jlee = 1 nbank = 951 nstep = 40400 34698396 0 887.36100 # 1 total E -1.46710E+02 rmsd from N 0.000 %NC 0.00 122.525 -93.591 151.176 -79.009 95.053 -45.448 112.029 -77.497 90.212 -48.209 103.386 -74.287 90.877 -42.638 130.858 -77.179 96.439 -39.750 141.324-120.498 96.814 -38.110 63.124 -70.173 91.822 -47.543 132.876-133.427 100.243 -35.897 176.469 173.529 92.606 -52.741 124.113-116.125 94.177-112.268 76.767 -76.906 111.099-153.726 151.465-163.352 109.761 1.326 89.982-109.450 93.634 66.190 136.380-120.584 91.039 50.055 126.168-144.631 90.782 49.160 106.311 -87.030 91.304 45.514 139.992 -96.645 97.368-101.226 124.577 -78.939 126.987-119.081 150.538 -75.708 133.212-170.918 154.526 102.290 104.754 -21.262 143.788-130.536 95.595-129.113 0.000 0.000 95.499 41.023 110.433 -83.848 91.913 48.416 150.043 -85.072 92.570 38.044 113.542-128.125 90.908 54.366 113.151 -76.915 90.008 52.197 135.582-101.508 91.625 38.173 136.607-141.585 96.274 82.261 152.549 -21.951 133.290 -50.004 120.569 -95.738 130.682 -90.316 110.105-103.931 90.917 61.844 112.893 -75.946 89.843 53.873 112.964 -37.614 89.544 47.611 103.556 -71.699 89.540 47.395 129.143 -75.887 88.456 46.622 101.847 -83.670 90.516 43.764 115.199 -65.234 90.241 47.624 143.985 -50.702 89.470 52.076 128.614 -77.052 87.663 76.058 108.073 -84.738 89.043 174.297 129.530 -78.052 93.841 54.281 140.684-115.696 90.048 46.928 135.767 -66.795 91.440 57.330 146.767 -30.659 88.825 42.973 137.052-137.488 94.746 81.631 102.842 -80.156 92.543 0.000 128.857 -76.727 # 2 total E -1.53640E+02 rmsd from N 0.000 %NC 0.00 93.115 168.326 137.800 -90.410 92.882 58.941 144.134 45.860 92.661 43.206 106.155 -82.894 92.335 50.777 130.831 -76.922 91.981 44.381 151.102-144.753 91.118 42.715 66.057 -78.868 93.474 40.685 120.721 -50.945 96.775 35.560 133.432 -97.211 93.947 45.549 148.460-159.670 92.974 80.887 86.954-107.300 91.996 -60.400 137.987-110.649 105.329 -74.727 91.619 -89.735 91.632-116.625 149.512 -8.868 110.834 -68.926 149.123-124.869 98.287-112.065 135.508-155.333 93.753 44.839 156.109-165.599 92.558 46.820 134.510 -82.506 90.745 48.885 130.120 -61.298 90.602 48.797 118.329 -55.400 90.206 43.263 145.581-156.062 94.336 37.727 0.000 0.000 92.748 47.139 138.218-101.372 90.444 42.504 126.669-117.933 90.882 45.212 114.452-123.665 89.549 49.166 113.077 -78.454 90.017 47.986 135.158-103.867 92.554 49.214 131.292-132.362 94.815 -96.688 141.927-125.943 113.139-176.174 111.043 -78.993 133.410-171.143 113.145-109.509 96.490 45.567 133.290 168.169 92.518 43.913 106.032 -25.407 90.106 53.268 132.560 -28.098 90.397 44.344 127.966 -77.092 90.976 47.755 101.645 -82.597 90.381 49.503 130.134 -58.195 90.936 65.806 127.338 -75.319 90.366 56.774 128.861 -76.942 94.952-171.977 82.322 -93.627 92.151 56.224 131.858 -77.143 90.729 45.830 141.265-109.511 88.267 61.698 133.098 -21.315 89.909 64.563 141.364 -48.273 86.800 37.899 147.565-170.895 95.738 87.352 103.588 -79.901 92.428 0.000 128.923 -76.393 # 3 total E -1.50478E+02 rmsd from N 0.000 %NC 0.00 93.006 152.750 139.380 -91.709 93.126 56.269 136.149 49.146 92.035 43.501 106.257 -82.697 91.888 49.265 130.266 -76.677 91.921 44.760 154.071-149.950 92.711 42.666 62.128 -71.852 90.896 45.780 128.672 -43.046 87.886 54.422 133.568-108.061 88.233 57.956 115.526-108.477 88.188 66.489 89.633 -94.172 93.530-159.098 125.964 -84.938 95.694 68.723 99.330-114.569 95.529 37.530 106.034 -81.246 91.267 91.182 152.464 -34.664 94.795 48.305 132.130-150.642 91.577 37.634 130.423-104.586 92.194 50.806 141.264 -56.444 94.166 42.882 106.843 -59.734 97.327 26.426 147.998 169.709 108.774 21.734 106.999 -82.954 98.521 43.917 0.000 0.000 93.246 46.051 133.228-116.874 91.414 41.553 122.609-117.086 90.690 41.758 114.934-120.955 91.094 49.718 114.462 -80.282 89.848 49.622 144.243-120.080 90.481 42.356 120.546-150.541 96.341-123.391 105.295 -82.216 107.199 172.966 154.349-137.260 95.299 -56.985 92.979-101.243 87.860 -53.728 110.431 -75.552 89.280 -54.535 110.190 -45.217 88.290 -47.683 115.341 -73.367 90.745 -41.960 126.886 -75.471 90.337 -43.808 103.364 -78.979 89.655 -50.819 143.293 -43.456 89.031 -44.586 139.155 -81.304 90.206 -45.537 127.770 -76.292 88.652 -48.128 126.589 -6.255 90.283 -48.691 129.312 -76.716 90.311 -40.956 145.184-142.420 89.263 -49.725 124.651 -11.085 89.969 -54.649 155.483 -18.882 90.742 -44.001 141.716-174.449 95.890 95.993 104.507 -79.816 92.496 0.000 128.958 -76.382 # 4 total E -1.47230E+02 rmsd from N 0.000 %NC 0.00 93.207 -71.914 127.998 -79.457 93.771 -50.435 115.766 -76.809 91.532 -43.657 103.619 -77.171 92.001 -45.638 127.811 -76.150 97.298 -23.463 143.922-133.776 102.943 -34.681 61.278 -67.713 95.067 -34.657 134.831 -41.058 99.429 -42.749 135.647 -87.894 89.780 -47.678 131.720-102.127 88.385 -49.810 77.475 -74.163 91.187 -44.552 152.180-104.570 98.875 -47.691 124.177-142.825 92.886 86.419 123.407-145.771 134.142 165.630 133.688-124.702 109.904 33.804 141.661-155.883 96.640 59.366 141.346-109.587 102.045-179.860 139.510-103.437 134.121 -2.525 132.719 142.158 95.102 44.830 147.666 -7.598 94.544 42.598 142.958-171.160 90.140 49.311 0.000 0.000 90.559 43.933 107.278 -85.558 91.199 43.375 140.837 -77.548 91.378 43.295 119.929-122.765 89.824 48.485 114.798 -79.450 90.593 46.178 132.708-104.841 91.909 48.227 134.078-146.428 93.279 -99.698 104.608 -85.950 118.509-175.370 114.477 -78.207 122.649 -5.255 117.221-119.979 143.063-127.896 123.758 -85.742 92.912 122.357 134.378 -99.418 94.499 -41.294 111.654 -76.418 91.875 -50.078 126.709 -75.602 88.188 -44.351 102.665 -80.121 89.502 -54.089 127.681 -76.599 89.222 -44.199 145.221-140.226 92.158 -42.467 127.824 -76.023 92.553 -44.917 112.237 -58.443 91.137 -49.975 130.065 -77.047 89.982 -46.246 138.110-165.031 90.922 -73.467 129.373 -27.038 90.247 96.707 151.638 -21.115 95.492 45.557 152.002 -26.726 95.983 22.703 138.391 -26.256 92.525 0.000 129.362 -76.721 # 5 total E -1.53127E+02 rmsd from N 0.000 %NC 0.00 92.550 133.857 126.097 -52.976 93.451 63.408 135.187 69.013 93.066 46.399 106.716 -76.606 93.524 38.104 130.444 -77.453 96.682 48.721 154.916-175.013 96.997 34.636 52.601 -72.873 94.953 44.842 136.981 -24.255 95.141 39.395 127.917-116.182 89.648 53.322 130.520 150.414 87.306 60.746 80.041-104.060 89.658-170.303 137.088 -91.832 92.974 87.937 104.321-143.662 90.892 52.204 108.204 -84.807 93.043 158.966 135.288 -86.446 133.002 -25.622 148.683 173.913 96.978 44.399 141.132 144.283 93.294 39.882 132.802 -90.464 90.979 55.443 159.920 115.781 89.587 45.903 130.250 -25.372 91.008 40.649 107.257 -82.594 90.217 48.839 0.000 0.000 89.709 50.171 104.236 -85.505 88.715 44.166 140.526 -76.669 90.307 44.040 121.383-125.326 89.553 49.191 114.010 -76.120 90.479 47.642 135.721-104.515 91.962 43.473 133.829-145.010 94.179-100.201 142.201-126.362 115.864-161.091 111.219 -78.296 94.377 -51.376 100.185-101.535 91.344 -50.443 110.271 -76.042 92.445 -67.117 110.501 -61.234 87.331 99.742 137.317 -35.307 92.255 53.289 128.797 -76.058 88.781 46.021 138.101 -39.770 89.544 49.155 146.257 -37.923 88.346 50.855 157.617-130.632 89.295 43.330 127.979 -76.559 89.493 47.737 111.047 -37.105 90.414 46.114 128.904 -76.763 90.716 46.595 136.969-123.125 89.792 49.858 130.207 -43.782 89.804 52.101 129.888 -62.001 90.609 45.266 108.593 -87.130 94.771 77.709 104.258 -79.724 92.528 0.000 128.935 -76.671 # 6 total E -1.46914E+02 rmsd from N 0.000 %NC 0.00 93.287 169.943 140.137 -99.586 93.701 54.623 132.941 45.657 91.387 43.470 105.656 -81.014 91.313 54.554 131.741 -76.864 89.738 42.596 152.304-162.526 91.170 42.976 67.323 -71.105 90.738 45.997 111.883 -46.047 88.084 52.146 149.630 -86.976 89.362 41.249 111.358-108.288 90.382 43.380 96.678 -92.582 93.362 66.004 139.028-100.452 91.868 60.368 106.301-113.492 89.609 167.669 130.895-126.297 143.093-170.104 162.885-151.752 96.147 64.208 138.278-144.384 99.400 -76.805 118.004-110.221 117.869-109.562 156.613 -58.527 93.527 48.249 145.149-108.370 92.945 47.410 149.035 117.623 93.950 38.714 143.481-135.445 94.341 43.655 0.000 0.000 96.382 29.305 136.331-118.730 103.543 37.811 167.434-155.130 95.409 37.232 117.186-143.346 93.204 50.214 115.238 -80.350 91.311 45.974 135.440-102.865 91.966 54.978 139.418-109.384 93.676 0.017 109.122 -90.659 127.618 53.800 171.437-164.058 137.181 -73.876 113.584-103.673 126.956 -16.276 117.067 -83.102 113.850-145.259 138.243 -29.998 95.286 54.213 121.532 -75.799 92.604 43.785 129.325 -76.286 88.559 47.506 142.462-127.253 88.754 53.852 121.901-127.848 89.877 53.972 138.883-151.142 88.003 41.899 128.088 -76.403 89.409 54.167 68.882 -90.193 89.784 46.374 128.973 -75.444 90.883 40.397 137.950-124.404 91.940 46.232 128.132 -46.934 91.098 50.679 131.422-102.117 90.804 44.204 134.938-147.182 95.413 72.890 103.901 -80.525 92.524 0.000 129.042 -76.663 # 7 total E -1.46828E+02 rmsd from N 0.000 %NC 0.00 93.105 161.132 139.401 -93.905 93.328 54.244 131.265 45.701 91.959 45.611 106.027 -79.157 91.472 45.464 131.929 -78.141 93.590 48.069 151.186-142.362 95.341 39.730 54.161 -67.451 89.798 49.534 129.020 -21.354 89.095 59.042 125.917-113.274 86.437 48.099 125.792-120.530 90.417 61.157 84.732 -98.983 91.418-170.003 139.069 -86.609 95.435 67.850 99.943-126.129 95.033 36.559 101.863 -83.100 90.715 71.143 149.061 -34.004 92.516 50.828 128.201-141.286 92.645 33.419 127.779-115.658 93.878 47.873 124.479 -55.867 93.555 49.926 111.502 -49.606 91.998 57.502 142.556-156.917 111.120 -16.561 101.947 -82.936 98.114 63.898 0.000 0.000 90.423 51.365 135.683-118.805 90.338 44.818 125.069-118.064 90.031 41.538 116.671-126.572 90.106 52.577 114.133 -79.767 89.707 53.761 140.312-113.156 90.101 42.269 124.386-155.917 96.260-103.376 149.320 -27.276 110.454-173.482 152.488 -17.187 107.270 -56.424 95.527 -98.443 112.626 -19.605 115.422 -78.897 93.869 -49.057 113.438 -53.918 92.914 -44.393 107.497 -74.895 90.125 -48.951 127.604 -76.887 88.102 -43.497 102.771 -79.878 88.164 -52.808 142.211 -45.916 88.970 -46.395 147.596-135.114 89.026 -48.442 127.415 -76.769 84.828 -65.199 116.476 -29.222 87.882 -55.299 132.651 -76.897 90.904 -42.043 135.727 -31.029 96.668 134.656 127.441 -21.934 99.586-113.932 149.081 -30.285 98.410 -17.065 110.795 -82.341 109.903-130.181 146.439 -16.009 93.015 0.000 129.996 -76.706 # 8 total E -1.46380E+02 rmsd from N 0.000 %NC 0.00 93.259 -88.472 122.901 -63.168 113.685-118.448 127.763 -53.451 93.294 40.994 107.169 -79.515 92.797 49.701 130.092 -76.103 92.553 43.518 139.894 -8.705 90.986 44.050 57.876 -70.769 89.500 49.976 161.121 28.116 90.054 42.731 134.790-103.941 89.512 52.300 135.590 131.376 86.537 59.600 73.096-115.834 89.251-177.954 138.783 -96.552 93.352 91.672 102.322-140.427 89.963 54.019 102.689 -84.076 96.293 147.346 119.909 -75.387 110.483 16.649 146.648-163.637 93.854 49.927 135.017 -98.854 91.171 50.445 121.604 -44.702 92.341 49.727 106.698 1.609 94.825 25.718 156.708 147.611 109.931 21.169 108.932 -82.699 97.914 45.178 0.000 0.000 92.140 49.007 151.281-164.998 90.865 44.495 137.478 -86.527 90.373 40.329 119.261-121.800 90.719 52.793 115.358 -77.218 89.498 52.335 139.683-106.533 90.685 38.558 130.853-149.152 96.205-102.280 149.894 -26.590 110.077-148.044 153.372 -17.264 105.006-107.739 100.367 -93.227 108.988 43.184 115.638 -78.941 93.464 -84.266 87.656 -66.896 93.797 -11.977 113.392 -71.211 99.841-123.396 129.593 -76.731 89.173 48.960 95.477 -85.881 91.714 61.920 113.229 -39.831 90.523 47.704 147.031 -26.899 89.805 42.724 128.822 -76.500 88.932 54.403 114.037 -54.301 90.671 46.825 128.536 -76.014 90.185 47.475 142.815-104.867 91.561 51.972 128.247 -41.992 92.548-120.879 135.985-100.997 96.785 -9.120 138.817-142.358 116.488-118.069 147.771 -7.425 126.445 0.000 145.759 -89.363 # 9 total E -1.46479E+02 rmsd from N 0.000 %NC 0.00 93.166 159.213 141.316-101.322 93.801 52.239 134.721 44.245 91.049 46.579 106.723 -81.818 91.249 49.211 130.810 -77.242 94.025 43.349 151.539-145.020 94.003 40.445 56.072 -72.304 89.772 49.100 120.182 -30.819 88.982 60.177 135.903 -99.873 86.019 43.909 128.492-124.757 90.906 42.577 77.895 -95.893 91.575 52.677 141.980 -76.131 94.450 43.223 94.595-102.997 89.264 49.329 136.247-118.988 92.594 43.448 111.594-120.120 94.289 152.278 126.708-118.138 96.879 45.035 120.055-149.112 94.861 41.686 136.442 -80.917 92.729 46.053 123.718 -55.374 92.255 52.427 141.744 -25.108 90.405 44.809 108.137 -82.633 92.354 41.468 0.000 0.000 92.703 48.453 111.856 -82.250 90.095 44.595 174.044-159.702 91.864 42.437 107.164-135.511 91.147 46.581 111.187 -77.529 89.951 56.127 147.214-105.107 90.862 46.628 144.882-121.366 92.240 37.729 141.963-125.144 101.064 3.654 151.323 -26.407 137.238-161.555 105.756 -93.869 97.376 48.557 115.414 -77.548 92.837 50.541 100.605 8.658 89.667 49.672 127.584 -16.542 91.030 56.507 130.890 -77.642 89.950 64.897 145.611 -26.162 87.692 -96.074 105.547 -49.420 94.531 -39.246 148.144 -25.073 93.654 -58.687 129.749 -75.871 95.625-116.025 116.476-126.614 91.080 48.329 130.242 -76.828 92.149 53.103 140.258-104.451 90.704 45.635 124.983 -20.356 91.467 55.744 149.001 -19.677 88.879 41.784 142.760-151.017 95.303 79.141 102.599 -79.777 92.516 0.000 128.963 -76.608 # 10 total E -1.51458E+02 rmsd from N 0.000 %NC 0.00 93.157 -85.512 119.170 -53.321 119.669-103.779 129.935 -39.055 93.136 45.200 106.081 -77.321 93.190 44.627 130.506 -77.648 94.529 43.143 149.521-148.376 93.086 43.946 50.388 -67.418 90.543 45.265 119.990 -13.951 90.068 49.626 132.372-101.482 90.057 45.110 122.494-112.043 92.588-178.472 89.480 -92.091 117.893 112.609 149.575-162.172 95.114 50.308 92.619-123.775 97.018 54.378 108.528 -85.350 96.134 -94.742 154.132-114.501 108.035-111.291 140.479-158.309 94.068 47.037 154.431-173.209 94.159 44.585 131.524 -86.287 91.457 45.599 128.309 -57.074 91.735 50.382 77.550-114.720 90.546 44.518 139.439-168.186 91.551 41.507 0.000 0.000 91.285 48.801 110.110 -82.831 90.300 50.189 145.951 -80.963 90.170 40.111 119.536-132.055 89.709 49.879 116.197 -76.812 91.396 47.701 137.804-109.322 92.080 51.444 132.446-170.517 92.769-100.844 141.072-121.129 110.571-176.668 151.802 -18.156 102.363 -44.177 97.652-101.510 104.611 -31.723 112.899 -78.328 93.642 -43.409 111.056 -52.880 91.578 -49.089 109.164 -73.469 89.505 -47.523 127.753 -76.649 88.536 -42.670 101.982 -80.189 89.303 -50.195 117.702 -31.819 89.840 -44.643 153.657 -22.064 89.810 -58.601 127.877 -76.309 88.451 -80.638 129.067 -14.795 87.438 96.014 132.488 -77.066 90.401 52.527 139.964 -91.177 88.215 48.277 110.448 -21.889 90.902 55.779 140.580 -34.479 88.930 41.791 139.633-131.296 95.105 84.312 103.167 -79.925 92.526 0.000 128.904 -76.618 # 11 total E -1.51014E+02 rmsd from N 0.000 %NC 0.00 93.194 -66.768 129.978 -86.102 94.249 -48.592 115.299 -76.840 91.025 -45.137 103.262 -76.465 91.857 -45.767 129.026 -75.986 94.341 -28.343 144.543-138.181 104.366 -36.193 55.239 -76.872 95.557 -25.476 122.893 -43.915 108.396 -31.140 170.237-138.771 96.325 -67.069 131.705-108.253 91.656-163.509 90.466 -91.935 95.486 73.212 146.150-134.157 97.970 37.794 89.611-115.718 96.969 76.927 114.486 -82.138 93.075 -85.590 145.004-109.407 110.091-113.089 139.986-152.173 92.751 46.740 138.940-107.882 92.985 46.468 135.258 -75.284 90.752 47.549 130.279 -41.708 90.724 48.340 98.436 -95.125 89.271 47.761 136.510-165.745 90.337 45.564 0.000 0.000 90.061 48.100 110.532 -76.250 89.956 45.604 138.339 -73.362 90.538 42.843 123.258-124.549 90.462 46.606 109.176 -75.962 92.144 42.559 136.910 -88.653 94.460 45.340 135.855-148.205 95.361 18.640 153.491 -21.142 111.399 120.657 110.993 -79.689 133.159-138.910 117.285-112.545 98.195 -25.454 111.572 -79.632 95.890-120.161 121.399 -18.973 93.009 48.798 134.247 -16.238 92.623 51.092 130.171 -76.420 91.423 40.034 103.128 -80.773 92.660 46.784 122.589 -35.013 94.025 40.262 131.098 -65.830 92.912 41.783 130.608 -78.202 93.269 73.262 105.034 -81.687 94.685-177.073 128.813 -77.167 91.223 53.380 140.649-104.838 90.441 50.575 125.628 -26.280 89.410 59.425 149.053 -29.768 88.946 46.711 137.991-139.950 92.426 104.433 141.895-123.712 92.580 0.000 128.620 -76.703 # 12 total E -1.48788E+02 rmsd from N 0.000 %NC 0.00 93.155 160.874 140.388 -97.230 93.329 55.219 134.862 39.964 91.728 44.377 106.398 -82.204 91.610 49.807 130.523 -76.611 91.760 43.136 151.073-140.542 91.324 43.761 59.557 -68.213 91.076 44.517 120.229 -30.273 89.387 48.996 132.813 -94.719 90.433 42.030 123.870-109.313 96.881 120.219 86.511 -93.949 106.983-111.639 150.435-105.419 91.529 52.547 98.306-106.475 93.153 44.365 104.024 -74.418 93.510 42.513 143.796 -38.342 94.857 38.033 134.365-119.954 95.870 41.553 124.835-114.815 99.405 -56.715 122.345 -77.743 139.354-152.790 96.666 -36.538 95.114 46.507 170.877-130.240 99.911 37.408 145.466-155.602 97.949 36.589 0.000 0.000 91.291 51.177 152.657 179.855 90.351 48.314 121.866-103.307 90.506 40.205 122.330-121.840 90.805 47.636 113.959 -73.575 90.646 43.339 131.565 -88.312 92.878 42.815 132.819-140.581 93.156 40.253 150.738 -27.948 94.640 47.896 153.406 -27.501 93.937 45.817 103.343-129.619 92.771 45.316 113.475 -79.422 95.394 -98.016 132.026 -72.779 126.024 146.238 120.076 -77.811 92.708 -92.227 127.122 -74.859 90.089 -45.926 103.015 -78.704 90.363 -49.424 142.441 -44.705 89.901 -44.042 147.625-112.211 90.386 -51.121 127.812 -76.393 88.151 -58.885 127.767 -8.777 90.136 120.116 131.847 -77.142 93.083 46.030 141.564-109.702 89.638 48.506 125.113 -20.883 91.099 61.143 144.434 -31.821 87.611 45.836 141.336-149.381 94.088 97.805 102.201 -80.030 92.520 0.000 128.830 -76.500 # 13 total E -1.49213E+02 rmsd from N 0.000 %NC 0.00 93.108 160.488 139.461 -93.658 92.662 56.187 131.916 48.716 91.588 42.627 105.957 -82.786 91.853 51.015 130.214 -76.552 88.978 45.931 153.342-161.475 88.845 49.280 72.569 -67.697 91.268 41.432 112.392 -54.059 89.380 46.433 144.056 -81.069 94.998 33.466 107.351 -99.550 100.040 112.559 99.332 -83.797 96.122-127.178 149.139-124.804 88.932 58.640 96.860-124.700 90.412 52.495 107.897 -90.235 90.660 48.945 131.965 -32.530 91.352 38.243 108.731 -89.781 94.600 50.755 136.245 -98.532 97.489 -69.350 118.455 -75.389 124.323-159.388 124.836 -84.650 104.796 35.459 145.145 -19.754 95.194 44.916 151.979 -30.667 97.121 38.483 0.000 0.000 93.883 42.306 141.611 -15.211 91.643 48.282 149.731-100.242 89.614 48.005 125.692 -77.542 88.470 46.605 106.696 -74.085 90.732 50.445 133.237 -54.847 91.060 40.205 134.604-128.875 92.772 53.002 151.903 -22.289 95.889 -63.564 111.660 -87.073 134.076-174.862 111.812-105.804 110.861 14.276 142.604 141.884 94.973 65.557 130.131 -87.297 97.910 27.626 116.028 -75.721 97.093 -99.813 128.035 -74.946 92.393 -32.538 100.450 -81.360 90.244 -64.056 118.715 -61.002 85.271 -51.609 140.433 -57.606 90.563 -44.230 127.821 -75.645 89.306 -48.490 114.983 -41.906 89.979 -51.073 129.439 -77.181 89.207 -44.249 144.767-127.867 87.670 -52.959 125.239 -12.740 89.967 -53.630 150.651 -17.276 90.239 -45.551 143.845-133.830 95.810 103.173 144.215-124.875 92.461 0.000 129.056 -76.094 # 14 total E -1.51523E+02 rmsd from N 0.000 %NC 0.00 93.176 163.438 139.721 -95.415 93.693 53.698 131.946 46.861 91.688 44.874 106.145 -81.195 91.539 47.200 131.087 -77.926 92.673 47.945 153.748-144.325 93.617 41.084 57.521 -69.598 90.397 46.957 132.519 -30.939 88.892 57.953 126.201-117.351 87.783 65.294 120.174-113.758 83.310 172.895 85.944 -89.915 94.536 78.686 145.880-164.869 92.950 43.774 91.659-121.141 93.646 51.309 109.879 -87.185 102.105 -86.396 153.856-118.596 120.099-116.795 138.807-156.043 94.057 50.194 145.005 147.455 91.901 46.561 133.986 -84.754 90.226 51.226 134.139 -56.853 91.817 46.817 106.338 129.680 93.013 38.690 108.997 -82.808 98.930 34.569 0.000 0.000 98.413 38.448 158.512 178.597 94.191 44.103 163.338-172.907 90.985 47.229 108.183-144.434 89.110 49.365 114.428 -78.016 90.749 51.499 150.753-124.087 89.447 46.113 122.386-173.936 94.767-108.107 103.224 -82.040 113.968-176.487 152.208 -15.688 130.839 -46.779 112.529-108.924 110.312 -23.320 113.220 -79.898 93.051 -48.291 112.319 -53.258 91.223 -45.428 111.174 -71.943 92.408 -44.101 126.914 -75.522 90.574 -39.406 100.597 -81.121 91.429 -48.107 131.395 -36.293 90.221 -54.602 145.264 -45.233 89.177 -46.951 129.588 -77.185 93.950-126.241 137.374 8.193 91.132 50.819 130.819 -75.990 92.335 48.606 141.528-107.908 92.869 37.197 125.557 -28.261 93.349 57.498 150.792 -17.957 88.627 47.284 138.796-158.285 93.863 106.391 101.833 -79.776 92.591 0.000 128.807 -76.458 # 15 total E -1.47947E+02 rmsd from N 0.000 %NC 0.00 92.723 130.927 134.073 -75.416 92.799 54.075 145.613 83.840 91.220 52.821 147.854 -39.723 91.971 45.460 128.495 -75.053 94.246 38.176 159.707-156.523 94.206 43.222 125.693 165.889 92.513 42.637 107.340 -67.075 93.576 45.097 137.088 -84.461 91.710 39.404 153.800-149.293 92.702 48.206 108.350-135.512 94.050 20.588 119.208-119.392 131.311-128.951 103.259 -93.345 83.361 -72.915 144.966 -32.349 110.249-151.592 154.508 -8.473 102.069-118.186 134.958-149.500 91.448 49.797 147.012 129.291 92.115 47.017 133.405 -84.208 91.470 44.124 131.967 -57.641 92.925 45.193 112.204 -23.141 92.015 44.011 106.842 -82.261 90.570 47.682 0.000 0.000 92.443 44.057 104.315 -84.361 91.309 42.403 149.638 -78.009 92.221 42.763 115.176-125.208 90.162 50.211 110.646 -77.446 90.702 50.494 132.578 -91.870 92.780 37.870 134.850-130.638 96.495 32.360 153.519 -20.911 118.220 40.828 110.956 -82.394 107.396-150.997 100.429 -80.745 93.065 61.938 113.577 -76.709 92.491 137.931 114.176 -97.408 94.468 59.897 114.560 -76.063 90.832 42.992 128.595 -75.742 91.125 45.546 108.122 -86.157 91.647 42.030 126.368 -89.420 91.910 52.583 130.743 -96.309 89.338 55.897 129.009 -77.569 89.228 62.369 74.699 -92.902 92.120-175.287 129.702 -76.500 91.937 55.145 140.029-105.442 90.130 53.880 119.089 -24.193 90.625 58.542 147.681 -28.766 88.605 41.681 139.546-145.872 95.308 81.016 102.592 -79.806 92.504 0.000 129.161 -76.639 # 16 total E -1.54088E+02 rmsd from N 0.000 %NC 0.00 93.126 -65.053 128.035 -79.769 94.722 -46.017 114.390 -78.880 90.563 -47.741 102.899 -75.734 90.509 -44.919 129.935 -76.739 92.922 -42.056 141.782-118.187 95.798 -36.929 63.073 -67.914 92.908 -46.578 140.550-112.259 98.005 -36.361 172.959 153.044 93.113 -62.587 121.287-111.737 90.481 -98.789 87.279 -91.075 116.596 90.266 146.523 159.627 92.068 56.339 96.533-128.826 95.207 48.064 146.498 -48.954 94.323 -96.062 157.266-153.829 120.326-107.836 155.515 -18.326 93.823 45.916 138.858 120.588 90.310 46.930 137.339 -86.591 89.419 54.967 128.504 -88.602 91.397 51.679 95.088 -12.987 93.478 32.060 104.727 -79.378 92.839 50.203 0.000 0.000 94.246 44.657 99.486 -87.128 91.086 42.022 174.650-172.984 92.250 41.867 102.429-133.931 91.095 51.518 114.653 -80.570 89.807 51.450 143.368-119.071 91.192 47.886 140.865-151.182 93.866-115.465 105.223 -83.054 107.599 166.656 150.059 -15.112 133.231-100.037 110.292-105.107 88.606 66.246 112.154 -76.083 89.655 72.430 107.895 -47.410 91.777 44.801 106.618 -72.521 92.604 40.008 129.053 -76.111 93.527 40.057 102.216 -80.894 91.804 52.203 150.411 -32.877 87.565 48.474 154.510-147.225 90.032 41.449 128.131 -76.532 90.348 47.692 118.028 -38.834 89.830 46.997 130.087 -77.544 90.126 48.075 136.191-118.558 89.380 49.389 127.290 -40.528 89.347 54.929 137.348 -92.986 89.784 42.813 129.487-117.687 95.455 75.160 104.135 -80.552 92.527 0.000 128.958 -76.686 # 17 total E -1.47168E+02 rmsd from N 0.000 %NC 0.00 93.204 162.181 141.278-101.085 93.533 53.102 156.994 131.815 92.317 45.313 107.178 -80.439 90.895 49.157 129.701 -75.941 90.187 44.439 150.671-138.271 93.953 41.769 135.005-175.123 91.563 40.866 112.075 -68.585 94.546 44.585 130.917 -90.280 91.288 42.964 143.434-116.798 90.612 45.948 121.823-149.436 95.100 66.612 111.112-129.408 130.925 -55.415 111.500-105.374 92.244 72.713 103.327 -79.756 93.168 42.396 133.370 -79.800 91.679 47.864 134.308-125.259 92.078 43.863 130.924-111.708 97.115-128.090 111.436 -70.454 93.648 126.298 139.060-100.165 121.493 172.495 117.657 -39.175 104.779 112.584 139.634-164.082 96.768 44.907 0.000 0.000 90.027 55.031 121.643 -73.166 89.001 45.890 138.319 -84.867 88.926 46.624 118.726-123.585 89.326 48.578 106.340 -79.408 90.109 52.436 135.085 -87.441 91.287 44.235 132.819-130.200 94.948-122.871 145.774 -31.862 96.436 169.110 150.601 -15.615 103.907 -18.763 95.599-111.735 107.172 -57.970 116.334 -78.296 113.662-112.541 133.783 -27.769 91.332 55.398 110.492 -72.501 91.239 50.109 129.375 -76.268 90.077 42.979 133.154-116.764 91.250 44.985 130.629 -90.335 89.602 50.683 136.791-112.744 89.357 49.922 128.226 -77.098 90.500 75.092 101.291 -71.381 88.736 -88.158 128.890 -76.856 93.854 -53.162 139.823-106.531 90.665-117.021 108.798 35.485 95.548 -88.926 150.899 -34.074 93.518 -5.094 109.856 -81.798 110.368 37.208 100.558 -77.702 92.466 0.000 129.107 -76.453 # 18 total E -1.52662E+02 rmsd from N 0.000 %NC 0.00 93.183 -68.670 128.660 -81.527 94.280 -48.053 119.280 -80.229 90.716 -47.464 103.418 -77.190 90.247 -49.276 127.793 -75.540 90.361 -39.907 141.360-131.084 92.917 -44.274 63.870 -60.625 91.226 -37.124 129.243 -4.662 100.582 -41.270 167.903 131.108 97.254 -39.107 131.196-115.071 96.500 142.284 86.520 -80.892 92.849 68.516 141.465-119.197 93.669 46.377 93.986-116.380 97.651 98.621 105.251 -84.797 129.158-107.224 149.139 -88.039 111.567-105.145 140.392-148.641 94.408 46.476 148.190 147.618 91.802 46.161 134.134 -85.085 89.830 53.811 142.591 19.045 89.996 48.135 130.113 -36.457 90.931 41.838 146.589-155.197 91.033 46.141 0.000 0.000 90.330 50.927 146.930 -20.286 89.104 46.322 141.386 -88.880 90.637 46.346 120.397-129.993 88.299 59.522 111.007 -74.389 88.167 54.406 124.581 -58.007 91.400 38.416 139.697-125.391 94.479 50.225 152.385 -21.883 98.874 25.099 114.314 -87.822 138.352-165.313 105.490 -90.644 95.161 47.466 114.938 -77.017 92.454 45.756 100.183 -15.156 89.607 50.130 129.825 0.004 90.733 48.880 129.732 -77.470 88.449 43.308 101.903 -83.380 89.882 51.026 135.030 -42.345 89.201 49.754 136.221 -47.668 89.293 44.236 128.238 -76.296 90.965 71.821 115.041-106.570 88.588 -99.213 128.728 -77.025 93.823 -43.701 143.886-128.286 89.087 -53.660 117.859 -5.378 90.786 -51.161 146.402 -32.905 91.454 -38.889 144.065-135.059 99.651 113.434 104.481 -79.022 92.397 0.000 129.286 -75.639 # 19 total E -1.49605E+02 rmsd from N 0.000 %NC 0.00 93.353 175.528 139.390 -98.647 94.309 52.420 146.090 128.413 93.282 44.027 136.580 -22.270 91.973 45.632 130.583 -76.796 92.566 42.477 152.781-153.312 94.244 40.788 123.920 162.552 92.245 43.336 121.723 -34.319 92.023 43.673 134.336 -94.825 91.639 54.511 151.136-168.496 92.277 91.968 99.291-132.839 94.293 -55.402 132.755-128.399 98.675 -57.257 89.364 -97.056 85.793 -80.681 141.510 1.097 99.483 -83.512 156.855 -28.310 93.568-111.568 136.318-155.368 94.049 42.273 150.497 141.800 91.507 50.396 133.740 -87.402 89.741 57.261 155.250 -68.281 90.339 45.686 130.962 -43.538 95.118 29.221 108.745 -82.770 100.775 37.390 0.000 0.000 94.997 42.235 141.006 -25.443 90.964 49.336 148.448 -92.003 89.250 45.427 115.864-130.922 89.007 48.103 105.692 -73.743 90.779 48.602 140.306 -48.860 91.730 45.087 135.579-129.328 92.126 43.084 152.180 -21.507 96.467 142.741 108.804 -85.201 97.077 71.194 132.077-156.579 118.482 63.650 119.110 -80.979 93.210 -58.456 111.990 -55.541 91.954 -40.235 110.181 -72.561 90.545 -51.609 127.768 -75.452 88.913 -42.224 106.353 -90.214 89.198 -50.953 99.416 -66.616 87.430 -52.872 146.457 -29.233 90.058 -54.284 129.794 -76.658 91.724-133.683 118.477-129.651 90.803 52.665 132.167 -77.110 91.105 44.571 139.784-103.792 89.570 49.704 127.408 -18.944 90.593 65.346 140.954 -37.383 86.582 43.946 139.406-140.283 94.657 93.462 101.729 -79.160 92.416 0.000 129.168 -75.959 # 20 total E -1.50883E+02 rmsd from N 0.000 %NC 0.00 93.220 -70.964 127.364 -76.010 94.273 -49.883 121.951 -80.543 91.563 -47.039 101.061 -80.629 89.877 -51.716 127.753 -75.355 90.266 -38.714 143.300-130.539 94.015 -43.831 62.426 -59.629 90.832 -37.642 139.045-173.145 98.670 -42.981 168.113 104.333 95.813 -41.745 134.179-113.316 96.127 143.791 84.885 -81.927 93.859 65.126 142.106-113.939 93.431 48.128 98.115-120.299 96.993 98.976 104.656 -86.078 131.258-107.264 148.267 -87.675 110.295-107.272 140.004-148.448 94.551 45.976 146.218 152.866 91.763 46.903 134.004 -85.123 89.834 53.421 141.783 11.127 90.295 47.699 127.657 -38.868 90.775 42.229 147.284-156.274 91.126 45.994 0.000 0.000 90.236 50.608 140.280 -26.683 88.951 47.509 141.902 -90.777 89.902 46.707 120.286-131.038 88.357 54.911 108.642 -74.076 88.918 53.348 125.031 -55.899 91.540 38.040 138.739-125.868 94.789 50.299 152.426 -21.682 99.366 27.406 113.504 -87.125 139.472-165.733 105.034 -88.641 94.258 47.060 114.795 -76.875 92.181 46.262 100.794 -16.483 89.467 50.143 131.620 12.775 91.339 46.264 129.531 -77.439 88.693 42.654 101.898 -82.947 89.517 61.486 140.586 -36.915 87.629 54.064 137.618 -45.406 89.473 36.621 128.060 -76.321 91.406 59.598 117.359-109.237 91.884 129.868 128.575 -76.407 90.902 50.753 144.917-164.664 90.020 49.332 131.631 -46.671 90.555 57.906 142.630 -31.768 88.769 47.871 143.982-149.808 92.836 109.549 101.967 -80.661 92.644 0.000 128.528 -76.782 # 21 total E -1.51096E+02 rmsd from N 0.000 %NC 0.00 93.134 -73.194 125.425 -65.491 123.253-101.959 130.616 -38.770 93.686 42.043 110.027 -80.704 93.566 48.336 131.102 -77.308 95.087 40.174 152.580-145.304 92.340 44.353 63.664 -92.091 90.406 44.735 114.181 -55.275 90.139 49.598 131.736 -95.973 92.289 41.563 117.655-103.952 96.838 104.640 101.923 -96.020 127.258-123.453 154.173-119.307 93.630 51.691 96.011 -99.996 93.659 46.266 101.636 -75.891 92.743 48.224 143.767 -40.669 91.775 39.599 135.216-125.534 94.678 50.256 126.556-117.133 99.059 -67.927 121.838 -88.763 127.401-134.261 130.934 -58.488 123.002 5.892 136.593 21.107 97.144 53.570 157.436 -23.130 93.552 42.081 0.000 0.000 90.440 53.797 136.668 -18.621 88.866 53.846 143.137 -91.027 89.108 45.369 122.560-131.437 88.189 52.378 111.770 -73.549 89.389 48.897 137.296 -46.417 91.026 43.578 135.560 -85.446 92.094 46.243 142.675-127.071 96.846 -86.614 109.210 -84.119 126.132-125.111 102.673 -98.035 96.239 52.686 140.631-105.424 101.547 19.129 128.399-171.137 109.609 123.619 117.701 -75.427 99.645-113.440 129.391 -76.624 89.384 50.380 101.388 -80.805 90.481 49.275 123.013 -19.014 89.478 49.589 142.475 -35.021 88.795 43.726 128.283 -76.629 87.603 57.964 125.789 -59.962 89.370 48.046 126.519 -75.283 89.931 43.654 140.511-119.288 91.322 47.205 127.252 -38.679 90.733 51.528 138.148 -88.487 90.751 44.312 136.353-146.277 94.942 77.831 143.125-121.973 92.508 0.000 128.995 -76.572 # 22 total E -1.46859E+02 rmsd from N 0.000 %NC 0.00 93.057 -64.978 127.055 -70.780 125.491 -99.415 131.273 -40.385 93.814 38.930 139.801 -56.400 94.209 49.957 130.529 -77.146 94.424 41.124 154.855-151.191 93.036 44.109 68.917-101.510 89.154 46.790 114.505 -65.459 89.397 60.486 135.274-104.037 86.020 53.918 142.050-166.115 88.591 172.092 80.458 -92.297 95.002 71.691 146.126-146.301 94.000 49.414 91.849-119.479 92.914 60.178 111.341 -87.568 96.335-126.844 142.628-114.799 126.173 -96.168 146.336-167.274 95.003 48.024 151.964-134.934 91.582 45.326 135.280 -80.935 89.582 59.981 138.228 -57.793 89.161 50.845 129.898-109.029 90.659 40.999 135.770-179.083 88.239 56.351 0.000 0.000 87.949 62.799 98.175 -82.243 87.893 47.186 133.748 -64.429 90.346 42.290 121.671-117.848 90.551 50.302 109.030 -75.305 90.722 48.758 132.688 -86.654 92.229 44.541 138.264-147.824 93.680 33.236 152.804 -21.933 109.519 46.919 112.547 -82.739 140.922-175.956 104.705 -87.186 93.494 47.193 114.561 -76.787 91.625 48.946 97.301 -19.142 89.410 51.537 121.184 9.027 90.031 46.740 129.468 -76.968 89.255 43.877 102.117 -83.739 89.869 50.481 132.313 -36.304 91.062 44.722 139.935 -54.231 91.349 40.709 128.551 -76.790 92.879 60.357 113.039 -92.889 92.712 -99.245 128.569 -76.526 112.317 -45.389 156.313-162.200 96.336 -26.293 120.998 9.773 112.845 117.834 147.209 -9.340 89.773 17.901 104.674 -82.441 107.011 -34.986 149.011 -22.236 119.226 0.000 144.648 -77.250 # 23 total E -1.48285E+02 rmsd from N 0.000 %NC 0.00 92.642 133.218 131.441 -67.039 93.739 50.520 122.818 -27.843 92.246 45.994 105.191 -82.299 92.662 47.348 127.855 -75.964 90.346 52.161 109.389 -60.986 94.064 36.259 82.322 -70.694 93.313 37.270 118.671 -59.476 110.650 15.509 94.959 -81.581 95.132 46.710 143.061 -45.928 93.247 34.872 100.394 -97.302 95.144 51.942 134.852-110.420 105.889 0.850 91.928-101.795 99.135 61.604 114.608 -84.452 91.881 95.452 117.857-102.634 89.825 43.550 134.760-142.015 93.504 59.611 134.085 -99.981 97.189 -46.053 124.924 -70.162 125.306-164.488 145.332 -72.166 107.576 35.795 117.760 96.627 93.878 51.797 149.839 -29.421 94.234 43.121 0.000 0.000 94.502 41.542 160.801 178.143 94.089 43.314 161.864 158.980 90.433 46.148 119.258 -70.014 90.963 46.989 112.607 -80.261 91.138 49.973 154.844-126.991 92.342 47.023 137.781-159.291 95.283-111.227 147.754 -29.203 97.586-165.629 151.630 -19.378 106.003 -39.163 93.664-104.172 104.830 -29.501 113.505 -78.243 95.281 -41.559 114.024 -55.066 95.598 -41.884 113.186 -74.171 92.121 -44.801 128.352 -76.980 90.372 -41.895 101.149 -81.462 88.122 -51.624 123.366 -12.919 90.948 -49.842 150.997 -15.926 89.507 -51.337 128.744 -76.598 92.195-135.773 136.845 22.116 90.399 55.026 132.177 -77.006 90.260 45.518 142.069-110.743 90.078 46.150 129.031 -37.835 90.748 55.326 140.209 -45.992 89.169 44.036 140.242-133.906 94.419 84.133 103.586 -80.194 92.555 0.000 128.816 -76.766 # 24 total E -1.47127E+02 rmsd from N 0.000 %NC 0.00 122.617 -92.534 150.885 -74.522 94.978 -47.334 113.705 -76.175 90.970 -46.295 141.337 -34.054 90.741 -47.336 130.477 -76.807 93.191 -39.745 140.359-123.590 94.307 -43.536 62.981 -59.920 88.110 -44.386 134.130 36.834 101.449 -68.584 159.317-169.231 90.818 -48.138 124.175 -97.815 91.511 113.483 91.721 -73.660 88.134 79.188 150.828-103.085 95.669 35.534 91.372-116.431 95.250 53.743 109.072 -85.701 95.384 10.281 134.566 -97.666 121.070 175.128 106.961 -88.190 98.575 40.588 147.140 154.538 94.591 43.816 136.205 -85.612 90.712 51.612 133.160 -59.955 90.706 55.041 115.993 -36.530 89.737 43.057 151.379 -15.980 90.079 46.104 0.000 0.000 89.770 56.496 109.955 -87.903 87.489 50.275 142.985 -77.214 88.950 44.509 121.721-129.035 88.945 51.423 111.681 -76.582 89.778 52.828 140.497-102.752 91.056 46.681 134.607-144.059 93.795-107.370 149.137 -31.390 104.108-167.335 154.191-133.566 103.527 -53.763 95.183-102.072 105.240 -27.767 112.751 -78.314 94.003 -44.373 112.087 -50.337 92.079 -47.224 109.517 -75.991 90.444 -47.682 127.554 -75.575 88.688 -46.619 136.326-142.202 91.414 -44.213 137.566 -34.725 91.962 142.211 158.508 145.513 89.741 57.691 119.354-115.672 93.336 87.615 96.125 -63.470 90.237 -74.190 130.356 -77.329 94.194 -44.586 150.017-162.239 90.954 -55.599 132.526 -32.635 95.717-114.819 146.288-172.788 94.852 -18.673 133.655-147.772 100.625 96.453 101.985 -78.996 122.395 0.000 146.363 -88.926 # 25 total E -1.49166E+02 rmsd from N 0.000 %NC 0.00 93.205 -74.858 127.514 -73.744 122.632-100.715 130.268 -28.804 93.848 41.709 110.560 -79.004 94.327 47.453 130.649 -77.143 94.160 40.362 144.470-122.399 92.356 44.995 66.859 -91.997 90.971 43.077 120.732 -66.090 90.060 47.094 134.754-113.774 87.805 53.977 128.646-131.169 87.566 57.030 79.586 -98.083 89.087-175.535 131.660 -74.916 95.305 78.170 130.257-155.667 91.646 48.134 107.219 -82.753 93.207 40.620 138.522 -41.064 93.353 48.463 113.738 -94.623 91.618 42.357 129.518-115.355 95.144-145.168 116.700 -78.516 120.759-162.752 124.409 78.159 97.024 -44.331 111.458 -84.584 92.654 -47.238 103.928 -82.265 90.852 -43.565 0.000 0.000 90.426 -48.035 133.103-107.228 89.909 -49.066 123.080 -91.006 90.921 -42.111 125.915-131.957 90.544 -45.521 116.560 -74.529 91.054 -58.475 138.923-119.698 88.399 -51.749 148.180-132.928 90.470 -44.189 106.774 -87.245 96.749 177.262 151.995-160.854 134.277 -15.926 110.193-104.710 108.550 -24.167 113.949 -79.044 91.586 -53.018 112.012 -52.435 89.739 -54.851 111.952 -78.537 89.368 -52.752 128.295 -76.203 88.172 -46.557 104.083 -86.191 88.989 -58.613 124.597 -2.590 95.467-127.846 146.038 -19.808 90.037 50.003 128.446 -75.876 91.278 53.485 132.500 -98.727 89.449 49.721 131.026 -76.461 91.727 36.757 146.785 -97.363 94.891 55.163 126.277 -39.735 94.579 -39.593 135.351 -91.631 126.573 -76.993 106.788 -85.079 99.978 157.959 147.279 -19.862 92.765 0.000 128.883 -76.532 # 26 total E -1.48440E+02 rmsd from N 0.000 %NC 0.00 93.071 152.007 141.804 -99.324 93.180 51.737 154.963 65.619 91.174 49.141 106.746 -81.769 91.446 54.907 130.178 -76.351 92.035 41.363 152.205-149.916 92.080 43.565 74.549-103.128 90.460 46.661 113.446 -82.404 88.636 60.265 138.979 -94.076 86.466 46.875 127.011-124.317 93.538 176.059 74.829 -89.875 94.998 69.470 160.876-138.436 95.676 45.976 92.136-119.833 94.152 36.709 106.137 -82.668 103.753 137.279 131.013 -73.364 111.247 17.419 145.086-167.457 95.606 47.763 137.648-103.568 94.623 39.881 118.684 -64.299 92.349 51.879 103.539 -0.486 90.562 42.077 140.299-164.531 96.487 35.874 107.979 -82.818 101.921 29.668 0.000 0.000 95.753 44.045 158.964 176.404 93.608 42.095 126.344-113.864 91.060 46.362 114.851-121.380 88.063 59.422 115.118 -78.150 88.947 54.387 138.059-105.982 90.219 39.474 133.343-152.628 97.314 -98.025 149.910 -26.545 115.472-169.945 152.470 -16.037 103.960 -45.777 98.976 -94.544 100.302 -35.427 113.065 -77.337 93.079 -44.033 110.118 -56.245 90.771 -52.402 107.826 -74.688 90.082 -44.063 129.793 -77.338 89.581 -47.501 102.454 -78.810 89.881 -93.462 114.325 -50.919 88.018 -54.348 151.994-102.858 91.029 -42.822 128.770 -76.862 96.465-131.351 112.950 -48.344 92.451 46.426 130.636 -76.652 91.642 50.884 142.406-116.643 90.979 58.314 121.640 -20.699 92.948-116.202 129.881 -66.876 97.374 -26.899 124.988-116.320 112.664 -7.976 102.854 -76.136 92.434 0.000 129.152 -76.021 # 27 total E -1.47436E+02 rmsd from N 0.000 %NC 0.00 93.235 -69.011 128.560 -80.820 94.837 -45.019 106.858 -74.953 92.828 -43.776 103.101 -73.351 93.807 -29.480 132.996 -78.207 108.012 -25.085 144.473-123.256 103.724 -37.702 61.849 -72.784 91.968 -32.423 121.569 -43.803 106.740 -39.533 162.427-177.743 91.635 -70.866 126.818-105.680 91.243-132.992 87.857 -89.869 103.921 79.968 154.320-175.019 93.514 57.796 95.956-127.131 94.654 57.419 108.929 -79.110 94.132 -96.260 154.410-112.753 115.805-103.099 140.445-155.135 92.226 49.605 140.320 144.629 90.940 46.670 133.049 -86.877 88.910 55.726 143.817 10.922 89.199 48.132 95.442 -34.535 90.093 41.516 108.657 -77.777 91.893 46.666 0.000 0.000 91.136 44.175 133.848 -34.268 91.663 43.586 140.714 -86.767 90.983 45.682 120.629-125.821 89.965 47.192 105.576 -74.141 91.832 49.796 143.237 -38.609 91.060 42.265 135.388-142.892 92.948 50.112 151.505 -20.348 97.531 165.087 111.603 -80.603 92.409 132.889 98.995-125.921 99.951 -36.590 112.036 -79.499 91.803 -51.855 114.210 -53.737 90.196 -45.581 115.238 -72.853 93.638 -41.986 126.848 -75.374 93.853 -36.260 99.775 -81.675 92.143 -42.314 126.763 -6.835 94.662 -52.171 153.188 -25.756 90.404 -46.627 129.299 -77.156 91.126-131.072 121.621-102.514 91.122 55.707 132.590 -77.915 92.154 46.175 140.421-108.194 91.759 41.064 122.969 -14.741 92.364 67.048 150.354 -25.003 87.797 53.455 134.884-141.882 92.998 107.010 101.429 -79.683 92.481 0.000 128.810 -76.446 # 28 total E -1.48205E+02 rmsd from N 0.000 %NC 0.00 93.190 -78.012 125.631 -68.253 118.606 -99.239 144.703 -18.038 96.459 37.982 103.649 -79.728 92.919 53.158 132.077 -77.665 92.715 42.295 140.167-124.867 91.751 41.138 62.134 -82.529 91.633 43.615 167.078 168.419 92.888 40.353 138.157 -93.039 91.894 44.406 132.679-117.247 89.397 51.886 90.230-104.379 90.801 168.465 136.996-107.480 87.642 71.782 107.594-159.146 90.388 46.599 97.211 -82.293 91.650 50.745 141.405 -36.130 91.526 39.496 136.356-113.843 93.492 48.201 126.605-123.598 93.382 40.634 125.996 -90.308 96.166-108.779 150.962-176.966 115.527 -86.163 88.678 -96.121 89.460 89.064 152.189 -20.415 89.905 60.510 0.000 0.000 90.279 47.016 104.416 -75.610 89.893 47.660 148.513 -62.942 90.426 41.821 121.601-127.461 90.094 47.514 112.220 -76.748 90.277 48.913 145.201-108.353 91.273 44.284 133.758 -88.950 90.939 42.935 112.423 -88.638 95.016 95.849 113.426 -79.448 93.470 77.209 103.252-116.832 92.216 -57.668 113.386 -78.826 109.565 161.611 116.687 54.375 104.376 -36.206 112.293 -77.162 94.155 -43.783 126.816 -75.259 92.575 -38.375 101.203 -79.727 91.786 -49.288 147.854 -34.723 90.463 -44.369 141.950 -90.635 91.541 -41.462 128.403 -76.620 88.871 -52.407 122.746 -13.219 90.202 -56.276 128.399 -76.287 89.955 -37.937 145.051-136.278 91.311 -46.065 124.414 -17.427 91.721 -61.445 150.994 -24.135 89.630 -51.698 140.188-165.883 94.384 75.609 100.637 -80.100 92.497 0.000 129.042 -76.525 # 29 total E -1.47795E+02 rmsd from N 0.000 %NC 0.00 92.498 125.623 124.286 -50.351 94.912 46.458 145.041 -0.857 92.897 45.763 108.213 -80.397 91.576 47.658 127.996 -75.145 91.055 43.769 118.544 -29.109 92.289 42.425 96.536 -69.520 92.962 40.256 112.232 -72.186 101.301 19.246 107.212 -79.077 100.455 39.407 149.317 -27.512 94.910 30.244 116.172-117.044 102.152 34.824 122.506-127.485 100.288 30.391 84.971 -91.091 93.645 54.914 147.406 -32.282 91.201 50.326 118.920-113.540 91.001 38.029 130.062-136.034 93.176 49.863 130.368-110.455 93.809 103.272 120.735 -74.949 90.980 51.614 144.070-145.207 93.255 46.176 137.911-118.950 103.118 -83.465 109.811 -79.921 113.955-138.694 0.000 0.000 97.207 45.479 112.795 -85.787 93.018 47.160 172.715-175.292 93.372 37.910 103.218-133.008 92.004 51.282 113.834 -78.351 90.270 60.950 151.510-122.023 89.941 43.064 145.350-126.047 93.599 41.564 152.523 -21.964 100.444 -8.094 119.407 -87.237 137.276-159.675 105.796 -92.258 96.052 48.772 114.870 -77.098 92.205 50.470 112.581 -9.689 88.768 51.770 120.355 -5.745 90.869 49.441 130.080 -77.034 91.145 39.557 102.313 -83.437 91.000 44.871 122.427 -45.915 92.503 70.727 136.829 -41.804 87.697 54.236 130.697 -78.350 88.776 176.538 73.672 -82.513 91.997 64.667 134.044 -78.759 89.692 50.827 141.355-104.563 90.539 52.083 117.066 -23.275 93.143-132.895 136.119 -54.988 97.597 29.088 134.204-135.933 120.590 31.369 106.386 -77.472 92.375 0.000 128.813 -75.936 # 30 total E -1.52042E+02 rmsd from N 0.000 %NC 0.00 93.117 -69.733 126.158 -68.490 122.677-102.426 129.885 -44.193 93.026 42.803 109.461 -80.616 93.532 48.392 131.209 -78.055 94.701 42.603 157.447-150.436 93.740 44.295 65.991 -97.513 89.000 47.453 122.145 -64.488 88.880 64.529 125.589-113.708 86.340 57.960 128.810-126.645 86.244 171.887 82.625 -90.465 93.589 78.220 153.522-162.571 94.088 39.578 91.278-120.832 95.354 42.146 109.699 -87.784 93.970 44.441 143.024-112.211 91.707 52.897 138.019-166.131 90.962 62.502 121.144-127.360 92.586 -77.354 130.570 -98.596 122.940-124.184 136.799 -55.768 93.390 41.197 146.359 -6.614 94.631 44.970 142.489-172.507 89.795 45.248 0.000 0.000 90.647 50.888 99.907 -85.432 87.679 48.045 152.642 -77.992 90.544 42.356 117.989-131.949 90.137 46.962 110.700 -77.083 88.822 62.353 147.765-106.978 89.756 47.526 145.519-128.174 91.207 41.003 152.213 -22.524 98.779 -9.076 117.168 -87.279 137.329-154.506 104.134 -89.664 94.233 50.293 114.173 -76.576 91.995 51.379 97.448 -51.847 90.415 53.840 121.443 0.364 92.366 42.174 128.894 -76.850 88.884 44.698 114.313 -92.590 91.613 48.727 134.088-117.778 90.682 60.249 139.802 -20.765 87.912 45.164 130.625 -78.251 93.319 178.900 75.917 -85.207 92.508 62.341 165.669 -89.559 91.786 44.895 140.548-104.665 90.069 51.868 122.643 -23.236 91.166 71.927 145.589 -40.820 86.677 47.996 140.522-160.338 94.889 93.774 101.467 -79.266 92.448 0.000 129.051 -76.129 # 31 total E -1.48156E+02 rmsd from N 0.000 %NC 0.00 92.640 73.493 136.518 -90.662 95.201 49.117 141.322 -10.309 97.312 39.111 105.372 -81.940 94.150 43.714 128.781 -75.966 91.687 49.072 106.176 -80.521 90.872 44.184 78.332 -67.300 88.332 52.175 124.161 -52.657 92.192 39.165 108.006-104.267 91.027 51.775 154.553-144.187 88.514 70.989 86.795-114.475 90.447-156.878 128.800-102.902 92.798 76.749 99.644-128.678 91.298 51.913 103.299 -82.282 94.255 124.027 133.349 -42.824 117.911 3.324 151.841-167.396 98.412 42.842 143.643-115.821 97.416 34.025 128.347 -77.973 92.671 55.044 140.743 98.699 89.362 47.777 136.709 -29.457 90.208 42.867 142.756-158.901 91.114 45.328 0.000 0.000 90.049 49.292 110.727 -82.674 90.573 46.601 140.971 -78.194 91.644 39.982 121.108-125.178 90.678 48.671 111.926 -77.500 90.812 55.053 132.500 -94.416 90.891 48.615 140.661-130.245 92.295 25.233 142.144-130.534 110.744 8.819 152.114-124.440 131.619-169.053 116.148-114.827 95.763 62.540 128.451 148.600 91.358 49.901 109.123 -28.274 89.152 54.118 117.999 -74.268 90.219 48.438 129.130 -75.884 88.765 45.040 102.736 -84.155 90.164 46.856 113.449 -65.256 90.587 59.808 133.098 -52.984 88.631 52.007 128.924 -76.980 91.799-179.506 75.549 -79.653 90.536 66.322 133.584 -77.903 89.685 47.013 140.861-101.539 88.802 51.363 125.515 -24.531 89.766 62.146 146.241 -39.413 87.612 44.711 142.707-162.089 94.180 92.887 102.960 -79.754 92.488 0.000 128.959 -76.457 # 32 total E -1.48136E+02 rmsd from N 0.000 %NC 0.00 122.602 -97.700 151.236 -81.482 94.578 -47.469 113.098 -76.041 91.158 -46.345 140.287 -32.425 90.962 -45.948 130.393 -76.614 92.921 -40.615 140.336-132.491 94.084 -42.869 61.469 -58.601 90.019 -42.026 130.731 30.154 99.578 -49.225 166.487 172.682 90.135 -52.446 123.129-118.273 94.093-102.868 80.503 -82.597 119.505 64.400 146.243-150.294 96.446 61.205 94.511-118.894 94.208 83.089 106.062 -81.834 93.444 -85.456 123.103 -89.981 96.313-119.336 108.717 -85.195 93.710 47.233 147.210 125.059 94.883 43.924 136.288 -84.017 92.405 41.969 120.032 -32.419 92.394 55.849 114.716 117.822 91.590 46.283 109.292 -84.090 94.915 32.764 0.000 0.000 91.157 57.415 