.000 94.770 39.094 122.471 -81.480 94.183 36.361 145.184-113.102 95.099 37.447 144.582 -74.990 94.556 38.853 126.355 112.608 93.513 39.581 144.557-125.711 92.890 42.890 148.927 -25.533 91.230 44.172 131.451 -78.620 92.644 43.603 127.213-101.394 91.548 41.449 141.310 82.610 93.788 42.812 141.604 -75.920 92.893 41.273 133.046-105.328 93.803 50.740 124.523-116.809 92.950 64.025 141.686 -74.986 94.690 81.215 125.297-127.133 118.008 0.000 132.217-155.991 # 132 total E -6.56147E+02 rmsd from N 0.000 %NC 0.00 1 125.797-125.383 160.729-104.502 128.228 -94.304 129.642 -77.703 91.784 57.201 134.945-156.724 91.125 43.391 130.714 -77.631 92.741 45.442 153.109 83.106 93.614 36.883 145.104 -73.755 93.449 41.900 138.014 -68.279 92.897 44.384 120.961 120.018 92.064 40.562 162.018 -56.829 92.801 40.581 136.491-118.807 93.387 63.169 142.579 73.424 91.130 69.580 128.506-100.851 91.985 14.919 121.861-117.140 107.054 -92.001 0.000 0.000 119.389 161.079 133.397 91.316 94.164 96.059 164.045 -16.785 92.079 89.320 139.927-143.564 92.396 0.559 117.941-108.432 98.654-103.221 167.044-117.212 128.360-169.921 133.553 26.951 93.611 21.562 125.008 -53.145 122.311 -90.708 145.732 -87.158 95.679 99.772 124.997-110.259 93.531 47.450 138.503 -67.800 124.785-152.678 165.130 -79.467 116.159 90.424 167.236-112.738 93.207 -27.596 109.356 -81.385 115.153-159.246 145.971 -78.470 130.659-136.082 154.432-116.086 92.724 45.427 94.589 -50.629 90.708 51.692 131.564 -78.467 90.988 41.880 140.438 167.853 90.645 50.313 140.936 -47.911 90.327 52.723 127.507 -75.569 91.895 38.331 133.732-130.273 92.485 45.987 133.313-140.265 91.545 47.155 120.039 -67.164 91.555 54.167 121.870 -93.004 90.950 42.990 129.072 -75.979 93.937 86.351 128.692-148.894 93.002 -61.775 155.984-161.872 95.093 -58.548 143.764-104.185 95.059 164.723 0.000 0.000 91.746 81.055 128.103 -95.317 92.998 62.947 89.118 -88.873 94.830 105.870 0.000 0.000 116.277-113.131 114.409 -99.963 92.819 45.761 163.309-117.184 92.668 43.925 134.483-115.223 92.403 47.455 128.127 124.026 91.760 41.295 142.497-109.483 92.400 42.804 147.598 -27.001 91.414 43.139 134.859 -80.009 92.450 45.033 132.826-126.442 91.052 41.023 136.952 80.612 93.313 46.860 141.973 -75.982 92.476 38.080 127.744 -98.272 94.231 56.453 118.974-119.942 92.830 72.324 141.137 -74.818 94.434 87.364 127.033-141.276 117.561 0.000 136.339-138.464 # 133 total E -6.95235E+02 rmsd from N 0.000 %NC 0.00 1 91.607 110.455 133.836 -76.742 125.397 -82.241 148.167-104.486 117.735-169.177 124.749-126.172 132.198-166.637 150.256 -79.120 122.517-172.331 167.751-139.730 94.769 92.582 117.570 -92.006 96.520 40.142 167.915-101.213 104.045 -71.506 104.916 -32.104 90.225 -25.015 112.303 -43.356 114.742-169.562 163.387 -1.289 122.941-156.924 172.346 -59.676 127.210-157.004 163.404 143.125 94.569 23.725 109.238-139.182 114.970-172.173 162.751-120.528 127.071-173.132 135.352 55.573 119.510-170.561 133.107-111.701 118.839 -72.974 147.135 119.986 92.948 -12.122 106.123-118.368 95.326 93.069 156.391-120.170 122.876-158.179 130.625 -45.497 124.235-168.294 129.235 -69.932 127.937-161.586 128.843-131.875 95.219 25.758 143.867 -74.894 110.895-171.235 137.154 73.351 130.421-162.214 163.584 -84.066 115.012-145.602 135.808-137.639 93.859 37.241 146.129 9.207 92.379 42.109 128.265 -74.796 94.017 36.889 141.164-125.359 95.138 43.574 160.612 30.690 91.850 39.266 128.285 -76.247 93.893 36.181 153.241 -91.928 93.662 42.764 139.171-133.985 91.751 42.461 127.500 -75.438 93.086 41.048 111.916 -73.581 92.469 40.182 143.548-140.453 91.762 42.784 117.821 -75.872 93.110 41.413 132.652-141.187 91.159 46.772 128.066 -76.144 91.897 43.832 127.370-148.574 92.133 46.051 150.083-131.305 93.590 35.331 120.999 -86.135 94.760 44.383 0.000 0.000 92.805 41.949 136.775-109.732 93.597 35.513 139.172 -22.694 96.271 37.911 0.000 0.000 94.642 39.045 121.364 -79.482 94.035 36.660 145.602-115.212 95.309 37.041 165.327-113.170 94.547 39.039 126.891 111.057 93.463 39.648 144.548-125.763 92.835 43.034 148.668 -26.259 91.209 44.204 131.388 -78.567 92.631 43.608 127.151-100.957 91.546 41.480 141.355 82.612 93.788 42.793 141.566 -75.922 92.896 41.276 133.090-105.386 93.802 50.743 124.515-116.754 92.950 64.057 141.690 -74.985 94.690 81.207 125.288-127.155 118.006 0.000 132.224-155.987 # 134 total E -6.83455E+02 rmsd from N 0.000 %NC 0.00 1 91.601 108.099 129.962 -63.975 124.207-173.250 143.722-115.478 94.845 63.132 110.960 -84.740 92.741 179.210 157.805 -92.337 93.930 45.883 142.285 -77.290 133.168-159.193 131.527 -58.199 119.573-147.201 146.808-137.484 131.240 -16.566 165.997 143.801 93.413-171.516 112.775 -38.802 124.845-164.935 176.484 1.824 124.451-170.428 169.940 -73.719 120.442 -63.355 138.657 90.475 92.962 -20.303 138.704-108.497 95.263 97.185 151.724 49.023 118.624-154.554 141.185 -70.975 124.344-162.875 163.806 -42.728 122.808-166.867 151.613 170.366 116.099 -3.925 133.975-113.279 94.516-176.793 118.346 62.818 134.651 -94.861 144.531 -21.353 136.008 -8.213 140.093 -78.354 138.567-167.744 79.757 -79.904 130.943-137.854 158.876 73.211 94.141 -16.722 154.316-149.871 119.639 142.604 144.554 -88.092 117.810 -79.016 159.179 156.756 94.547 -68.634 148.621 -23.632 91.937 39.144 129.852 -76.458 123.336-141.478 146.253-103.368 125.798-168.821 129.753 -41.745 126.799 -99.162 141.609 -86.343 91.410 48.882 156.652 37.904 91.071 48.366 134.454-133.131 90.605 51.414 127.307 -74.111 91.818 45.763 131.391 -44.569 91.694 64.728 150.463-140.418 91.426 60.058 134.403-102.998 92.234 108.405 109.440 -83.984 91.262 62.022 128.366 -75.697 94.351 81.327 132.350-162.018 92.491 -67.504 158.041 8.891 93.942 -54.886 156.238 -46.263 94.197 164.724 164.220-142.818 92.340 51.571 127.838 -85.765 94.760 32.885 77.360 -85.870 98.677 31.280 0.000 0.000 98.080 31.719 120.625 -87.601 96.844 29.964 107.571 -47.917 97.433 35.574 169.940 -30.590 95.737 35.097 114.451 141.614 94.487 36.700 155.411-135.013 92.884 43.624 161.019 -8.234 90.839 47.130 131.607 -78.922 91.394 42.651 126.580-111.019 91.203 41.556 140.726 80.375 93.296 45.062 133.692 -88.592 92.641 39.941 130.353-103.924 93.966 48.736 121.395-120.097 93.136 63.176 141.690 -74.976 94.687 81.577 126.442-123.765 118.052 0.000 131.672-156.270 # 135 total E -6.63246E+02 rmsd from N 0.000 %NC 0.00 1 91.574 64.929 154.627 31.604 123.746 -85.007 147.073-122.969 92.835 70.835 109.618 -83.080 115.694 140.953 86.968-108.002 121.376-177.834 127.433 -70.664 95.932 -37.897 176.430 -70.889 95.610 -80.909 136.636-122.459 91.789 67.456 131.932 74.954 92.741 58.552 114.551 -55.350 92.182 169.490 165.908 157.435 123.619-170.083 129.950 -86.986 122.058-171.372 163.279-149.252 94.964 68.306 151.921 -60.860 138.460-114.783 144.314-102.591 122.565-119.363 161.637-148.215 134.338-177.560 176.437 -40.503 124.912-176.816 160.477-131.947 120.023 -90.315 110.819 120.472 95.803 12.695 149.953 132.257 94.339 67.206 116.121 -38.987 137.382-165.560 147.481 -68.545 123.340-163.434 146.908-103.670 127.622 169.375 161.888 -35.850 92.593 56.313 92.682 -31.246 104.190-155.313 129.001 -75.910 93.401 76.230 138.050-144.162 92.547 93.173 110.822 -82.778 123.763 -74.270 128.769-112.734 91.998 62.912 105.997 -53.553 92.846 45.049 146.052 -79.015 91.098 50.433 127.323 -72.002 91.254 38.928 142.337 116.988 91.393 46.619 143.510 -67.331 90.641 51.858 125.642 -74.703 92.217 40.379 153.484-122.932 92.811 42.799 137.656-140.444 91.991 44.142 120.625 -83.084 92.260 61.607 120.713 -78.945 90.746 53.294 128.904 -75.885 93.380 78.351 158.531 -20.155 92.737 -69.042 153.983-163.902 94.676 -56.990 143.660-102.228 94.437 160.939 0.000 0.000 92.299 50.634 117.035 -83.145 94.213 37.349 77.793 -84.612 99.119 28.466 0.000 0.000 98.993 31.407 120.435 -90.250 97.357 29.257 144.163-100.719 97.164 40.502 119.691-129.692 94.003 37.862 116.395 177.134 93.304 37.849 149.560-106.863 93.107 42.896 149.857 -37.024 91.152 46.914 132.692 -75.437 92.346 41.720 139.968 -73.961 91.419 41.428 142.352 -83.176 93.161 44.593 114.027 -84.057 92.604 40.771 146.182-110.196 93.792 44.731 125.919-111.858 93.272 64.292 142.886 -75.368 94.646 80.551 127.026-115.615 118.044 0.000 131.680-157.232 # 136 total E -6.60327E+02 rmsd from N 0.000 %NC 0.00 1 91.568 57.705 133.567 -78.003 126.406-160.014 142.010 -90.865 94.198 45.682 112.753 -99.029 92.456 164.767 137.774 -79.526 93.490 27.487 131.964 -90.276 95.454-168.986 123.945-101.363 136.844 -85.903 124.817 -83.613 133.998-152.040 149.099 -24.856 102.831 175.825 130.454 66.469 92.859 37.283 126.379 -89.605 111.294 156.360 167.337 17.891 94.606 -40.323 155.528 148.452 92.628 -43.451 137.175-108.670 94.777 90.780 0.000 0.000 128.124-105.578 116.432 -87.355 124.843-166.979 166.673 -10.532 130.125-172.303 141.591 120.995 113.118 65.944 110.899-120.026 96.653 133.536 150.759 -29.240 126.352 -74.918 133.387 -45.325 134.100 -36.647 140.411 -91.282 126.273-166.104 79.908 -90.444 129.359-157.314 146.596 88.608 94.244 -28.289 159.624 -82.629 119.071-157.330 136.468 -88.527 127.701 165.774 139.707 -88.552 92.627 8.858 142.732-158.009 124.988-111.498 161.735 -91.534 132.220-105.845 124.980 74.266 133.353 -98.279 130.271-114.817 126.891-130.328 135.590 -71.375 91.334 51.050 130.486 43.740 91.052 43.323 104.862-128.992 90.843 48.999 128.193 -75.597 92.146 47.100 164.330 121.790 91.963 39.089 132.630 -62.628 92.292 38.471 116.058 -85.089 94.047 43.569 118.533 -24.160 91.901 43.973 127.996 -77.319 94.110 47.247 126.278-146.726 93.612 28.763 151.785-137.990 114.587 -96.873 136.455-135.013 114.404-124.881 0.000 0.000 93.999 48.690 137.487-106.781 93.743 43.636 90.003 -83.718 96.605 85.179 0.000 0.000 128.797-167.787 156.728-115.759 128.067-146.158 165.276 -7.007 130.307-161.837 158.029 51.231 122.927-161.288 167.332 4.253 126.729-171.326 150.216 -10.589 122.844 -60.535 150.489 -4.675 91.757 -23.609 130.098 -76.965 96.047 95.110 145.637 63.153 121.858-152.459 172.930-153.356 131.892-166.267 140.854 41.487 128.487-147.013 159.726-131.591 125.269-159.410 131.436 -46.633 119.189-175.780 122.979-145.896 95.399 66.296 133.119-131.644 117.472 0.000 138.125-160.411 # 137 total E -6.97347E+02 rmsd from N 0.000 %NC 0.00 1 91.594 5.702 126.169 -55.397 129.135 -87.771 130.688 -87.206 91.317 62.776 136.296-159.365 90.695 51.759 131.799 -78.777 91.882 45.728 153.052 90.252 92.647 39.382 145.005 -72.909 92.501 43.459 140.372 -76.152 91.696 49.147 128.921-101.082 90.781 40.566 114.571 35.967 91.855 43.928 130.374-112.671 91.695 60.314 136.331 -71.754 91.062 54.420 132.198-116.984 92.421 38.539 110.804 -88.502 94.540 60.100 166.868-143.670 95.347 -77.730 140.272 -97.067 126.622-168.485 131.519 -95.452 120.763 163.422 158.525-153.808 113.291 -62.657 176.475-142.297 118.580 -45.437 0.000 0.000 93.305 71.587 110.171 -53.729 95.774 87.892 141.666 -72.990 133.664 -96.780 163.107 8.757 93.639 53.597 108.766-103.089 91.627 49.426 93.588 -19.213 91.043 42.452 128.271 -77.138 92.243 41.248 144.657 -78.679 91.741 45.194 140.195-150.806 91.027 45.003 127.628 -76.340 91.365 40.299 111.092 -49.140 92.576 44.962 143.679 -74.448 91.061 44.316 124.089 -74.510 91.620 43.577 144.154 138.335 91.489 44.701 144.453 -58.396 90.915 45.028 127.717 -75.832 92.209 43.053 133.986-126.409 91.806 44.873 139.574-139.862 91.572 42.616 120.413 -76.693 92.793 42.437 112.217 -62.163 91.096 47.173 128.666 -76.589 91.908 44.238 123.758-144.436 91.986 46.747 153.865-146.972 93.328 35.778 120.175 -85.028 94.586 44.795 0.000 0.000 92.724 42.050 135.731-108.217 93.559 35.625 139.130 -22.668 96.240 37.988 0.000 0.000 94.614 39.128 122.112 -80.437 94.020 36.679 145.251-114.687 95.298 37.071 165.400-112.795 94.542 39.049 126.805 111.148 93.469 39.635 144.527-125.710 92.846 43.013 148.665 -26.253 91.211 44.210 131.421 -78.590 92.632 43.613 127.125-100.920 91.547 41.473 141.360 82.609 93.789 42.782 141.564 -75.923 92.897 41.287 133.121-105.451 93.801 50.742 124.538-116.734 92.949 64.052 141.691 -74.986 94.690 81.206 125.267-127.147 118.007 0.000 132.222-155.993 # 138 total E -6.97594E+02 rmsd from N 0.000 %NC 0.00 1 91.568 55.288 122.817 -61.152 126.943 -90.889 124.483 -96.102 117.558 -93.207 121.073-120.165 91.176 52.175 131.302 -77.130 91.822 46.767 111.981 -91.396 92.061 48.861 149.734 26.042 91.962 41.192 106.249 -65.059 92.782 60.408 75.935 105.063 91.321 68.533 106.408 46.778 91.414-169.693 145.471-128.407 124.939-178.265 175.444 -71.674 94.852 40.899 143.949-121.519 95.692 149.056 144.434 59.391 131.661 44.145 166.868-143.670 122.057-113.974 169.799-117.638 130.255-162.331 134.689 -97.521 111.324 -57.842 151.658-109.166 92.439 -24.885 105.486 122.061 95.237 91.996 158.735 163.941 126.033-117.083 138.955 -12.182 124.290-146.382 163.273 -92.189 134.602 -64.400 152.904-104.121 134.164 -26.969 125.868 -85.741 129.489-175.635 176.481-173.705 90.868 95.494 152.442 -87.192 93.412 91.772 132.994 -97.475 93.155 111.200 98.107 -83.654 113.584-114.199 134.693-106.502 92.482 43.582 120.488 -54.561 92.563 51.102 110.465 -40.902 91.056 47.018 125.887 -79.533 91.194 43.184 129.748 122.380 91.572 44.049 145.095 -63.252 91.299 43.913 126.545 -75.226 92.711 42.006 163.030-161.197 92.124 48.366 142.817-140.629 91.198 48.673 120.458 -72.991 91.462 76.515 128.372 -98.557 91.110 47.459 128.393 -75.544 94.068 84.152 132.797-158.631 92.923 -64.542 148.734 169.641 94.727 -53.830 141.837-100.131 94.409 164.083 164.220-142.818 91.662 58.672 132.875-104.464 93.780 33.958 82.321 -84.112 98.440 30.167 0.000 0.000 98.416 30.285 113.282 -88.676 96.597 33.422 150.552 -93.841 96.671 35.873 155.242 153.513 96.065 33.227 118.114 104.841 95.619 33.589 149.275-137.247 93.835 44.698 159.017 -20.091 91.025 47.599 128.150 -77.321 91.788 42.466 140.020 -73.909 91.543 41.103 139.572 87.147 94.079 41.782 112.233 -71.143 93.154 41.293 134.681-113.363 93.897 49.296 131.366-113.859 93.006 63.581 141.859 -74.363 94.679 81.308 124.126-123.005 118.048 0.000 131.783-156.434 # 139 total E -6.51419E+02 rmsd from N 0.000 %NC 0.00 1 91.567 59.558 135.151 -76.975 122.683 -80.341 114.642 -84.764 117.000-142.472 119.813-118.175 133.574-145.165 143.954 -83.661 128.299-119.907 131.409-126.520 138.420-155.123 154.139 -86.646 121.843-155.719 172.581 -26.355 139.184-119.397 150.511 -20.340 125.749-161.832 98.946-101.790 92.804 1.468 118.753 120.395 123.665-132.711 171.577 -46.299 125.259-163.710 167.241-120.552 102.783 -60.691 118.880-129.036 97.350 -20.433 171.212 -76.272 93.401 87.849 124.724 95.528 124.293-123.713 159.162 -25.970 127.952-152.687 148.913-156.290 96.024 8.662 156.714-100.599 118.206-139.911 0.000 0.000 123.347-166.463 144.986 33.928 128.779-133.107 143.183 -76.184 122.348-157.181 169.108 -35.099 119.481 -29.798 136.739-145.480 93.922 179.761 125.975 71.853 91.546 73.784 131.586 -77.701 93.282 96.278 129.670-115.592 93.206 -76.111 138.094 -23.131 116.095 -3.738 142.349 -68.762 125.187-104.664 149.980 -90.924 131.792-155.964 152.323 3.582 115.339-175.816 130.067-100.220 133.216-146.955 138.155-116.705 111.007 -71.922 103.457 22.324 124.329-163.099 162.286 -76.166 125.753-110.309 147.448 -23.308 92.050 39.148 161.319-130.087 92.263 45.785 119.240 -21.697 94.416 37.159 128.010 -82.549 91.695 46.889 134.042 -80.945 92.129 42.880 120.455-158.948 92.198 46.433 151.126-130.573 93.566 35.057 119.445 -86.180 94.744 44.612 153.032-115.937 92.781 41.813 136.263-108.428 93.587 35.800 140.831 -19.292 96.298 37.366 0.000 0.000 94.599 39.962 121.281 -79.876 94.045 36.409 146.342-112.897 95.022 38.115 122.041 -36.490 94.347 39.171 127.191 111.578 93.412 39.425 143.909-125.856 92.853 43.010 151.435 -27.847 91.181 44.628 131.409 -78.745 92.392 44.691 128.439-101.581 91.324 41.822 140.761 81.954 93.644 43.172 116.119 -83.276 92.942 40.925 132.539-108.253 93.951 50.490 123.992-118.327 93.051 64.072 141.762 -74.528 94.693 81.562 123.612-128.215 118.013 0.000 132.104-155.774 # 140 total E -6.58730E+02 rmsd from N 0.000 %NC 0.00 1 125.210-128.849 161.510 135.224 131.858-100.004 174.771 -68.147 121.293 107.917 139.910-146.691 91.879 28.776 129.878 -75.638 118.686-152.873 161.748-174.419 96.023 47.500 131.316 -91.333 129.765-179.432 141.858 -81.679 118.127 176.248 119.583 45.018 93.456 16.016 111.914 -51.669 108.408-161.662 173.772 -18.247 133.072-138.337 142.330-114.120 131.982 146.501 158.752 67.493 100.636 -62.979 163.640-174.790 93.250 41.258 139.049-111.457 114.472 -87.291 131.518-111.809 122.969-153.460 158.265 -57.525 126.686-134.433 155.964-172.907 123.557 6.545 151.275 127.390 114.333-171.141 112.685 -60.578 130.607-172.496 143.801 -12.777 94.544 38.501 120.723 -81.947 120.540-164.327 144.046 -93.583 122.819 103.892 146.276-129.819 93.062 111.606 155.426-118.243 90.736 -28.567 130.093 -74.921 98.309 -80.924 138.691 -68.333 115.364-112.161 149.173 -5.417 90.901 46.261 132.208 -77.137 90.753 45.925 113.540 -46.055 91.230 51.262 163.891 -89.225 90.457 47.970 125.168 -77.621 90.823 43.184 163.962 140.280 90.882 48.345 140.559-136.790 90.335 54.779 127.957 -77.861 91.228 46.931 129.243-123.948 91.211 45.455 134.851-142.705 91.449 45.900 122.260 -93.373 91.810 64.399 120.104 -75.402 90.626 63.659 127.929 -75.386 92.360 113.554 128.397-152.621 92.314 -28.382 161.786 -14.514 92.772 -60.902 168.920-141.886 99.457 -28.719 126.360 -94.941 92.466 108.786 130.483-111.571 94.575 53.838 136.374-162.295 96.053 115.688 168.407-131.814 134.749-168.001 171.124-126.998 120.341-173.876 164.368 27.732 132.756-155.522 129.399-133.983 128.505-158.364 153.363 16.268 112.929 -65.193 156.092 -17.809 94.206 -16.152 148.689 -16.674 93.149 94.149 129.476 -76.302 124.033-144.944 171.420 -48.369 132.998-169.135 155.503 -66.447 120.834-174.305 168.965 -97.800 130.135-176.913 133.151 -82.382 93.149 89.264 123.012-129.687 92.932 85.464 120.697-122.454 94.780 75.958 101.625 -97.548 117.417 0.000 139.185-149.979 # 141 total E -6.56858E+02 rmsd from N 0.000 %NC 0.00 1 91.598 106.760 131.878 -87.626 130.226 -86.347 130.540 -87.101 117.390-104.552 144.849-159.253 91.488 53.290 133.534 -78.461 91.821 43.469 114.266 -96.531 92.021 49.426 142.864 -72.513 91.730 58.533 141.021 -75.108 92.296 53.534 82.476 85.600 92.273 92.583 108.055 -51.421 92.853 -55.924 148.590-117.346 130.028-156.146 150.848 -96.574 121.659-156.749 168.585-167.739 106.582 -64.914 120.182-115.469 97.629 -20.041 0.000 0.000 93.490 87.483 115.544 79.555 123.530-140.848 153.347 60.712 121.870-164.926 141.847-159.229 95.020 19.556 126.109-120.102 95.748 98.063 0.000 0.000 92.425 80.911 156.142 65.360 93.931 115.974 171.769 -80.311 94.534 163.093 135.545 -91.416 124.147-159.519 124.638-107.530 121.710 -70.584 123.171-120.169 126.110-172.290 154.672 -84.352 124.233-157.278 162.706-150.425 93.676 -0.347 147.884 146.786 114.517-141.962 159.237 -88.506 134.051-163.774 140.454 9.174 127.224-132.786 129.924-104.479 129.956-157.826 145.827 -77.679 97.041 -42.129 153.020 95.884 93.638 -77.800 133.267 -68.901 90.732 77.039 130.042 -76.789 94.653 41.615 146.035 25.755 119.385-159.084 152.152 -84.550 122.902-162.724 129.115 142.756 131.139-123.045 158.801-176.338 134.403-166.423 115.172-114.130 95.226 13.263 121.932-143.686 94.598-172.578 161.477 7.086 135.723-176.790 118.974 -96.328 93.095 96.836 0.000 0.000 122.401-118.447 123.536 -95.226 94.181 -33.725 104.859 -67.306 127.454 -7.499 0.000 0.000 126.365-125.191 125.733 -96.181 136.116 -95.192 169.614 -13.548 131.683 -42.832 116.208 -83.315 113.725-162.152 96.437 -94.534 93.022 50.522 157.803-144.450 92.520 45.104 112.760 -80.811 91.529 45.777 176.413 -87.798 92.781 45.770 136.690 -98.678 91.245 41.245 139.436 -88.844 93.742 41.170 110.604 -72.009 93.553 39.851 143.699-117.215 94.179 46.185 129.221-123.028 93.188 64.009 142.953 -75.979 94.630 82.967 125.737-114.889 118.093 0.000 131.100-155.170 # 142 total E -6.46426E+02 rmsd from N 0.000 %NC 0.00 1 126.054-131.448 149.901 -84.809 126.294 -72.391 133.472 -77.158 114.175-134.399 134.513-148.472 91.842 43.485 131.683 -77.251 93.172 41.059 117.211 -73.389 94.793 38.713 163.157-110.957 93.802 41.651 100.596 -60.045 94.077 36.856 142.716-106.209 93.078 39.892 136.203-101.551 92.682 42.834 149.789-134.375 93.375 44.392 120.626 -84.583 94.580 41.487 134.596-118.115 96.240 -28.128 113.270 -94.821 135.798 -68.733 164.396-123.999 120.541-161.206 164.250 -78.397 127.241-138.366 126.865 -84.503 137.243-126.197 141.459-124.482 127.980-170.711 110.203-115.787 119.323 173.301 167.044-117.212 121.507 -95.806 131.517 -23.250 94.277 19.571 138.368 -75.867 95.765 69.259 104.444-115.463 126.280-178.968 149.318-115.951 127.230 162.320 145.740 -50.453 91.149 126.536 127.268 -73.761 93.485 72.716 138.000-153.932 93.389 70.139 146.991 -25.701 108.348 -59.373 161.143 -88.886 126.669 -12.933 126.158 -40.102 121.506-111.846 109.493 -60.791 130.930-138.634 151.635 -72.052 91.324 47.601 135.525-142.259 91.204 47.338 167.426-106.633 91.145 49.624 128.131 -75.860 92.293 43.578 118.177 -68.370 90.723 64.272 121.602-115.982 91.215 56.663 116.055 -63.551 92.860 83.817 100.206 -76.692 91.771 -32.654 129.902 -76.550 115.871-141.032 138.994-168.951 92.713 53.210 162.776 -10.067 92.910 37.317 140.223-101.319 93.648 49.354 154.394 9.316 92.442 44.818 119.815-104.412 93.559 33.772 137.557 -20.569 97.100 34.211 0.000 0.000 96.300 35.903 123.735 -82.320 95.578 32.266 141.737 -79.991 97.955 30.739 168.238 -79.938 97.604 32.191 122.005 117.285 96.330 33.528 150.052-137.551 94.773 41.282 161.770 -13.354 91.828 41.004 128.954 -76.539 94.027 39.808 141.792 -76.881 92.420 40.072 139.301 86.319 94.201 44.022 143.334 -75.741 92.741 40.102 131.151 -89.018 93.870 47.058 127.887-114.614 93.072 63.001 141.504 -74.759 94.680 80.807 134.165-122.953 118.026 0.000 132.009-156.788 # 143 total E -6.47366E+02 rmsd from N 0.000 %NC 0.00 1 91.604 109.041 131.352 -77.138 126.008 -89.114 133.258 -85.104 114.938 -75.425 105.146 -88.419 91.605 88.956 154.497 -88.913 95.476 138.951 108.498 -57.192 94.191 70.204 145.867 -71.559 94.443 107.681 139.455 -74.138 131.170-117.270 132.965 -42.381 93.184 25.121 116.251 -55.635 122.399-116.366 153.626 -84.769 122.911-142.947 164.934 -83.674 122.709-169.835 170.444-150.386 102.157 -62.391 161.754 -36.517 97.936 -19.922 0.000 0.000 93.669 91.338 112.969 70.831 122.213-131.907 140.213 -88.307 124.516-173.275 161.066 150.491 131.316 -77.326 147.330-110.281 125.920 -28.704 0.000 0.000 124.819-174.131 128.156 36.874 95.245 46.297 126.037 -99.992 136.337 -88.448 149.896-127.581 95.989 104.912 174.194 -91.641 92.856 30.992 149.441 -98.709 117.161-127.713 141.080 -98.354 92.912 59.905 146.735 -80.415 92.473 124.677 94.700 -82.021 129.030-109.045 146.027-100.407 92.942 34.284 126.145 -51.054 92.791 55.658 118.133-132.170 91.347 43.833 125.493 -76.365 91.625 40.816 131.388 145.405 91.603 45.944 143.806 -62.086 90.880 47.698 127.650 -76.493 91.923 42.572 131.323-145.430 91.720 46.872 135.757-142.300 91.540 55.056 123.252 -81.185 92.205 106.918 128.514-116.221 91.350 41.231 128.310 -75.492 107.390-166.941 138.711-155.707 116.572 -70.681 161.589 -20.788 92.688 -15.765 149.346 -97.337 94.428 99.600 0.000 0.000 122.171-152.162 166.381 -76.533 93.142 32.680 133.939-129.232 123.230-128.898 0.000 0.000 127.042 -98.996 102.648 -78.575 92.859 46.474 127.367 144.956 93.623 41.772 140.350 -77.222 93.298 44.025 127.674 126.463 92.680 38.913 146.901-136.416 92.901 42.127 147.416 -33.118 91.207 45.868 132.262 -79.127 92.483 44.980 145.130 -75.571 91.059 43.453 141.092 -79.449 93.096 44.049 113.572 -83.448 92.837 40.270 129.551-104.118 94.154 50.055 126.498-113.910 93.152 63.637 143.018 -75.785 94.703 80.988 124.752-127.704 118.011 0.000 132.186-156.516 # 144 total E -6.51036E+02 rmsd from N 0.000 %NC 0.00 1 91.566 56.728 157.974 -17.378 123.419 -60.298 143.611-102.394 120.188-153.467 113.604-108.612 126.794-160.398 143.117 -80.076 125.644-173.638 159.250 176.515 94.628 36.071 109.201 -83.456 119.173-163.413 135.612 -97.658 128.967-171.882 153.184 9.928 92.609 39.980 126.537 -63.103 119.056-161.619 141.874-124.843 125.376-152.720 166.383 -82.804 119.461 145.705 164.133-136.424 103.880 -61.921 145.366-119.149 93.171 37.206 0.000 0.000 115.838 -85.428 105.883 -81.418 122.509-158.527 147.168 -88.613 134.188-132.960 159.308 152.810 118.391 21.233 123.975 121.986 120.957-171.201 0.000 0.000 127.406-166.183 144.785 -10.983 95.561 30.433 129.874 -90.279 123.240 173.515 128.165 -73.898 93.998 95.581 107.694-124.460 92.728 49.122 135.361-139.466 92.047 105.094 129.667 -77.131 93.425 -13.158 163.244 156.909 93.120 -77.397 138.130 159.084 92.409 -11.633 128.619 -75.652 94.724 102.125 131.631 -36.295 94.973 129.825 145.669 -73.517 91.908 49.715 127.223 -76.064 92.543 39.681 158.693 49.730 92.482 46.783 143.089-140.418 91.404 43.104 118.456 -94.946 92.024 50.201 124.454 -54.348 90.013 46.181 120.165 121.241 90.451 50.170 115.934 -71.931 91.895 42.295 130.346 -37.404 90.964 48.192 124.626 -72.113 91.675 44.827 126.901-146.747 91.779 49.181 150.775-145.601 92.915 35.662 123.365 -83.422 94.228 50.185 0.000 0.000 92.479 43.241 125.817-102.706 93.005 39.791 111.998 -63.736 95.119 50.559 141.102 -25.486 92.615 67.857 134.235-102.612 92.948 48.813 134.350-126.036 111.725-151.527 139.352 41.448 131.202-118.750 136.062 145.597 126.336-171.608 119.878 -87.929 114.963 -64.214 146.473 4.553 91.947 -22.181 129.613 -76.380 96.463 88.456 163.277 -61.119 127.565-122.286 160.988 -62.253 122.456-164.013 149.174 48.090 137.505-102.069 123.526 106.123 120.480 -39.847 144.690-107.773 125.479-159.757 170.074 -1.554 94.935 64.055 141.021 -74.740 117.282 0.000 140.813-165.344 # 145 total E -6.50333E+02 rmsd from N 0.000 %NC 0.00 1 126.108-127.687 150.526 -77.461 125.911 -78.709 138.753 -96.218 119.601-163.651 122.086-121.627 128.773-161.887 153.393 -68.971 122.299-171.049 161.619-155.202 94.999 95.649 116.491 -93.983 95.974 35.373 166.499-126.270 106.587 -69.160 98.188 -43.134 91.166 -25.964 114.286 -56.060 115.949-172.238 164.361 -4.175 124.568-148.185 167.278 -64.303 125.806-146.379 165.289-136.486 105.424 149.464 173.542 -14.387 129.094 32.849 171.212 -76.272 132.384-136.433 167.875 -61.235 124.629-160.145 141.327 -82.209 115.650 -61.934 157.291-177.371 92.614 -21.212 107.638 120.290 95.133 91.761 167.044-117.212 125.143-140.114 133.438 -35.739 126.232-137.176 127.674 -70.004 121.080-145.244 173.170 -76.186 131.218-150.610 154.937 159.246 122.888-151.692 165.696 -36.057 91.969 -53.832 129.267 -77.311 96.318 -68.909 136.649-133.696 92.105 79.983 98.739 -80.415 92.203 33.595 128.990 -76.645 127.257-155.594 147.320 47.878 120.582-158.186 123.251 -21.367 127.733-160.502 150.878 -85.245 93.271 -36.348 162.958 155.848 93.246 -77.866 135.706 -71.215 91.045 68.298 130.311 -77.441 95.003 55.112 158.081 -10.038 95.891-177.195 124.210 128.286 120.334-167.450 153.662 137.768 135.022-136.254 151.228 177.084 119.232 -88.825 136.008 -75.682 94.920 -49.573 115.753 150.996 119.593 174.364 154.316 -33.169 108.968-103.258 150.031-137.021 94.890 33.841 0.000 0.000 94.306 50.437 138.519-111.173 94.348 29.914 143.825 -16.171 97.744 35.811 0.000 0.000 96.800 30.809 121.618 -80.933 96.119 33.031 150.953-104.035 97.056 34.031 165.000 -67.247 96.389 34.497 125.400 120.312 96.109 30.981 148.947-139.635 94.840 41.679 154.589-128.645 91.526 45.382 128.645 -78.753 92.369 43.832 143.473 -77.116 91.207 41.247 136.853 84.946 93.958 43.626 115.717 -90.948 92.910 40.529 129.247-107.003 94.028 50.376 129.420-117.859 93.103 63.629 141.427 -74.281 94.691 81.916 123.809-128.412 118.037 0.000 131.868-155.602 # 146 total E -6.51330E+02 rmsd from N 0.000 %NC 0.00 1 126.164-130.622 146.517 -76.991 124.929 -82.511 124.984-100.236 107.881 -43.791 99.774 -78.607 91.429 102.908 131.395 -76.210 121.448-150.367 133.200 -87.490 126.827-143.129 142.667 -46.269 126.291-160.225 144.858-117.210 130.486-166.680 154.930 -4.619 93.498 43.758 140.686 -81.954 114.507-164.953 141.774 -92.248 126.963-132.052 155.020 -87.595 125.569-170.147 157.101-129.698 106.022 -62.456 131.463-116.354 97.807 -19.937 0.000 0.000 93.662 85.273 141.378 -91.605 128.625-121.862 149.835-105.122 125.860-175.780 176.424 -3.767 132.583 -90.112 144.181 -92.455 126.147 -7.056 0.000 0.000 121.738-165.233 128.793 30.091 135.844-153.289 140.689 -48.730 116.146-163.728 136.955 -95.180 133.559-137.297 159.010-150.238 123.192 -94.955 149.324 70.735 92.114 42.518 131.364 -78.340 92.702 43.421 145.385 -95.560 90.873 60.994 138.399-143.199 91.002 48.077 126.215 -76.544 92.669 32.937 110.405 -58.155 94.765 43.874 140.166-113.009 91.157 53.097 129.020 -77.333 91.656 41.401 147.064 -91.421 92.717 38.807 140.002-132.814 91.721 45.554 128.088 -76.365 92.320 49.893 114.003 -80.835 90.795 45.145 144.935-146.655 91.219 42.752 119.026 -86.567 93.137 42.439 106.285 -45.553 91.022 48.147 131.427 -78.598 91.383 45.439 124.643-147.507 91.520 50.253 152.989-154.501 92.731 36.162 121.090 -80.879 94.004 50.081 102.580 -55.005 92.349 44.835 131.190-108.190 93.090 45.364 139.980 -16.376 94.750 72.704 0.000 0.000 112.215-156.633 148.316-117.295 123.348-167.001 176.465 139.082 125.623-168.442 154.854 17.216 129.922-154.354 135.073-136.026 120.192-166.296 163.327-129.327 117.745 -67.413 148.116 3.869 92.096 -17.622 129.559 -76.306 96.124 90.629 141.741 -73.172 126.609-143.345 171.998-113.052 127.165-165.480 160.170 -14.551 126.212-159.365 152.515 132.206 128.181-166.056 170.190 -81.775 123.405-175.036 166.202 -38.002 95.117 61.821 141.191 -74.358 117.364 0.000 139.625-173.418 # 147 total E -7.03701E+02 rmsd from N 0.000 %NC 0.00 1 91.567 57.500 130.733 -70.682 127.991 -72.815 135.308 -92.629 116.397-151.400 102.432 -78.684 125.496-153.827 157.640 -94.764 124.348-172.478 145.897 -87.969 96.619 -24.684 157.584 59.514 94.805 -86.003 121.830-143.007 93.457 57.329 150.297-110.798 93.166 67.352 104.206-104.678 92.946-178.212 129.883-160.898 119.923-159.627 166.182 36.222 125.601-159.874 160.073 145.341 106.371 -62.509 124.773-122.899 96.723 -20.370 0.000 0.000 93.297 88.334 117.319 81.724 125.983-125.649 166.661 -60.789 132.484-167.999 154.541-137.860 115.778 -3.624 141.611-120.140 94.979-179.525 0.000 0.000 128.072-175.923 138.341 80.416 95.239 97.333 94.590 -69.771 94.209 -9.416 119.025 -81.748 94.434 -75.948 122.591-106.010 104.721-179.205 149.489 -77.385 120.519 164.040 154.585 -78.632 92.840 5.127 131.610 -97.184 112.997-110.148 109.925 -93.788 91.710 91.981 123.384 -74.965 91.620 40.934 119.758 -32.264 93.593 44.116 142.797 -74.170 91.155 51.855 129.603 -78.105 90.898 42.659 136.727 160.180 91.199 44.132 149.825-137.605 90.765 48.913 126.737 -74.818 91.921 45.425 150.238-115.727 91.479 47.144 136.238-141.308 91.341 53.423 123.566 -93.942 91.935 87.689 128.486 -93.261 91.038 47.717 128.729 -75.761 93.959 85.559 132.484-159.614 92.661 -63.593 151.845-164.869 94.573 -57.289 144.894-104.160 94.676 165.638 0.000 0.000 92.054 60.358 134.919-102.979 92.619 44.039 84.550 -84.415 115.918 4.713 0.000 0.000 95.116 44.661 114.479 -82.058 96.056 24.365 153.277 -92.250 97.561 41.316 165.890 -2.878 94.951 33.880 119.665 132.390 94.456 38.832 152.492-122.288 92.611 44.607 148.560 -21.595 90.951 47.316 129.759 -78.385 91.573 44.291 122.883-109.790 91.511 39.677 140.904 78.174 93.501 45.379 111.987 -57.444 92.916 39.473 133.503-105.196 93.913 55.826 121.540-113.757 92.834 74.239 141.847 -74.682 94.611 97.347 127.502-134.415 117.469 0.000 133.656-121.198 # 148 total E -6.47964E+02 rmsd from N 0.000 %NC 0.00 1 91.567 62.350 135.644 -60.719 118.260-175.246 141.314 69.627 93.693 9.875 130.053-151.702 105.821-108.639 153.550 -89.130 92.350 42.727 142.804 -77.153 95.145 71.497 140.673 -70.806 118.663-148.103 145.159 -95.262 133.378-164.804 156.228 1.458 92.627 37.397 121.584 -65.653 119.304-162.716 155.058-114.032 122.945-133.932 151.359 -91.279 119.448 156.239 163.219-142.297 95.676 -65.242 157.218 -31.999 91.947 31.672 0.000 0.000 114.525 -71.621 121.849 -82.582 127.113-162.943 167.735 -52.528 128.531-116.935 165.327 178.118 122.166 19.995 126.983 123.570 117.751-167.521 0.000 0.000 132.069-162.236 143.017 3.192 94.457 31.768 123.262-111.711 120.770-125.417 139.818 -96.229 95.982 93.171 110.703-116.045 136.402 -77.289 155.622-105.716 118.868-118.584 129.481 -86.016 92.170 46.652 141.868-135.503 91.899 41.284 102.400 -78.530 91.794 43.214 128.558 -75.912 92.135 44.489 119.650 -56.802 93.581 52.836 128.552-116.759 91.487 57.843 128.709 -76.313 118.798-102.935 156.846 -79.207 91.878 91.079 140.556 -96.309 91.253 47.451 131.275 -77.800 92.755 44.921 157.935 20.543 92.257 39.978 125.457 142.210 92.060 41.564 126.956 58.876 92.905 42.481 121.659 -60.180 91.193 49.759 125.767 -75.277 92.123 46.081 145.881 -54.692 92.291 56.866 159.373 -18.956 103.088 -54.396 133.453-113.128 122.680-148.700 0.000 0.000 122.929 110.643 167.491 -79.491 90.955 -27.058 136.889-135.152 95.452 -51.644 0.000 0.000 115.121-153.209 139.730 -91.591 92.465 50.685 160.842-131.823 93.340 38.344 112.363 -54.570 94.032 42.586 129.292 109.059 93.212 39.153 153.438 -37.897 92.890 43.198 150.644 -28.446 91.270 43.515 131.856 -78.892 92.677 44.877 130.839-102.612 91.389 41.861 139.771 82.726 93.626 42.854 115.504 -82.975 92.981 41.399 130.812-109.372 93.920 49.898 125.051-119.828 93.098 63.222 141.668 -74.528 94.701 81.793 123.447-127.160 118.040 0.000 131.831-155.849 # 149 total E -6.69907E+02 rmsd from N 0.000 %NC 0.00 1 125.967-131.890 151.669 -97.855 127.267 -92.470 110.067 -84.270 116.397-100.202 