151.509 173.855 89.416 54.384 119.958-106.526 90.239 41.010 121.569-122.883 89.737 49.722 117.822 -76.190 90.526 51.070 134.024-106.067 91.550 50.675 130.338-144.002 92.789-102.636 151.368 -32.468 108.974 164.545 113.306 -75.900 107.374-168.566 91.467 -96.333 92.666 51.397 115.129 -76.925 91.196 51.317 102.342 -15.834 90.015 49.289 118.959 -14.356 89.982 45.116 130.277 -76.877 90.270 47.189 103.247 -84.525 89.371 51.227 118.470 -31.614 89.757 49.471 130.024 -60.828 89.584 43.897 129.645 -77.030 91.301 106.327 112.887-106.009 91.949-156.544 129.492 -78.142 93.618 50.916 140.328-108.525 92.369 43.352 127.452 -28.077 92.297 54.147 152.645 -21.836 89.960 43.099 135.024-143.195 95.201 114.875 103.368 -80.475 123.773 0.000 144.945 -90.920 # 33 total E -1.48477E+02 rmsd from N 0.000 %NC 0.00 92.700 -21.100 128.450 -83.363 95.039 -50.812 112.968 -74.164 92.483 -42.803 103.821 -77.700 91.355 -45.437 129.765 -76.154 92.270 -40.870 139.857-128.335 93.206 -43.132 60.031 -58.204 91.134 -40.723 134.643 27.605 99.423 -40.118 164.406 178.525 90.001 -57.335 126.939-124.058 88.413 -90.387 137.745 -4.398 89.579 109.441 146.693-166.779 98.594 37.094 86.338-112.656 95.461 47.909 138.849-126.270 94.468 43.015 135.758-127.773 96.018 95.318 129.315-165.911 91.296 -74.568 108.678-134.292 96.037 -54.219 136.077 -87.855 95.171-152.667 163.243-158.877 118.863 -13.843 85.136-114.021 95.828 -45.801 103.325 -82.761 93.246 -40.663 0.000 0.000 92.419 -48.567 140.141-112.875 91.232 -44.953 122.303-100.125 91.206 -43.561 116.972-126.908 91.779 -46.421 127.191 -37.574 94.589 -39.853 153.056 -99.152 96.666 -35.762 124.663-145.898 98.458 -64.991 145.391-128.707 118.846-160.155 157.281 -11.056 98.749-135.012 95.669 -93.740 95.854 41.484 114.486 -77.146 92.093 49.726 99.899 -6.896 92.577 43.980 118.271 23.200 89.953 49.963 131.138 -77.841 89.389 45.337 103.652 -85.377 89.427 46.561 120.871 -20.847 90.174 48.502 137.474 -49.408 90.135 42.688 128.311 -76.651 91.250 84.883 114.856-101.869 89.116 -75.801 129.257 -77.155 95.020 -60.927 144.123-152.370 92.628 -38.471 113.737 23.038 95.812 113.060 141.651 -38.802 96.177 20.093 142.009-158.682 99.853 36.580 140.731 -28.739 92.467 0.000 129.405 -76.449 # 34 total E -1.48686E+02 rmsd from N 0.000 %NC 0.00 117.245 147.185 153.098-103.611 93.720 56.312 140.494 43.683 92.391 43.870 106.582 -82.815 91.659 50.809 130.768 -76.600 92.830 42.041 151.636-143.512 92.030 42.396 61.398 -74.229 91.568 44.537 120.453 -39.773 90.604 46.382 139.456 -96.619 88.918 45.816 137.769-125.280 89.580 42.630 78.714-100.188 92.426 49.212 141.536 -84.768 97.769 30.125 98.216-103.971 93.128 51.525 135.719-124.126 94.884 23.979 107.000-114.852 112.035-174.945 138.942-133.588 93.801 51.500 130.933 133.576 90.658 51.062 133.920 -87.918 89.086 60.952 140.542 -57.945 89.053 50.150 135.341 -28.586 88.909 43.565 109.050 -82.480 91.438 46.136 0.000 0.000 89.812 49.812 114.111 -77.405 89.208 45.101 143.489 -79.589 90.039 43.677 120.724-128.246 89.714 48.106 108.235 -76.065 90.015 50.321 135.116 -83.919 90.504 40.883 136.714-139.962 92.348 51.592 114.877 -88.578 94.927 -77.755 111.825 -84.018 125.913-109.699 109.917-108.003 91.516 67.009 125.590 136.718 91.617 84.748 121.029 -92.583 96.019 5.629 112.527 -76.410 96.812 -97.520 129.706 -76.115 90.355 -46.735 97.948 -80.115 88.474 -49.126 119.724 2.621 94.502 -36.373 150.827 -13.784 95.216 -52.708 127.680 -75.629 94.053-114.906 119.271-107.785 91.178 53.824 130.281 -77.064 91.968 56.226 141.084-107.558 90.990 47.022 117.270 -16.272 93.991-131.048 144.696 -37.230 97.051 27.491 108.877 -84.988 119.041 101.060 102.561 -72.239 92.667 0.000 129.457 -76.806 # 35 total E -1.47998E+02 rmsd from N 0.000 %NC 0.00 121.005 104.001 143.014 -28.941 93.101 57.682 148.186 23.317 94.637 40.120 106.970 -82.602 92.794 50.345 129.253 -75.156 91.852 41.134 143.434 -26.973 88.768 55.065 65.797 -73.958 87.785 54.408 111.129 -49.233 88.805 43.917 132.449 -86.751 89.425 46.261 143.757-130.445 89.869 55.876 78.771-102.461 90.300 132.938 134.691 -82.121 93.228 76.095 127.608-151.615 92.225-164.738 103.299 -86.938 139.517-150.467 153.859-160.182 108.789-118.491 153.180 -30.552 93.764 46.990 141.101-106.348 92.351 48.517 136.839 -72.803 91.385 45.484 118.958 -27.773 93.437 43.267 128.755 114.108 94.967 37.223 146.818 -45.598 97.211 43.225 0.000 0.000 94.092 42.906 156.693 -1.913 91.667 48.095 175.314-178.469 91.325 44.663 110.091-139.703 90.437 45.731 108.131 -73.916 90.702 54.617 148.220 -45.903 89.714 47.148 143.252-119.502 90.171 51.849 112.963 -89.481 93.757 29.746 139.638 -96.726 121.393 146.555 117.276-119.933 94.648 44.710 131.702-159.311 96.004 96.723 134.365-102.514 87.529 -70.264 112.356 -72.754 91.246 -48.146 126.452 -75.057 88.164 -44.291 105.458 -81.760 89.505 -53.307 115.970 -68.180 87.150 -47.539 138.555 -56.514 90.067 -46.021 127.564 -75.351 88.624 -48.923 112.066 -50.413 89.652 -48.815 130.225 -77.538 89.601 -46.057 139.311-133.030 86.515 -58.394 129.513 -26.887 88.020 -59.270 149.719 -13.532 89.264 -47.871 137.613-105.960 95.169 86.116 103.915 -79.480 92.471 0.000 129.096 -76.249 # 36 total E -1.48351E+02 rmsd from N 0.000 %NC 0.00 93.381-175.704 137.008 -91.304 93.540 60.324 152.240 10.100 94.056 40.598 106.075 -82.382 92.124 53.518 131.981 -76.728 91.587 42.277 139.652-118.128 90.411 43.751 70.532 -83.573 91.981 42.530 114.244 -62.310 91.222 45.211 140.708 -94.781 89.573 51.874 140.774-148.440 88.390-177.182 83.049 -91.389 94.298 84.320 143.733-164.996 94.173 49.951 91.976-124.713 95.832 63.004 107.988 -86.184 94.453 -78.033 151.669-115.351 111.311-112.401 141.129-158.432 94.476 43.160 146.263-125.090 93.653 47.058 135.938 -78.669 91.613 44.124 126.936 -63.760 92.700 50.774 96.755 -97.982 90.802 40.577 134.013-166.422 92.942 46.432 0.000 0.000 105.494 10.120 104.702 -84.209 102.465 45.278 173.636-147.170 101.530 25.328 118.623-150.985 98.065 97.820 121.297 -79.628 92.966 -55.060 141.519-137.675 97.414 -66.054 135.498-120.185 93.497 -9.072 151.619 -22.131 111.234-131.066 157.142 -19.539 98.995 -43.751 97.234 -96.070 91.249 -48.506 111.296 -73.680 92.347 -66.595 117.147 -42.446 91.328 105.669 108.522 -70.021 93.027 44.308 129.707 -77.332 90.634 48.397 140.755-134.476 90.384 47.842 117.674 -31.663 92.092 42.069 133.901 -65.101 93.325 41.752 128.499 -76.695 94.110 61.834 105.779 -84.423 96.963 178.899 129.228 -77.186 91.611 54.138 140.346-107.450 90.800 57.804 129.126 -37.116 88.862 77.198 144.784 -33.842 88.526 53.221 132.700-133.628 93.318 109.500 142.011-120.418 92.496 0.000 128.939 -76.194 # 37 total E -1.49049E+02 rmsd from N 0.000 %NC 0.00 93.399-166.221 134.674 -83.652 93.181 61.078 151.220 18.740 95.303 39.806 106.340 -81.984 92.829 47.441 131.732 -77.119 93.656 42.959 134.722-111.647 91.697 44.110 61.133 -77.056 91.097 43.376 126.932 -50.325 90.401 46.183 131.370-113.837 87.968 53.458 129.491-132.984 87.883 62.439 80.285 -98.898 88.286-170.222 133.181 -79.207 95.514 75.139 127.963-152.237 91.824 48.553 106.760 -85.734 92.709 41.624 139.917 -39.219 93.143 48.735 110.218 -92.822 91.471 41.742 130.325-114.298 95.483-148.829 117.097 -79.953 116.161-160.393 125.529 75.319 97.559 -44.324 109.959 -84.234 92.554 -47.671 104.000 -82.154 91.125 -43.058 0.000 0.000 90.802 -47.729 132.822-108.351 90.007 -49.541 123.691 -90.051 91.044 -43.212 124.806-128.810 91.153 -41.947 118.355 -73.468 92.766 -58.446 144.093-132.804 89.604 -58.237 149.085-126.141 90.810 -33.593 109.832 -89.095 101.650 179.067 149.773-130.131 134.352 -34.881 110.716-104.952 110.605 -20.244 114.197 -79.433 92.025 -53.794 111.457 -52.504 89.772 -52.872 112.753 -78.754 89.568 -54.085 127.946 -76.119 87.831 -45.515 105.063 -86.513 89.079 -56.423 124.969 -1.949 95.985-128.071 145.681 -18.936 89.625 50.195 128.485 -75.860 91.061 54.054 133.926 -94.784 89.336 49.128 131.075 -76.524 92.053 36.058 148.697-107.118 95.070 55.197 126.629 -41.173 94.617 -36.351 134.182 -93.123 127.247 -78.220 106.509 -84.989 97.643 158.338 147.239 -20.992 92.806 0.000 128.565 -76.724 # 38 total E -1.48635E+02 rmsd from N 0.000 %NC 0.00 93.055 157.580 139.066 -91.589 93.443 54.655 151.075 119.102 92.541 46.383 143.598 -25.053 91.295 46.716 129.956 -75.965 91.874 42.985 155.174-152.537 93.289 41.833 122.739 163.619 92.141 42.868 117.799 -46.104 92.954 41.669 135.178 -96.465 93.923 52.442 149.763-174.078 92.171 86.684 103.789-132.056 96.366 -56.669 127.359-129.511 99.442 -60.680 89.051 -97.451 85.486 -84.580 146.253 -8.332 100.310 -78.720 157.607 -28.495 95.542-110.385 138.542-160.665 94.107 43.210 154.378 160.785 92.223 47.985 133.307 -85.505 89.888 51.936 159.417 -39.753 91.805 45.930 129.564 -49.064 94.928 29.544 108.821 -82.735 100.357 36.063 0.000 0.000 95.749 43.662 140.480 -18.133 90.496 48.217 145.696 -93.066 88.790 46.344 115.414-128.691 89.275 49.103 107.622 -72.483 91.095 47.844 142.447 -48.993 92.954 34.495 132.216-125.771 97.997 79.395 151.835 -21.960 143.352 172.025 116.329 -79.857 94.348 132.922 96.110-109.223 94.600 -46.484 111.556 -78.596 91.599 -50.696 113.076 -57.565 92.054 -39.986 111.402 -70.702 94.151 -41.532 128.163 -76.129 93.260 -38.043 105.089 -87.554 89.995 -55.138 102.315 -63.285 87.420 -54.380 151.128 -32.026 89.623 -51.047 128.119 -75.918 92.445-132.039 123.730-128.592 90.540 56.269 132.205 -76.545 91.292 44.143 140.081-105.115 90.704 44.135 124.657 -21.097 91.482 64.771 147.983 -30.532 87.180 51.888 140.274-155.544 91.751 119.743 100.898 -79.485 92.578 0.000 128.720 -76.469 # 39 total E -1.46971E+02 rmsd from N 0.000 %NC 0.00 92.733 -22.273 130.685 -84.518 124.837-114.074 132.495 -55.260 94.766 40.720 107.676 -79.537 92.133 49.933 129.456 -75.198 93.645 37.720 160.605 -9.341 93.541 47.740 143.336 127.819 89.478 48.005 115.131 -63.064 91.347 45.422 126.969-100.091 89.293 62.719 151.469 169.509 87.003-176.612 74.593 -93.860 91.750 79.840 150.386-151.065 94.352 42.881 90.799-119.998 92.200 45.429 108.350 -84.551 91.648 49.570 145.716-103.658 90.164 49.506 128.371-135.924 91.266 38.900 125.145-118.733 96.355-133.456 117.143 -68.399 126.082 157.133 116.721 56.497 99.027-174.471 126.915-138.446 96.078 47.898 153.624 -36.480 92.741 48.825 0.000 0.000 91.394 43.675 140.190 -24.848 90.398 52.619 142.415 -91.404 89.181 52.177 126.397-135.509 88.759 43.666 109.024 -75.036 92.271 48.297 135.702 -87.104 92.331 48.656 134.713-152.484 93.726 -97.652 149.357 -31.779 116.411 171.000 161.538-151.117 125.199 -87.887 110.265-110.237 90.701-143.299 108.582 -73.567 95.163 36.079 141.903-135.541 102.718 41.039 115.573 -75.926 104.688 22.395 129.977 -76.831 94.760 48.027 113.245 -83.661 91.675 49.619 134.515-102.043 90.249 44.768 149.385-175.545 91.500 36.672 127.933 -76.236 92.613 49.654 108.269 -92.510 90.845 45.143 130.476 -77.878 90.852 47.990 140.122-124.809 91.147 58.001 129.710 -43.352 90.937-121.679 130.343 -66.496 96.971 1.539 106.920 -84.877 120.573-138.672 148.797 -16.800 92.944 0.000 129.554 -76.297 # 40 total E -1.46822E+02 rmsd from N 0.000 %NC 0.00 93.216 -70.372 128.417 -79.761 93.992 -49.756 111.652 -75.425 91.591 -43.390 103.335 -76.145 92.694 -41.755 130.407 -76.809 97.691 -26.561 143.512-132.834 103.786 -37.038 57.552 -76.800 94.473 -26.972 124.553 -40.610 109.731 -30.010 169.322-131.728 96.225 -66.493 127.114-108.995 94.002-154.931 82.822 -81.699 107.244 68.513 153.095-141.466 97.772 46.152 90.759-117.903 96.515 75.234 114.788 -81.979 92.014 -77.515 147.451-110.983 107.929-116.193 140.174-153.588 92.948 44.160 141.205-113.368 92.577 48.100 135.488 -76.667 90.757 47.486 126.980 -45.877 91.029 47.503 100.060 -94.193 89.356 46.830 135.081-166.995 89.996 47.898 0.000 0.000 89.572 48.245 109.467 -76.259 90.673 43.958 134.290 -70.746 91.474 41.796 124.455-119.628 92.176 44.841 110.182 -76.681 92.935 41.952 141.989 -93.093 95.092 44.081 133.575-151.363 96.361 17.192 153.810 -20.715 114.025 120.248 111.023 -79.950 133.403-128.516 115.853-110.634 98.930 -26.693 112.073 -78.798 95.318-121.130 119.860 -17.077 93.215 47.507 132.192 -4.292 92.991 51.100 131.752 -77.231 91.867 36.533 103.412 -79.433 90.793 51.928 117.436 -33.969 90.047 50.582 140.601 -48.791 89.599 41.011 129.696 -77.811 88.412 53.385 111.149 -51.245 89.540 55.978 127.187 -75.769 89.658 43.923 148.661-124.907 91.861 45.990 128.861 -43.405 96.703 -69.119 136.288 -98.360 128.894 -34.242 108.310 -87.803 121.915-162.850 144.388 -12.507 93.004 0.000 129.493 -76.467 # 41 total E -1.46422E+02 rmsd from N 0.000 %NC 0.00 93.155 -64.357 129.116 -83.487 93.927 -47.740 117.961 -80.968 90.488 -47.971 103.350 -77.307 90.301 -48.361 128.371 -75.665 90.956 -39.258 139.959-129.759 93.763 -43.730 63.993 -63.820 91.679 -34.768 130.058 -17.394 102.735 -38.008 168.932 136.282 96.244 -44.862 128.966-115.329 95.386 141.478 82.284 -85.196 93.041 98.542 139.050-100.921 96.405 20.215 93.931-116.700 103.068 124.558 113.168 -87.790 146.858-106.155 176.362-165.874 114.270-119.167 145.161-152.333 95.669 47.331 147.164-128.114 92.844 44.879 137.102 -80.339 90.697 50.059 134.978 -75.025 91.165 50.117 118.716 -80.509 91.716 42.471 139.705-175.302 90.112 45.407 0.000 0.000 90.970 51.394 105.068 -91.488 87.510 56.076 151.601 -89.542 86.662 55.575 117.440-142.734 86.906 53.535 102.897 -72.649 90.940 53.979 116.045 -36.337 93.021 18.753 145.301-117.994 108.678 34.222 155.786 -17.385 128.066 83.103 114.082 -82.076 94.256 -75.632 102.610-101.836 94.215 -43.100 112.295 -77.500 91.448-112.999 115.727 -20.114 100.468 -43.373 109.669 -72.322 93.668 -39.530 127.024 -76.320 94.185 -39.243 100.040 -81.010 90.137 -49.641 125.043 -7.841 92.817 -40.733 154.013 -14.243 92.362 -46.800 129.093 -76.672 93.229 -58.729 124.303 -46.237 92.750 115.688 129.469 -75.941 94.866 34.143 139.508 -96.869 92.322 57.496 128.608 13.922 91.055 66.953 147.423 -34.992 88.273 47.751 138.295-144.892 94.963 77.597 142.910-121.183 92.251 0.000 129.440 -75.966 # 42 total E -1.49790E+02 rmsd from N 0.000 %NC 0.00 123.533 -95.208 148.238 -50.305 94.610 -50.872 116.222 -75.548 91.362 -44.792 104.036 -77.777 90.625 -48.106 128.564 -76.765 88.211 -49.701 128.923-110.408 87.561 -51.251 69.003 -54.396 91.032 -35.888 128.704 14.530 99.396 -37.137 135.979 -77.439 93.728 -40.989 142.646-118.078 93.112 -70.021 90.950 -85.122 100.446-159.010 161.352 -20.603 106.546 -88.782 119.128-130.619 94.959-132.370 108.278 -83.402 109.953 141.612 153.797 171.491 117.769 -92.016 111.416 -86.409 94.616 48.997 151.958 159.520 93.530 42.324 139.022 -82.988 91.147 49.304 132.623 -56.512 90.272 48.934 113.862 -32.386 89.942 44.518 145.670-123.500 91.625 43.766 0.000 0.000 93.061 42.831 107.413 -82.863 90.112 47.592 153.477 -83.341 91.436 39.262 116.038-133.329 93.518 62.289 113.978 -78.866 92.851 -55.194 139.987-109.537 119.517 -70.418 125.133-144.460 94.966 -25.123 144.075-128.956 106.165-159.447 151.268 -14.280 116.477-137.524 112.443-117.499 93.543 42.985 114.097 -76.835 93.559 45.697 99.832 -28.432 92.841 44.170 134.758 -1.180 91.686 43.655 130.037 -78.164 89.191 50.979 101.073 -82.618 88.502 67.931 138.785 -42.575 87.125 51.465 152.652-111.128 89.276 40.117 128.190 -76.496 89.837 53.658 129.182 -42.657 89.030 49.962 128.704 -75.968 89.957 42.904 135.321-113.570 90.916 47.568 129.231 -38.579 90.778 50.269 132.136 -58.650 90.961 44.841 111.727 -90.726 95.112 113.539 146.889 -24.532 124.359 0.000 144.273 -93.111 # 43 total E -1.46937E+02 rmsd from N 0.000 %NC 0.00 92.752 -21.259 131.155 -94.872 95.505 -49.182 115.348 -78.423 91.917 -43.822 103.546 -78.253 90.660 -48.711 128.784 -75.567 91.147 -39.358 138.094-130.527 93.835 -41.075 59.002 -66.787 94.707 -34.717 132.934 37.932 102.181 -37.122 171.062-157.391 92.032 -47.299 119.514-114.584 89.048 -54.266 76.280 -72.923 91.345 -35.425 149.150 140.999 123.764 171.387 122.169-129.052 92.640 151.721 109.635 -83.051 145.577 176.755 172.502-164.999 104.190-109.379 152.386 -29.380 91.420 53.226 139.646 121.224 91.070 47.387 137.628 -82.706 90.459 48.570 126.931 -54.696 89.868 46.935 135.336 -17.450 90.113 46.885 144.104-153.066 89.948 46.662 0.000 0.000 89.300 49.127 111.196 -81.532 90.760 44.232 138.302 -80.027 91.727 42.960 121.065-122.500 90.007 49.944 110.980 -77.190 90.288 56.973 128.615 -90.131 90.540 37.313 134.969-129.776 94.720 44.929 114.029 -89.824 97.613 12.875 142.362 -96.348 128.354-139.381 113.512-111.201 95.770 11.079 114.160 -77.477 111.978 173.870 127.988 14.624 116.240 -12.790 114.636 -74.693 93.112 -55.065 129.249 -77.235 91.376 -35.468 101.333 -84.176 94.899-117.011 119.421 22.895 92.018 52.308 141.482 -26.204 91.396 49.822 130.306 -78.023 91.868 120.760 117.722-126.691 90.867 -51.382 130.741 -78.428 91.992 -45.169 143.838-127.893 87.913 -52.325 128.346 -23.856 90.847 -61.452 150.425 -21.817 89.091 -44.509 137.134-127.483 97.504 102.240 101.995 -79.866 118.998 0.000 146.625 -79.915 # 44 total E -1.46443E+02 rmsd from N 0.000 %NC 0.00 92.366 61.905 129.471 -73.057 94.487 54.121 148.947 33.780 94.249 42.584 145.204 -28.709 91.506 49.107 130.958 -76.287 91.227 42.749 138.433-121.254 92.769 44.911 116.426 140.812 91.044 71.369 107.241 -58.220 90.856 -65.741 133.340 -91.766 107.214 -76.449 117.938 -85.165 85.896-109.660 90.587 -62.301 115.574-144.343 170.413 -12.162 111.675 -73.504 123.614-134.652 103.819-116.434 106.198 -82.747 116.331 150.818 162.181 177.733 108.922 -98.997 111.763 -85.131 93.744 50.139 144.728 139.221 92.863 43.501 139.221 -83.755 90.900 49.153 127.743 -56.031 90.067 49.655 138.051 -31.599 89.958 45.441 143.441-165.167 90.531 43.087 0.000 0.000 91.076 49.995 108.168 -84.326 87.238 50.177 148.981 -83.304 89.732 40.746 120.048-137.095 92.574 61.921 112.014 -76.724 92.732 -56.683 142.856-106.844 120.095 -68.841 127.027-145.256 95.322 -26.444 144.157-129.056 105.082-161.836 152.191 -9.525 121.319-143.229 112.133-115.693 97.044 36.836 114.543 -77.183 93.368 46.481 122.868 -51.350 92.156 46.245 142.829-156.200 90.839 44.787 129.526 -77.190 89.165 46.056 107.169 -87.639 89.213 52.285 142.600-107.128 88.475 48.066 133.025-136.656 88.510 47.727 128.345 -76.870 87.219 63.282 109.213 -53.749 88.701 47.305 127.574 -75.878 89.940 47.276 139.025 -68.025 91.470 56.369 126.687 -37.655 92.057-160.350 138.340 -88.716 95.849 62.030 140.185-148.960 98.133 112.102 101.008 -77.971 92.356 0.000 128.965 -76.096 # 45 total E -1.46942E+02 rmsd from N 0.000 %NC 0.00 122.757-106.210 151.060 -86.367 94.746 -47.165 123.909 -79.618 91.060 -48.208 102.048 -76.933 90.866 -48.582 128.727 -76.254 95.457 -27.391 148.111-156.673 102.324 -38.404 54.796 -76.701 96.646 -25.380 139.567-139.490 105.011 -46.475 173.562-145.155 93.373 -35.128 135.401-117.630 106.522-131.389 71.536 -79.901 115.308 66.720 166.525-150.858 98.692 35.781 92.583-115.686 95.169 44.033 106.264 -79.700 91.585 56.292 139.084 -47.817 91.151 45.276 106.054 -84.524 91.454 45.895 139.762-101.990 94.262 40.675 123.408 -95.032 99.391 -95.909 155.495-113.531 115.098-112.113 114.100 -75.545 93.390 54.172 146.339-159.476 92.291 47.939 0.000 0.000 93.179 40.349 137.543 -9.218 93.271 45.082 155.086 -82.501 92.212 41.212 121.256-137.977 89.446 49.946 105.899 -74.752 91.142 66.014 109.595 -27.722 87.311 49.807 152.569-137.486 92.065 48.233 112.296 -89.095 98.330 -98.254 120.338 -80.895 105.658 -42.400 92.563 -88.025 90.126 -66.174 119.582 -76.717 88.872 -51.305 148.717-115.027 90.383 -60.590 112.774 -74.375 91.072 104.426 129.922 -75.699 93.080 42.504 104.085 -82.790 89.348 57.069 135.458 -22.775 89.234 48.646 146.907 -30.914 89.382 41.200 128.349 -76.892 88.301 58.504 128.474 -50.999 89.347 50.198 126.775 -75.893 89.003 43.712 144.487-129.728 90.980 47.721 127.777 -41.158 90.610 51.111 136.629 -80.571 90.714 44.748 139.847-144.272 95.120 74.755 104.238 -80.839 92.544 0.000 129.017 -76.624 # 46 total E -1.52494E+02 rmsd from N 0.000 %NC 0.00 93.277 171.719 139.142 -96.503 94.033 56.389 136.770 47.814 93.226 41.497 105.661 -81.236 91.813 50.219 131.773 -77.466 91.283 44.620 150.616-147.407 91.735 43.018 60.925 -70.186 91.331 44.634 122.958 -31.174 91.797 43.538 132.708-104.713 89.317 49.329 144.205-155.156 88.402 55.921 74.020-100.969 90.666 162.998 126.031 -66.928 93.802 63.670 131.508-156.072 122.744-165.425 100.239 -85.677 126.345 178.405 166.217-158.869 113.786-103.171 154.124 -25.670 93.999 45.649 146.761-107.721 92.400 46.288 137.459 -74.384 90.848 47.813 123.320 -63.223 91.398 47.923 133.853 -32.530 91.853 42.666 143.849-165.320 90.772 44.031 0.000 0.000 90.899 52.820 103.545 -82.474 88.129 47.782 148.369 -75.368 90.771 40.163 118.511-129.007 90.971 48.078 111.424 -77.124 89.638 53.596 138.255 -97.930 91.242 56.996 141.849-115.667 90.208 21.697 107.719 -86.697 112.731 40.495 150.348 -21.275 139.231-102.228 110.043 -97.334 126.552 8.662 118.290 -81.850 92.460 -61.022 111.754 -49.166 91.061 -47.939 113.767 -68.881 91.193 -43.181 126.973 -74.770 89.741 -42.555 102.482 -86.070 91.467 -47.373 144.551 -36.498 89.843 -47.570 154.865-111.511 89.591 -48.515 129.512 -77.872 92.983-124.745 135.961 5.684 89.221 51.753 132.499 -77.336 89.849 47.810 141.695-102.426 88.747 47.088 111.018 -17.028 90.385 55.553 145.761 -36.502 88.569 38.597 141.720-150.080 96.238 82.033 103.449 -79.717 92.523 0.000 128.946 -76.619 # 47 total E -1.46800E+02 rmsd from N 0.000 %NC 0.00 122.151 -93.405 152.087 -75.115 94.978 -47.243 114.194 -76.468 90.598 -47.024 141.123 -33.471 90.544 -48.725 129.113 -76.183 92.237 -39.432 138.227-123.173 95.045 -41.192 64.855 -70.350 93.194 -36.621 132.318 -18.870 104.455 -33.190 168.748 157.297 96.526 -60.738 132.270-104.883 94.185-148.416 81.924 -83.419 103.459 80.391 151.590-167.155 94.778 44.503 93.949-122.321 95.057 43.527 113.331 -81.336 92.977 42.558 146.939-104.147 92.942 48.151 132.378-141.931 92.554 59.445 123.878-120.487 93.947-100.261 120.585 -82.909 113.932-177.339 152.807 -80.496 141.553-145.871 136.737 -67.445 101.777 -25.159 109.373 -82.861 108.105-111.177 0.000 0.000 90.373 57.475 109.446 -78.151 90.576 48.249 145.360 -79.473 90.679 42.418 117.070-128.087 90.314 48.538 110.355 -74.495 90.798 51.642 138.275 -94.289 91.762 37.895 135.629-114.106 95.028 39.215 116.118 -90.337 100.590 -14.778 117.216 -87.566 138.285-161.159 106.315 -91.893 91.393 64.508 140.378 169.440 93.067 125.956 113.267 -84.717 92.805 -41.403 111.862 -71.671 92.773 -48.837 126.663 -75.581 92.047 -38.042 99.897 -80.316 92.086 -45.624 147.721 -31.163 91.519 -49.242 137.928 -89.570 90.775 -53.501 128.975 -77.538 93.567-120.046 132.819 23.279 91.503 49.948 130.205 -76.614 91.733 53.291 142.312-118.846 90.535 57.304 132.243 -43.337 92.638-140.582 139.009 -47.213 98.760 44.648 107.115 -85.232 115.185 93.004 107.546 -73.023 92.531 0.000 129.475 -76.646 # 48 total E -1.46408E+02 rmsd from N 0.000 %NC 0.00 92.963 -63.579 126.823 -75.759 94.270 -48.788 115.816 -78.361 90.973 -45.943 103.803 -77.693 90.571 -47.581 128.563 -75.898 90.838 -40.792 136.203-118.256 94.556 -41.736 67.378 -65.155 92.163 -33.167 125.736 -29.122 103.396 -36.123 165.528 153.054 96.336 -46.974 136.322 -77.657 92.911 156.278 89.763 -72.478 91.768 68.791 149.833-136.682 94.205 37.747 91.438-120.317 95.270 82.947 110.921 -82.994 90.609 -64.439 146.413 -46.852 104.538-126.456 145.259-148.532 93.361 41.813 143.118-121.682 93.163 48.180 135.988 -78.210 91.817 44.728 133.750 -46.718 92.205 45.382 97.783 -83.462 89.592 48.157 131.540 167.461 89.457 47.899 0.000 0.000 91.858 41.012 106.644 -82.536 90.789 47.334 151.025 -78.449 90.884 42.308 117.585-132.298 92.078 63.515 114.003 -79.581 90.984 -69.870 142.324-114.479 116.371 -62.978 150.571 -27.932 101.137 -62.499 146.195-126.960 95.429 142.831 147.945 -15.530 128.283 -76.936 109.574-108.276 88.603 61.613 112.840 -75.796 91.246 47.643 104.513 -28.382 91.543 43.384 111.566 -72.698 92.457 41.172 129.714 -76.143 94.083 38.498 101.752 -83.745 92.890 43.752 144.633 -38.263 91.047 48.588 143.230-108.769 91.350 37.837 128.327 -77.348 93.211 73.148 107.757 -94.422 124.140 162.127 131.986 -95.536 92.046 53.697 143.429-179.185 90.745 52.063 130.678 -46.362 89.852 54.920 144.481 -35.635 90.059 53.421 151.332-150.134 91.284 142.146 102.346 -81.952 126.726 0.000 140.861 -99.170 # 49 total E -1.49869E+02 rmsd from N 0.000 %NC 0.00 93.152 159.448 141.058 -99.145 93.647 53.280 156.365 155.356 91.961 46.598 147.446 -21.675 90.182 50.598 129.602 -75.717 89.122 47.451 149.181-137.182 92.652 41.460 123.803-155.071 90.890 44.382 113.034 -67.917 91.235 49.201 132.293 -96.871 90.924 59.291 141.934-122.453 87.464 127.020 121.753-172.705 107.056-104.991 124.473-125.529 92.878 53.988 96.313-117.875 95.566 37.368 104.070 -84.508 92.469 54.344 163.117-141.412 90.722 41.473 123.391-136.525 94.216 48.448 124.042-118.235 99.284 -31.088 137.873 -76.158 127.258 167.616 145.766 -77.705 95.831 53.266 124.333 117.438 94.848 41.569 145.996 -39.869 96.829 39.635 0.000 0.000 95.967 41.143 158.856-175.023 93.417 45.430 161.067 177.377 91.290 45.733 114.463-156.497 90.258 46.411 116.339 -76.682 91.768 45.004 152.168-131.153 93.116 54.440 134.185-162.825 93.273 -84.743 152.335 -32.015 120.138 104.977 116.367 -76.949 132.963 157.836 106.563 -98.689 99.556 36.788 145.685-130.460 95.934 44.662 120.661 120.545 98.780 97.872 113.235 -74.822 91.435 -60.184 129.702 -77.206 91.430 -47.987 101.479 -86.381 84.882 -71.818 103.255 -59.533 85.044 -63.979 148.166 -29.239 89.820 -34.420 129.881 -77.022 99.102-153.800 112.292-116.989 93.000 56.307 130.456 -75.381 92.162 40.916 139.993-108.806 91.514 45.451 128.003 -18.237 92.470 55.099 143.874-109.516 88.789 44.961 130.837-175.454 93.653 90.972 102.090 -79.948 92.550 0.000 128.762 -76.688 # 50 total E -1.52603E+02 rmsd from N 0.000 %NC 0.00 93.110 -64.165 127.651 -80.271 94.303 -48.637 117.952 -79.551 90.932 -46.961 103.503 -77.614 90.589 -47.054 128.310 -75.679 91.362 -40.730 141.803-129.789 94.942 -41.440 63.181 -62.885 91.671 -39.476 128.368 -15.692 99.549 -40.708 168.391 155.979 95.880 -60.987 131.626-117.964 94.815-149.980 76.540 -81.905 113.150 65.212 155.013-152.910 96.776 38.884 91.626-116.762 96.816 84.846 108.757 -81.212 94.831 -77.143 141.297 -45.249 98.318-132.743 140.290-136.291 92.625 51.969 135.593 131.645 92.853 45.555 134.628 -84.521 91.751 44.441 126.113 -29.352 90.323 51.268 139.557 93.739 89.903 47.639 140.245-143.340 91.646 41.359 0.000 0.000 90.243 49.522 154.308-165.956 90.190 49.125 129.849-100.346 90.172 42.536 122.206-127.368 89.232 48.946 117.260 -77.994 90.758 49.136 136.276-110.180 91.013 50.211 128.557-152.445 93.110-102.275 102.987 -82.572 112.713-177.851 151.563 -17.489 128.745 -57.432 112.888-110.691 109.010 -23.979 112.882 -79.775 94.050 -45.778 112.399 -54.377 93.205 -41.672 111.885 -71.147 92.576 -44.430 127.971 -76.627 92.049 -37.675 101.284 -81.036 90.080 -46.796 120.455 -27.480 90.968 -55.203 149.868 -27.213 88.193 -51.850 130.329 -77.720 91.460-130.149 136.428 12.107 90.081 52.368 132.796 -77.589 91.413 47.181 141.294-108.636 90.125 46.944 128.738 -34.986 90.574 71.823 144.813 -33.558 87.197 54.456 135.166-134.778 92.507 114.270 100.756 -79.782 92.570 0.000 128.734 -76.513 # 51 total E -1.48423E+02 rmsd from N 0.000 %NC 0.00 93.165 -64.985 129.229 -83.433 94.739 -45.423 115.684 -80.951 90.346 -48.563 103.023 -77.345 89.991 -46.821 129.829 -76.331 93.998 -38.765 139.968-120.821 94.898 -39.861 62.285 -66.648 94.102 -40.379 132.859 28.233 102.285 -34.777 172.039 168.101 96.025 -55.411 123.755-119.380 97.119-146.338 81.028 -77.086 118.106 70.480 153.964-140.598 97.704 46.852 91.570-116.211 98.132 66.753 111.569 -86.925 123.652 -50.111 140.944 -93.565 97.240-159.486 135.337-135.843 95.000 50.622 138.579 143.931 93.183 44.147 134.070 -85.610 92.025 45.359 130.318 -51.402 90.894 50.340 149.871 170.689 90.241 48.706 109.864 -84.022 91.438 40.565 0.000 0.000 89.403 53.013 131.635-103.714 88.802 47.966 119.274-108.689 89.466 44.468 122.530-124.915 90.100 44.331 112.949 -76.729 91.667 49.547 135.046 -99.345 92.075 46.892 130.868-143.147 92.632-110.692 148.851 -31.354 103.622-168.776 153.702-132.926 102.140-126.431 95.326 -96.648 90.996 61.966 112.647 -76.553 94.212 134.810 116.937-108.165 90.479 53.022 120.850 -73.425 90.895 44.810 128.488 -75.774 89.080 48.243 111.181 -87.832 89.042 47.598 128.653-101.500 89.016 53.104 137.024-121.242 88.407 49.544 128.118 -76.748 87.708 53.118 107.631 -79.253 89.663 46.948 128.076 -76.298 89.556 52.838 141.899-123.388 88.300 61.362 132.218 -50.482 89.449 49.002 130.521 -61.895 91.636 47.495 158.539-153.718 94.560 76.281 104.118 -80.963 92.490 0.000 129.032 -76.604 # 52 total E -1.47470E+02 rmsd from N 0.000 %NC 0.00 93.033 150.423 141.891 -99.269 92.904 53.642 154.320 44.154 91.686 47.391 107.149 -80.548 90.622 50.300 129.460 -75.711 91.070 40.500 146.130-130.059 93.152 48.656 122.090 152.121 90.439 54.900 108.416 -58.591 91.282-112.284 113.891 -79.173 89.683 -53.520 97.167 -9.906 95.714 -41.049 148.695 1.072 95.259-119.357 150.559-126.291 92.160 71.287 99.402-135.706 95.250 125.532 104.263 -86.324 120.428-122.352 149.864-120.377 109.203-106.969 153.482 -31.587 94.160 44.045 151.175 171.623 92.348 46.895 137.492 -82.049 90.710 47.438 125.548 -72.920 92.747 46.682 119.903 -48.504 93.843 40.096 149.230-157.958 94.656 37.554 0.000 0.000 92.874 52.692 114.699 -86.570 88.187 45.998 141.629 -90.680 89.565 44.873 117.028-126.326 89.343 50.008 111.366 -78.030 89.881 50.330 140.625-103.680 90.780 45.357 130.506-147.415 94.401-100.842 104.231 -82.978 112.741 168.426 151.209 -15.813 105.974-165.298 90.223 -90.069 94.607 53.132 129.265 33.131 92.779 45.087 108.370 -26.507 90.855 47.871 141.343 -41.718 91.314 43.833 129.023 -76.348 92.641 46.405 101.182 -82.251 91.162 42.960 132.436 -49.728 92.108 53.591 121.657 -86.480 89.506 43.411 130.070 -78.060 92.328-169.862 101.671-100.637 114.266 99.916 166.058 -90.260 93.519 44.161 140.298-106.132 91.673 47.458 126.407 -20.606 91.226 59.297 149.346 -32.245 88.584 44.416 137.909-146.789 94.491 91.522 103.181 -80.174 92.517 0.000 128.809 -76.533 # 53 total E -1.47157E+02 rmsd from N 0.000 %NC 0.00 93.192 -70.354 127.681 -78.490 94.109 -49.891 118.136 -79.256 91.514 -45.993 102.606 -79.243 90.499 -47.404 129.349 -75.919 92.158 -38.940 140.069-134.247 93.798 -43.905 61.887 -62.303 90.931 -39.865 155.882-153.135 100.808 -44.197 171.266 168.590 90.906 -36.741 140.205-124.076 105.355-128.684 74.684 -81.833 114.392 63.696 164.592-134.736 99.190 34.449 92.520-113.772 94.095 46.606 108.562 -79.994 91.417 57.071 130.150 -48.202 90.286 42.718 109.275 -88.885 92.062 46.725 134.930 -97.871 94.061 40.154 122.329 -69.832 99.776-102.480 154.320-117.703 111.460-109.288 111.034 -79.281 92.285 59.860 146.193-173.074 92.243 47.160 0.000 0.000 92.381 40.109 139.132 -22.355 93.464 45.911 144.466 -80.997 91.693 46.601 121.974-129.066 89.471 45.926 105.521 -74.701 92.605 52.460 117.027 -55.335 91.295 43.542 145.372-128.553 94.897 24.491 154.312 -20.591 128.196 26.614 114.581 -84.084 143.580-163.199 100.734 -78.265 93.126 53.949 116.522 -75.915 91.103 51.912 101.547 -7.069 88.496 52.351 126.678 3.278 91.276 42.287 127.241 -75.137 90.010 46.839 108.310 -89.524 89.649 53.489 117.547 -13.889 89.470 44.663 134.121 -51.728 91.932 44.891 129.215 -76.751 92.279 118.504 112.725-117.558 91.670 -46.764 129.413 -77.940 92.292 -47.998 147.074-126.997 89.529 -52.827 118.587 14.419 95.385 112.507 159.904 -18.202 107.114 32.932 141.756-166.753 98.957 54.216 105.502 -76.413 92.418 0.000 129.357 -76.330 # 54 total E -1.50049E+02 rmsd from N 0.000 %NC 0.00 93.056 158.365 137.312 -86.003 92.648 57.217 136.998 58.680 92.027 46.075 106.187 -81.739 92.435 43.918 130.341 -77.122 94.860 45.097 155.850-157.831 93.591 40.636 55.279 -72.646 92.491 44.630 127.428 -31.156 92.767 42.597 131.558-111.758 89.443 52.427 142.587 179.314 88.508 54.067 77.711-103.779 90.494 166.803 131.281 -80.560 95.412 69.245 129.206-153.857 94.564 36.640 96.571 -80.405 92.936 52.128 146.632 -38.479 90.358 48.080 131.850-134.167 90.677 49.457 123.057-139.816 91.277 42.678 130.735 -81.349 94.214-126.309 113.159 -74.489 122.088 -86.922 61.275 69.937 94.192 73.286 151.631 -25.847 93.199 43.880 0.000 0.000 90.131 48.554 143.091 -5.990 90.158 49.200 142.723 -97.596 89.693 50.039 131.371 175.637 85.814 61.046 114.372 -73.157 87.914 43.027 134.384 -56.682 92.959 56.146 125.476 -34.557 94.770 -19.420 142.789-126.899 128.285 39.055 122.319 -88.724 135.313 170.169 106.434 -95.093 108.362 32.918 147.375-139.499 94.843 47.465 131.007-164.456 98.683 103.521 110.792 -74.448 97.074-138.998 128.084 -74.736 87.081 54.266 94.939 -81.239 91.274 51.733 111.395 -34.087 89.516 47.909 145.425 -23.992 89.672 42.121 128.039 -76.491 89.246 54.136 116.864 -82.926 89.916 46.129 128.174 -76.469 90.383 45.734 142.287 -97.210 90.692 47.563 126.974 -39.458 90.671 51.445 136.363 -93.280 90.825 44.174 136.330-146.698 95.033 76.641 143.061-121.917 92.494 0.000 128.978 -76.553 # 55 total E -1.48524E+02 rmsd from N 0.000 %NC 0.00 93.039 154.163 140.909 -97.571 93.410 53.065 129.791 40.555 90.849 45.652 106.318 -81.624 91.602 49.831 130.869 -77.069 90.802 43.926 152.324-144.133 93.173 43.263 59.011 -65.447 90.465 46.127 124.034 -27.716 88.486 54.552 127.166-104.168 88.824 44.783 116.564-106.587 94.677 98.721 91.439 -92.496 106.533-126.728 147.572 -99.728 93.566 59.852 98.409-108.326 94.100 42.233 107.808 -79.793 91.668 49.299 146.109 -42.435 90.837 42.986 129.438-124.375 93.330 59.428 123.375-115.801 94.175 -60.454 126.061 -68.592 129.426-164.297 141.855 -81.546 105.689 31.612 161.183 103.630 97.049 39.109 146.390 -33.740 100.820 31.793 0.000 0.000 100.408 32.754 152.000 -5.397 96.928 40.822 171.970 174.829 91.534 46.957 116.778-153.483 89.054 48.555 105.914 -74.625 91.336 50.070 137.413 -31.969 91.355 40.391 140.802-142.056 93.711 42.201 143.530-130.339 102.399 -52.464 110.877 -87.350 136.200-153.653 100.984 -86.446 94.330 54.742 142.682-128.177 102.287 20.551 121.218-143.237 120.790 102.625 118.355 -77.499 129.618 -90.470 141.571 -80.331 95.434 37.505 96.667 -77.722 91.270 54.106 120.730 -6.746 87.887 56.676 143.988 -35.770 87.790 47.004 128.005 -76.641 87.104 53.678 114.742 -27.079 89.263 50.953 128.279 -75.579 88.985 44.756 138.788-103.192 89.835 49.178 128.975 -36.817 89.787 54.086 137.905 -52.351 89.857 44.304 139.484-129.748 94.365 83.204 142.960-121.628 92.529 0.000 128.835 -76.575 # 56 total E -1.52501E+02 rmsd from N 0.000 %NC 0.00 93.062 155.873 139.733 -93.780 94.264 52.879 128.572 54.157 90.919 47.824 106.360 -75.933 92.288 43.216 129.431 -77.322 93.382 49.408 153.624-158.254 95.410 36.407 52.776 -66.417 93.259 46.519 131.337 -5.753 91.626 44.057 131.682-117.950 91.194 56.126 141.648 173.564 87.321 89.088 84.568-107.176 90.256 -65.678 133.205-102.797 103.464 -78.020 91.884 -85.632 88.589 -67.082 146.831 -7.288 115.653 148.990 159.045 156.946 113.707 56.464 136.655-150.315 127.439-104.806 146.073-122.858 92.799 54.928 137.474 -82.213 91.202 50.419 130.206 -43.085 89.766 49.562 138.200-120.735 88.180 50.472 141.637-130.408 88.545 53.967 0.000 0.000 90.913 42.093 107.549 -84.714 90.899 46.747 176.266 178.784 90.016 50.555 105.869-141.349 88.704 49.612 106.274 -72.448 90.882 50.446 145.471 -35.556 91.019 43.798 137.142-152.700 95.633 -96.921 142.989-125.039 115.679-162.160 154.931 -18.588 100.048 -52.480 98.720-104.588 92.870 -48.210 111.448 -74.520 92.697 -71.960 108.178 -56.012 91.172 105.262 132.210 -41.926 94.077 45.540 128.645 -76.352 89.455 49.820 103.786 -74.778 90.577 56.231 145.871 -27.680 87.544 48.180 165.372-161.822 90.038 41.911 128.111 -76.354 91.224 48.130 117.852 -30.576 89.841 46.734 131.261 -77.580 90.232 45.932 138.861-117.005 89.441 51.331 130.819 -44.149 89.124 54.368 135.817 -59.325 89.881 44.283 138.750-123.288 94.761 79.528 104.009 -80.346 92.535 0.000 128.896 -76.703 # 57 total E -1.49643E+02 rmsd from N 0.000 %NC 0.00 93.263 -74.034 127.632 -73.092 122.552-101.440 131.589 -32.330 93.695 42.215 110.383 -80.000 93.625 47.344 131.324 -77.644 95.635 39.566 148.192-125.900 92.407 45.075 64.438 -92.718 89.340 44.917 113.585 -59.991 91.247 53.687 122.199 -94.662 88.308 35.437 134.755-116.884 99.212 106.824 90.272-102.159 126.151-120.902 160.725-108.455 93.267 52.936 96.647 -90.410 91.298 51.674 103.872 -76.984 92.552 44.041 141.958 -44.484 91.557 45.639 137.702-122.803 93.432 45.216 123.593-115.400 97.039-109.490 116.146 -76.848 102.270 -98.100 141.529-106.719 94.079 73.812 135.739 -62.700 98.221 44.012 146.459 -49.010 98.897 36.349 0.000 0.000 92.893 49.820 147.857 -3.832 92.300 49.287 163.571-137.356 90.899 47.392 111.197-142.209 90.027 46.461 110.701 -73.286 91.353 52.853 149.331 -35.705 90.763 45.512 137.493-144.804 92.956-116.291 106.052 -83.717 109.580 171.548 151.904 -11.471 126.134-133.337 117.975-120.919 92.875 61.610 114.197 -76.265 91.865 46.999 103.116 -30.975 90.966 48.789 114.029 -68.747 90.576 42.244 129.060 -76.741 89.612 45.890 101.959 -82.594 89.890 51.321 136.695 -44.609 88.537 46.514 144.754 -99.687 90.646 40.684 128.435 -76.978 90.142 49.549 112.634 -40.860 89.717 49.530 129.338 -76.973 89.844 45.266 135.260-132.813 89.532 48.331 130.052 -39.774 89.860 53.755 135.652 -58.884 90.008 44.258 137.947-122.764 94.686 82.025 143.049-122.512 92.552 0.000 128.916 -76.543 # 58 total E -1.48480E+02 rmsd from N 0.000 %NC 0.00 123.134 -97.365 149.820 -64.895 94.579 -51.020 116.658 -73.830 91.525 -45.181 141.085 -34.941 91.091 -48.035 127.994 -75.673 90.549 -41.397 141.904-131.143 94.024 -42.684 65.689 -59.579 90.307 -41.438 124.194 -22.607 97.482 -44.382 167.328 159.773 91.477 -51.312 135.583-120.953 95.010 159.813 87.884 -94.290 115.815 60.595 157.262-146.528 92.442 51.484 101.454-131.849 96.271 57.997 104.805 -86.824 109.343 -5.023 141.722 -89.085 111.860-153.665 148.722-144.054 114.475 23.394 147.756 158.439 95.589 46.191 136.269 -82.820 92.823 41.284 118.659 -48.993 92.536 53.738 117.929 -77.527 88.964 45.255 140.268-169.480 89.713 44.901 0.000 0.000 91.110 46.478 106.045 -81.523 91.423 46.141 142.898 -75.982 92.041 40.045 120.343-126.004 90.650 49.137 113.887 -78.115 91.407 54.968 135.467-102.317 91.253 69.310 135.327-171.195 91.139 -77.991 104.597 -85.257 118.785 157.602 151.313 -16.949 106.736 -76.493 94.822 -95.231 115.557 -13.650 116.009 -79.390 93.002 -50.479 114.270 -40.394 92.817 -43.304 110.245 -72.450 91.189 -47.072 126.027 -74.904 89.683 -38.369 104.548 -83.226 92.013 -48.112 110.046 -61.892 88.196 -51.414 146.843 -49.334 88.794 -56.244 127.928 -76.280 87.042 -78.947 124.208 -35.635 88.618 94.326 131.684 -77.046 92.094 66.634 140.516 -87.971 91.694 52.314 114.267 -29.167 93.739-113.414 144.485 -34.805 96.775 -0.522 110.498 -83.719 121.465 146.552 102.748 -75.984 122.347 0.000 149.050 -80.298 # 59 total E -1.51000E+02 rmsd from N 0.000 %NC 0.00 93.114 -65.159 127.460 -78.070 94.431 -47.508 115.622 -79.230 90.658 -46.964 103.443 -77.209 90.430 -47.653 128.566 -75.886 91.152 -40.819 138.033-117.515 94.737 -40.341 59.653 -59.134 92.594 -39.272 135.357 6.349 100.413 -38.613 166.568 172.674 91.337 -63.725 111.467-110.875 85.340 -87.640 134.354 -5.916 91.053 102.386 146.938 177.348 99.635 34.288 90.902-113.571 95.949 42.992 150.226-145.716 91.742 49.577 145.767 -43.346 96.016 37.671 98.529 -89.416 95.929 41.277 138.023-104.584 96.768 35.722 149.523 -98.660 117.683 -93.245 155.826-162.563 130.959-102.130 106.192 -84.949 92.105 58.847 147.170-160.291 91.245 47.622 0.000 0.000 89.101 48.288 135.751 -20.386 90.741 51.003 143.421 -87.266 88.821 44.536 122.587-134.741 87.620 54.716 107.412 -73.174 91.719 47.750 140.719 -43.349 92.290 41.635 137.527-144.303 96.208 46.515 144.857-132.092 120.263 -98.257 107.656 -85.919 97.566 -46.603 94.378 -88.906 91.310 -58.719 121.176 -77.413 90.667 -54.286 147.424-155.893 91.425 -63.005 113.428 -74.322 91.654 97.798 129.198 -76.200 93.213 44.952 103.605 -82.457 88.688 68.401 120.652 -13.849 86.938 56.857 140.944 -36.351 88.444 46.934 128.019 -76.296 88.375 54.340 117.481 -22.742 89.051 50.945 129.415 -75.607 88.862 45.055 140.957-110.633 89.412 50.732 130.814 -42.642 89.254 55.168 136.327 -54.044 89.565 44.088 135.588-119.371 94.633 81.164 103.965 -80.620 92.542 0.000 128.859 -76.732 # 60 total E -1.47217E+02 rmsd from N 0.000 %NC 0.00 118.389 150.603 152.968-105.311 93.486 57.032 140.048 42.626 92.703 43.033 106.506 -81.957 91.511 50.644 131.398 -76.609 92.890 40.677 150.685-142.161 91.581 43.148 58.976 -71.747 91.007 44.964 116.983 -33.728 91.015 45.985 142.159 -90.759 90.008 41.564 129.061-116.214 90.095 43.014 73.781 -89.998 93.586 57.933 144.031 -51.599 96.866 19.105 99.523 -99.994 97.243 54.447 115.077 -86.944 95.884 -0.279 115.789 -97.088 124.390-172.393 148.126-128.329 92.372 57.247 132.000 115.444 91.178 48.571 134.100 -86.096 88.913 55.641 129.411 32.355 88.349 53.224 155.752 -4.146 88.453 44.382 142.527-137.568 90.633 46.149 0.000 0.000 88.456 51.688 133.388 -31.257 88.940 50.582 131.370 -85.496 89.051 44.721 126.528-127.795 89.057 48.537 107.315 -74.112 90.322 48.406 130.729 -52.481 90.731 47.303 138.225-132.214 90.904 42.312 113.905 -88.412 96.588-136.321 105.814 -75.725 101.537-164.109 93.759 -87.454 93.110 -55.535 112.991 -74.973 92.184 -47.120 143.908-155.716 91.474 -48.633 112.472 -73.877 92.867 154.194 128.252 -73.828 89.736 47.357 100.452 -82.025 92.340 40.476 110.079 -59.040 91.938 51.877 153.679 -26.854 88.507 46.726 124.777-106.081 88.153 51.823 98.652-104.761 89.995 48.633 127.994 -75.419 89.912 43.850 140.730-103.297 91.026 45.736 127.618 -41.778 90.852 52.336 136.393 -97.172 90.377 43.614 134.865-138.651 95.305 73.198 104.054 -80.528 92.586 0.000 129.027 -76.622 # 61 total E -1.47485E+02 rmsd from N 0.000 %NC 0.00 122.719 -99.651 150.955 -76.513 95.433 -47.559 117.399 -79.446 90.882 -46.754 102.810 -75.765 90.319 -48.331 128.865 -76.283 90.114 -41.704 139.877-132.591 94.058 -38.852 56.577 -63.231 93.804 -42.661 149.667-129.799 96.359 -41.678 172.693-178.171 90.394 -55.695 130.800-119.944 93.288-100.978 97.341 -76.491 112.016 56.731 142.054-165.610 93.354 55.421 98.794-133.374 87.884 66.746 116.872 -82.688 88.699 52.067 122.745 -45.860 93.143 34.103 111.181 -87.349 96.833 45.136 138.232 -97.288 99.359 -9.234 105.032 -63.477 127.187-159.907 113.954 -35.315 106.909 -18.113 106.270 158.346 103.729 74.177 145.668-172.485 97.352 38.801 0.000 0.000 92.018 46.144 137.944 -13.674 91.187 48.518 139.700 -94.410 91.223 49.821 122.363-129.939 89.650 42.321 107.764 -74.022 91.355 56.015 149.830 -37.062 88.436 57.377 125.854 46.921 89.381 37.555 113.320 -89.261 97.125-115.018 114.122 -78.183 123.017-147.598 119.297-124.050 115.022 -30.954 119.743 -76.546 92.237 -53.513 123.910-136.429 92.756 -65.266 112.955 -74.184 91.597 107.612 129.334 -74.955 95.315 35.771 105.229 -83.213 90.913 50.498 120.954 -7.118 89.129 56.121 146.592 -32.233 88.105 48.873 128.620 -77.401 87.927 49.834 116.122 -27.492 89.456 48.581 129.817 -76.119 89.245 47.380 148.337-121.113 88.646 48.243 130.914 -44.356 89.195 54.868 135.368 -49.804 89.441 44.333 139.357-126.408 94.473 82.588 103.662 -80.748 92.563 0.000 128.835 -76.754 # 62 total E -1.46760E+02 rmsd from N 0.000 %NC 0.00 93.339 171.440 138.772 -95.283 93.331 57.313 142.311 40.562 92.399 42.973 106.134 -82.660 91.694 53.711 131.989 -77.133 91.006 42.503 150.273-146.403 88.996 47.168 68.075 -76.945 90.463 45.674 110.510 -51.578 91.203 44.424 142.349 -83.537 89.129 41.749 140.935-141.362 92.102 49.998 79.045-104.040 89.713 77.342 143.042 -98.039 92.739 67.465 96.630-118.311 89.395 129.432 131.999-123.533 118.006-138.249 131.656-113.502 96.058 73.899 139.124-146.651 98.017 -69.135 118.123-113.754 116.647-113.272 152.479 -43.131 93.172 47.236 147.264-100.162 95.067 46.032 166.666 147.240 97.255 36.310 144.196-154.063 95.080 41.730 0.000 0.000 93.466 47.161 109.946 -86.573 91.948 43.034 171.437-162.234 92.759 38.970 103.463-131.459 91.782 48.734 115.292 -79.677 91.157 58.117 146.433-123.235 90.196 42.182 142.460-114.775 93.251 38.911 114.373 -91.263 112.561 7.486 148.724 -99.571 113.128-144.713 98.361 -86.286 94.090 69.425 113.604 -76.886 93.595 144.414 114.159 -99.676 96.782 54.421 109.433 -74.409 90.742 45.475 129.594 -76.543 89.886 45.991 106.202 -85.478 91.092 44.989 124.546 -82.913 90.403 48.830 137.552-100.061 89.902 52.101 128.452 -77.346 89.404 70.280 106.723-102.225 90.874-178.586 129.407 -76.970 92.798 53.176 140.352-108.183 89.361 49.590 105.404 -42.185 91.638 59.685 147.379 -31.911 88.123 45.235 140.570-151.867 94.271 89.992 102.566 -80.067 92.539 0.000 128.877 -76.483 # 63 total E -1.52995E+02 rmsd from N 0.000 %NC 0.00 93.466 176.942 139.933-100.733 93.235 55.162 142.577 11.196 92.586 44.165 105.641 -82.403 92.123 49.804 130.628 -76.525 93.295 42.285 135.481-112.376 91.481 42.764 62.038 -75.995 91.543 44.144 118.002 -45.691 90.470 45.844 134.055 -98.041 92.550 45.556 117.415-106.981 94.946 98.578 98.469 -95.657 123.451-136.217 147.759-108.069 92.499 51.791 95.942-107.154 92.918 49.969 108.631 -84.891 91.071 49.420 124.130 -11.962 91.796 39.329 108.768 -87.243 94.884 44.804 133.637 -99.879 99.620 -65.608 117.811 -70.312 133.061-155.363 96.029 -33.498 109.786 29.636 148.017 -33.776 96.364 45.856 145.267-164.770 95.302 38.454 0.000 0.000 91.677 48.926 141.748 -11.183 90.440 46.540 134.221-108.091 90.011 48.690 118.190-130.290 87.384 60.119 111.489 -76.656 88.210 56.196 135.106 -50.056 90.008 39.480 137.376-129.607 95.447-115.390 142.401-121.040 117.212 175.450 153.203 -9.755 126.536-113.291 119.097-121.676 95.037 57.129 114.394 -76.902 90.866 51.947 114.642 -5.826 88.688 53.582 110.093 -68.624 88.787 46.134 128.823 -76.209 88.959 44.924 104.465 -82.662 89.606 48.902 146.516 -25.919 89.874 44.500 145.820-121.978 90.691 40.826 128.076 -76.727 87.945 62.492 126.583 -62.480 89.221 50.908 126.158 -75.959 89.484 40.826 139.887-127.013 92.391 46.130 127.186 -39.859 91.429 50.789 139.285 -86.544 90.746 44.449 137.769-150.937 