121.619-122.090 91.344 64.061 157.847 -87.166 93.342 50.959 139.508 -75.966 94.336 83.944 140.334 -70.485 94.585 18.590 137.435 -98.058 128.688 -85.012 71.472 -84.733 123.938-118.718 70.709-106.240 129.130 -60.492 151.985 175.291 124.046-154.738 138.129 -92.983 106.926 -48.788 141.158-100.003 93.223 -31.454 108.897 148.517 95.385 92.040 153.357-137.902 121.594-126.567 151.521 -88.344 123.684-102.421 145.719 51.583 123.748-153.219 165.034-165.366 93.967 80.981 99.187-117.641 138.171-104.914 156.391-120.170 123.797-128.283 136.535 42.584 130.222 -58.076 144.004-124.951 93.602 92.316 107.970 -69.349 94.005 88.570 98.972-113.488 92.379 50.832 99.820 -42.930 91.521 137.873 129.864 -75.277 93.194 63.930 133.744-103.224 93.419 89.726 98.594 -84.676 117.564-130.911 124.517 -97.486 91.631 55.243 109.588 -53.211 92.816 52.648 143.060 -74.228 91.290 42.113 127.043 -75.175 92.192 41.857 153.410 159.036 91.880 45.806 152.486-141.272 91.086 46.291 127.742 -75.474 92.818 39.517 137.909 -91.113 92.387 43.821 126.794 124.170 91.478 45.534 118.220 -68.581 92.204 51.601 107.186 -53.559 91.135 43.784 129.556 -76.384 94.255 84.747 126.261-147.617 92.896 -66.088 152.794 172.067 94.888 -52.620 141.240 -99.484 94.833 173.926 0.000 0.000 91.362 61.774 140.261-106.801 92.494 34.864 88.035 -81.166 96.018 39.564 153.860 36.738 94.408 39.658 120.386 -99.841 94.273 36.687 113.618 -71.589 95.812 34.157 143.020 -71.883 96.017 36.656 114.977 109.168 94.259 41.403 145.424-149.348 93.436 41.908 151.919 -27.567 91.551 41.584 137.736 -81.319 93.084 45.262 128.896 -97.498 91.272 42.681 140.898 82.741 93.531 42.399 114.133 -81.891 93.060 41.527 133.109-113.680 93.920 49.692 125.010-119.607 93.066 63.958 141.798 -74.578 94.691 81.931 123.232-126.436 118.042 0.000 131.779-155.651 # 150 total E -6.51915E+02 rmsd from N 0.000 %NC 0.00 1 91.567 59.779 134.563 -77.155 122.496-106.179 128.533 -88.485 92.537 58.330 104.217 -85.705 91.730 56.071 130.628 -77.219 93.753 92.352 146.385 -78.214 93.536 -9.768 141.402 -70.407 113.041-105.864 124.256-123.515 134.567 -28.443 148.712 123.518 123.806-128.970 83.720 -79.834 136.047 -84.050 167.848 -1.730 135.188 -20.556 146.990 -93.474 131.642-175.315 133.139 -84.493 98.986 -54.817 124.063-118.325 100.178 -24.252 145.570 51.587 93.372 85.520 144.485 -96.141 130.186-106.775 142.671 -91.702 120.315-110.022 153.532 -16.773 126.395-152.389 162.509-122.132 94.360 98.108 118.346 62.818 116.059-106.980 128.714 -34.970 129.584-101.071 130.113 -50.855 92.805 81.510 138.253-113.661 93.313 75.730 139.271 -79.427 92.436 172.467 107.694 64.993 90.963 74.114 131.243 -77.643 91.802 41.970 143.336 -79.330 91.414 49.101 136.780-151.834 90.797 48.611 129.581 -77.455 91.001 44.431 109.753 -51.515 91.961 43.533 143.761 -74.514 90.596 51.887 133.030 -81.413 90.072 45.741 162.324 135.933 90.158 48.383 148.299-137.443 90.450 47.720 124.169 -72.333 92.105 40.793 138.688-104.457 92.218 44.546 138.480-141.800 91.784 42.409 122.995 -84.299 92.895 42.398 117.881 -76.389 91.119 46.964 128.510 -76.106 91.905 44.036 156.009 -53.312 91.787 48.210 152.882-128.031 92.983 36.678 122.179 -87.670 94.434 46.742 0.000 0.000 92.883 41.537 141.865-109.848 93.532 36.041 113.450 -63.071 96.204 37.788 0.000 0.000 94.696 38.941 119.896 -78.431 94.133 36.730 146.415-119.899 95.213 37.118 142.320-122.261 94.521 39.106 126.935 109.538 93.446 39.587 144.272-125.708 92.808 43.033 151.116 -28.419 91.155 44.653 131.531 -78.651 92.399 44.644 128.141-100.369 91.334 41.858 140.954 81.955 93.654 43.067 116.051 -83.131 92.955 40.986 132.904-108.563 93.951 50.393 124.099-118.064 93.049 64.059 141.777 -74.510 94.689 81.541 123.596-127.998 118.016 0.000 132.094-155.859 # 151 total E -6.67009E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.822 136.460 -76.183 123.143 -80.142 134.853 -97.367 117.295-141.855 94.411 -77.906 130.396-151.573 142.826 -88.220 127.730-160.264 146.407-127.032 125.271-170.623 139.011 -75.323 130.431-158.969 167.527-125.685 125.951-171.171 121.854 -43.338 125.750-172.585 118.096 55.354 91.950 15.254 145.653-105.068 115.509-172.474 167.890 -38.718 126.405-173.605 166.371 116.976 94.463 34.479 139.522-106.503 119.216-169.613 119.878 -98.682 124.441-144.279 156.382-118.331 126.550-163.661 140.105 -90.099 116.785 -56.816 150.031-107.400 91.906 -25.589 103.569-114.588 95.291 94.322 167.044-117.212 125.387-130.685 139.240 -10.748 128.678-162.139 141.774 -83.657 133.832-119.077 145.314-114.553 120.078 1.452 136.539-120.471 127.090-165.866 143.173 49.602 122.910-175.305 167.162 -73.758 94.510 18.276 139.059 -75.890 110.465-175.702 139.048-115.067 133.011-173.595 102.726-141.924 118.628-165.928 140.877 49.938 128.925-162.112 149.821 -3.991 119.498-164.243 150.400 -82.505 127.522-160.923 153.895-169.292 93.620 -30.958 121.332-146.885 91.942 -81.741 129.952 -77.279 92.545 65.182 135.628 -47.535 93.830 59.747 131.305-139.632 92.246 177.453 113.836-143.207 129.860-175.816 176.286 158.083 127.751-154.559 156.669 -84.668 135.616-164.564 149.688 9.741 110.506-173.555 159.324 -13.443 121.700 -41.223 140.542-149.105 131.698-134.599 153.032-115.937 124.065 109.252 167.803 -80.264 90.969 -28.913 135.242-128.571 94.603 -51.334 0.000 0.000 113.088-161.652 134.330 -92.161 91.982 52.258 152.499 -97.122 92.724 44.539 120.091 -40.018 93.413 39.718 130.467 113.567 93.477 37.386 139.899-132.563 92.685 47.234 153.068-122.462 91.069 42.636 131.856 -80.443 92.803 41.759 126.356-106.549 91.744 42.257 141.905 81.679 93.705 43.521 109.141 -72.649 92.847 40.929 131.798-101.361 93.906 47.047 122.863-119.022 93.165 63.460 142.070 -74.677 94.663 81.545 129.505-125.085 118.029 0.000 131.963-155.956 # 152 total E -7.03115E+02 rmsd from N 0.000 %NC 0.00 1 91.568 61.211 136.173 -75.193 123.966 -85.210 130.702 -90.988 119.956 172.899 117.932-119.217 128.721-163.744 153.673 -94.494 125.787-152.207 160.558 67.858 95.578 43.750 121.604-104.821 121.871 170.804 138.756-102.599 139.617-125.738 142.632 14.629 116.007-116.589 122.213 -50.285 113.002 178.412 135.675 92.633 93.856 65.462 111.187-106.431 118.976 142.677 111.987 -80.126 86.457 -55.982 138.541 -98.159 94.791 -32.206 151.724 49.023 93.626 87.360 121.439 82.090 127.538 -90.959 140.314 -88.204 121.947-159.445 158.635-137.286 131.898 -93.449 152.086 -87.798 127.755 -34.588 0.000 0.000 125.249-150.390 136.825 16.120 129.201-139.285 128.453 -50.022 96.138 41.672 121.496 -85.524 130.553-177.172 148.149-122.137 127.954-166.835 149.135 -31.782 120.203-170.644 154.920 -67.123 94.482 96.122 121.931-138.921 93.439 -8.645 106.854 -90.296 92.151 -81.952 128.730 -76.702 100.536-177.420 154.867 -1.277 127.916-172.890 150.552 -9.735 130.381-160.240 147.590 -96.036 131.231-164.919 149.853 159.621 95.236 -31.292 176.487 -69.175 91.440 -81.645 128.275 -76.328 92.269 62.153 105.496 -80.968 94.087 61.998 142.381-147.720 92.090 175.819 121.960-140.736 135.798-167.799 155.058-175.406 125.252-171.586 144.911 -35.620 128.384-170.622 144.884-173.959 122.461-177.237 159.819 4.675 125.287 -63.925 163.852-157.967 130.998 -17.374 0.000 0.000 93.396 55.304 137.509-109.414 93.990 27.361 92.783 -84.910 96.682 45.571 0.000 0.000 92.974 40.639 127.059 -89.141 92.784 39.378 149.370-114.474 93.210 40.505 145.398 -75.446 93.160 41.891 143.079 99.717 92.270 40.938 140.860-126.467 91.704 44.989 148.805 -25.874 90.791 46.311 128.474 -77.231 92.302 43.037 128.197-108.546 91.570 41.407 139.721 85.142 93.994 43.279 141.973 -76.111 92.899 40.524 127.091 -97.919 93.962 50.650 124.175-122.109 93.059 62.852 141.506 -75.103 94.708 81.970 127.321-127.895 118.017 0.000 132.115-155.390 # 153 total E -6.88876E+02 rmsd from N 0.000 %NC 0.00 1 91.569 61.628 136.324 -74.535 124.249 -86.901 136.841 -90.953 118.524 -82.096 107.853-101.944 91.395 86.399 156.539 -86.577 92.931 112.090 141.878 -98.914 93.365 28.856 141.489 -76.116 98.040-151.182 129.441-112.235 132.578-157.208 147.208 -17.304 94.326 45.621 139.320 -84.666 122.067-177.235 169.867 -4.519 128.079-123.037 135.242-100.599 126.997-168.886 166.916 97.965 104.757 -63.222 160.701 -31.017 98.455 -18.608 136.532 -81.433 93.633 87.616 143.877 -91.730 126.922-124.231 136.721 -83.819 119.507-171.739 146.160-131.211 133.798 -86.284 145.352 -97.774 128.515 -3.851 151.550 -22.359 120.578-156.668 129.592 33.584 132.625-150.075 162.050 -28.905 93.724 20.552 140.154 -75.172 117.811-105.150 147.642 69.199 134.144-176.275 81.754 -50.248 91.500 75.513 130.515 -77.425 93.887 67.925 138.874 -92.973 93.653 84.672 146.339 6.129 119.303-129.284 126.248 -87.572 91.658 51.726 110.652 -51.645 92.553 48.893 143.298 -74.284 91.097 44.759 128.072 -75.229 91.722 41.333 148.696 130.550 91.614 44.550 143.495 -62.610 91.241 43.406 123.804 -72.925 93.347 39.244 139.216-109.672 93.347 39.904 143.952-145.130 92.537 38.733 115.125 -68.807 94.233 41.230 116.418 -71.783 91.282 46.121 131.716 -79.938 92.032 43.473 125.830-149.362 91.947 47.562 152.662-152.096 93.180 35.323 121.062 -86.785 94.438 47.526 0.000 0.000 92.778 41.700 134.493-107.048 93.516 36.093 113.687 -62.996 96.299 37.145 0.000 0.000 94.774 39.066 122.237 -80.952 94.182 36.464 145.407-113.203 95.100 37.414 144.614 -75.014 94.572 38.798 125.953 111.961 93.557 39.365 144.398-126.089 92.931 42.821 151.303 -28.216 91.199 44.545 131.739 -78.831 92.425 44.622 128.280-100.704 91.337 41.816 140.954 81.986 93.654 43.061 115.967 -83.004 92.959 40.976 132.905-108.619 93.952 50.411 124.127-117.952 93.047 64.092 141.779 -74.493 94.687 81.471 123.597-128.020 118.017 0.000 132.092-155.810 # 154 total E -6.81372E+02 rmsd from N 0.000 %NC 0.00 1 91.569 60.175 136.203 -75.827 123.007 -72.792 132.629 -92.961 116.513-145.636 94.786 -80.340 122.577-176.464 152.245 -86.531 134.185-153.416 150.840 130.685 124.826-162.148 145.174 -84.506 128.491-150.014 165.802 -35.941 128.598-166.888 117.789 -41.843 128.188-153.089 104.825 66.977 92.402 16.657 154.213-111.950 114.497-174.013 168.972 -11.352 130.612-175.360 147.133 93.554 94.015 25.400 146.257 -93.483 121.208-166.728 171.212 -76.272 122.068-167.461 163.445 39.835 122.437-172.592 133.513 -83.377 122.284 -66.643 136.930 133.779 93.273 -17.076 105.799-119.800 95.180 95.335 0.000 0.000 123.337-156.059 129.242 -48.452 122.993-163.986 129.587 -72.760 131.139-144.579 140.307-136.803 119.126 10.241 162.993 -61.190 115.545-171.162 132.867 53.768 125.946-178.151 162.651-109.175 94.125 22.762 140.396 -77.250 94.974-162.749 103.291 -90.504 131.602-163.753 107.332-143.953 128.418-170.971 140.042 38.837 126.560-157.697 129.215 -34.205 123.057-169.473 135.846 -89.924 123.315-171.408 131.813 114.781 93.846 41.118 108.553 149.274 92.406 147.026 129.516 -75.835 93.117 53.090 163.667 138.256 91.814 43.813 138.064-155.052 91.761 43.416 128.061 -65.310 92.516 47.635 131.305 -47.065 91.222 47.822 129.225 -76.558 93.860 84.547 127.399-148.173 92.301 -64.300 151.139-170.384 94.476 -56.357 142.456-101.555 94.387 172.514 0.000 0.000 91.910 54.325 136.566-102.324 93.681 31.965 83.517 -84.812 97.398 37.113 0.000 0.000 95.915 35.703 120.793 -89.405 95.313 35.272 151.140-110.707 96.637 32.351 133.592-112.598 95.334 40.953 118.800 114.991 92.962 42.674 152.188-133.396 92.454 41.688 151.406 -30.305 91.342 42.887 160.683 -87.108 92.757 46.499 124.970-105.991 91.119 43.324 141.477 80.388 93.306 43.191 115.462 -87.919 92.967 40.957 131.635-110.831 93.982 50.832 122.204-119.453 93.056 64.330 141.688 -74.490 94.680 81.659 122.912-128.559 118.016 0.000 132.090-155.580 # 155 total E -6.62494E+02 rmsd from N 0.000 %NC 0.00 1 91.566 61.063 135.180 -70.317 123.389 -74.996 173.762-107.583 117.399-141.950 95.320 -78.321 128.643-147.735 150.478 -95.351 123.711-174.698 176.426 -79.163 96.199 29.788 133.144-102.172 96.367-161.276 125.493-114.930 135.359-127.353 124.427 -42.373 120.540-115.715 118.104 -94.529 110.552-169.174 138.462 56.799 113.009 63.554 126.149-103.338 113.298 142.383 156.251-149.241 87.350 -56.436 136.509 -98.217 94.248 -32.855 139.049-111.457 93.637 87.428 148.664-100.602 130.606 -91.338 143.479 -90.905 128.146-157.310 156.152 -18.767 128.777 -73.777 139.667-119.221 132.239 -48.296 0.000 0.000 126.235-176.752 135.654 41.101 137.751 -97.712 176.467 -37.164 121.515 -11.500 110.151 -99.242 115.775-165.021 168.804 -99.393 141.497 153.569 144.748 -27.465 91.160 97.593 158.649 -89.018 93.964 84.189 140.650 -76.417 93.073 108.541 137.347 -10.777 115.241-120.336 125.394-114.300 91.921 46.852 90.344 -76.695 92.849 49.733 142.904 -74.568 91.342 42.895 128.674 -76.364 92.334 41.719 135.664 118.389 92.212 41.167 145.805 -73.972 91.061 46.410 128.244 -76.121 92.479 42.125 159.485 -30.392 92.843 40.496 139.251 -90.366 92.225 38.722 117.432 -82.500 93.160 48.690 116.872 -71.132 91.227 49.524 125.964 -74.770 92.569 44.728 127.067-149.977 93.320 73.246 153.922-122.993 114.315 -44.988 141.409-107.292 128.633-134.747 153.032-115.937 124.286 110.425 167.842 -81.164 90.869 -31.375 99.873 -82.035 92.536 -50.275 0.000 0.000 115.784-132.352 138.380 -85.776 92.226 41.026 167.333-158.947 92.419 50.334 142.503 -68.998 92.753 42.125 144.743 122.202 92.587 37.310 140.312-145.731 92.232 45.887 151.971 -29.548 90.754 49.013 127.851 -78.060 91.562 43.958 124.821-109.862 91.259 41.026 139.634 81.314 93.881 43.886 118.972 -87.973 92.736 40.219 128.062-102.545 94.125 54.091 123.512-122.274 93.047 72.765 141.254 -74.366 94.579 100.635 125.312-143.666 117.436 0.000 132.225-116.286 # 156 total E -6.57574E+02 rmsd from N 0.000 %NC 0.00 1 126.133-130.448 147.872 -78.936 125.482 -79.598 131.010 -93.150 116.889-140.090 99.002 -78.131 129.541-154.734 151.465 -97.889 126.282-164.595 156.499 67.108 95.260 41.376 140.721 -76.608 125.040-166.703 140.916 -89.993 121.422-177.222 163.845 -28.186 94.660 33.960 148.108 -71.033 121.798-161.717 158.359-147.836 126.320-110.069 137.854 -89.705 128.808-173.755 131.200 -92.308 103.242 -63.416 156.127 -47.445 97.773 -20.467 0.000 0.000 93.651 87.226 141.858 -93.978 127.896-114.941 142.071 -88.671 122.850-177.525 164.899-149.713 131.039 -74.355 140.519-101.658 131.311 -19.684 0.000 0.000 131.239-161.211 129.057 36.138 128.710-159.712 144.468 109.774 96.859 28.054 139.386 -75.999 125.408-165.930 133.253-111.641 125.933-167.131 159.297 -70.251 92.499 13.379 127.448-113.996 122.706-149.466 144.222-126.971 131.023-166.481 101.444 -76.410 127.337-152.447 142.880 -86.687 124.335-163.076 142.671 35.020 113.679 -34.568 144.997-124.144 91.616 -82.698 129.263 -76.092 91.988 69.504 131.081 -80.022 93.688 57.534 137.760 -90.585 119.062-172.738 176.420 -88.656 121.693-163.861 139.695 -43.917 132.654-146.919 152.013-110.957 123.974-168.893 117.264 6.228 109.443 15.991 92.013 146.639 108.449-152.220 145.476-111.702 125.602-147.240 132.139 33.303 92.593 50.664 150.678 149.589 93.143 35.549 118.812 -98.225 94.266 51.437 0.000 0.000 92.474 42.363 131.355-107.407 93.415 36.296 111.132 -63.887 96.248 37.444 0.000 0.000 94.700 39.331 122.383 -82.783 94.126 36.538 144.466-114.446 95.063 37.473 144.485 -74.994 94.531 38.934 126.379 112.533 93.483 39.689 144.403-125.432 92.877 42.881 148.953 -25.394 91.233 44.160 131.499 -78.646 92.642 43.636 127.137-101.547 91.541 41.482 141.329 82.598 93.781 42.814 141.603 -75.920 92.896 41.252 132.992-105.410 93.803 50.809 124.470-116.830 92.947 64.078 141.684 -74.984 94.689 81.223 125.258-127.252 118.006 0.000 132.233-155.968 # 157 total E -7.13587E+02 rmsd from N 0.000 %NC 0.00 1 91.567 55.153 127.634 -75.255 126.970-106.157 120.457 -85.886 91.284 67.789 105.732 -90.409 90.715 56.429 128.898 -78.491 92.205 44.087 138.710 -72.520 93.828 38.287 168.282 -67.057 93.846 41.705 102.091 -62.523 93.300 42.851 132.086-109.662 91.709 45.428 112.357 39.856 92.220 39.694 151.120-122.767 92.177 69.727 117.827 -79.597 93.443 29.682 141.584-130.088 95.450 140.162 115.993 102.176 125.169 23.390 0.000 0.000 127.547-107.239 172.371 -87.409 130.246-163.101 145.124 -80.103 110.878 -59.396 140.151-126.386 92.368 -24.833 103.192-117.496 95.227 91.008 0.000 0.000 125.467-117.738 137.988 0.956 125.294-135.866 133.126 -97.769 129.803-119.905 158.594 -45.520 114.870-176.690 163.621-166.114 94.872 32.503 143.709 -67.413 92.981 104.497 131.670 -81.946 93.823 -26.072 124.528 154.993 93.079 -62.633 148.093-100.336 91.347 12.362 128.948 -75.977 119.188-174.895 145.669 22.326 128.825-169.348 164.034 -29.833 130.495 -81.451 145.735 -86.438 91.926 53.235 125.762 -44.129 91.318 41.506 133.058-119.987 90.788 51.318 130.683 -77.755 91.602 43.817 126.269 -92.666 91.307 49.224 145.397-146.876 91.005 44.747 126.246 -92.674 91.298 59.222 110.985 -61.258 90.785 46.126 128.542 -75.730 93.663 85.312 128.757-149.973 92.703 -61.207 159.239 0.201 94.752 -58.435 156.971 -46.174 94.577 169.049 0.000 