95.148 74.909 104.033 -80.503 92.480 0.000 128.997 -76.647 # 64 total E -1.48715E+02 rmsd from N 0.000 %NC 0.00 93.340 -71.891 128.857 -82.055 93.648 -50.996 109.086 -73.502 92.681 -40.083 103.930 -73.012 93.929 -39.864 128.758 -75.224 103.559 -15.117 151.700-138.873 107.733 -36.422 58.230 -79.700 96.773 -22.145 118.627 -53.760 107.561 -39.073 166.184-178.867 101.474 -61.342 137.618-142.152 90.804-148.937 72.893 -95.484 94.772 69.171 152.186-174.296 98.850 31.091 90.140-118.602 92.904 52.679 115.104 -76.662 90.594 63.432 144.697 -28.689 89.505 39.941 123.541-119.188 94.577 41.909 135.123-106.909 101.289 -26.566 128.956 -77.398 135.657 170.433 128.362 -58.694 105.646 38.342 164.684 119.708 97.485 43.405 109.523 -82.007 108.484 22.667 0.000 0.000 96.546 44.099 151.967 -7.283 93.500 48.546 171.089-166.545 90.551 49.371 111.357-145.478 89.680 45.164 107.392 -70.762 92.410 46.051 145.453 -46.976 92.944 51.491 140.062-152.818 94.807 -89.951 149.564 -27.612 119.183 165.317 151.882 -22.150 100.474 -73.151 94.454-104.761 94.861-131.095 112.521 -75.271 94.823 45.391 150.178-170.348 96.820 43.426 115.634 -72.674 93.892 39.565 129.314 -75.725 89.964 51.032 146.532 0.064 89.549 43.289 117.492-119.320 90.820 49.330 142.156-164.379 89.949 43.136 126.640 -75.476 89.766 51.224 73.133 -87.096 90.421 43.559 128.734 -75.987 91.496 40.608 137.078-130.912 91.664 47.314 127.879 -58.712 90.863 52.317 132.279-113.643 90.061 41.960 131.105-146.096 95.578 71.781 104.000 -80.444 92.535 0.000 129.035 -76.632 # 65 total E -1.47537E+02 rmsd from N 0.000 %NC 0.00 93.207 -69.324 129.229 -83.178 94.942 -45.264 111.394 -78.296 91.174 -45.984 103.535 -73.375 91.005 -42.720 132.091 -78.204 95.062 -40.902 142.360-121.977 94.604 -38.989 59.725 -66.379 92.413 -45.854 139.852-124.116 98.769 -34.867 171.951 159.762 90.895 -57.801 123.455-116.346 87.964 -87.517 134.942 -0.577 89.385 112.519 146.587 175.156 97.164 36.999 88.619-115.745 93.015 50.293 143.617-143.196 92.720 41.982 139.097-152.751 94.035 56.903 126.959-139.507 95.686 -49.183 122.492-125.144 123.277 -75.728 154.050 -76.584 110.300-141.793 147.564 20.195 104.125 -35.448 135.979 -88.650 96.530 -39.706 104.206 -81.740 99.593 -31.974 0.000 0.000 100.700 -34.739 118.008 -87.260 94.280 -50.488 129.743 -87.042 89.641 -49.676 119.959-121.893 89.121 -44.828 112.077 -71.085 92.880 -45.266 145.877 -98.183 95.093 -39.199 139.487-144.267 97.000 -67.339 144.937-127.799 126.355-166.294 159.145 -4.154 123.125 -7.898 109.778-109.552 102.319 -34.502 111.667 -79.102 94.111 -43.587 109.242 -57.614 91.567 -45.496 114.377 -72.328 90.984 -46.519 128.102 -76.077 89.250 -42.885 105.460 -85.041 88.804 -56.530 112.064 -71.254 86.461 -56.152 152.939-136.631 89.255 -43.768 128.145 -76.757 93.252-118.812 132.424 -53.710 91.210 53.336 131.699 -76.786 91.019 50.146 142.694-116.551 91.287 61.400 129.261 -30.769 91.517-104.960 146.025 -43.610 100.178 -31.379 134.447-122.951 112.173 53.404 101.818 -76.915 92.482 0.000 129.234 -76.490 # 66 total E -1.49336E+02 rmsd from N 0.000 %NC 0.00 93.303 -85.295 130.138 -86.318 94.104 -48.937 125.056 -70.689 91.547 -47.347 102.708 -78.569 90.887 -43.883 127.687 -75.338 90.355 -48.930 145.096 175.991 91.928 -45.096 98.549 -60.530 92.504 118.771 135.158-121.514 94.576 42.538 139.913 -82.436 90.337 63.774 154.576 178.890 87.800-179.797 76.633 -99.681 105.069 80.504 154.854-159.005 93.093 42.004 92.356-120.309 95.111 63.113 109.626 -89.159 94.114 -85.062 155.433-141.785 112.325-118.535 142.603-162.727 97.245 41.678 155.998 138.469 92.627 46.109 134.263 -92.418 90.539 54.597 159.656-129.273 90.380 49.411 96.863-130.916 90.722 39.315 132.339-168.604 90.704 47.967 0.000 0.000 89.772 50.917 107.095 -90.415 88.812 50.754 138.054 -75.448 88.173 46.595 123.811-129.133 89.350 48.852 108.324 -74.611 90.645 47.847 136.550 -79.184 92.175 44.506 135.847-146.128 95.352-101.226 152.643 -30.494 113.638-165.055 114.682 -76.076 97.930 -47.704 96.184-103.360 91.215 -48.983 110.213 -76.097 91.546 -72.079 109.243 -46.363 87.096 101.748 121.275 -73.284 92.179 47.254 128.865 -76.453 88.095 47.652 138.986 -39.890 89.600 60.924 140.311 -27.797 86.278 50.955 156.793-128.226 89.425 41.656 127.961 -76.386 90.519 48.105 117.042 -27.670 89.517 48.111 130.923 -77.314 89.790 45.537 137.338-120.445 89.193 49.384 130.663 -42.929 88.865 55.909 136.438 -58.602 89.412 43.721 133.333-118.293 94.760 81.329 103.924 -80.422 92.520 0.000 128.920 -76.733 # 67 total E -1.49146E+02 rmsd from N 0.000 %NC 0.00 93.236 166.688 140.233 -98.835 93.836 53.471 132.595 38.507 91.499 46.168 106.486 -80.089 91.629 47.200 131.683 -78.105 92.383 46.883 148.568-135.864 92.277 41.930 56.443 -67.560 90.379 49.177 128.736 -27.382 90.303 48.428 126.688-112.777 87.382 46.992 137.458-154.662 88.958 55.178 75.727-102.357 88.553 106.668 134.751 -77.016 91.722 49.409 98.622-113.611 94.683 55.458 101.718 -81.115 94.499 -1.845 144.794 -41.606 124.565 178.567 107.235 -83.815 97.496 36.862 143.537 114.710 93.172 45.499 135.660 -86.452 90.825 51.739 144.239 -74.313 90.358 48.710 133.752 -24.832 89.807 42.307 152.614 -15.246 89.739 48.735 0.000 0.000 89.047 52.859 109.569 -86.352 88.331 44.464 141.921 -84.269 90.435 45.607 121.040-127.543 88.161 55.469 113.722 -76.470 89.136 55.051 137.935-107.807 89.325 39.936 126.496-151.242 96.818 -99.371 150.580 -29.629 117.379-169.273 162.882-152.821 100.979 -52.502 97.183 -97.331 95.584 -41.263 111.744 -77.020 91.593 -46.397 112.482 -47.251 90.211 -51.813 108.743 -75.806 89.955 -48.970 128.606 -76.219 88.945 -41.449 102.106 -83.504 97.607-111.308 143.399 -17.050 90.379 62.904 149.299 -94.070 89.917 42.966 136.055-105.343 91.388 81.775 120.483-136.218 90.181 -76.004 129.300 -77.412 97.524 -55.013 140.964-113.746 98.825 -11.389 121.076 7.459 103.469 -61.912 140.407 -48.834 91.030 -15.942 140.897-166.201 112.881 150.352 103.822 -78.901 123.949 0.000 148.282 -84.019 # 68 total E -1.50274E+02 rmsd from N 0.000 %NC 0.00 122.608 -97.943 151.111 -83.256 94.825 -47.130 119.021 -78.645 90.644 -47.805 142.779 -30.818 90.141 -53.363 128.186 -75.761 90.075 -39.720 139.381-132.393 92.953 -44.412 60.787 -59.773 91.142 -37.263 164.614 150.660 101.684 -39.506 168.229 142.692 96.691 -42.380 124.574-116.190 94.313 139.302 82.433 -77.734 92.151 86.357 145.928-104.848 93.294 34.961 94.090-116.644 96.558 53.400 106.305 -84.432 95.906 -8.850 140.211 -93.271 129.609-171.097 108.156 -87.448 109.221 35.539 147.361 146.193 94.458 46.069 135.678 -84.525 91.317 48.151 129.507 -51.875 90.588 53.739 111.003 -34.085 89.275 46.704 153.320 -19.701 89.789 45.813 0.000 0.000 89.934 51.914 107.369 -86.266 87.900 54.700 144.882 -77.192 87.801 48.855 124.873-134.961 88.791 46.731 106.080 -71.554 91.267 47.250 144.020 -46.127 92.326 47.930 137.783-139.849 92.512-100.724 141.158-122.101 111.351-158.524 156.347-143.841 95.764 -42.094 100.594-106.298 95.454 -49.710 111.705 -78.211 92.510 -34.324 131.465 -96.193 96.170-122.953 132.547 -0.849 92.337 -47.159 127.589 -76.123 90.331 -39.284 103.494 -81.516 90.931 -50.368 108.585 -53.241 88.234 -50.678 151.237 -44.328 89.135 -50.109 127.471 -76.058 86.193 -50.939 120.431 -35.952 89.875 -50.903 128.484 -75.344 90.124 -41.826 142.885-154.236 90.230 -48.277 125.104 -18.824 89.514 -62.337 150.657 -33.241 89.463 -59.554 110.256 -83.607 91.952 83.948 104.332 -79.231 92.529 0.000 128.891 -76.639 # 69 total E -1.50024E+02 rmsd from N 0.000 %NC 0.00 93.153 -79.202 123.138 -62.803 117.251-104.367 132.422 -40.884 92.033 46.264 107.474 -80.625 92.762 46.325 130.537 -77.553 95.864 43.738 151.690-143.676 93.404 42.632 55.084 -78.073 89.306 46.902 125.136 -35.532 90.056 55.113 127.855-109.633 85.295 44.858 137.931-136.180 90.645 41.967 76.830-101.586 93.812 41.261 139.931 -83.303 97.081 40.953 101.415 -99.796 90.602 62.072 135.227-124.143 92.277-111.280 112.308-122.009 112.564 131.366 154.320 -23.155 100.471 -82.325 120.664-131.257 108.662-121.519 157.258 157.645 94.710 39.448 141.268-116.938 95.470 48.234 152.388 151.757 100.010 28.855 107.394 -80.792 98.691 37.700 0.000 0.000 100.798 28.026 104.281 -85.954 97.656 40.473 171.429 153.486 95.055 35.597 94.544-127.782 93.252 45.485 113.779 -78.126 90.931 52.961 140.936-106.367 91.171 46.594 142.170 -84.959 92.475 35.431 141.973-124.831 101.091 4.834 151.355 -25.588 137.935-164.676 106.282 -93.915 94.529 51.192 114.899 -76.991 91.702 53.939 101.356 -15.589 89.614 51.358 119.805 -9.207 90.681 46.738 129.916 -77.287 89.900 44.992 103.168 -84.223 90.204 48.875 119.702 -34.516 91.555 48.909 133.165 -55.541 90.772 38.458 129.048 -77.013 93.450 93.383 106.008 -94.189 92.052 -85.690 128.960 -77.557 95.250 -43.918 141.376-126.176 92.843 -45.431 130.705 -50.320 93.541 -61.538 129.407 -85.903 90.990 -62.283 104.644 -87.406 94.739 70.225 104.394 -78.796 92.374 0.000 129.469 -75.862 # 70 total E -1.49893E+02 rmsd from N 0.000 %NC 0.00 92.458 121.244 121.811 -45.248 93.492 53.353 144.046 33.614 94.442 41.618 106.851 -82.396 93.221 45.517 126.654 -73.657 92.903 47.694 137.368 -15.316 89.861 46.476 63.228 -72.878 90.597 47.097 120.378 -38.624 92.266 39.175 134.627-100.121 90.474 54.113 136.777 141.620 87.226 54.889 77.172-106.314 90.339-167.154 126.336 -78.976 96.781 56.387 127.592-150.143 97.021-118.336 100.745 -82.750 97.001-122.266 147.105-178.772 111.357-112.945 156.524 -44.402 94.704 38.520 146.575-134.826 90.782 50.205 132.956 -65.452 90.259 49.484 103.535 -46.033 93.207 43.709 120.089 -96.678 98.185 20.809 142.029-142.348 106.439 29.563 0.000 0.000 95.759 46.921 136.320-112.327 90.573 44.388 129.532-110.645 90.834 42.073 114.404-121.585 90.836 46.643 109.842 -76.970 90.243 48.993 131.538 -88.256 93.537 43.274 131.326-137.114 95.484 35.472 143.445-128.635 100.993 34.214 156.711 -19.094 129.452-170.743 118.957-120.210 97.350 56.438 115.893 -77.126 91.658 48.850 101.710 -9.633 88.506 56.724 108.932 -67.318 89.862 47.299 129.606 -76.853 88.930 41.305 138.127-141.090 90.786 48.075 142.393 -42.361 88.502 51.405 149.813-116.573 88.822 43.402 128.172 -76.887 88.474 49.585 117.205 -54.634 89.840 46.973 127.139 -75.380 90.798 44.596 133.237-120.241 90.704 46.368 128.512 -41.957 90.512 52.469 135.475 -99.855 90.352 43.342 133.160-134.665 95.617 72.128 104.300 -80.619 92.517 0.000 129.019 -76.653 # 71 total E -1.46686E+02 rmsd from N 0.000 %NC 0.00 93.159 161.068 139.774 -95.128 93.755 51.443 149.686 111.836 92.529 46.471 140.430 -23.821 91.370 45.999 130.806 -76.663 93.990 41.233 156.945-148.740 93.704 39.289 125.767 161.218 92.885 46.487 123.681 -44.772 90.625 41.576 138.492 -92.616 93.689 51.811 151.764-160.149 92.183 91.230 103.888-134.873 96.675 -52.186 130.105-133.281 98.304 -61.935 89.584-100.045 84.724 -86.011 142.234 6.038 100.732 -77.209 160.477 -26.954 95.045-112.709 138.106-164.960 94.661 42.374 154.285 156.324 91.999 48.820 134.556 -86.639 90.336 52.889 143.580 -80.223 91.906 46.281 128.026 -48.344 96.288 26.891 108.855 -82.690 100.176 38.686 0.000 0.000 94.453 45.836 135.042 -40.911 89.093 51.379 145.582 -92.999 88.528 48.987 117.013-132.271 88.469 49.888 107.375 -74.983 90.737 47.779 143.034 -86.658 92.536 50.987 131.559-124.854 95.896 9.543 154.231 -21.028 131.565-150.019 118.446 -75.844 95.805 73.096 128.864-152.514 89.714 54.764 113.190 -76.424 89.856 56.856 128.183 -65.233 90.113 46.337 119.692 -30.291 91.202 42.795 128.670 -75.574 90.545 46.183 132.948-121.662 91.752 44.216 128.499-100.929 89.665 49.947 149.552-171.595 89.924 42.681 126.823-101.915 93.009 163.661 89.969 -64.920 92.673 69.570 132.541 -77.906 90.496 48.944 141.300-104.122 91.978 61.833 109.370 -19.993 93.497-100.057 141.248 -49.847 100.403 -27.894 108.385 -85.662 117.632 123.109 108.257 -78.814 92.584 0.000 129.579 -76.287 # 72 total E -1.49060E+02 rmsd from N 0.000 %NC 0.00 93.128 -65.380 128.047 -79.831 94.563 -46.801 115.495 -79.623 90.627 -47.269 103.301 -76.866 90.371 -47.188 128.884 -75.951 91.948 -40.540 138.910-120.890 94.174 -40.695 60.389 -59.969 92.260 -42.929 131.159 18.341 97.631 -45.289 169.211 178.397 90.168 -64.960 118.621-109.135 88.121 -85.734 90.174 -89.979 114.409 137.079 133.838 177.867 114.000 2.170 86.368-107.117 96.301 59.289 107.088 -83.341 91.036 55.470 128.262 -91.547 93.470 37.701 104.410 -89.884 94.203 47.325 140.471 -96.113 95.601 29.856 116.474 -79.319 119.397 -86.852 143.797 -47.823 115.257-124.136 111.812 -73.884 93.793 61.646 149.011-176.765 93.083 44.851 0.000 0.000 92.630 42.165 134.999 -3.639 93.912 44.749 140.362 -85.533 91.722 44.597 134.713-157.008 94.669 178.319 107.484 -76.555 122.563-168.044 167.950 -7.478 118.825-153.047 123.267-137.001 98.548 43.077 142.521-171.629 98.869 101.167 146.232-123.142 100.981-134.315 92.260 -97.419 94.370 48.872 127.244 23.527 91.315 48.828 104.827 5.301 88.924 51.719 124.031 4.019 88.815 51.057 129.320 -76.642 87.137 47.694 137.939-143.868 89.465 47.291 137.593 -33.929 88.701 48.466 151.966 -97.042 89.742 43.582 128.144 -76.883 88.525 50.647 109.206 -39.092 89.465 50.646 128.594 -76.233 90.055 43.150 134.208-102.782 91.152 49.110 127.698 -35.199 92.381 132.325 135.433 -61.729 92.937 67.568 139.735-173.471 94.465 105.752 97.856 -79.799 92.496 0.000 128.938 -76.253 # 73 total E -1.46691E+02 rmsd from N 0.000 %NC 0.00 93.128 -78.106 121.885 -59.437 118.036-104.850 131.815 -37.011 92.838 43.469 108.397 -81.365 93.007 50.074 130.417 -76.680 93.417 39.677 152.766-150.212 92.774 43.055 58.891 -76.906 90.914 44.370 116.533 -34.215 89.483 49.306 143.060 -91.439 89.255 44.573 119.319-106.557 90.381 41.103 81.410 -89.273 94.067 130.956 137.909 -62.766 90.256 89.762 138.197-166.865 90.029-170.026 100.670 -85.829 122.862-170.110 155.571-166.459 111.612-103.931 154.071 -27.098 93.586 46.338 146.079-109.215 92.787 45.640 137.277 -74.372 91.222 46.158 124.871 -57.416 91.671 47.865 132.386 -39.145 90.808 44.295 144.117-162.221 90.938 43.790 0.000 0.000 91.313 48.341 107.661 -80.963 90.881 44.209 143.244 -79.080 92.239 40.489 117.758-121.290 92.222 50.826 110.673 -77.168 93.114 98.136 131.462 -88.057 93.489 27.693 142.061-159.448 95.792 68.416 114.695 -87.798 97.468 -14.674 139.950 -92.350 130.021 -70.419 110.982-106.847 93.252 -40.768 109.389 -77.292 90.057 -65.960 113.691 -31.060 86.684 -51.047 106.812 -67.830 89.394 -42.591 127.392 -76.618 88.848 -49.023 104.121 -80.046 87.080 -56.333 146.127 -32.546 87.523 -46.141 142.288 -98.975 90.090 -45.972 127.288 -76.103 87.948 -48.305 126.544 -5.544 90.053 -51.450 131.132 -77.361 89.986 -43.054 142.114-152.511 93.044-100.434 125.390 -5.750 91.720 67.670 152.584 -19.165 93.537 48.203 153.050 -27.083 95.155 57.722 146.393 -24.274 92.410 0.000 129.163 -76.406 # 74 total E -1.50970E+02 rmsd from N 0.000 %NC 0.00 93.072 -62.913 127.750 -79.250 94.499 -46.926 115.733 -80.015 90.790 -47.108 103.406 -77.830 90.355 -46.536 129.500 -76.119 92.486 -40.327 139.285-120.269 94.589 -42.748 62.169 -55.961 88.554 -41.820 133.905 40.074 97.189 -58.154 158.017-175.836 89.394 -49.376 131.328 -92.971 90.177 124.903 88.666 -72.652 89.798 80.147 153.489-102.210 92.790 35.110 93.233-120.376 97.408 53.303 103.153 -82.912 96.652 -3.549 140.467 -80.515 128.248-176.674 110.106 -87.416 96.997 46.810 147.230 161.550 94.946 42.832 135.916 -84.675 90.802 48.888 132.583 -53.212 91.702 56.271 118.836 -39.123 90.706 42.988 150.679 -17.653 89.913 45.637 0.000 0.000 90.095 58.439 105.332 -86.660 87.444 51.006 140.884 -75.760 88.851 43.994 121.287-127.576 89.287 51.251 111.951 -77.527 89.976 52.198 142.486-106.737 90.747 49.791 134.158-152.431 92.798-110.211 104.207 -83.487 98.336-168.013 148.956-123.831 103.777 -55.813 94.361-104.509 108.647 -23.960 113.619 -79.035 94.583 -44.730 114.228 -50.684 93.323 -44.631 109.687 -75.019 90.652 -49.782 127.693 -76.414 88.120 -44.427 102.127 -80.110 90.380 -43.062 148.152 -25.068 93.524 -48.465 159.628 175.905 91.656 -40.807 128.978 -76.948 94.813-106.484 122.880-101.737 90.649 69.531 130.545 -76.643 92.939 46.407 142.242-118.651 91.835 41.427 138.610 -52.471 91.827 58.046 149.478 160.749 88.294 49.725 136.067-167.051 92.471 113.593 98.763 -79.284 92.589 0.000 128.549 -76.731 # 75 total E -1.47106E+02 rmsd from N 0.000 %NC 0.00 124.695-108.334 145.942 -38.096 116.911-104.256 144.725 -57.785 93.309 44.496 106.982 -80.981 92.227 50.546 130.868 -76.839 93.956 41.690 155.060-156.081 91.338 42.422 57.441 -74.382 90.226 46.953 120.448 -34.104 89.302 50.131 143.309-100.226 89.103 41.744 122.945-114.487 88.641 48.246 76.389 -86.970 90.998 66.847 140.818 -52.958 94.976 21.940 100.152 -99.197 95.839 56.683 114.825 -86.624 95.772 -12.277 123.520-101.500 126.629-161.900 143.993-133.397 94.623 57.051 143.111 131.168 92.431 48.027 133.538 -87.400 89.107 57.837 149.323 17.898 89.149 60.696 141.105 -30.871 87.444 46.554 108.714 -82.273 91.302 43.613 0.000 0.000 91.205 49.870 156.119-160.467 88.751 48.146 166.820-161.797 90.383 44.464 110.774-142.286 90.303 46.692 114.670 -76.924 88.899 49.370 149.271-114.988 90.550 57.568 139.923-158.172 88.781 54.476 140.047-122.186 91.583 177.757 144.307 -33.441 129.305 45.742 121.982-124.449 98.826 29.758 114.859 -78.394 94.484 46.074 137.378 -73.903 93.389 46.907 110.217 -72.951 91.737 41.770 128.264 -76.128 90.044 45.067 114.143 -90.840 91.738 44.095 119.585-100.368 90.495 49.165 132.318 -79.960 89.840 50.138 128.339 -76.998 91.832 77.297 97.501 -76.945 88.631 -89.641 129.000 -76.444 93.278 -42.456 142.994-120.219 88.250 -52.372 112.623 22.321 91.239 -57.146 146.709 -34.088 89.615 -54.002 134.852-113.072 94.237 105.149 104.141 -79.954 120.924 0.000 146.009 -84.597 # 76 total E -1.47015E+02 rmsd from N 0.000 %NC 0.00 93.032 158.062 138.661 -91.136 93.283 51.220 124.902 -28.191 95.747 42.628 108.088 -81.354 93.303 42.640 128.232 -75.209 90.552 49.003 101.771 -71.969 90.187 43.940 87.041 -60.119 90.378 41.583 118.899 -65.372 95.864 35.322 106.527 -92.315 93.069 44.938 134.573 -72.249 90.600 39.815 125.010-122.629 96.145 42.143 116.666-139.482 101.110 19.113 92.828-103.964 100.342 44.678 107.129 -82.454 92.232 47.158 130.890 -90.054 94.544 40.965 103.168 -89.632 96.258 31.539 134.443-103.622 100.048 32.590 135.176 -78.181 140.324 -65.941 140.436 -69.889 135.619-120.831 116.386 -76.748 94.041 61.181 147.526-161.693 92.288 46.253 0.000 0.000 89.421 47.832 137.535 -15.269 91.256 50.740 143.297 -91.807 89.562 43.824 121.557-133.766 87.887 53.869 107.843 -73.611 91.502 48.609 136.778 -38.884 91.890 49.373 136.966-133.903 93.083 35.750 143.117-129.324 108.406-108.867 103.469 -82.055 96.363 -38.499 97.240 -85.385 93.314 -62.329 116.382 -74.670 89.180 -48.461 133.383-156.751 90.823 -56.694 112.757 -73.978 91.704 107.803 130.371 -76.673 94.103 43.236 103.069 -82.576 89.322 66.272 137.486 -24.528 88.040 50.895 147.098 -34.992 88.918 42.958 128.392 -76.690 88.795 55.403 123.459 -27.617 89.149 49.583 129.185 -76.086 88.926 44.756 146.746-136.365 89.610 50.296 131.542 -45.910 89.126 54.599 136.043 -56.948 89.781 44.123 135.779-119.958 94.831 79.686 104.124 -80.444 92.524 0.000 128.909 -76.690 # 77 total E -1.55749E+02 rmsd from N 0.000 %NC 0.00 93.352 -70.747 129.529 -84.517 94.374 -47.666 122.427 -81.464 90.888 -48.359 103.220 -78.273 90.135 -49.032 128.335 -75.675 90.734 -40.256 144.663-143.061 92.482 -44.940 60.964 -51.277 89.389 -43.233 145.682 66.710 96.245 -40.971 167.855 134.500 95.371 -45.343 125.853-118.095 92.902 140.259 83.929 -71.112 93.010 93.827 143.983-102.923 91.431 35.736 96.320-121.396 98.445 54.971 102.340 -83.168 96.401 -7.817 142.759 -78.931 127.571-178.081 109.052 -87.495 97.704 40.829 146.491 150.427 94.045 43.682 136.093 -86.293 90.544 52.597 143.139 -69.583 89.783 53.390 127.157 -36.199 89.431 43.054 145.000-161.359 90.063 45.414 0.000 0.000 90.582 49.930 107.557 -89.679 88.384 54.953 147.849 -82.471 87.664 48.638 120.830-137.718 88.103 51.042 107.188 -72.963 90.028 48.976 139.025 -46.631 91.162 47.677 136.656-138.319 94.519 -98.953 103.876 -83.104 112.682-167.537 153.808 -19.066 97.312 -52.723 97.712-106.705 91.405 -48.821 110.338 -74.541 91.649 -68.499 107.382 -53.008 89.086 108.614 116.523 -76.686 94.474 45.466 128.719 -76.664 89.136 48.590 103.522 -76.097 89.224 62.810 140.735 -41.469 87.478 52.349 157.327-132.156 89.841 38.978 128.153 -76.382 90.903 49.068 116.582 -38.825 89.811 50.085 130.474 -77.678 89.519 48.391 141.134-130.836 88.766 49.470 127.477 -40.266 89.206 60.771 144.103 -98.933 88.338 48.915 137.150-133.399 92.189 96.149 101.978 -80.452 92.572 0.000 128.531 -76.804 # 78 total E -1.48109E+02 rmsd from N 0.000 %NC 0.00 126.403-115.484 142.565 -25.761 127.505 -99.850 128.971 -55.345 95.444 41.998 104.675 -76.243 93.220 41.052 132.723 -79.183 96.747 42.302 152.368-152.671 95.265 42.822 47.834 -70.153 89.381 45.863 155.964 2.292 90.022 51.400 128.283-102.456 89.111 43.761 128.718-114.103 93.716 86.907 87.672-100.833 93.112-145.891 144.059-103.236 94.899 61.101 96.617-118.779 95.415 37.119 106.290 -87.200 91.472 57.745 156.538-139.252 91.007 64.971 117.726-151.544 89.118 49.535 124.164-128.923 96.925-116.777 117.130 -86.491 135.052 -69.391 125.744 34.366 96.229 42.664 131.065 -15.860 92.015 45.936 148.984-165.172 89.060 51.778 0.000 0.000 89.702 45.495 110.090 -83.258 89.921 42.784 144.186 -82.222 91.348 45.301 119.991-127.041 88.713 50.458 114.940 -77.492 89.727 47.643 133.161-105.750 91.395 45.517 127.970-142.000 95.336 -92.280 105.626 -86.560 123.576-175.805 116.615 -77.578 123.906-105.665 117.000-120.555 119.077 7.778 115.762 -80.590 91.955 59.154 115.269 -13.216 88.731 54.058 116.990 -69.924 89.726 47.593 129.801 -77.302 88.788 42.388 103.420 -83.848 89.586 48.104 112.579 -46.711 89.454 54.293 140.337 -48.886 88.201 43.914 128.326 -76.851 89.470 54.716 108.214 -99.266 91.697-108.625 128.440 -76.584 109.322 -42.612 148.888-159.866 112.613 -91.984 144.956 34.152 92.281 64.851 149.522 -21.873 91.228 38.879 142.205-147.534 94.760 82.973 102.493 -80.126 120.961 0.000 146.104 -86.544 # 79 total E -1.46760E+02 rmsd from N 0.000 %NC 0.00 124.187-108.687 147.269 -43.004 125.437 -99.444 130.287 -38.396 95.185 40.148 110.471 -80.568 93.323 46.053 131.809 -77.961 95.952 39.946 151.278-136.576 92.738 46.086 56.128 -80.237 88.843 46.335 122.035 -39.306 90.585 49.400 120.878-102.791 86.701 45.670 135.208-125.247 90.225 59.560 81.708-100.425 90.630-172.341 135.050 -84.380 92.865 74.074 101.563-127.582 94.940 38.765 104.039 -78.919 93.111 44.906 141.543 -35.565 99.827 27.689 106.445 -96.547 98.020 43.927 130.326-111.297 95.220 37.166 140.747 -91.672 99.770-103.862 146.104-168.660 127.967 -98.343 105.739 -85.772 90.920 56.598 148.676-150.564 90.008 52.054 0.000 0.000 88.055 52.146 132.496 -22.002 89.879 46.154 134.612 -88.188 89.307 50.062 126.373-134.769 87.645 69.101 109.467 -74.618 88.094 51.051 135.301 -59.917 91.239 40.559 106.537 104.661 97.681-126.188 105.043 -82.414 114.087-179.308 166.628-159.846 121.702 -97.909 115.016-119.650 95.650 41.324 114.057 -77.306 91.872 48.020 101.992 -9.911 89.673 52.839 126.458 -19.074 88.938 46.880 128.660 -76.338 89.124 43.994 103.501 -83.906 90.630 46.815 121.870 -29.101 91.464 41.270 135.673 -61.173 92.248 44.524 128.396 -76.621 92.200 70.176 113.914 -80.877 89.876-104.242 129.484 -76.887 94.626 -35.837 148.541-170.723 93.084 -79.438 121.369 13.928 92.040 92.102 152.326 -28.531 96.210 47.660 141.604-157.452 96.875 100.152 97.641 -77.980 118.066 0.000 146.305 -78.081 # 80 total E -1.47677E+02 rmsd from N 0.000 %NC 0.00 92.514 127.578 125.042 -51.624 94.711 47.749 137.340 10.697 93.393 43.737 111.190 -80.139 91.596 47.277 128.126 -74.894 90.756 43.916 124.049 -25.077 90.468 46.762 86.502 -57.943 89.098 46.004 119.059 -66.626 92.090 40.980 122.536 -97.861 90.947 43.890 137.340 -30.922 90.914 36.907 124.561-118.911 99.472 42.562 118.071-132.486 101.990 21.763 91.104-100.425 95.559 49.055 139.415-114.523 92.100 52.109 116.101-118.330 89.406 50.024 128.847-131.729 90.561 40.765 125.463-118.499 98.716-148.307 112.324 -71.469 92.991 167.618 131.821 56.853 122.229 -18.924 81.308 -89.571 94.231 -51.156 104.928 -83.556 92.579 -44.258 0.000 0.000 95.803 -40.321 119.323 -80.615 89.507 -54.881 136.213 -94.415 91.012 -44.648 147.036-141.200 89.033 -46.857 112.760 -74.627 89.218 -55.281 135.188 -99.636 90.256 -47.099 155.879-179.959 93.694 -28.953 143.599-133.909 103.060 -43.002 116.411 -85.592 107.282-148.786 103.629 -86.941 104.995 -16.010 111.679 -79.311 93.908-126.059 146.351-150.864 96.095 44.794 127.396 19.422 92.621 51.873 130.154 -76.255 92.030 37.262 101.298 -79.186 91.590 50.084 119.525 -30.369 89.280 49.970 150.182 -36.407 88.820 45.049 128.427 -77.032 88.582 50.842 112.348 -40.568 89.632 47.984 129.560 -76.325 89.368 45.638 148.712-127.880 89.424 48.095 130.346 -43.665 89.182 54.306 136.366 -60.888 89.840 43.846 136.265-126.760 94.862 80.131 104.020 -80.550 92.535 0.000 128.896 -76.711 # 81 total E -1.46375E+02 rmsd from N 0.000 %NC 0.00 92.605 76.626 136.285 -89.063 94.136 51.313 158.272 136.412 93.047 45.078 146.101 -27.507 91.586 48.258 130.433 -76.419 91.029 43.163 143.083-127.460 93.023 45.072 130.150 178.549 92.389 89.109 102.028 -55.002 85.346 -75.744 131.502 -87.520 95.108 -52.609 89.066 -53.178 89.588 -23.847 142.028 -31.971 107.568 -43.276 155.044 173.747 100.879 -46.438 98.920-113.585 91.631 135.772 103.277 -83.114 95.133 97.409 127.038 -65.827 95.636 27.255 145.542-137.487 96.780 52.939 132.189-121.022 96.435 8.720 120.488 -74.462 112.772 152.432 141.864 -42.894 95.668 48.133 106.110-175.373 98.352 39.504 108.284 -82.267 112.731 15.124 0.000 0.000 94.878 47.815 156.241-164.803 93.928 39.639 115.921-121.587 91.524 47.926 115.455-120.902 88.880 49.863 116.013 -75.395 90.274 49.364 128.661 -98.749 91.574 45.379 135.315-144.908 93.864-111.298 104.042 -82.369 99.222-128.813 154.069 -20.568 99.349 -40.948 102.354-105.114 94.065 -48.177 111.713 -76.244 93.393 -58.393 105.811 -69.429 90.912 108.587 112.897 -72.985 92.393 45.136 128.732 -76.272 88.411 52.505 139.252-132.908 89.895 47.740 137.837 -33.623 90.388 42.692 142.283 -98.282 91.533 41.217 128.233 -76.829 90.081 52.397 103.441-110.253 89.318 54.438 129.239 -76.920 89.737 36.609 136.603-142.786 93.918 78.092 129.393 -45.125 92.055 -65.348 142.808 -53.245 103.568 -58.901 137.061-120.376 96.160 135.750 102.487 -77.137 92.553 0.000 128.634 -76.058 # 82 total E -1.47493E+02 rmsd from N 0.000 %NC 0.00 93.272 -70.280 126.670 -71.304 119.074-103.027 131.205 -34.551 92.717 42.819 109.379 -80.659 93.339 51.336 131.484 -76.915 93.702 38.662 151.870-141.604 91.662 43.713 64.261 -91.927 89.735 47.302 111.075 -51.324 89.080 50.007 138.668 -87.210 88.631 41.158 122.831-111.982 91.892 44.677 86.102 -94.248 93.756 125.877 135.631 -80.465 90.844 73.279 134.336-162.310 96.288 117.714 98.303 -84.438 112.010 -17.908 119.852 -76.994 105.251-126.649 150.528 -49.298 94.186 43.357 149.132 159.354 93.615 44.025 137.235 -82.595 90.667 47.652 139.961 -40.754 90.628 55.469 134.329 -50.246 87.511 44.639 142.453-157.602 90.993 42.627 0.000 0.000 91.658 46.345 111.785 -82.110 90.427 45.777 140.358 -82.961 91.148 42.757 120.354-125.207 90.869 48.301 116.697 -74.537 92.615 42.486 127.644 -94.817 95.076 49.474 135.001-141.200 139.673 -84.990 111.030 -83.726 123.209 136.655 167.436-158.182 132.324 -59.302 111.254-106.335 104.224 -23.773 112.768 -78.794 93.021 -50.417 113.629 -44.931 92.020 -43.476 113.525 -72.499 91.492 -47.779 127.637 -76.154 88.436 -44.247 101.217 -79.372 88.479 -56.079 134.922 -57.077 88.488 -52.744 151.008-141.628 88.803 -47.078 127.690 -76.287 93.454-122.391 127.488 -23.313 89.581 58.631 132.757 -77.585 91.493 44.457 145.350-136.773 92.729 79.057 131.035 -41.326 91.270 -70.861 146.029 -52.913 102.285 -52.511 105.304 -80.081 94.918 140.573 98.232 -70.935 92.581 0.000 128.412 -76.315 # 83 total E -1.46688E+02 rmsd from N 0.000 %NC 0.00 93.415 172.504 140.996-103.955 93.872 52.184 135.395 31.214 91.495 47.972 104.984 -76.800 91.331 46.070 131.379 -77.776 95.114 43.896 141.885-126.265 93.250 40.418 50.182 -70.857 91.017 45.508 166.922 102.975 91.903 48.588 130.934 -95.965 90.206 37.243 135.195-120.683 97.050 96.866 87.458-104.168 94.866-142.280 150.402-119.071 93.422 58.536 96.290-120.913 95.132 38.451 104.719 -86.397 91.983 52.447 158.053-133.488 90.932 47.311 125.460-146.490 92.701 58.516 122.610-121.490 95.199 -61.956 137.638 -80.643 119.446-162.657 146.641 -75.506 97.024 47.995 129.368 98.202 94.355 40.721 151.788 -19.997 91.711 46.382 0.000 0.000 89.525 54.734 148.011-169.343 88.952 46.828 133.250 -94.788 91.347 40.200 121.529-123.975 89.962 53.372 119.564 -74.464 89.132 49.281 133.222-108.664 91.983 45.640 130.636-130.471 95.668 -90.099 153.572 -29.338 118.177-160.704 114.452 -74.674 136.127 170.163 112.702-105.297 108.738 9.953 117.913 -79.243 94.013 69.271 135.616-112.585 96.348 27.684 114.121 -73.218 95.234-104.193 128.971 -74.616 93.696 -31.436 103.588 -91.430 91.358 -56.267 101.548 -67.299 86.237 -52.060 144.113 -37.910 90.768 -52.098 129.256 -76.492 93.175-140.228 99.633 -55.901 90.489 56.168 131.689 -76.381 89.984 51.705 142.016-113.848 90.603 59.447 123.307 -23.687 91.863-107.991 147.136-105.888 100.499 -17.451 136.742-141.490 115.486 124.420 155.847-145.757 92.654 0.000 129.593 -76.662 # 84 total E -1.48053E+02 rmsd from N 0.000 %NC 0.00 93.126 157.034 140.396 -97.641 94.232 52.104 128.719 48.352 90.714 48.440 106.758 -75.972 91.970 43.891 130.001 -77.667 93.474 49.098 150.930-149.096 94.645 39.051 54.603 -65.113 91.184 49.232 133.475 -12.912 90.220 48.848 125.977-123.905 88.798 51.402 137.432-169.221 86.977 58.133 76.205-104.247 88.118 98.694 131.778 -76.892 93.912 41.438 94.972-106.369 95.027 56.192 108.595 -83.506 95.285 -5.139 139.327 -96.263 122.098-176.103 107.337 -88.198 98.943 40.764 149.349 123.010 94.992 43.605 135.797 -85.046 92.151 46.020 133.437 -47.337 92.396 49.183 116.264 -25.397 89.470 46.164 153.676 -15.124 89.445 48.254 0.000 0.000 89.896 51.666 115.141 -80.523 89.153 43.315 145.016 -82.490 88.993 47.782 120.215-128.021 87.810 59.189 107.782 -79.398 88.655 56.041 145.373 -98.771 88.495 34.118 125.679-160.016 98.637-100.003 150.833 -29.000 120.040-178.435 164.805-157.372 98.343 -60.184 92.888 -93.177 88.978 -53.270 112.150 -75.399 91.355 -45.071 116.685 -12.697 91.109 -45.729 112.603 -69.686 91.081 -42.158 127.221 -75.845 90.364 -44.787 139.554 -39.137 90.309 -46.659 147.532 -42.338 89.383 -44.597 151.390-126.385 90.257 -47.674 133.874-105.710 88.669 -57.140 133.208 -4.645 90.351 140.575 131.723 -77.036 92.362 50.288 142.539 -95.782 91.755 41.399 113.941 -33.718 93.360 52.024 146.653 -37.875 90.650 48.760 110.618 -91.623 93.553 86.809 102.210 -79.114 92.561 0.000 128.779 -76.734 # 85 total E -1.49722E+02 rmsd from N 0.000 %NC 0.00 92.467 125.423 124.256 -50.327 94.886 46.942 145.971 9.452 92.498 46.249 107.123 -82.812 92.163 50.040 128.435 -76.067 90.984 44.708 126.337 -29.838 94.380 39.887 68.398 -68.738 93.099 42.429 118.927 -34.808 108.382 15.043 104.090 -78.615 96.951 40.336 145.571 -41.353 98.801 28.784 86.120 -99.635 96.200 44.935 145.970-137.961 102.339 16.028 86.128-107.080 97.364 52.693 136.830-110.744 91.349 90.323 122.696-116.106 92.485 36.154 128.436-127.724 95.056 47.791 138.450-106.627 99.879 -4.721 122.719 -83.627 122.562 158.029 136.680 -82.161 114.186 41.563 113.293 125.289 97.694 42.402 147.587 -48.571 99.492 38.620 0.000 0.000 93.313 43.473 150.344 -8.210 94.420 46.854 132.625 -82.785 89.809 46.459 131.014-127.137 89.717 46.502 107.579 -77.550 91.187 52.666 140.368 -50.273 91.026 40.941 137.443-144.102 94.170-129.929 140.099-108.640 98.526-179.409 150.269 -8.509 122.196-120.842 116.817-121.515 93.518 48.446 114.187 -76.729 92.113 46.245 103.479 -40.296 90.973 49.099 129.664 -29.363 90.670 42.965 128.649 -76.383 91.184 46.209 101.838 -83.477 90.852 46.380 127.789 -64.514 92.188 53.490 129.126 -76.498 92.872 71.292 129.914 -77.737 96.892-169.599 103.379-117.621 92.626 51.725 130.647 -76.683 91.160 46.822 141.370-110.547 88.715 63.736 138.265 -27.173 88.930 67.311 149.966-112.789 86.434 37.092 130.662-172.137 95.720 91.550 102.768 -79.169 92.449 0.000 128.937 -76.384 # 86 total E -1.49629E+02 rmsd from N 0.000 %NC 0.00 122.994 -92.492 149.640 -61.740 94.825 -49.343 115.860 -77.073 91.104 -45.511 103.753 -77.606 90.563 -47.512 128.502 -76.170 90.955 -41.004 134.762-116.315 94.470 -40.758 67.985 -67.487 92.856 -33.095 124.682 -34.663 106.817 -30.444 165.310 168.971 95.650 -49.041 137.634 -56.670 90.008 160.456 96.550 -68.349 94.267 74.928 152.309-155.999 96.497 29.988 91.441-124.858 96.517 43.638 106.131 -81.931 91.784 53.739 136.182 -42.748 91.047 47.145 113.452 -85.794 90.574 47.836 142.315 146.784 93.983 32.878 121.586 -94.503 98.343 178.784 148.485-112.208 129.152 36.418 100.010 143.879 97.541 46.088 108.742 -82.650 97.150 38.088 0.000 0.000 93.466 47.190 154.788-148.900 91.386 44.930 122.225-129.151 90.336 42.420 113.909-125.601 90.817 49.176 115.070 -74.364 90.468 52.335 149.847-115.998 92.361 67.760 126.880-153.398 89.930 -83.601 106.131 -87.555 95.258 -51.169 116.858 -84.379 100.488 -99.419 101.650 -85.583 94.067 -39.222 118.621 -79.195 95.891-116.306 125.834 -33.303 91.910 51.465 135.248 -40.262 92.812 50.682 129.206 -76.021 90.781 42.052 104.965 -80.602 90.407 51.410 142.827 -32.038 89.276 49.630 145.167-101.373 90.418 39.469 128.336 -76.887 91.077 46.994 120.170 -54.546 90.502 48.916 129.819 -76.926 90.022 45.193 140.104-118.265 89.941 45.081 129.659 -44.332 90.553 54.101 135.746-106.771 89.682 42.348 130.880-127.035 95.460 75.211 103.841 -80.591 92.539 0.000 128.929 -76.690 # 87 total E -1.50224E+02 rmsd from N 0.000 %NC 0.00 93.224 168.839 138.131 -92.291 92.806 58.388 147.542 18.624 92.940 43.649 106.096 -82.898 92.117 50.399 131.866 -77.106 93.268 42.211 142.502-117.643 90.085 44.571 63.656 -79.463 90.134 46.189 117.632 -50.665 92.061 43.521 126.166 -95.345 88.880 44.060 143.423-139.283 91.170 50.028 79.045-103.762 91.147 146.553 136.713 -87.295 94.302 86.856 125.988-150.209 92.513 103.649 100.302 -85.514 93.280 -68.818 131.624-101.127 99.903-121.064 151.389 -36.449 91.638 50.130 138.235 127.815 91.170 47.989 136.603 -83.718 90.243 48.281 130.423 -51.048 90.762 48.065 128.688 -24.054 90.156 45.523 109.859 -82.851 89.052 48.552 0.000 0.000 88.843 56.815 109.191 -80.822 87.315 44.217 139.805 -81.506 89.850 45.900 119.851-125.300 88.675 55.318 111.773 -77.462 88.580 54.345 142.744-109.556 90.384 39.834 130.817-135.846 96.607-101.932 143.495-125.557 114.724-174.812 152.912 -17.962 109.310 -90.646 94.883 -95.620 118.683 17.471 117.585 -79.884 91.564 -69.091 103.791 -51.449 90.462 -25.900 121.055 -73.899 100.959-119.440 128.402 -75.820 84.643 65.406 100.751 -82.164 89.733 69.246 138.264 -45.321 88.383 52.968 165.155-143.238 89.320 39.216 128.272 -76.640 90.861 52.183 126.174 -53.177 90.107 48.383 128.840 -75.910 90.254 44.650 142.371-144.693 90.759 45.362 128.002 -43.129 91.102 52.175 135.881 -94.574 90.398 43.582 134.767-138.555 95.540 72.503 104.177 -80.493 92.560 0.000 128.960 -76.630 # 88 total E -1.49547E+02 rmsd from N 0.000 %NC 0.00 93.104 -69.583 125.824 -67.475 122.063-103.447 130.413 -36.968 93.467 41.723 109.787 -80.246 93.515 50.357 131.127 -76.912 93.807 39.585 154.933-143.603 90.859 43.745 66.497 -93.297 91.421 44.025 110.282 -57.482 92.189 42.109 142.611 -89.835 89.837 45.416 144.514-149.578 89.291 48.622 80.896-107.004 91.043 166.189 140.194-100.923 88.365 71.959 107.346-155.968 91.832 45.125 97.048 -80.195 93.127 45.075 140.052 -37.916 92.756 41.401 117.956 -89.937 92.604 46.736 129.141-118.222 92.903 41.561 123.260 -88.879 95.463-107.699 148.784-171.044 123.737 -84.184 80.626-104.961 86.189 77.512 112.624 -79.344 87.591 61.581 0.000 0.000 88.932 47.802 126.830 -42.214 89.498 46.324 141.665 -81.512 89.287 53.696 122.020-130.129 87.937 52.503 109.630 -77.838 89.674 49.937 150.206-110.883 90.665 46.654 139.255 -99.361 94.580-104.408 104.250 -83.500 113.389-175.772 158.471-145.724 131.252-159.518 110.989-107.253 96.940 42.769 115.121 -77.404 92.871 46.386 101.644 -6.414 91.744 46.433 118.528 -0.384 89.592 49.730 130.742 -77.318 88.920 45.629 104.120 -84.185 89.328 46.086 119.467 -27.419 89.665 48.174 140.334 -50.153 89.510 45.676 128.443 -76.862 87.867 52.474 110.325 -41.076 90.011 46.832 126.999 -75.708 90.952 45.836 136.906-165.415 92.477 79.092 133.016 -55.693 88.807 -86.148 133.229 -68.128 96.412 -38.390 136.258-136.164 109.233-115.740 147.520 -18.742 93.039 0.000 129.261 -76.743 # 89 total E -1.49268E+02 rmsd from N 0.000 %NC 0.00 125.840-108.047 143.374 -27.143 120.477-105.119 131.347 -40.293 93.622 41.662 107.682 -81.778 93.170 51.201 130.392 -77.242 91.338 44.284 154.358-165.156 88.937 49.892 66.967 -76.423 89.871 45.291 108.070 -48.437 88.276 49.208 145.945 -74.217 89.889 42.168 113.232-106.450 91.576 46.077 91.939 -90.352 93.579 107.072 140.896 -88.079 89.517 74.966 134.648-163.287 92.041-170.927 101.227 -85.713 156.028-140.676 176.448 179.311 94.064-124.984 148.590 -43.148 95.279 49.494 153.282 153.112 93.203 50.243 136.731 -83.499 92.296 44.883 110.328 -15.775 93.960 42.646 147.008 56.853 94.475 43.430 155.479 -13.181 91.144 47.798 0.000 0.000 90.038 54.052 136.937 -19.160 89.177 51.097 146.375 -83.418 90.185 42.194 121.285-132.968 89.237 54.564 110.989 -74.016 89.690 60.800 131.992 -36.358 89.308 36.766 140.161-147.593 94.618 51.944 113.540 -88.902 97.549 -35.535 137.099 -89.733 130.344 152.058 108.313-101.921 128.453 71.679 139.523 73.928 93.195 93.635 135.258-107.722 97.821 -6.992 116.396 -77.421 95.095 -86.228 126.698 -74.977 86.386 -49.304 104.328 -81.533 88.955 -56.500 110.938 -60.325 85.778 -49.636 138.071 -55.243 89.797 -49.238 127.092 -75.074 87.680 -48.274 117.388 -45.344 89.335 -48.978 130.407 -77.094 89.505 -45.405 146.254-144.968 87.692 -53.526 129.676 -26.386 87.779 -56.424 152.459 -18.061 90.787 -46.005 143.965-167.692 95.273 91.107 105.171 -80.047 92.499 0.000 128.985 -76.408 # 90 total E -1.50353E+02 rmsd from N 0.000 %NC 0.00 93.038 155.121 139.524 -92.724 93.116 56.778 132.277 51.341 91.920 42.385 106.723 -83.133 91.772 50.827 130.174 -76.271 89.886 45.133 154.556-164.965 92.061 42.373 64.794 -69.575 90.900 46.019 132.474 -44.264 87.091 56.930 140.562-107.849 88.027 63.116 113.789-110.051 84.012 166.139 88.854 -90.725 95.720 67.034 143.099-158.582 93.898 36.911 92.940-120.736 94.407 44.488 103.101 -80.506 94.512 42.198 144.397 -41.334 93.091 48.045 141.031-129.987 92.287 34.717 123.059-119.256 99.786-153.819 115.551 -67.100 91.670-154.512 131.584 53.015 100.468 -41.819 142.135-102.698 95.868 -37.812 106.093 -80.624 102.292 -26.853 0.000 0.000 103.368 -27.556 134.024-100.315 100.528 -39.657 129.968-104.756 92.779 -46.630 121.163-136.795 89.861 -46.900 116.412 4.480 91.747 -44.175 148.585 -35.576 94.160 -45.980 141.778-159.479 94.236 -61.638 143.249-125.581 109.961-171.421 153.370 -7.700 123.646 -11.778 109.505-109.257 101.575 -34.635 111.437 -78.927 93.913 -43.542 108.919 -57.487 90.666 -47.876 113.256 -71.075 91.384 -43.969 127.389 -75.811 89.335 -44.972 103.352 -87.478 88.696 -58.862 110.148 -73.997 86.499 -52.928 150.432-126.068 90.021 -45.674 127.404 -75.885 93.877-124.860 125.229-123.344 90.865 55.045 131.705 -76.280 90.765 47.116 140.910-109.749 91.075 59.973 124.014 -18.537 92.076-103.036 138.988 -52.167 101.679 -37.697 130.739-122.499 114.942 104.304 106.258 -77.251 92.501 0.000 129.771 -76.536 # 91 total E -1.47710E+02 rmsd from N 0.000 %NC 0.00 125.760-111.490 143.498 -28.073 123.568-103.613 127.543 -45.020 93.035 44.736 108.601 -79.579 93.457 43.691 129.690 -77.038 95.679 44.043 154.314-160.349 94.020 40.990 53.949 -75.534 91.998 43.733 127.568 -30.389 91.691 45.263 135.386-113.122 88.917 52.815 144.170-178.700 87.440 49.705 79.029-106.463 91.160 165.652 133.999 -88.122 92.227 69.359 106.350-139.401 95.883 35.661 97.808 -82.576 93.756 48.255 139.430 -35.482 91.723 46.797 108.220 -99.074 90.692 47.780 128.686-125.982 92.144 44.980 125.247 -80.954 95.761 -95.532 143.474 -94.327 126.359-114.588 117.471 -77.836 91.304 58.914 154.953 -21.539 90.730 51.552 0.000 0.000 88.405 50.037 134.701 -24.417 88.922 53.312 139.023 -96.638 88.357 59.240 127.416-151.226 85.090 66.791 110.397 -75.622 87.771 57.558 145.476-104.138 90.585 44.611 129.681 -48.592 95.588-104.996 148.752 -28.291 108.331-173.264 152.824 -16.637 105.988 -56.865 96.901-104.536 118.111 -11.553 115.795 -80.115 93.369 -50.819 110.702 -52.736 91.971 -42.610 112.567 -71.298 93.317 -46.504 124.679 -74.736 88.721 -40.463 99.977 -81.931 92.372 -45.534 126.231 -21.231 91.550 -49.109 148.684 -21.345 90.990 -46.615 129.976 -77.593 95.484 136.514 137.228 28.924 95.933 -93.782 130.252 -76.823 118.572 -26.691 150.694-145.918 109.409 -96.321 126.431 12.027 92.464 66.561 155.461 -23.188 90.725 44.336 142.084-156.468 94.094 102.842 98.773 -77.208 122.731 0.000 145.310 -89.615 # 92 total E -1.47643E+02 rmsd from N 0.000 %NC 0.00 123.766 -93.901 147.613 -37.291 125.387-103.606 131.480 -49.862 93.455 41.920 109.127 -81.319 93.733 50.487 129.976 -77.614 92.076 47.856 154.862-178.292 89.018 50.099 74.520-101.474 89.829 43.260 100.591 -59.768 88.571 54.518 151.166 -68.159 87.707 45.750 115.690-109.926 90.068 43.269 76.793 -85.339 93.664 121.965 143.233 -50.798 90.851 75.662 136.867-165.162 91.592-147.325 100.085 -85.479 137.456-160.753 155.763-164.923 100.697-130.972 151.254 -36.127 95.543 44.769 141.293 146.242 92.549 46.368 136.523 -84.256 91.091 48.836 117.918 -19.790 91.315 47.004 153.636 70.034 93.298 41.580 151.705 -22.512 92.223 43.950 0.000 0.000 90.409 55.497 141.768 -22.791 88.840 55.318 144.410 -83.232 89.904 41.274 122.768-132.516 89.553 51.303 109.388 -73.376 89.952 63.477 137.383 -46.284 89.613 41.852 141.337-145.351 93.107 47.020 115.809 -89.928 99.607 -33.567 120.139 -89.644 129.922 159.819 112.747-108.221 102.298 50.988 132.967 122.968 93.694 92.141 133.591-102.584 98.067 -15.864 117.846 -79.608 96.588 -85.111 127.414 -75.069 86.986 -52.895 102.610 -79.747 88.557 -55.791 120.197 -64.545 87.614 -44.788 132.228 -61.887 89.382 -50.141 127.231 -74.563 88.870 -49.398 119.740-105.566 90.970 -53.385 130.449 -75.794 93.256 -14.373 139.890-134.420 111.650 166.573 127.269 -32.294 120.037-134.942 156.981 -24.386 100.144 40.026 111.218 -82.869 100.826 36.359 104.135 -73.317 92.437 0.000 129.253 -76.454 # 93 total E -1.48505E+02 rmsd from N 0.000 %NC 0.00 124.530-106.922 146.235 -37.497 122.399-101.354 133.463 -32.036 94.916 38.782 106.929 -79.482 93.151 52.266 131.572 -77.126 92.693 38.944 149.675-148.076 91.951 45.098 60.380 -79.619 88.959 47.196 115.531 -41.290 88.917 52.810 137.050 -95.881 86.394 42.307 124.725-121.110 90.643 46.004 79.879 -92.760 90.805 53.322 141.947 -74.027 96.943 28.823 95.453-100.766 93.409 54.248 114.949 -87.064 92.459 40.317 119.984-100.720 101.198-142.626 138.804-122.529 95.744 82.823 138.323-107.205 118.169-133.647 153.399 -62.555 142.122 -16.692 147.987 97.047 97.224 52.497 142.782 -20.219 93.938 42.342 142.359-150.090 91.687 46.553 0.000 0.000 93.232 44.621 104.980 -84.686 89.977 43.977 174.786-171.417 91.505 43.871 104.859-135.834 90.255 46.417 111.158 -76.673 90.318 51.369 149.399-110.770 91.281 42.148 145.154-131.329 93.243 40.980 115.130 -89.709 98.177 -2.864 117.165 -85.505 138.755-161.048 102.481 -86.532 93.407 51.549 114.528 -76.591 92.082 51.980 101.422 -13.116 90.513 47.256 123.849 -1.848 90.525 47.398 130.969 -77.554 90.081 43.986 103.348 -84.714 89.852 48.717 119.184 -27.313 89.988 47.895 133.376 -56.937 90.041 44.459 129.968 -77.616 89.810 62.562 113.592-104.385 92.203-172.908 128.103 -76.731 94.714 98.799 140.532-113.053 95.352 86.101 126.791 -31.323 92.234 -87.976 146.028 -40.550 95.286 -33.906 111.939 -84.302 109.786-158.788 103.053 -75.357 92.936 0.000 129.465 -76.199 # 94 total E -1.47318E+02 rmsd from N 0.000 %NC 0.00 123.224 -99.873 148.402 -46.125 125.368-101.716 130.521 -41.211 93.993 40.678 110.035 -80.519 93.448 49.326 130.882 -76.775 94.682 38.577 155.119-153.751 93.152 42.868 64.162 -90.976 91.158 43.315 112.985 -53.870 90.088 48.859 138.008 -88.690 90.767 41.257 115.249 -97.050 91.033 42.517 102.501 -93.329 94.899 41.717 135.685-106.876 96.802 49.775 107.667-110.472 93.884 104.881 112.622 -95.140 117.500 -33.264 138.315-124.188 114.975-114.402 154.371 -25.340 96.479 43.009 143.655 63.865 92.151 45.711 137.099 -80.469 89.776 53.542 126.484 -71.551 92.922 51.827 141.580 -34.035 91.167 39.127 155.374 -6.607 91.462 46.435 0.000 0.000 90.935 57.583 104.121 -82.817 87.693 48.619 150.386 -78.326 90.589 39.747 116.524-129.365 90.467 52.419 109.917 -76.230 89.263 65.339 142.402 -98.204 88.770 39.141 138.664-133.375 93.046 47.871 113.952 -89.511 96.284 11.235 140.343 -95.875 122.964 152.854 116.605-117.557 94.472 46.624 129.337 150.793 93.941 113.155 130.062 -87.484 90.148 -51.751 114.708 -75.862 90.982 -50.781 126.598 -75.480 87.198 -45.411 103.524 -79.020 89.227 -51.871 140.414 -37.068 88.359 -45.308 137.892 -78.990 90.389 -47.721 127.646 -76.309 88.329 -47.591 123.258 -15.402 89.931 -49.046 129.946 -76.905 89.624 -44.549 147.245-148.559 88.661 -50.704 126.221 -14.504 89.448 -52.612 152.213 -22.452 91.204 -44.842 145.980-158.284 96.265 123.070 105.443 -79.894 123.061 0.000 144.277 -88.266 # 95 total E -1.52246E+02 rmsd from N 0.000 %NC 0.00 93.150 163.135 139.395 -94.755 93.413 55.838 135.469 44.831 91.634 45.653 105.979 -81.650 91.969 47.459 129.846 -76.826 92.519 46.964 151.013-146.450 92.606 40.545 59.195 -71.171 92.824 43.455 125.590 -30.955 92.643 42.021 133.971-109.251 90.473 53.440 143.594-172.315 87.435 53.768 78.633-104.194 91.275 163.070 126.974 -78.846 92.875 69.247 129.186-153.895 94.582 38.694 98.098 -81.726 93.418 49.567 147.312 -28.828 91.411 39.900 139.594-132.474 93.016 52.756 122.457-129.012 92.528 42.677 130.712 -77.061 92.956-119.006 134.342 -79.804 95.583 -47.511 139.490-117.653 95.784 137.965 142.425-150.774 99.042 39.460 0.000 0.000 91.063 49.758 139.547-101.381 91.106 44.442 130.055-112.790 89.813 44.441 116.467-123.620 89.969 46.571 112.278 -80.373 90.600 48.397 138.053-105.706 92.048 49.557 130.545-132.757 93.116-103.340 103.138 -82.595 108.155-175.704 150.732 -17.576 130.419-162.459 110.988-107.586 96.249 43.679 115.014 -77.246 94.250 42.538 105.256 -16.241 93.836 43.342 129.315 -9.747 90.152 48.261 129.898 -77.304 88.701 49.416 102.001 -85.014 90.449 44.799 130.508 -39.343 91.998 39.934 133.004 -80.260 93.378 44.329 128.681 -77.163 91.926 54.897 110.105 -80.454 92.362-155.175 129.128 -77.399 94.912 14.338 140.784-114.859 104.331-114.622 129.609 -7.850 125.113 118.823 160.340 -9.517 96.154 76.958 140.293 178.985 96.333 73.930 98.696 -78.284 92.473 0.000 129.186 -76.376 # 96 total E -1.52082E+02 rmsd from N 0.000 %NC 0.00 93.198 160.249 141.950-102.926 93.730 51.655 142.290 39.592 91.060 47.481 105.990 -82.318 91.639 51.508 130.242 -77.546 94.055 46.939 149.075-135.683 92.342 41.515 64.508 -85.790 90.143 48.182 123.840 -58.817 90.026 62.516 129.606-112.902 86.015 58.475 139.271-171.378 85.670 165.649 79.499 -92.943 93.846 63.758 155.559-151.022 94.585 38.181 94.272-123.237 93.452 44.866 101.540 -80.732 92.043 56.313 140.431 -41.218 90.676 41.400 106.178 -92.919 94.027 41.027 137.300-101.249 100.418 -4.244 121.732 -73.013 134.154 157.033 121.992 -44.693 104.871 36.980 144.583 150.127 96.891 43.371 146.376 -33.633 111.314 17.565 0.000 0.000 97.612 44.168 150.415 -5.272 94.187 44.133 170.286-161.734 90.957 50.321 115.852-151.734 89.976 44.872 107.934 -74.169 91.151 48.940 142.923 -43.230 92.682 43.798 138.535-143.897 93.302 49.658 152.202 -22.093 97.045 28.040 113.510 -86.890 140.072-169.045 104.090 -87.747 94.718 47.133 115.076 -76.991 91.716 49.773 98.268 -9.600 89.129 52.061 115.264 2.629 90.266 47.738 129.911 -76.755 90.212 41.004 103.923 -83.534 90.179 48.786 120.340 -26.658 89.146 52.644 143.568 -45.615 88.509 44.701 128.403 -76.930 87.881 51.833 116.540 -54.427 89.895 47.799 126.672 -75.125 90.252 45.446 140.099-105.135 90.579 46.473 128.378 -41.917 90.910 52.041 135.532 -99.819 90.428 43.516 136.459-133.053 95.606 71.780 104.336 -80.947 92.517 0.000 129.013 -76.651 # 97 total E -1.48801E+02 rmsd from N 0.000 %NC 0.00 92.964 153.677 139.475 -91.619 93.170 54.998 139.630 45.500 91.690 46.838 106.486 -82.251 91.876 46.318 130.682 -77.410 95.006 45.388 152.247-137.886 92.467 42.078 58.126 -75.033 90.947 45.982 129.050 -42.926 92.112 47.484 127.596-113.703 88.159 52.149 137.636 177.704 88.657 133.290 80.870 -99.114 94.991 60.771 140.970-115.230 92.745 43.673 99.250-118.060 94.374 63.814 106.241 -85.707 94.421 -81.814 138.938 -99.157 114.696-115.266 142.160-156.266 94.670 44.496 140.161-115.094 93.520 46.676 135.814 -76.373 90.994 47.608 126.217 -53.920 91.759 49.442 93.046 -99.997 89.792 45.406 133.799-172.326 90.103 47.276 0.000 0.000 90.595 50.011 106.732 -81.081 90.507 43.053 139.349 -76.812 91.925 48.389 136.098-151.537 95.256 121.193 111.614 -78.992 112.801 -99.939 153.343-119.778 122.405 -89.393 125.746-155.849 97.032 45.089 152.114 -20.226 110.949 117.286 147.608 -19.607 97.034 -39.613 96.620 -98.663 92.894 -53.968 114.976 -77.905 94.717-120.110 124.845 -71.975 88.584 54.618 141.365 -6.975 91.240 48.057 128.530 -75.744 88.951 46.660 143.358 -25.839 90.194 49.112 132.254 -33.768 89.296 46.672 139.544 -81.123 91.134 40.937 128.091 -76.921 90.845 48.027 118.018 -69.338 90.270 50.164 130.694 -77.703 89.249 46.102 140.908-131.394 89.286 48.988 129.967 -40.711 89.909 53.429 138.012 -49.506 89.899 45.235 145.312-141.576 94.038 87.078 142.502-121.492 92.602 0.000 129.034 -76.665 # 98 total E -1.50273E+02 rmsd from N 0.000 %NC 0.00 122.772 -95.301 150.497 -72.640 94.725 -48.333 117.517 -78.944 90.862 -46.841 103.365 -77.159 90.165 -48.773 129.096 -76.383 91.553 -38.423 139.718-125.297 93.994 -44.169 64.700 -69.464 91.143 -33.211 126.839 -9.495 107.430 -34.042 167.559 129.376 94.233 -45.438 130.408-115.014 94.967 142.762 87.494 -85.154 93.582 59.141 143.617-111.673 95.644 47.817 93.283-109.329 96.730 110.189 106.827 -84.468 137.245-113.518 149.905 -93.555 109.511-102.090 139.658-148.225 93.225 51.519 144.240 137.185 91.679 45.654 135.669 -88.059 90.162 52.637 158.938 -86.845 89.424 47.479 143.931 -34.105 89.970 44.951 143.307-138.336 90.828 46.640 0.000 0.000 89.271 51.480 149.162-148.945 88.708 44.455 123.566-115.546 90.397 45.038 119.468-129.609 88.379 54.189 112.341 -73.522 89.205 46.197 136.683 -97.046 91.661 49.207 132.646-167.173 94.780 -83.710 105.860 -87.445 125.100 166.659 116.967 -77.556 128.651 -29.015 114.132-112.761 104.673 -56.181 109.363 -79.723 89.187 109.281 117.225 -53.145 91.605 57.921 110.871 -72.556 91.663 42.928 130.167 -77.728 90.714 41.452 104.066 -83.918 91.099 48.245 118.517 -45.565 91.222 46.046 137.259 -57.034 91.138 40.439 128.443 -76.800 91.963 51.199 105.938 -88.256 94.501-117.769 128.093 -76.530 116.761 -12.475 150.010-136.996 125.614 -85.031 134.855 -20.130 94.206 64.012 148.250 -29.101 92.753 42.722 147.452-152.064 96.109 73.041 101.944 -77.024 117.486 0.000 146.699 -79.069 # 99 total E -1.48133E+02 rmsd from N 0.000 %NC 0.00 93.300-137.243 131.119 -75.846 93.865 59.875 134.308 72.196 94.093 41.543 105.941 -74.183 93.345 42.008 131.923 -77.783 95.809 40.049 153.584-164.142 96.495 39.135 45.514 -67.084 90.276 47.672 160.226 -11.338 89.729 50.094 137.692 -92.360 89.512 43.321 124.589-107.118 89.868 45.100 90.155 -97.825 92.336 140.706 132.873 -88.283 92.609 73.309 134.316-162.267 90.275-159.803 102.340 -85.890 129.687-163.073 149.910-165.167 121.484-113.541 155.838 -23.122 94.122 47.510 141.424 -99.686 92.243 47.447 136.678 -72.620 90.664 49.426 145.688 15.344 91.302 44.699 122.112 130.659 92.674 42.169 148.173 -25.381 97.998 33.547 0.000 0.000 108.414 21.638 149.640 -0.601 96.678 43.789 153.732 -87.544 93.301 47.411 132.889 170.561 95.561 113.107 107.712 -76.324 94.111 -21.048 145.584 -98.531 96.382 -72.007 137.871-138.477 92.277 24.787 144.139-132.528 115.002 -81.808 113.874 -84.871 118.402 -79.169 121.190-128.641 95.141 -19.150 114.819 -79.783 101.524-124.017 129.162 -14.855 93.199 43.895 134.786 -31.765 93.882 51.204 129.538 -76.176 98.283 14.362 103.749 -76.567 104.573 45.499 136.003 -21.158 90.824 50.197 156.473 -18.327 90.040 42.862 128.216 -77.072 89.176 48.260 114.459-102.467 89.233 57.762 130.789 -78.031 89.161 47.071 142.287 -88.726 91.540 78.643 128.911 -40.492 91.686 -72.092 136.687 -56.767 99.728 -49.931 107.925 -79.960 104.142-165.872 108.127 -77.617 92.968 0.000 129.098 -76.775 # 100 total E -1.48771E+02 rmsd from N 0.000 %NC 0.00 125.208-112.570 145.105 -32.524 119.530-103.663 131.018 -37.370 93.232 43.226 108.622 -81.890 92.718 48.663 130.386 -76.767 92.426 43.680 151.541-150.975 91.262 44.257 59.047 -71.724 91.186 44.169 119.471 -29.134 88.816 47.062 144.674 -90.548 90.244 49.727 129.570-118.273 88.741 44.083 82.863 -98.794 92.641 158.186 130.394 -77.398 94.611 100.826 135.642-163.375 90.050 152.853 104.435 -86.715 129.531 176.983 160.840-143.705 110.136-101.680 153.326 -25.512 92.229 50.994 136.236 97.046 91.436 44.616 137.456 -83.420 90.715 48.554 125.993 -65.578 89.617 48.666 146.114 -10.374 91.186 41.451 149.424 -47.911 92.158 45.430 0.000 0.000 87.928 61.246 111.553 -81.164 88.173 50.518 121.527 -83.810 89.222 39.857 139.975 156.058 95.574 106.665 109.956 -76.923 93.735 -25.541 157.654-131.679 96.823 -70.856 135.578-102.815 91.468 16.025 143.438-131.464 116.290-125.849 112.166 -80.250 130.731 -66.320 111.209-107.501 94.626 -39.943 112.640 -81.168 96.358-120.064 122.354 -18.456 92.771 47.128 124.076 8.700 91.459 53.001 129.704 -75.521 91.007 39.331 103.667 -80.093 92.224 44.585 126.378 -26.940 90.963 45.294 141.666 -52.830 90.994 43.952 128.345 -76.902 90.325 46.602 105.973-111.808 90.674 45.701 130.555 -77.344 91.444 49.733 138.554 -87.878 93.482 74.515 125.773 -40.652 88.972 -87.155 144.213-106.048 95.112 -36.887 135.275-138.172 97.960 -96.526 103.310 -69.883 92.793 0.000 129.938 -76.183 # 101 total E -1.51087E+02 rmsd from N 0.000 %NC 0.00 93.105 -64.123 127.418 -78.197 94.514 -47.121 114.791 -78.749 90.732 -47.004 103.496 -77.229 90.578 -45.923 129.724 -76.235 92.219 -41.032 137.813-118.785 94.903 -40.420 60.506 -59.150 92.034 -39.357 135.096 7.579 100.863 -39.792 165.327 164.688 91.845 -62.298 108.903-105.856 86.889 -87.247 135.744 -5.897 92.969 93.758 146.758 177.018 97.870 36.266 90.725-117.031 94.096 46.899 144.642-172.900 91.575 57.758 139.264 -21.335 92.086 34.169 104.993 -94.174 95.168 47.805 141.610-103.639 96.324 25.515 121.716 -87.716 117.589 -89.585 158.247-177.290 130.633-104.480 112.727 -79.740 93.320 56.058 112.410 -81.383 91.011 47.497 0.000 0.000 88.997 53.881 133.533 -27.834 87.910 59.417 137.474 -79.695 87.918 49.555 128.094-137.839 88.563 48.157 110.207 -72.621 90.691 45.544 141.604 -89.436 92.424 54.883 134.094-141.972 92.651 -88.673 103.796 -84.603 117.199 167.324 160.218-148.485 124.283-176.138 114.623-116.596 95.415 47.256 115.040 -76.724 93.858 43.181 122.993 -61.145 95.137 39.136 131.899 -44.141 93.479 44.222 129.874 -75.819 92.199 42.423 107.535 -89.183 92.398 40.082 117.564 -84.786 92.222 51.137 129.787 -78.724 89.944 45.149 131.525 -78.704 91.625 113.741 96.467-101.295 91.872 -48.668 128.998 -77.612 92.145 -47.069 142.494-121.571 88.736 -51.834 133.855 -44.166 91.251 -52.217 157.721 -20.779 90.516 -41.311 107.587 -85.904 97.165 115.749 105.584 -78.235 92.492 0.000 128.905 -76.080 # 102 total E -1.47650E+02 rmsd from N 0.000 %NC 0.00 93.044 158.212 138.432 -88.120 93.043 57.859 142.447 45.955 92.080 44.031 105.993 -82.606 91.908 52.772 130.862 -76.577 91.696 42.088 154.644-152.748 91.444 43.931 66.863 -78.161 92.529 42.169 117.372 -54.657 92.552 43.997 136.325 -97.809 89.346 56.401 145.216-174.193 88.108-174.967 81.908 -91.033 92.443 88.754 146.062-169.088 94.120 43.583 91.416-122.357 92.680 44.130 106.194 -85.334 91.732 52.420 150.912-108.144 89.798 49.825 125.399-132.585 91.339 37.720 126.629-116.573 97.381-129.884 117.587 -67.089 126.517 163.609 121.498 53.776 101.208-172.463 135.961-156.921 99.183 42.469 109.651 -82.334 93.795 47.325 0.000 0.000 92.189 41.238 136.160 -39.412 91.945 53.515 145.487 -90.321 89.956 47.682 121.132-135.115 88.604 47.277 114.242 -76.123 91.409 52.668 147.640-116.818 90.126 46.159 126.094-169.085 93.200-109.479 148.827 -27.883 111.706-167.443 152.506 -14.619 95.829 -61.142 99.007 -97.467 94.793 -42.259 111.000 -77.473 91.311 -46.094 110.595 -47.020 91.556-109.544 115.408 -70.405 91.109 -45.696 128.407 -76.523 89.235 -44.720 105.516 -81.812 90.465 -56.797 115.647 -76.044 86.499 -50.505 140.527-174.911 91.012 -47.479 127.926 -75.868 93.291-132.185 120.014 -36.338 91.473 -54.432 129.811 -76.697 92.075 -42.377 146.342-139.549 91.517 -47.130 132.745 -35.092 89.850 -59.956 147.956-120.007 90.139 -48.044 136.905-163.727 95.250 78.134 103.491 -79.912 92.447 0.000 129.122 -76.351 # 103 total E -1.46489E+02 rmsd from N 0.000 %NC 0.00 122.535 -95.988 151.221 -78.818 95.220 -46.907 117.800 -73.793 90.775 -48.642 103.884 -78.803 90.874 -42.974 127.282 -74.672 91.882 -52.773 152.432-149.722 94.059 -30.437 88.246-103.820 98.602 114.027 102.202 -69.814 113.286 71.520 171.422-123.848 88.697 71.727 140.182 147.171 88.390 162.945 75.766 -90.230 92.818 62.746 158.295-129.674 94.297 39.859 95.114-122.072 91.791 46.873 101.831 -80.934 90.828 60.775 140.995 -42.357 89.966 40.863 120.220-113.194 94.407 42.575 134.605-107.643 100.480 -8.237 124.802 -73.579 135.940 162.517 122.191 -46.608 108.210 33.972 147.037 136.384 96.207 45.336 141.524-125.494 111.130 19.199 0.000 0.000 97.739 44.049 149.760 -3.633 93.258 44.978 170.699-166.660 91.014 50.657 113.258-146.842 89.844 45.291 108.612 -74.161 90.702 48.742 142.800 -42.490 92.583 44.309 137.422-143.227 93.159 50.005 152.106 -22.210 96.261 28.441 114.016 -86.777 139.312-169.697 104.092 -88.971 95.678 45.282 115.209 -77.159 91.955 49.768 98.883 -8.744 89.207 52.438 115.048 0.286 90.266 48.766 130.043 -76.593 90.425 40.016 103.896 -83.432 90.769 46.808 120.951 -29.841 89.657 52.820 144.733 -47.144 88.617 45.330 128.449 -77.165 87.461 51.538 112.689 -54.771 89.885 48.606 126.231 -74.940 90.211 45.067 138.726-104.440 90.570 45.930 128.603 -41.966 90.991 52.359 135.474-101.051 90.256 43.213 135.937-131.707 95.625 71.788 104.329 -80.960 92.475 0.000 128.940 -76.644 # 104 total E -1.47546E+02 rmsd from N 0.000 %NC 0.00 123.571-102.970 148.277 -48.721 121.919-102.590 130.842 -39.768 93.011 42.724 108.965 -81.186 93.120 48.959 130.454 -77.043 94.863 41.214 153.815-145.809 91.609 43.575 61.044 -86.060 90.937 43.729 119.502 -48.538 90.750 45.823 136.232-100.704 89.806 46.798 131.860-111.481 88.433 47.968 89.591-102.884 92.102 116.740 134.105-100.356 91.832 67.734 128.673-152.306 90.994 109.060 99.478 -84.206 92.640 -79.936 117.534 -81.950 101.943-109.135 150.965 -36.009 90.377 55.465 138.732 107.357 91.096 45.238 137.187 -82.497 89.195 51.884 130.994 29.156 88.727 50.336 143.321 -5.410 88.759 45.125 154.438 -31.081 89.790 48.306 0.000 0.000 87.844 54.059 129.909 -35.983 87.705 52.289 133.905 -87.650 88.569 53.498 126.240-134.667 88.191 62.594 109.249 -75.554 89.557 126.552 132.091 -83.939 94.457 38.928 136.972 -86.213 96.114 67.137 114.040 -87.820 95.728 -8.870 148.520 -96.988 127.772 -75.530 114.163-112.145 97.043 -33.621 109.545 -78.409 90.400 -54.602 115.028 -21.128 88.652 -45.516 117.156 -73.344 94.112 -40.951 127.381 -75.012 98.511 -19.496 101.875 -81.447 105.256 -37.234 139.800 -31.736 93.908 -46.949 143.555 -53.487 90.729 -51.927 130.247 -77.488 91.719-131.050 129.685 24.548 91.216 48.563 131.815 -77.668 91.282 53.148 142.242-114.223 90.727 56.866 129.479 -40.483 92.007-134.945 130.522 -62.028 98.132 45.981 137.737-142.243 116.227 31.020 109.758 -75.192 92.420 0.000 129.009 -76.170 # 105 total E -1.51806E+02 rmsd from N 0.000 %NC 0.00 92.433 125.059 123.589 -48.923 94.733 47.812 148.766 7.764 92.553 44.398 106.247 -81.942 92.096 51.990 128.382 -75.980 90.686 45.747 122.445 -27.416 94.858 36.271 81.878 -77.640 94.839 42.089 109.353 -60.545 102.688 16.461 104.492 -70.927 101.613 43.960 149.168 -24.121 96.379 28.031 92.877 -93.015 96.683 53.387 149.587 174.463 97.886 12.239 87.621-111.021 103.817 83.830 139.893-117.173 128.114 -95.456 140.340-145.422 114.494-115.304 142.970-162.488 96.878 44.205 156.901-179.954 93.276 44.106 133.415 -85.002 90.060 54.109 132.339 -66.928 92.149 52.987 95.678-125.354 90.169 40.225 132.158-178.897 90.469 46.848 0.000 0.000 91.152 52.837 103.317 -84.130 87.937 48.478 151.478 -79.495 89.639 42.640 117.012-133.287 90.067 49.845 113.195 -77.223 90.203 48.336 140.880-107.147 91.767 52.036 136.569-152.588 92.647-102.028 103.039 -82.805 107.985 165.101 150.290 -17.515 105.742-169.641 90.743 -93.603 92.978 53.203 128.073 35.083 92.067 47.783 114.927 -46.313 90.473 46.444 130.477 -27.513 92.703 42.672 129.188 -76.536 92.997 41.635 103.435 -83.478 90.396 49.393 117.305 -67.894 90.072 64.076 130.209 -58.111 87.637 50.268 130.069 -77.664 90.876-174.770 71.585 -82.979 92.127 72.804 133.170 -77.649 90.813 45.742 140.696-104.076 90.979 45.691 129.052 -25.466 91.352 56.358 147.729 -35.909 89.002 43.102 138.680-147.362 94.433 82.945 103.557 -80.036 92.634 0.000 128.835 -76.744 # 106 total E -1.49369E+02 rmsd from N 0.000 %NC 0.00 125.801-112.431 143.525 -28.375 121.986-103.831 129.668 -40.120 94.264 40.965 108.615 -80.261 93.076 48.639 131.124 -77.373 92.622 41.806 155.163-150.331 91.649 45.605 57.789 -71.932 90.139 45.028 122.644 -31.593 88.400 50.030 135.518-100.774 88.538 48.826 124.840-115.626 92.235 87.156 87.534 -97.810 91.223-148.089 147.519-106.135 95.070 59.800 96.511-121.429 94.530 38.545 105.839 -87.804 91.668 61.279 155.520-138.972 90.759 65.083 117.518-152.313 89.314 47.324 127.121-124.426 98.293-121.546 116.643 -86.983 135.737 -63.128 128.256 43.455 97.328 41.964 125.082 -14.354 92.379 45.430 151.033-148.571 89.481 52.988 0.000 0.000 90.702 43.167 108.789 -83.676 90.774 42.304 148.599 -84.875 91.912 45.405 117.444-128.974 88.619 51.850 114.953 -76.577 90.088 46.202 134.501-106.471 91.379 46.424 127.516-163.453 95.762 -86.709 105.765 -87.263 128.731 172.243 117.526 -77.770 123.292-100.883 116.922-121.000 119.114 4.489 115.928 -80.805 91.321 60.312 104.388 -13.755 88.159 58.251 120.310 -78.826 90.033 48.474 129.414 -77.504 86.209 48.694 103.485 -83.484 88.463 58.477 110.756 -44.644 89.486 45.431 134.809 -48.667 90.955 41.253 128.018 -75.823 92.662 64.385 110.113 -97.191 92.118-119.099 129.790 -77.052 100.046 -20.737 142.149-143.874 93.342 -59.888 138.450 -86.856 92.160 -71.343 154.168 -28.824 90.722 -57.670 134.264-146.259 94.394 110.491 103.835 -79.431 121.663 0.000 145.411 -85.952 # 107 total E -1.53765E+02 rmsd from N 0.000 %NC 0.00 93.016 158.095 137.880 -87.717 92.493 56.743 119.045 -30.334 92.977 44.681 104.383 -82.367 92.951 46.462 127.984 -74.633 91.994 42.815 111.835 -86.165 93.352 40.896 65.137 -66.689 93.208 43.439 121.231 -35.334 91.206 43.785 139.712 -98.802 91.266 50.375 127.526-120.692 91.719 78.771 89.263 -99.523 92.039-161.676 139.283-103.986 94.284 62.344 97.028-125.252 95.523 36.227 99.368 -81.708 91.314 54.117 150.068 -45.542 91.053 51.460 126.438-132.943 91.468 58.959 122.057-126.697 94.074 -15.298 131.312 -82.667 119.607 174.616 153.193 -89.384 106.578 32.249 138.959 9.268 91.345 54.922 147.233-168.899 91.167 45.089 0.000 0.000 92.411 43.392 110.658 -78.043 92.276 43.364 146.138 -75.741 91.070 43.397 117.584-123.490 90.466 49.123 111.989 -76.382 89.975 49.725 141.512-105.577 91.739 45.388 136.701-141.039 94.413-131.265 140.140-109.399 95.918 161.596 146.742-124.450 129.991 -93.147 112.586-110.272 89.084 62.687 112.480 -75.834 89.990 56.841 118.962 -58.254 89.101 49.697 112.294 -72.441 89.549 41.842 128.707 -76.106 89.791 45.696 103.970 -83.901 89.740 47.149 133.216 -81.359 89.652 46.565 146.868-127.091 89.969 41.253 128.012 -76.570 89.616 50.281 112.106 -70.418 89.931 45.189 128.624 -76.978 90.609 45.043 135.789-131.557 90.359 49.492 128.056 -43.461 89.594 53.309 136.602-100.210 90.267 43.350 131.560-130.661 95.438 73.315 104.152 -80.340 92.516 0.000 128.987 -76.666 # 108 total E -1.50242E+02 rmsd from N 0.000 %NC 0.00 125.452-111.705 144.347 -31.794 119.139-105.150 129.714 -37.615 93.039 42.518 108.033 -80.474 93.085 49.814 130.706 -77.208 91.739 42.062 154.607-148.882 91.454 45.830 59.562 -71.433 90.065 44.945 121.090 -33.972 88.470 50.500 135.011-100.297 88.113 48.191 125.489-117.118 92.373 85.025 86.552 -97.852 91.300-148.805 147.501-103.349 95.039 61.123 96.641-120.899 94.584 38.154 105.979 -87.575 91.539 61.264 155.608-137.599 90.860 65.468 116.427-151.227 89.241 47.258 127.057-125.315 98.175-122.048 116.288 -87.509 135.285 -62.963 128.647 44.172 97.236 42.360 124.450 -13.954 92.446 44.857 149.546-142.494 89.728 52.985 0.000 0.000 90.872 43.153 108.326 -83.647 90.385 43.118 151.491 -84.917 91.413 45.400 116.642-130.794 88.474 51.750 113.324 -75.360 89.951 46.751 139.142-106.047 91.795 45.057 126.013-158.781 96.833 -89.478 149.915 -27.149 126.797 173.904 155.447 -16.522 101.823-118.014 98.783-108.789 107.156 29.071 115.543 -78.816 90.759 55.034 120.206 -13.181 88.048 55.644 137.902-153.292 90.701 47.746 128.986 -77.193 87.277 46.658 136.572-139.067 89.342 57.254 113.562 -41.178 89.572 47.601 134.285 -49.897 91.314 38.831 128.179 -76.002 93.710 57.286 107.704 -97.220 95.782 171.967 129.570 -76.653 90.704 57.753 143.626-129.846 90.614 76.290 141.893 -90.145 88.671 71.264 141.518 -31.258 88.064 41.083 135.142-131.883 96.953 81.056 102.081 -79.194 92.435 0.000 129.210 -76.165 # 109 total E -1.48846E+02 rmsd from N 0.000 %NC 0.00 92.685 152.075 122.255 -45.541 93.734 72.966 140.026 46.892 95.466 40.218 107.146 -81.058 92.330 45.208 131.917 -77.635 92.816 45.857 151.324-156.718 93.042 46.130 56.974 -66.719 88.389 46.205 134.162 -28.927 89.720 52.775 122.332-123.986 86.807 44.158 123.382-122.506 89.402 47.692 76.299 -90.947 89.852 53.034 140.442 -60.804 96.925 31.910 95.366 -96.827 92.292 53.582 115.262 -86.056 91.805 41.132 119.739-100.424 100.569-139.267 107.710 -88.444 96.449 66.511 139.753-112.080 115.562-151.499 156.471 -82.744 115.391 38.235 154.458 -96.028 94.245 49.893 139.189 -6.313 94.532 39.807 142.681-134.862 96.372 40.115 0.000 0.000 99.675 28.942 115.353 -87.771 99.770 37.075 170.260 178.687 96.414 37.751 113.162-142.490 91.459 49.840 114.310 -76.480 90.711 57.317 139.724-106.173 90.183 42.964 147.618-127.012 92.929 38.056 143.092-129.417 101.393 -1.899 113.820 -88.887 139.430-161.425 102.220 -85.040 94.033 53.419 115.025 -76.538 92.507 49.200 101.290 -16.767 90.113 47.186 131.000 -7.495 92.247 46.297 130.100 -76.797 91.465 39.401 102.567 -84.434 90.860 47.245 114.040 -33.386 91.733 56.888 132.996 -46.372 89.419 33.800 130.957 -78.094 93.251 110.110 99.599 -96.406 93.886 -37.860 130.236 -78.535 96.373 -53.463 140.517-127.000 95.764 -18.317 125.514 -19.529 104.988 -55.188 155.592 -23.370 91.406 -41.137 144.152-118.030 96.941 87.153 104.041 -80.325 92.548 0.000 128.902 -76.451 # 110 total E -1.49406E+02 rmsd from N 0.000 %NC 0.00 93.142 154.950 142.465-103.296 93.781 52.551 130.106 42.066 90.754 45.553 106.300 -82.165 91.251 51.338 129.975 -76.527 90.669 45.674 151.589-150.711 91.821 42.130 62.487 -68.349 90.572 46.949 120.980 -34.846 87.597 54.568 139.069-104.886 87.676 50.281 115.304-112.001 88.899 43.581 89.139 -93.343 92.470 170.199 134.724 -82.787 99.452 88.873 131.122-155.820 96.330 113.281 103.353 -87.520 125.187 -12.770 148.049-102.040 97.731 -62.713 139.908-138.508 97.905 -1.572 137.037-102.014 115.669-134.442 148.345 -20.761 93.994 47.088 124.168 -79.417 95.969 49.384 141.244-173.271 109.351 3.860 150.189 -21.810 98.793 51.290 0.000 0.000 93.730 41.621 135.551 -39.895 91.243 51.870 139.271 -79.580 88.339 47.969 122.753-128.547 90.356 46.185 108.992 -78.140 91.232 49.552 150.050-102.247 92.284 47.305 133.515-154.035 93.909-102.843 141.886-121.552 110.101-177.157 150.563 -16.602 136.812-165.351 108.184 -98.480 94.630 45.792 114.793 -77.073 92.900 45.896 102.560 -8.204 91.147 47.020 125.598 0.238 89.885 46.273 129.777 -77.406 88.894 47.294 103.797 -84.075 88.884 51.129 120.876 -23.499 87.505 47.265 137.118 -59.515 89.216 48.733 128.370 -76.731 88.104 52.865 113.372 -32.920 88.927 45.772 128.647 -76.309 90.370 48.066 129.638-135.444 89.252 58.900 131.759 -48.000 88.734 53.824 133.271 -62.191 90.456 45.014 142.935-119.126 94.882 77.147 104.283 -80.350 92.524 0.000 128.936 -76.662 # 111 total E -1.46521E+02 rmsd from N 0.000 %NC 0.00 93.090 -60.742 128.693 -82.742 94.381 -46.642 115.722 -80.149 90.581 -47.441 103.304 -77.358 90.478 -46.666 129.811 -76.001 91.295 -41.465 139.974-123.979 93.728 -40.911 59.159 -60.828 92.769 -40.507 134.562 26.247 99.892 -37.868 165.077 168.319 91.592 -58.619 121.268-119.646 87.946 -87.237 136.808 -7.191 90.943 109.772 144.641 178.612 97.130 38.150 88.242-116.944 93.919 49.223 139.518-152.543 91.559 58.666 143.219-146.569 89.377 50.260 124.798-147.199 95.573-166.995 128.721 -99.764 95.036 60.757 152.310 120.480 92.593 131.144 140.011-104.485 97.959 -30.575 104.612-115.344 94.437 -62.012 104.468 -84.807 94.757 -14.839 0.000 0.000 103.942 -60.902 146.453 -6.976 133.037-122.667 155.938 -22.451 93.943 44.794 115.924 -90.338 92.293 46.070 117.361 -76.671 92.157 49.328 154.864-148.838 93.539 68.533 136.953-136.213 92.204 -98.360 139.683-119.529 111.431 176.178 151.328 -18.566 103.306 -44.327 95.001 -98.984 105.123 -28.626 113.390 -78.634 93.396 -46.072 108.607 -57.164 91.529 -45.674 112.744 -71.376 91.545 -46.260 127.473 -74.970 90.312 -39.862 104.332 -87.702 91.364 -49.376 116.228 -79.388 88.772 -53.374 147.288-130.662 89.791 -44.548 130.216 -78.044 94.550-123.481 124.594 -36.895 91.678 50.495 130.965 -76.356 91.461 50.173 143.420-121.514 91.365 62.985 128.380 -34.255 91.840-103.551 130.347 -63.236 99.162 -27.050 131.217-133.128 122.822 90.346 106.978 -79.607 92.474 0.000 129.677 -76.308 # 112 total E -1.48879E+02 rmsd from N 0.000 %NC 0.00 93.104 -63.504 127.770 -79.109 94.240 -48.256 115.959 -79.577 90.898 -46.473 103.410 -77.553 90.763 -46.241 128.967 -75.563 91.691 -39.962 139.585-124.191 95.498 -39.963 62.436 -62.120 93.272 -38.265 132.775 -9.352 98.688 -41.135 169.924 168.338 91.697 -68.326 113.399-107.880 84.056 -66.001 79.293 -77.415 94.492 -48.169 138.061 142.187 122.829 95.290 121.917-128.580 104.224 123.846 112.323 -80.849 95.109 -58.800 136.174 -96.561 104.361-117.418 107.751 -87.606 91.412 50.176 147.369 173.540 91.032 51.374 136.022 -85.457 89.817 49.976 145.919 -15.103 90.346 46.059 136.319 -70.020 89.699 48.580 108.844 -82.668 88.498 55.462 0.000 0.000 89.869 44.790 104.065 -79.284 91.830 44.024 143.449 -62.591 92.161 40.722 120.742-122.431 90.981 48.530 111.257 -77.587 91.196 49.215 131.353 -91.647 92.463 39.665 136.023-102.556 95.852 35.581 113.594 -90.204 101.255 -5.602 143.738 -92.937 139.551-164.180 105.649 -91.190 91.485 64.740 117.645 -75.977 93.120 122.515 114.492 -94.827 95.324 -36.415 109.405 -71.613 91.817 -51.704 128.659 -77.366 90.505 -40.603 101.099 -80.523 90.165 -47.255 148.819 -24.362 91.258 -47.195 141.206 -96.120 90.850 -50.256 128.840 -77.598 92.996-119.831 133.409 23.089 91.448 48.706 131.161 -76.944 91.964 53.488 141.974-114.681 91.981 66.756 128.303 -31.801 90.297-104.146 138.787 -49.020 95.822 -19.143 109.413 -85.166 108.894 -56.042 99.969 -73.079 92.636 0.000 129.552 -76.254 # 113 total E -1.47744E+02 rmsd from N 0.000 %NC 0.00 93.026 159.705 137.396 -86.389 93.176 59.640 135.967 52.544 92.796 42.411 107.074 -82.163 91.915 47.759 130.634 -76.550 92.635 42.697 154.094-158.547 93.249 42.646 58.298 -67.853 90.610 44.871 124.218 -31.616 88.780 52.353 140.271-105.434 88.222 46.654 121.178-109.414 88.503 44.280 88.668 -96.024 91.747 69.400 141.636 -94.964 91.557 64.190 100.489-113.111 85.418-171.928 103.081 -86.957 151.231-128.205 169.850-170.634 100.947-104.073 150.853 -38.628 93.598 49.934 147.922 148.114 92.499 45.814 134.419 -83.932 90.718 51.437 125.209 42.852 89.512 48.493 123.085 -34.970 88.197 47.533 109.080 -82.718 91.604 46.192 0.000 0.000 91.709 41.084 141.518 -21.777 90.947 45.286 143.126-102.539 91.070 59.922 118.204-133.709 85.469 58.339 112.724 -75.869 90.240 44.940 127.364 -97.068 91.739 51.909 137.738-145.057 94.765 -67.797 104.790 -85.386 127.523 130.853 167.888-163.647 124.181-179.483 117.919-121.619 95.308 56.689 115.013 -76.624 92.498 43.816 96.030 -57.520 90.218 56.047 117.647 -73.394 90.016 47.520 128.717 -76.178 88.237 43.656 99.910 -81.932 89.817 52.527 108.821 -37.664 89.488 48.900 142.616 -31.540 89.524 42.820 128.216 -76.532 91.213 62.234 113.396 -83.470 90.878-109.325 128.665 -76.926 95.341 -37.547 141.225-119.516 90.262 -56.758 128.300 -14.707 91.009 -49.377 152.430 -27.436 92.171 -38.826 110.294 -85.041 98.264 129.380 105.373 -78.178 92.558 0.000 128.742 -76.196 # 114 total E -1.49347E+02 rmsd from N 0.000 %NC 0.00 123.961-107.318 147.976 -47.333 122.343-100.675 131.414 -30.643 94.062 41.326 110.012 -80.736 93.498 49.255 131.299 -77.114 93.641 41.510 146.497-136.948 91.166 44.543 62.178 -81.897 91.123 42.996 119.444 -45.870 91.190 45.180 140.517-100.939 88.894 46.642 136.638-140.071 89.026 49.836 82.011-104.800 90.169 138.456 140.682 -99.966 90.852 87.923 103.504-140.281 89.129 101.119 101.852 -88.167 92.283 -66.212 125.126-101.314 99.897-122.902 151.236 -34.624 92.019 48.863 138.835 126.065 91.242 48.013 137.826 -83.602 90.351 47.964 125.712 -48.486 90.785 48.307 130.384 -22.911 90.166 44.704 144.548-151.803 90.036 47.466 0.000 0.000 88.975 57.798 112.638 -72.875 88.165 43.834 139.320 -80.824 90.562 42.404 119.171-123.262 89.413 55.028 105.336 -73.778 89.819 50.130 135.316 -59.694 90.795 43.910 130.692-117.165 92.732 41.013 114.922 -89.045 101.599-122.853 106.684 -77.670 100.356 -47.667 94.428 -90.538 118.023 120.645 155.188 -87.410 92.865 49.029 114.949 -33.181 90.225 54.011 115.111 -68.399 91.717 44.215 127.343 -74.965 90.452 41.641 101.863 -85.228 92.243 45.812 119.717 -63.423 91.952 44.017 129.027 -67.928 90.901 41.422 130.438 -78.116 90.809 47.699 105.359 -66.607 91.506 44.518 128.208 -76.441 91.773 42.991 141.032-136.338 91.309 46.163 131.786 -52.951 91.152 51.362 132.097-113.495 90.644 43.320 131.783-143.040 95.688 69.094 104.289 -80.517 92.526 0.000 129.080 -76.657 # 115 total E -1.50173E+02 rmsd from N 0.000 %NC 0.00 123.964-108.038 148.153 -49.205 123.033-100.942 131.020 -32.020 93.747 42.479 109.955 -80.229 93.594 47.118 130.621 -77.109 94.980 41.660 146.216-132.919 91.306 44.480 60.011 -82.360 90.732 44.148 119.825 -46.380 90.945 45.291 137.177-102.270 88.687 47.657 135.663-137.015 89.363 49.019 79.853-102.682 90.833 139.992 142.925 -93.874 90.384 89.509 103.571-140.456 90.021 99.746 100.754 -87.376 92.912 -67.604 124.261 -98.639 100.490-121.802 151.313 -35.098 91.827 50.754 138.837 126.192 91.345 47.613 138.134 -83.437 90.297 48.513 129.668 -49.848 90.180 49.196 133.992 -23.524 89.784 46.249 143.023-149.002 90.034 46.066 0.000 0.000 89.250 56.528 113.375 -78.317 86.981 46.884 139.735 -85.875 89.089 46.119 120.165-128.193 88.620 52.847 110.788 -76.151 89.417 45.732 144.722-106.209 92.448 48.119 133.080-116.162 95.775 -71.890 154.601 -28.778 128.381 102.262 119.519 -77.901 128.287 159.706 108.575-104.364 100.821 39.720 141.942-172.609 94.320 46.437 113.273 94.056 95.376 98.303 112.968 -74.295 90.242 -74.368 129.389 -76.432 93.632 -38.368 105.685 -89.961 89.221 -53.277 99.343 -63.397 87.180 -45.622 146.459 -26.121 92.509 -61.703 124.663 -74.257 84.118 122.003 109.630-126.783 92.870 44.801 129.225 -76.936 92.235 41.153 139.465-150.714 92.060 46.580 130.837 -64.211 91.200 50.624 127.818-110.904 90.882 43.846 132.104-142.274 95.697 68.385 103.747 -80.809 92.513 0.000 129.034 -76.631 # 116 total E -1.52245E+02 rmsd from N 0.000 %NC 0.00 123.944-113.583 148.517 -58.601 122.399-104.049 134.979 -18.879 93.817 44.147 109.754 -79.624 94.580 46.084 129.307 -76.322 94.890 37.909 135.080-108.765 95.454 41.522 59.366 -79.591 94.699 39.579 121.557 -39.627 93.720 40.920 142.193 -97.216 92.097 48.459 131.101-124.416 92.309 74.252 87.122-100.761 92.426-158.236 133.986 -95.747 97.012 70.055 125.989-148.845 94.931 36.503 103.830 -86.062 90.827 55.412 150.091-100.080 90.973 46.221 119.234-136.751 92.426 58.321 122.981-126.891 94.647 -18.704 128.829 -80.023 119.009 177.864 152.037 -85.295 105.530 33.897 143.035 9.594 91.459 54.254 145.474-168.695 91.744 44.259 0.000 0.000 92.273 43.011 112.903 -78.369 93.021 43.182 142.574 -77.593 91.379 43.377 118.120-120.956 90.329 49.330 112.944 -77.342 90.152 50.642 139.455-106.844 91.461 45.080 135.820-134.673 94.169-130.782 139.939-109.069 96.113 162.292 147.789-129.012 129.825 -91.982 112.415-110.191 89.098 62.500 112.461 -75.830 90.042 56.328 118.963 -58.544 89.120 49.656 111.918 -72.129 89.685 41.698 128.692 -76.106 89.806 45.616 104.293 -84.108 89.697 47.553 133.367 -82.936 89.544 46.903 148.434-131.957 89.880 40.904 127.992 -76.538 89.740 50.129 112.815 -72.852 90.022 44.903 128.626 -76.974 90.767 45.090 136.019-130.644 90.364 49.392 128.227 -43.822 89.688 53.011 135.751-101.366 90.348 43.445 131.942-132.269 95.460 72.874 104.149 -80.352 92.520 0.000 129.003 -76.673 # 117 total E -1.47375E+02 rmsd from N 0.000 %NC 0.00 93.150 156.487 142.050-102.010 93.882 52.227 129.456 44.383 90.877 45.948 106.501 -81.188 91.329 49.047 130.347 -77.185 91.740 46.276 152.027-149.629 92.622 43.699 57.598 -66.953 89.262 46.663 129.867 -29.381 89.105 55.021 130.063-120.332 86.523 45.663 126.604-123.372 88.538 47.183 75.743 -92.958 90.578 51.185 138.493 -63.245 96.169 35.199 96.504 -93.969 91.034 53.197 115.681 -86.800 91.261 48.882 120.921-102.410 95.315-136.311 131.301-114.233 95.738 55.656 137.308-107.775 123.765-144.500 144.936 -44.745 111.698 47.111 156.138-114.231 126.292 12.563 145.023 83.817 97.102 49.697 145.967-163.027 92.568 41.947 0.000 0.000 91.551 54.681 112.831 -78.257 88.047 45.289 144.153 -78.155 90.171 42.513 118.463-126.017 90.490 50.341 108.469 -73.825 91.635 38.594 140.754 -85.422 95.000 47.096 131.560-124.788 98.300 -18.611 108.256 -88.872 128.214 55.516 170.921-164.808 126.605 -26.333 113.591-112.328 142.159-161.547 122.363 -90.110 131.991 73.773 130.745 135.396 133.132 75.315 119.891 -79.716 94.066 -50.060 130.150 -76.207 95.855 -35.257 98.500 -81.765 97.896-110.901 143.326 -37.003 90.044 65.393 141.989-141.168 90.948 42.694 129.728 -78.314 91.676 118.205 123.014-148.758 92.134 -47.705 130.958 -78.779 92.000 -50.266 141.326-126.442 88.650 -52.658 137.793 -81.365 90.355 -55.380 156.366-128.887 90.008 -46.405 101.669 -86.894 95.433 100.888 104.727 -78.549 92.435 0.000 129.105 -75.993 # 118 total E -1.49038E+02 rmsd from N 0.000 %NC 0.00 93.675-167.221 140.876-106.450 93.807 52.843 141.854 38.154 91.920 46.643 108.906 -80.026 91.852 45.538 131.691 -77.363 95.412 40.706 142.094-125.509 95.283 37.862 51.019 -74.786 92.332 44.917 161.530 127.695 92.770 43.269 138.530 -88.695 91.516 42.649 143.702-130.867 90.282 45.967 83.084-109.309 92.444 157.336 128.778 -91.323 92.958 74.082 133.028-160.763 91.025-155.690 101.022 -85.692 115.773-168.305 145.201-170.690 124.779-114.072 156.662 -21.337 94.696 45.477 142.434-101.852 92.434 46.256 136.857 -73.535 90.553 49.567 155.348 5.672 90.857 47.003 119.415 145.987 93.904 35.782 148.222 -25.418 100.783 33.109 0.000 0.000 101.971 22.239 146.503 -15.460 101.274 44.030 144.953 -90.364 93.934 48.585 135.916 169.897 94.041 100.242 110.605 -77.571 94.765 -32.617 141.199-106.957 99.259 -74.756 135.275-134.216 93.316 24.873 144.396-132.553 123.030-154.326 111.936 -78.832 103.736 -52.648 93.089 -97.867 96.255 -42.451 113.405 -78.791 96.072-119.003 123.416 -26.862 93.829 49.621 121.535 6.353 91.703 50.556 129.870 -75.613 91.557 38.923 104.285 -79.222 92.485 44.621 122.708 -22.724 91.365 45.202 147.666 -40.387 90.529 44.259 128.466 -77.104 88.463 52.322 108.682 -43.739 91.251 45.274 126.209 -75.275 91.081 44.029 122.697 172.838 92.257 53.015 130.824 -49.501 94.381 168.051 128.412 -64.091 94.274 55.391 143.473-173.188 108.805 149.649 99.664 -78.199 92.702 0.000 129.335 -76.465 # 119 total E -1.50274E+02 rmsd from N 0.000 %NC 0.00 123.428 -99.387 148.868 -57.410 93.695 -51.446 116.438 -76.304 91.292 -45.503 103.433 -77.530 91.098 -45.703 128.461 -75.883 91.629 -39.385 140.011-123.682 94.787 -41.763 62.807 -65.639 91.940 -37.302 133.404 -5.121 103.570 -32.137 170.141 154.472 94.983 -52.102 126.009-113.022 96.471-161.943 81.406 -83.953 93.698 74.892 157.719-162.422 94.587 8.892 93.294-121.428 106.291-149.644 109.922 -83.314 125.731-111.064 151.678 -15.510 94.108 -23.769 139.402-129.561 109.516 -20.730 153.759-144.511 122.414-104.485 151.684 -19.587 93.505 43.482 132.829 -73.236 94.937 50.978 136.030 -3.183 94.875 37.045 102.220 -79.885 95.503 44.303 0.000 0.000 100.079 26.457 106.757 -87.995 98.477 39.244 170.047 172.608 96.650 35.172 90.428-124.224 91.885 52.886 118.152 -77.902 90.448 45.746 136.190-113.392 92.129 56.716 140.822-110.461 93.524 -18.612 106.042 -86.323 123.413 145.401 149.051 -17.523 135.193 -91.264 110.576-100.981 107.986 -4.211 112.203 -82.638 95.164-148.196 84.311 -52.943 96.550 38.757 117.371 -76.010 94.331 47.480 129.805 -76.503 93.173 37.118 146.236-167.396 90.653 55.689 153.383 -26.387 87.175 52.412 145.932-135.750 88.961 42.092 127.979 -76.601 89.732 48.891 117.714 -28.357 89.395 49.320 129.953 -76.457 89.476 45.818 135.877-134.892 89.150 48.719 130.537 -42.648 89.027 57.430 139.091 -48.338 88.919 43.529 130.793-118.333 94.514 83.491 103.625 -80.438 92.552 0.000 128.811 -76.763 # 120 total E -1.52317E+02 rmsd from N 0.000 %NC 0.00 92.677 103.426 137.281 -91.603 93.442 57.122 134.270 50.013 92.844 42.858 106.437 -81.206 91.836 46.631 131.291 -77.361 92.852 44.869 151.481-147.796 92.951 43.226 55.893 -67.018 89.925 45.107 127.516 -27.348 89.891 50.479 131.177-113.961 88.075 45.672 121.455-112.247 88.722 45.288 81.465 -90.825 91.348 52.496 141.162 -70.551 97.080 28.591 97.349 -97.677 93.944 53.055 114.757 -86.761 92.583 42.406 116.822 -97.852 105.662-154.302 108.334 -87.648 95.575 70.826 138.201-109.808 99.284-164.799 150.327 -89.525 101.580 49.725 140.810-164.752 93.062 44.630 153.166 135.389 95.952 36.391 146.808 -22.027 98.850 35.968 0.000 0.000 100.713 27.399 117.942 -88.110 100.473 36.302 168.731 172.923 96.683 37.909 116.552-149.102 91.460 49.392 115.841 -75.734 90.655 51.859 138.002-107.004 90.556 47.638 148.841-133.386 92.229 30.482 107.949 -86.287 106.316 5.922 151.691 -21.979 137.818-164.312 105.283 -91.551 92.776 55.051 114.581 -76.547 91.750 51.340 99.650 -20.987 90.073 47.773 134.320 -7.553 91.836 44.560 130.132 -77.236 90.707 42.482 102.447 -84.004 89.582 55.877 116.548 -33.260 88.897 53.330 133.853 -51.400 88.617 41.789 128.869 -76.771 91.002 81.145 113.287-107.505 91.775-166.291 129.123 -77.235 92.316 58.040 141.127-111.472 90.581 49.535 132.722 -58.175 90.778 56.037 151.813 172.265 88.790 43.396 135.998-150.971 94.966 98.043 100.751 -79.412 92.496 0.000 128.902 -76.345 # 121 total E -1.49689E+02 rmsd from N 0.000 %NC 0.00 92.976 144.887 141.045 -96.378 93.670 50.777 148.346 63.412 90.790 49.534 106.963 -80.264 90.491 52.731 129.218 -75.426 90.733 40.759 153.746-153.215 92.088 48.242 118.118 154.915 91.703 51.271 107.973 -54.154 90.003-112.079 129.711 -75.870 93.054 -54.798 95.045 -18.657 92.942 -38.568 146.560 -6.532 100.925-117.904 150.229-130.929 92.642 67.964 96.318-126.851 97.523 118.114 104.163 -88.292 122.245-114.582 147.568-107.594 107.501-109.842 153.067 -27.093 94.714 43.748 151.153-171.865 92.453 46.935 136.526 -83.203 90.685 48.569 122.592 -71.070 91.403 49.730 106.723 -50.443 90.821 42.549 108.672 -81.683 91.758 43.813 0.000 0.000 90.096 52.517 129.362-105.625 89.537 43.373 127.218-109.249 90.340 44.396 118.066-124.288 89.894 50.651 110.334 -80.697 89.818 56.714 138.096-102.431 89.527 43.276 128.381-150.236 95.667-113.484 105.589 -82.901 106.911 163.622 149.802 -13.814 137.026 -92.274 109.157-101.078 89.058 69.888 112.694 -75.333 89.415 59.516 112.073 -56.889 87.176 53.082 113.908 -73.953 90.241 42.930 128.027 -75.959 88.799 49.469 131.552-118.474 88.132 60.681 136.453 -97.190 87.460 50.545 145.039-134.703 89.549 40.014 127.894 -76.279 89.490 54.324 118.027 -91.783 89.003 56.665 128.576 -76.563 88.044 45.439 138.003-134.948 92.186 79.064 130.768 -46.292 87.947 -84.157 140.034 -52.631 96.631 -42.318 110.015 -83.086 104.960-131.867 146.629 -18.549 92.911 0.000 129.516 -76.182 # 122 total E -1.51221E+02 rmsd from N 0.000 %NC 0.00 93.121 164.632 138.243 -90.229 92.860 58.462 145.804 39.674 92.560 43.631 106.192 -82.667 91.900 51.976 131.972 -77.088 92.628 41.329 151.438-139.035 90.358 44.368 64.604 -79.099 90.404 47.010 114.984 -51.233 90.317 46.047 137.076 -98.398 87.230 46.619 141.086-162.567 88.991 53.914 77.199-103.893 88.301 152.253 144.004 -93.102 90.017 67.816 106.167-148.992 92.530 37.995 96.259 -81.177 92.418 50.038 148.473 -39.786 90.759 42.848 131.613-113.911 91.928 52.804 122.260-128.028 91.490 41.366 132.142 -87.708 93.925-120.336 148.165-137.125 106.213 -61.189 140.953-129.620 89.611 102.652 116.006 -79.721 89.136 56.141 0.000 0.000 89.911 46.985 132.351 -34.816 89.399 49.538 141.566 -84.400 89.119 53.086 123.660-130.186 88.353 48.071 110.050 -76.179 90.275 50.448 150.468-107.266 91.709 46.014 134.857-120.337 94.503-101.723 142.241-122.357 114.811-179.304 151.482 -16.475 134.221-165.121 109.798-102.848 95.764 44.356 115.188 -77.324 92.467 47.543 101.691 0.274 90.857 47.373 119.208 -0.545 89.503 48.528 130.839 -77.635 88.735 46.935 138.278-147.127 88.596 48.643 119.053 -21.100 88.593 49.112 137.976 -51.020 88.879 46.727 128.217 -76.613 87.864 54.390 117.224 -43.467 89.603 44.410 127.334 -75.312 91.947 47.985 137.410-136.546 93.344 76.564 128.392 -43.600 89.185 -87.096 139.760 -93.967 95.443 -38.609 105.510 -85.823 104.214-110.821 146.204 -13.636 93.061 0.000 129.214 -76.872 # 123 total E -1.50015E+02 rmsd from N 0.000 %NC 0.00 93.110 159.997 139.600 -94.118 92.960 56.324 142.887 25.309 92.263 45.995 106.243 -83.115 92.269 46.512 130.189 -76.760 94.254 44.996 142.265-116.441 91.613 41.573 58.997 -75.375 92.065 44.654 124.716 -36.143 92.085 42.069 130.591-102.026 90.749 50.627 137.095-126.668 91.019 85.956 85.787-102.891 90.452-153.912 144.686-110.386 92.040 65.631 97.058-126.542 91.212 47.655 100.393 -79.795 92.084 50.413 142.321 -38.015 91.431 41.203 133.334-124.157 93.014 46.594 126.514-117.488 93.125 50.245 125.024 -77.860 95.445-112.207 121.424 -75.335 118.607-106.554 101.812 -88.102 90.295 64.547 111.803 -81.731 91.846 47.457 0.000 0.000 89.168 48.101 138.012 -12.223 90.034 50.607 141.707 -89.963 89.076 46.551 123.403-135.088 87.194 53.952 111.437 -74.152 89.772 48.533 138.711 -46.181 90.562 45.053 138.406-147.105 95.351 -85.675 104.908 -83.750 125.868 144.457 151.999 -13.223 99.883 -72.198 95.415 -94.062 93.019-163.338 112.146 -75.054 93.549 52.575 73.408 45.610 94.781 40.513 118.338 -76.698 97.231 36.961 129.095 -76.067 101.815 26.809 114.112 -82.437 95.604 49.969 156.103 -15.504 90.145 49.400 160.966-157.524 89.979 39.344 128.117 -76.793 91.181 49.789 114.232 -29.287 90.604 47.934 129.627 -76.883 90.375 46.101 141.820-131.126 91.780 72.762 131.720 -48.307 89.494 -91.623 136.007 -61.001 98.763 -37.984 137.228-137.653 110.932-147.064 105.199 -76.497 92.936 0.000 129.490 -76.291 # 124 total E -1.55877E+02 rmsd from N 0.000 %NC 0.00 93.204 167.644 139.015 -94.689 93.105 56.744 143.765 21.950 92.690 44.893 106.044 -82.621 92.144 47.302 131.076 -77.228 94.140 45.237 141.337-114.918 90.521 42.738 60.118 -76.169 90.844 46.139 122.021 -41.711 92.754 41.794 125.574-102.339 90.121 46.772 143.186-141.944 88.907 54.414 78.970-101.805 92.347 153.001 128.655 -77.292 90.408 74.145 127.668-152.419 96.733 106.292 96.763 -79.970 92.400 -61.806 146.914 -42.175 97.459-125.816 143.550-141.221 91.296 47.731 137.696 127.908 91.234 48.174 134.774 -85.477 90.380 47.517 145.752 -45.301 91.101 46.151 136.338 -26.375 90.427 44.647 142.303-162.515 89.135 49.857 0.000 0.000 89.107 53.246 107.451 -81.343 88.436 43.338 139.306 -78.911 89.978 45.647 120.287-123.848 89.432 52.701 110.716 -77.966 88.975 50.942 138.128-101.211 91.575 42.579 130.885-130.509 96.638 -96.711 143.514-125.356 115.540-170.236 151.878 -17.281 138.425-169.605 108.944 -97.985 95.852 44.022 115.054 -77.373 92.006 48.843 101.595 -8.926 89.500 52.178 132.687 -1.804 89.269 49.307 129.779 -77.458 87.203 48.454 103.808 -82.413 87.998 61.190 143.447 -29.544 85.954 53.188 158.779-129.762 88.624 41.840 128.029 -76.387 88.210 53.714 112.890 -22.552 88.665 50.837 128.051 -76.856 88.527 48.092 135.003-125.894 88.449 55.588 132.181 -45.495 88.545 55.569 133.316 -52.549 89.755 44.332 138.059-112.053 94.696 80.400 104.076 -80.320 92.538 0.000 128.878 -76.715 # 125 total E -1.54351E+02 rmsd from N 0.000 %NC 0.00 93.032 154.474 139.620 -92.821 93.108 50.783 116.419 -30.469 92.677 45.798 104.423 -81.423 92.255 47.247 129.733 -75.489 92.232 44.708 109.432 -79.123 89.435 41.578 70.419 -65.979 88.610 53.796 122.218 -50.006 88.438 47.158 122.391 -91.526 88.407 43.974 133.125-109.375 90.119 49.137 84.078 -97.531 91.571 177.922 128.937 -78.766 91.719 80.298 134.161-163.286 91.867 45.830 107.452 -82.199 91.697 47.120 143.034 -32.464 92.389 39.342 139.618-122.367 93.686 48.468 122.895-127.331 93.016 40.072 125.343 -90.933 95.029-107.901 144.788-178.672 111.221 -88.778 86.709 -99.922 87.963 92.134 151.738 -9.805 89.966 64.007 0.000 0.000 91.315 44.984 111.021 -78.161 90.192 43.408 150.816 -82.091 90.885 47.962 118.666-129.797 87.999 53.727 113.544 -79.001 89.200 50.149 136.064-107.462 90.404 43.084 129.230-144.411 95.757 -92.640 104.764 -83.355 124.569 165.424 152.494 -14.590 131.611-165.081 108.848-102.346 97.021 45.901 115.339 -77.400 93.071 45.516 103.727 -6.600 92.086 46.464 128.196 -3.609 90.419 46.139 129.571 -77.241 89.879 49.094 103.665 -85.772 89.828 48.919 118.972 -23.185 91.786 41.369 128.203 -65.008 92.665 44.245 129.763 -76.903 94.708 113.372 112.240 -95.102 89.097 -60.311 129.761 -77.838 91.004 -46.679 145.537-133.595 88.644 -48.731 131.290 -21.237 90.171 -55.652 158.215-156.056 90.153 -44.194 128.808-149.730 94.751 103.320 103.145 -79.436 92.546 0.000 128.791 -76.545 # 126 total E -1.47590E+02 rmsd from N 0.000 %NC 0.00 92.903 158.925 135.441 -79.805 92.896 61.329 123.493 -29.978 94.348 43.069 104.428 -81.147 92.469 44.976 130.224 -76.095 93.977 44.852 114.950 -86.475 92.117 41.283 62.580 -68.348 90.006 46.718 120.552 -41.044 90.157 50.395 130.243 -99.297 88.522 44.460 128.359-113.476 90.228 41.685 87.965-100.878 93.282 78.976 143.625-110.143 90.042 71.433 104.031-127.140 86.777 96.225 127.178-125.981 94.274-158.881 115.382 -95.214 98.545 110.351 139.236-157.486 97.025 -50.994 127.853-121.105 100.288-127.503 150.885 -75.738 93.013 48.572 158.708-145.064 93.795 43.680 166.793 92.047 95.219 40.812 140.603 176.011 91.898 46.317 0.000 0.000 90.373 47.062 123.545 -95.868 93.132 40.785 164.095-151.362 93.163 39.725 107.759-132.487 91.913 47.262 112.969 -79.507 90.937 58.118 146.825-112.753 90.410 42.898 145.033-135.389 93.045 39.183 152.881 -21.889 101.392 -7.606 115.144 -89.267 138.956-157.650 103.456 -87.198 94.620 54.270 114.980 -76.753 92.405 49.450 102.350 -26.324 89.659 49.465 132.936 -13.678 91.819 48.512 130.154 -76.805 91.427 38.109 101.874 -83.605 90.876 50.198 118.564 -54.604 90.972 73.108 135.889 -44.734 87.556 52.922 130.345 -78.029 89.257 177.895 72.847 -85.572 92.959 61.897 133.857 -78.790 90.320 49.205 141.571-104.988 90.969 57.302 127.169 -32.867 94.093-132.204 135.428 -50.668 97.281 32.913 126.335-117.705 120.012 31.540 107.209 -76.434 92.424 0.000 128.768 -75.925 # 127 total E -1.47404E+02 rmsd from N 0.000 %NC 0.00 93.173 158.839 141.914-101.077 92.740 54.073 153.515 25.462 91.840 46.823 106.692 -80.339 90.631 50.557 130.362 -75.620 90.888 41.637 140.278-125.029 92.493 45.304 124.857 155.705 92.271 84.273 103.550 -52.647 83.280 -80.781 133.740 -87.388 92.809 -51.220 112.738 -84.240 89.666 -34.321 100.946 -70.986 103.151 -43.782 153.741-138.201 96.482 -44.853 107.565-128.872 102.695 155.401 109.124 -85.364 136.290 -92.794 169.947-165.491 111.852-119.809 141.415-155.011 96.459 43.451 148.620 168.895 93.455 44.941 135.111 -85.006 90.874 48.266 128.215 -66.736 92.898 54.742 106.463 -40.986 92.594 38.075 107.527 -81.619 90.453 47.880 0.000 0.000 90.253 61.582 104.365 -87.528 87.730 46.000 138.672 -75.477 90.464 42.161 118.131-121.379 90.857 51.615 108.788 -75.654 90.617 48.993 133.222 -85.710 92.256 41.722 133.168-133.250 94.405 33.532 115.449 -90.535 114.151 82.644 118.745 -82.503 130.346-146.444 115.015-110.324 108.353 2.111 114.314 -79.063 95.398-159.651 127.729-103.271 115.828 50.322 124.559 -77.209 93.825 36.323 130.451 -77.896 94.038 46.946 103.270 -84.608 91.528 53.536 120.759 -67.470 92.001 44.345 121.331 -76.960 91.248 40.868 130.618 -77.813 94.258 92.260 100.946 -98.108 90.170 -82.602 129.046 -77.415 92.093 -44.214 142.480-120.654 90.222 -51.087 130.124 -38.151 91.320 -52.292 140.389-100.889 91.210 -53.975 102.194 -88.354 94.771 75.812 105.340 -78.264 92.399 0.000 129.384 -75.983 # 128 total E -1.51436E+02 rmsd from N 0.000 %NC 0.00 93.035 157.483 137.301 -85.681 93.184 57.964 138.506 52.445 92.334 44.825 106.225 -82.075 92.197 46.732 130.428 -77.166 93.624 46.362 156.303-151.514 92.793 38.885 59.248 -74.482 93.761 44.952 123.357 -33.384 94.306 35.672 134.944-102.857 93.761 54.705 146.534-176.377 88.766 71.362 86.474-103.914 92.096-164.225 130.213 -96.435 91.056 67.536 99.194-125.831 90.806 49.733 103.633 -82.095 90.248 53.466 120.840 -10.511 92.466 36.804 105.197 -85.720 95.867 44.271 137.091 -98.844 98.522 -0.281 118.621 -68.546 131.678 142.973 123.190 -27.503 95.829 48.548 147.722-160.254 98.536 30.997 141.578-128.698 113.297 23.425 0.000 0.000 96.520 42.017 145.020 -21.343 92.697 54.519 150.170 -95.501 88.736 51.490 115.972-132.843 88.403 45.383 110.820 -76.109 91.383 48.593 144.737-101.804 92.753 51.892 134.199-127.484 92.722 -99.387 140.780-119.534 111.215 175.841 150.526 -17.633 132.146-168.783 110.988-106.509 94.864 45.596 114.968 -77.035 93.022 44.794 104.447 -14.746 91.999 46.846 127.823 -11.457 90.423 44.224 129.827 -77.897 89.166 51.820 102.719 -85.005 88.542 54.913 120.403 -31.425 90.424 40.636 128.878 -65.126 93.484 41.791 128.504 -76.173 96.285 87.896 111.771 -92.891 90.517 -81.582 129.170 -76.622 91.280 -44.269 144.001-112.979 90.030 -56.692 106.421 40.234 95.887 117.795 146.665 -19.641 98.317 31.853 139.252 179.388 101.983 19.724 105.922 -78.332 92.357 0.000 129.605 -76.298 # 129 total E -1.50106E+02 rmsd from N 0.000 %NC 0.00 93.144 171.126 138.498 -93.729 92.787 58.274 146.995 7.124 92.898 43.572 105.889 -82.842 92.293 50.637 131.942 -77.334 92.884 42.147 137.523-112.747 89.801 45.446 65.178 -79.516 89.452 49.609 115.825 -52.607 90.829 43.019 124.683 -98.357 87.800 48.539 145.995-175.339 89.762 56.068 77.885-105.840 87.507 163.115 141.190 -95.183 98.079 60.682 128.277-152.179 94.224 35.479 97.332 -80.683 92.320 52.400 145.016 -43.546 91.386 45.017 128.599-110.739 91.919 49.668 124.649-153.777 93.073 25.705 126.070 -99.098 102.104 150.637 143.073-146.817 107.706 34.921 144.187 108.459 92.388 49.958 140.533-130.818 98.083 35.368 0.000 0.000 98.553 39.109 138.444 -86.345 95.350 36.656 162.998-177.743 92.304 47.173 111.303-142.436 90.600 48.696 110.992 -79.084 89.910 49.906 149.167-113.654 91.778 43.500 134.110-139.242 95.812-101.183 143.013-124.973 113.663-172.083 157.218-144.939 136.630-164.891 108.112 -98.611 96.009 45.574 114.922 -77.261 93.122 45.493 102.890 -12.590 91.037 48.045 129.430 -6.700 89.420 49.818 129.774 -77.279 88.184 48.262 102.520 -83.163 89.509 46.255 134.164 -40.904 88.901 50.021 142.070 -85.766 88.466 45.320 127.237-106.733 88.714 51.149 111.028 -45.875 89.996 42.625 128.005 -76.273 92.120 51.050 133.499-136.102 90.898 58.671 128.351 -43.771 91.389-147.948 132.457 -90.308 94.439 46.846 139.487-145.333 106.768 167.778 101.867 -77.914 92.856 0.000 129.187 -76.437 # 130 total E -1.49287E+02 rmsd from N 0.000 %NC 0.00 92.970 141.343 143.457-104.199 93.666 53.958 129.864 44.012 91.327 43.944 106.256 -81.848 91.469 50.261 129.937 -76.575 89.933 46.467 152.556-150.536 90.857 43.356 62.555 -65.819 91.235 44.815 121.947 -28.337 88.597 46.061 136.707-101.440 91.031 55.097 115.076-103.496 88.625 73.210 95.099 -93.701 90.562-159.443 127.826 -95.862 93.423 67.222 98.491-120.504 94.807 38.346 102.531 -81.372 92.503 51.476 146.324 -23.167 92.999 38.007 111.961 -97.954 94.982 43.074 130.072-110.854 99.122 -8.466 121.688 -74.613 122.499 129.111 142.994 -70.129 94.415 47.216 154.369 114.128 92.914 42.691 142.229-164.160 94.199 42.142 0.000 0.000 91.887 43.814 140.980 -29.936 91.368 48.709 133.695 -91.919 89.152 50.271 121.944-125.148 89.134 44.682 105.939 -78.498 91.572 51.676 133.846 -74.590 91.500 47.534 135.786-140.648 93.836-120.004 147.778 -37.198 95.317 169.503 114.103 -79.477 102.597 -12.084 96.424-116.771 109.701 -65.673 117.860 -78.875 103.272-102.151 123.133 -73.816 90.727 68.573 126.988 -31.617 91.241 52.744 129.148 -75.841 88.415 46.608 145.519 -22.239 90.200 47.991 138.467-118.366 87.886 50.448 139.930-177.098 88.297 48.557 127.563 -76.219 88.720 48.678 103.328 -54.414 90.212 44.433 128.323 -75.121 90.658 45.420 128.980-161.149 90.470 49.316 127.803 -43.066 88.972 54.166 137.020 -90.950 90.336 43.036 126.145-134.298 95.359 75.091 104.211 -80.543 92.485 0.000 128.956 -76.668 # 131 total E -1.47487E+02 rmsd from N 0.000 %NC 0.00 121.882 -85.689 153.650 -94.441 127.639 -98.366 131.414 -48.150 93.260 45.193 143.797 -29.482 91.982 48.030 129.675 -76.401 89.385 50.565 152.554-150.968 93.553 40.421 98.569-128.599 89.532 49.782 132.499 -39.118 88.617 69.517 129.202-126.248 83.538 65.986 133.943 164.644 83.606 63.050 83.544 -95.492 89.164 109.701 125.731 -81.261 94.276 72.841 97.696-107.524 92.782 97.355 101.906 -83.891 94.949 -59.986 125.150 -87.901 98.994-120.466 150.114 -41.870 92.867 48.217 142.180 139.089 93.164 46.519 136.525 -83.753 91.760 43.631 134.034 -48.804 91.957 49.446 108.888 -27.695 89.311 46.190 108.584 -81.515 91.668 44.140 0.000 0.000 95.213 34.643 112.228 -79.704 100.447 34.786 143.851 -72.824 96.643 38.528 143.147-178.688 97.298 101.938 113.625 -78.283 93.253 -47.283 131.145-110.288 96.382 -67.451 137.883-122.579 93.083 38.581 144.412-131.811 125.292 -69.761 120.002 -84.384 111.817-107.981 99.486 -84.926 100.491 -35.077 113.198 -81.111 96.105-120.259 126.598 -25.485 92.084 53.046 116.641 -73.747 90.960 49.142 129.277 -76.098 88.576 45.172 103.275 -80.159 90.869 50.776 139.418 -30.078 87.847 44.418 144.995-109.562 91.100 44.427 128.255 -76.761 90.222 47.969 113.471 -34.010 89.744 47.979 130.298 -77.314 89.735 44.700 134.787-136.192 89.652 51.372 130.805 -45.110 88.818 55.132 136.467 -57.070 89.737 44.085 135.153-119.493 94.703 79.938 103.812 -80.353 92.533 0.000 128.903 -76.689 # 132 total E -1.52357E+02 rmsd from N 0.000 %NC 0.00 93.059 -53.431 130.829 -91.826 94.784 -47.853 118.018 -79.455 91.198 -46.594 103.054 -77.323 90.485 -47.729 129.033 -76.020 91.137 -41.951 143.653-136.099 92.997 -43.516 60.024 -68.314 91.840 -45.832 132.753 21.950 107.167 -79.054 168.450 153.838 107.414 -6.703 119.435-103.023 103.076-147.017 88.368 -79.251 109.476 75.745 148.112 177.880 95.929 37.466 91.931-120.507 93.204 46.920 113.417 -90.013 89.673 58.134 146.527-138.736 89.210 49.944 129.542-117.479 91.495 52.374 128.284-105.399 95.954 -61.753 125.417 -64.438 124.727-164.122 139.238 -66.266 113.029 27.530 143.662 99.215 94.028 46.616 143.811-171.783 92.229 43.610 0.000 0.000 91.240 47.438 137.231 -29.849 89.524 48.518 148.400 -84.198 89.429 45.790 120.152-131.992 88.351 50.068 106.528 -73.322 91.074 48.348 139.808 -48.627 92.181 41.597 134.751-131.888 94.827 31.669 115.466 -89.612 126.241-171.269 108.462 -74.682 91.536 71.676 137.148-166.469 88.645 53.444 113.055 -76.362 88.690 61.609 121.994 -28.810 87.871 50.895 106.514 -71.054 89.568 42.020 128.049 -75.747 89.078 49.827 101.442 -82.059 89.828 48.090 125.057 -49.749 90.347 41.476 134.826 -80.002 92.734 40.211 128.456 -76.873 91.655 47.725 105.607 -56.107 90.713 48.064 129.292 -77.154 90.054 43.365 136.999-146.881 91.002 46.495 128.007 -43.373 90.613 52.020 136.445 -93.323 90.496 43.828 133.950-138.942 95.421 73.172 104.220 -80.476 92.517 0.000 128.995 -76.648 # 133 total E -1.47104E+02 rmsd from N 0.000 %NC 0.00 92.907 145.006 138.856 -89.305 93.859 51.724 149.366 143.909 90.851 48.955 107.411 -80.326 90.580 47.486 128.274 -75.443 91.745 47.509 159.115-140.133 94.277 32.819 128.786-155.424 97.448 38.380 116.132 -18.740 113.816 12.557 117.693 -64.800 92.820 48.629 146.245 -34.087 96.057 28.575 78.946-105.680 95.842 56.077 146.727-142.301 99.424 -2.321 89.239-109.971 105.377 66.451 113.669 -81.997 104.430-137.823 123.530 -94.362 115.401 -91.529 142.336-168.058 93.208 53.586 143.446 80.135 92.970 43.299 134.367 -85.073 91.796 46.748 138.940 -70.197 91.052 46.890 146.331 -29.211 91.374 41.942 107.021 -80.145 94.943 39.843 0.000 0.000 97.290 32.184 113.181 -82.086 97.691 41.708 149.031 -81.197 93.040 41.367 121.188-130.401 92.929 64.068 115.147 -80.104 92.212 -75.697 135.724-108.293 113.914 -58.880 131.566-144.714 95.447 -36.286 150.497 -20.816 106.363 172.978 150.721 -13.718 125.776 -92.793 112.660-113.133 89.520 60.001 112.654 -75.900 90.413 56.036 118.290 -61.578 89.678 48.921 105.392 -66.617 90.033 42.075 129.565 -76.394 91.210 43.363 104.037 -85.864 91.569 45.171 124.681 -78.838 89.914 49.852 136.853 -93.790 93.736 77.771 122.839 -99.770 94.868-171.735 111.833-125.878 92.052 54.257 152.130 -87.276 91.651 44.547 140.453-104.745 89.703 50.481 132.454 -28.582 90.237 60.354 138.359-126.863 87.566 40.216 127.401-157.528 95.173 84.497 103.079 -79.299 92.510 0.000 128.879 -76.530 # 134 total E -1.50811E+02 rmsd from N 0.000 %NC 0.00 92.701 -19.177 130.101 -81.782 126.605-107.057 135.068 -41.231 93.626 47.173 145.729 -26.089 91.870 47.902 129.886 -75.850 92.533 41.659 153.369-146.191 91.477 43.159 122.920 155.714 92.600 42.343 117.122 -49.515 94.130 38.759 136.500 -90.826 90.988 47.897 147.570-153.054 89.422 57.208 79.089-108.753 90.406 38.217 131.164 -86.647 105.043-120.820 96.576 -85.737 116.254 178.171 107.017 -83.538 138.650-105.446 172.798-166.265 103.343-118.197 137.435-144.032 93.804 45.544 151.619 169.382 92.778 46.228 133.767 -84.734 91.257 48.322 137.937 -41.360 89.885 48.995 115.690 -45.556 88.925 48.811 110.432 -82.394 91.224 42.280 0.000 0.000 89.279 51.297 126.393 -75.460 89.666 41.235 127.823 -94.288 91.048 49.084 122.056-121.493 90.328 51.332 108.737 -77.190 91.850-119.459 125.210 -81.945 94.812 -74.081 138.657-114.633 95.044 90.063 142.676-171.264 105.235-109.813 100.098 -79.434 106.356-114.212 96.991 -79.128 93.395 -35.734 116.804 -82.210 97.945-118.008 127.538 -22.919 90.619 51.711 117.722 -71.250 91.272 48.617 129.266 -76.022 89.219 43.497 103.762 -81.591 90.424 49.291 140.609 -34.049 88.488 46.180 145.474-110.166 90.770 41.622 128.209 -76.827 90.613 47.145 116.043 -44.082 90.072 45.180 129.788 -77.753 90.846 49.051 137.117-134.278 89.414 50.614 127.724 -42.622 89.385 53.319 134.539 -89.202 90.398 43.847 133.091-130.269 95.338 74.048 104.231 -80.453 92.520 0.000 128.990 -76.648 # 135 total E -1.51941E+02 rmsd from N 0.000 %NC 0.00 93.118 -66.065 127.960 -74.694 120.246-102.456 130.690 -40.644 92.276 43.129 108.607 -80.127 93.316 50.772 130.799 -77.046 93.404 39.832 155.201-146.332 93.502 41.922 67.600 -99.433 89.287 47.511 108.890 -57.198 88.858 58.763 135.957 -89.334 85.763 46.889 132.748-123.257 90.277 40.743 73.888 -95.461 93.762 171.796 133.157 -59.890 95.906 63.967 137.204-165.462 97.161-135.919 104.367 -82.583 111.199-134.490 159.441-146.177 102.168-119.562 134.042-160.477 92.985 46.599 138.246 133.070 91.379 47.504 133.930 -85.380 90.767 47.295 125.535 -66.147 91.738 47.712 131.326 -27.801 92.395 41.527 107.802 -82.625 90.643 46.346 0.000 0.000 90.560 52.958 103.593 -86.105 87.785 50.318 143.510 -78.078 89.991 40.001 121.764-132.641 95.495 95.897 111.933 -77.442 91.218 -60.070 156.340-140.209 95.989 -55.572 138.825-119.480 91.415 -38.555 142.351-125.148 108.304-156.329 154.636 -12.198 110.477-132.451 113.917-123.399 98.856 35.455 115.220 -77.594 94.545 45.482 108.909 -27.546 94.685 42.179 129.174 -11.850 91.379 48.422 129.764 -77.220 88.553 47.818 101.216 -83.833 91.237 42.657 130.986 -53.889 92.712 51.464 133.059 -76.198 91.337 62.582 138.323-107.950 93.663-167.947 63.320 -92.635 92.214 58.933 156.826 -90.544 90.837 47.139 142.509-118.982 88.733 64.421 143.731 -79.818 88.944 67.269 145.701 -42.797 86.697 41.281 139.458-150.001 95.994 84.137 100.228 -78.316 92.461 0.000 129.091 -76.280 # 136 total E -1.47584E+02 rmsd from N 0.000 %NC 0.00 122.594 -90.712 150.639 -71.276 94.697 -48.493 115.757 -78.334 90.945 -46.291 103.326 -77.315 90.719 -46.300 130.121 -76.163 91.452 -40.549 139.197-124.186 94.220 -41.729 62.854 -66.002 91.943 -36.770 132.450 2.098 104.571 -31.690 168.382 149.950 94.711 -51.204 125.312-116.418 96.452-161.761 81.034 -84.645 93.615 75.870 159.449-159.744 94.213 6.416 93.333-121.543 106.125-142.603 108.481 -82.901 123.582-111.345 151.303 -14.505 93.994 -22.429 139.701-133.907 109.385 -27.589 153.231-150.678 124.758-101.189 154.235 -34.891 93.458 45.296 137.025 -90.394 94.580 47.824 159.110 146.912 95.504 35.424 103.878 -79.481 99.026 37.924 0.000 0.000 99.236 28.067 114.715 -86.559 100.553 35.886 167.940-165.291 98.751 37.235 109.323-135.699 91.862 50.644 118.562 -77.697 91.631 61.781 136.771-113.842 90.591 75.799 147.354-139.580 90.918 -69.468 104.249 -85.587 118.692 154.454 150.556 -16.588 107.132 -71.041 95.776 -93.410 114.917 -14.043 115.247 -80.092 92.338 -53.626 98.766 -49.399 90.004 -45.558 130.251 -12.986 91.854 -50.571 126.502 -73.974 89.244 -39.002 103.952 -90.951 90.221 -56.833 105.860 -72.801 86.632 -56.058 152.861-134.886 89.210 -45.039 129.448 -77.671 94.075-123.612 126.974-125.252 90.882 51.944 132.088 -77.165 91.006 51.579 140.862-109.126 90.294 58.402 124.982 -18.293 91.233-129.721 131.440 -62.597 98.045 31.810 105.314 -86.367 123.045 22.899 104.700 -74.281 92.441 0.000 128.548 -76.227 # 137 total E -1.49194E+02 rmsd from N 0.000 %NC 0.00 93.044 150.745 141.334 -98.092 93.503 51.652 138.865 46.303 90.848 47.991 105.973 -82.451 91.806 48.883 130.248 -77.829 94.367 47.773 152.834-139.493 92.898 42.987 61.838 -81.298 89.604 48.925 132.695 -55.630 90.281 61.218 121.246-123.263 85.527 57.707 137.355-169.556 86.162 164.671 80.072 -94.364 93.625 61.898 154.130-155.245 93.253 42.372 93.402-122.100 92.284 46.457 103.548 -81.145 92.153 46.558 143.539 -46.135 91.157 45.274 135.847-129.218 93.193 52.311 125.771-118.555 95.266-107.637 123.325 -80.013 94.132 131.722 137.296 -93.435 92.280 112.083 154.855 178.255 88.538 56.273 156.388 -30.098 88.337 54.422 0.000 0.000 88.345 49.361 129.803 -31.991 89.920 46.007 136.026 -80.093 90.056 48.882 124.908-126.964 88.710 50.563 106.032 -74.301 90.257 50.717 124.225 -56.006 91.395 38.463 138.077-126.964 94.596 49.891 113.477 -89.776 96.139 13.109 140.859 -95.772 129.560 152.772 112.236-108.495 119.332 11.804 123.636 -80.904 94.591 53.721 131.027 144.648 99.850 76.460 110.839 -74.824 93.167 -70.678 128.750 -76.370 93.284 -43.407 100.438 -87.361 86.640 -68.169 103.523 -57.434 85.834 -58.462 156.549 -35.003 90.565 -45.195 126.790 -74.784 92.954-127.591 117.806-126.279 91.438 57.185 131.358 -76.669 93.229 45.110 138.402 -98.511 93.569 37.793 116.495 -7.747 94.107 58.884 152.179 -31.893 90.050 78.989 110.698 -92.000 92.377 86.733 95.977 -77.809 92.435 0.000 129.156 -76.111 # 138 total E -1.54338E+02 rmsd from N 0.000 %NC 0.00 93.136 -64.096 128.965 -82.874 94.754 -46.537 115.605 -80.093 90.894 -47.006 103.217 -77.189 90.463 -46.163 129.782 -76.300 92.538 -40.907 140.541-127.619 94.245 -41.094 60.621 -60.666 91.458 -42.329 131.022 24.778 99.619 -44.590 167.826 167.805 90.905 -62.390 116.142-114.970 88.732 -82.274 83.274 -85.581 110.365 158.797 138.790 170.822 107.479 -18.472 91.042 -97.304 98.875 115.126 109.340 -80.549 94.865-131.585 152.374-142.363 110.153-109.720 141.412-160.932 93.764 44.588 143.917 153.436 92.188 45.840 134.439 -85.624 90.256 49.236 126.614 -64.630 91.789 51.072 111.829 -33.738 91.497 39.775 107.823 -81.837 90.030 48.655 0.000 0.000 89.917 60.493 106.156 -85.088 86.930 45.161 141.786 -76.931 88.971 45.154 117.546-123.510 89.901 52.964 107.958 -78.024 88.659 50.215 140.238 -93.104 91.461 43.805 129.958-134.180 97.116 -96.412 104.607 -83.027 113.022-168.932 151.863 -17.242 137.517-168.879 110.126-101.288 97.706 43.733 115.370 -77.601 93.011 45.836 101.520 -10.560 90.132 51.288 128.877 -16.773 89.205 51.943 129.783 -76.977 88.534 45.079 102.701 -82.596 89.428 45.429 136.692 -48.306 89.456 54.976 147.324-103.559 88.681 45.140 128.366 -77.087 88.397 46.807 106.891 -56.827 90.178 50.606 129.062 -76.712 89.185 47.693 136.731-111.637 88.757 50.426 130.573 -42.418 89.687 53.803 133.999 -54.702 89.841 44.576 140.852-118.266 94.788 79.299 104.004 -80.722 92.534 0.000 128.901 -76.700 # 139 total E -1.53735E+02 rmsd from N 0.000 %NC 0.00 93.099 164.886 137.332 -87.766 92.700 58.821 147.380 56.376 92.732 44.211 106.302 -80.472 92.566 49.409 131.987 -77.517 94.154 41.322 152.958-146.454 92.066 41.008 62.653 -82.147 93.483 42.523 117.249 -52.413 95.861 37.141 138.443 -93.850 92.576 45.607 149.310-154.920 90.277 47.164 82.273-106.417 93.549 172.727 128.151 -87.338 90.582 75.890 132.557-161.170 90.998 48.207 100.269 -79.980 91.646 50.616 142.029 -33.374 91.659 39.209 138.449-113.544 93.466 48.143 123.195-126.152 93.385 38.383 125.171 -90.009 97.416-113.038 149.984-178.111 116.361 -83.264 86.794 -98.008 88.969 91.925 151.460-175.217 88.387 56.254 0.000 0.000 89.923 48.331 106.778 -78.250 89.488 45.724 146.298 -73.715 90.559 44.452 119.400-127.658 88.686 52.392 114.295 -79.397 89.110 52.096 136.902-109.659 90.897 50.524 133.637-117.259 94.324-100.462 103.197 -82.860 109.673 168.678 149.401 -18.562 137.751-117.631 108.590 -98.540 87.319 75.503 112.254 -75.470 89.649 68.430 118.698 -51.607 90.800 45.120 126.195 -33.591 91.585 42.103 128.989 -76.145 89.314 49.904 100.921 -81.564 89.285 54.262 131.678 -53.400 88.628 44.971 148.151 -99.324 91.106 39.530 128.351 -76.739 91.112 49.707 112.188 -47.319 89.849 49.015 130.182 -77.741 89.641 44.437 138.707-124.838 89.850 49.427 129.996 -42.761 89.753 54.283 137.322 -55.541 89.711 44.272 138.164-124.776 94.722 79.944 103.967 -80.327 92.539 0.000 128.886 -76.712 # 140 total E -1.46786E+02 rmsd from N 0.000 %NC 0.00 92.899 145.951 138.407 -87.267 93.077 56.267 135.704 52.449 91.549 45.161 106.403 -82.934 91.893 49.009 129.664 -76.167 92.356 44.957 157.913-163.966 92.332 39.833 61.905 -72.347 93.740 43.605 124.149 -32.418 92.170 41.297 141.799-100.635 92.049 51.116 142.042 160.258 92.584 89.498 85.643-102.748 91.725 -66.018 136.692-103.618 96.309 -51.162 92.479 -86.605 90.866 -49.223 151.550 -33.982 93.275 -41.178 153.882 -31.678 94.678 -40.598 143.454-164.646 95.307 -42.823 132.768-117.531 93.833 -96.186 130.573 -76.770 91.254-107.235 149.006 50.383 92.889 50.556 118.532 151.794 109.328 -71.879 111.348 -82.412 102.095 140.783 0.000 0.000 92.049 50.125 164.981-162.815 92.853 44.742 133.280-101.597 89.988 43.293 117.373-123.311 90.224 50.343 111.867 -75.717 92.904 41.727 136.547 -89.850 99.038 22.554 135.172-146.821 101.625 41.086 151.747 -21.869 96.212 77.868 150.029 -34.723 93.018 51.322 99.496-129.921 92.769 31.432 113.427 -79.251 98.375 43.640 136.627-117.701 129.943 175.876 115.467 -76.004 90.656 64.540 159.255 -79.887 90.483 45.746 138.537-156.853 89.547 46.195 118.127 -11.916 88.917 53.397 147.275 -28.987 87.958 49.148 128.265 -76.942 87.640 49.617 114.625 -35.976 89.532 45.624 128.687 -75.442 90.750 45.682 144.802-110.200 90.292 45.293 129.926 -43.584 89.716 51.702 127.703 -59.753 90.772 45.046 106.077 -95.816 94.565 79.749 104.069 -80.498 92.540 0.000 128.899 -76.701 # 141 total E -1.50768E+02 rmsd from N 0.000 %NC 0.00 93.436-166.960 136.242 -88.160 93.710 60.253 133.518 44.741 93.721 40.004 105.653 -79.658 91.794 49.631 132.226 -77.127 90.200 42.650 148.612-148.796 90.998 45.124 57.892 -62.008 90.480 45.433 115.156 -14.969 88.574 47.888 138.210 -94.199 91.421 40.776 118.833-110.390 94.119-166.023 93.360 -88.270 123.176 128.628 144.746-174.317 96.623 45.740 91.226-122.788 97.780 56.633 111.870 -85.899 96.488 -92.085 156.845-141.804 110.821-110.224 143.615-162.229 94.758 46.928 153.600 161.485 93.703 44.285 132.122 -85.989 90.765 48.475 130.571 -57.026 91.550 51.885 86.209-123.504 90.166 42.654 133.817-162.796 90.232 46.518 0.000 0.000 89.513 58.599 109.467 -82.414 88.189 47.045 142.634 -80.328 88.873 42.903 118.630-127.364 89.763 53.064 109.649 -78.263 89.684 53.098 141.817 -99.693 89.413 42.600 128.561-162.509 95.118-106.253 104.993 -83.652 106.844-166.433 154.922-137.168 99.622 -55.728 94.385 -96.435 93.506 -43.157 111.851 -76.530 93.220 -40.736 117.625 -36.484 92.843 -46.611 112.134 -73.838 90.861 -45.389 127.902 -76.486 88.425 -46.645 140.803 -39.559 90.539 -46.396 145.373 -24.273 94.574 -34.659 165.473-178.392 95.853 -45.471 129.056 -76.954 94.715 -62.720 125.246 -44.180 92.493 112.469 129.159 -75.621 93.694 38.633 141.104-102.099 93.164 56.940 139.590 -29.736 93.880-141.260 145.474 -40.533 97.897 30.894 134.016-143.470 121.315 79.116 104.935 -77.681 92.524 0.000 129.943 -76.674 # 142 total E -1.48118E+02 rmsd from N 0.000 %NC 0.00 93.245 168.657 140.636-100.188 93.600 53.582 135.849 30.740 91.777 45.654 106.071 -81.507 91.431 48.856 131.536 -77.602 93.191 43.497 145.901-126.551 91.340 43.354 56.217 -69.133 89.936 49.312 122.821 -29.196 89.191 51.858 127.994-102.146 87.408 43.311 137.813-139.059 95.580 98.109 80.437 -99.978 91.373 -64.640 145.664 -97.614 94.154 -45.332 94.468 -89.771 88.773 -53.163 150.774 -28.111 92.715 -48.090 138.967-122.501 90.497 -43.847 126.278-156.800 95.414 83.313 138.478-125.988 127.931-130.781 142.223 -92.091 130.890 -32.987 135.312 17.088 94.393 68.547 158.709-138.325 97.958 49.029 106.026 -83.353 112.965 10.301 0.000 0.000 91.624 57.638 153.222-164.240 92.876 42.711 105.624-113.841 90.424 45.126 114.210-107.654 89.754 49.088 112.115 -77.931 90.168 52.838 131.755 -93.711 90.635 40.093 132.094-141.030 95.763-120.346 106.944 -83.717 109.677 171.616 151.085 -14.416 126.927-124.606 119.433-122.266 95.244 58.620 114.678 -76.646 91.957 46.453 104.102 -14.908 91.208 46.573 111.735 -70.763 91.162 45.285 129.177 -76.564 91.242 41.270 102.481 -82.534 90.796 49.057 146.982 -27.750 89.399 46.709 143.929-115.984 90.585 41.046 128.262 -76.826 89.716 50.101 124.824 -58.133 90.051 47.994 128.077 -76.226 90.614 43.478 136.810-113.930 91.156 45.771 128.993 -42.825 91.212 51.719 135.424-102.289 90.537 43.611 134.198-141.645 95.640 71.445 104.284 -80.371 92.518 0.000 129.025 -76.647 # 143 total E -1.46469E+02 rmsd from N 0.000 %NC 0.00 92.865 -43.864 125.336 -75.446 94.970 -46.450 117.689 -72.637 94.866 -38.089 103.904 -78.104 94.611 -40.749 125.852 -73.372 97.647 -24.439 149.473 -33.092 103.648 -34.881 62.119 -65.483 94.915 -27.471 128.014 -42.026 104.771 -27.108 133.369 -72.305 102.434 -44.806 140.362 -78.252 94.347 41.270 133.916-133.226 139.346 -75.717 143.279-166.935 105.199 -45.668 90.061 -97.605 100.320-118.183 111.294 -82.518 146.828-120.715 156.261-161.258 107.178-109.737 110.012 -86.690 95.044 48.949 142.368-108.615 94.123 45.095 138.996 -74.087 91.866 44.410 135.927 -61.919 94.040 47.323 133.404 -32.619 93.700 42.536 144.897-165.813 91.659 42.463 0.000 0.000 92.113 52.617 105.399 -85.550 87.882 45.817 145.246 -76.376 89.519 44.681 118.291-127.339 90.314 47.640 107.864 -75.612 90.365 47.044 134.767 -80.681 93.438 35.117 136.759-143.022 96.176 48.829 113.927 -89.470 94.479 33.455 141.634 -96.862 117.995-125.853 115.594-121.182 93.209 -15.910 113.558 -77.417 104.285-135.073 126.400 13.373 114.504 -7.867 121.179 -77.146 94.004 -57.536 127.758 -76.395 100.731 -1.643 107.996 -86.675 103.017 -56.113 104.772 -66.369 86.570 -53.052 144.899 -45.708 91.037 -54.689 130.482 -77.356 91.693-135.427 120.358-127.064 92.425 47.300 131.404 -77.027 91.721 48.741 140.495-109.434 91.007 65.706 125.663 -7.886 92.553-124.053 133.759 -56.910 97.224 22.023 123.001-112.431 127.215 91.235 102.265 -78.123 92.608 0.000 129.708 -76.973 # 144 total E -1.49039E+02 rmsd from N 0.000 %NC 0.00 93.212 159.447 142.486-105.031 93.729 51.531 143.434 21.851 91.292 47.246 106.175 -82.862 91.471 52.576 130.551 -76.880 94.123 43.483 142.605-122.743 91.473 42.244 64.127 -84.482 90.477 46.678 115.663 -53.221 90.059 53.961 128.741 -95.038 88.787 39.177 132.357-120.338 98.792 105.996 90.509-102.522 130.031-116.550 157.070-101.943 94.626 49.585 98.396 -89.251 93.976 43.966 103.384 -73.679 93.421 46.377 144.700 -43.972 90.679 46.859 134.574-125.911 91.934 47.132 125.026-118.536 96.047-135.836 122.298 -87.127 95.067 121.949 138.008 -98.666 113.339 125.177 128.046 -77.165 95.196 53.410 114.332 -86.269 90.901 49.133 0.000 0.000 89.597 52.617 133.437 -16.890 89.089 52.982 138.664 -87.749 91.280 55.277 124.936-138.702 94.261 159.048 113.839 -76.813 147.510 63.870 176.416-170.639 132.065 -10.690 147.024-156.250 95.304 60.950 145.183-135.018 95.145 51.699 142.328-108.671 107.624 167.199 93.603 -78.000 91.870 49.017 125.915 27.780 90.707 50.016 94.538 -19.960 89.983 50.808 116.166 8.294 88.603 48.242 129.341 -76.883 87.934 50.383 102.297 -83.914 89.833 49.154 136.137 -27.728 89.805 41.301 140.380 -83.123 92.298 43.802 128.538 -77.065 90.052 53.233 113.919 -38.307 89.604 51.321 129.178 -76.605 88.266 43.369 121.048-155.080 90.591 51.160 131.309 -45.871 89.709 53.384 138.357 -52.716 90.024 44.817 141.420-133.683 94.535 80.009 103.972 -80.348 92.537 0.000 128.885 -76.711 # 145 total E -1.53390E+02 rmsd from N 0.000 %NC 0.00 93.185 -66.647 131.158 -90.057 94.759 -46.222 122.014 -83.937 90.314 -49.352 102.754 -77.961 89.719 -52.158 127.393 -75.193 89.027 -41.218 140.293-136.945 92.203 -44.150 59.931 -56.007 91.404 -39.403 163.463 141.421 99.250 -37.332 170.038 145.784 98.066 -43.152 125.713-120.423 94.009 141.979 83.981 -71.030 93.413 92.666 142.275-103.160 92.162 34.576 96.066-119.805 98.229 55.209 103.051 -83.418 96.653 -9.561 141.026 -81.373 125.722-175.045 108.371 -87.325 98.938 39.058 148.226 159.436 95.162 43.039 136.368 -85.503 91.449 48.623 138.299 -61.186 90.715 52.597 110.883 -36.898 89.666 44.242 153.844 -20.355 90.279 45.464 0.000 0.000 89.985 51.195 108.359 -88.363 88.947 55.224 145.606 -81.034 87.981 47.868 123.947-134.852 88.436 48.739 106.229 -73.383 91.938 49.456 140.099 -36.920 92.482 40.181 137.640-137.262 94.537 32.768 116.733 -90.196 129.115 175.828 103.499 -78.190 93.311 57.155 135.207-162.074 91.825 48.616 113.768 -77.334 90.185 91.184 133.623 -35.287 89.015 57.328 114.550 -73.132 90.876 40.566 129.006 -76.229 89.376 47.890 107.514 -83.263 88.162 57.151 138.251 -51.895 87.043 51.482 151.521-125.601 89.156 40.594 128.076 -76.501 89.498 49.723 111.352 -40.843 89.251 50.512 129.351 -77.268 89.263 47.448 136.689-124.337 89.021 49.027 126.932 -38.669 88.871 61.103 142.614 -88.938 88.492 49.189 133.354-130.915 92.100 98.052 101.905 -80.531 92.600 0.000 128.567 -76.934 # 146 total E -1.47835E+02 rmsd from N 0.000 %NC 0.00 93.173 -71.111 129.793 -85.379 94.110 -47.380 122.120 -79.959 90.693 -47.532 103.214 -76.954 90.879 -50.077 126.343 -75.088 92.838 -27.678 148.138-142.088 102.860 -35.520 52.411 -74.230 97.215 -26.294 127.432 -47.129 104.554 -31.294 138.523 -79.039 100.133 -45.512 142.527-109.819 92.355 64.183 118.541-131.000 139.438 -98.443 123.568-114.436 94.305 -23.764 95.962 -97.081 111.431 -71.261 110.091 -78.154 126.301-152.253 155.752-114.908 105.686-123.657 102.203 -92.227 95.689 43.497 139.303 132.988 92.105 45.320 136.069 -89.996 90.339 53.078 157.880-105.948 91.692 49.808 125.299 -22.777 94.330 33.765 105.738 -82.793 91.331 49.383 0.000 0.000 91.973 51.463 97.926 -87.688 88.473 47.256 176.434 178.162 90.852 41.448 106.361-135.863 91.829 51.437 111.980 -78.050 90.131 88.222 152.310-119.686 91.918 39.023 145.698-149.695 93.986 54.821 113.768 -88.300 98.333 -0.984 142.499 -89.363 137.181 -77.239 108.679 -97.460 97.628 -32.924 110.990 -77.513 91.339 -57.239 111.211 -44.988 88.695 -47.881 107.366 -72.582 90.275 -44.215 127.618 -76.951 89.543 -44.858 101.573 -79.823 87.611 -57.143 132.395 -37.005 87.572 -52.774 146.401 -42.629 88.686 -50.068 128.612 -76.185 93.308-137.748 120.415 -17.886 91.241 45.661 130.923 -76.493 91.736 52.776 138.334-141.595 91.197 55.298 128.563 -37.192 91.201-124.257 123.341 -72.855 95.431 -21.519 137.312-140.762 115.177 -85.535 106.067 -74.766 92.912 0.000 129.353 -76.537 # 147 total E -1.51058E+02 rmsd from N 0.000 %NC 0.00 93.287 169.212 140.547-101.774 93.512 53.625 133.616 34.811 91.623 45.420 105.989 -81.276 91.339 49.198 131.554 -77.469 92.420 44.136 145.929-134.650 91.780 43.460 56.963 -67.935 90.379 45.940 120.083 -28.204 89.552 51.411 131.546-102.364 88.744 44.959 123.464-115.548 94.025-178.545 85.290 -92.459 125.668 106.549 161.294-163.239 94.033 55.724 94.319-122.459 97.164 56.383 106.493 -86.731 96.565 -92.753 162.033-132.333 105.849-111.738 140.311-156.999 93.640 47.478 154.788-178.154 94.212 44.623 131.778 -85.625 91.634 44.173 130.541 -57.169 92.765 49.223 78.610-115.669 91.259 43.679 139.321-169.441 91.642 41.646 0.000 0.000 91.687 48.390 109.958 -83.852 90.547 48.522 145.518 -83.121 90.010 41.336 118.252-130.056 89.555 50.404 115.957 -79.412 91.071 50.564 137.155-111.644 91.150 47.964 131.211-167.878 93.714-105.527 151.371 -32.365 106.731-174.779 114.150 -76.955 105.310 -61.555 94.625-104.280 115.374 -13.291 115.425 -79.750 94.405 -49.543 111.170 -56.779 93.933 -39.318 114.242 -74.897 91.824 -50.732 127.033 -76.245 88.155 -41.837 104.925 -82.611 89.507 -51.996 121.207 -74.701 88.251 -53.489 147.959-144.396 89.492 -44.113 128.214 -76.507 92.706-119.931 126.965 -36.416 91.351 53.841 132.138 -77.003 91.708 48.106 143.699-121.931 92.304 69.535 130.344 -36.976 91.921 -89.901 139.921 -50.028 98.987 -36.930 130.122-111.295 114.075 128.214 101.689 -78.318 92.426 0.000 129.860 -75.555 # 148 total E -1.47791E+02 rmsd from N 0.000 %NC 0.00 121.790 -84.587 153.212 -87.445 129.738 -95.120 132.172 -42.667 95.405 41.490 143.705 -29.052 91.975 49.079 130.472 -76.426 88.566 47.951 147.799-149.518 89.591 46.275 98.047-126.233 90.628 43.057 107.554 -62.440 89.017 51.379 144.749 -73.442 89.899 32.965 124.543-113.874 95.917 54.742 90.142 -94.853 94.815 7.780 136.458 -88.024 114.726-119.005 95.552 -83.530 108.268-142.962 105.167 -81.530 130.266-141.832 175.257-163.524 112.699-104.446 139.636-150.288 92.872 48.809 139.627-107.746 92.556 45.962 133.838 -75.353 91.126 47.707 139.879 14.412 90.890 44.678 150.448 9.242 90.919 45.348 110.389 -82.467 90.501 47.023 0.000 0.000 89.424 47.181 134.517 -34.148 89.968 46.597 136.829 -83.778 89.751 51.263 124.517-128.816 89.336 44.986 107.203 -75.175 94.622-118.289 121.168 -64.177 96.138 -71.345 137.563-117.970 96.261 74.942 148.295-156.038 108.342-111.204 103.717 -79.932 106.392-124.047 98.414 -85.549 107.603 -38.898 116.346 -85.196 99.390-116.636 129.488 -34.499 91.556 52.889 117.583 -71.068 90.729 47.266 129.433 -76.118 87.948 46.460 105.798 -81.799 89.819 48.395 139.653 -40.414 89.110 45.031 151.391-114.861 90.902 40.522 128.156 -76.755 89.520 50.464 109.984 -41.572 90.360 46.982 127.617 -76.801 90.502 45.837 135.639-158.543 93.643 78.552 129.495 -47.355 88.415 -84.341 145.528 -87.863 95.737 -38.887 134.501-138.065 101.383-114.171 104.457 -70.585 93.023 0.000 129.233 -76.796 # 149 total E -1.46859E+02 rmsd from N 0.000 %NC 0.00 93.099 -67.213 123.377 -65.990 94.839 -45.428 132.081 -81.722 96.011 -37.796 102.182 -79.920 93.398 -41.979 126.091 -74.024 98.938 -21.874 143.819 -12.263 102.744 -38.001 73.301 -66.878 95.413 -25.377 136.135 -37.429 102.850 -43.854 124.266 -79.106 91.899 -45.678 140.666 -84.251 91.975 -72.101 82.021 -73.642 92.652-123.551 135.351-117.726 91.665 53.126 101.454-123.571 111.387-160.118 101.408 -85.128 142.522-153.275 168.141-158.773 108.612-111.855 111.416 -85.711 94.982 46.471 140.628-104.471 93.405 45.995 136.981 -74.302 91.415 47.128 129.432 -49.455 91.838 49.352 117.583 -19.115 89.978 45.377 107.966 -82.179 91.677 46.044 0.000 0.000 92.911 44.844 111.920 -79.388 92.384 40.939 173.939-159.195 92.209 43.631 106.539-135.021 91.154 49.091 112.671 -78.623 90.676 50.786 151.448-120.745 92.045 35.507 140.947-135.639 95.577 48.484 114.393 -89.814 96.341 22.552 141.477 -99.553 122.669-133.199 117.985-121.381 95.281 1.311 114.180 -77.652 104.475-148.251 129.641 7.602 104.415 -41.638 115.273 -80.303 95.103 -35.876 126.598 -75.312 95.084 -37.005 99.263 -81.215 98.731 -29.387 140.988 -12.868 98.016 -49.996 147.621 -39.938 91.941 -37.810 130.501 -77.275 95.128-152.467 106.144-103.791 93.091 53.453 131.580 -77.100 92.337 45.706 140.360-113.145 93.762 67.425 123.567 -5.267 93.250 -87.660 143.419 -98.500 101.223 -39.621 100.842 -86.826 107.263 127.991 105.288 -74.011 92.401 0.000 129.631 -75.877 # 150 total E -1.46677E+02 rmsd from N 0.000 %NC 0.00 93.240 162.940 141.841-103.733 93.828 52.268 138.457 27.765 91.808 46.595 106.251 -81.872 91.607 47.022 130.586 -77.156 94.810 46.024 143.427-116.803 92.624 40.831 56.652 -74.210 91.430 45.272 125.526 -34.268 91.389 48.725 126.394-103.130 89.203 48.315 139.316-124.881 94.077 94.482 87.900-107.744 121.335 13.225 150.297-105.423 99.030 -55.659 104.053 -99.562 101.934-138.349 109.233 -83.054 144.428 35.375 164.879-166.446 97.735 45.033 140.859-161.468 94.739 39.728 137.849 -98.974 98.697 129.432 106.378 -61.506 109.574 28.739 160.041-117.279 98.170 42.912 126.381 117.900 98.061 34.854 148.935 -27.135 91.960 53.279 0.000 0.000 91.002 49.178 146.254-162.043 90.346 40.816 164.125-164.519 92.844 42.175 109.797-137.895 90.954 49.956 117.761 -76.241 90.666 43.947 145.893-114.092 92.412 52.619 133.209-159.958 95.224 -82.512 103.499 -83.302 124.204 119.893 149.280 -22.295 97.906 0.793 96.576 -97.383 102.117 141.426 119.243 -80.142 93.355 63.215 125.868 154.630 95.618 76.995 112.266 -75.098 90.477 -80.936 127.826 -75.568 91.340 -42.229 101.097 -80.894 87.413 -58.315 113.517 -48.918 88.241 -52.680 145.261 -34.631 89.675 -55.226 127.836 -75.630 91.728-129.841 117.844 -27.848 91.009 51.052 131.907 -76.808 91.038 51.455 140.302-109.931 91.026 58.558 129.215 -36.005 91.681-127.478 125.208 -62.463 96.358 16.703 107.424 -84.528 116.555-114.183 103.311 -66.352 92.899 0.000 129.476 -76.236 # 151 total E -1.53798E+02 rmsd from N 0.000 %NC 0.00 93.135 162.493 139.628 -95.105 93.597 55.647 138.077 48.946 92.234 44.449 105.827 -81.438 92.043 47.850 130.490 -77.302 93.142 46.351 150.933-146.396 92.892 40.254 59.866 -74.123 92.822 42.725 125.393 -37.995 93.654 41.580 133.638-106.776 91.322 50.386 148.088-163.474 87.723 48.159 81.068-106.949 93.368 143.534 130.461 -88.679 90.034 84.453 104.256-130.630 93.671 102.360 96.852 -84.641 93.413 -63.965 137.302 -85.186 97.270-123.979 135.682-141.120 90.809 51.214 138.588 122.576 91.931 46.660 133.284 -85.832 91.107 46.294 133.461 -26.731 89.658 49.991 137.841 -25.532 88.513 51.519 111.402 -82.819 90.169 42.823 0.000 0.000 88.768 51.059 122.890 -76.742 89.012 47.154 130.446 -87.498 88.994 46.288 123.969-123.559 88.595 47.728 110.297 -79.271 90.686 51.433 133.305 -96.974 92.203 51.946 132.368-124.280 92.931-107.942 109.317 -87.065 95.645 176.056 146.822-121.501 105.274 -34.848 90.569-110.064 105.039 -52.056 113.277 -81.547 108.170-112.609 133.118 -26.254 91.718 51.656 112.472 -71.562 91.286 47.295 128.835 -76.043 91.057 42.540 106.086 -85.928 92.108 44.887 140.476 -24.311 91.531 42.146 134.169 -97.529 92.446 41.030 128.557 -77.347 94.611 98.349 115.642 -85.265 86.835 -74.119 130.232 -77.700 92.701 -42.639 147.100-139.104 89.832 -44.966 122.407 -8.532 91.347 -58.083 152.363 -35.476 90.237 -49.740 136.917-169.714 94.548 73.730 100.339 -79.837 92.508 0.000 129.018 -76.603 # 152 total E -1.46609E+02 rmsd from N 0.000 %NC 0.00 92.960 155.444 137.757 -85.907 93.428 55.827 136.245 54.861 92.160 45.780 107.362 -78.389 91.841 45.883 131.280 -77.629 94.708 45.028 158.951-154.370 93.885 36.987 56.459 -72.296 93.187 47.674 152.238 115.190 93.724 38.075 137.112 -95.797 92.311 46.070 150.255 177.355 93.686 95.204 78.774-116.691 90.236 -64.615 144.013-117.452 97.764 -51.223 93.330 -97.941 89.516 -48.968 138.209 -0.578 116.877-107.061 158.754 -11.174 106.572 -46.941 143.226-148.127 134.096 -51.269 150.880-149.229 94.944 57.999 136.059 -76.367 91.987 45.030 123.883 -34.743 91.810 49.583 136.135-145.963 89.796 49.764 111.561 -84.657 87.738 53.513 0.000 0.000 88.862 58.434 107.274 -80.174 86.902 49.209 145.933 -75.879 89.342 43.974 119.409-131.033 88.336 54.220 114.353 -77.413 89.148 52.039 144.458-119.864 90.200 45.545 132.323-143.421 94.576 -94.509 149.777 -31.377 124.742 103.947 166.603-162.078 109.003 168.917 89.285 -81.564 107.413 35.851 125.810 -77.159 93.458 46.247 141.718 53.383 95.924 118.254 110.646 -74.386 92.711 -80.479 129.864 -76.897 93.148 -21.371 101.464 -83.184 101.639-123.589 109.600 -48.772 95.503 -52.004 147.977 -42.952 92.724 -35.006 130.156 -76.622 96.225-140.443 121.414-151.346 91.824 56.982 132.331 -78.393 91.027 45.780 140.727-105.321 91.036 43.730 131.446 -41.036 92.035 57.877 161.264-158.404 88.433 44.329 127.053-157.254 94.742 84.754 103.327 -79.864 92.501 0.000 128.970 -76.472 # 153 total E -1.46500E+02 rmsd from N 0.000 %NC 0.00 93.148 -71.361 127.254 -77.536 93.616 -51.378 114.018 -74.520 91.541 -42.438 104.059 -77.127 92.414 -45.992 127.284 -75.814 96.217 -23.243 144.308-131.916 104.323 -34.141 51.796 -74.427 95.091 -30.420 126.975 -55.740 105.824 -30.108 135.376 -88.451 97.039 -51.173 141.332 -94.018 91.068 72.427 126.626-131.553 134.461-100.034 129.031-110.946 94.676 -23.708 96.230 -94.238 113.851 -61.880 115.569 -79.918 127.203-174.140 151.885-136.674 119.534-124.503 110.930 -84.438 116.161 34.888 140.331 145.225 94.555 43.580 134.779 -85.447 91.228 49.795 128.839 -61.058 91.912 58.898 129.369 -39.450 91.361 39.685 106.687 -82.389 89.985 47.244 0.000 0.000 90.759 59.967 101.956 -87.424 87.566 50.521 176.450-174.977 90.407 39.636 107.070-137.926 91.195 51.526 112.430 -77.690 89.455 73.434 154.804-129.001 89.481 44.544 146.369-139.529 91.858 46.027 112.682 -89.006 97.295 12.988 141.417 -89.600 132.733-136.848 111.276-104.105 124.577 60.038 119.392 -81.434 94.010 -65.625 113.956 -70.877 93.524 -33.071 113.004 -72.930 96.401-122.367 129.544 -76.521 88.933 48.012 99.809 -85.334 91.333 58.013 121.405 -28.940 89.889 49.662 142.991 -19.054 89.092 41.686 128.721 -76.987 88.978 61.393 118.493 -49.093 90.337 48.614 127.906 -75.000 90.301 43.895 142.295-118.390 92.416 48.180 128.567 -40.907 94.220-137.914 129.323 -67.191 94.811 30.248 137.816-142.460 121.419-166.277 107.575 -76.922 92.829 0.000 129.619 -76.297 # 154 total E -1.51400E+02 rmsd from N 0.000 %NC 0.00 122.440 -91.585 151.286 -79.664 95.280 -45.915 116.468 -81.049 90.508 -48.178 103.002 -77.256 90.074 -47.496 129.649 -76.473 92.385 -40.766 141.395-123.235 94.201 -41.199 62.922 -68.591 92.242 -41.164 131.465 30.956 103.026 -39.653 167.224 160.973 93.716 -53.840 126.703-112.818 96.229-109.938 80.307 -79.722 122.883 71.163 155.331 179.605 93.046 49.447 94.268-123.589 93.037 43.369 97.579 -76.831 94.701 69.291 141.578 -21.787 94.704 21.642 139.488-136.247 98.546 54.836 139.235-105.828 97.412 26.107 122.469 -82.571 103.850-105.508 169.034-163.996 108.686 -99.822 81.992 -93.242 92.006 100.750 147.846-154.264 94.636 45.698 0.000 0.000 91.359 46.966 122.393 -74.294 91.491 42.838 137.676 -86.150 89.747 47.891 118.767-121.662 89.409 49.084 109.697 -80.139 90.420 50.115 139.461-101.063 92.217 43.420 129.713-144.571 97.235-100.083 143.592-128.455 107.782-159.379 110.103 -78.580 138.653 -69.489 109.365 -99.159 107.098 -14.586 114.355 -78.756 92.809 -57.033 110.404 -54.951 94.417 -36.887 113.541 -70.092 94.729 -44.468 128.489 -76.760 94.202 -33.701 102.693 -86.294 90.105 -56.570 102.053 -55.484 88.128 -57.425 152.746 -23.459 88.916 -51.958 128.174 -76.321 91.740-131.877 123.667-134.846 90.376 57.375 132.847 -77.228 91.223 44.551 139.878-104.723 90.361 46.395 128.148 -25.939 90.765 68.652 146.254 -35.515 87.716 51.303 134.590-136.364 92.204 106.447 146.737 -24.453 92.521 0.000 128.862 -76.350 # 155 total E -1.47636E+02 rmsd from N 0.000 %NC 0.00 92.561 127.341 125.031 -51.674 94.815 48.043 137.803 4.369 92.867 44.179 106.799 -82.171 92.299 49.884 128.360 -75.640 91.232 43.422 123.247 -29.357 93.202 41.654 72.391 -68.799 92.692 41.644 117.464 -39.363 108.686 17.979 105.891 -77.887 95.027 38.628 143.173 -40.026 103.785 19.854 90.309-100.216 103.612 36.817 147.295-140.202 100.301 29.248 90.261-109.173 93.194 57.034 137.629-121.561 91.019 54.910 108.605-121.175 89.011 41.393 131.075-150.171 92.049 50.829 131.870-110.132 93.537 113.662 121.609 -82.001 91.649 57.746 145.069-128.990 93.370 50.939 138.030-119.548 101.372 -89.537 108.841 -79.041 106.882-146.181 0.000 0.000 96.440 47.838 110.915 -85.243 91.522 44.559 171.926-164.256 93.150 40.371 102.751-132.885 91.065 51.376 112.199 -77.673 89.710 61.023 149.815-114.392 89.734 41.297 143.252-139.844 93.735 43.286 152.478 -21.960 99.349 -12.221 119.284 -87.693 136.156-157.418 106.344 -93.403 93.533 52.853 114.021 -76.594 92.025 49.342 111.989 -72.743 89.850 49.856 123.317 -6.856 90.882 48.930 129.620 -76.237 90.735 38.824 100.498 -84.042 92.931 42.335 120.448 -41.334 92.479 49.522 141.367 -46.573 90.102 42.468 130.314 -78.290 91.066 112.366 101.777 -99.353 92.155 -41.319 130.405 -78.976 93.673 -55.721 143.796-139.981 90.126 -51.741 122.908 1.141 93.677 121.804 157.055 -24.740 98.327 51.482 140.510-163.599 96.324 -14.206 103.866 -71.142 92.503 0.000 129.684 -76.666 # 156 total E -1.50481E+02 rmsd from N 0.000 %NC 0.00 92.866 118.785 142.573-107.723 93.999 54.220 142.687 30.635 92.386 43.752 105.346 -80.625 91.627 54.381 131.429 -77.311 91.283 45.440 149.007-129.674 89.951 42.078 69.462 -81.238 93.069 41.474 116.388 -59.087 93.639 41.614 133.145 -95.145 89.851 59.667 147.497-167.810 88.263-173.555 79.809 -93.941 92.322 81.692 137.564-154.196 94.744 45.141 90.771-118.587 91.892 46.560 109.722 -85.255 91.336 50.068 139.655-101.987 90.279 45.236 124.169-128.000 92.437 49.180 127.032-116.094 96.197-103.659 121.212 -74.797 117.872 127.187 150.260 -52.695 106.696 156.906 134.169-152.146 97.117 49.553 152.810 -24.148 91.209 49.830 0.000 0.000 89.029 49.076 129.608 -46.729 90.446 53.290 133.027 -84.876 89.378 48.650 128.033-129.107 88.624 48.485 110.451 -74.996 90.958 51.565 137.894 -93.405 90.596 51.424 132.078-155.043 93.374-102.721 103.346 -83.703 106.412-171.159 154.050-134.492 99.672 -58.128 93.680-114.789 92.622 -53.057 108.982 -76.517 92.135 -78.173 113.795 -29.775 90.027 94.363 114.501 -71.114 94.781 41.340 129.287 -76.446 91.059 43.068 143.178-159.151 90.087 55.224 112.118 -34.687 88.720 52.379 138.397 -43.560 88.623 42.725 128.183 -76.493 91.611 72.267 113.783-104.694 88.796 -99.762 129.117 -77.059 93.289 -47.292 142.121-120.651 89.274 -55.527 124.846 -9.091 89.686 -55.914 144.392 -39.136 90.181 -36.799 112.940 -82.781 104.243 159.141 106.332 -78.098 92.608 0.000 129.536 -75.811 # 157 total E -1.46435E+02 rmsd from N 0.000 %NC 0.00 93.152 -75.274 124.792 -65.949 121.133-102.164 129.072 -38.810 93.178 42.554 107.300 -78.803 93.260 47.990 131.917 -78.318 96.206 39.149 154.112-142.005 94.053 43.317 56.662 -86.035 88.702 48.702 115.608 -41.311 89.960 57.197 128.968 -95.047 84.989 42.821 137.914-130.790 91.162 42.966 76.189 -99.346 94.075 41.824 138.270 -76.617 96.584 41.077 101.841 -96.020 90.259 54.898 136.406-122.694 93.758-126.956 109.590-116.777 110.873 147.647 154.310 -22.647 99.337 -63.887 127.464-134.011 102.139-138.407 155.108 157.244 95.980 43.054 143.583-156.211 94.032 45.725 155.770 130.198 97.181 33.635 108.275 -80.267 98.668 37.946 0.000 0.000 102.088 22.162 114.363 -86.303 101.147 39.644 169.210 166.472 98.625 33.557 103.970-133.246 92.351 52.246 118.126 -78.056 90.858 65.043 137.534-112.816 90.143 47.980 141.239-106.608 92.771 31.677 142.227-125.686 118.615 46.003 153.573 -21.112 135.358 -95.085 113.809-104.786 113.284 -13.837 113.165 -79.962 93.324-164.968 109.940 -38.673 97.825 56.846 116.286 -75.344 92.480 38.427 130.632 -77.526 92.745 47.746 145.149-161.701 91.689 63.135 128.010 -74.914 92.331-108.058 135.992-101.971 95.043 -46.714 128.261 -77.339 99.358-116.951 123.949-110.697 90.501 55.940 131.448 -76.623 92.045 44.522 138.530 -82.957 90.034 47.729 124.995 -19.904 90.911 73.579 143.346 -40.250 86.946 53.528 139.885-153.848 92.770 112.302 100.917 -79.535 92.555 0.000 128.689 -76.466 # 158 total E -1.47392E+02 rmsd from N 0.000 %NC 0.00 122.826 -97.703 150.609 -77.018 94.078 -48.194 117.677 -81.034 90.792 -48.254 102.810 -81.247 89.654 -48.330 129.835 -76.092 92.859 -37.791 139.026-122.875 93.614 -44.145 60.065 -58.056 91.666 -38.933 135.469 74.627 98.462 -44.016 165.283-175.915 91.034 -56.965 135.570-110.282 94.266 161.773 87.702 -82.972 105.936-160.561 157.956-139.230 94.039 50.914 97.040-129.930 96.497 36.654 103.927 -87.132 92.537 52.396 157.732-134.213 91.727 58.579 120.062-151.680 90.610 57.648 123.090-126.680 96.910-104.113 125.633 -84.605 133.482 -85.282 128.934 -17.658 94.571 42.349 141.004 -11.582 93.116 44.229 143.910-171.091 88.797 50.523 0.000 0.000 89.400 49.423 106.120 -85.440 88.439 44.378 146.880 -82.844 90.761 44.230 119.818-131.082 88.292 52.162 113.077 -74.709 89.710 48.379 140.440-107.177 91.107 47.218 126.933-159.917 95.263 -90.920 149.607 -27.510 128.315 169.994 155.699 -11.426 101.098-119.640 99.398-109.223 110.458 28.407 116.141 -79.164 90.841 54.268 116.349 -14.387 89.916 49.015 134.584-132.259 91.523 48.581 130.283 -77.904 86.633 47.057 134.742-135.254 89.090 60.340 105.692 -47.603 89.350 49.176 136.395 -41.942 91.053 36.563 128.198 -76.076 93.907 57.068 105.325 -69.570 98.728 170.996 128.463 -76.185 89.492 58.885 144.111-138.301 91.117 69.558 141.984-107.550 88.021 66.192 147.080 -29.397 89.077 39.729 128.681-106.518 96.319 89.101 146.595 -23.107 92.544 0.000 128.874 -76.471 # 159 total E -1.47968E+02 rmsd from N 0.000 %NC 0.00 125.705-116.300 144.244 -31.419 123.041-101.080 146.895 -64.266 95.877 42.929 113.144 -85.118 92.217 45.057 132.922 -78.257 94.910 41.698 148.973-142.227 92.881 44.456 53.135 -72.809 89.490 45.808 126.528 -29.023 89.157 51.500 126.864-102.297 87.110 46.155 125.312-114.909 91.349 68.097 86.502 -97.155 90.845-158.666 141.567 -92.707 95.095 71.106 97.381-119.719 94.265 39.339 107.418 -87.010 91.143 57.506 153.657-126.426 90.561 61.493 113.801-147.454 89.701 56.054 123.926-126.916 95.861-102.844 119.490 -82.836 135.081 -83.121 124.190 6.990 95.135 42.752 128.959 -17.100 91.747 46.733 149.974-161.533 88.739 50.798 0.000 0.000 89.872 47.442 110.019 -83.815 89.103 42.164 146.146 -83.863 90.648 47.591 118.661-128.370 88.368 53.473 110.256 -75.707 89.048 47.186 134.980 -95.243 92.969 43.849 130.514-141.674 101.396 -72.741 150.341 -25.723 123.109 165.097 150.649 -18.484 136.536 -5.251 112.224-104.788 100.591 -14.618 117.565 -83.170 113.148-138.985 136.858 -15.766 95.892 39.951 118.099 -74.119 94.753 43.561 129.598 -76.244 100.973 15.477 147.670-149.341 101.969 44.644 155.326 -25.191 91.689 48.418 166.552-162.056 90.054 41.051 128.335 -77.002 90.707 48.391 112.665 -39.706 90.578 44.867 130.555 -77.807 90.991 50.944 138.325-108.563 90.584 58.771 129.311 -40.025 91.042-139.658 131.252 -79.368 97.009 41.982 107.710 -85.354 118.569 103.003 103.625 -73.972 92.534 0.000 129.643 -76.405 # 160 total E -1.50823E+02 rmsd from N 0.000 %NC 0.00 93.173 163.918 139.716 -96.097 93.738 53.933 131.977 47.375 91.165 47.543 105.996 -78.421 92.181 44.128 129.864 -77.428 93.341 48.569 150.578-145.520 93.926 38.544 53.467 -68.265 93.182 46.372 141.036 -8.787 92.457 41.458 131.932-109.656 90.957 54.578 141.954-169.479 88.687 74.698 80.957-106.380 89.246-161.813 142.456-102.430 92.620 67.462 97.688-127.872 90.930 48.396 100.652 -81.380 91.848 52.469 141.765 -33.653 92.834 37.803 102.371 -90.158 95.414 41.951 138.209-100.738 101.158 -5.034 117.789 -73.804 137.273 159.434 127.671 -56.545 94.773 51.349 128.591-179.654 96.815 41.119 139.243-124.527 108.829 20.550 0.000 0.000 97.040 43.145 161.465-176.991 94.875 38.611 118.599-132.205 91.039 48.148 115.436-135.508 88.413 52.528 111.702 -78.574 89.255 48.342 140.848 -99.350 91.195 46.928 137.458-119.837 94.817 -94.136 103.372 -82.809 118.118-178.029 152.680 -16.618 120.444 -33.953 113.905-117.315 94.075 -53.672 113.765 -80.173 100.128-118.308 132.672 -46.258 90.676 56.240 127.558 -30.920 91.313 51.464 129.056 -75.791 89.937 46.664 105.360 -81.993 91.313 40.091 127.565 -65.565 91.889 53.741 131.791 -80.490 90.254 62.036 128.486 -77.151 89.853 179.387 92.469 -85.265 90.564 71.000 131.292 -76.837 90.224 46.598 140.902-102.226 90.905 43.758 124.759 -24.336 91.520 50.224 142.181 -99.936 91.238 47.535 134.086-158.275 94.597 108.307 102.046 -79.478 92.534 0.000 128.831 -76.404 # 161 total E -1.48925E+02 rmsd from N 0.000 %NC 0.00 123.542-103.475 148.735 -50.931 123.344-100.902 130.470 -32.080 94.255 39.825 110.594 -80.273 93.530 50.921 131.640 -77.258 93.106 39.738 150.504-138.542 90.064 46.545 65.074 -87.028 89.594 46.461 110.350 -54.932 89.154 45.877 135.445 -92.953 88.933 45.202 125.736-116.043 90.372 52.895 86.887 -96.729 90.300 155.653 137.677 -90.961 92.931 64.701 128.884-155.249 93.816 38.169 96.838 -81.395 91.411 54.411 143.989 -33.433 90.579 45.060 125.887-115.881 92.080 49.761 122.580-151.563 93.692 24.558 129.279 -97.100 102.279 163.047 145.559-146.456 124.349 18.910 134.754 83.592 92.010 57.246 142.192-141.577 95.501 40.383 0.000 0.000 94.460 44.264 130.182 -73.844 92.832 39.257 168.632-169.026 91.213 48.434 107.234-134.488 90.073 48.986 110.557 -81.222 89.960 50.464 149.696-118.473 91.076 45.349 133.558-139.489 95.320-104.819 104.364 -83.459 109.190-174.742 155.806-139.819 136.064-162.694 108.111 -99.410 96.296 46.734 115.037 -77.226 93.775 43.868 103.860 -16.396 91.748 46.680 127.934 -12.409 89.583 50.556 130.063 -77.396 88.849 48.304 101.995 -84.145 89.947 42.513 128.999 -49.458 90.317 53.021 135.591 -74.054 89.786 45.944 127.995 -76.916 91.770 117.100 106.239 -98.048 90.200 -54.765 129.016 -77.506 91.123 -47.571 142.537-121.527 88.380 -49.650 130.835 -16.222 90.719 -54.701 162.195-152.569 90.233 -43.573 105.610 -92.511 95.321 106.850 105.734 -79.159 92.531 0.000 128.774 -76.481 # 162 total E -1.48467E+02 rmsd from N 0.000 %NC 0.00 121.887 -95.312 149.615 -48.446 123.794-103.517 132.729 -39.654 93.287 41.639 109.953 -81.094 93.489 51.273 130.160 -76.488 91.815 43.389 153.601-156.060 92.130 43.514 73.859-100.559 90.535 45.465 110.390 -72.068 88.021 54.128 139.386-100.502 88.124 51.541 112.137-105.570 88.859 44.302 88.413 -88.775 93.598-176.530 130.643 -73.724 98.368 81.824 130.614-154.708 109.880 114.952 107.532 -84.856 115.977 -3.122 163.260-118.319 95.344 -68.775 135.981-143.215 94.585 14.045 135.310-100.857 118.628-144.846 144.508 -15.653 92.954 49.584 127.757-107.398 96.982 45.640 106.662 170.240 100.396 23.048 147.834 -32.144 101.481 39.930 0.000 0.000 96.101 42.059 132.859-108.555 93.406 43.169 134.579-107.914 90.943 41.177 117.366-127.013 91.759 47.462 113.715 -80.980 90.755 49.356 139.680-109.468 91.650 48.590 130.147-149.075 93.825-104.301 103.177 -82.539 107.187-172.904 150.352 -17.332 136.676-166.610 109.165 -99.803 94.120 46.537 114.790 -76.943 92.742 45.966 103.688 -15.415 90.919 47.346 132.522 -0.844 89.649 48.019 129.976 -77.591 86.840 50.553 102.525 -82.790 88.075 54.641 140.136 -36.396 87.055 48.196 155.303-112.006 89.185 43.090 128.295 -76.709 87.830 55.573 113.344 -31.638 88.342 51.119 127.440 -75.966 88.806 44.107 131.195-137.516 89.659 50.945 131.213 -44.323 88.891 55.929 136.248 -53.948 89.513 43.999 132.648-120.356 94.653 81.368 103.893 -80.245 92.546 0.000 128.684 -76.642 # 163 total E -1.47254E+02 rmsd from N 0.000 %NC 0.00 92.939 147.397 140.168 -92.885 93.822 52.193 154.225 142.309 90.497 49.610 107.255 -80.345 91.205 51.640 128.867 -75.314 90.911 41.792 153.837-144.469 93.360 40.534 84.413-113.450 91.583 43.072 110.255 -49.760 89.587 51.167 134.510 -78.938 89.347 45.047 121.477 -99.410 90.023 45.130 91.243 -94.353 92.592 56.292 131.263 -84.494 104.620-115.310 95.256 -91.094 90.911 111.799 104.186 -83.579 90.153 59.736 145.858 -43.377 92.740 37.577 133.960-123.517 95.236 46.641 131.623-117.390 95.581 15.342 121.396 -68.890 113.763 160.475 142.904 -64.508 95.108 101.191 98.063 164.331 135.022 -40.428 107.781 -83.016 96.455 56.898 0.000 0.000 96.549 36.319 128.634-102.812 92.016 45.976 140.213-118.616 89.600 53.375 110.968-129.885 87.677 58.757 107.326 -78.677 89.187 52.130 140.558 -89.342 90.610 43.155 136.280-171.736 96.040 -97.567 150.299 -30.657 114.962 165.724 160.265-146.902 110.880-166.029 87.885 -89.616 95.200 47.768 115.807 -76.999 92.281 48.173 101.992 -9.582 89.354 50.578 120.419 -7.732 91.411 44.777 128.387 -76.742 91.113 42.534 103.822 -84.725 90.267 51.661 117.462 -26.968 89.258 58.099 144.185 -37.196 88.763 38.525 128.665 -76.509 91.584 100.249 108.790-107.243 93.824 -19.508 128.589 -77.081 100.097 -84.310 125.651 -98.338 91.015-128.491 124.930 -0.568 110.348 -81.295 166.681-167.959 98.027 -17.284 133.225-123.267 99.760 91.349 97.594 -79.579 92.535 0.000 128.842 -76.585 # 164 total E -1.46466E+02 rmsd from N 0.000 %NC 0.00 124.944-114.754 145.424 -36.438 121.780-102.717 129.724 -43.168 91.430 48.781 104.856 -73.072 93.566 40.361 130.381 -78.327 98.220 45.091 149.657-145.553 97.270 38.555 49.992 -73.293 89.998 48.513 153.759 3.517 90.518 53.184 128.016-100.247 88.235 44.416 127.042-112.106 91.280 64.916 87.364-100.808 91.140-163.092 137.699 -89.803 94.954 73.130 97.782-119.650 95.032 38.533 107.474 -86.512 91.346 54.247 156.416-129.824 90.910 56.724 118.335-141.880 90.452 61.225 121.958-125.504 94.702 -83.769 122.304 -74.089 133.209-102.275 122.718 -37.587 93.939 41.424 123.275 -18.866 91.416 49.214 153.536-156.345 88.498 49.317 0.000 0.000 90.431 45.975 106.243 -83.108 88.843 44.789 149.381 -80.782 89.945 46.607 119.273-131.706 88.209 48.361 113.446 -75.829 90.287 48.996 143.133-111.024 90.974 40.875 127.807-163.590 94.197-101.539 149.576 -26.929 120.014-166.355 156.316 -7.010 95.834-140.071 100.839 -98.301 96.141 48.136 114.315 -77.096 95.693 35.959 93.305 -46.865 101.913 35.702 134.434 -24.630 93.196 47.620 131.738 -77.637 91.047 43.532 129.932-126.469 92.682 42.440 119.322 -90.569 103.711 -41.829 133.868 -84.021 131.509 -73.179 132.371 -85.092 98.675-107.503 124.347-109.592 91.354 61.161 132.697 -77.943 91.304 43.474 140.871-103.571 89.311 52.986 132.943 -29.974 89.700 65.239 141.578 -41.861 87.212 44.461 137.473-136.823 94.808 86.233 103.271 -79.732 92.491 0.000 129.037 -76.307 # 165 total E -1.46400E+02 rmsd from N 0.000 %NC 0.00 123.189 -96.603 149.391 -61.179 94.258 -50.988 108.196 -70.326 92.279 -41.040 137.625 -33.626 93.494 -41.717 129.152 -76.556 98.385 -23.389 139.876-120.636 105.551 -36.692 60.837 -74.198 93.414 -25.395 120.916 -49.141 109.430 -33.463 165.707-133.190 93.399 -66.512 119.378 -95.574 85.600-126.214 93.933 -83.362 120.689 137.249 168.225 -4.396 120.295 -54.041 111.890-116.096 95.018-134.043 103.405 -82.093 122.763 -12.803 159.861-153.499 95.475 62.241 157.601 -47.720 94.287 18.062 131.248-103.664 106.938-125.142 147.137 21.357 129.640-163.951 130.831 77.922 101.439 -39.082 107.208 -89.623 91.391 -49.559 104.178 -82.959 88.686 -48.460 0.000 0.000 90.311 -46.363 131.258 -93.403 91.920 -41.399 133.580 -97.205 92.801 -43.883 121.288-134.543 90.151 -50.613 110.333 -71.923 90.306 -48.092 145.307 -46.139 92.121 -42.147 139.515-145.629 93.885 -67.452 105.037 -83.399 102.999-172.997 153.655 -6.658 113.833-116.748 121.480-133.828 99.721 35.846 115.096 -77.737 91.671 52.033 123.172 -7.361 89.726 48.157 126.090-146.502 90.904 53.010 129.614 -76.698 85.724 50.267 102.758 -83.635 87.822 60.628 106.297 -56.075 87.213 54.184 139.477 -32.629 87.777 44.610 128.075 -76.161 88.128 56.224 113.657 -64.274 89.165 47.348 127.993 -75.683 89.752 45.696 145.137-125.804 90.449 48.467 127.393 -42.174 89.994 52.671 135.980 -80.459 90.322 44.175 136.567-132.669 95.199 75.145 104.061 -80.636 92.528 0.000 128.974 -76.664 # 166 total E -1.48634E+02 rmsd from N 0.000 %NC 0.00 92.543 -16.283 125.002 -66.357 125.011-111.076 137.492 -49.610 92.163 51.098 146.375 -27.917 92.034 47.580 129.164 -75.979 91.991 42.685 157.382-149.348 93.135 42.624 127.315 166.401 92.215 41.951 117.855 -60.008 95.755 41.247 131.602 -96.184 90.041 43.800 150.225-141.098 90.611 50.608 81.651-110.885 92.660 56.589 132.286 -92.759 95.670-109.744 101.746 -95.860 113.395 168.379 108.062 -83.191 124.664-106.968 161.733-139.287 95.046-120.063 134.837-145.942 91.970 48.126 138.269 130.624 92.110 47.150 133.623 -85.366 91.424 45.213 126.683 -46.975 91.158 48.212 112.767 -23.146 89.070 47.255 108.068 -81.780 91.294 46.609 0.000 0.000 95.067 32.701 110.715 -78.468 99.022 37.844 148.053 -72.970 97.113 35.590 124.076-127.248 99.323 105.829 114.367 -78.841 93.279 -41.946 135.141-116.188 95.666 -68.225 139.120-124.489 91.867 41.271 143.974-131.492 124.270 -79.038 113.314 -84.919 110.343-115.702 101.997 -89.411 115.341 -39.099 115.462 -83.579 100.596-116.853 129.887 -35.684 91.880 53.351 112.148 -71.480 91.678 47.739 129.231 -75.999 89.331 43.642 104.757 -80.968 90.551 49.590 141.263 -37.298 88.107 48.304 145.393-115.589 89.812 43.000 128.140 -76.781 90.156 47.074 117.018 -45.507 90.055 45.354 129.663 -77.069 90.495 47.664 136.113-143.393 89.619 49.736 128.168 -42.614 88.876 54.248 136.131 -82.596 90.248 43.476 132.121-129.349 95.202 75.787 104.416 -80.611 92.569 0.000 128.929 -76.631 # 167 total E -1.49301E+02 rmsd from N 0.000 %NC 0.00 93.241 -72.575 129.402 -83.712 93.669 -49.213 117.691 -74.856 91.181 -44.146 103.466 -76.109 92.089 -48.182 126.263 -74.965 97.428 -17.750 150.766-142.078 104.969 -35.966 54.490 -81.707 96.406 -25.700 122.050 -83.126 107.655 -35.800 129.397 -81.063 93.036 -42.791 145.467-120.326 94.464 44.072 126.740-120.843 142.566-127.394 132.972-119.794 94.411 44.862 96.383-103.462 120.512-165.972 103.442 -80.270 123.241-178.336 162.786-154.228 112.286-102.347 112.550 -85.245 93.574 50.629 140.301 126.884 92.549 43.703 137.983 -84.545 90.951 47.582 130.906 -64.984 91.345 50.013 144.337 -25.759 92.514 41.355 106.969 -82.493 90.770 44.196 0.000 0.000 91.188 54.205 102.508 -87.077 87.882 47.768 175.151-162.943 90.319 43.409 108.261-135.799 90.649 51.324 111.192 -77.333 89.901 86.174 154.664-121.402 91.210 40.172 143.950-154.564 92.909 53.137 109.383 -85.485 99.239 -1.674 147.123 -34.424 138.625 -76.524 105.546 -91.054 97.980 -33.545 112.604 -76.919 92.108 -53.974 111.996 -42.307 90.036 -44.814 111.967 -71.591 91.301 -44.491 127.677 -76.863 90.971 -43.278 102.078 -80.922 88.366 -49.670 124.530 -10.012 91.718 -45.652 151.882 -26.106 90.376 -48.966 128.600 -76.414 90.672 -85.705 133.880 24.791 90.892 92.880 130.783 -76.377 92.749 62.788 140.882-107.064 92.389 33.066 123.684 -31.771 103.728-127.389 146.865 -25.938 95.957 28.310 137.486-136.118 114.639 87.831 105.235 -69.891 92.471 0.000 129.643 -76.355 # 168 total E -1.48643E+02 rmsd from N 0.000 %NC 0.00 93.113 162.456 138.740 -91.984 93.632 55.853 134.007 52.888 91.844 44.791 105.908 -81.040 92.069 47.669 129.968 -77.028 92.245 47.316 155.173-160.494 93.154 39.149 59.778 -71.432 93.790 42.688 124.768 -30.246 94.275 38.521 135.946-104.497 93.446 52.595 143.521 166.511 91.549 82.095 89.227-101.468 91.035 -77.852 125.877 -99.567 95.704 -45.937 94.725 -85.949 91.913 -50.028 145.062 -47.111 91.101 -50.395 141.868-110.051 91.767 -50.811 126.674-160.386 94.250 101.925 130.261-147.117 103.275-160.561 145.485 -78.723 147.064 -26.449 111.898 23.977 93.181 60.468 165.043-166.513 96.933 58.111 107.204 -82.213 116.098 -10.208 0.000 0.000 92.809 63.814 150.733-152.072 90.761 46.563 111.327-126.018 91.369 42.158 109.414-114.049 90.568 46.593 118.449 -74.679 91.446 45.431 134.121-107.926 93.900 62.132 129.716-137.211 92.520 -93.199 105.139 -87.710 101.426-163.113 112.785 -79.262 128.167 -67.108 118.307-120.959 97.293 -39.316 112.018 -80.425 96.499-118.805 126.254 -28.557 92.482 50.993 132.595 -29.072 91.510 51.449 129.371 -76.118 90.001 44.563 105.164 -81.427 91.902 44.722 135.224 -29.095 92.087 44.307 135.310 -88.059 92.908 37.740 128.779 -77.451 95.514 104.881 108.668 -80.399 90.510 -67.907 129.235 -77.643 92.171 -44.663 142.134-119.324 90.524 -44.717 123.310 -9.718 93.026 -53.420 147.816 -38.165 90.512 -44.770 115.148 -90.126 96.655 71.688 105.752 -79.124 92.463 0.000 129.158 -76.372 # 169 total E -1.54649E+02 rmsd from N 0.000 %NC 0.00 92.964 152.213 139.220 -91.194 93.271 51.582 121.422 -29.394 93.686 44.506 105.309 -81.084 92.801 45.262 128.311 -74.987 91.289 44.631 107.075 -78.894 90.170 45.247 84.109 -64.163 88.268 47.717 115.751 -54.321 87.751 47.211 125.815 -96.183 88.915 53.127 120.048-106.290 87.236 50.906 93.464 -99.100 92.043 56.213 126.614 -89.764 102.674 -53.676 99.758 -92.627 114.872 159.692 110.137 -85.694 144.306-159.168 166.715-158.732 104.045-115.252 142.384-157.280 94.001 46.986 139.826 134.796 91.329 47.737 135.356 -85.726 90.319 50.075 121.765 -62.717 91.362 47.585 122.639 -27.750 91.309 43.483 152.719 -12.805 90.723 46.776 0.000 0.000 89.627 57.032 114.289 -82.609 87.795 45.766 144.410 -83.455 88.960 45.604 118.966-128.060 88.545 55.818 109.913 -79.953 88.967 54.281 146.518-111.745 89.188 42.590 120.810-157.589 95.358-110.538 103.345 -81.698 108.135 179.476 153.554 -11.014 105.308-132.991 90.815-103.037 97.872 45.819 115.198 -77.283 93.282 44.496 119.567 -6.131 90.710 47.141 145.040-141.421 89.625 52.885 130.564 -77.452 85.737 50.803 102.684 -84.088 87.830 49.101 114.237 -46.609 89.203 49.947 145.388 -27.521 88.714 44.499 128.356 -76.591 87.220 56.164 104.495 -47.347 89.594 51.112 128.142 -76.017 88.819 43.930 146.182-162.070 90.106 48.783 130.976 -47.485 90.138 52.977 135.828 -58.163 89.997 44.760 140.327-127.764 94.740 79.112 103.893 -80.605 92.617 0.000 128.858 -76.552 # 170 total E -1.49555E+02 rmsd from N 0.000 %NC 0.00 93.407 -80.003 126.951 -76.564 93.724 -51.334 112.674 -74.209 92.271 -41.802 103.625 -76.474 92.166 -44.685 130.615 -77.149 96.403 -25.066 143.577-136.197 102.299 -41.102 53.631 -72.300 94.274 -18.241 123.100 -41.290 111.927 -35.128 172.350-150.530 98.464 -41.975 131.071-110.361 93.693 115.767 120.194-149.263 114.734 179.038 145.857-112.054 92.377 63.268 99.454-135.946 118.010 175.174 101.409 -85.185 131.608-166.182 175.121-161.268 102.410-114.617 151.880 -32.111 91.691 51.517 139.800 126.658 91.613 46.740 137.714 -82.744 90.833 46.580 124.021 -43.986 91.030 46.903 124.050 -21.067 89.183 49.727 148.978-168.067 88.964 47.041 0.000 0.000 91.367 44.773 108.976 -79.986 90.466 41.996 150.812 -78.836 92.676 43.742 116.110-125.628 89.459 50.190 109.438 -77.071 88.813 59.573 132.179 -87.830 90.343 40.527 136.203-133.440 93.290 43.759 113.386 -89.437 97.902 6.204 139.902 -90.506 135.171-165.800 106.820 -96.900 95.264 50.595 114.930 -76.927 93.879 45.046 107.705 -28.246 91.670 43.338 132.824 -19.166 93.044 49.040 129.411 -76.041 89.931 38.333 101.726 -85.113 93.279 42.462 120.423 -56.545 93.498 44.179 136.743 -58.664 91.696 42.444 130.876 -78.653 92.712 118.826 97.997 -96.137 91.731 -48.706 130.605 -78.490 93.717 -44.037 145.618-123.146 90.004 -44.242 124.324 -9.286 96.099 -88.973 161.824 -17.603 90.453 -64.193 127.572-125.583 91.709 86.105 103.515 -79.330 92.481 0.000 128.973 -76.458 # 171 total E -1.47758E+02 rmsd from N 0.000 %NC 0.00 92.970 -63.884 125.765 -74.149 94.199 -49.379 113.422 -73.705 91.222 -44.754 140.936 -36.018 90.732 -49.664 128.059 -75.861 90.283 -40.236 134.439-113.169 93.707 -42.792 62.406 -56.543 92.364 -33.331 141.170 27.791 100.524 -40.987 162.562 166.957 93.879 -49.585 142.350 -31.798 91.508 140.481 96.830 -67.732 91.754 66.409 145.675-123.225 94.088 33.546 97.067-123.388 106.184-178.204 104.378 -84.879 145.800-161.069 174.908-170.729 109.549-122.874 104.287 -88.087 94.755 45.855 137.924 122.306 91.373 45.846 136.491 -91.529 90.192 53.235 162.056-121.927 90.600 48.174 132.946 -18.079 93.319 36.844 106.084 -82.894 90.822 48.646 0.000 0.000 91.117 51.321 100.803 -89.515 88.733 48.033 175.945-171.824 90.077 46.142 108.076-136.254 91.207 50.203 109.485 -75.627 92.638 97.382 154.551-106.215 92.517 32.892 143.401-165.211 94.944 64.118 109.918 -85.212 99.102 -8.174 152.550 -29.541 133.827 -69.312 108.782 -98.472 98.932 -34.445 111.189 -77.656 92.206 -49.742 112.354 -43.157 90.874 -45.437 107.373 -70.887 90.600 -43.957 128.741 -77.749 91.013 -45.511 99.488 -81.272 87.503 -51.900 124.814 -14.686 93.691 -32.460 155.153 -7.457 95.986 -52.655 128.795 -76.550 104.518 -80.777 132.174 33.397 90.857 77.929 130.037 -75.958 91.303 46.696 141.027-105.761 90.326 52.522 123.832 -17.979 93.607-134.700 137.838 -45.857 96.931 23.871 135.984-138.395 124.927 91.020 105.612 -79.186 92.525 0.000 129.996 -76.632 # 172 total E -1.48168E+02 rmsd from N 0.000 %NC 0.00 92.926 160.115 135.944 -81.472 92.963 60.574 134.515 52.056 92.629 41.778 106.386 -81.140 91.831 49.997 131.822 -76.818 91.183 42.092 155.150-169.529 91.553 43.526 60.277 -67.095 90.670 46.218 124.468 -33.499 87.444 50.682 148.420 -95.966 88.602 45.725 119.994-113.250 89.186 44.998 87.273 -94.973 89.940 81.161 141.026 -90.341 91.642 79.029 104.462-122.515 84.703 110.098 125.725-124.228 94.665 -44.014 119.779-111.233 113.858-109.114 153.936 -28.810 91.753 55.710 149.139 134.267 91.148 47.126 138.333 -88.334 89.603 52.264 143.726-103.118 89.161 52.808 123.050 -25.156 87.526 46.144 108.121 -80.951 95.162 35.932 0.000 0.000 105.645 22.307 121.103 -81.593 98.718 39.914 153.556 -84.820 94.339 45.020 125.621-139.373 90.831 52.830 109.009 -73.853 91.352-124.855 122.021 -74.584 93.442 -64.034 138.460-108.755 94.459 83.398 144.767-168.730 107.672-120.397 105.132 -79.097 107.303-101.998 99.341 -84.414 97.710 -19.234 115.902 -81.500 97.977-117.930 123.864 -24.909 93.085 44.990 115.218 -73.947 93.742 55.050 129.561 -76.315 93.835 32.369 101.571 -76.751 92.114 54.824 151.342 -17.139 88.244 47.551 142.379-132.232 90.545 40.791 128.298 -76.823 89.923 49.277 118.397 -26.836 90.157 47.589 128.561 -76.905 89.676 46.178 133.704-154.319 89.161 51.817 131.579 -47.664 89.156 53.956 134.156 -59.205 90.039 44.623 139.497-123.477 94.615 80.523 103.903 -80.501 92.497 0.000 128.842 -76.595 # 173 total E -1.50483E+02 rmsd from N 0.000 %NC 0.00 93.132 161.220 139.839 -95.277 92.954 55.809 148.766 58.677 91.817 45.103 106.295 -82.446 92.084 54.135 130.666 -76.579 92.013 42.731 153.134-154.776 91.562 43.816 70.352 -91.545 90.554 47.423 120.248 -70.526 86.988 57.077 140.803-103.040 86.590 55.983 115.521-114.435 89.167 70.257 86.537 -92.850 90.841-163.270 141.705 -88.290 95.422 66.086 98.430-123.042 94.404 37.397 102.514 -81.099 92.602 96.058 150.223 -41.729 96.055 47.228 133.828-158.018 91.601 39.227 131.772-104.280 91.662 54.459 141.469 -63.589 93.786 45.666 104.937 -60.657 97.622 22.551 144.818 151.665 110.820 24.197 107.111 -83.005 97.498 45.993 0.000 0.000 92.526 47.510 131.128-114.598 91.749 39.519 120.504-111.664 91.839 41.762 116.417-117.517 92.416 47.149 113.484 -81.957 90.266 50.648 145.715-121.312 90.368 45.806 119.840-150.460 94.837-107.167 104.595 -83.035 109.030-175.967 155.449-138.715 135.150-162.363 108.404-100.173 95.504 44.357 115.035 -77.401 92.756 46.551 102.176 -1.822 91.493 46.591 121.241 8.786 89.570 47.361 130.054 -77.298 88.883 47.164 105.273 -85.642 89.133 49.394 117.437 -5.064 88.403 46.556 134.961 -54.452 90.687 46.674 127.541 -76.159 94.704 121.271 122.415-116.131 89.104 -48.646 131.040 -77.586 91.049 -50.911 142.584-120.083 86.709 -54.651 129.381 -6.553 88.407 -56.651 163.208-170.822 89.897 -43.880 106.595 -88.395 94.793 137.205 106.214 -79.742 125.024 0.000 142.650 -92.167 # 174 total E -1.52885E+02 rmsd from N 0.000 %NC 0.00 93.037 -62.168 124.090 -68.696 94.184 -50.227 113.801 -75.230 91.680 -44.344 103.766 -77.837 90.806 -45.633 129.853 -76.596 91.717 -42.756 129.587-112.430 90.753 -46.945 65.412 -57.096 90.720 -34.005 130.140 36.802 103.770 -36.821 140.268 -85.209 94.720 -45.626 134.782-103.521 92.646 102.756 120.520-127.256 129.488 149.498 145.571-159.294 91.109 72.422 96.750-147.407 93.728 118.632 98.109 -85.113 94.017 -56.108 134.036 -98.297 97.204-123.750 135.650-151.855 92.247 47.701 139.207 139.193 91.996 47.735 135.223 -85.223 90.633 46.931 128.245 -60.573 90.734 50.264 126.856 -32.406 90.327 45.367 145.642-168.125 90.131 43.994 0.000 0.000 91.352 48.420 107.722 -89.537 88.040 56.198 155.753 -90.964 86.338 54.582 116.867-143.037 86.379 54.240 104.117 -73.054 89.789 49.839 138.268 -39.905 90.654 46.125 139.642-141.661 94.170 -98.242 104.833 -84.213 110.842-162.509 157.347-143.027 96.992 -54.554 96.622-107.690 90.957 -48.424 110.738 -76.530 91.979 -62.732 104.849 -57.576 88.782 113.113 118.318 -74.583 93.216 44.381 127.996 -76.219 89.471 51.918 110.866 -82.087 90.074 49.770 135.912 -30.223 89.013 44.691 132.864 -86.742 90.861 43.164 128.207 -76.712 91.097 47.457 121.660 -58.859 90.141 45.500 130.505 -76.872 91.073 43.021 136.531-119.108 91.000 47.035 128.008 -41.468 89.902 53.300 136.337 -99.114 90.245 43.158 127.202-137.905 95.301 76.761 103.991 -80.628 92.497 0.000 128.994 -76.716 # 175 total E -1.47006E+02 rmsd from N 0.000 %NC 0.00 123.810-103.147 148.233 -49.118 124.786-118.223 129.743 -54.859 95.997 35.541 104.404 -79.221 93.295 52.925 129.330 -75.537 93.830 41.494 136.911 1.557 93.901 41.464 70.164 -89.887 92.396 47.263 115.119 -63.065 102.665 -98.286 130.498 -88.271 114.731 -62.263 115.108 -93.353 101.259-167.703 92.363 -77.971 93.971 85.422 153.508-118.468 95.864 32.947 97.580-118.204 96.435 56.741 110.995 -82.119 93.916 -3.672 140.307 -93.872 124.963-165.399 105.023 -85.448 113.340 22.385 142.389 123.869 95.419 45.678 135.985 -83.850 92.302 44.394 129.883 -62.389 91.425 55.427 95.980 -15.507 88.791 42.254 142.951 -46.403 91.784 46.441 0.000 0.000 93.636 42.551 107.858 -88.726 89.527 51.201 167.871 162.234 88.225 64.227 102.657-146.897 84.528 63.295 104.795 -73.910 89.460 50.885 137.060 -38.615 90.461 46.966 142.585-137.446 94.214 -98.100 105.056 -84.096 113.069-167.942 158.735-145.888 97.302 -55.202 96.220-106.599 91.253 -49.588 110.481 -75.071 92.143 -64.789 106.419 -58.120 89.231 109.289 117.333 -75.688 94.045 44.124 128.171 -76.083 89.496 50.339 106.645 -77.994 90.010 50.395 134.760 -38.462 89.710 45.682 139.306 -92.341 91.789 39.764 128.373 -76.779 91.649 47.441 114.644 -60.688 90.079 51.581 130.655 -77.574 89.009 45.428 139.604-152.654 89.294 47.728 131.496 -47.349 89.879 55.523 136.359 -48.115 89.357 44.604 134.821-130.845 94.183 85.601 103.328 -80.809 92.530 0.000 128.809 -76.895 # 176 total E -1.48405E+02 rmsd from N 0.000 %NC 0.00 92.724 135.946 134.530 -75.755 93.913 48.749 120.100 -33.782 92.066 49.193 107.095 -80.204 92.005 44.480 127.437 -74.516 91.302 45.680 104.842 -70.418 90.718 42.684 99.139 -65.367 89.284 46.722 110.697 -67.522 90.001 43.128 112.615 -83.889 89.469 50.348 138.031 -84.594 87.777 39.107 115.185-122.721 96.277 41.890 115.437-119.652 102.624 20.182 97.996 -95.658 103.122 139.955 116.522 -85.661 145.403 149.449 166.637 179.280 107.202-102.878 143.127-160.500 94.593 47.547 140.716 145.482 91.540 46.919 135.750 -85.523 89.893 53.741 120.379 -65.922 90.382 49.480 131.012 -34.231 90.364 43.383 144.617-168.073 91.106 44.364 0.000 0.000 91.273 50.637 108.653 -83.047 88.213 48.197 151.492 -85.403 89.903 43.441 117.405-133.629 88.627 52.655 113.701 -75.236 90.480 47.570 144.910-113.891 91.646 54.929 130.481-150.688 94.688 -16.201 106.408 -85.931 122.380-160.082 151.981 -17.687 116.721 36.373 130.277-143.103 96.169 39.853 116.081 -78.460 94.005 42.315 143.024 -79.042 93.263 43.802 110.457 -72.101 91.882 46.543 127.209 -74.578 90.925 37.845 140.056-151.874 95.030 48.158 100.145-115.647 92.928 33.700 131.021 -84.265 106.434-110.192 137.810 -93.330 98.489-108.295 125.299-111.562 91.791 57.827 131.348 -76.916 90.869 47.590 140.811-101.697 91.466 44.925 120.421 -16.984 91.640 52.661 150.677 -25.769 90.149 39.138 137.214-139.064 96.528 64.802 103.677 -79.449 92.498 0.000 129.081 -76.582 # 177 total E -1.46774E+02 rmsd from N 0.000 %NC 0.00 93.298 -69.088 132.780 -93.403 113.398-116.717 130.941 -44.810 93.394 38.060 107.955 -81.682 93.360 54.655 128.231 -75.095 90.066 44.277 133.662 -23.850 91.711 43.743 77.757 -89.666 91.137 54.281 111.415 -64.727 92.785 39.884 127.691 -88.335 92.299-114.785 160.555-133.070 91.318-161.289 80.835 -91.417 95.215 68.315 152.698-158.268 98.054 29.088 90.796-117.580 93.694 49.501 113.658 -83.052 90.751 57.319 140.321 -36.178 90.453 41.799 106.264 -92.712 93.708 39.293 138.997-101.152 101.062 -16.596 123.063 -78.121 132.186 164.023 130.762 -67.546 100.813 39.475 160.140 136.073 94.724 45.686 142.025-127.723 107.570 19.664 0.000 0.000 98.683 41.973 153.488 9.886 95.131 37.931 169.408-170.559 91.347 51.613 117.017-155.490 86.200 63.903 109.663 -73.222 89.114 53.989 144.121 -38.145 89.468 38.041 140.499-164.391 96.671 -90.393 150.123 -26.301 123.695-174.911 154.654 -8.771 102.491-135.979 96.476 -90.683 96.072 47.186 114.836 -77.028 93.974 40.724 92.869 -38.944 92.550 48.609 116.721 32.979 89.854 53.814 130.594 -77.365 89.425 42.959 136.245-143.558 90.456 43.955 119.862 -10.782 90.659 49.180 138.748 -55.310 89.735 46.234 128.166 -76.905 90.225 84.157 116.805-109.591 87.570 -82.563 128.457 -76.790 94.547 -50.179 145.168-133.905 92.950 -37.643 114.832 24.580 92.995 -54.853 140.346 -48.621 91.757 -43.660 139.848-166.054 97.659 48.150 104.799 -79.865 92.461 0.000 129.352 -76.413 # 178 total E -1.50099E+02 rmsd from N 0.000 %NC 0.00 93.214 169.712 138.369 -92.980 93.295 57.453 137.353 49.382 92.209 41.615 106.054 -83.063 91.793 54.455 130.966 -76.329 89.095 44.362 154.073-162.868 90.987 44.267 71.992 -75.941 90.344 46.930 114.935 -57.087 86.823 59.880 144.224-100.577 86.716 53.793 111.667-113.515 89.178 178.426 88.290 -89.943 113.873 45.311 144.665-154.873 93.205 56.477 103.165-138.889 88.888 55.343 101.351 -84.178 90.514 62.666 116.922 -59.252 89.946 52.739 103.488 -81.004 91.546 32.684 139.173 -95.503 101.298-141.535 121.062 -72.136 104.415-150.149 128.431 58.597 104.540 -45.783 116.759 -76.452 91.916 -47.899 103.833 -82.119 89.619 -46.351 0.000 0.000 91.987 -44.351 134.676-104.137 93.649 -44.745 127.810 -91.178 93.219 -38.980 121.108-126.827 93.076 -47.173 118.843 -29.317 92.670 -43.634 149.330 -43.227 92.767 -50.696 134.195-131.761 90.798 -57.819 141.514-122.379 99.687-174.904 152.915 -15.062 101.904-123.598 93.434 -91.081 96.692 47.276 114.630 -76.843 93.247 43.910 115.689 -80.483 89.776 54.543 122.944-179.100 89.261 62.538 128.559 -75.469 85.840 48.995 100.668 -84.342 90.449 40.914 104.983 -62.265 90.914 60.889 141.151 -39.011 87.975 60.476 128.384 -76.933 89.724 60.472 85.294 -84.935 91.814-102.524 128.111 -75.356 94.030 -38.278 143.562-124.016 90.406 -53.792 122.567 -6.354 90.489 -52.486 147.948 -29.236 91.277 -41.849 143.733-147.866 97.875 97.964 104.618 -79.394 92.438 0.000 129.130 -76.051 # 179 total E -1.48466E+02 rmsd from N 0.000 %NC 0.00 93.115 -67.810 125.874 -73.157 93.632 -51.361 113.825 -74.485 92.488 -39.511 103.712 -77.966 92.789 -42.727 126.629 -74.890 97.210 -24.865 143.622-116.154 104.706 -30.396 54.394 -72.047 98.764 -26.802 133.094 -67.813 106.540 -39.653 123.763 -88.908 91.257 -50.439 110.080 -66.954 89.789 -29.972 142.996-114.839 110.140 -37.476 126.273-156.414 104.259 -51.606 88.520-106.223 104.819-147.114 105.701 -84.064 127.552 -33.910 144.269-127.880 101.864-119.405 104.922 -92.846 97.469 39.144 152.641 163.389 93.363 45.002 137.254 -93.132 90.770 51.742 155.578-136.291 91.285 52.815 129.297 -51.180 91.702 34.663 106.748 -82.772 94.480 42.173 0.000 0.000 93.075 46.922 107.957 -90.825 89.068 52.610 150.879 -88.409 87.436 47.264 116.184-135.399 89.014 49.429 106.822 -76.398 90.004 47.491 140.737 -45.987 91.861 47.959 135.135-131.992 93.991 -99.691 103.023 -82.731 111.716-151.733 153.602 -18.362 115.413 -62.060 117.594-125.545 94.375 -29.612 116.070 -77.452 100.746-106.821 126.277 -76.969 89.598 80.745 135.109 6.281 91.331 58.181 129.455 -76.080 88.794 42.398 95.972 -75.867 90.309 54.611 145.750 -23.134 87.294 50.845 156.573-136.958 89.401 42.913 128.108 -76.564 89.667 48.118 115.403 -28.394 89.691 48.530 129.988 -76.935 89.748 45.818 136.665-118.421 89.211 49.750 130.264 -42.223 89.138 55.377 136.154 -58.333 89.524 43.760 134.587-115.599 94.826 80.341 103.960 -80.543 92.540 0.000 128.866 -76.717 # 180 total E -1.48943E+02 rmsd from N 0.000 %NC 0.00 93.388-179.258 138.274 -96.021 93.739 57.142 133.923 39.690 92.930 41.923 105.907 -81.243 91.589 49.496 132.459 -77.780 90.763 43.384 149.315-138.568 91.090 44.315 57.829 -64.195 90.769 45.117 116.182 -18.743 89.173 47.606 136.779 -94.981 91.163 42.391 123.010-113.684 94.112-170.766 90.695 -90.795 124.407 125.135 149.104-170.176 95.586 49.526 92.204-123.186 97.900 55.737 109.644 -87.018 96.081 -90.431 158.124-139.802 110.675-110.735 143.870-161.642 94.695 46.278 155.285 161.834 93.720 44.316 132.484 -86.005 90.936 47.668 129.981 -57.660 91.656 51.519 86.087-121.851 90.391 42.350 134.070-163.100 90.598 45.414 0.000 0.000 89.814 56.299 106.601 -81.296 88.471 48.057 140.430 -74.877 88.765 42.014 120.661-126.617 91.023 47.882 110.957 -77.566 91.192 47.362 139.141 -97.912 92.272 44.870 134.731-161.793 93.795-104.246 152.227 -30.687 109.648-166.439 113.690 -75.563 103.489-143.781 95.629 -96.037 110.826 95.150 117.561 -79.612 91.584 -57.593 110.918 -61.975 93.135 -42.232 109.598 -72.032 93.078 -40.536 128.366 -75.941 92.166 -45.134 102.563 -90.544 85.332 -72.268 102.509 -52.968 85.037 -62.309 147.538 -18.702 89.618 -42.920 127.965 -75.714 95.537-147.112 99.927-107.127 91.575 52.957 131.289 -76.530 90.846 49.685 140.141-109.082 90.890 54.702 128.282 1.465 92.148-156.501 142.284 -92.632 96.946 59.832 140.366-144.367 99.121 39.827 99.782 -77.866 92.509 0.000 129.236 -76.676 # 181 total E -1.49249E+02 rmsd from N 0.000 %NC 0.00 92.587 132.978 128.301 -58.132 93.512 50.943 144.341 20.180 93.483 42.958 106.964 -82.449 92.683 46.879 128.467 -75.301 94.020 42.670 135.838 -31.590 91.836 45.252 60.545 -72.783 89.238 51.475 122.858 -37.891 90.602 44.720 121.775-102.636 88.846 49.720 146.357 166.668 88.119 48.099 77.709-106.826 93.016-168.946 123.710 -76.068 96.012 73.045 135.045-160.587 94.436-147.572 107.576 -82.667 112.352-117.330 147.339-162.561 103.301-126.419 154.129 -29.894 93.548 45.523 142.026 142.720 92.229 47.694 137.930 -82.437 91.304 42.962 119.085 -60.753 94.131 48.664 134.318 -41.301 94.407 41.381 145.755-162.726 92.402 40.735 0.000 0.000 91.776 58.380 106.594 -84.290 88.098 49.779 147.574 -80.309 90.816 38.779 116.384-127.728 91.196 50.542 111.185 -76.713 90.050 65.293 141.474 -99.410 89.878 45.381 143.938-136.541 92.108 39.033 142.153-125.263 101.810 -3.927 150.234 -28.306 137.978-160.681 104.089 -89.214 94.130 52.087 114.875 -76.684 92.281 50.068 103.302 -5.777 90.193 46.616 125.117 4.563 91.724 46.493 129.032 -75.505 89.425 41.495 136.843-142.362 92.420 44.647 121.841 -18.003 92.705 42.766 138.145 -42.034 90.646 42.898 129.952 -77.915 92.907 108.982 108.060-104.958 91.014 43.218 131.508 -78.076 92.136 47.899 141.228-125.075 92.421 64.039 129.135 -45.100 90.535-121.627 137.924-115.178 96.532 -6.041 139.215-142.396 112.875-156.820 147.619 -15.342 93.019 0.000 129.231 -76.917 # 182 total E -1.49908E+02 rmsd from N 0.000 %NC 0.00 92.999 154.972 138.415 -88.881 93.390 56.344 137.731 50.043 92.000 45.086 106.632 -82.526 91.834 47.849 130.202 -76.651 93.480 45.469 156.125-151.167 92.697 38.893 59.755 -73.350 93.797 44.089 126.796 -31.184 93.225 39.804 138.099-102.468 92.236 50.484 145.045 174.850 91.469 84.063 86.731-102.148 90.331 -77.330 130.497 -99.498 97.041 -45.201 93.417 -85.329 91.989 -42.990 152.606 -25.497 94.660 -47.384 143.312-125.361 92.504 -40.184 144.271-171.560 98.680 -30.257 123.719-148.536 117.876-107.357 141.594 43.310 94.271 30.852 129.615 -71.529 96.991 57.605 117.177 143.584 112.237 -1.500 102.478 -82.629 94.012 60.880 0.000 0.000 86.467 56.789 124.620-109.024 89.190 45.105 112.801 -96.441 90.025 42.620 125.429-113.699 89.814 49.596 115.038 -79.153 90.037 47.774 133.500-106.357 91.531 48.524 130.298-140.794 93.788 -95.851 103.545 -82.840 118.007 170.827 151.665 -16.474 129.583-168.675 111.225-107.853 96.541 43.976 115.444 -77.408 93.226 45.421 107.738 -9.240 92.659 43.756 127.777 -9.464 91.332 46.482 130.899 -77.730 89.352 44.915 137.539-142.670 88.912 50.182 116.223 -29.282 88.843 50.506 138.059 -41.714 89.180 42.163 128.024 -76.255 90.069 49.120 119.604 -60.787 90.413 44.240 129.961 -77.222 91.193 47.856 137.580 -80.237 90.576 54.540 130.335 -45.624 91.716-156.782 133.593-114.513 97.483 53.591 139.902-148.709 99.782 62.264 102.155 -80.179 92.421 0.000 129.435 -76.173 # 183 total E -1.47108E+02 rmsd from N 0.000 %NC 0.00 92.703 155.448 123.272 -51.644 114.475 108.896 120.984 56.533 89.909 -47.481 102.985 -77.704 91.100 -46.298 129.656 -76.159 92.565 -41.523 143.088-131.216 92.870 -42.740 62.646 -65.932 91.365 -41.917 131.665 33.854 103.332 -38.216 166.154 156.985 92.964 -54.348 125.392-122.207 95.512-104.386 128.764 -10.152 115.429 86.322 155.921 161.678 91.752 53.435 93.528-123.953 96.007 50.886 107.352 -88.769 114.340-122.812 169.280-150.790 114.979-112.197 141.386-154.918 95.766 46.702 149.583 167.966 93.552 43.865 134.596 -84.132 90.830 49.001 130.126 -63.919 92.200 54.597 107.980 -37.050 92.502 39.625 106.995 -81.681 90.348 46.906 0.000 0.000 90.530 61.279 103.903 -87.794 87.255 49.993 143.519 -75.645 89.651 41.874 117.772-127.051 90.100 52.666 111.992 -75.205 89.484 49.232 139.449 -99.288 91.744 47.111 134.600-147.491 94.296 -98.119 150.163 -30.565 117.234-166.458 162.753-152.568 97.590 -59.040 94.854-105.103 92.836 -41.327 114.043 -74.958 94.445 -86.791 115.339 -45.505 91.253 98.458 110.067 -71.420 93.155 47.795 129.079 -76.235 92.544 40.174 98.368 -72.951 92.852 48.513 152.862 -27.089 88.858 48.284 159.637-177.172 89.860 42.913 128.229 -76.685 90.053 48.517 117.635 -36.613 90.133 46.519 129.495 -76.496 90.543 44.514 139.034-142.070 90.168 49.903 130.868 -45.819 89.620 53.224 134.667 -61.843 90.187 44.622 138.251-124.853 94.886 77.620 104.304 -80.485 92.526 0.000 128.855 -76.677 # 184 total E -1.47051E+02 rmsd from N 0.000 %NC 0.00 123.986-105.353 147.602 -44.357 122.611-101.792 130.591 -36.263 94.021 41.194 110.043 -81.338 93.229 48.067 130.816 -77.141 94.604 40.439 151.867-142.208 91.740 45.106 58.823 -79.509 89.605 45.481 120.204 -39.081 89.285 49.227 134.952 -99.182 88.461 44.345 129.772-121.213 89.510 47.963 78.691 -95.428 89.516 64.732 139.186 -74.550 95.562 32.931 93.360-101.261 92.208 53.745 139.402-121.590 94.991 27.036 113.282-120.244 116.960-173.910 140.183-142.878 95.647 49.970 146.846 144.087 92.294 47.042 135.112 -87.384 89.356 65.970 136.287 -69.626 90.373 55.696 134.534 -36.007 90.354 39.353 107.881 -82.411 91.458 47.684 0.000 0.000 89.789 59.905 105.653 -81.980 87.470 48.562 144.570 -76.996 90.290 40.906 118.878-127.443 90.516 49.711 108.660 -74.964 89.809 57.183 139.726 -89.827 89.956 42.559 141.153-139.919 92.611 41.667 114.272 -88.953 98.991 -3.121 115.713 -80.985 141.314-160.200 100.805 -80.989 91.712 54.263 140.615-122.470 92.194 49.046 95.944 -20.824 90.352 47.304 124.777 5.433 90.153 48.186 130.020 -77.351 88.345 47.572 102.087 -83.453 90.207 47.545 133.226 -34.759 89.673 45.245 138.334 -73.119 90.354 43.449 128.636 -77.254 89.043 53.365 119.790 -63.817 89.699 46.583 128.106 -76.498 90.699 44.056 133.446 -43.417 91.103 46.110 129.275 -38.836 91.056 52.033 135.482-108.081 90.528 43.321 132.311-142.704 95.651 70.938 104.221 -80.089 92.542 0.000 129.097 -76.575 # 185 total E -1.49202E+02 rmsd from N 0.000 %NC 0.00 93.129 -67.621 127.094 -76.744 94.246 -47.991 115.416 -78.078 91.177 -46.323 103.240 -77.331 90.762 -45.238 129.742 -76.478 92.741 -40.379 142.330-123.114 94.733 -40.805 61.363 -64.480 92.195 -41.022 131.258 25.026 100.849 -41.499 168.485 160.308 93.141 -57.132 124.152-115.330 94.116-106.250 80.991 -83.759 118.979 75.598 151.951 175.091 92.353 51.497 96.656-127.589 96.908 35.261 102.473 -84.085 95.955 40.235 145.503 -27.660 101.104 27.786 112.993 -90.411 98.812 39.868 129.585-104.708 100.208 5.494 140.471 -77.472 131.715 -24.552 143.689 -72.087 138.097-157.757 125.161 -98.756 93.025 73.028 145.176 176.418 91.962 49.880 0.000 0.000 91.743 41.716 138.581 -20.016 91.088 50.864 144.485 -89.076 88.502 53.839 120.545-132.976 88.355 47.714 109.991 -74.531 90.957 49.698 150.170 -98.119 91.808 38.388 128.011-151.050 98.923-121.110 144.934-126.212 113.678 174.362 152.492 -16.575 96.765 -51.573 94.515 -99.441 88.220 -52.822 111.072 -75.568 88.851 -55.494 125.551 -32.710 89.016 -47.989 116.890 -74.318 91.010 -40.626 127.171 -75.590 90.130 -46.108 102.323 -79.361 90.088 -48.938 147.455 -26.467 91.317 -42.939 133.431 -77.565 91.630 -43.581 128.439 -76.428 92.113 -59.748 126.493 -4.672 92.470 117.697 130.384 -76.668 95.089 53.324 139.933-110.066 94.131 41.405 124.089 5.669 100.970-129.050 146.230 -31.101 94.034 11.231 136.243-136.616 108.672-135.771 101.041 -69.774 92.956 0.000 129.398 -76.302 # 186 total E -1.48847E+02 rmsd from N 0.000 %NC 0.00 124.374-105.670 146.236 -36.914 123.119-102.697 129.364 -43.586 93.686 41.803 109.322 -81.308 93.068 47.552 130.439 -76.790 95.324 40.024 156.400-157.072 92.726 43.376 57.162 -79.244 90.204 44.986 120.217 -37.080 89.336 50.052 139.260 -98.329 88.367 45.578 129.233-111.869 89.099 42.185 81.669 -96.078 91.603 53.612 141.247 -82.419 96.680 31.000 97.308-103.327 92.674 52.844 136.832-124.384 94.490 26.902 109.515-117.520 115.866-172.334 139.761-138.102 94.404 48.376 133.690-115.075 91.854 51.709 135.526 -77.374 89.413 61.796 142.448 -63.672 89.733 49.596 139.843 -24.135 89.881 42.357 108.461 -82.567 91.883 46.233 0.000 0.000 90.095 51.428 110.095 -77.843 89.031 45.965 145.256 -78.120 90.507 41.613 119.825-128.025 90.476 47.885 108.259 -75.418 90.371 51.377 137.706 -81.988 92.077 38.587 139.151-126.338 95.447 37.820 116.979 -91.060 100.827 -15.338 120.824 -91.106 133.029 165.847 110.014-103.138 98.376 46.542 135.314 135.417 94.125 42.570 133.156-102.411 92.360 52.294 117.358 -72.938 91.796-135.651 126.793 -74.782 85.450 -59.118 97.113 -82.223 90.692 -45.187 121.510 14.664 96.478 -32.893 151.429 -20.164 97.832 -46.646 128.213 -75.802 95.826-122.224 123.915-101.040 91.389 49.145 130.872 -77.592 91.704 54.549 141.205-107.748 90.926 48.785 119.561 -12.116 92.984-130.537 143.042 -41.277 97.111 26.796 108.651 -85.290 120.765 102.021 104.252 -75.941 92.503 0.000 129.617 -76.513 # 187 total E -1.48339E+02 rmsd from N 0.000 %NC 0.00 123.154 -96.320 149.485 -62.224 93.846 -50.372 117.064 -77.314 91.024 -46.214 103.388 -77.484 90.876 -46.269 128.243 -75.756 91.313 -39.886 140.991-125.487 94.521 -41.627 62.524 -64.723 92.148 -38.362 133.093 -4.328 102.080 -33.523 169.946 152.656 95.806 -51.604 126.061-115.177 96.582-161.777 81.138 -84.051 94.329 78.237 155.909-166.151 94.073 4.225 93.737-122.434 106.842-133.010 105.998 -82.210 119.624-109.529 156.037 -10.177 98.930 -29.395 140.519-137.657 115.286 -12.779 153.474-137.078 117.891-113.474 154.641 -36.763 94.147 47.254 131.983 -75.609 92.842 46.519 148.251 122.088 93.038 39.946 143.400-125.817 99.368 36.828 0.000 0.000 102.224 21.722 137.472 -92.786 101.885 39.253 160.106 171.636 95.765 37.122 112.780-147.344 90.789 52.929 117.430 -75.354 90.118 46.086 146.325-121.088 92.823 54.783 141.452-129.976 94.423 -13.392 142.098-125.312 117.398 144.523 144.869 -23.777 108.909-111.050 96.741 -93.189 100.164 11.022 109.125 -81.445 101.126-146.164 86.187 -52.611 95.169 42.941 115.436 -76.137 93.148 50.310 130.057 -76.431 91.278 41.432 147.453 -8.589 90.301 51.976 161.903 167.945 88.745 45.918 123.810-149.718 90.834 39.832 127.622 -76.381 91.322 49.556 125.960 -23.803 90.395 44.174 128.734 -76.889 91.144 47.119 133.655-144.356 92.438 77.100 131.430 -47.368 84.606-102.333 132.780 -67.831 92.365 -65.935 102.974 -83.541 92.102 61.870 108.076 -77.474 92.484 0.000 129.250 -76.373 # 188 total E -1.49521E+02 rmsd from N 0.000 %NC 0.00 123.836-101.285 147.717 -42.363 124.165-101.593 129.351 -42.635 93.904 41.155 109.864 -81.185 93.212 47.845 130.794 -76.990 95.652 39.111 155.239-154.537 92.836 43.711 58.160 -84.151 89.293 46.782 116.333 -39.571 88.840 53.156 137.901 -93.167 87.582 43.827 127.561-115.097 89.723 42.720 79.808 -94.218 91.457 55.864 141.591 -76.266 95.711 31.857 99.254-103.436 92.665 51.792 136.482-122.087 95.206 22.614 109.218-117.866 112.794-174.897 138.479-138.310 95.140 52.459 122.314 139.978 91.090 50.189 135.003 -88.156 89.308 65.251 137.719 -71.386 89.966 52.066 134.830 -31.842 90.401 40.263 107.990 -82.702 91.254 48.233 0.000 0.000 89.957 53.687 105.189 -81.963 88.577 45.832 143.100 -77.783 90.462 42.819 120.038-127.210 90.399 49.303 110.022 -76.547 89.742 53.769 141.367 -96.364 90.925 38.477 136.709-145.147 93.862 47.046 115.015 -89.394 96.487 25.815 121.851 -88.252 127.524-125.432 109.660-104.425 95.371 -5.185 131.423-127.991 106.131-134.765 130.142 1.067 96.995 -45.076 113.117 -77.501 94.376 -36.309 126.705 -74.894 95.763 -35.623 99.755 -78.210 104.468 -18.454 142.648 -17.342 103.279 -38.798 157.276 -27.806 97.239 -35.372 129.492 -76.655 97.926-136.651 118.974-113.998 91.275 52.747 131.618 -77.638 90.534 50.608 141.396-105.802 90.439 52.035 120.261 -10.062 91.899-124.337 137.716 -50.908 98.218 13.356 108.717 -85.265 127.100 109.232 101.437 -72.249 92.560 0.000 129.648 -76.541 # 189 total E -1.46806E+02 rmsd from N 0.000 %NC 0.00 93.252 -80.346 126.594 -75.170 93.174 -54.823 112.132 -71.346 93.310 -38.704 103.804 -76.770 93.953 -42.076 127.887 -75.357 100.217 -17.817 149.124-153.165 103.643 -38.247 54.669 -79.582 96.682 -23.440 122.765 -57.297 108.028 -33.926 130.956 -77.850 95.263 -28.789 152.267-136.603 106.339 -13.089 154.401-132.908 123.219 -41.131 143.465-167.035 101.894 -28.021 92.407-106.479 98.752-126.707 109.952 -85.963 125.436 -63.079 136.931-157.850 99.216-113.610 137.965-157.636 93.148 47.374 146.853 136.462 92.109 47.074 135.593 -84.735 90.947 46.407 124.464 -63.095 91.801 48.326 137.197 -37.320 91.282 43.265 143.224-167.473 91.478 42.473 0.000 0.000 91.737 49.241 105.482 -83.898 88.370 46.751 145.728 -79.646 90.507 43.127 119.343-129.610 90.435 47.625 110.385 -77.024 90.008 45.626 134.926 -91.719 94.259 65.657 136.898-143.135 94.254 -31.928 142.115-130.931 125.050 126.532 112.869 -79.733 105.526 -63.917 96.213-102.654 116.455 -11.469 115.340 -80.109 92.377 -53.176 109.566 -56.215 89.679 -50.887 109.393 -69.565 90.387 -47.340 126.660 -75.463 89.320 -40.169 102.601 -87.406 89.104 -59.438 101.201 -57.475 86.023 -58.936 148.722 -25.201 88.672 -49.683 129.677 -77.017 93.929-141.609 120.059-128.172 91.725 48.273 131.441 -76.839 91.489 51.131 140.342-109.425 