0.000 91.898 52.068 132.333 -95.931 93.818 32.948 84.997 -82.827 98.346 31.568 0.000 0.000 97.339 33.528 119.741 -87.482 96.344 30.231 96.866 -46.438 97.446 34.081 135.116 -91.320 96.237 34.904 112.663 135.114 95.067 36.518 154.630-135.108 93.637 40.828 149.716 -20.040 91.212 46.922 132.123 -81.221 91.636 46.234 129.188-102.389 90.851 41.154 139.833 81.654 93.227 44.610 112.934 -72.898 92.841 40.031 132.945-114.639 93.877 48.840 122.817-119.467 93.167 68.538 141.877 -74.613 94.591 85.015 127.552-122.612 117.685 0.000 135.710-144.998 # 158 total E -7.18291E+02 rmsd from N 0.000 %NC 0.00 1 91.571 64.656 141.866 -80.804 123.090 -88.904 133.065 -76.789 117.127-103.757 138.029-147.448 91.125 54.142 131.214 -76.906 92.102 47.837 111.561 -86.750 93.249 37.711 158.895 -69.422 93.245 42.737 140.090 -71.766 93.142 43.250 174.978 15.722 91.322 42.892 119.272 -46.467 91.703 42.427 132.455 -98.798 91.954 45.213 121.418 -67.395 92.439 46.650 150.675 179.453 92.422 39.475 172.510-143.154 94.325 53.085 151.724 49.023 92.997 97.449 142.299 -99.541 96.138 -5.080 139.310-108.319 93.826 -79.656 144.915-146.252 92.881 -3.657 105.364-126.529 96.286 96.098 0.000 0.000 130.156-131.175 143.925 12.675 123.336-156.744 162.704 -53.010 126.652 -78.299 138.487-121.935 123.995 -86.794 128.645 -83.184 92.516 47.265 138.422 -77.082 91.157 47.282 129.789 -76.823 92.223 44.526 147.882-103.239 91.543 44.444 108.757 -64.168 91.414 41.205 127.701 -75.712 92.396 41.069 110.755 -49.195 93.839 41.138 140.016 -73.609 91.502 44.900 135.367-102.576 92.305 39.221 156.448-176.183 92.286 43.977 141.528 -49.462 91.279 44.612 129.852 -78.133 92.666 41.463 127.945 -97.788 92.171 40.835 140.162-141.416 91.492 44.568 114.728 -65.944 92.139 50.682 133.446 -80.025 91.070 45.205 129.188 -76.272 93.990 82.041 129.470-151.239 92.633 -66.261 151.628-172.741 94.681 -55.131 141.902-100.209 94.542 171.857 0.000 0.000 91.766 55.113 137.165-101.329 93.255 33.863 86.837 -84.872 97.492 34.772 0.000 0.000 96.235 34.616 117.911 -89.731 95.244 34.737 150.795-102.135 96.666 32.953 160.681 -66.893 96.773 33.493 119.080 119.369 95.906 34.329 149.204-128.733 94.052 42.159 149.340 -23.631 91.259 46.209 129.772 -79.141 92.399 42.101 128.604 -89.996 91.836 39.569 140.922 82.844 94.135 42.645 141.261 -75.678 92.849 41.674 137.385-106.488 93.710 50.259 127.142-113.423 92.880 63.037 141.707 -74.919 94.720 80.501 124.415-125.113 117.989 0.000 132.476-156.649 # 159 total E -6.98423E+02 rmsd from N 0.000 %NC 0.00 0 91.571 57.324 137.124 -85.396 119.201 174.561 130.628-105.723 94.097 29.577 144.961-174.689 92.821-156.069 129.357 -76.232 129.542 178.999 150.382-109.212 95.333 33.783 168.944 -77.508 95.420 166.632 99.772 -74.587 139.806 -88.422 83.863 -75.522 117.177-122.581 117.856 -63.662 120.761-158.923 163.380 15.236 95.225 37.775 140.019 -75.309 129.915 162.473 169.793 176.307 91.543 -49.211 120.152 -89.060 97.763 -29.431 0.000 0.000 94.165 78.157 140.327 90.666 132.148 -90.568 151.988 -98.612 124.569-141.522 162.307 -4.738 133.059-125.938 169.248 98.802 124.202 -10.874 0.000 0.000 107.230 160.398 128.574 77.675 138.592 -70.605 154.712 33.909 124.144 0.409 129.311 -85.290 129.211-174.005 99.256-101.604 136.263-175.929 38.030 -48.052 91.482 11.963 130.571 -77.400 118.620 -80.686 168.256 -81.469 92.872 73.339 128.222-135.229 118.683-177.189 142.441 -45.573 141.395 -58.661 133.629 47.450 134.760 -66.693 126.255 -78.251 135.722-145.817 137.003 -82.018 90.950 51.296 146.168 65.525 91.088 46.575 92.644 -62.838 90.586 51.987 129.626 -74.826 91.625 45.423 141.605-120.234 91.406 46.347 124.240 131.477 91.434 46.602 118.334 -72.875 91.618 74.093 121.959 -83.144 90.815 50.309 128.431 -75.575 93.584 80.956 130.448-154.784 92.643 -65.499 152.171-170.111 94.673 -55.943 142.406 -98.891 94.420 166.393 0.000 0.000 92.228 52.788 132.429 -95.943 94.316 32.619 79.947 -84.695 98.665 30.718 0.000 0.000 98.169 30.762 117.278 -85.639 97.077 30.833 151.336 -98.591 98.166 30.590 142.704 -76.020 97.779 31.879 133.915 127.851 96.387 33.902 153.775-145.271 94.489 40.606 150.793 -26.723 91.801 42.520 128.821 -78.203 93.812 40.812 151.741-103.640 92.648 39.932 134.761 102.459 95.548 39.458 142.531 -75.177 93.867 39.151 115.956 -84.752 94.573 50.476 133.595-126.892 93.248 61.347 140.739 -73.772 94.734 83.060 130.636-131.755 117.995 0.000 132.400-154.035 # 160 total E -6.75717E+02 rmsd from N 0.000 %NC 0.00 1 91.603 108.992 132.162 -79.444 125.744 -83.362 133.999 -84.111 116.897 -98.741 136.073-144.171 91.349 52.297 131.483 -77.042 92.486 43.284 111.266 -77.758 93.240 41.370 166.966 -82.529 93.100 40.152 100.787 -55.355 93.561 42.568 154.985 -93.906 92.114 39.616 119.606 -38.982 92.711 42.382 144.398-103.571 93.285 38.444 118.155 -81.884 93.019 48.100 143.470-116.752 93.907 33.674 138.594 -94.121 95.780 51.145 139.049-111.457 93.677 81.996 135.224 -93.721 143.694-143.882 106.830 -84.377 127.647 165.969 149.230-168.538 116.682 -85.827 176.539 -86.852 95.854 13.289 167.044-117.212 94.161 73.749 126.800 -41.979 95.119 146.828 120.729 -58.264 94.195 150.327 126.010 -90.213 96.479 36.364 109.522-112.924 92.064 127.734 100.747 -8.498 91.638 108.876 129.948 -76.895 92.618 -10.921 138.387-113.465 94.223 -76.255 144.288-160.831 117.553-163.039 128.961 -85.950 121.724 -45.406 133.501 -1.748 122.658-134.709 137.171 -65.684 131.699 -88.291 132.970 -70.006 91.539 50.858 116.758 -45.556 90.838 47.076 131.550 -67.890 90.752 51.078 129.046 -76.774 91.930 40.259 114.902-101.526 91.755 48.270 146.167-142.355 91.571 43.493 125.790 -82.925 93.055 40.830 113.937 -59.551 91.335 45.990 129.070 -76.995 92.313 44.563 126.280-146.522 92.091 46.011 160.314 -19.807 93.354 36.486 119.647 -88.391 94.459 45.248 0.000 0.000 92.649 42.276 136.376-109.172 93.518 35.477 137.960 -17.352 96.153 38.544 0.000 0.000 94.603 38.656 123.013 -81.270 94.119 37.369 144.637-115.545 95.593 35.928 166.435-113.246 94.956 38.358 124.173 105.911 94.196 36.652 144.070-129.059 93.834 41.323 150.894 -28.521 91.484 43.512 130.951 -78.446 92.752 44.598 140.964 -76.789 91.293 41.762 138.463 84.528 93.580 43.199 113.478 -81.002 93.017 40.721 133.574-109.710 93.991 50.678 129.256-116.183 93.024 64.038 141.727 -74.436 94.688 81.703 123.189-127.400 118.033 0.000 131.896-155.776 # 161 total E -6.60442E+02 rmsd from N 0.000 %NC 0.00 1 91.572 56.725 133.925 -76.792 111.938-173.532 142.230 87.449 95.678 11.388 141.923-166.725 94.443-108.632 131.001 -77.814 91.692 45.221 102.987 -54.796 95.173 74.017 135.230 -67.688 118.863-135.816 154.936-167.894 133.276 177.549 139.516 39.361 92.614 34.640 119.607 -59.923 118.443-138.550 158.099-144.371 124.407-128.997 169.726 -47.242 124.491-171.905 166.438 167.463 107.552 -63.515 129.479-119.884 98.629 -19.235 0.000 0.000 93.706 84.423 140.890 -91.033 126.916-128.413 147.608-103.253 124.297-171.286 176.452 5.390 132.812 -76.628 136.428 -89.996 127.357 -18.225 118.346 62.818 124.363-176.157 138.319 24.679 94.003 53.730 138.154 -74.237 93.312 82.948 166.541-117.156 94.058 76.200 111.021 -85.089 91.736 137.155 128.496 84.444 91.338 100.142 131.821 -78.697 92.710 -8.850 141.226 -77.791 92.897 -83.173 137.165-137.073 114.745-172.901 157.176 -91.405 91.867 47.409 105.258 -54.424 93.289 47.829 164.944-107.417 91.463 45.246 129.577 -76.261 92.363 40.193 128.172 95.792 92.127 44.617 150.115 -69.972 91.276 44.749 128.815 -78.297 92.399 43.411 129.950-156.412 91.951 43.639 135.868 109.429 91.420 45.613 119.373 -76.621 91.756 55.536 125.268-110.666 90.746 45.644 129.449 -76.313 93.324 80.955 127.643-151.282 92.843 -65.081 153.698-153.202 95.248 -59.389 143.938-104.647 95.094 164.640 141.674 -98.339 92.221 75.197 125.334 -90.612 93.205 62.594 86.424 -88.959 95.272 100.848 0.000 0.000 114.095-126.598 121.079 -99.010 92.798 48.965 159.193-103.648 92.928 44.029 142.605 -74.584 93.114 43.780 130.340 103.554 93.217 37.331 136.836-115.520 93.532 41.464 147.179 -34.357 91.459 46.077 130.874 -78.004 93.329 43.209 126.882 -85.047 92.478 37.353 135.384 90.111 95.361 41.267 140.681 -98.657 93.642 41.038 136.689 -96.522 93.573 59.234 132.020-129.401 92.239 73.522 140.321 -75.047 94.435 92.746 94.294 -83.822 117.484 0.000 135.564-127.736 # 162 total E -7.12318E+02 rmsd from N 0.000 %NC 0.00 0 91.571 49.091 118.896 -70.125 134.816 -85.155 145.574 -87.963 115.820 -94.105 144.472-161.751 91.843 49.682 133.107 -78.760 93.026 40.220 97.893 -43.968 93.763 47.017 156.944 123.658 93.139 41.503 108.695 -62.938 93.496 36.699 131.286-117.603 92.475 43.522 120.757 50.585 92.328 47.460 163.130-160.634 90.731 49.698 121.491 -93.228 92.088 62.471 126.378-125.058 91.957 -80.562 135.846 -85.588 115.960 -50.004 145.570 51.587 93.399 146.240 132.672 84.092 94.569 89.360 141.779 -72.729 92.512 135.623 136.897-108.753 105.979 -64.837 105.322 111.959 93.373 45.313 167.044-117.212 111.281-143.725 130.158 -28.522 129.722-167.173 164.996-150.983 123.781-172.584 167.146 -45.987 130.630-155.523 164.083 21.361 114.299 22.495 141.184 -95.963 92.284 107.940 131.028 -78.029 93.701 -21.721 176.277 -72.820 93.539 -63.660 153.079 -1.943 92.065 8.159 131.223 -75.643 115.905-160.799 132.856 32.381 127.415-161.270 138.146 -39.844 121.807-160.745 143.185 -95.614 130.336-161.894 150.266-158.653 95.830 -23.421 118.598-142.109 92.015 -86.407 129.532 -77.165 92.362 64.124 119.658 -30.663 93.718 62.408 152.340-134.360 92.366 179.296 121.467-140.085 129.111-170.071 176.471 129.778 126.839-146.119 160.015 -91.151 122.568-157.113 134.906 158.949 93.954 44.252 154.481-169.173 92.928 39.949 162.073 -3.385 93.790 46.711 0.000 0.000 92.553 42.436 124.238 -99.726 93.574 35.713 140.625 -23.186 96.338 37.797 0.000 0.000 94.646 39.331 127.414 -86.456 94.033 36.379 143.838-110.326 95.372 37.027 165.878-109.658 94.613 38.808 126.044 111.562 93.548 39.604 144.831-125.670 92.903 42.872 148.662 -26.231 91.232 44.190 131.587 -78.717 92.631 43.636 127.108-100.566 91.551 41.474 141.394 82.664 93.795 42.730 141.544 -75.914 92.902 41.307 133.265-105.814 93.792 50.761 124.601-116.636 92.945 64.070 141.693 -74.980 94.683 81.209 125.185-127.166 118.011 0.000 132.213-155.989 # 163 total E -6.61681E+02 rmsd from N 0.000 %NC 0.00 1 126.133-130.759 147.832 -79.253 125.517 -78.211 130.131 -90.005 116.821-139.986 102.561 -72.825 128.581-156.643 137.787 -95.839 126.214-172.572 176.439 -92.780 94.120 40.326 163.169 -81.147 114.817 177.399 135.261 -85.607 132.338-121.201 163.301 46.888 130.296-120.984 111.583 -63.506 113.114-174.173 143.865 151.511 96.696 67.126 139.645 -69.706 121.018 140.761 171.488 172.998 87.130 -53.896 133.023 -99.516 95.807 -31.535 145.570 51.587 93.722 84.318 145.900 -95.883 129.729 -84.672 141.494 -90.499 122.041-158.799 153.961 -11.777 128.021 -84.689 142.499-100.936 129.110 -43.930 118.346 62.818 134.378-151.517 142.162 -22.942 122.245-136.023 132.108 -73.736 96.754 48.968 100.105 -83.136 135.701 175.561 95.405 -81.497 131.635-174.294 56.538 -48.413 91.250 -11.692 163.829 -95.359 120.657-128.273 165.649 -77.048 91.884 38.979 93.551 -91.284 90.999 59.888 128.293 -76.007 91.522 43.326 104.090 -46.878 92.195 48.307 166.009 -81.388 90.683 52.405 128.500 -76.676 91.638 59.642 117.050 -81.186 91.276 116.244 140.669 137.066 91.385 35.341 131.300 -81.135 122.770-168.510 72.108 -83.510 92.571 1.328 132.924 69.534 119.652-156.060 135.879 -21.218 121.691-145.998 154.310 118.355 91.533 -53.992 125.934 -73.801 92.740 -65.521 117.453-126.838 91.709 85.146 159.197 -18.899 95.804 27.882 105.180 -93.132 126.640-151.169 0.000 0.000 122.076-151.718 141.951 -82.156 94.385 -33.687 141.230 -27.118 138.899-116.161 0.000 0.000 122.403-158.622 165.294-149.276 92.749 40.672 160.891-120.924 92.942 52.278 156.564 -47.019 92.640 42.220 115.300-168.397 93.180 35.984 136.953-121.423 93.493 44.003 154.075 -20.448 91.375 43.407 129.699 -78.338 92.482 45.288 126.221-104.028 91.439 40.294 140.438 86.507 93.999 42.471 137.666 -71.130 93.037 41.542 133.577-119.886 93.928 51.594 126.583-116.946 92.761 64.776 126.318 -82.860 94.679 81.526 123.071-126.113 118.031 0.000 131.941-155.824 # 164 total E -6.68776E+02 rmsd from N 0.000 %NC 0.00 1 126.103-130.383 148.999 -82.126 127.736-146.622 129.607 -78.179 90.919 93.197 139.013-165.880 91.143 45.124 130.520 -77.179 92.637 48.705 152.107 82.371 93.491 36.642 146.312 -73.258 93.952 39.973 137.940 -71.834 92.903 43.746 110.138 136.327 91.999 41.167 167.325 -44.300 92.374 40.381 140.238-115.108 92.750 67.042 142.246 74.135 90.956 71.316 132.249-105.523 91.773 14.222 120.096-118.761 103.091 -94.770 151.724 49.023 116.164 153.699 134.734 86.618 93.728 73.368 156.112 -34.300 92.110 73.682 132.959-120.528 92.915 18.473 132.040 -98.757 116.753 -8.165 0.000 0.000 127.954-147.618 93.312 -75.043 123.246-172.278 159.151 33.377 118.866 179.892 109.704-121.172 132.339-151.437 150.032 165.289 130.781-165.953 157.003 -15.926 111.013 -71.501 150.320 -93.778 93.946 -13.715 140.065 -75.192 94.053 93.425 104.941 -83.934 118.202-152.071 155.430 -84.257 126.797-161.106 140.754 29.975 122.706-162.115 135.367 -42.885 120.794-165.829 153.293 -84.421 125.262-163.283 153.423-155.871 94.852 -27.052 116.237-146.619 92.107 -84.196 128.562 -76.553 92.249 62.940 136.406-131.443 93.920 62.251 130.089-142.487 92.261 178.737 121.481-139.802 131.236-173.043 160.338 150.543 128.475-153.810 162.530 -84.915 127.090-168.478 139.698 154.951 124.880-170.233 171.669-164.911 122.055 -50.513 162.848 161.026 94.715 176.236 0.000 0.000 92.453 54.256 137.163-110.603 93.159 33.900 90.056 -83.631 96.583 40.644 0.000 0.000 94.408 38.992 121.917 -94.427 93.864 38.663 146.468-118.075 94.809 37.237 141.259-122.315 94.307 40.071 123.479 109.095 93.217 39.631 143.250-125.939 92.758 43.432 151.099 -30.237 91.172 43.917 139.372-102.295 92.600 44.594 126.208 -99.935 91.459 41.676 141.649 82.199 93.763 42.462 115.111 -82.891 93.034 41.317 133.205-113.903 93.928 50.291 124.964-116.910 93.015 64.358 141.852 -74.425 94.681 81.446 122.962-127.488 118.022 0.000 132.023-155.876 # 165 total E -7.04384E+02 rmsd from N 0.000 %NC 0.00 1 91.600 108.861 131.969 -79.507 125.544 -83.954 132.239 -85.032 116.965 -97.127 132.755-138.589 91.289 53.645 157.302 -83.696 92.492 43.050 112.560 -70.418 93.049 42.770 176.447 -65.668 92.557 40.203 101.601 -54.512 92.986 43.238 155.371-101.676 91.644 44.937 137.155 -93.136 92.476 38.259 149.790-110.093 91.975 67.838 112.553 -92.926 93.620 56.619 152.286-174.582 92.944 57.939 151.175 33.015 94.808 137.620 0.000 0.000 127.737-164.880 155.040 88.149 120.325-160.132 176.430 -94.676 120.252 -69.448 164.626-153.713 92.576 -14.944 104.614-116.722 95.325 91.457 0.000 0.000 124.102-155.423 146.578 -27.497 124.238-162.030 157.811 -58.244 94.641 99.724 117.063-129.846 93.035 -15.034 123.247 -81.004 94.035 -75.359 122.601 -90.348 92.279-176.371 130.587 -76.604 133.210-153.196 170.417-160.136 119.879 -93.108 151.045 -13.140 92.035 48.621 128.936 -76.011 91.847 39.965 114.105 -44.921 92.444 53.697 142.781 -73.846 91.363 43.233 121.915 -74.402 93.061 36.164 138.373 141.476 93.207 42.941 142.433-135.898 91.623 46.288 128.132 -77.038 93.274 38.923 143.516-116.218 93.335 39.198 139.431-139.670 91.962 44.972 116.833 -78.768 92.520 55.364 124.131 -90.238 90.849 45.761 129.144 -76.209 93.777 79.044 128.923-150.387 92.855 -69.661 152.842-173.637 94.912 -53.172 141.874 -99.103 94.713 170.468 0.000 0.000 91.840 59.175 136.155 -94.937 93.505 32.332 85.471 -85.625 97.877 33.566 0.000 0.000 97.019 33.361 118.678 -91.130 95.712 34.351 104.831 -49.530 96.731 33.530 135.052-121.594 95.699 36.628 118.204 117.927 94.251 38.346 149.631-145.308 93.360 41.600 151.078 -22.722 91.196 44.505 134.715 -78.952 92.222 44.445 126.657 -96.943 91.244 40.774 139.955 84.561 93.663 42.481 110.321 -74.883 93.093 40.463 139.912-104.550 94.001 53.756 127.186-120.965 92.830 69.789 141.696 -74.371 94.611 88.132 123.603-135.901 117.584 0.000 136.235-139.739 # 166 total E -6.74065E+02 rmsd from N 0.000 %NC 0.00 1 91.571 59.952 135.566 -79.917 123.802-104.850 136.797-101.952 92.351 59.197 102.883 -92.981 91.233 47.235 129.531 -74.336 92.999 39.217 141.686 -77.716 94.409 37.623 168.209 -72.394 93.960 41.782 100.832 -53.548 93.486 41.086 144.498 -98.888 92.674 39.100 120.820 60.087 92.814 39.254 146.391-106.052 92.027 52.045 120.126 -82.263 91.884 58.303 146.983 158.589 93.068 31.706 117.431 -83.586 95.467 60.849 166.936 174.261 119.792-137.841 149.127 -84.645 125.627-138.244 138.970-104.990 119.752-125.048 176.483-160.294 129.512 -72.668 123.619-121.321 116.564 -4.505 0.000 0.000 127.749-151.579 139.550 -32.649 122.594-158.128 163.372-119.599 95.104 99.756 142.115 -76.457 93.683 -14.621 114.179 -99.304 93.503 -75.313 90.901 -24.141 91.997-176.678 131.433 -76.650 130.646-160.839 167.094-152.462 116.063-100.369 150.591 -8.544 91.539 45.773 130.085 -76.711 91.256 43.865 114.473 -48.083 91.304 65.235 137.409-112.762 90.562 47.404 124.943 -77.402 91.234 41.486 131.944 113.809 91.221 46.160 138.760-133.467 90.585 50.849 127.851 -76.253 91.687 42.117 130.570-155.669 92.184 40.422 136.896-116.519 91.753 43.664 120.111 -88.755 92.070 47.314 129.199 -91.124 90.884 53.130 128.683 -74.248 92.422 37.772 120.492-138.517 93.465 58.419 152.568-125.321 109.479 -67.430 141.144-109.856 117.785-166.552 146.548-108.735 124.735 109.029 169.670-113.086 91.246 -7.394 140.134-145.659 97.224 -82.032 0.000 0.000 119.595-167.866 143.609 -86.952 92.615 52.694 126.487-133.829 92.788 75.271 115.110 -48.574 91.989 49.319 139.409 96.738 91.850 39.932 153.860 -26.561 92.184 46.316 147.693 -25.855 90.879 47.779 131.952 -78.206 91.871 43.508 127.840-107.996 91.426 39.648 138.965 78.464 93.703 46.313 144.085 -75.048 92.328 39.631 128.033 -66.676 93.582 52.292 121.127-116.259 92.957 65.303 141.304 -75.022 94.530 79.853 128.959 -99.194 118.115 0.000 130.923-158.570 # 167 total E -6.46366E+02 rmsd from N 0.000 %NC 0.00 1 126.051-133.708 147.071 -86.589 126.638 -83.114 132.786 -83.938 116.972 -99.659 137.539-146.607 91.383 52.251 156.313 -83.037 92.393 44.751 113.544 -85.247 93.077 40.564 161.092 -86.889 92.841 42.241 136.354 -74.924 93.418 41.393 176.479 170.183 91.699 42.872 124.595 -44.826 91.972 44.170 142.001-113.361 92.675 42.935 120.880 -73.164 93.168 43.535 144.636-127.199 93.572 40.820 116.544 -92.701 94.348 56.723 0.000 0.000 93.461-115.635 139.797-103.855 94.231 130.350 169.167 -59.026 92.236 75.883 145.312-123.544 94.615 23.562 132.359-100.060 127.182 -19.844 167.044-117.212 99.606 -85.324 126.050 -64.438 114.856 170.492 158.205 11.500 94.195 87.099 168.076-113.407 94.277 117.394 106.616 -54.565 92.365 60.929 152.066-144.229 91.985 96.523 131.571 -77.493 118.753-107.664 142.271 -81.405 121.640 -97.730 153.847 -14.066 91.423 50.487 129.052 -75.900 91.490 44.313 114.660 -45.076 92.765 44.488 141.116-109.836 91.099 46.220 127.624 -75.536 91.988 41.953 168.750-125.090 92.203 42.554 122.399 -32.215 91.295 51.750 126.740 -73.460 93.530 74.383 148.354-134.290 91.970 44.564 148.762-153.760 91.758 130.877 127.506 -22.391 132.736-100.474 160.548 12.040 122.399 -87.422 120.387 -86.724 111.557 -78.389 135.069-164.446 92.700 71.501 157.336 2.196 94.173 39.476 138.706-103.757 94.929 65.460 153.032-115.937 106.520-162.499 134.844-119.878 93.801 -43.093 144.226 -20.418 120.764-157.893 0.000 0.000 124.031-132.103 129.548-113.393 93.365 36.432 79.760 -58.800 94.092 47.343 159.600 -40.385 93.820 39.179 123.043 134.969 93.824 36.675 145.874-126.962 93.339 43.097 148.916 -25.907 91.274 45.921 130.117 -79.642 92.230 43.620 126.745-107.952 91.418 40.352 140.471 82.907 93.934 43.626 141.617 -76.122 92.842 40.466 131.069-104.269 93.876 51.341 124.237-117.205 92.938 64.222 141.647 -74.917 94.689 81.261 125.612-127.621 118.001 0.000 132.292-155.818 # 168 total E -6.48335E+02 rmsd from N 0.000 %NC 0.00 1 91.569 50.713 119.908 -68.900 125.722 -87.030 130.932 -91.007 116.761-101.281 141.547-152.367 91.473 50.558 131.669 -77.689 92.220 49.923 127.723 -95.626 92.223 57.991 146.487 -73.761 91.706 62.035 91.557 -66.452 93.519 52.601 133.674-104.025 93.737 153.034 120.777 -59.893 92.867 46.610 143.291 -12.703 117.001-167.326 166.306 39.417 119.207-169.030 138.053-108.210 109.454 -70.234 167.118 -24.621 97.403 -13.573 164.396-123.999 93.478 90.324 115.496 72.890 121.819-147.369 145.487 -80.552 125.444-160.290 154.776-164.272 133.238 -62.972 156.246-147.351 140.719 -33.268 151.550 -22.359 147.902-178.257 129.180 57.160 95.061 69.495 115.480 -74.830 94.497 161.189 136.045-102.793 139.536 -44.538 138.786-116.487 93.734 151.405 125.569 99.262 145.576 156.052 155.434 -91.941 93.915 34.116 140.216 -92.855 94.137 176.635 127.926-127.171 126.075 177.619 133.726 -88.411 116.373 173.437 131.477 31.877 122.442-176.840 154.408 156.221 124.724 179.515 157.307 -73.510 123.686-173.408 158.943 154.193 106.816 -30.594 111.151-154.020 91.445 -82.137 128.414 -75.855 92.677 62.599 176.414 174.671 93.913 64.160 154.117-141.538 92.305 165.153 121.833-140.873 130.686-179.578 152.011-152.146 125.401-176.755 162.823 -80.231 126.940 176.515 169.518-145.112 115.594 172.856 166.863-156.282 128.743 179.792 148.780 144.372 123.104 178.256 0.000 0.000 154.734 148.706 164.113 -46.364 92.759 7.896 104.016 -82.379 126.962-106.637 0.000 0.000 126.475 160.863 115.475 -79.298 92.520 54.498 131.568 -94.366 92.826 52.772 138.545 -73.977 92.783 41.494 116.902 137.125 93.420 37.636 148.593-114.822 92.724 46.778 147.952 -21.629 90.723 54.037 131.299 -79.221 90.344 44.314 119.035-112.131 90.725 42.232 142.846 79.492 93.210 43.569 110.931 -60.264 92.865 41.881 135.762-119.739 93.703 44.072 123.854-119.705 93.411 63.020 142.312 -75.479 94.927 83.417 127.010-105.243 118.038 0.000 131.826-154.014 # 169 total E -6.89355E+02 rmsd from N 0.000 %NC 0.00 1 125.471-129.564 159.511 15.292 124.260 -76.784 118.850 -93.434 115.986-139.604 101.145 -79.607 133.639-154.697 154.434-103.717 118.427 172.026 173.381 -30.740 95.067 99.500 130.103 -55.316 96.223 68.820 99.086 -62.900 132.285 -86.347 115.666 -57.434 92.820 21.149 92.085 -77.140 116.232 -92.472 147.476 -82.316 119.565-142.762 167.928 -55.734 124.826-166.249 156.143-113.129 101.269 -68.762 167.964 9.368 95.885 -15.374 151.724 49.023 93.814 87.728 143.134 -95.633 124.812-127.669 135.840 -98.104 127.128-171.416 158.212-125.401 129.664 -75.613 153.944-109.212 129.743 -25.128 112.685 -60.578 129.552-127.450 117.552 56.183 136.339 -71.313 170.019 -33.927 125.353 -32.790 108.499-111.558 124.764-103.857 133.008 -76.693 92.204 42.145 138.111 -76.144 90.886 50.456 130.204 -77.169 91.718 45.626 145.428 -79.217 91.754 44.250 109.003 -65.455 91.702 38.184 127.266 -75.514 92.371 43.476 110.572 -49.020 93.050 45.681 105.957 -63.457 91.723 42.504 128.049 -75.967 94.330 31.782 138.191 -70.074 94.923 41.535 147.406 -54.138 92.009 43.891 129.130 -80.087 92.410 41.576 123.807 161.904 91.877 43.991 154.708-138.516 91.717 41.892 119.515 -71.862 92.955 41.791 148.409 -92.629 91.300 46.171 128.058 -75.881 91.974 43.801 129.374-152.091 92.007 46.848 149.161-133.055 93.418 35.109 121.236 -87.718 94.614 46.979 0.000 0.000 92.897 41.493 136.557-111.319 93.539 36.079 113.523 -63.285 96.223 37.691 168.407-131.814 94.740 38.865 120.347 -78.820 94.173 36.523 145.022-120.196 95.261 37.059 142.249-122.265 94.541 39.073 127.228 110.395 93.432 39.753 144.553-125.723 92.781 43.078 148.709 -26.052 91.191 44.271 131.238 -78.443 92.621 43.610 126.996-100.947 91.545 41.480 141.389 82.558 93.790 42.795 141.593 -75.938 92.893 41.288 133.078-105.244 93.802 50.725 124.506-116.737 92.952 64.024 141.692 -74.988 94.690 81.198 125.312-127.144 118.007 0.000 132.224-156.001 # 170 total E -6.54137E+02 rmsd from N 0.000 %NC 0.00 1 125.999-138.018 141.641 -85.541 127.108 -96.948 144.853-101.557 93.798 49.592 100.687 -83.291 111.842-179.861 158.302-103.970 94.149 48.661 141.214 -76.757 117.410 179.771 131.673 -96.992 132.607 -82.757 130.533 -95.854 140.378-170.835 176.452 141.557 105.221 178.222 106.798 45.426 92.055 42.510 144.454-147.483 108.394 151.207 166.490 2.872 95.535 -36.476 149.578 144.535 92.646 -48.495 134.033-109.700 93.974 88.978 166.423 166.409 127.666 -98.956 110.549 -89.261 125.141-164.333 166.533 -54.232 121.606 174.083 140.863 124.710 93.486 81.623 104.453-123.349 97.603 121.010 176.451 6.068 122.842 -75.507 160.224 -14.666 135.928 -25.606 137.132 -69.969 125.782-162.588 129.896 -87.791 122.131 109.150 173.387 -60.154 92.430 105.848 92.905 -4.418 91.533 -5.257 130.150-125.800 102.945 -83.352 115.236-112.441 118.911 -91.735 151.362 -24.615 91.169 49.346 129.515 -76.904 91.060 42.846 112.231 -47.038 92.474 45.670 163.438 -91.142 90.812 45.865 130.656 -79.539 91.189 39.680 138.984-179.486 91.448 44.819 143.791-137.205 90.473 48.540 125.037 -74.156 91.608 44.191 136.931-112.907 91.361 46.329 161.057-165.823 91.149 52.239 124.967 -90.741 91.918 65.731 92.937 -51.192 90.806 60.462 131.001 -77.136 93.204 119.839 125.990-149.159 92.478 -26.342 164.266 -3.501 92.964 -62.325 167.743-135.513 99.117 -25.988 0.000 0.000 92.979 105.380 124.723 -98.094 94.452 41.110 136.419-171.191 95.542 158.419 0.000 0.000 127.216-160.216 168.227 46.623 122.967-150.480 128.242 -55.478 128.703-124.547 120.536 -69.321 92.774 55.549 141.356 91.423 93.213 33.333 150.130 -27.497 94.359 42.464 148.160 -30.405 91.663 43.550 128.111 -77.205 93.224 47.471 169.666 14.066 90.872 40.358 137.340 -59.006 93.616 42.491 111.174 -86.130 93.881 35.790 129.771-108.090 94.851 51.950 148.042-114.145 93.059 63.749 142.785 -77.845 94.672 83.602 123.441-123.018 118.121 0.000 130.770-154.888 # 171 total E -6.58971E+02 rmsd from N 0.000 %NC 0.00 1 91.569 60.408 135.648 -76.853 123.294 -87.893 124.872 -88.152 116.870-125.820 102.570 -69.090 129.820-138.696 148.151 -94.651 125.170-161.517 153.117 -88.991 131.956-152.069 153.781 26.025 117.607-160.927 168.333-117.610 129.182-168.090 155.405 -1.963 92.460 43.541 108.681-115.230 117.766-165.190 142.276-120.056 119.303-144.076 164.798 -56.128 124.447-168.851 164.568-176.462 108.109 -63.672 143.802-106.175 98.460 -17.450 171.212 -76.272 93.731 86.410 140.386 -90.301 128.137-131.955 150.233 -99.829 125.047-171.345 166.497 -7.133 131.664 -93.835 142.810-104.949 127.443 -10.858 0.000 0.000 121.951-164.882 127.441 29.993 135.765-154.947 143.869 -52.847 110.224-171.269 123.912 -77.073 139.044-136.245 134.152-126.710 116.485 -93.291 156.577 96.004 91.645 50.427 130.205 -77.423 92.502 36.931 144.426 -78.139 91.423 59.605 137.643-142.313 90.784 50.279 125.959 -76.008 91.921 35.947 109.742 -51.535 95.303 39.210 143.062 -74.927 91.791 46.280 129.961 -76.490 91.455 46.956 135.464 175.419 91.183 44.319 145.502 128.314 91.084 50.068 129.580 -77.629 92.376 73.217 121.073 -50.545 91.700 75.619 82.401 100.233 90.923 137.924 106.275 -26.058 97.865 72.072 130.112 140.557 92.157 -75.662 135.559 -79.009 92.798 -27.991 92.811 -95.523 93.052 97.424 157.712 -13.319 120.229 -72.875 151.491-133.670 127.288 -40.463 153.032-115.937 123.771 178.249 155.592 -85.495 93.554 20.331 140.280 -25.263 135.883 -42.231 0.000 0.000 130.517-150.062 155.173-104.639 129.364-136.686 163.450 29.987 130.231-168.747 128.590 -76.157 131.117-131.276 135.577-127.599 134.581-170.878 123.287 -81.660 121.773 -66.587 149.826 -3.262 91.789 -19.678 129.926 -76.385 96.366 87.150 160.491 -60.913 129.219-137.746 172.275-145.264 129.935-160.417 152.030 43.504 128.038-134.124 166.935 14.926 128.341-160.453 128.293 -64.336 120.848-173.401 136.710 -55.094 126.276-134.247 136.576-135.201 117.670 0.000 148.285 131.026 # 172 total E -6.50028E+02 rmsd from N 0.000 %NC 0.00 1 126.095-129.853 149.622 -80.690 126.055 -77.934 129.543 -83.851 117.013-174.408 126.294-128.453 132.473-158.075 141.444 -89.000 127.035-137.337 138.802-100.364 93.866 -33.721 142.467 -73.806 107.255-135.716 124.329-124.921 93.484 43.998 124.409 -69.176 91.226 47.198 129.165-115.933 91.948 46.574 138.209-167.150 91.880 43.830 136.346 -74.224 92.730 63.843 127.192-118.659 96.746 -72.124 131.835 -69.249 117.068 -27.229 111.470 -82.115 132.822 178.400 130.442 65.515 116.973-174.003 119.156 -99.180 124.692 -81.879 151.989 175.726 93.279 -4.133 109.422 107.019 95.672 87.504 0.000 0.000 120.733-172.093 138.668 -23.645 124.279 173.191 120.252 -60.572 93.778 92.629 106.883-129.528 140.607 -44.220 123.268-110.291 133.016-133.962 144.052 -88.225 127.287-158.976 143.067 -82.551 115.002 -63.307 132.764-134.640 94.196 -20.583 104.655 -83.346 92.881 89.368 130.028 -76.508 128.139-132.170 157.746 -56.581 124.476-121.784 120.327 -18.329 90.476 53.781 129.073 -78.314 90.902 51.457 144.476 -58.392 91.078 50.510 143.509 -65.519 90.896 43.571 127.583 -76.353 92.327 47.894 154.447 -2.611 91.857 41.470 133.761 -77.616 91.835 39.857 115.290 -79.008 92.804 46.941 104.434 -31.909 91.315 46.539 125.872 -75.347 92.589 53.931 124.755-142.066 92.663 34.612 151.446-123.639 106.336-104.296 143.221 -98.798 93.834 151.793 0.000 0.000 92.929 83.260 161.980-135.979 93.043 35.423 104.705 -72.677 95.243 52.442 0.000 0.000 92.743 73.631 133.049-101.122 93.356 121.169 136.321 143.317 116.976-110.571 165.586 -53.902 92.356 47.503 130.841 115.710 92.258 41.215 147.312-129.893 93.107 41.918 153.521 -16.706 91.188 44.710 133.537 -80.042 92.335 44.778 141.734 -77.654 91.100 42.180 138.197 84.208 93.304 44.136 108.524 -71.798 92.959 40.036 132.538-106.106 94.045 50.327 127.374-117.595 93.103 64.171 141.922 -74.609 94.673 81.650 124.829-124.874 118.043 0.000 131.742-155.846 # 173 total E -6.49855E+02 rmsd from N 0.000 %NC 0.00 1 126.124-128.175 149.724 -81.965 127.065 -99.549 130.066 -80.381 116.706-170.594 139.092-150.624 128.498-170.844 156.167 -96.123 128.697-154.395 163.591 43.018 120.204 13.648 148.290 -97.669 95.332-177.097 126.654 -84.241 142.738-147.082 134.000 32.649 116.013-116.471 116.375 -51.099 108.148 175.451 108.875 95.193 94.017 60.331 119.069 -95.929 117.515 146.895 166.993 162.109 87.275 -54.202 134.534 -94.814 95.500 -31.692 166.936 174.261 93.717 83.994 147.347 -99.304 130.370 -90.189 141.653 -91.145 124.258-160.298 159.729-142.335 130.731 -89.158 144.944-102.482 130.403 -52.797 0.000 0.000 126.596-161.958 131.393 17.268 127.795-147.935 130.662 -82.672 94.061 13.411 145.179 -81.606 123.071-164.525 176.461 -93.958 126.395-166.487 127.465 -39.879 126.706-168.939 157.440 -89.393 124.091-166.580 153.861 -97.208 92.992 1.916 143.157-149.165 122.400-159.126 138.043 -99.640 128.285-159.798 137.943 -70.808 108.866 -40.047 169.595 -54.811 91.669 -79.889 129.273 -75.975 91.580 73.021 147.126 -38.955 93.221 50.997 129.366 25.580 113.159-179.976 160.898 -82.418 118.275-158.962 147.806-139.343 111.644 9.395 116.794 114.926 92.329-176.719 117.596-143.949 125.685-172.373 133.583 -53.603 131.765-166.400 157.506 -90.780 123.346-160.315 147.090 -71.412 129.506 168.466 173.014-174.630 109.261 110.816 164.434 164.936 95.156 106.856 0.000 0.000 119.737-121.672 165.975-132.320 122.522 -71.285 163.747-165.792 132.676 -34.697 141.102 -25.486 93.166 49.934 111.945 -89.430 93.105 36.246 123.882 84.871 93.979 44.037 163.144 -20.512 92.678 39.489 137.453 81.311 92.706 40.404 137.915-142.515 92.252 43.771 143.164 -27.223 90.984 44.506 129.702 -78.331 92.418 44.468 169.985 -73.931 91.055 42.837 135.704 -61.557 93.038 44.568 113.698 -82.621 92.862 38.185 126.505-100.017 94.446 51.187 132.304-116.996 93.135 62.583 142.829 -77.420 94.713 81.964 124.974-127.093 118.040 0.000 131.743-155.829 # 174 total E -6.80121E+02 rmsd from N 0.000 %NC 0.00 1 91.567 47.684 118.081 -71.477 127.905 -66.860 123.868 -72.027 115.753-137.493 142.987-157.221 90.868 67.721 131.343 -76.999 91.879 48.713 119.080 -81.515 93.879 38.350 117.349 -57.173 93.404 46.384 142.284-132.211 92.697 46.313 120.133 98.457 91.918 54.327 128.649 62.685 91.962 37.808 133.808-120.625 112.060-145.556 168.854 16.685 124.526-148.955 159.277-122.710 107.261 148.557 171.850 -19.428 135.617 17.849 166.936 174.261 135.461 -98.463 176.431-111.285 128.163-161.352 137.887 -85.766 110.277 -55.704 134.873-114.456 92.478 -27.248 102.980-117.003 95.035 89.762 0.000 0.000 126.385-114.850 139.714 13.141 126.435-131.488 110.411 -66.824 121.673-138.796 147.381-112.401 131.502-155.926 158.469 140.715 126.768-163.010 160.879 21.452 126.196-161.629 164.673 -82.161 117.317 97.895 120.219-121.461 93.142 -14.264 147.113 -12.558 92.427 -74.535 129.638 -76.271 118.132-176.528 149.824 55.393 130.136-158.928 128.213 -24.782 121.463-163.344 142.824 -83.067 127.874-156.587 142.024-125.008 93.585 -23.685 176.432-126.185 113.700 -97.030 135.524 -98.506 92.229 58.491 159.108-140.987 91.407 58.483 132.740-139.193 91.179 69.280 130.902-116.336 91.887 98.059 121.461 -73.125 90.918 54.485 129.054 -76.176 93.798 83.143 130.912-156.694 91.934 -65.698 145.325-105.042 93.811 -58.782 143.152-104.521 94.395 172.204 102.580 -55.005 92.695 49.993 164.360-124.471 93.784 31.802 95.657 -75.990 97.676 35.849 0.000 0.000 96.541 34.310 118.283 -81.341 96.039 31.965 165.667-114.025 97.877 31.154 128.706-125.750 96.992 34.715 120.055 112.846 95.444 35.123 151.744-142.405 94.404 39.917 155.644 -24.800 91.610 43.057 130.050 -77.830 92.944 44.230 140.425 -75.233 91.511 40.280 138.763 85.616 93.707 43.141 126.740 -72.559 92.946 41.019 134.495-105.901 93.832 48.025 130.982-114.269 92.929 62.010 141.572 -74.748 94.723 81.099 127.691-122.865 118.053 0.000 131.677-156.887 # 175 total E -6.78559E+02 rmsd from N 0.000 %NC 0.00 1 91.567 59.804 134.536 -77.228 126.073 -96.398 131.202 -89.082 91.876 57.373 106.670 -90.347 90.949 46.325 129.901 -76.811 92.338 45.730 157.005 145.974 92.336 41.354 167.121 -78.543 92.044 44.298 102.475 -55.833 92.696 42.578 130.965-109.853 92.380 39.148 125.173 50.294 92.767 42.099 143.856-122.624 91.772 54.092 121.725 -81.079 91.913 45.211 132.314-105.809 94.116 38.334 112.713 -85.831 95.598 60.699 145.570 51.587 110.422 -91.748 144.161 -88.337 93.962 112.151 142.431 -76.150 92.136 77.882 138.003-154.235 93.559 29.592 105.469 120.206 119.260 -17.816 118.346 62.818 108.894 -93.222 131.795 -16.931 122.064-174.249 176.463 -61.027 93.785 75.746 143.188 -74.586 93.753 75.876 103.556 -78.108 92.380 66.100 167.298-144.228 91.725 65.759 130.847 -76.819 105.289 -92.606 86.958 -86.422 93.034 -35.596 136.808-142.647 115.941-158.321 145.688 -82.622 130.288 -88.965 133.573 -40.264 92.479 57.893 139.050 -69.799 90.666 52.767 129.318 -78.862 91.024 43.828 152.053 100.509 91.241 45.677 140.547-134.527 90.879 46.867 126.085 -72.667 92.262 40.729 132.284-120.907 92.223 43.691 146.369-139.703 91.701 42.580 122.754 -89.317 92.965 41.801 120.758 -88.110 91.184 46.575 128.475 -76.234 92.004 43.744 125.826-145.676 92.110 46.333 152.623-140.047 93.507 35.341 120.219 -87.092 94.681 44.660 0.000 0.000 92.751 42.037 135.628-108.481 93.583 35.529 139.115 -22.708 96.293 37.815 0.000 0.000 94.653 39.048 121.897 -80.091 94.031 36.686 145.480-114.500 95.306 37.032 165.434-112.715 94.558 38.990 126.807 111.120 93.479 39.629 144.521-125.733 92.840 43.053 148.674 -26.271 91.209 44.202 131.401 -78.578 92.635 43.595 127.136-100.952 91.550 41.482 141.361 82.593 93.786 42.805 141.566 -75.919 92.894 41.272 133.109-105.414 93.805 50.738 124.493-116.760 92.948 64.076 141.691 -74.988 94.687 81.209 125.297-127.147 118.007 0.000 132.223-155.983 # 176 total E -6.58156E+02 rmsd from N 0.000 %NC 0.00 1 91.549 36.648 121.484-105.358 95.311 176.732 102.416 -83.338 93.561 58.366 133.838-156.352 92.182 34.916 130.308 -76.765 113.697 -99.601 171.751 -83.163 119.917-119.885 155.518 39.344 130.516-168.208 105.593-101.985 129.492-142.152 145.539 -41.043 123.159-162.804 74.125 -87.209 91.012 -2.848 141.806 125.046 114.354-161.169 164.028 -57.381 119.297-172.886 167.660-140.148 116.513 -90.308 160.400-144.706 96.016 10.160 139.049-111.457 94.756 66.807 123.270 78.750 139.681-153.719 145.263 -98.261 117.094-153.715 160.827-133.961 94.497 -7.833 104.733 121.354 119.302-145.536 0.000 0.000 117.787-167.580 130.365 23.699 128.875-118.818 166.351-144.591 121.631-159.784 161.883 -57.297 128.440 -67.727 139.928-131.417 127.242 -56.519 107.369 60.561 131.035-158.563 136.020 -87.733 125.942-171.717 129.096 -98.579 92.398 59.314 137.184-136.948 117.378 -94.815 129.274 -76.322 122.068-133.326 136.887 43.794 130.056-171.239 152.856 -8.571 128.642-150.737 160.099 -84.198 122.809-167.224 165.794-175.185 105.823 -27.897 156.460 -53.593 91.578 -86.459 129.769 -77.771 92.634 63.321 79.583 -91.082 93.181 62.018 159.953-126.645 104.673-176.537 124.223-145.871 121.479-161.656 141.184 164.000 126.868-153.885 150.184 -58.989 115.524-153.600 147.011 158.035 118.634-177.481 156.589 17.495 105.860 -59.041 172.434 -20.256 103.438 -23.647 0.000 0.000 93.921 90.125 125.887 -95.621 118.466-140.333 151.704-160.658 130.052-166.289 0.000 0.000 127.517-124.754 137.457-109.012 119.405-157.156 127.634 61.336 94.526 92.064 144.131 -74.316 93.208 40.809 129.831 117.956 94.493 32.909 148.798-129.884 93.451 49.747 148.051-113.008 90.870 47.549 130.449 -79.739 91.834 40.373 123.223-104.396 91.773 40.074 141.656 78.514 93.665 44.398 114.190 -70.613 92.872 41.822 137.041-111.258 93.597 45.774 124.125-116.438 93.251 64.826 142.448 -75.486 94.939 82.997 128.502-117.077 117.639 0.000 136.615-147.571 # 177 total E -6.89559E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.780 135.510 -74.364 124.905 -82.396 132.429 -84.299 116.939 -99.053 135.044-142.349 91.362 52.081 131.413 -77.057 92.401 44.146 120.295 -79.311 92.963 42.480 168.616 -69.025 92.510 41.747 100.039 -56.354 93.036 43.194 145.091 -90.762 92.273 40.251 113.339 35.485 92.594 41.383 144.688-106.117 92.417 48.825 120.280 -82.011 93.279 42.044 129.334 -98.608 94.393 34.322 128.255 117.426 95.897 42.901 164.396-123.999 92.974 43.970 135.905 -80.348 93.472 58.598 137.598 -72.752 91.673 76.317 139.302 149.608 92.004 11.282 104.859 114.462 111.558 -90.953 151.550 -22.359 123.776 -90.156 131.692 44.853 124.954-154.999 161.055-140.119 95.740 37.547 106.101 -54.439 123.478-179.270 173.582-101.337 120.400-173.840 144.806 -58.410 117.200 179.441 158.798 -74.800 94.054 95.370 128.087-129.691 93.024 -8.503 104.868 -83.414 92.317 -82.098 130.049 -78.115 104.979 176.771 146.598 40.367 126.610-173.890 157.248 2.731 127.964-161.904 154.098 -69.554 126.090-162.061 143.162 163.432 98.023 -25.380 115.215 22.190 91.090 -83.677 129.748 -76.566 92.509 58.721 134.778 -49.682 94.569 68.058 139.461-145.897 92.418-176.003 126.936-144.563 134.563-170.282 158.961 164.375 125.845-171.715 157.383 -76.470 130.562-171.589 140.929-176.333 93.982 142.894 155.472 -9.348 119.609 -62.972 133.832-133.765 119.134 -6.549 0.000 0.000 122.939-111.006 107.393 -75.754 94.388 59.142 99.762 -76.087 123.610 -12.732 0.000 0.000 93.315 50.817 114.154 -85.176 94.908 27.470 153.085 -98.323 96.712 40.654 157.086 42.322 95.080 32.045 112.311 127.589 94.888 40.391 147.763-130.883 92.736 44.315 153.182-150.804 90.739 47.451 134.978 -78.496 91.312 42.300 124.426-111.954 91.202 41.892 140.586 77.493 92.863 46.570 122.702 -71.286 92.405 39.588 134.873 -96.085 93.509 48.567 119.469-121.883 93.100 70.236 142.184 -75.867 94.402 86.021 133.971-125.999 117.560 0.000 136.884-140.538 # 178 total E -6.66556E+02 rmsd from N 0.000 %NC 0.00 1 91.567 56.810 128.208 -69.159 125.603 -87.859 115.752 -87.553 117.379 -92.621 122.895-123.466 91.139 60.535 131.803 -77.694 92.406 46.538 138.280 -73.266 93.238 45.053 175.144 -64.092 92.426 45.902 100.016 -62.902 92.587 54.938 130.804-103.221 90.818 73.048 111.725 46.402 91.320 77.406 121.404 -66.347 118.388-150.733 116.561-102.847 110.582 -56.421 159.358-119.963 92.502 -26.907 138.674-108.071 94.688 95.907 151.724 49.023 123.574-133.589 149.703 -84.761 124.996 -81.883 155.638 36.497 124.978-135.803 150.416 115.342 118.725 -66.220 110.459-111.242 94.628 54.095 158.735 163.941 121.911-164.567 147.772 -38.354 126.848-169.062 167.695 -28.418 122.297-170.080 142.933 -74.125 129.147-155.441 176.457-102.014 118.130 18.778 143.472 -83.987 91.918 107.529 129.942 -76.879 93.786 -19.531 165.617 173.407 93.693 -65.508 144.003 166.899 91.964 5.910 129.932 -74.925 117.905-161.602 136.611 39.445 126.180-163.429 151.021 -27.010 122.228-166.095 152.411 -87.149 124.149-165.493 145.907-170.352 95.024 -32.212 118.506-146.072 92.056 -82.137 128.652 -76.577 92.316 65.710 163.115-134.978 93.468 58.587 129.849-135.460 92.240 175.300 114.831-141.714 125.413-172.600 170.983 144.576 129.067-154.836 164.215 -91.387 120.678-153.890 135.770 166.305 93.014 50.210 154.541-168.848 92.520 38.297 154.010 -39.748 93.936 49.792 164.220-142.818 92.638 41.920 128.243-100.742 93.480 36.486 112.271 -67.495 96.201 37.632 0.000 0.000 94.695 39.257 125.850 -85.230 94.128 36.431 143.816-115.012 95.280 37.061 142.213-121.731 94.586 38.913 126.458 111.000 93.500 39.722 144.661-125.478 92.839 42.950 148.700 -26.038 91.208 44.243 131.449 -78.587 92.630 43.621 126.871-100.718 91.553 41.487 141.436 82.573 93.788 42.748 141.574 -75.932 92.902 41.310 133.233-105.663 93.798 50.760 124.553-116.644 92.947 64.081 141.697 -74.987 94.689 81.199 125.207-127.173 118.006 0.000 132.229-156.000 # 179 total E -6.50122E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.624 136.380 -77.955 125.517 -84.340 114.154 -97.589 114.050-166.217 102.174 -80.800 129.543-167.502 176.424 -89.066 130.337-171.497 153.661-103.444 97.365 -35.120 149.313 3.956 94.686 -80.988 119.425-125.240 92.267 65.939 169.847 17.844 93.001 56.138 119.034 -52.796 92.404 169.317 175.457-163.634 122.070-158.022 170.757 -69.960 121.925 173.232 173.655-142.552 107.106 -60.957 117.407 -92.812 118.572 -43.106 0.000 0.000 92.432 76.219 137.186 -91.907 94.855 35.996 114.043 -71.343 92.716 71.895 157.676 -18.299 92.482 20.408 148.947-102.553 114.338 -42.811 0.000 0.000 127.519-169.269 142.848 -37.159 122.798 -74.596 169.554 -87.751 94.920 -9.103 118.294 -78.758 95.738 87.119 141.854 -74.684 123.220 176.125 171.482 173.462 122.832 173.569 152.933 -95.427 93.013 56.353 172.535-124.544 92.027 44.182 103.184 -75.064 91.848 41.762 127.944 -76.395 92.680 44.560 157.769 -57.126 94.508 49.195 162.555-121.488 91.798 70.777 128.721 -76.126 125.544 -85.867 146.453 -78.875 91.828 77.498 138.208 -75.294 91.095 45.106 131.258 -78.357 92.595 47.223 138.953 43.770 91.820 41.121 137.952 150.851 91.373 45.200 117.883 49.724 91.422 49.204 126.961-111.614 90.900 50.470 120.999 -70.311 92.323 41.755 151.044 -39.814 93.011 60.172 157.834 -20.906 106.509 -74.564 132.432-103.535 123.307 -22.115 0.000 0.000 124.902 -97.399 164.496 162.690 94.153 23.987 95.126 -83.260 96.570 64.780 141.225-101.327 93.951 89.034 141.017 -79.077 138.255 -74.658 105.463 -95.079 94.301 49.661 118.713-118.775 92.700 40.047 120.114 158.669 92.590 43.844 145.798 -14.195 91.618 44.332 148.163 -28.710 91.001 43.241 126.649 -74.327 92.880 42.647 111.753-103.808 91.991 40.238 145.621 84.874 94.009 41.650 139.932 -72.535 93.268 40.689 151.593-116.124 94.132 47.777 126.062-108.076 93.131 62.078 141.792 -74.210 94.819 78.198 124.107-116.562 118.057 0.000 131.582-160.023 # 180 total E -6.51360E+02 rmsd from N 0.000 %NC 0.00 1 91.568 55.950 134.186 -84.237 122.843-170.016 131.503 -82.840 94.705 54.103 136.425-157.967 92.718 166.571 171.172 -81.826 93.518 40.849 140.682 -76.532 96.417 166.155 128.406-100.715 138.141 -61.334 113.217 -77.332 128.294-159.793 123.515 -43.429 116.537 177.296 127.460 62.788 92.728 45.502 124.384 -73.671 108.817 143.937 125.501 -97.643 97.936 -36.687 148.923 144.588 92.488 -50.833 134.378-110.209 93.919 87.555 0.000 0.000 127.960 -96.436 107.374 -89.879 124.572-161.943 174.700 -41.656 130.856-173.838 144.105 115.290 94.082 69.080 107.854-126.655 96.490 119.561 150.759 -29.240 137.249 -62.372 117.609 -56.254 135.021 -23.802 134.204 -79.618 130.100-164.481 125.785 -81.204 128.333-133.456 165.579 37.228 104.933 -33.947 94.241 26.913 91.198 -80.075 129.588 -76.954 91.903 71.427 134.535 -95.610 94.286 58.181 154.739 173.276 114.223-178.793 128.956 -86.857 134.043-167.831 138.108 -14.736 122.486-172.538 112.502 -49.365 129.721-178.648 145.781-101.190 119.163-167.589 162.174-153.682 95.852 -28.995 150.338 -63.538 92.343 -84.287 128.457 -76.394 92.313 63.738 111.455 -83.623 93.327 61.097 133.807-140.393 92.044 174.331 113.573-151.857 128.687-177.347 162.395 162.743 129.941-168.339 175.407 -86.219 118.547-163.030 131.633 149.338 128.295-174.347 163.143 145.664 124.705 -82.054 138.368 118.442 96.965 38.310 146.548-108.735 95.332 44.230 139.205-106.160 94.337 32.447 165.198 -4.661 96.769 40.717 0.000 0.000 94.236 39.586 130.806 -87.715 94.110 34.726 146.818-110.232 94.659 41.092 119.731 -16.799 93.585 41.341 142.036 107.698 93.050 37.726 143.734-134.446 93.213 41.026 149.611-113.855 91.390 44.979 128.398 -75.930 92.684 42.594 143.234 -81.701 91.454 40.966 137.271 85.188 93.801 43.995 118.114 -93.162 92.922 39.750 127.847 -81.111 94.158 51.341 127.739-117.650 93.193 61.764 141.023 -74.008 94.761 81.488 126.108-135.164 117.934 0.000 133.173-154.920 # 181 total E -6.68372E+02 rmsd from N 0.000 %NC 0.00 1 125.787-123.986 161.027-107.086 126.984-102.198 134.735 -82.899 92.302 53.223 136.743-159.273 91.171 47.758 129.708 -76.070 92.829 43.738 127.567-119.660 93.314 41.404 144.920 -70.702 92.569 49.094 142.249 -74.839 92.638 52.395 129.332 -92.809 91.856 126.333 97.575 122.508 92.116 -22.603 144.728-105.620 116.207-149.879 168.772 4.527 122.166-165.008 141.635-118.675 106.358 -62.827 131.823-117.609 97.438 -19.070 151.724 49.023 93.560 85.521 141.106 -91.776 129.244-122.782 151.130-107.294 128.532-152.382 151.323 -10.277 124.759 -67.918 158.245-132.213 137.284 -36.671 118.346 62.818 123.867 156.581 152.560 3.400 94.230 92.975 140.093 -75.693 93.167 90.863 130.945-108.795 93.665 66.238 110.199-117.649 92.168 143.833 130.909 82.760 91.340 100.404 131.721 -78.588 92.877 -8.774 140.870 -78.243 93.246 -82.471 137.276-138.468 114.693-171.666 152.962 -83.463 91.834 50.287 106.598 -55.348 93.351 50.190 143.227 -66.776 91.801 40.876 129.689 -75.937 94.093 35.522 147.927-109.651 93.978 42.086 143.466-139.103 91.930 43.922 128.926 -77.585 93.634 37.672 114.555 -77.706 93.787 39.627 138.891-138.518 92.424 41.640 103.679 -49.836 93.213 48.082 134.501-102.714 91.288 53.459 129.106 -76.211 93.900 76.923 129.988-153.196 92.735 -73.287 150.295 169.923 94.400 -50.035 142.855-102.664 94.132 163.135 0.000 0.000 91.868 65.300 120.813 -83.773 93.624 35.840 84.424 -87.682 98.546 28.892 0.000 0.000 98.406 31.974 124.124 -89.246 96.295 32.465 101.478 -43.120 96.926 35.707 162.242-136.739 96.216 32.348 112.967 113.097 96.293 32.548 146.246-139.059 94.782 41.693 150.945 -21.751 91.341 46.359 132.183 -80.179 92.199 43.171 139.222 -72.319 91.512 39.998 139.179 86.746 94.057 42.195 110.947 -72.410 93.169 41.096 136.470-118.696 93.964 49.648 132.319-112.797 93.004 63.978 141.941 -74.303 94.691 81.524 123.166-123.045 118.056 0.000 131.595-156.213 # 182 total E -6.72423E+02 rmsd from N 0.000 %NC 0.00 1 91.567 55.942 131.043 -76.276 129.042-165.969 172.113 -20.955 93.181 27.285 141.607-167.070 101.233-155.799 131.968 -79.021 129.626-168.827 172.924 -34.822 93.962 33.234 108.504-112.979 110.704-171.534 135.306-101.922 140.473-132.186 146.570 14.713 126.466-128.011 114.643 -62.661 128.471-170.851 176.503 -5.323 95.859 83.167 142.397 -76.225 117.299 127.598 128.869 -88.420 84.539 -56.235 133.665 -96.231 94.589 -33.866 171.212 -76.272 93.659 89.338 127.249 82.497 125.608 -83.385 144.101 -99.543 121.635-162.173 159.481 -4.356 129.019 -85.359 158.917 -93.963 130.305 -43.784 0.000 0.000 133.050-155.722 145.557 -1.993 125.836-134.821 128.126 -54.631 96.603 42.305 124.124-108.775 129.275-176.579 116.507 -62.602 139.021-178.522 52.106 -47.664 91.406 15.329 132.336 -79.818 117.840-106.236 128.303-118.959 93.637 53.062 95.075 -87.121 119.587-139.152 127.830 -30.646 109.045-157.397 171.336 -72.438 125.933 -69.132 102.039-142.845 126.504 -77.269 141.737 -88.522 92.087 51.771 136.305-166.003 92.023 40.384 141.712 -76.556 91.177 47.532 128.116 -75.728 92.314 43.942 135.215-125.681 92.727 42.105 137.642-146.628 92.687 35.017 118.628 -86.001 93.966 49.063 107.820 -58.815 91.270 65.775 127.673 -75.893 91.401 42.986 128.610-158.402 92.837 70.895 151.312-117.442 111.035 -34.767 139.729 -99.673 128.351-134.181 153.032-115.937 123.655 111.405 168.920 -84.246 90.749 -36.002 139.314-142.328 92.343 -42.983 0.000 0.000 114.917-137.098 137.192 -94.501 92.489 42.731 169.430-146.736 93.113 46.887 161.855 -55.029 93.309 40.535 131.389 111.309 93.538 35.261 136.976-134.580 93.440 44.079 148.885-109.789 91.317 44.485 130.798 -77.744 92.908 41.451 134.944 -91.527 91.675 40.103 140.670 -96.373 93.131 48.020 106.709 -62.948 92.132 40.943 141.130 -96.886 93.377 44.598 119.935-117.064 93.112 65.939 142.862 -74.957 94.538 81.171 133.078-107.267 118.073 0.000 131.335-156.683 # 183 total E -6.90694E+02 rmsd from N 0.000 %NC 0.00 1 91.565 38.963 113.113 -77.786 129.001-107.253 118.476 -93.584 92.590 69.901 99.759 -82.584 91.522 103.187 124.188 -74.314 93.254 92.256 166.162-111.045 94.331 -8.198 141.729 -73.855 98.014 -85.405 138.478-105.314 113.603 170.361 123.726 46.584 92.149 26.440 121.535 -51.048 114.587-135.540 161.367-132.920 122.485-123.474 170.260 -45.936 123.529-170.024 163.494-169.921 102.535 -60.494 157.471 -57.735 97.102 -22.428 151.724 49.023 93.527 88.053 119.648 101.104 125.655-118.626 141.495 -83.515 124.888-174.918 160.726 129.182 128.280 -74.948 138.112 -86.220 128.384 -27.129 118.346 62.818 125.295-168.895 142.365 39.859 93.524 50.927 145.072 -74.243 92.596 43.948 118.819-125.454 93.636 41.555 118.509 -92.552 92.323 43.220 155.124 131.540 91.348 44.022 130.157 -77.235 92.424 41.898 143.971 -78.244 91.818 43.979 140.793-154.634 91.306 43.440 127.102 -75.486 91.885 41.544 111.454 -49.029 92.992 43.893 144.262 -74.691 91.134 44.302 127.611 -76.107 91.846 42.350 120.531 -66.945 91.768 44.661 144.880 -60.098 91.162 43.773 127.736 -75.765 92.743 40.962 136.407-122.467 92.281 44.285 137.337-144.330 91.673 42.076 119.389 -73.462 92.939 42.421 118.043 -74.277 91.115 46.578 128.407 -76.202 91.922 44.362 125.853-145.471 92.019 46.382 160.203 -19.799 93.299 36.416 119.847 -86.326 94.422 45.426 0.000 0.000 92.632 42.146 136.544-109.337 93.535 35.617 137.943 -17.372 96.238 38.033 0.000 0.000 94.606 39.183 121.695 -80.250 94.022 36.645 145.387-115.119 95.309 37.069 165.834-112.640 94.550 39.015 126.803 111.207 93.474 39.625 144.543-125.720 92.846 43.014 148.676 -26.251 91.211 44.200 131.403 -78.581 92.634 43.602 127.147-100.933 91.549 41.472 141.360 82.622 93.790 42.787 141.565 -75.921 92.896 41.284 133.105-105.397 93.803 50.728 124.534-116.740 92.950 64.043 141.690 -74.984 94.697 81.205 125.290-127.120 118.007 0.000 132.220-155.998 # 184 total E -6.70127E+02 rmsd from N 0.000 %NC 0.00 1 126.138-130.755 147.127 -80.394 125.789 -90.525 119.471 -89.893 115.111 -93.002 134.782-142.187 91.429 66.570 130.367 -77.245 93.841 42.118 140.505 -75.409 96.536 168.739 131.676-110.734 97.412 46.955 87.539 -70.904 123.453-155.370 157.810 -75.486 92.888 33.622 121.842 47.216 117.256-161.741 156.978 138.121 132.210-101.292 136.743 -96.355 129.856-174.770 136.442 -90.849 103.282 -62.475 132.785-113.587 98.039 -21.732 153.357-137.902 93.594 85.450 141.827 -93.208 127.623-111.591 147.974-102.543 123.662-176.618 176.450 -2.039 133.654 -78.117 137.338 -88.451 127.220 -5.996 156.391-120.170 120.283-132.853 154.339 -78.065 134.719 -96.576 67.957-115.910 138.334 -33.239 145.429 -85.071 139.185-141.242 130.241 -77.626 92.462 59.329 141.099 -91.149 111.936 144.352 152.645-102.150 94.615 -32.438 167.689 -72.592 93.039 -52.767 137.680-137.916 91.516 86.541 129.339 -76.071 124.202 -87.389 149.903 -9.926 127.089-133.053 151.913 4.189 90.486 58.300 129.071 -76.615 91.056 42.002 112.981 -73.754 91.116 47.107 145.570-138.205 90.714 49.415 129.225 -79.334 91.964 39.780 114.620 -93.410 92.104 44.414 145.315-137.106 91.659 46.277 122.133 -77.055 92.562 41.184 128.879-112.411 91.195 46.995 129.740 -75.095 91.963 43.594 127.204-148.359 92.198 46.135 150.419-132.729 93.597 35.155 120.301 -86.861 94.754 44.552 0.000 0.000 92.799 41.971 136.006-109.420 93.579 35.599 139.252 -22.468 96.206 38.177 168.407-131.814 94.538 39.327 121.923 -80.175 93.943 36.921 145.200-115.134 95.108 37.625 165.625-112.788 94.308 39.788 127.098 109.994 93.398 39.305 144.097-131.259 92.811 43.364 150.877-112.200 91.206 43.898 131.911 -79.045 92.614 43.901 128.093-100.807 91.443 41.833 140.772 81.145 93.668 43.060 117.365 -92.513 92.912 41.167 132.957-107.756 93.894 50.765 124.193-118.175 93.023 63.989 141.574 -74.416 94.693 81.530 123.076-129.590 118.010 0.000 132.214-155.663 # 185 total E -6.50404E+02 rmsd from N 0.000 %NC 0.00 1 91.570 57.767 136.888 -82.429 118.608 176.391 132.745-101.357 94.226 79.830 143.842-171.543 91.929 -61.962 129.879 -76.348 122.879 -86.258 147.616 -90.665 134.375 -22.358 136.195 -82.755 122.591-156.134 123.838 -98.773 126.790-172.461 153.466 26.496 92.702 38.400 142.440 -77.507 110.935-159.614 136.981 -79.536 118.102-153.530 151.403 -81.875 126.834-166.105 165.294-160.266 107.481 -69.326 158.032 -30.512 98.239 -11.213 139.049-111.457 93.883 87.325 139.709 -90.544 126.406-143.371 145.969 -99.293 123.552-176.481 157.622 -24.360 133.308 -95.823 141.811-122.335 125.257 -9.418 124.355 -63.640 122.300-162.868 125.945 27.619 130.753-162.418 145.520 -63.330 94.428 42.876 113.235 -45.243 117.734-174.278 162.183 -91.930 128.967-174.170 142.706 -55.316 117.414 177.506 173.685 -85.965 94.119 97.649 135.595-121.891 93.078 -11.749 105.661 -83.661 92.534 -77.721 129.575 -76.288 108.508 178.764 146.777 56.351 128.582-170.056 156.758 -15.222 133.048-167.499 128.043-101.139 128.484-151.338 134.370 163.234 107.055 -28.605 170.896-120.367 91.356 -82.552 128.985 -76.149 92.833 57.361 127.821 -91.126 93.991 70.867 164.499-153.037 92.108 169.586 128.078-148.514 118.715 179.376 150.884 165.157 91.774 47.113 130.181 -78.154 95.491 82.651 124.265-177.401 92.061 -64.885 156.469-172.887 93.357 -54.008 143.539-104.250 94.442 177.331 0.000 0.000 91.539 58.645 142.618-100.103 92.717 33.159 89.655 -83.767 96.331 42.975 0.000 0.000 93.857 39.375 123.069 -95.851 93.392 40.618 146.445-103.389 94.578 37.205 164.487-110.088 94.334 40.353 125.504 100.933 93.739 37.139 141.823-134.119 93.532 42.282 151.020-112.874 91.442 42.957 131.620 -79.017 92.932 43.953 141.038 -76.609 91.407 41.778 138.224 83.770 93.607 43.164 114.982 -89.852 92.978 40.936 133.747-109.823 93.935 50.978 129.282-116.304 92.995 64.060 141.480 -74.293 94.689 81.753 122.612-128.886 118.025 0.000 131.993-155.613 # 186 total E -6.59068E+02 rmsd from N 0.000 %NC 0.00 1 91.565 61.039 132.408 -66.971 126.784 -99.521 169.251 -69.496 92.151 56.127 137.049-160.388 91.084 46.829 130.657 -76.554 92.530 42.631 125.096-110.763 93.499 38.353 144.638 -75.216 93.112 42.940 141.002 -75.420 92.739 44.919 156.618 -90.100 90.991 43.633 120.509 -40.193 92.221 39.993 134.045-107.163 92.218 55.444 115.541 -79.865 92.980 41.345 151.273-159.370 94.400 141.873 109.606 -99.374 134.498 28.595 0.000 0.000 122.599-158.759 153.118 111.231 126.895-157.023 128.520 -94.186 111.116 -57.096 144.085-116.711 92.271 -25.633 106.638 121.059 95.206 90.775 0.000 0.000 125.964-118.781 155.966 -23.566 128.590-159.351 148.350 -5.897 93.894 36.290 124.993-116.031 115.853-154.582 176.489 -68.071 134.988-103.000 108.324 51.938 127.946 -80.568 150.297 -93.447 95.488 18.678 146.098 -79.375 95.252 77.020 138.624-139.882 91.622 148.625 128.299 -75.265 92.549 68.518 108.773 -53.005 94.652 95.920 135.631-105.893 91.232 -74.502 128.673 -75.243 101.768 -6.694 157.049 -86.013 127.257-101.369 134.267 -12.524 130.847-145.523 142.679 -75.723 91.975 54.096 127.922-134.811 91.229 42.108 123.537 138.728 91.485 43.402 133.927 82.300 92.558 43.353 106.826 -46.472 91.237 46.861 123.018 -74.703 92.427 50.039 123.468-133.080 92.438 43.028 155.173-126.867 100.858-113.937 117.305 -89.556 94.218 150.434 155.041-136.808 93.367 45.636 149.529-103.863 92.689 36.733 92.968 -78.919 112.778 13.011 172.439 -21.201 95.524 42.326 105.814 -83.605 95.939 26.924 161.144 -82.754 98.187 35.320 168.961 -71.284 96.933 30.774 113.108 121.111 96.300 35.313 154.309-140.808 94.326 41.396 153.296 -25.939 91.657 42.379 131.826 -79.291 93.359 42.508 132.392 -89.192 91.865 40.242 140.109 82.697 93.970 44.029 112.744 -77.935 92.900 40.333 135.950-107.077 94.013 49.748 125.245-116.251 92.998 64.679 141.906 -74.452 94.650 81.268 125.185-125.690 118.030 0.000 131.927-156.148 # 187 total E -6.99184E+02 rmsd from N 0.000 %NC 0.00 0 91.570 46.629 115.903 -69.992 134.111 -81.495 148.078 -90.443 116.171 -97.463 136.644-146.611 91.899 44.777 131.712 -77.585 92.970 44.724 140.019 -71.090 92.392 46.778 170.105 -46.256 91.983 43.735 105.811 -64.087 92.418 39.843 128.618-115.845 92.197 41.290 124.659 47.721 92.331 47.849 147.591-162.135 91.158 50.112 123.741 -88.142 92.231 62.880 123.741-114.520 91.373 -80.027 137.497 -98.646 114.058 -47.183 140.415 -67.435 93.141 147.984 134.085 83.686 94.735 82.078 139.171 -74.219 92.321 135.268 130.796-104.873 103.916 -60.620 104.889 109.734 92.930 51.727 130.333 45.806 114.743-132.450 135.624 -46.013 125.714-164.636 171.203 -44.153 123.200-173.011 176.428 -64.611 125.807 -73.222 170.988 -32.108 94.582 -9.855 146.053 -94.977 92.932 92.729 129.676 -76.697 128.551-161.147 172.320 -94.447 118.756-166.169 103.686 -85.092 138.630-148.055 134.026-124.628 109.385 -18.259 134.401 -20.565 124.912 -91.352 131.589 -82.123 91.018 54.029 129.288 -75.416 91.466 38.768 114.728 -89.679 91.405 50.409 160.729-150.381 90.954 44.834 125.152 -74.034 92.599 41.093 108.019 -79.488 92.420 40.607 123.357 130.329 91.611 45.606 119.004 -73.736 92.223 48.610 136.340-133.236 90.936 49.739 129.273 -76.379 93.681 77.392 129.085-152.506 92.215 -70.944 148.672-138.542 94.121 -56.574 141.109-100.128 93.992 162.370 0.000 0.000 92.567 50.941 145.133-112.260 93.336 34.699 90.232 -79.287 97.277 34.737 0.000 0.000 97.397 31.727 116.438 -84.881 96.520 31.448 134.505 -70.111 97.364 35.778 140.008-126.246 95.345 39.031 120.556 113.532 93.899 38.082 154.237-141.283 93.771 40.568 147.092 -5.486 91.489 45.336 135.219 -80.032 92.621 44.023 126.883 -92.435 91.651 39.889 141.183 83.637 94.047 42.314 142.833 -76.277 92.984 41.415 139.115-108.400 93.759 51.160 127.064-113.734 92.867 64.362 141.630 -74.785 94.701 80.987 123.860-126.882 118.004 0.000 132.239-156.186 # 188 total E -7.05995E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.747 135.919 -74.580 124.754 -77.873 130.277 -84.292 116.651-173.078 131.388-137.504 130.948-169.350 147.850 -81.944 130.911-128.567 145.740-135.337 127.291-155.382 110.624 -64.630 125.211-143.594 137.278-122.868 125.427 -21.348 154.899 150.046 110.702-166.423 113.805 -47.242 122.638-158.777 150.705 158.117 128.783-169.916 146.453 -86.656 120.047 -65.462 169.231-138.898 92.710 -19.903 138.333-106.976 95.196 95.294 137.795 -85.601 120.649-150.904 153.746 -68.241 127.832-159.742 168.949 -57.493 119.064-166.108 155.272-158.954 131.668 -3.181 138.475-120.813 95.398-179.063 124.355 -63.640 126.687-126.377 168.035 -87.953 128.887-163.933 129.432-104.845 124.641-148.071 141.931-117.741 122.389-155.554 164.444 43.490 114.872 21.362 146.156 -82.534 92.035 107.483 130.704 -77.622 93.411 -21.903 170.708-121.692 93.127 -65.511 139.623-137.490 91.513 8.592 128.972 -75.893 117.907-168.752 131.682 35.219 130.706-147.752 130.712 -41.263 124.590-164.321 137.979 -78.690 93.178 68.279 130.038-157.068 129.443-117.029 107.596 42.799 91.259 112.251 129.571 -77.442 93.769 94.504 87.897 -79.843 92.017 73.195 150.364-131.540 91.710 85.651 112.857-126.929 93.145 110.879 130.569-137.796 91.178 46.249 128.724 -75.357 94.614 83.895 136.065-162.299 92.111 -64.959 156.710 -18.864 93.591 -57.526 157.894 -45.226 94.240 169.893 153.032-115.937 92.243 50.251 145.257 -82.693 94.107 32.194 86.609 -84.533 98.913 30.737 0.000 0.000 97.798 31.811 115.222 -80.787 96.249 31.925 159.344 -88.317 97.557 32.533 160.653 3.928 97.020 32.772 114.672 135.997 95.709 34.434 154.101-127.612 93.302 46.616 151.754 -18.581 91.148 44.283 133.534 -79.682 92.389 43.050 125.080-107.634 91.626 42.184 141.989 80.802 93.736 44.093 104.869 -70.386 92.746 40.711 130.636-110.128 93.875 45.843 122.070-119.105 93.319 63.901 142.087 -74.637 94.646 81.730 128.906-118.761 118.074 0.000 131.394-156.283 # 189 total E -7.03890E+02 rmsd from N 0.000 %NC 0.00 1 91.566 58.778 124.188 -50.890 128.747 -84.579 134.981 -89.301 116.832 -96.615 135.031-142.253 91.389 49.759 131.630 -77.927 92.483 44.872 138.351 -74.365 92.967 43.935 169.028 -79.564 92.470 42.315 103.636 -66.798 93.315 39.015 129.539-116.408 92.282 42.132 121.337 49.389 91.973 47.706 153.869-128.063 91.046 51.682 123.693 -89.286 92.125 61.583 127.771-124.712 93.608 -77.711 128.856 -95.169 115.384 -21.684 0.000 0.000 133.583-127.530 149.551 75.619 125.334-158.294 165.110 -90.727 116.068 -60.505 149.462-123.968 92.534 -22.584 103.297 115.511 95.434 88.175 150.759 -29.240 128.418-123.553 141.607 -10.442 123.044-136.224 140.312 -79.648 92.819 59.444 145.021-115.280 92.072 42.966 106.208 -62.044 91.875 46.319 166.968-173.968 91.226 43.150 128.269 -76.001 92.330 43.074 143.881 -97.851 91.734 43.634 140.499-147.768 91.317 43.776 127.505 -75.572 91.930 41.073 111.191 -49.596 93.141 43.461 143.729 -74.711 91.253 43.858 127.977 -76.366 91.840 42.491 146.203 145.026 91.657 44.792 148.909-139.189 91.056 44.495 127.717 -75.699 92.590 40.923 136.307-118.662 92.238 44.504 139.958-143.053 91.671 42.063 122.050 -83.235 92.935 42.444 117.507 -73.538 91.114 46.610 128.431 -76.208 91.915 44.396 125.911-145.637 92.010 46.433 160.278 -19.321 93.285 36.435 119.860 -86.292 94.407 45.503 0.000 0.000 92.599 42.283 136.128-108.730 93.474 35.736 138.051 -17.065 96.119 38.457 0.000 0.000 94.455 39.480 122.979 -81.805 93.874 37.215 144.893-115.330 95.108 37.434 166.461-111.923 94.374 39.510 123.278 111.070 93.309 39.454 143.864-125.496 92.805 43.329 151.146 -30.244 91.185 43.916 138.520-102.826 92.588 44.524 126.480-100.552 91.450 41.676 141.556 82.178 93.748 42.556 114.960 -82.805 93.023 41.255 132.934-113.360 93.935 50.266 124.836-117.112 93.022 64.315 141.850 -74.427 94.682 81.468 123.069-127.446 118.023 0.000 132.017-155.882 # 190 total E -6.64979E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.305 134.955 -76.622 123.028-107.641 129.215 -88.209 92.695 56.831 105.333 -88.733 91.616 61.217 131.652 -77.506 93.938 86.012 146.436 -78.455 95.064 -52.144 138.287 -73.105 116.643-150.457 110.942-113.619 124.623-132.824 110.231 132.233 114.240 173.988 124.562 54.047 92.955 45.808 123.742-138.859 95.187 111.107 141.192 -74.068 96.545 42.710 153.369 145.781 102.211 -74.587 127.262-129.344 94.215 -19.140 151.724 49.023 93.450 97.550 140.629 -93.732 128.981 -76.215 176.484 -60.478 135.446-167.489 157.761-163.450 120.374-150.638 138.063 115.734 96.640 47.186 112.685 -60.578 129.448 167.063 140.957 50.691 95.520 80.928 148.259 -78.611 93.755 105.604 141.284 -72.105 95.303 0.032 119.426-131.131 125.128-123.074 134.520 55.200 91.075 52.437 130.683 -77.380 91.464 50.035 143.400 -78.704 90.335 48.922 136.073-146.871 90.995 47.231 128.327 -76.520 91.606 37.897 109.722 -51.555 93.287 44.887 143.954 -74.997 91.033 47.870 131.433 -80.156 90.952 44.291 164.426-134.899 91.307 44.418 148.313-138.718 90.988 46.645 129.425 -74.206 92.179 42.443 127.731 -78.865 91.724 43.651 140.302-145.285 91.184 46.281 121.501 -82.200 91.515 55.414 124.128 -60.390 90.907 45.859 128.769 -76.022 93.922 87.555 128.878-149.898 92.787 -61.647 155.777-158.377 94.574 -57.669 142.701 -98.811 94.382 167.066 164.220-142.818 91.666 53.690 132.109 -93.817 93.870 33.060 83.950 -84.030 98.672 31.120 0.000 0.000 97.607 32.215 119.350 -90.766 95.677 34.057 102.775 -43.896 96.714 36.211 164.136-129.880 95.888 33.544 113.427 109.752 96.006 32.609 144.133-146.086 94.616 43.002 154.119-138.537 91.361 45.881 133.549 -80.743 92.574 42.639 141.040 -70.322 91.672 41.439 142.613 -81.044 93.738 42.219 110.943 -79.551 93.094 40.617 135.538-119.695 94.073 48.035 130.167-109.408 93.104 64.438 143.164 -75.664 94.670 80.813 124.297-121.439 118.041 0.000 131.781-156.832 # 191 total E -6.50281E+02 rmsd from N 0.000 %NC 0.00 1 91.566 58.202 132.867 -75.598 123.362 -85.934 135.209 -95.164 116.449 -89.455 124.712-125.991 91.622 63.541 131.946 -77.931 93.289 54.580 141.414 -74.208 115.843-179.462 165.611-142.023 95.898 76.827 140.790 -75.478 133.228 179.289 155.404 16.058 92.983 48.159 114.866 -68.905 122.718-161.490 154.820-124.502 125.466-147.357 166.819 -85.200 122.366-164.573 144.235 -93.831 107.703 -63.230 130.596-118.342 98.100 -17.142 0.000 0.000 93.908 84.002 140.954 -90.250 129.993-126.884 152.298-103.123 124.938-173.533 162.795 -5.709 130.732 -96.954 144.182 -93.807 123.621 -2.004 112.685 -60.578 128.688-104.823 138.310 -20.278 94.517 103.980 135.485 -65.542 92.395 108.800 116.673 -68.584 95.189 35.640 75.577 -93.032 93.514 153.125 123.965 82.878 91.403 97.249 131.918 -78.560 93.254 -12.344 141.301 -79.349 93.845 -77.477 137.609-137.146 120.574-161.551 146.662 -76.256 129.221-160.385 138.653 -33.008 132.038-158.419 143.438 -81.214 90.966 89.537 133.665 -77.029 91.022 65.321 128.601 -92.677 90.511 49.510 157.875-137.080 90.553 54.129 128.756 -76.643 91.680 46.665 136.534 -93.692 91.738 55.015 136.038-141.994 91.710 52.856 127.355 -98.622 111.531 -59.393 120.993 -85.873 121.715-167.467 152.570 -83.518 128.947 175.502 143.292 162.829 111.965-176.941 162.446-159.254 95.975 46.432 144.847-111.525 96.498 104.714 0.000 0.000 93.587 -30.975 157.660 141.741 92.692 -56.356 142.997 -8.614 94.047 14.925 0.000 0.000 119.525-170.779 167.392 -96.142 92.609 46.819 157.273 88.126 94.712 38.662 161.332 -18.165 95.070 38.952 118.493 113.021 95.227 32.266 136.274-134.221 94.866 40.937 150.613 -22.177 91.735 43.734 131.815 -79.370 93.436 42.027 140.374 -75.089 92.113 37.889 136.579 88.436 94.513 41.343 110.404 -74.474 93.376 42.786 138.218-108.764 93.668 48.160 137.092-121.498 93.023 59.755 141.561 -74.677 94.789 81.517 122.391-120.930 118.015 0.000 132.208-156.204 # 192 total E -6.85559E+02 rmsd from N 0.000 %NC 0.00 1 91.590 105.838 131.194 -81.508 134.311 -98.646 148.672 -74.819 117.403-111.347 140.689-152.039 91.552 60.085 127.083 -74.524 93.157 48.594 141.031 -76.049 94.254 68.468 139.482 -74.486 126.385-141.467 167.651-109.592 122.281-155.963 153.846 -15.195 126.260-170.470 116.388-105.473 92.928 3.985 137.848 166.611 133.848-147.778 176.422 -85.792 123.422-166.677 171.674-132.844 107.468 -62.821 152.473-125.505 97.971 -20.626 137.795 -85.601 93.259 90.525 114.753 105.779 121.215-140.390 130.310-111.053 130.109-156.340 176.440 174.462 121.236 8.657 151.720-121.868 94.658-170.928 124.355 -63.640 123.025-156.699 133.083 32.454 122.162-161.872 161.490-136.952 120.603 -71.325 168.739 -49.299 93.965 -11.686 107.614-126.089 94.080 88.302 147.593-124.462 132.514-145.874 143.162 -91.554 126.225-160.862 151.018 -96.745 127.863-153.455 100.699 -58.102 91.766 15.214 125.836 -74.214 127.634-152.272 133.557 65.532 126.635-160.257 151.442 34.120 128.089-156.156 150.842 -64.876 132.945-163.432 137.275-176.070 93.334 -36.211 124.452-141.405 91.717 -80.560 130.977 -77.703 91.566 70.241 173.651 9.028 93.713 53.070 143.621 133.256 92.768 177.446 148.493 174.151 124.302-165.109 161.563 -6.460 131.083-150.238 157.444 -78.477 126.717-150.697 130.645-150.567 130.658-157.952 159.554-170.107 124.151 -44.763 165.324-165.895 133.117 -16.349 153.032-115.937 93.618 56.570 135.050-106.682 93.536 26.820 91.269 -85.487 95.727 55.984 0.000 0.000 90.854 48.291 139.274-108.103 91.158 42.458 138.806-123.037 92.310 41.588 143.335 -73.409 92.488 45.206 176.482 147.140 92.220 38.542 139.335-128.778 92.497 42.434 148.319 -27.021 91.101 46.247 128.504 -76.391 92.950 42.494 136.363-109.251 92.351 37.290 137.118 101.194 95.610 39.479 143.207 -75.958 93.895 39.427 119.271 -76.831 94.508 49.555 133.504-127.318 93.273 60.517 140.692 -73.551 94.786 82.915 131.808-131.400 117.983 0.000 132.564-154.118 # 193 total E -6.59874E+02 rmsd from N 0.000 %NC 0.00 1 91.568 62.636 137.992 -73.831 124.445 -77.349 151.424-108.615 118.072-162.714 125.986-127.701 130.623-165.046 155.538 -70.509 124.384-171.907 163.321-157.915 94.674 93.156 124.994 -98.096 96.151 38.732 143.606 -76.925 105.772 -69.177 106.571 -32.827 90.604 -27.810 112.790 -46.614 114.362-169.526 162.180 3.848 127.216-152.166 170.903 -73.791 121.507-155.216 166.453-172.689 95.719 32.344 111.789-129.310 119.620-174.818 151.724 49.023 126.618-159.577 133.391 63.788 122.131-164.975 134.352-116.583 116.072 -67.660 169.320-147.371 92.628 -17.391 105.061-116.416 95.304 93.073 0.000 0.000 124.238-145.235 135.634 -23.941 127.352-161.669 134.251 -73.669 127.860-149.601 129.674-125.941 95.142 31.820 144.375 -73.418 123.044-177.151 145.259 70.335 120.803-160.627 175.502 -84.813 123.239-134.763 142.965-151.919 92.669 21.607 149.170 13.737 92.402 68.011 128.155 -74.826 128.647-110.983 171.615 -28.169 124.904 -64.827 87.547-100.908 122.624-147.710 134.437-105.591 141.905-157.256 135.599-134.357 93.154 -29.535 110.813-151.863 92.577 -82.612 128.318 -76.497 92.604 62.647 153.947-118.177 93.650 61.128 109.637 -69.886 92.602-176.579 124.419-133.259 120.104-156.677 155.700 103.153 91.900 45.472 131.741 -77.115 94.979 92.759 125.798-172.705 92.301 -61.101 160.812-168.216 94.050 -54.264 143.779-103.659 94.881 179.920 0.000 0.000 91.783 59.201 139.277-100.564 92.390 35.523 95.288 -68.289 95.775 43.127 0.000 0.000 93.342 41.984 123.921 -97.214 93.202 39.233 139.663 -97.995 94.305 38.212 145.221 -74.797 94.264 39.722 126.526 109.443 93.339 39.787 142.992-127.546 92.863 43.028 151.194 -28.595 91.193 44.488 132.170 -79.069 92.449 44.670 128.036-100.669 91.340 41.901 140.979 81.954 93.646 43.038 115.925 -83.068 92.965 40.998 133.042-109.339 93.951 50.468 124.082-118.059 93.038 64.231 141.782 -74.508 94.681 81.527 123.492-128.103 118.016 0.000 132.095-155.738 # 194 total E -6.63456E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.628 135.589 -75.392 124.722 -83.602 129.291 -87.235 116.903-101.510 138.296-147.404 91.361 54.726 133.862 -78.814 92.283 42.145 116.724 -83.475 91.835 50.746 146.042 -77.808 91.000 46.594 99.902 -48.324 92.472 43.504 176.469 20.291 91.633 44.176 134.758 -51.230 91.601 44.021 136.994-131.643 91.579 52.361 119.426 -94.114 91.866 51.216 141.341-112.691 92.565 36.002 119.709-114.099 112.608 5.608 0.000 0.000 119.962 -88.807 100.236 -81.995 122.989-170.630 166.786-112.591 125.685-154.727 176.442 178.750 120.406 -57.507 98.711 112.525 95.302 67.412 150.759 -29.240 138.588-174.519 73.387 -77.585 128.145-160.582 156.659 2.046 121.155-164.494 138.110 -72.267 127.187-148.743 145.982-176.764 121.637 106.243 143.060 54.437 90.926 -28.806 129.604 -76.888 93.341 -52.552 166.190 -95.623 123.943-176.864 113.362 -93.069 125.297-159.687 150.273-102.633 124.207-167.685 132.442 39.179 128.175-169.261 163.560 -60.219 122.536-171.174 158.616 -80.128 122.435-166.604 138.854 144.140 95.338 -34.741 119.954-148.738 91.929 -80.843 132.393 -79.141 92.513 65.147 163.168 -5.716 93.457 59.024 126.919-144.012 92.091 174.979 115.387-140.315 126.980-174.467 153.274-140.202 125.062-168.548 166.154 -84.181 126.864-170.654 141.351 163.275 116.221-175.866 167.930-151.209 126.382 178.434 157.374 149.605 93.118 80.239 0.000 0.000 92.858 55.832 122.016-116.831 93.644 33.070 90.899 -80.878 96.253 42.723 0.000 0.000 93.936 40.549 123.500 -98.769 93.532 39.066 141.891-126.502 94.532 37.544 140.250-123.959 94.191 40.185 127.514 108.327 93.198 40.143 141.685-116.681 92.743 43.178 148.596 -26.362 91.188 44.266 131.820 -78.802 92.634 43.657 126.178-100.690 91.555 41.547 141.648 82.459 93.792 42.706 141.555 -75.941 92.909 41.333 133.411-106.315 93.798 50.759 124.482-116.516 92.942 64.184 141.721 -75.002 94.685 81.183 125.119-127.150 118.006 0.000 132.231-155.992 # 195 total E -6.72024E+02 rmsd from N 0.000 %NC 0.00 0 91.575 60.508 136.537 -76.642 122.820 -82.526 122.714 -91.299 108.233 -47.315 132.764-143.680 91.281 103.231 131.363 -76.718 117.162-158.760 135.885 -90.961 126.498-163.334 164.059 -30.943 124.471-161.901 129.784-121.465 127.722-164.221 153.082 6.402 92.925 38.832 141.769 -77.604 113.599-163.025 144.581 -79.216 121.832-127.127 149.438 -86.772 127.051-169.147 166.693-179.451 101.736 -63.533 126.357-119.572 97.467 -20.644 164.319-137.030 93.394 89.499 114.807 70.452 121.963-127.786 166.726 -69.966 124.707-173.362 157.889 164.380 130.341 -88.477 144.068 -96.748 126.592 -9.013 159.597 153.027 120.760-162.856 127.562 28.360 131.430-159.895 127.264 -45.621 123.539-167.174 135.587-117.130 128.392-167.458 163.568-151.090 124.904-179.442 157.746 69.779 91.787 74.138 131.161 -77.914 95.731 58.099 130.095-112.815 92.630 -80.830 153.491 -2.585 90.694 -27.004 132.686 -76.473 109.257-173.202 141.848 13.102 127.925-165.653 122.252 -40.837 125.829-168.412 157.259 -89.670 122.282-162.451 160.275 170.618 93.756 -34.005 117.587-151.976 91.893 -79.951 128.084 -76.485 92.589 65.246 109.502 -80.769 93.870 58.932 137.735-143.427 92.352 177.323 117.044-141.303 126.852-174.341 157.369 177.592 127.262-166.799 162.695 -81.748 122.232-156.772 135.336 159.157 92.533 52.106 150.962 164.766 92.629 37.455 154.495 -7.250 94.176 47.172 0.000 0.000 92.559 42.549 134.228-106.411 93.448 35.965 140.438 -23.623 96.115 38.371 0.000 0.000 94.485 39.479 123.201 -82.710 93.941 36.876 144.389-114.299 95.228 37.159 165.436-112.626 94.535 39.045 126.536 111.203 93.471 39.681 144.303-125.592 92.874 42.899 148.578 -26.244 91.208 44.265 131.302 -78.551 92.639 43.580 127.031-100.678 91.540 41.493 141.520 82.578 93.818 42.654 141.571 -75.991 92.903 41.337 133.126-105.639 93.800 50.624 124.655-116.414 92.948 63.802 141.628 -74.885 94.723 80.979 125.195-126.743 117.793 0.000 132.150-156.181 # 196 total E -6.70338E+02 rmsd from N 0.000 %NC 0.00 1 125.230-111.463 156.210 52.637 126.507 -76.750 128.611 -88.408 116.430 -99.135 136.727-145.575 91.697 50.049 128.415 -77.988 92.695 46.840 139.902 -74.520 93.505 49.663 167.319 -36.110 94.628 30.491 105.745 -72.217 95.108 52.270 111.025 -87.863 92.710 49.489 129.279 -69.286 91.941 -98.258 138.994 -79.215 119.750-136.139 142.494 -85.411 127.139-168.675 140.817-111.957 108.813 -61.804 137.078-100.283 98.205 -19.432 164.396-123.999 93.534 88.797 143.314 -86.556 127.289-127.979 164.650 -62.043 121.892-172.150 153.702 160.961 130.672 -74.188 152.666-105.938 129.182 -18.266 151.550 -22.359 128.198 -75.491 113.807 60.072 136.953-161.787 132.286 -55.288 119.199-163.496 138.870-109.662 122.920 112.159 159.990-152.231 123.091 -91.828 136.999 -57.428 91.116 52.646 130.223 -76.876 91.930 44.901 130.995 -94.422 91.544 46.632 137.439-162.262 90.856 44.662 127.480 -75.614 91.157 42.916 112.475 -47.083 92.084 47.678 143.555 -74.109 90.879 44.920 127.682 -76.476 91.065 44.313 155.104 139.558 91.139 46.575 140.356 -49.622 90.585 45.527 131.883 -78.787 90.934 48.747 121.662 -34.114 90.956 42.933 164.277-130.927 91.382 40.113 119.384 -85.848 91.954 51.192 122.779 -71.179 90.750 66.291 120.169 -71.912 91.438 43.403 122.275-131.645 93.101 79.887 152.330-121.091 106.999 -21.352 137.868 -91.407 120.724-136.437 0.000 0.000 123.607 108.278 168.806 -85.539 90.760 -36.290 102.192 -80.526 92.448 -43.381 0.000 0.000 116.217-132.436 139.956 -85.514 92.744 39.337 169.593-173.485 92.712 49.118 147.293 -71.384 93.461 41.494 133.512 111.666 93.705 34.317 139.243-157.078 93.978 41.523 147.173 -32.835 91.469 46.291 130.342 -79.173 92.367 45.288 144.563 -76.082 90.998 41.672 141.252 -79.256 93.303 43.869 111.999 -81.964 92.933 39.937 131.482-109.170 94.169 50.347 128.345-112.709 93.074 64.041 143.103 -75.725 94.696 81.050 123.839-126.270 118.022 0.000 131.995-156.501 # 197 total E -6.64976E+02 rmsd from N 0.000 %NC 0.00 1 91.568 60.040 135.964 -75.020 124.491 -69.990 128.554 -86.452 116.450-159.527 129.501-134.966 132.099-166.801 152.711 -87.992 126.153-130.518 171.234-115.783 127.990-160.609 113.173 -62.339 129.583-131.714 147.458-126.557 126.979-174.482 103.589 -50.811 92.868 4.338 113.249 58.155 114.803-147.557 161.535-159.802 122.909-160.763 168.346 -29.166 111.128 -54.276 159.916 155.360 92.443 -27.613 138.918-107.787 94.883 95.616 151.724 49.023 121.795-125.440 134.005 -74.456 122.588-158.746 160.473-152.336 93.189 14.372 160.829 -31.041 120.733-134.610 141.617-121.515 135.077-178.480 124.355 -63.640 121.845-142.506 134.254 10.913 125.235-167.471 124.587 -67.777 130.057-128.902 122.100-112.529 124.418-163.155 176.430 -44.876 93.315 43.817 131.029-110.886 92.788 107.620 130.723 -78.117 93.186 -24.841 172.093 -87.651 92.616 -62.564 104.371 -78.360 91.405 16.110 129.132 -76.016 117.708 171.622 145.540 -59.570 93.053 66.480 114.772 -44.558 91.356 46.200 127.536 -74.564 92.848 40.964 135.355 136.980 93.219 40.978 148.954 -42.678 91.821 41.674 127.479 -75.730 93.266 43.954 144.397-121.019 92.455 41.465 135.370-107.114 91.905 39.604 114.747 -72.959 93.241 46.466 122.086 -83.462 91.271 55.492 129.969 -76.936 92.332 46.454 126.172-148.548 93.248 70.511 153.681-125.834 120.912-105.707 138.890-117.309 135.071 -75.021 0.000 0.000 92.814 50.710 137.030-107.882 92.520 35.509 89.807 -84.051 94.732 47.148 0.000 0.000 92.362 45.381 131.580-106.145 92.138 40.883 139.972-126.239 92.843 42.378 141.878-121.088 92.665 46.269 123.550 74.893 92.153 41.437 137.138-129.629 92.122 43.270 147.398-101.557 90.836 52.543 135.335 -80.931 92.151 44.456 121.638 -72.832 91.857 38.598 140.413 95.946 95.342 38.666 140.433 -76.641 93.944 41.399 138.698-111.591 93.958 49.639 136.120-119.509 92.893 62.882 141.286 -73.872 94.699 82.479 123.684-123.173 118.055 0.000 131.620-155.335 # 198 total E -6.58642E+02 rmsd from N 0.000 %NC 0.00 1 125.223-132.033 164.840 53.023 126.052 -77.910 166.820 -87.961 116.911-141.712 96.715 -75.995 127.361-164.044 139.240 -99.488 127.430 -95.228 165.943-141.930 96.720 33.967 99.151 -60.605 96.404 159.289 169.527 -91.420 93.155 65.767 123.248-115.887 93.069 68.374 108.804 -54.210 91.856 -81.220 131.285 -58.507 87.188 -37.566 109.721-104.899 120.128-150.077 161.226 112.857 111.297 150.624 144.645 -18.614 131.872 30.785 0.000 0.000 133.514-101.017 156.093 -84.541 130.019-161.836 142.192 -93.996 111.734 -56.452 143.331-105.427 92.577 -25.651 104.810 121.908 95.343 90.202 167.044-117.212 125.165-120.610 141.093 -5.268 122.739-130.460 163.143-144.579 131.068-116.917 175.505 -53.515 130.393-138.395 73.052 -85.260 126.990 -39.871 81.653 -45.379 129.486-157.777 150.853 -91.368 108.253 -56.352 153.949-100.756 94.524 -24.151 139.138-139.968 92.910 91.525 130.000 -76.449 128.558-121.986 151.746 -75.228 120.420-133.560 159.519 -26.836 91.178 52.104 136.572-131.342 91.750 40.051 152.773 133.517 92.198 42.479 138.028 -49.769 91.206 46.256 125.099 -77.646 92.013 45.919 131.915-110.591 91.141 48.928 103.876 122.781 91.115 58.395 88.575 56.801 91.888 112.082 126.935-133.360 91.355 39.259 127.510 -75.343 105.969-166.115 138.523-150.834 117.137 -71.534 164.386 -12.438 92.631 -14.884 159.615 -41.380 94.364 99.609 0.000 0.000 121.096-155.875 164.531 -85.831 93.184 35.407 96.168 -82.488 119.277-134.810 0.000 0.000 125.797-108.506 106.987 -99.034 92.497 52.050 130.293-139.944 93.175 41.685 141.522 -75.460 93.654 42.005 134.388 88.366 93.251 35.127 134.289-133.417 93.065 45.845 152.284 -30.259 91.093 44.798 138.287-102.310 93.002 40.645 142.470 -74.577 92.140 38.627 134.303 77.489 94.212 43.034 109.845 -72.226 92.562 45.871 133.326 -90.874 92.759 52.188 135.630-121.820 92.620 69.972 141.305 -75.488 94.510 85.345 118.811 -83.273 117.863 0.000 133.519-147.846 # 199 total E -6.90919E+02 rmsd from N 0.000 %NC 0.00 1 91.561 65.456 135.632 -55.439 129.016-164.454 127.846 -80.271 93.675 64.890 119.220-103.421 92.521 157.616 125.257-131.867 92.796 38.202 140.897 -76.043 94.872 178.195 123.720-106.061 139.055 -60.241 108.417 -68.622 131.884-167.256 174.257 13.972 112.130-178.201 125.824 45.049 92.117 42.248 152.592-121.743 109.927 146.929 167.157 18.232 96.673 -33.772 151.810 140.898 92.753 -51.276 131.901-110.423 94.086 87.033 151.724 49.023 128.230 -91.986 113.410 -91.738 122.436-161.270 164.122 -22.977 126.068-176.982 134.877 117.302 93.682 74.563 105.830-122.354 97.340 116.261 0.000 0.000 131.136 -64.562 141.881 -22.692 131.714 -28.156 121.000 -67.774 127.373-167.372 125.169 -83.952 132.769-111.948 157.332 60.825 133.176 -29.317 152.622 60.876 92.045 -12.808 130.744 -77.188 125.489-145.900 141.029 -68.613 91.972 57.627 91.382 -74.804 91.115 48.974 127.197 -75.144 93.190 34.848 121.824 -50.986 95.988 39.644 119.125 -40.184 92.657 39.916 123.497 -78.310 93.074 42.400 121.430 139.828 91.909 44.072 154.063-141.513 91.384 43.711 129.175 -77.184 93.730 36.800 150.895-140.934 93.583 42.725 136.890-141.165 92.083 42.815 119.203 -79.161 92.932 46.535 120.510 -85.095 91.187 51.289 129.202 -76.312 93.956 80.256 126.709-146.413 92.574 -70.278 158.882 8.692 94.552 -53.636 148.488 -98.570 94.750 164.347 0.000 0.000 92.121 82.765 119.461 -85.948 93.151 54.713 87.688 -90.652 95.402 99.618 0.000 0.000 116.088-119.052 166.355-134.371 92.639 51.564 124.800 88.425 92.712 42.364 123.115 -93.935 92.296 47.255 116.886-139.474 91.078 49.321 141.230-159.414 91.150 50.802 141.251 -12.814 91.031 47.722 129.300 -75.949 92.592 115.159 110.391-135.048 91.410 10.655 118.320 133.462 111.755-119.772 143.446 -62.853 92.179 69.651 142.185 90.482 93.527 69.882 121.236 -91.241 92.579 68.524 140.003 -72.878 94.892 88.122 161.177-138.389 117.468 0.000 137.490-135.305 # 200 total E -6.64398E+02 rmsd from N 0.000 %NC 0.00 1 125.070-135.517 164.144 -7.012 123.815 -87.705 141.071 -96.109 116.582-137.218 100.987 -80.365 124.605-176.856 135.516 -86.247 125.214-114.832 129.862-116.068 94.164 46.736 142.728 -72.182 94.356 120.236 162.451 -83.666 93.194 93.083 105.965 -97.989 91.774 58.619 116.228 -54.765 92.987 -75.126 110.855-100.800 125.307-128.505 130.818 -96.553 132.317-170.386 158.411 -99.687 108.215 -65.453 161.087 -18.754 98.619 -16.112 151.724 49.023 93.486 87.352 152.858 97.420 127.673-132.443 137.781 -80.501 123.101-169.393 156.877 154.973 131.352 -85.633 164.947-166.498 125.538 -26.870 0.000 0.000 120.545 -74.843 118.962 65.169 126.729-156.025 131.016-100.325 94.957 52.986 112.748-103.918 94.674 141.531 116.731-125.397 91.818 66.626 89.713 21.605 92.137 67.778 132.284 -78.823 93.121 -77.750 143.871 -73.349 92.562 -39.629 146.118 -34.585 93.132-177.413 127.267 -75.027 92.418 58.694 125.403 1.914 95.402 106.015 170.233 -57.937 111.957-116.417 131.620 -87.323 92.053 47.265 125.178 7.343 92.272 45.944 134.022-130.805 91.479 43.432 129.470 -77.898 92.337 46.851 109.687 -98.933 91.456 48.530 88.910 115.934 91.275 56.179 86.753 57.339 92.193 112.217 129.726-142.118 91.328 38.760 128.526 -75.743 107.272-168.184 137.510-149.538 117.014 -70.759 160.496 -20.579 92.668 -15.906 159.622 -41.903 94.358 99.899 0.000 0.000 121.764-152.581 167.944 -81.349 93.158 28.699 96.332 -82.576 120.912-112.107 0.000 0.000 122.186-119.704 119.523-101.661 93.020 47.097 160.219-127.711 93.351 43.946 132.645-132.543 93.063 42.345 132.792 92.071 92.608 39.959 136.149-126.274 92.988 43.771 146.390 -28.398 91.359 43.362 130.103 -73.820 92.741 43.639 145.349 -78.683 91.148 43.988 141.165 -82.167 92.651 45.956 106.006 -66.698 92.656 39.726 136.068 -89.257 94.019 53.822 122.760-118.804 92.948 70.083 142.957 -75.411 94.620 85.910 127.060-136.058 117.415 0.000 138.472-137.093