90.874 56.681 123.478 -11.289 92.548-146.144 133.086 -79.453 96.032 51.354 135.930-136.649 113.297 38.379 104.296 -75.183 92.512 0.000 128.884 -76.696 # 190 total E -1.50000E+02 rmsd from N 0.000 %NC 0.00 93.031 160.819 139.968 -95.720 92.982 55.328 141.780 26.592 92.143 46.591 106.228 -82.623 92.029 46.268 130.827 -77.145 94.808 44.944 142.248-117.441 91.690 42.116 57.205 -75.143 91.383 45.416 126.649 -35.960 91.591 44.798 127.059-103.934 89.251 48.664 135.533-126.551 92.258 90.456 83.199-101.772 90.505-149.484 150.663-111.044 91.901 65.658 96.597-124.780 89.914 53.673 101.315 -79.968 92.240 51.069 134.647 -44.738 92.973 34.776 137.202-118.022 95.723 48.774 132.018-109.663 95.235 45.467 119.989 -75.227 96.619-109.923 148.456 -86.613 112.433-104.793 92.070 -92.268 89.668 69.483 110.741 -82.817 93.973 44.814 0.000 0.000 90.391 45.181 140.601 -5.239 90.991 46.760 140.799-105.161 90.187 50.243 120.390-136.905 85.653 61.337 111.539 -73.635 89.007 49.990 134.486 -53.137 90.172 44.304 142.131-149.288 95.858 -82.117 105.282 -83.942 128.280 141.764 152.094 -13.163 100.235 -73.134 96.495 -94.124 91.759-162.813 112.321 -74.717 94.832 49.234 70.317 48.545 96.371 39.846 118.995 -76.343 98.313 36.517 128.913 -76.220 100.245 31.624 112.869 -84.846 94.287 53.799 155.303 -11.873 89.111 49.138 158.301-163.217 90.256 40.108 128.113 -76.784 90.941 49.930 114.720-121.965 89.518 57.556 130.183 -76.869 87.987 47.527 140.835-137.182 90.253 55.188 131.022 -44.602 91.911-109.651 136.464 -49.529 101.330 95.296 138.625-138.691 132.872 0.119 111.072 -75.288 92.547 0.000 128.966 -76.409 # 191 total E -1.52741E+02 rmsd from N 0.000 %NC 0.00 92.995 147.159 140.436 -94.854 93.758 47.648 115.874 -14.304 92.433 45.908 105.386 -82.174 92.496 45.819 127.633 -75.229 92.225 47.547 115.038 -80.269 90.104 42.882 67.328 -65.910 88.649 47.572 122.638 -36.725 88.186 50.078 118.433-101.959 87.502 52.335 117.241-101.076 86.795 45.089 95.225 -97.361 92.993 55.046 127.970 -90.165 100.695 -49.837 103.841 -97.960 118.573 165.689 109.511 -85.957 149.655-172.575 170.170-170.388 106.496-115.067 143.191-162.811 94.658 46.641 140.602 134.756 90.977 48.362 134.798 -86.784 90.111 52.059 124.110 -74.363 91.487 48.553 123.933 -28.379 92.473 39.568 107.663 -82.542 90.911 48.681 0.000 0.000 90.319 56.168 105.551 -86.214 88.049 45.649 146.223 -74.890 90.542 42.042 118.210-126.949 90.325 51.817 109.684 -76.501 89.760 51.429 140.354 -93.908 90.600 47.461 134.763-137.993 90.539 47.552 142.005-127.954 96.696 172.479 106.364 -82.766 93.214 59.710 132.283-158.604 90.029 50.321 113.972 -76.678 89.838 53.557 121.041 -10.756 88.252 51.415 112.994 -71.266 89.365 43.403 128.443 -76.063 88.867 48.285 138.613-141.503 89.715 49.081 134.978 -38.610 89.447 43.312 140.501 -95.335 91.995 41.915 128.384 -76.973 90.735 48.697 110.288 -40.581 90.142 51.582 130.654 -77.596 88.211 44.549 127.761-159.334 89.846 50.303 131.475 -47.109 89.416 54.605 136.254 -54.674 89.709 44.291 136.491-119.946 94.723 80.014 103.933 -80.357 92.536 0.000 128.891 -76.714 # 192 total E -1.47741E+02 rmsd from N 0.000 %NC 0.00 122.785 -55.252 147.348 -61.996 99.703-126.688 127.439 -59.674 92.399 49.059 107.475 -81.205 94.875 42.838 126.785 -75.120 97.139 42.211 139.373 -17.469 96.968 37.095 71.287 -90.493 94.160 57.475 110.568 -60.117 94.989 27.120 123.288 -85.684 101.938-116.510 157.460-112.823 92.050-120.185 81.806 -88.572 110.127 78.286 154.991 167.137 92.736 50.042 97.120-127.581 96.215 34.806 98.214 -73.004 94.397 48.670 147.516 -32.519 92.947 38.010 114.211 -90.864 94.956 48.784 126.893-112.011 95.230 11.467 118.931 -75.059 113.477 157.847 141.074 -66.249 108.226 28.414 104.927 161.223 94.602 47.767 142.757-126.897 112.775 10.146 0.000 0.000 99.235 43.719 153.484 8.931 96.479 35.442 165.920-163.752 91.458 53.576 116.237-152.168 86.627 67.016 109.648 -77.153 88.657 54.001 141.471 -41.608 90.111 42.061 141.504-145.803 95.760-101.025 105.607 -84.060 110.830-164.205 157.579-143.735 99.821 -52.655 95.521 -97.529 93.572 -41.797 111.424 -76.785 92.213 -44.366 112.632 -48.474 91.338 -46.788 112.022 -73.069 91.029 -45.242 127.426 -76.272 88.486 -44.845 102.101 -80.059 89.696 -50.486 141.639 -30.039 90.024 -48.827 145.610 -41.935 89.917 -48.828 128.251 -76.081 91.467-137.434 122.779 -0.171 91.875 47.621 130.381 -76.911 91.233 51.707 133.197-161.319 91.024 52.949 130.609 -43.946 92.053-135.056 120.893 -63.675 95.410 -15.154 137.875-141.058 119.196 -89.188 149.557 -17.018 92.853 0.000 129.289 -76.409 # 193 total E -1.50171E+02 rmsd from N 0.000 %NC 0.00 93.098 156.224 140.827 -97.524 93.731 52.784 158.092 160.948 91.781 47.372 147.538 -16.028 90.380 49.377 129.343 -75.594 89.169 46.059 150.062-136.511 93.031 42.076 115.475-134.319 90.633 42.901 118.413 -56.077 91.783 45.568 131.072 -98.095 89.552 46.020 133.930-115.610 89.322 46.161 89.934-107.503 92.422 54.753 131.143 -98.271 100.190 -64.543 102.373-100.782 119.367 157.110 105.880 -87.578 153.791-151.969 175.680-179.645 104.990-120.887 139.593-156.084 96.419 47.060 142.259 143.692 91.770 48.197 134.724 -86.703 90.325 53.732 122.350 -69.600 91.778 52.230 109.942 -34.522 92.792 38.827 107.719 -82.030 90.907 49.820 0.000 0.000 90.379 64.989 102.217 -84.744 88.139 51.335 140.246 -75.025 90.760 39.625 117.073-123.169 91.557 55.019 110.840 -76.267 91.443 78.294 139.895 -97.402 90.620 48.860 137.144-162.701 91.373 40.285 142.257-128.775 98.075 107.615 116.104 -88.573 99.874 126.117 133.122-155.128 96.304 16.552 115.185 -78.099 102.622-144.233 131.133-119.943 115.251 25.921 124.121 -75.867 94.974 44.187 129.334 -75.772 97.353 33.786 103.644 -84.036 94.127 49.524 133.617 -33.956 91.975 46.361 124.052 -81.625 90.834 38.083 130.977 -78.537 94.363 114.323 105.658-102.048 90.427 -56.063 130.548 -78.529 91.324 -46.933 143.149-126.038 89.543 -46.186 134.391 -51.921 91.053 -56.603 160.619-139.304 90.496 -37.559 110.874 -94.643 98.472 95.248 103.205 -78.636 92.395 0.000 129.328 -75.832 # 194 total E -1.47166E+02 rmsd from N 0.000 %NC 0.00 92.696 141.878 134.955 -76.536 93.545 55.669 130.633 59.067 91.579 45.971 106.936 -81.599 91.853 45.116 129.450 -76.538 93.489 49.306 161.864 175.513 94.547 35.467 57.014 -70.419 94.726 42.410 130.236 -20.697 93.955 41.232 132.615-109.700 89.546 55.832 121.804 132.929 86.859 63.158 80.226-102.882 88.025-104.629 138.147 -90.900 103.279 -37.524 86.863 -74.263 90.455 -48.433 141.664 -47.535 91.185 -49.263 145.557-148.893 95.329 -35.164 156.976-176.809 98.122 -37.987 141.194-107.570 96.384 -50.169 131.645 -68.686 95.041 113.589 151.703-122.013 119.740 38.113 122.752 172.316 126.863 -20.052 109.230 -82.730 94.237 63.100 0.000 0.000 92.381 41.084 140.146 -33.087 90.185 52.661 143.267 -92.013 88.436 50.208 121.132-134.654 88.540 48.508 109.554 -76.232 90.537 48.664 142.159 -95.580 91.309 48.499 131.402-148.718 94.200 -95.509 103.531 -82.713 118.164 169.916 151.839 -16.231 128.871-165.286 112.278-110.679 98.161 42.399 115.666 -77.582 93.022 46.353 102.882 -2.049 91.688 46.123 124.226 -15.552 89.925 50.358 130.493 -77.039 88.175 46.835 137.842-145.948 89.516 44.249 116.724 -30.425 90.337 50.016 144.907 -29.529 89.089 44.460 128.126 -76.749 88.084 52.201 109.416 -52.443 90.628 44.683 127.531 -76.223 90.610 48.683 142.071 -98.263 91.828 67.320 128.469 -44.921 89.508-104.746 139.458-114.483 97.186 -28.104 137.591-141.077 108.059-113.402 104.831 -75.669 124.091 0.000 146.741 -82.632 # 195 total E -1.46458E+02 rmsd from N 0.000 %NC 0.00 92.815 -18.846 135.970-104.035 125.801-106.673 134.538 -11.809 94.190 46.193 145.396 -32.319 92.751 46.849 129.433 -75.827 96.011 32.232 133.091-105.610 99.074 39.677 136.122 154.122 95.492 34.034 119.060 -45.140 97.857 44.886 146.244 -81.657 89.793 41.196 146.278-135.423 92.413 47.818 77.315-104.472 92.832 63.466 135.641 -82.209 97.321 -97.376 105.314-102.166 114.426 174.110 106.444 -86.022 138.232-128.487 164.070-160.384 100.833-118.704 138.766-149.362 93.194 47.947 141.276 137.919 92.059 46.798 133.989 -85.618 91.080 46.943 126.033 -53.129 91.241 48.012 125.494 -30.637 90.317 46.006 109.734 -82.455 90.785 44.468 0.000 0.000 89.898 51.578 115.059 -80.416 89.497 44.161 138.165 -82.891 90.499 44.045 120.688-124.302 89.237 53.151 109.401 -76.301 90.479 52.779 132.937 -89.442 92.043 40.902 133.811-146.358 96.587 98.737 118.052 -91.448 131.228-103.370 170.582-157.402 122.674 15.983 113.464-116.229 92.011 -60.283 110.699 -77.821 89.588 -47.986 125.248 -10.967 92.790 -47.782 106.045 -71.531 92.645 -33.258 127.611 -75.431 98.251 -36.553 100.239 -79.828 97.285 -40.109 145.949 -42.792 91.325 -47.225 147.691 -97.796 90.789 -47.522 129.055 -76.926 94.382-125.977 131.420 16.465 90.565 48.214 130.567 -76.681 92.464 53.569 140.822-137.917 90.741 54.383 131.216 -45.541 93.166-140.460 119.376 -67.887 96.774 45.533 139.162-146.009 115.965 165.049 111.221 -75.272 92.878 0.000 129.277 -76.568 # 196 total E -1.46993E+02 rmsd from N 0.000 %NC 0.00 93.027 157.428 139.655 -92.985 93.015 56.917 140.880 35.582 92.285 45.496 106.471 -82.821 92.087 47.006 130.536 -76.796 93.778 44.532 147.413-128.311 91.663 40.473 58.284 -73.126 93.076 45.129 121.877 -24.312 92.729 38.928 136.760 -96.964 93.941 48.099 139.657-135.599 93.588 128.702 89.550-102.593 103.710 -38.743 132.861-121.808 94.529 -48.707 92.095 -92.367 91.275 -39.214 146.988 -28.012 96.952 -44.547 155.991 175.157 97.311 -21.758 137.641-157.954 106.748 -37.468 144.848-171.172 97.392 -33.673 125.451 -92.368 102.325 135.512 145.553-164.931 127.189 39.677 83.806-131.846 139.676 -65.019 108.367 -78.576 91.574 59.490 0.000 0.000 90.070 47.140 131.953 -50.126 90.757 50.982 125.988 -86.982 89.111 48.460 126.227-122.583 89.601 47.066 109.652 -75.677 90.731 52.412 133.188 -90.500 91.084 45.834 133.263-140.429 93.439-118.824 104.278 -82.201 99.879-179.911 150.060 -19.280 104.821 -84.339 93.392 -95.672 94.627-126.562 110.830 -75.048 94.299 39.576 148.856-148.757 99.304 37.413 114.913 -73.302 109.423 19.148 144.254 -82.974 93.733 49.416 138.728-137.829 91.877 43.391 146.876 -43.964 90.767 45.690 160.802-140.391 90.604 39.903 128.014 -76.519 90.596 52.769 109.707 -48.441 89.859 44.427 129.255 -77.705 90.624 48.096 137.827-137.661 91.681 62.197 128.210 -43.538 90.512-147.029 141.675 -91.812 95.619 52.151 139.415-143.877 108.950 143.004 100.660 -76.442 124.443 0.000 149.223 -85.688 # 197 total E -1.46414E+02 rmsd from N 0.000 %NC 0.00 93.244 161.941 141.264-101.063 93.839 52.713 136.256 31.733 91.711 46.771 106.914 -81.783 91.637 45.790 130.339 -77.017 94.357 46.792 144.854-121.240 93.226 39.630 55.298 -70.618 91.166 46.541 126.351 -24.852 90.982 46.321 126.017-100.566 89.359 47.593 143.113-137.138 94.975 30.378 69.820-100.128 97.139 42.910 161.970-110.074 100.514 26.739 95.169-113.470 94.504 55.888 115.470 -87.794 91.052 50.174 118.300-102.546 95.611-117.917 135.710-120.878 114.913 15.417 149.611-170.033 109.236-129.121 160.340 156.181 94.368 45.633 139.349 -87.144 95.399 45.372 125.639 127.944 98.285 31.767 109.278 -81.470 95.181 46.622 0.000 0.000 87.934 51.449 141.577-147.560 90.108 45.988 110.601-104.141 90.676 41.627 126.094-117.234 90.078 47.741 118.059 -78.973 90.819 46.587 132.035-108.926 92.226 54.064 129.855-141.056 92.528 -95.176 103.034 -82.991 114.251 166.861 150.880 -17.386 128.713-173.756 113.366-112.115 95.600 45.407 115.359 -77.306 92.896 45.256 102.031 -15.804 92.757 44.439 131.572 -26.022 91.478 45.899 130.289 -77.456 88.062 47.917 136.915-139.984 88.865 53.456 113.666 -33.555 88.084 47.594 139.154 -43.906 89.460 43.792 128.040 -76.254 89.475 52.701 118.109 -54.917 89.852 45.270 129.059 -76.674 90.238 47.078 139.271-103.508 91.677 60.677 129.134 -44.596 89.563-116.163 140.970-113.073 98.122 -32.791 138.464-142.519 108.270-124.734 106.030 -77.096 125.063 0.000 146.755 -84.746 # 198 total E -1.51042E+02 rmsd from N 0.000 %NC 0.00 123.153-106.005 150.110 -79.071 102.043-119.770 123.050 -52.110 93.261 44.092 107.198 -80.863 92.542 51.075 129.602 -75.487 92.113 43.141 131.292 -16.925 91.100 44.118 60.643 -72.322 90.467 51.164 162.963 -16.712 90.453 41.021 133.529-100.520 90.663 48.583 147.279 152.528 89.632 67.893 79.848-110.254 90.119 -73.885 136.415 -98.064 120.561 -69.783 108.064-107.774 88.614-114.887 136.328-150.775 106.915 -56.924 146.052-144.251 100.053-109.620 152.490 -35.613 94.261 43.254 151.918 160.955 91.911 47.100 136.052 -83.100 89.367 56.205 131.137 -36.394 90.810 49.275 137.365 -50.185 92.279 32.581 142.783-141.855 97.795 38.856 0.000 0.000 93.506 46.384 146.794 -14.254 92.148 43.292 162.185-138.602 89.835 47.568 109.530-139.214 87.567 62.335 109.445 -76.127 88.998 56.109 145.436 -35.609 88.864 38.109 136.975-158.344 96.863 -96.756 106.239 -84.452 116.150-169.809 161.330-153.274 100.404 -56.216 95.930 -94.574 93.752 -43.182 111.902 -76.494 92.712 -42.561 114.734 -35.013 92.433 -45.371 110.615 -70.260 90.967 -45.626 127.595 -76.596 90.881 -42.255 102.288 -80.453 90.389 -43.262 127.195 -6.128 92.704 -47.045 151.286 -30.908 91.127 -48.619 129.429 -76.862 92.662-133.780 101.101 -53.716 91.057 47.071 131.115 -77.465 91.880 52.895 142.405-122.963 91.247 52.743 125.874 -15.254 91.602-118.138 120.328 -68.731 94.033 -34.896 136.530-135.814 113.272 -74.140 147.867 -8.041 92.866 0.000 129.060 -76.664 # 199 total E -1.47968E+02 rmsd from N 0.000 %NC 0.00 117.909 148.164 153.645-118.111 93.538 53.054 139.677 49.456 92.161 43.697 106.533 -82.500 91.403 48.965 130.657 -77.262 93.742 46.831 150.277-135.995 93.478 39.780 60.312 -77.487 90.506 47.916 122.046 -39.190 89.266 75.798 130.014-103.834 85.984 63.481 127.059-126.874 84.582 166.230 80.213 -97.777 93.533 61.055 153.274-154.993 94.445 36.691 92.891-123.070 93.750 47.161 100.615 -80.534 92.284 56.908 145.928 -36.774 88.607 51.453 140.485-143.509 91.288 33.740 128.359-115.744 99.037-125.171 124.451 -70.494 137.922 174.760 115.959 54.365 102.830-166.518 150.204 -69.947 125.293 25.920 111.465 -83.265 94.461 48.629 0.000 0.000 92.512 45.245 143.474 -12.362 89.740 54.258 147.253 -80.462 89.147 46.193 122.632-137.011 89.191 47.646 108.236 -70.663 91.251 44.328 139.365 -54.904 92.692 49.986 139.589-144.353 92.966 -88.127 141.403-122.621 126.740-171.303 155.042 -15.285 106.904-128.164 116.761-128.478 97.352 34.133 114.807 -77.530 92.237 51.538 99.668 -22.973 92.484 47.712 115.545 7.456 90.461 47.234 130.104 -76.634 89.693 41.941 101.989 -83.161 92.228 46.102 134.849 -41.055 90.254 46.394 142.144 -52.961 90.084 45.777 128.355 -76.874 91.520 85.691 116.563 -96.570 85.201 -85.635 129.596 -77.650 91.925 -50.179 142.765-120.201 86.578 -51.594 111.733 20.707 91.244 -51.185 146.329 -26.950 90.855 -46.774 111.398 -80.982 95.966 93.135 105.484 -78.607 92.470 0.000 129.058 -76.311 # 200 total E -1.49929E+02 rmsd from N 0.000 %NC 0.00 93.130 164.542 138.376 -91.407 93.324 58.175 145.422 41.873 92.854 42.824 106.062 -82.587 92.004 52.432 131.483 -76.978 91.747 43.474 152.383-139.625 90.680 43.023 68.227 -79.702 93.212 40.990 117.269 -57.741 93.659 41.275 134.879 -95.907 90.172 60.041 147.155-169.317 88.548-173.781 79.638 -94.062 92.238 81.097 136.837-152.486 94.765 45.055 90.735-118.115 91.706 46.920 110.057 -85.215 91.242 50.086 138.917-102.023 90.232 45.234 124.163-127.604 92.431 49.226 127.308-115.527 96.104-103.462 122.451 -75.414 117.940 127.187 150.376 -53.452 107.185 156.991 133.008-151.742 97.201 49.585 152.989 -23.495 91.200 49.767 0.000 0.000 89.035 49.209 129.009 -47.549 90.356 53.673 133.785 -84.630 89.422 48.558 128.086-129.775 88.616 48.065 110.941 -74.733 91.168 51.827 138.425 -95.244 91.106 48.859 132.309-155.494 93.872-101.380 149.299 -31.600 110.278-171.184 158.309-143.066 99.835 -59.043 92.837-111.121 92.217 -51.972 109.153 -76.153 92.167 -76.933 113.366 -31.941 89.816 95.940 113.849 -70.815 94.779 41.426 129.388 -76.749 91.050 43.500 143.336-158.534 89.823 56.695 112.525 -34.134 88.471 55.025 140.312 -44.501 88.300 41.491 128.200 -76.613 90.370 67.682 113.877-104.318 91.524 159.832 128.962 -76.641 91.145 62.866 142.705-122.739 89.622 56.871 139.853 -84.168 89.899 57.952 143.733 -28.809 89.166 44.881 147.003-145.775 94.131 84.500 102.863 -80.125 92.530 0.000 128.784 -76.642 # 201 total E -1.47393E+02 rmsd from N 0.000 %NC 0.00 117.714 143.276 153.025-100.356 93.613 56.510 135.614 50.356 92.323 43.988 106.851 -82.335 91.749 47.854 131.036 -77.482 92.863 45.725 154.140-151.347 93.280 43.189 58.512 -71.398 89.460 48.730 129.793 -35.313 88.363 63.195 128.821-118.342 86.470 63.139 137.055-147.111 83.350 166.638 85.150 -85.990 96.372 79.266 155.478-168.292 93.930 38.183 96.445-136.616 99.008 33.241 101.976 -84.600 93.941 49.533 139.252 -80.091 93.304 50.572 143.552 148.276 90.075 41.632 112.830-150.223 94.375 27.135 123.529 -89.045 116.207 -19.714 131.439 -89.686 130.844-156.451 122.314-113.496 98.048 64.266 152.876 -7.495 92.828 55.742 0.000 0.000 90.659 50.386 137.766 -19.769 89.338 56.005 146.638 -83.930 88.912 51.141 124.774-136.469 88.994 46.135 109.776 -74.945 91.430 53.401 143.778 -88.015 90.910 51.637 134.509-156.823 92.638-111.908 145.846 -36.486 96.794 170.735 149.166-124.258 103.722 -36.712 93.497-115.055 113.618 -51.216 115.658 -79.593 112.418-113.688 131.455 -28.234 92.646 49.445 108.965 -70.634 92.864 46.092 129.670 -76.814 93.260 40.918 140.849-149.788 92.572 43.705 136.895 -41.832 90.935 51.200 128.889 -86.173 88.829 44.657 129.483 -78.282 91.538 82.761 109.196-104.622 87.407 -81.766 129.318 -77.368 92.260 -50.983 142.521-118.191 86.784 -57.571 106.434 27.932 89.662 -53.310 146.064 -31.186 90.941 -42.877 111.274 -81.335 99.470 114.312 105.332 -77.709 92.389 0.000 129.405 -75.524 # 202 total E -1.53708E+02 rmsd from N 0.000 %NC 0.00 124.818-109.453 146.001 -39.414 122.243-104.090 130.305 -38.231 93.113 43.928 109.030 -80.781 93.275 46.474 130.755 -77.599 95.052 43.575 152.983-139.663 92.064 43.753 58.125 -79.526 90.638 44.359 124.729 -41.434 92.277 44.773 128.605-107.177 88.780 48.115 142.775-158.879 88.344 50.014 79.515-106.074 91.412 135.929 135.257 -90.329 90.724 76.399 102.893-129.750 91.809 106.191 97.107 -84.236 93.287 -65.031 133.198 -71.010 95.692-121.452 136.511-137.838 89.969 53.166 136.473 119.656 92.016 46.695 133.180 -85.649 90.905 44.869 146.476 -18.909 90.695 49.131 137.849 -21.269 88.775 50.307 110.592 -82.668 89.517 44.813 0.000 0.000 89.231 49.811 119.258 -80.638 89.544 45.555 133.237 -83.906 89.580 46.635 123.115-123.346 88.732 50.417 111.533 -79.412 89.724 49.545 135.358-101.030 91.520 48.983 130.887-130.053 94.407 -98.903 103.145 -82.780 111.201 178.774 150.876 -16.909 134.552-167.138 110.629-104.594 96.361 46.672 115.083 -77.211 93.628 43.455 109.270 -34.655 91.257 48.738 131.448 -26.691 90.699 45.931 128.956 -77.375 90.762 48.110 102.387 -84.132 90.148 46.459 127.012 -70.429 90.494 59.296 126.839 -71.651 89.908 58.666 128.582 -76.713 92.456-176.448 92.515 -94.890 91.421 61.353 131.291 -76.962 90.178 48.392 141.005-104.851 89.497 49.968 124.974 -13.426 90.219 56.624 143.514 -84.264 88.448 41.938 137.976-172.411 94.839 96.520 146.867 -23.939 92.510 0.000 128.801 -76.513 # 203 total E -1.47785E+02 rmsd from N 0.000 %NC 0.00 92.545 130.999 127.255 -55.141 93.542 52.850 145.384 6.092 93.676 42.081 106.974 -82.640 92.632 49.716 127.741 -74.188 92.760 41.636 132.823 -36.578 89.993 47.516 67.055 -74.799 89.553 52.036 119.005 -50.132 91.444 39.594 125.769 -98.661 90.605 47.644 151.630-154.139 88.627 56.289 78.556-102.859 90.857 56.117 135.677 -84.023 97.068 28.403 96.111 -96.265 93.444 54.253 139.750-119.188 94.632 31.174 109.817-115.610 114.577-175.409 140.316-132.558 93.789 48.941 145.497 134.776 91.243 50.608 134.171 -84.919 88.939 75.857 115.708 -18.368 88.696 55.316 151.141 -32.598 89.179 41.971 144.350-149.637 91.640 46.719 0.000 0.000 88.911 51.694 141.750 -20.743 89.552 48.048 136.748 -95.374 88.515 45.494 121.689-130.803 88.300 57.417 112.746 -76.413 88.756 46.600 135.964 -51.780 91.510 42.669 138.495-136.267 97.289 -81.207 105.029 -83.731 126.050 171.813 153.309 -19.113 131.138 -19.818 112.429-107.418 109.884 -19.454 119.344 -80.607 98.374-149.660 96.645 -60.845 96.059 44.554 135.882 159.972 93.852 42.087 128.745 -75.718 92.624 42.059 158.006 -17.930 91.069 48.940 141.666 -39.164 90.783 47.107 139.145-101.777 91.934 36.122 127.810 -76.708 90.997 52.256 107.090 -98.845 90.222 52.078 128.999 -77.231 88.722 48.203 138.553-135.265 91.032 62.771 130.117 -45.107 90.069-109.594 138.047 -51.811 97.701 -15.561 109.518 -84.682 109.998-107.864 103.345 -69.300 92.826 0.000 129.620 -76.035 # 204 total E -1.46773E+02 rmsd from N 0.000 %NC 0.00 92.554 130.260 125.987 -53.165 93.446 54.541 144.809 14.427 93.393 41.778 133.227-111.590 92.901 49.468 127.876 -74.173 93.276 41.548 138.643 -33.717 90.467 47.817 61.556 -73.569 89.741 51.273 122.426 -40.729 90.846 40.638 127.039-103.345 90.080 50.043 147.471-163.647 87.798 59.079 77.620-102.063 89.482 55.572 134.419 -81.194 97.645 30.257 90.892 -94.871 92.326 53.945 141.228-118.132 93.447 26.942 110.849-114.717 111.442-173.494 137.568-129.191 92.799 51.398 138.991 114.902 90.648 55.181 134.063 -84.917 89.134 83.314 110.273 -15.014 89.087 51.568 150.543 6.130 87.747 48.381 144.649-159.148 90.045 49.653 0.000 0.000 89.248 45.813 139.228 -22.470 90.386 43.733 139.110 -98.220 89.965 54.959 120.202-131.063 86.177 62.768 108.975 -76.288 88.737 48.275 127.798 -79.589 91.165 45.857 140.377-137.752 95.773 -84.943 104.392 -83.601 123.010 171.467 152.646 -14.233 131.158 -36.744 112.427-107.854 111.018 -17.742 117.279 -80.547 94.777-152.698 98.027 -58.653 96.807 45.810 143.412 28.458 94.607 41.967 128.583 -75.945 91.934 43.172 153.581 -16.478 90.434 57.410 135.817 -40.357 88.368 48.565 132.389 -55.740 90.442 40.246 128.302 -76.105 92.585 46.083 109.481-118.969 91.207 45.448 130.709 -77.263 90.928 47.851 142.884-165.558 89.907 47.208 127.359 -45.850 90.455 52.846 136.453 -92.207 90.241 43.512 134.292-137.745 95.397 74.139 104.010 -80.535 92.573 0.000 128.967 -76.588 # 205 total E -1.46527E+02 rmsd from N 0.000 %NC 0.00 116.346 132.468 152.641 -89.167 93.786 50.091 117.104 -30.141 94.421 44.372 106.138 -81.130 93.061 44.491 128.386 -75.757 90.872 47.829 101.271 -70.134 91.019 43.750 79.157 -60.448 89.282 46.106 125.697 -32.750 90.808 42.098 108.376 -96.848 90.151 46.195 130.493 -82.003 101.132 22.470 79.342 -95.490 98.104 40.980 156.636-148.094 103.022 21.136 85.371-105.915 95.289 55.238 120.096 -81.881 91.905 40.353 114.488-101.829 92.307 47.206 139.941-129.161 92.207 43.488 120.994-121.491 96.808-115.516 121.005 -86.253 112.336 145.142 151.460 -46.170 106.469 171.928 136.063-128.150 96.669 50.184 154.323 -25.060 92.462 47.700 0.000 0.000 89.367 47.499 146.528 -21.353 91.211 52.427 132.885 -77.968 88.582 48.301 129.357-124.246 89.208 45.734 107.550 -77.835 91.738 49.294 133.615 -75.955 92.449 48.971 138.203-143.418 94.295-120.903 147.660 -32.971 94.824 172.152 148.359-124.226 103.180 -14.444 96.384-124.170 103.580 -62.120 115.446 -78.222 99.090-106.633 123.150 -34.582 91.453 65.921 111.794 -72.218 91.307 50.691 130.039 -76.142 89.453 42.277 133.679-125.468 92.747 42.596 120.923 -80.618 90.554 48.020 139.179 -92.003 90.210 49.466 128.513 -77.593 91.496 77.896 105.344 -91.533 87.058 -85.920 129.314 -77.175 92.475 -46.973 142.311-117.009 86.162 -56.543 110.035 22.313 90.358 -52.617 148.118 -26.260 90.595 -44.011 111.070 -82.005 97.337 101.004 105.712 -78.407 92.440 0.000 129.165 -75.942 # 206 total E -1.51835E+02 rmsd from N 0.000 %NC 0.00 92.911 142.271 139.930 -92.693 93.714 50.748 149.628 68.905 91.149 50.009 107.208 -79.959 90.919 48.875 129.030 -76.018 90.466 45.074 155.768-150.148 94.081 42.511 136.178 162.078 91.442 43.124 124.231 -52.884 94.664 43.024 127.628-103.811 89.512 47.070 148.265-139.198 89.311 51.861 80.885-110.760 92.223 53.769 132.168 -91.276 100.353-101.072 100.365 -95.685 119.134 173.505 106.404 -86.277 147.670-128.770 169.925-172.186 104.813-121.960 138.186-152.734 96.368 45.562 144.426 150.035 92.774 46.052 134.575 -85.484 90.928 49.450 122.150 -61.980 91.765 52.428 117.440 -35.823 92.502 40.891 108.109 -82.541 91.228 44.418 0.000 0.000 90.679 63.336 98.321 -81.202 86.877 55.597 142.082 -64.104 89.117 39.277 119.192-126.882 91.621 46.682 111.712 -76.712 90.613 49.707 145.412-105.909 90.916 53.232 138.320 -90.069 88.634 41.924 140.423-126.472 97.087 152.653 109.141 -83.633 109.803 144.045 130.904-147.355 110.282 -15.715 116.541 -79.302 94.063-123.930 117.637 -15.502 95.389 42.383 115.168 -77.311 92.629 52.476 130.391 -77.017 87.306 48.654 105.586 -79.017 90.170 51.567 103.392 -66.641 90.279 45.443 136.393 -51.384 91.211 39.785 128.399 -76.438 94.021 96.343 100.933 -95.465 89.432 -82.212 129.938 -77.544 93.394 -43.371 144.387-121.518 91.750 -40.926 123.050 -1.715 93.955 -62.249 140.852 -49.629 90.494 -59.484 138.115-149.554 94.354 69.767 102.990 -79.548 92.422 0.000 129.299 -76.161 # 207 total E -1.49380E+02 rmsd from N 0.000 %NC 0.00 93.046 -57.088 129.713 -86.637 94.361 -47.775 117.061 -79.443 90.728 -47.415 102.820 -77.226 90.466 -47.418 128.769 -75.919 91.091 -41.594 142.705-127.362 93.950 -41.148 60.804 -65.804 92.295 -41.818 130.510 24.450 101.277 -39.159 168.355 154.630 94.770 -55.365 126.414-118.410 96.843-104.991 78.825 -83.981 121.730 78.399 151.474 145.738 90.516 51.716 95.400-125.283 93.893 39.982 99.663 -83.051 94.901 51.838 176.417-155.357 97.260 20.972 110.514 -94.871 100.921 44.294 140.334 -98.214 98.690 21.191 118.580 -66.298 119.687 -87.523 149.841 -14.767 128.152-113.860 96.517 -85.804 89.803 78.691 148.685-169.997 90.893 52.095 0.000 0.000 90.663 41.143 138.478 -23.396 91.890 47.057 138.672 -94.603 89.701 56.261 120.460-129.493 87.351 51.444 107.189 -77.883 90.290 52.531 127.752 -82.859 90.528 44.224 138.288-143.139 94.571-120.457 105.138 -83.086 98.846 178.075 150.000-126.408 105.838-137.909 89.378 -97.292 93.993 54.487 128.950 21.414 92.231 45.843 100.619 -19.577 89.985 49.621 126.778 -16.704 90.420 46.014 128.942 -76.811 90.446 47.396 141.104-151.460 90.335 43.933 128.307 -43.917 90.502 53.758 130.062 -74.882 89.612 50.844 129.190 -77.441 90.326-173.010 109.127-106.210 93.448 90.077 132.019 -77.904 93.218 36.776 142.769-127.988 94.384 84.489 140.909 -79.858 92.581 -68.007 147.701 -43.137 100.244 -56.958 109.891 -85.391 96.438 136.314 103.446 -77.682 92.686 0.000 128.499 -76.356 # 208 total E -1.49074E+02 rmsd from N 0.000 %NC 0.00 123.493-138.924 149.236 -74.906 96.574 -31.510 142.840-107.176 106.605-109.733 141.783 -12.586 90.748 57.726 130.505 -77.373 94.790 52.600 137.496-120.096 92.814 38.269 53.847 -71.170 91.256 49.276 122.405 -19.018 91.143 48.415 126.291-105.378 89.134 48.381 141.211-145.914 91.807 173.076 84.980-102.675 135.638 99.411 164.517-158.676 94.103 63.949 97.018-122.406 97.557 65.260 105.661 -87.041 94.659 -78.327 160.658-126.755 106.247-115.119 139.216-156.057 94.034 43.651 149.306-124.565 93.352 46.800 134.947 -79.326 91.177 45.950 126.719 -58.466 91.994 49.689 93.916-104.453 90.897 42.948 132.744-169.180 90.491 45.854 0.000 0.000 90.100 52.456 105.266 -83.663 89.378 49.336 141.471 -73.188 89.780 40.937 121.691-128.154 90.525 49.112 114.089 -77.664 91.283 49.128 135.691-103.350 92.102 51.230 135.091-166.659 92.765-113.400 149.888 -34.383 97.388-166.877 113.071 -77.484 101.785 -46.717 95.106-101.790 99.578 -33.311 112.228 -77.704 93.466 -43.442 113.279 -44.483 91.832 -48.754 108.992 -72.957 90.058 -47.396 127.329 -76.197 88.706 -41.906 103.176 -79.384 90.073 -49.398 143.769 -44.320 89.427 -49.954 154.254-145.268 89.191 -45.508 127.945 -76.649 90.040 -92.019 132.499 -3.906 89.797 71.334 132.718 -78.150 94.172 63.989 140.800-105.548 94.356 62.394 121.842 -9.819 91.714 -99.270 143.957 -32.851 93.663 -20.729 136.777-128.288 106.961-114.201 101.520 -76.927 92.880 0.000 129.548 -76.113 # 209 total E -1.47702E+02 rmsd from N 0.000 %NC 0.00 93.276 169.873 139.859 -98.555 93.496 55.500 138.228 37.747 92.301 44.426 106.735 -82.069 91.665 48.192 131.087 -77.039 93.429 43.081 147.200-132.213 91.840 43.841 56.786 -70.029 90.475 45.694 122.620 -28.343 90.640 49.058 127.937-100.721 88.390 43.323 129.495-116.132 94.979 113.560 82.560 -96.219 90.768 -62.532 146.612-105.350 97.491 -41.923 93.956 -94.658 91.958 -44.090 105.799 -75.678 96.559 -32.063 146.740 170.082 98.816 -56.532 149.644-170.696 96.923 30.312 129.940-125.871 133.237 -76.099 151.097 -60.185 133.813 -68.557 135.948 49.647 98.439 48.094 151.114 156.284 99.810 31.127 107.306 -82.922 97.280 40.333 0.000 0.000 94.872 45.606 109.586 -87.182 91.304 44.759 146.831 -84.757 91.864 39.372 114.315-124.368 91.116 49.398 111.417 -77.374 90.874 50.289 133.502 -93.089 91.527 43.789 137.193-122.166 93.291 30.708 116.499 -91.271 108.061 -7.854 119.395 -87.053 139.101-162.761 105.557 -89.773 91.727 68.585 142.477 171.677 92.687 123.405 114.251 -88.269 93.901 -39.449 109.892 -74.285 91.662 -52.581 127.617 -76.175 89.289 -43.570 101.837 -81.115 90.237 -48.591 147.421 -35.198 90.090 -49.368 155.646-157.240 90.878 -46.573 128.830 -76.410 92.049-122.008 134.110 15.501 90.590 58.185 132.722 -78.179 90.986 44.853 141.372-103.388 89.517 49.799 132.061 -41.511 90.439 68.473 140.753 -41.917 86.539 49.873 137.887-138.803 93.778 87.751 99.110 -78.484 92.494 0.000 128.955 -76.421 # 210 total E -1.49104E+02 rmsd from N 0.000 %NC 0.00 93.216 164.086 140.624 -99.493 93.621 54.190 138.896 29.603 92.083 45.562 106.556 -82.728 91.858 47.152 130.093 -76.854 93.349 47.002 144.488-119.864 91.386 41.265 59.628 -72.608 91.472 45.634 126.591 -30.327 91.660 43.440 129.386-106.997 89.081 52.040 139.736-153.556 87.797 59.473 77.983-104.922 90.065 40.143 131.239 -81.211 107.050-122.677 92.896 -82.152 113.454-146.720 105.661 -82.069 149.484-162.727 176.457-177.760 104.769-103.196 139.446-148.129 93.369 52.298 141.994 141.710 91.606 47.125 134.674 -87.912 90.409 52.641 144.056 -78.930 89.557 46.776 128.079 -32.912 90.301 46.422 109.518 -82.364 90.566 46.504 0.000 0.000 88.927 51.331 141.464-127.449 88.559 47.422 128.472-102.547 90.521 41.742 123.052-129.070 90.299 46.848 115.132 -73.811 92.683 39.424 132.730 -99.323 95.700 48.504 130.598-133.298 95.843 0.123 154.713 -21.044 121.594 175.365 112.754 -79.139 113.588 175.603 133.888-150.019 99.085 -19.883 111.751 -79.590 93.792-121.703 109.308 -7.323 94.217 43.082 127.476 35.688 92.388 53.669 131.939 -78.026 91.080 40.459 103.042 -79.188 89.657 54.866 120.150 -26.888 88.318 50.528 137.983 -48.677 89.202 43.017 128.646 -76.916 89.012 52.184 123.522 -59.084 89.836 48.127 127.874 -75.497 90.485 44.473 140.706-108.653 90.672 44.972 129.504 -44.080 91.069 52.669 134.596-104.349 90.227 42.899 132.267-133.723 95.764 71.372 104.264 -80.682 92.518 0.000 129.013 -76.659 # 211 total E -1.48045E+02 rmsd from N 0.000 %NC 0.00 93.222 166.804 138.287 -92.160 93.288 57.474 140.419 36.281 92.697 44.639 106.769 -82.276 91.998 46.422 130.869 -76.943 94.119 43.642 147.366-127.635 92.362 42.976 55.929 -70.694 91.221 44.946 122.639 -24.872 91.576 46.931 125.040 -98.558 89.228 44.216 141.072-120.488 93.811 120.547 79.387 -99.407 92.806-121.331 145.510-105.445 90.922 54.119 97.280-115.395 95.392 43.658 105.027 -82.946 94.599 37.684 151.535 -33.024 95.882 44.799 138.997-137.062 93.639 38.808 126.433-118.673 98.684-164.203 130.749 -92.243 113.507 179.325 139.109 81.784 109.728-154.853 108.008-141.984 95.617 45.757 155.740 -25.115 92.548 47.802 0.000 0.000 90.307 46.855 143.009 -21.403 89.661 54.305 141.512 -88.261 88.748 50.257 126.915-135.111 88.149 45.693 109.465 -74.731 91.571 52.024 136.901 -88.287 91.861 51.371 135.654-153.969 92.909-112.333 145.757 -35.937 95.191 178.393 150.313-149.630 107.976 -23.356 91.629-119.183 107.338 -43.836 113.301 -79.560 93.000-122.438 119.151 -19.656 94.270 49.445 113.989 -78.224 90.809 49.781 130.789 -77.178 88.928 45.622 140.011-148.911 90.312 48.211 117.977 -29.409 90.538 44.473 135.770 -54.239 91.677 41.236 128.479 -76.657 94.323 107.000 109.307 -97.312 88.680 -70.049 129.685 -77.820 91.324 -47.025 142.931-121.363 89.307 -46.262 123.481 -5.367 91.791 -51.715 147.064 -37.098 91.192 -47.246 113.195 -84.771 95.890 83.527 106.042 -79.072 92.456 0.000 129.050 -76.352 # 212 total E -1.47198E+02 rmsd from N 0.000 %NC 0.00 92.948 170.330 128.831 -63.709 93.370 68.349 148.618 46.110 95.541 40.813 107.378 -81.798 92.534 46.395 131.969 -77.244 94.687 41.886 148.292-136.044 92.477 45.448 56.475 -74.699 90.361 45.299 123.399 -38.874 91.900 46.140 124.764-101.827 89.572 44.936 139.408-134.532 93.798 96.586 82.852-102.697 94.555-140.598 150.427-110.573 93.417 61.596 94.202-113.200 93.019 46.869 101.374 -77.998 92.703 46.768 142.503 -45.431 90.624 48.249 138.851-131.068 92.302 53.445 123.096-117.228 95.528-122.910 118.498 -67.318 92.146 120.364 135.043 -82.371 91.442 89.530 148.849 -53.423 91.297 49.973 107.864 -87.099 90.040 45.087 0.000 0.000 89.579 51.553 132.639 -18.445 90.077 48.446 134.699 -88.498 91.454 48.097 126.588-134.559 93.742 150.137 111.973 -77.215 119.726 -72.242 151.259-123.633 97.012 -77.855 137.444-134.009 95.681 42.555 152.026 -21.402 109.712-101.912 152.581 -22.604 103.675 143.229 99.748 -75.397 94.033 44.183 124.059 32.238 90.617 51.386 106.936 -20.651 89.470 49.558 127.619 -35.524 90.626 43.103 128.937 -77.123 89.378 46.964 101.110 -83.624 88.579 59.624 121.758 -42.915 88.194 48.577 136.026 -53.399 90.236 39.516 128.350 -76.246 90.710 50.969 113.993 -50.712 90.602 47.402 128.445 -76.607 90.106 46.067 142.192-167.891 90.430 46.879 128.101 -43.807 90.922 51.344 135.946 -89.033 90.640 44.287 139.414-144.060 95.403 73.002 104.234 -80.536 92.471 0.000 129.329 -77.008 # 213 total E -1.47457E+02 rmsd from N 0.000 %NC 0.00 93.082 158.512 138.797 -89.827 93.140 56.361 138.899 47.315 92.169 44.014 105.921 -82.028 92.011 49.660 130.997 -77.246 92.376 44.151 155.538-145.675 91.630 42.808 61.264 -73.728 91.664 45.812 123.158 -38.256 91.420 42.470 134.867-101.752 90.069 50.515 143.700-174.982 88.144 49.326 79.244-104.923 91.537-177.811 128.000 -81.072 96.219 87.652 132.182-157.867 91.077 164.617 104.678 -83.307 117.991 85.709 149.261-126.773 133.736 -15.709 152.119-178.107 99.066 42.189 141.991-102.737 98.402 33.434 136.082 -70.481 94.562 48.030 126.176 -19.856 92.908 44.720 139.897 155.968 95.498 34.733 150.127 -38.702 98.562 36.878 0.000 0.000 93.123 50.046 142.913 -14.478 89.855 54.199 134.686 -97.269 90.429 45.654 123.615-133.367 94.787 100.644 109.622 -75.335 92.703 -58.376 140.606 -88.459 95.361 -52.697 133.210-115.767 91.927 -55.248 142.709-125.686 112.330-161.317 160.531 -8.009 100.983-131.151 93.625 -93.176 98.457 45.981 115.635 -77.249 94.205 43.397 109.274 -28.341 92.305 45.024 132.727 -15.880 92.406 49.040 128.925 -76.368 91.448 40.993 101.719 -84.937 91.883 42.948 118.415 -61.812 92.205 54.811 131.070 -62.622 89.089 48.843 130.703 -78.506 90.142 138.650 101.194-115.122 93.473 46.154 130.588 -77.933 92.470 47.193 151.544-177.444 91.586 47.469 128.781 -45.378 92.049 48.970 131.522 -99.749 91.487 45.332 137.409-167.100 95.379 70.571 104.239 -80.865 92.531 0.000 128.951 -76.543 # 214 total E -1.46535E+02 rmsd from N 0.000 %NC 0.00 93.219 163.981 140.783 -99.194 93.475 54.598 137.087 37.356 91.615 44.345 105.981 -82.421 91.489 53.252 131.193 -76.664 90.965 42.404 150.103-143.761 90.067 44.633 64.084 -72.770 90.883 45.824 116.279 -39.996 90.734 44.063 139.192 -91.608 89.643 43.403 135.910-128.946 90.967 48.448 72.474 -95.399 91.156 114.607 141.376 -61.095 88.861 85.525 130.833-157.434 89.064-158.186 99.460 -86.700 149.468-154.833 165.819-162.636 94.342-124.668 149.954 -37.700 94.031 45.404 143.651 77.470 92.438 50.251 136.152 -81.513 93.636 40.931 104.983 -27.344 95.634 38.582 147.613 55.723 95.496 42.326 159.176 -13.114 91.396 48.317 0.000 0.000 89.743 49.428 137.717 -29.031 89.214 49.923 140.317 -79.537 90.137 50.298 126.362-133.844 93.798 100.527 109.027 -76.084 90.203 -69.216 146.389-106.000 94.620 -43.139 135.647 -62.023 95.735 -63.061 151.058 -24.423 127.888-141.480 160.495 -8.717 114.469-104.185 124.354-135.341 96.712 51.244 113.358 -76.854 93.088 48.177 139.958 -2.091 92.722 41.230 109.880 -76.268 90.120 56.609 129.363 -76.162 85.916 57.878 105.103 -87.006 91.879 30.833 118.368 -83.171 93.890 54.595 168.146 175.605 90.126 49.764 123.854-107.219 91.461 162.001 86.600 -94.998 92.505 51.761 131.590 -78.103 90.856 48.370 141.312-107.227 91.324 63.109 127.110 -25.875 90.738-116.453 135.546 -64.323 99.511 7.180 106.432 -86.733 125.479 88.820 100.893 -76.393 92.610 0.000 129.523 -76.818 # 215 total E -1.47518E+02 rmsd from N 0.000 %NC 0.00 93.131 -60.884 130.331 -88.529 93.470 -48.114 117.134 -78.098 90.427 -45.776 103.666 -76.334 91.764 -49.277 126.476 -74.808 96.440 -16.805 146.654-128.158 107.252 -35.545 56.369 -75.862 94.720 -27.048 123.867 -57.606 109.143 -24.306 141.234 -88.032 101.348 -47.164 150.948-128.677 94.655 47.863 131.620-134.278 140.614 -75.109 141.615-160.044 104.254 -45.951 87.939 -94.126 96.683-103.395 113.051 -81.235 147.622-121.977 155.323-161.806 102.010-114.723 135.398-153.569 94.286 49.730 138.893 126.826 91.921 47.367 135.906 -84.870 91.084 47.310 129.040 -71.820 92.799 46.547 137.077 -27.774 94.570 40.629 144.563-165.879 91.735 43.592 0.000 0.000 91.507 54.674 103.954 -85.699 88.807 49.813 146.371 -75.313 90.710 39.413 118.046-127.912 90.455 51.693 112.332 -77.319 90.023 63.149 140.500-103.824 89.062 42.198 141.965-134.362 91.925 45.602 113.030 -89.364 96.133 26.087 139.494 -92.487 126.302 160.044 114.575-113.152 95.467 32.004 115.325 -78.139 102.307 121.517 127.998 28.495 91.079 -48.800 107.712 -76.135 90.184 -53.662 126.512 -75.449 87.192 -45.485 103.484 -78.890 90.853 -46.396 131.830 -28.087 90.054 -45.727 143.241 -53.080 90.887 -56.920 128.633 -76.378 90.361-124.797 121.467 6.526 90.381 49.541 131.963 -77.718 91.630 52.305 135.763 -60.064 91.847 71.614 128.980 -34.474 89.433 -99.499 126.791 -65.600 95.600 -21.977 136.321-135.898 114.002-103.909 100.833 -73.383 92.917 0.000 129.384 -76.528 # 216 total E -1.51355E+02 rmsd from N 0.000 %NC 0.00 119.287 120.549 145.224 -41.585 103.239 40.953 141.322 7.774 92.093 48.405 109.065 -80.069 91.422 47.004 128.036 -75.059 91.174 43.540 117.410 -27.602 91.774 43.401 98.823 -63.713 92.483 40.713 112.811 -72.737 102.033 19.300 109.118 -80.675 99.061 39.719 150.590 -28.877 95.446 33.153 118.189-121.429 96.747 42.210 122.496-129.645 98.772 24.189 87.436 -95.385 97.053 47.964 144.066 -48.325 95.603 27.560 123.459-101.274 100.422 48.530 134.810-128.066 95.629 38.369 121.613-122.527 108.813 -86.678 160.921 176.304 128.123 -97.142 140.763 -70.313 116.734 20.343 154.108 94.329 96.091 49.665 144.219-163.739 93.701 37.680 0.000 0.000 92.323 55.226 110.249 -82.356 87.401 45.021 146.141 -85.423 90.715 44.495 116.453-126.569 89.770 49.676 106.255 -74.876 88.852 55.352 131.534 -67.042 90.494 41.040 135.281-138.344 93.456 47.579 108.434 -86.015 98.027 20.960 150.909 -25.811 130.620-169.783 110.809-104.946 95.754 46.174 115.014 -77.212 92.654 46.642 112.143 -5.035 89.385 49.119 130.633 -12.869 90.710 48.658 128.864 -77.412 88.831 45.660 102.808 -84.190 91.236 45.107 129.657 -36.919 92.743 42.338 132.758 -75.621 93.002 40.918 128.816 -77.240 92.686 58.161 106.585 -79.264 94.703 175.210 129.154 -77.457 91.145 57.045 141.552-111.332 89.980 66.234 131.155 -46.964 89.458 67.885 143.415 -34.061 88.147 48.774 150.252-142.842 93.356 108.384 101.517 -79.979 92.560 0.000 128.715 -76.578 # 217 total E -1.46600E+02 rmsd from N 0.000 %NC 0.00 93.280 168.342 140.697-101.456 94.315 52.165 135.114 45.838 91.628 45.601 105.369 -80.005 91.645 48.391 131.260 -78.425 93.701 48.269 151.463-140.247 94.400 40.039 58.046 -75.191 90.040 50.611 127.825 -38.993 90.399 74.306 127.530-113.225 85.323 58.712 139.195-166.602 86.794 167.384 80.145 -94.491 92.761 70.447 153.626-153.099 93.126 42.922 91.749-119.997 94.075 46.974 106.494 -83.722 94.537 39.169 147.280 -98.295 97.020 126.120 134.843-160.856 95.882 -51.576 112.978-132.507 93.848 -52.249 136.962 -87.100 94.347-148.629 144.132 -62.241 108.370 -24.212 105.006 -85.768 92.867 -51.813 104.362 -81.676 90.359 -44.825 0.000 0.000 92.882 -45.668 150.153-140.320 89.874 -45.282 124.744-100.151 91.942 -40.806 118.292-137.401 94.653 -43.159 136.540 -7.584 96.882 -21.100 162.419-133.642 106.994 -40.276 131.087-160.976 94.009 -41.681 140.550-116.880 95.845 151.272 148.586 -15.695 95.505 1.219 97.409-104.150 139.611 -76.381 125.097 -85.698 100.966-145.461 118.370 -80.983 124.782 27.711 139.479 14.317 91.780 51.545 130.541 -76.573 89.007 45.433 139.681-144.709 90.121 50.380 137.585 -45.633 88.153 48.658 158.381-112.291 89.562 43.524 128.161 -76.742 89.083 50.175 110.859 -40.895 89.598 49.217 129.139 -76.299 89.696 44.297 136.267-122.051 90.012 48.804 129.319 -41.579 89.712 54.099 135.854 -61.128 89.829 44.125 135.987-121.937 94.869 78.893 103.992 -80.628 92.534 0.000 128.909 -76.702 # 218 total E -1.49931E+02 rmsd from N 0.000 %NC 0.00 93.470-179.968 140.567-104.112 93.856 52.988 139.184 15.826 92.614 44.960 105.439 -79.419 92.439 45.928 130.624 -77.068 94.458 42.111 132.362-109.486 94.458 40.366 53.460 -70.337 92.680 43.757 128.374 -29.838 89.489 50.164 136.897 -97.238 90.487 49.040 125.553-111.732 93.278 82.773 96.818-103.960 123.463 19.685 146.125-108.411 99.199 -54.270 105.073-100.330 102.058-143.988 107.795 -82.981 135.109 34.506 157.258-155.752 94.779 53.976 136.360-163.282 93.723 39.892 137.799-106.397 99.494-146.906 131.963 -77.438 132.901 -75.036 114.997 52.429 98.304 42.867 143.745 -4.817 94.026 45.200 156.430 -10.259 89.928 50.113 0.000 0.000 89.465 54.489 109.623 -81.396 88.483 41.310 140.806 -82.200 92.629 44.805 119.740-123.889 89.647 53.908 111.193 -75.904 90.213 55.271 124.884 -91.414 90.875 51.366 134.039-140.086 94.707 -3.102 142.626-127.242 133.087 76.858 150.199 -17.523 106.954-167.007 96.662 -82.174 95.525 48.935 115.553 -76.904 91.955 46.750 99.934 -10.229 89.314 51.003 128.886 4.284 90.404 48.325 129.269 -77.154 89.461 43.306 103.548 -84.599 90.080 49.118 119.791 -26.127 89.722 48.247 134.771 -55.527 89.996 46.174 128.222 -76.447 91.819 74.771 116.261-105.392 88.289 -92.433 130.191 -77.734 93.738 -44.591 143.337-115.789 86.822 -60.892 111.479 -2.313 90.113 -55.806 147.416 -23.399 90.391 -41.122 112.404 -83.215 98.674 93.756 105.283 -78.298 92.378 0.000 129.388 -75.760 # 219 total E -1.47777E+02 rmsd from N 0.000 %NC 0.00 93.272 160.138 142.496-105.568 93.812 51.378 155.780 151.869 92.095 46.237 143.638 -22.852 90.875 48.474 130.488 -76.248 90.539 44.967 147.778-137.205 91.378 42.996 125.967-173.346 90.885 46.207 118.900 -43.247 91.237 44.462 135.923 -97.452 89.400 47.732 138.771-134.592 89.310 52.535 78.271-103.214 91.270 48.336 131.312 -77.855 103.682-134.884 96.622 -86.826 105.354-129.559 103.731 -82.730 144.710-174.452 175.849-174.935 104.461-109.339 140.025-150.240 92.899 51.261 142.019 129.623 91.853 46.248 133.795 -86.853 90.730 48.775 128.872 -58.608 90.705 49.172 126.327 -22.681 91.471 43.931 108.046 -82.175 91.567 43.722 0.000 0.000 90.537 53.799 114.149 -82.670 89.814 48.216 175.024-175.818 90.812 38.643 108.992-141.973 91.900 47.723 113.912 -79.014 89.932 52.881 152.226-130.880 89.606 51.827 152.660-168.769 89.282 37.748 112.316 -89.634 95.632 108.430 117.968 -81.473 96.653 100.718 124.793-143.828 96.117 23.440 113.420 -78.518 120.783-147.555 146.616 9.605 90.608 60.039 120.859 -69.498 90.103 49.632 129.537 -76.137 86.955 47.351 106.588 -82.787 89.108 49.994 138.304 -93.031 88.980 48.695 147.849-158.865 89.046 43.571 127.941 -76.384 88.241 79.813 99.644 -51.948 90.203 66.374 127.231 -76.436 89.470 16.133 142.408-128.443 106.994-156.850 118.903 4.387 114.173 -88.437 176.454-156.047 97.156 -18.620 103.915 -91.946 100.605 53.181 101.047 -79.565 92.460 0.000 129.342 -76.226 # 220 total E -1.49468E+02 rmsd from N 0.000 %NC 0.00 93.318 175.258 140.464-101.753 93.406 55.510 139.158 24.969 92.052 43.781 105.837 -83.102 91.718 54.014 132.162 -77.608 90.019 42.773 142.207-133.425 88.604 52.028 67.448 -73.731 88.199 54.827 111.418 -46.070 89.178 41.796 132.294 -89.570 90.086 48.186 155.428-156.976 89.051 54.670 75.826-103.193 90.839 150.278 131.357 -74.367 92.763 90.245 132.808-158.263 89.707-179.982 100.631 -85.982 111.290 179.395 154.759-165.467 109.283-102.515 142.282-154.590 92.287 49.921 148.200 141.728 93.057 44.048 134.367 -84.537 91.530 45.132 126.165 -54.549 91.508 48.270 115.454 -26.222 90.204 45.142 107.330 -82.064 90.748 46.038 0.000 0.000 92.801 41.605 105.489 -83.712 90.283 48.745 156.749 -80.474 90.813 39.382 115.566-135.923 93.082 64.201 114.200 -79.304 91.618 -59.799 145.314-117.473 117.501 -68.298 145.566 -96.536 94.855 -25.038 144.098-128.635 104.973-158.644 150.465 -15.576 113.268-131.469 116.071-125.266 95.116 40.428 114.017 -76.791 93.216 48.566 135.377 -59.173 92.118 43.141 133.051 -15.306 91.024 46.746 130.570 -78.318 87.446 51.883 105.670 -86.050 87.455 60.380 138.832 -98.526 86.940 49.130 146.842-153.542 88.536 43.258 128.012 -76.277 88.637 54.550 110.234 -45.889 88.911 48.297 128.838 -76.091 89.656 43.841 138.673-134.700 90.345 49.526 129.274 -41.045 89.374 53.882 136.167 -65.004 90.131 43.277 137.665-128.200 95.416 113.597 146.865 -24.437 124.328 0.000 144.486 -92.853 # 221 total E -1.51098E+02 rmsd from N 0.000 %NC 0.00 93.136 -66.560 127.945 -79.509 94.489 -47.342 116.528 -79.771 90.644 -47.586 102.886 -77.275 90.216 -47.625 128.855 -76.076 91.223 -41.164 139.555-122.477 94.327 -40.631 60.768 -61.551 92.053 -41.537 130.711 8.385 100.046 -38.672 169.013 161.398 92.673 -66.419 117.031-112.019 87.741-100.896 82.985 -83.234 127.184 106.411 156.973 175.120 95.944 42.199 92.595-117.989 94.679 42.499 107.809 -84.846 92.743 54.904 159.891-162.358 92.802 38.801 108.231 -87.423 95.419 40.740 137.439-101.671 97.855 21.632 132.484 -83.493 131.864 -86.725 139.796 -58.406 119.870-128.323 119.124 -69.747 93.749 59.811 148.984-169.300 92.029 46.214 0.000 0.000 90.813 48.114 137.004 -7.259 89.734 48.327 140.894 -96.841 91.511 58.687 121.940-137.801 87.420 97.442 113.864 -73.132 88.934 60.026 130.049 -98.937 91.218 45.802 137.244-141.608 95.465-119.862 104.961 -82.334 111.899-175.458 158.975-145.864 103.697-118.868 97.197-109.949 92.699 56.409 122.017 30.925 88.717 66.006 104.894 16.294 87.564 59.205 113.050 -21.149 88.361 46.387 128.939 -75.723 87.660 50.536 139.929-148.585 89.041 51.209 136.031 -34.219 87.620 47.365 154.554-106.066 89.568 44.303 128.073 -76.668 88.970 51.135 111.239 -34.867 89.007 48.824 129.733 -76.805 89.608 44.350 135.236-107.959 89.715 50.609 129.095 -37.218 88.889 56.979 137.386 -56.937 89.262 42.393 129.690-112.653 95.381 117.005 146.893 -24.522 124.727 0.000 144.263 -93.653 # 222 total E -1.48457E+02 rmsd from N 0.000 %NC 0.00 92.607 128.707 129.817 -63.967 94.475 49.020 142.604 -89.656 90.653 49.355 105.401 -80.941 90.946 50.683 127.711 -75.611 89.394 53.609 105.731 -66.192 90.649 36.379 100.546 -75.314 92.233 49.871 109.043 -81.227 94.476 45.605 119.119 -92.502 93.874-110.376 149.750-113.636 100.699 167.531 85.481 -77.191 93.670 74.116 143.854-132.351 97.221 45.740 92.378-116.511 99.650 105.194 108.045 -83.129 109.100 -58.429 151.241-104.718 97.355-122.008 136.040-147.619 93.109 46.075 145.191 146.417 93.291 46.113 135.443 -84.412 91.235 44.234 127.609 -50.709 92.221 52.006 126.268 -38.230 89.943 44.796 146.261-161.494 90.465 42.972 0.000 0.000 91.607 49.890 108.561 -83.553 88.851 46.336 147.396 -81.014 89.815 43.967 117.976-129.308 89.168 50.481 111.981 -77.428 89.970 51.344 139.155-102.493 91.446 45.872 132.700-155.385 94.932-104.889 151.892 -31.454 106.138-168.352 113.370 -76.479 106.285 -57.427 94.774-100.870 106.318 -23.450 113.550 -78.373 92.840 -49.082 113.590 -45.995 91.780 -47.274 107.221 -71.926 90.231 -48.246 127.210 -76.308 89.183 -41.277 102.413 -80.054 90.410 -45.682 147.364 -32.388 91.536 -51.025 155.997-143.334 89.807 -43.615 128.424 -77.235 91.359-113.952 133.885 22.176 91.229 54.068 132.748 -78.170 93.190 52.666 141.816-119.037 94.696 72.147 128.778 -30.655 91.354 -86.813 146.671 -38.561 95.143 -34.529 131.388-112.945 96.678 -79.305 100.122 -71.461 92.867 0.000 129.629 -76.747 # 223 total E -1.47097E+02 rmsd from N 0.000 %NC 0.00 93.160 -68.466 128.049 -79.560 94.263 -48.397 116.811 -78.403 90.779 -46.861 103.340 -76.949 90.673 -47.074 129.086 -75.744 90.513 -41.773 141.359-126.598 93.342 -41.976 58.715 -64.566 92.129 -40.985 130.952 1.863 103.242 -29.518 168.362 150.849 95.652 -57.088 127.690-122.755 94.702-143.991 150.331 -12.072 94.696 58.438 155.624 169.496 91.058 49.653 101.922-142.899 92.008 41.442 96.769 -79.436 91.798 51.751 145.464 -34.697 90.203 48.966 127.116-117.973 91.678 40.387 125.364-119.314 97.570-156.135 123.309 -69.090 116.453-172.942 130.124 63.072 108.773 -42.569 139.556-143.244 96.204 -41.836 148.802 -27.704 112.452 -91.680 0.000 0.000 91.409 60.051 113.031 -84.095 93.406 47.093 174.574-168.613 91.616 41.278 106.549-139.421 90.176 52.099 115.320 -77.930 90.362 55.577 149.484-131.785 90.270 37.081 143.701-147.505 94.584 45.604 113.901 -89.985 97.611 5.225 140.513-100.393 126.536 158.276 115.857-115.235 96.733 42.991 115.840 -78.249 94.197 120.732 127.645 -90.321 93.239 -44.743 113.007 -73.219 91.399 -50.855 127.344 -76.357 88.590 -44.251 100.024 -80.824 90.349 -47.156 140.812 -19.050 94.378 -36.213 153.803 -19.505 94.274 -47.713 129.127 -76.482 94.154 -59.368 127.489 24.951 94.393 129.073 129.231 -76.232 94.421 32.759 140.810-109.361 92.724 61.385 130.052 -25.127 92.657 69.389 156.639-133.644 86.984 42.893 124.891 174.455 95.384 85.067 102.165 -79.492 92.429 0.000 129.187 -76.101 # 224 total E -1.46584E+02 rmsd from N 0.000 %NC 0.00 93.132 -64.801 126.536 -75.673 94.238 -49.222 114.113 -75.355 91.193 -45.036 106.435 -76.589 90.980 -45.494 128.225 -75.808 92.384 -39.442 136.626-119.951 92.220 -43.181 65.825 -57.556 94.325 -39.899 127.880 46.358 98.071 -39.164 168.389-144.913 92.481 -47.525 123.722-118.800 90.670 -69.486 79.266 -71.314 95.353-133.044 145.938 153.567 97.043 53.048 91.487-112.906 95.626 118.934 112.888 -92.349 152.117-128.567 176.430-170.948 97.740-123.157 137.771-143.970 94.307 48.445 141.544 139.189 92.405 47.402 133.553 -86.074 90.892 48.300 129.155 -51.672 91.621 49.042 111.557 -29.784 90.031 45.750 108.990 -81.813 90.261 47.576 0.000 0.000 90.573 54.215 114.900 -80.080 88.173 40.730 145.408 -88.257 90.654 50.626 116.782-127.342 88.407 67.047 109.221 -79.926 88.230 54.667 138.131-100.835 90.076 44.164 135.762-149.629 96.380 -97.478 103.670 -82.203 120.517 176.280 153.045 -15.609 128.673-152.315 118.890-121.459 99.885 53.551 115.807 -77.520 92.004 47.178 101.839 -12.799 89.291 58.542 113.986 -67.596 88.736 44.975 129.413 -76.835 88.368 45.626 138.029-141.492 89.232 50.582 137.428 -38.962 89.006 49.521 149.604 -95.963 89.143 39.699 128.077 -76.758 89.027 53.330 121.006 -66.718 89.946 50.141 127.212 -75.404 92.120 34.407 136.472-118.999 95.512 49.250 126.021 -38.080 93.298 31.665 129.919 -76.401 108.434-133.329 106.915 -83.775 92.011 102.250 146.457 -23.819 92.579 0.000 128.427 -76.660 # 225 total E -1.48442E+02 rmsd from N 0.000 %NC 0.00 92.809 -28.409 131.393 -97.606 99.965-119.700 122.353 -49.861 93.239 42.984 107.361 -80.462 93.006 52.639 128.468 -74.653 91.505 40.836 139.787 -15.246 90.488 46.305 82.475 -94.845 90.174 51.098 119.239 -90.702 89.222 47.253 139.929 -94.966 89.445 56.723 143.618 153.462 87.250 171.401 80.605 -91.730 95.200 67.865 157.594-161.998 95.704 36.547 92.473-120.397 95.167 42.106 101.777 -80.237 92.722 54.278 142.772 -47.383 91.517 38.804 108.048 -90.998 94.823 44.641 135.936-104.156 96.974 13.766 120.625 -75.862 122.142 157.778 137.039 -58.505 104.492 27.741 108.952 144.862 96.251 51.139 147.313 -29.083 116.382 8.280 0.000 0.000 99.787 41.643 155.960 7.934 95.901 38.010 169.228 179.093 90.466 52.455 114.485-148.854 88.046 53.607 109.494 -73.770 89.869 49.166 141.010 -45.088 92.207 33.135 138.289-145.070 103.967-117.606 150.211 -25.303 119.405 176.738 157.971 -8.058 110.703 -96.518 97.874 -89.676 95.640 53.092 115.356 -76.358 90.564 46.642 97.790 -19.477 88.833 60.267 120.999 -40.693 88.686 47.335 127.802 -75.248 89.207 43.612 137.595-139.210 91.611 42.181 128.081 -52.672 92.747 46.127 136.273 -73.905 91.454 49.645 128.434 -77.100 91.036 45.412 100.906 -67.305 94.614-126.982 128.040 -76.137 93.993 -12.775 140.380-109.671 103.451 -95.990 120.410 21.238 116.170-114.194 159.373 -17.006 96.923 -29.236 136.206-148.007 109.282 36.923 106.585 -73.620 92.445 0.000 129.198 -76.322 # 226 total E -1.48755E+02 rmsd from N 0.000 %NC 0.00 124.998-127.805 145.726 -43.679 95.057 -53.815 118.359 -73.272 92.761 -45.772 104.388 -76.439 92.498 -37.909 128.775 -75.860 93.869 -51.087 148.132-162.557 95.519 -45.973 99.024-100.052 95.382 111.384 100.026 -52.802 94.642 43.668 148.379 -78.723 93.288 70.021 150.390 170.319 89.962 120.372 116.789-130.363 126.154 -86.028 132.936-144.528 114.922 21.462 113.345-121.953 92.011 56.873 108.932 -90.498 91.342 53.300 139.220-115.101 89.780 47.600 127.242-152.123 92.129 57.850 130.521-109.910 95.703 -72.361 123.125 -73.722 118.684-164.926 147.616 -60.507 96.897 50.996 152.971 -28.148 94.248 43.481 142.301-169.195 91.665 44.046 0.000 0.000 91.285 49.497 108.231 -87.843 89.369 48.301 145.292 -82.399 90.350 44.047 119.673-130.552 88.934 51.510 114.617 -77.761 90.085 51.726 134.611-105.266 91.206 54.265 130.782-164.212 91.607-115.580 138.016-110.003 100.915 163.417 149.327-130.453 130.892-100.605 112.163-109.884 88.471 66.894 112.057 -75.923 89.722 64.694 113.546 -64.010 91.546 46.448 106.669 -71.005 91.737 39.327 128.662 -75.781 92.927 41.971 104.131 -83.372 92.367 48.130 144.117 -84.408 89.224 44.371 151.879-170.547 91.076 40.029 128.223 -76.563 90.826 49.001 113.261 -54.699 89.717 46.683 130.224 -77.545 90.009 45.805 138.508-139.245 89.959 48.251 127.491 -41.821 89.347 55.307 138.803 -91.575 89.603 42.814 129.520-121.511 95.286 77.017 103.882 -80.475 92.479 0.000 128.816 -76.635 # 227 total E -1.52291E+02 rmsd from N 0.000 %NC 0.00 93.243 -74.809 126.313 -69.958 121.796-102.193 130.358 -34.352 93.504 42.726 109.918 -80.110 93.651 47.428 131.064 -77.646 95.292 41.903 150.144-129.219 91.052 45.016 63.761 -90.551 90.152 45.055 118.737 -59.047 91.277 45.144 128.304-105.569 88.311 48.668 138.720-140.986 88.661 53.654 80.856-104.602 90.597 141.192 134.227 -88.823 95.074 74.172 125.648-148.147 92.987 108.410 144.567 -36.810 92.982 -66.931 125.279 -73.516 95.823-121.445 137.945-137.181 90.048 53.616 138.230 118.879 91.853 47.088 134.468 -85.457 90.818 45.260 145.615 -16.403 90.271 49.734 137.462 -18.565 89.224 49.694 143.192-149.309 90.224 43.866 0.000 0.000 89.767 50.080 117.449 -78.065 89.372 48.232 138.342 -78.694 89.157 44.535 122.294-125.983 89.173 48.839 113.405 -80.115 90.404 50.703 142.102-114.296 91.749 51.167 135.165-118.400 92.990-109.869 140.022-117.166 100.177-170.864 149.174-129.749 132.081 -50.192 111.056-107.298 104.507 -27.352 112.581 -78.921 95.108 -43.391 120.145 -65.997 95.917 -39.241 112.915 -72.260 94.131 -42.161 127.728 -76.361 94.096 -34.636 99.713 -81.320 93.815 -41.088 130.711 -32.539 92.131 -52.016 153.231 -34.555 90.536 -48.204 131.010 -77.760 91.735-136.077 93.101 -60.871 92.160 49.404 131.551 -77.249 92.098 47.754 141.585-115.069 92.214 67.732 124.571 -6.667 92.140 -96.708 133.655 -63.766 100.887 -25.374 105.648 -86.811 119.593 117.861 103.233 -76.220 92.622 0.000 129.494 -76.340 # 228 total E -1.47757E+02 rmsd from N 0.000 %NC 0.00 92.877 122.994 141.192 -99.815 93.188 56.854 143.981 64.629 92.639 42.084 105.985 -82.107 91.928 53.704 131.026 -76.430 91.729 42.810 155.383-165.679 90.926 42.747 72.097 -84.867 91.922 44.792 110.659 -64.456 87.910 53.346 143.822 -99.830 89.447 48.330 107.969-103.248 89.871 173.102 91.399 -83.820 94.415 70.501 135.010-149.984 97.731 34.938 90.539-115.463 109.288 167.079 109.902 -83.589 132.531 -75.988 163.983-179.410 126.548 -92.616 148.987-149.456 94.118 59.427 138.703 -98.728 96.349 -96.202 122.474 -72.130 128.198-104.406 110.693 15.742 92.613 53.113 123.645 -29.220 90.823 48.195 154.002 -20.496 89.864 46.805 0.000 0.000 89.519 51.707 112.000 -78.018 87.759 45.199 142.956 -78.169 89.752 46.650 122.997-127.664 88.910 48.788 106.622 -75.378 89.067 47.918 132.261 -73.994 92.796 40.927 134.654-132.894 94.074 44.561 114.708 -89.519 96.165 33.633 118.446 -85.557 134.930-175.444 106.966 -96.618 94.873 45.226 114.711 -77.117 92.404 47.400 128.239 -88.590 89.538 51.560 120.831 -2.893 89.871 49.688 129.475 -76.756 88.829 41.885 102.753 -84.440 91.212 48.792 119.715 -16.029 90.941 39.019 137.320 -53.440 94.413 48.619 128.581 -76.694 96.606 75.764 118.552 -86.543 89.989 -81.552 128.895 -76.726 90.891 -44.055 141.314-109.272 87.785 -66.081 128.753 8.385 88.742 -56.460 147.736 -23.229 90.218 -28.001 109.922 -82.107 102.485 132.043 103.605 -75.543 92.549 0.000 129.220 -76.211 # 229 total E -1.49514E+02 rmsd from N 0.000 %NC 0.00 125.205-116.622 144.872 -35.198 118.657-104.002 133.377 -45.279 91.385 49.650 107.113 -75.851 93.123 41.632 130.610 -77.970 95.879 47.609 147.143-143.242 96.134 39.002 52.305 -70.422 91.487 46.694 136.357 -13.702 90.472 49.422 124.623-119.265 88.779 52.378 126.264-113.256 87.737 60.074 88.831-101.293 90.711-168.070 135.235 -94.351 94.717 74.196 99.440-128.060 93.552 44.234 99.720 -79.747 93.471 109.188 144.160 -44.963 95.626 44.534 137.466-164.860 92.813 40.213 130.743 -98.953 90.829 54.718 139.142 -27.931 92.269 48.190 108.025 -53.918 95.724 25.514 148.244 162.178 106.994 25.340 107.442 -83.076 97.978 44.205 0.000 0.000 91.050 51.050 145.352-133.206 91.408 37.176 108.615-115.079 91.630 45.000 117.264-112.296 91.415 49.016 112.273 -81.681 89.750 54.599 156.645-148.383 88.549 37.839 112.236-155.197 96.480-114.503 105.107 -82.739 107.169-170.801 155.693-140.411 97.495 -63.659 94.314 -93.328 91.428 -48.505 111.788 -76.032 92.051 -42.596 116.049 -24.849 91.524 -46.554 112.736 -73.173 90.853 -46.027 127.042 -75.701 89.026 -43.140 105.182 -78.777 91.034 -49.424 143.084 -49.518 87.448 -54.241 150.992-120.685 89.762 -42.066 130.340 -77.001 96.002-131.968 104.467 -51.523 92.012 45.475 130.119 -75.961 92.839 54.243 141.567-167.383 92.500 68.424 125.897 -20.699 90.498 -96.555 130.693 -91.549 94.938 -31.972 136.231-137.003 109.101-109.680 147.044 -12.052 92.983 0.000 129.338 -76.678 # 230 total E -1.47342E+02 rmsd from N 0.000 %NC 0.00 93.281 171.672 139.348 -96.892 93.014 57.212 139.985 51.927 93.018 41.108 106.765 -82.805 91.724 49.038 130.449 -76.562 92.036 44.643 150.790-140.944 92.568 43.209 61.668 -72.106 90.543 43.532 123.333 -40.074 88.782 56.135 130.157-101.483 87.540 65.104 122.413-106.112 82.121 167.148 89.182 -96.045 95.095 69.713 134.124-152.412 92.182 45.740 96.359-129.057 95.143 66.192 107.062 -86.125 93.874 -77.487 149.340-109.532 115.480-116.579 142.551-159.645 95.270 43.334 145.241-126.435 93.190 45.885 136.242 -78.992 90.540 49.025 123.011 -59.671 91.932 52.672 110.061 -94.860 90.973 40.698 136.763-168.751 90.798 47.324 0.000 0.000 90.069 74.431 105.828 -79.673 85.385 50.417 146.065 -78.875 88.960 42.995 112.538-125.400 89.835 51.312 104.924 -72.965 89.536 48.202 135.784 -52.307 91.957 41.249 135.698-135.915 94.637 37.333 152.408 -21.389 108.190 111.877 110.967 -80.004 124.412 -83.860 115.480-115.742 97.543 -19.983 114.406 -79.119 97.212-119.491 122.981 -22.845 94.119 43.524 114.967 -77.091 93.418 56.960 129.632 -76.055 97.300 26.470 102.129 -76.886 96.102 45.812 145.199 -22.789 92.968 41.099 130.354 -97.978 92.017 45.410 128.176 -77.358 92.318 77.649 116.881 -93.527 88.666 -90.344 129.914 -77.383 94.639 -42.045 141.837-118.602 89.256 -49.483 113.768 28.559 92.560 -79.542 155.732 -29.470 92.816 -48.287 109.877 -87.554 96.714 53.775 100.706 -79.541 92.521 0.000 129.037 -76.480 # 231 total E -1.47841E+02 rmsd from N 0.000 %NC 0.00 93.223 -79.987 126.411 -68.893 125.070 -99.813 131.222 -34.397 93.815 43.387 111.152 -75.675 94.836 42.852 131.012 -77.634 97.310 32.707 143.202-123.769 99.995 40.668 54.488 -85.124 93.684 42.257 153.711 -77.496 90.192 52.964 145.571-106.447 88.456 57.661 116.736-114.890 86.272 170.394 88.789 -95.288 105.625 49.262 141.921-153.165 91.977 50.184 97.480-127.743 90.600 49.893 102.716 -83.048 91.479 45.385 134.582 -50.819 92.719 46.933 106.900 -87.067 92.473 38.419 134.623-102.490 99.684-160.466 119.179 -69.805 101.187-165.045 132.032 69.723 108.981 -32.091 125.076-113.774 96.051 -38.615 104.897 -81.434 98.789 -31.945 0.000 0.000 103.759 -25.926 118.874 -86.326 100.053 -42.369 138.982 -91.538 92.936 -45.476 119.185-122.078 88.309 -51.737 120.047 -18.864 90.018 -55.187 135.836 -46.099 89.855 -54.443 127.089 -95.752 89.868 -55.507 141.605-124.451 109.837-170.532 151.459 -17.092 102.736-123.245 96.611 -73.199 93.242 50.913 116.464 -75.223 92.667 45.735 117.794 -82.257 90.838 47.601 141.487 149.411 90.308 46.723 128.817 -76.998 90.982 43.273 101.122 -84.570 90.137 48.228 121.518 -18.999 89.959 47.769 134.652 -57.824 89.858 45.156 128.000 -76.328 91.187 78.721 117.699-105.630 87.505 -91.463 128.653 -76.588 93.636 -44.759 144.634-129.246 90.661 -44.847 118.078 13.516 92.047 -52.418 144.623 -40.657 91.325 -44.823 141.548-153.686 96.989 73.424 104.607 -79.646 92.412 0.000 129.276 -76.359 # 232 total E -1.50913E+02 rmsd from N 0.000 %NC 0.00 93.284 167.882 140.770-101.238 93.495 53.563 134.287 45.064 91.373 45.056 106.254 -81.888 91.499 49.730 130.773 -77.046 92.378 42.899 152.028-146.806 92.712 42.242 58.039 -69.709 90.046 46.298 120.852 -32.292 89.153 52.358 134.180-101.348 87.756 46.204 128.222-117.105 89.733 41.857 82.276 -97.699 93.874 157.914 132.449 -76.041 92.713 86.583 137.374-167.009 86.612 151.614 101.388 -87.095 93.349 55.217 133.269-114.458 92.260 46.207 132.694-149.655 94.010 67.505 144.501-107.419 95.285 -86.630 126.006 -93.227 102.440-140.535 133.518 -94.990 94.799 46.048 152.233 51.776 93.239 50.573 154.840 -25.325 91.778 44.782 0.000 0.000 90.396 51.670 138.029 -17.215 89.015 56.895 139.204 -90.558 89.541 50.249 126.878-137.497 93.331 93.317 110.508 -74.850 90.774 -67.454 151.564-101.787 95.621 -50.908 135.705 -84.128 92.676 -51.126 143.224-126.381 115.733-158.681 161.582 -10.655 100.054-132.180 95.080 -95.641 97.846 46.149 115.102 -77.196 93.733 43.379 105.135 -31.877 92.225 46.877 134.920 -15.373 92.217 46.011 128.404 -76.833 91.320 44.007 101.521 -84.140 91.290 47.577 125.988 -64.264 90.484 57.418 128.058 -70.267 89.468 57.037 129.855 -77.819 91.339-174.701 79.202 -75.343 92.498 64.757 132.104 -77.468 90.999 44.296 140.750-103.684 89.266 54.836 134.119 -16.789 90.222 64.953 143.315 -41.091 87.071 42.295 142.771-156.134 95.055 89.331 102.710 -79.409 92.497 0.000 128.954 -76.415 # 233 total E -1.51241E+02 rmsd from N 0.000 %NC 0.00 92.717 137.685 134.446 -73.567 93.668 49.442 122.794 -31.429 93.146 46.745 106.781 -80.658 92.358 44.088 127.791 -75.240 89.748 52.466 105.744 -64.360 90.146 40.916 99.377 -66.566 91.899 38.696 119.475 -80.845 108.781 15.944 103.384 -92.612 95.484 40.934 141.842 -73.889 98.139 33.772 88.770-104.926 93.736 43.717 142.356-123.829 94.096 38.900 92.088-107.989 92.594 51.318 104.590 -86.967 91.586 41.495 137.993 -89.221 93.864 47.011 131.820-131.199 99.657 -9.197 118.608-115.309 128.888 -98.807 155.420 -75.110 137.195 -78.257 126.917 65.367 99.307 49.910 164.764 158.548 99.859 32.328 106.724 -83.037 95.525 43.498 0.000 0.000 94.128 46.789 104.651 -85.495 90.426 47.638 154.497 -81.943 91.865 38.689 113.412-129.198 91.260 51.183 112.910 -77.852 90.338 69.929 142.064-106.030 89.853 44.184 145.211-142.807 92.547 41.805 143.060-129.395 100.361 -4.655 117.740 -90.497 136.420-165.228 106.731 -94.484 97.198 48.270 115.161 -77.276 92.362 48.900 102.428 -23.970 89.791 52.672 126.233 -16.024 91.202 50.020 129.199 -76.517 90.806 41.110 101.508 -83.463 91.574 46.606 125.225 -63.739 91.294 66.201 136.220 -65.802 88.964 63.908 130.223 -78.310 88.838 170.746 98.538-111.375 92.934 62.578 132.073 -77.566 91.412 42.643 140.683-103.104 90.610 48.478 126.602 -33.570 91.492 60.690 140.975-105.640 87.872 47.153 132.053-171.828 92.891 93.421 101.870 -79.738 92.526 0.000 128.785 -76.690 # 234 total E -1.47689E+02 rmsd from N 0.000 %NC 0.00 92.940 151.825 137.641 -85.550 92.999 54.395 125.722 -21.669 94.003 43.556 106.224 -84.480 92.989 45.306 127.341 -74.463 91.068 50.555 113.439 -77.720 90.855 41.571 70.777 -69.569 91.235 42.149 125.875 -53.408 93.791 39.641 106.100 -93.612 90.138 51.639 145.366 -85.042 88.788 42.029 110.572-124.089 94.155 39.643 118.218-127.768 105.284 -16.270 96.966-100.055 127.487 95.329 111.082 -84.394 109.304 -82.527 153.395-115.117 108.444-118.541 139.281-154.513 94.444 44.871 148.715 153.909 92.839 46.052 134.470 -85.197 90.625 47.860 126.144 -56.693 92.051 52.009 110.213 -35.776 89.987 42.569 107.873 -81.663 90.284 47.284 0.000 0.000 91.732 51.316 106.739 -82.885 87.997 43.906 151.801 -83.706 90.130 45.995 115.498-130.178 89.114 53.004 111.103 -77.694 89.297 50.738 141.321-104.027 90.640 41.552 128.844-151.908 95.983 -92.608 143.332-125.089 125.594 166.019 152.359 -14.986 133.549-164.558 107.704 -99.278 97.178 46.388 115.306 -77.318 92.991 46.344 102.517 -6.324 91.964 45.959 124.728 -6.111 89.965 49.365 130.539 -77.198 89.139 46.876 103.935 -85.080 89.647 45.928 118.193 -28.009 91.637 43.623 135.335 -54.943 91.434 45.738 130.292 -77.742 90.241 55.802 114.235 -83.500 91.882 104.917 127.643 -76.179 133.816 177.588 136.003 -77.469 94.508 103.937 130.959 -63.402 125.782 176.672 144.046 -91.022 95.317 47.352 139.003-151.849 114.723 126.579 100.194 -77.733 92.544 0.000 129.807 -76.119 # 235 total E -1.51877E+02 rmsd from N 0.000 %NC 0.00 92.671 98.742 136.129 -87.508 93.390 54.131 125.387 -40.455 93.927 43.700 104.015 -80.933 92.380 45.849 128.460 -75.087 91.664 48.385 108.232 -82.244 88.548 43.960 88.413 -71.967 88.792 46.752 113.148 -78.110 89.570 51.654 122.801-102.444 87.550 52.785 138.698-131.915 87.778 176.767 86.603 -98.194 109.513 51.638 143.913-157.540 93.241 58.276 94.705-122.463 93.189 59.114 104.503 -84.434 94.853-109.626 128.073 -84.596 101.813-116.147 139.700-151.181 92.946 49.814 141.768 159.345 92.569 45.811 134.014 -86.341 90.343 49.090 120.851 -52.209 90.404 53.956 108.346 -36.927 89.757 46.121 109.224 -81.937 90.444 43.283 0.000 0.000 89.865 56.605 109.065 -82.433 87.081 49.528 139.655 -74.889 88.953 43.893 122.565-128.235 90.083 47.502 107.159 -75.136 89.912 47.182 134.775 -76.813 93.073 43.615 137.682-140.540 93.610 41.190 143.203-130.786 97.288 36.365 115.428 -89.203 136.813-177.491 106.662 -95.221 95.827 44.820 115.269 -77.383 92.133 49.131 101.246 -8.292 89.599 50.756 119.853 -9.214 90.352 48.315 129.560 -76.686 89.581 42.071 103.925 -83.705 91.228 45.564 121.224 -30.520 91.103 45.055 138.020 -56.382 91.449 42.241 128.566 -76.896 90.437 47.686 111.065 -60.088 91.252 46.341 128.081 -76.275 91.220 43.618 141.751-158.833 91.001 45.262 130.412 -48.513 91.273 51.887 133.386-107.787 90.496 43.105 132.824-136.847 95.725 70.808 104.337 -80.753 92.506 0.000 129.037 -76.657 # 236 total E -1.49121E+02 rmsd from N 0.000 %NC 0.00 116.653 118.791 149.889 -63.881 94.256 48.733 115.166 -30.411 92.954 46.992 105.239 -81.370 92.707 45.659 128.118 -75.786 90.240 54.974 104.920 -60.001 91.512 33.173 92.875 -71.585 93.373 56.447 109.795 -70.829 94.288 28.027 117.883 -89.530 98.152-120.273 129.806 -82.144 84.454 -63.568 79.565 -70.681 92.047 -52.008 155.693 145.805 98.430 -48.549 104.538-118.083 99.614 165.664 102.070 -84.277 121.841 -79.001 153.870-113.538 101.333-118.676 137.807-149.722 93.661 46.368 145.372 150.061 92.297 46.712 134.117 -85.757 90.673 48.552 131.877 -54.989 90.917 49.822 127.467 -39.893 89.217 45.694 109.830 -82.289 89.930 46.703 0.000 0.000 88.929 55.675 132.469 -90.596 88.443 41.110 127.731-107.562 90.087 47.653 118.171-124.637 88.657 59.109 109.586 -78.405 88.401 52.735 134.096 -95.324 90.759 39.460 133.874-143.541 97.410 -97.975 143.976-126.842 121.316-171.813 163.198-157.235 133.221-146.660 111.091-106.054 97.660 41.657 114.579 -77.699 91.534 49.697 97.098 -14.210 89.668 55.816 121.456 3.263 89.269 50.420 129.667 -77.105 87.837 45.521 102.126 -81.324 88.825 55.844 141.709 -39.093 87.616 55.680 161.549-115.903 88.133 41.669 128.110 -76.489 89.249 50.893 116.299 -42.998 89.741 47.980 129.195 -76.807 89.804 47.590 137.933-120.507 89.845 48.910 127.685 -40.211 90.078 52.612 136.137 -81.088 90.344 44.175 138.526-131.292 95.230 74.951 104.138 -80.839 92.527 0.000 128.818 -76.664 # 237 total E -1.53454E+02 rmsd from N 0.000 %NC 0.00 93.173 164.263 139.665 -95.568 93.251 55.535 141.925 30.091 92.364 45.136 106.353 -82.567 91.872 47.765 131.340 -77.430 94.048 44.820 145.588-121.123 90.929 42.656 59.191 -75.006 90.517 46.983 124.519 -39.999 91.293 45.033 127.412-104.382 88.521 47.149 142.173-150.486 88.722 52.345 77.507-102.734 91.045 137.937 135.505 -81.583 89.380 83.338 103.544-130.368 93.256 99.838 96.470 -84.322 93.491 -67.278 132.419 -78.434 98.527-118.721 136.529-139.741 90.174 54.139 135.763 122.616 91.523 47.405 134.464 -85.535 90.287 46.408 149.706 -16.939 90.662 48.101 139.990 -21.858 89.514 47.905 142.408-154.644 89.272 47.078 0.000 0.000 89.195 53.397 113.858 -78.536 88.091 44.886 141.397 -85.322 89.399 46.728 119.868-127.627 87.991 56.093 111.520 -78.455 88.636 55.085 144.977-113.100 88.433 40.318 120.391-146.972 96.270-114.452 105.140 -82.911 112.721 173.993 157.948-144.529 98.347 -65.050 92.946 -98.700 89.561 -50.402 110.621 -75.918 89.281 -52.897 122.861 -29.842 89.629 -48.556 111.950 -73.153 90.857 -40.945 127.199 -75.715 89.479 -46.956 102.365 -79.152 89.289 -54.981 142.352 -42.102 88.003 -45.289 142.109 -91.443 90.749 -44.478 127.617 -76.198 88.450 -50.795 121.373 -21.842 89.621 -53.206 128.301 -76.098 88.885 -41.900 144.803-148.643 89.919 -48.177 126.304 -17.068 90.521 -53.091 150.611 -21.356 91.050 -44.019 143.473-166.107 96.196 92.957 104.759 -79.724 92.487 0.000 128.998 -76.340 # 238 total E -1.47128E+02 rmsd from N 0.000 %NC 0.00 93.226 167.922 141.023-102.083 93.321 53.942 141.482 48.267 92.121 43.094 106.386 -82.866 91.548 49.984 130.540 -77.077 93.159 47.523 150.836-135.521 93.164 40.742 63.734 -80.054 90.070 47.819 122.827 -48.123 89.490 76.468 127.889-107.124 86.822 60.588 125.470-125.176 85.874 169.676 83.113 -96.166 95.836 59.471 150.410-158.917 95.238 38.592 93.262-121.493 93.016 45.730 102.350 -80.545 92.337 55.608 145.820 -36.513 88.711 51.038 138.458-140.066 91.352 34.477 127.745-116.775 98.455-124.488 124.287 -70.875 138.644 172.557 114.888 55.361 100.929-168.033 148.427 -72.659 123.535 27.979 111.336 -83.155 94.359 48.538 0.000 0.000 92.756 44.505 144.379 -11.668 90.005 53.477 147.977 -80.028 89.232 46.075 121.755-135.526 89.129 47.761 108.039 -70.741 91.343 44.512 139.274 -55.653 92.683 49.388 140.109-147.370 94.094 -87.444 149.847 -27.224 124.617-176.496 155.054 -16.249 96.353-131.760 98.102-105.023 95.578 41.693 124.394 43.136 91.244 49.115 99.810 -15.143 91.334 48.737 110.416 24.997 90.630 45.864 129.974 -76.748 90.108 41.620 138.956-142.326 91.313 47.839 138.361 -26.047 90.730 46.362 147.528 -40.944 90.316 40.566 128.419 -76.931 88.836 57.479 117.532 -51.153 90.659 45.967 127.163 -75.732 90.871 45.187 143.151-141.923 92.164 47.527 128.368 -42.763 94.469-139.263 129.294 -74.147 94.922 34.986 138.349-143.782 122.844 159.054 106.287 -77.337 92.709 0.000 129.453 -76.219 # 239 total E -1.52080E+02 rmsd from N 0.000 %NC 0.00 93.037 157.667 138.524 -89.798 93.698 55.325 143.674 37.313 92.597 46.999 108.231 -75.712 92.435 43.207 131.658 -77.813 96.623 43.195 144.836-118.075 93.305 38.372 50.692 -75.876 92.425 45.673 162.563 139.968 92.008 44.022 139.077 -93.161 90.855 40.539 147.320-156.150 92.537 60.480 83.622-110.960 91.830 -41.993 140.075-110.785 125.273 -96.816 112.003-110.666 106.386-157.658 142.973 175.942 124.291 -91.847 146.183-134.623 97.875-119.085 136.490-145.157 93.710 44.670 141.107 141.434 92.050 46.477 134.643 -85.513 89.985 51.476 114.646 -20.846 90.161 51.832 122.304 -31.934 89.336 42.964 153.960 -15.832 89.571 48.849 0.000 0.000 88.719 55.305 130.304 -36.823 87.680 50.186 143.323 -88.123 88.944 45.573 121.699-132.812 88.141 54.677 107.279 -72.882 89.023 51.030 133.384 -49.844 90.690 44.933 136.227-126.916 91.923 40.676 142.134-128.413 97.334 136.089 111.672 -80.806 120.594 157.499 129.087-138.562 94.446 -14.666 113.957 -77.535 101.200-138.602 135.696 -4.906 92.249 52.151 144.924 -41.537 92.882 46.445 128.973 -76.212 92.800 42.399 105.830 -81.731 92.188 46.478 123.088 -76.336 91.703 54.934 126.972 -75.339 91.068 65.617 130.177 -77.755 90.903-175.947 96.318-109.511 92.698 57.100 131.172 -76.841 90.831 50.371 141.243-108.028 91.565 61.954 125.187 -23.180 91.781-109.939 141.710-108.646 97.021 -22.902 103.917 -87.530 104.959-118.636 101.601 -69.429 92.921 0.000 129.520 -76.278 # 240 total E -1.46917E+02 rmsd from N 0.000 %NC 0.00 93.289 -72.802 128.253 -79.804 94.338 -50.753 114.467 -74.183 92.165 -49.192 145.440 -26.702 91.839 -44.473 129.641 -76.642 94.161 142.055 145.009-156.580 109.065 40.607 142.660 169.432 89.888 46.962 126.457 -41.243 93.781 44.049 129.884-102.262 89.205 48.712 147.221-116.932 88.866 49.748 81.835-108.128 92.092 57.385 132.718 -88.708 99.700 -91.494 100.152 -97.390 119.638 171.465 104.921 -86.113 149.557-138.315 172.164-176.878 103.060-123.112 137.455-152.712 96.514 45.786 141.376 149.605 92.557 46.680 134.593 -85.919 90.758 49.981 120.499 -60.928 91.775 53.034 109.786 -34.769 92.260 40.465 107.945 -82.287 90.586 47.115 0.000 0.000 90.510 63.480 98.639 -81.353 87.255 53.136 142.851 -63.938 89.562 39.433 118.335-126.054 91.304 48.367 110.123 -75.834 90.579 52.143 148.410-102.504 90.729 49.342 140.911-103.605 90.203 34.846 141.346-128.535 99.897 138.004 111.940 -87.116 114.251 147.978 131.687-146.073 107.997 -6.327 117.032 -78.824 96.665-138.708 140.059-148.222 99.102 45.380 113.083 -73.522 92.921 43.320 130.223 -77.393 92.845 43.272 102.676 -81.616 92.103 52.619 131.941 -35.430 90.321 47.026 131.221 -86.390 91.387 35.375 128.847 -77.447 96.366 109.567 108.980 -96.100 89.792 -67.830 130.414 -77.749 92.419 -42.529 145.209-126.368 90.890 -43.118 123.413 -9.825 92.608 -56.201 151.565 -36.123 90.436 -50.695 140.140-156.123 94.207 82.221 102.516 -80.150 92.428 0.000 129.141 -76.290 # 241 total E -1.48164E+02 rmsd from N 0.000 %NC 0.00 92.989 -54.131 127.518 -80.938 92.458 -49.278 113.365 -77.779 90.409 -48.063 103.597 -77.471 91.684 -40.931 129.713 -76.071 94.185 -39.604 141.364-123.476 95.643 -41.411 62.564 -58.593 91.144 -41.977 133.591 -3.781 98.099 -43.120 167.729 166.223 92.510 -65.736 121.330-115.878 91.988-110.614 137.711 -3.084 105.616 79.455 144.984-178.933 94.194 49.661 92.384-119.677 93.507 85.911 106.649 -80.040 94.424 138.351 151.671 -31.975 105.532-102.440 137.662-167.261 97.087 45.047 139.085 148.753 92.167 45.177 136.781 -88.193 89.941 67.805 130.539 -82.788 90.643 53.089 133.285 -35.363 90.757 38.248 142.347-173.988 90.747 48.411 0.000 0.000 90.756 53.978 103.833 -84.203 88.156 46.584 149.112 -74.861 90.658 40.222 117.572-128.843 90.472 50.452 111.259 -77.024 89.305 55.051 139.959-100.639 90.050 40.495 140.362-130.112 92.915 44.283 113.044 -89.449 95.618 21.580 139.824 -92.817 125.773 156.548 113.161-111.999 95.942 38.590 115.232 -78.022 95.502 120.399 134.354-109.520 91.351 -49.128 111.753 -72.292 90.613 -51.209 126.967 -75.811 88.979 -42.558 100.766 -80.407 90.171 -47.204 124.696 -17.003 92.513 -36.732 153.236 -23.149 93.314 -51.387 128.884 -76.589 91.381 -48.851 127.038 16.474 92.059 117.224 129.651 -76.822 93.682 43.384 142.155-116.883 91.459 48.292 152.154 40.456 90.700 50.665 147.515 -91.435 92.622 43.933 130.917-127.794 97.205 60.544 104.957 -81.438 92.457 0.000 129.274 -76.372 # 242 total E -1.46696E+02 rmsd from N 0.000 %NC 0.00 92.981 156.911 137.179 -85.477 93.503 57.349 135.929 54.145 92.386 43.038 106.143 -82.144 91.993 49.631 130.311 -76.680 91.436 45.988 158.368-166.184 92.216 40.830 63.340 -72.486 93.235 42.332 123.579 -39.468 92.826 41.205 137.980-102.944 92.394 50.103 138.364 147.812 89.183 67.834 89.345-103.167 92.814 -70.961 131.763-100.011 108.841 -76.525 92.921 -84.530 97.474-145.607 108.620 -79.411 94.845 -64.452 142.724-113.328 91.598-122.113 150.246 -38.112 91.845 44.937 163.322 -67.454 92.806 48.151 136.987 -76.412 92.174 42.023 115.329 -36.597 91.786 48.540 86.534 -45.680 87.657 50.583 155.824 -18.670 88.706 50.590 0.000 0.000 89.557 43.922 111.804 -75.412 93.154 39.112 135.945 -77.360 92.737 47.207 127.133-122.507 91.655 82.388 112.410 -79.078 84.860 -89.089 134.587-112.368 93.716 -47.494 143.911-138.442 92.272 -45.553 149.929 -22.066 98.084 178.901 158.582 -6.762 128.755 -92.211 114.277-114.955 115.682 22.427 117.119 -80.075 93.028 48.684 131.952 -97.991 88.682 62.762 116.664 -79.288 88.002 65.692 129.354 -77.948 82.894 56.326 101.103 -83.447 89.025 51.038 109.225 -59.788 90.217 41.114 131.990 -59.230 95.052 91.577 129.291 -76.472 95.195-161.394 123.871 -98.615 92.783 56.313 130.201 -76.483 91.562 42.304 140.467-105.115 90.414 48.466 129.868 -2.281 90.946 55.254 140.662-128.506 88.992 41.827 129.311-171.887 93.533 90.596 103.463 -80.620 92.605 0.000 128.614 -76.931 # 243 total E -1.47614E+02 rmsd from N 0.000 %NC 0.00 93.287 -75.415 128.253 -79.882 93.476 -49.305 117.085 -79.341 91.011 -46.897 103.686 -77.284 90.890 -45.895 128.649 -75.522 91.311 -40.296 141.677-133.882 93.511 -43.293 60.675 -54.653 90.647 -41.468 132.346 31.111 97.904 -42.442 164.804-174.789 89.022 -54.935 124.198-128.006 88.515 -84.832 139.726 -12.696 88.817 112.648 141.997-163.216 112.264 28.639 87.227-111.468 99.990 126.437 116.354 -84.082 121.530-110.116 152.988-139.026 92.520-125.789 137.066-136.828 95.393 42.878 140.788 134.318 95.521 42.456 135.020 -84.392 93.776 40.317 148.120 -15.326 92.510 52.594 126.293 138.645 90.713 44.367 108.896 -83.291 92.834 37.753 0.000 0.000 90.679 52.319 149.693-159.206 89.408 48.016 116.137-114.784 90.527 42.863 120.810-124.019 89.814 48.106 116.194 -76.053 90.756 47.134 133.574-103.695 92.818 51.430 130.104-140.681 94.119 -90.585 152.729 -30.877 118.051 169.944 114.864 -75.816 131.905-178.282 113.468-110.547 96.430 45.195 115.294 -77.380 92.578 46.770 107.516 -25.718 91.269 47.600 119.870 -25.640 90.551 47.636 130.874 -77.467 91.010 43.675 101.554 -83.562 90.032 46.809 118.537 -54.720 90.652 64.314 132.437 -59.351 88.881 58.900 129.509 -77.119 86.733-179.570 71.560 -84.329 92.268 60.227 133.997 -78.993 90.410 51.801 141.323-106.942 91.167 51.850 122.146 -24.353 92.772-122.570 135.499 -55.938 96.056 -0.675 136.076-137.299 116.475-122.406 97.460 -66.744 92.945 0.000 129.469 -76.156 # 244 total E -1.47958E+02 rmsd from N 0.000 %NC 0.00 93.152 166.016 138.012 -90.122 92.507 57.530 143.413 38.341 92.454 45.477 106.599 -82.737 92.290 45.996 131.269 -77.576 94.850 42.508 148.380-126.014 92.258 44.741 57.008 -74.069 89.984 46.562 125.827 -38.246 91.201 48.079 119.705-105.557 87.461 45.263 133.629-122.460 92.254 74.711 83.181 -99.535 92.335-161.976 143.670 -94.008 94.399 66.472 95.148-117.308 93.076 43.311 102.746 -78.924 90.921 53.747 149.136 -42.299 89.729 45.472 130.536-140.875 92.686 55.233 121.561-118.381 94.151 -31.391 123.754 -56.420 127.024-174.535 113.633 -17.654 112.764 22.582 148.808 -10.584 99.867 37.369 110.278 -82.062 101.189 32.414 0.000 0.000 95.339 44.518 148.739 -10.016 90.581 48.940 140.241-107.930 89.355 57.195 126.004-167.625 85.569 60.144 111.173 -73.035 87.964 51.371 138.904 -87.666 90.819 46.124 132.986 -59.186 94.196 -97.358 141.923-120.624 120.506-176.338 153.071 -16.221 130.262-156.526 112.543-108.645 94.470 45.116 114.844 -77.131 90.999 50.601 96.366 -20.002 90.768 50.193 111.744 8.989 90.176 44.342 130.191 -76.674 90.176 43.404 138.516-141.990 90.239 50.143 132.822 -30.981 89.006 49.163 144.052 -45.068 89.119 42.688 128.370 -76.822 88.856 53.273 117.406 -46.933 89.987 45.596 127.519 -76.052 91.209 45.357 142.865-118.939 91.744 53.382 128.391 -40.378 91.177 37.859 131.299 -75.433 100.029-111.421 111.552 -88.217 117.813 -61.905 150.299 -19.081 92.622 0.000 129.402 -76.303 # 245 total E -1.46737E+02 rmsd from N 0.000 %NC 0.00 93.330 165.930 141.427-103.010 93.744 52.591 136.133 27.616 91.713 46.373 106.113 -81.950 91.571 47.780 130.967 -77.323 93.562 46.392 142.181-122.381 91.521 42.277 57.576 -71.784 90.811 46.055 127.276 -30.886 91.046 47.091 127.378-110.094 88.634 47.766 133.441-130.949 93.072 90.712 82.527-100.707 89.978 -73.701 146.618-102.791 98.373 -45.118 93.976 -93.976 90.720 -47.230 108.492 -77.963 94.444 -40.675 142.583-171.518 94.398 -60.461 133.891-168.245 95.195 42.285 128.984-135.818 132.314 -80.032 151.752 -64.478 133.243 -71.446 134.442 28.689 111.576 39.687 168.300-176.085 97.314 38.289 107.605 -82.935 94.055 42.055 0.000 0.000 92.344 50.734 107.324 -85.746 90.008 44.922 141.795 -82.776 91.627 40.375 117.390-123.179 90.781 49.869 110.361 -76.672 90.594 52.511 132.687 -89.227 91.084 43.390 134.895-122.767 93.315 31.409 116.815 -91.106 108.489 -10.277 119.162 -87.282 138.507-161.427 105.402 -89.893 92.299 71.346 142.400 174.582 93.183 121.868 114.717 -90.291 93.507 -39.988 111.151 -72.933 91.931 -51.459 126.644 -75.327 90.190 -39.502 101.344 -80.072 91.397 -46.240 145.903 -36.633 90.558 -48.156 156.361-130.423 90.813 -48.697 129.596 -78.084 90.940-145.677 134.138 14.907 91.788 49.820 131.509 -77.925 91.109 48.273 142.353-133.441 91.099 50.127 134.163 -59.444 93.502-176.812 130.337 -65.229 95.760 45.098 138.447-151.296 114.666 14.929 103.879 -79.739 92.415 0.000 129.398 -75.854 # 246 total E -1.47263E+02 rmsd from N 0.000 %NC 0.00 93.070 152.936 140.445 -95.892 93.475 51.906 151.877 98.303 92.117 47.511 144.839 -24.810 90.863 47.973 129.373 -75.894 90.755 44.688 155.783-150.172 93.634 41.691 127.137 160.391 91.293 43.271 122.971 -34.024 93.962 43.423 132.832 -98.125 88.610 51.357 149.224-164.169 88.241 61.054 77.416-110.321 91.997 42.173 131.958 -84.119 101.433-114.045 104.723 -92.060 117.557 173.673 110.768 -85.594 141.089-109.263 162.124-160.898 105.761-120.529 137.776-152.673 96.058 43.993 149.372 154.353 93.057 45.656 134.551 -84.881 91.070 48.726 129.652 -61.428 91.681 52.304 122.840 -41.590 91.298 41.796 108.590 -82.671 90.564 45.503 0.000 0.000 89.766 61.580 106.374 -85.199 87.324 48.817 137.663 -82.608 90.253 40.881 118.392-122.766 90.367 51.763 110.537 -76.432 90.095 52.202 136.829 -95.264 91.594 53.251 130.568-116.947 93.461 -1.929 142.594-130.697 124.099 144.230 109.654 -78.655 134.523-159.580 117.042-110.750 99.455 -20.145 113.742 -77.863 94.645-133.186 120.101 -7.478 94.592 46.885 112.886 -72.648 92.075 50.300 132.840 -78.075 89.659 39.653 104.114 -80.811 92.528 42.146 104.974 -61.159 91.867 53.249 140.540 -32.595 90.648 33.676 130.023 -78.133 93.988 102.371 91.210 -92.619 94.751 -28.207 129.886 -78.073 97.856 -63.372 141.808-120.254 92.508 -8.634 126.480 -19.486 114.283 34.650 159.954 -8.181 140.117-162.923 176.440 169.793 94.858 65.748 105.002 -90.334 92.533 0.000 128.900 -76.853 # 247 total E -1.47632E+02 rmsd from N 0.000 %NC 0.00 93.148 164.556 139.956 -95.156 93.391 55.621 137.757 35.324 92.229 44.316 106.221 -82.387 91.704 48.768 131.508 -77.460 92.518 44.349 149.180-129.769 90.959 44.135 58.901 -70.728 90.041 46.932 127.900 -35.566 88.856 50.023 127.227-107.270 87.408 47.360 135.313-134.409 91.482 85.464 82.487-102.609 90.484 -55.157 150.503-109.429 102.515 -72.382 93.965 -96.296 85.982 -70.906 143.770 4.507 91.784 -41.731 146.482 152.158 94.716 -57.068 128.757-175.593 94.717 61.910 137.749-107.789 127.173-119.259 149.913 -50.681 123.753 56.319 142.835 32.728 111.933 144.155 138.534 142.072 134.492 -72.040 113.743 -84.397 96.099 46.866 0.000 0.000 93.005 46.545 121.172 -82.299 89.837 47.188 146.960 -90.421 89.876 46.097 116.190-129.737 87.986 54.331 115.358 -77.263 89.264 53.035 142.359-117.313 89.235 44.758 122.113-155.711 94.737-121.706 104.739 -82.461 108.189 173.883 154.505-136.845 96.589 -61.864 93.921-102.497 90.117 -47.523 110.118 -76.373 88.969 -53.958 120.286 -29.919 88.662 -51.139 115.140 -73.454 91.340 -39.036 127.390 -76.064 90.142 -46.340 99.042 -78.402 87.225 -67.331 142.010 -42.860 86.035 -51.531 146.008 -99.748 91.111 -37.940 127.819 -76.211 91.510 -47.506 118.624 -37.005 90.242 -53.576 130.690 -77.582 88.745 -47.305 149.479-128.579 88.841 -52.515 126.144 -9.623 93.392 110.499 149.085 -20.733 104.896 35.954 144.241-162.330 97.166 40.957 106.130 -71.862 92.255 0.000 129.735 -75.687 # 248 total E -1.47756E+02 rmsd from N 0.000 %NC 0.00 120.818 -46.576 149.126 -78.211 99.213-124.634 125.316 -55.349 93.308 46.330 107.699 -80.940 94.144 47.385 127.623 -75.040 93.314 42.161 134.649 -15.637 93.946 40.467 83.425 -91.068 92.721 60.082 105.891 -69.944 91.918 24.381 127.671 -86.279 105.426-110.227 147.823 -98.310 97.598-150.468 76.516 -79.321 94.443 55.721 156.997-163.820 93.271 44.184 95.855-123.584 92.773 44.581 151.366 -24.006 92.253 46.363 137.123 -32.389 93.903 35.195 110.149 -94.959 96.266 47.765 129.575-107.738 95.232 25.469 105.487 -54.659 106.708-174.072 137.049 -19.714 121.563 3.303 105.750 153.660 119.534 40.011 147.636-165.054 101.585 31.781 0.000 0.000 93.701 49.499 144.657 -6.642 90.313 56.063 140.638 -99.691 89.099 45.180 119.856-131.182 89.241 48.947 110.727 -70.112 90.713 42.342 138.616 -55.129 93.845 57.462 134.845-131.294 93.716 -68.937 106.877 -86.649 116.317 -81.357 161.189-147.422 117.729-117.692 126.096-137.391 98.436 -29.316 113.996 -79.518 94.578-121.575 124.002 -21.948 92.871 47.752 134.025 7.297 92.646 50.750 129.430 -75.928 91.142 39.799 103.104 -77.983 91.115 50.609 122.641 -33.718 89.605 46.275 139.227 -55.533 91.410 41.575 128.436 -76.797 90.509 47.998 114.943 -67.700 90.047 53.038 130.581 -77.568 88.467 46.767 150.233-128.510 88.978 46.389 130.694 -44.671 90.246 54.703 137.376 -46.986 89.360 44.085 140.708-127.965 94.539 82.563 103.716 -80.568 92.538 0.000 128.864 -76.712 # 249 total E -1.55901E+02 rmsd from N 0.000 %NC 0.00 92.925 161.250 133.343 -74.399 93.430 62.472 139.998 55.201 94.091 43.008 106.125 -81.113 92.497 43.630 131.143 -77.587 94.675 47.267 151.979-145.777 93.401 42.834 56.265 -71.919 90.886 45.748 131.414 -28.695 91.461 45.797 121.425-114.553 89.346 50.249 142.280-153.242 89.961 73.361 83.190-104.999 91.373 -71.482 134.828 -95.649 106.246 -68.078 89.587 -78.604 91.644 -67.475 151.041 -19.189 117.875-160.448 153.945-170.530 110.323-108.141 149.544-157.474 94.620 45.103 144.146 149.130 92.121 45.995 135.641 -84.234 90.484 49.308 119.187 -65.926 91.391 51.278 134.918 -41.096 91.754 41.110 143.050-161.598 91.013 44.399 0.000 0.000 90.687 59.053 103.082 -82.758 88.068 49.525 145.955 -77.730 90.837 38.803 117.125-126.374 91.812 50.393 109.775 -76.001 90.750 71.850 145.511 -95.758 90.277 40.111 142.105-131.154 93.483 44.489 143.435-130.747 100.976 -10.402 141.632-106.375 129.832-162.487 117.683-118.099 97.940 57.601 127.751 155.103 91.906 48.138 119.914 -33.476 88.832 57.406 115.201 -68.028 91.358 44.038 128.141 -76.268 91.472 41.766 104.674 -85.344 92.394 45.536 121.821 -77.143 90.925 60.477 129.563 -78.754 88.279 53.777 130.334 -78.512 90.471-179.500 74.778 -89.683 92.262 65.330 133.217 -78.270 91.488 44.017 140.199-100.070 90.196 52.896 120.086 -24.902 91.958 87.260 139.215 -50.501 87.467 51.082 140.353-157.276 95.168 91.069 100.881 -79.195 92.439 0.000 129.106 -76.102 # 250 total E -1.48523E+02 rmsd from N 0.000 %NC 0.00 93.117 147.984 144.944-111.212 94.113 50.973 133.356 21.500 91.000 47.511 106.095 -82.371 91.369 49.201 129.513 -76.627 92.591 47.802 140.018-121.275 91.557 39.996 59.778 -71.582 92.205 44.868 125.411 -26.778 90.989 46.174 136.980-105.120 89.701 50.613 142.035-161.361 93.106 89.279 82.044-104.339 91.270 -69.766 140.142-100.120 94.891 -46.531 93.999 -89.307 88.003 -58.042 149.438 -7.534 93.693 -45.464 135.597-104.611 92.167 -44.914 125.316-163.893 98.752 -34.101 136.791-114.577 119.781 99.931 149.997 -47.196 94.341 40.120 108.713 -45.219 92.995 57.483 164.664 125.573 91.192 44.883 154.880 -32.113 90.898 42.460 0.000 0.000 89.615 52.680 132.695-121.430 88.180 47.639 117.762-122.430 88.455 54.639 120.288-138.770 86.024 58.773 107.500 -75.585 89.393 49.558 131.425 -84.079 90.331 46.141 138.619-151.219 95.323 -82.026 104.820 -83.763 126.870 150.580 152.085 -14.724 133.163-169.548 110.005-102.905 95.542 48.625 115.300 -77.262 91.673 49.390 100.610 -4.899 90.699 47.941 122.339 -1.814 90.320 46.192 130.659 -77.247 89.033 45.290 138.209-144.186 88.784 53.001 119.351 -18.222 87.748 51.161 143.912 -43.376 88.060 46.742 128.497 -77.057 86.850 61.530 114.844 -29.791 88.582 47.754 126.737 -75.363 90.279 49.394 136.964-146.435 90.381 61.213 132.703 -48.437 90.133-130.264 125.685 -62.047 95.480 26.291 138.048-140.041 118.831-139.069 109.899 -75.360 93.003 0.000 129.306 -76.689 # 251 total E -1.47095E+02 rmsd from N 0.000 %NC 0.00 93.116 -74.718 124.872 -70.216 94.042 -52.693 118.010 -75.634 92.346 -44.032 103.402 -77.285 91.368 -46.050 128.210 -75.695 90.370 -42.306 144.305-137.553 92.215 -44.066 61.101 -55.069 90.338 -46.730 131.398 25.401 96.143 -37.365 166.770 159.731 91.671 -64.408 121.798-117.330 87.300 -87.908 136.050 -8.925 90.302 124.229 138.860 166.642 96.582 3.323 91.982-116.838 113.782 122.427 108.066 -81.662 111.614-117.530 151.623 -26.506 98.962-119.250 135.609-150.765 92.262 48.844 139.000 120.664 91.769 45.924 133.254 -86.132 90.592 47.665 140.375 -65.363 91.574 49.350 115.890 -13.549 89.973 43.918 107.792 -82.061 89.557 51.705 0.000 0.000 90.816 48.213 145.036-139.308 91.321 41.649 171.174 179.980 91.388 41.492 109.186-138.059 92.125 49.442 116.228 -78.579 90.409 48.530 147.964-125.714 91.628 44.801 142.573-150.693 94.677-129.490 105.203 -82.701 99.166 179.315 150.455 -17.514 95.629 -56.405 94.697 -99.099 90.432 -46.934 111.108 -76.249 90.231 -46.901 121.498 -16.861 91.010 -47.774 120.072 -75.493 91.707 -42.076 128.235 -76.333 90.355 -45.847 102.575 -82.593 93.760 -81.220 147.121 -15.304 114.829-118.634 162.318 -21.184 92.746 42.448 128.719 -76.212 90.702 51.780 114.352-106.279 89.591 61.027 130.770 -77.388 88.225 48.054 141.869-101.294 90.916 73.476 130.887 -41.851 90.102 -85.431 135.573 -55.504 99.430 -36.354 108.832 -80.127 115.769 118.433 142.092 -20.750 92.584 0.000 129.464 -76.434 # 252 total E -1.49232E+02 rmsd from N 0.000 %NC 0.00 118.162 104.124 147.035 -42.484 94.842 47.082 123.615 -57.856 90.658 50.840 112.889 -81.371 89.889 49.003 127.890 -75.818 89.268 50.781 100.346 -59.111 92.852 34.672 107.625 -68.393 94.746 38.054 151.399 154.247 102.102 25.805 102.453 -74.284 94.185 49.205 143.300 -39.369 99.214 21.489 77.458-100.582 96.367 58.915 153.497-167.766 96.455 -14.940 87.685-110.778 114.875 170.752 107.995 -82.629 120.202-168.572 162.968 175.046 102.121-111.679 138.957-148.229 91.975 50.335 137.464 135.917 92.063 45.810 133.630 -85.335 90.808 47.279 123.498 -40.423 90.650 48.938 123.264 -25.261 88.362 48.917 109.071 -82.296 90.061 47.164 0.000 0.000 91.090 43.220 112.938 -76.465 92.132 42.812 143.497 -79.093 92.361 43.183 119.639-124.483 90.382 47.938 111.889 -77.850 91.115 45.607 130.203 -93.553 93.179 48.071 135.860-139.345 93.853 27.708 107.991 -86.461 109.306 54.654 149.043 -21.492 136.745-179.528 109.788-100.096 95.490 43.602 115.052 -77.527 91.753 49.331 103.972 -7.141 88.749 53.000 133.740 -6.550 90.144 46.167 128.800 -77.053 89.787 42.992 104.593 -84.127 89.714 51.258 122.049 -27.398 89.054 50.760 136.541 -56.236 89.007 42.811 128.295 -76.605 89.445 67.774 115.624-107.108 91.193 168.012 128.276 -76.382 89.660 65.354 142.350-113.143 89.771 55.336 136.686 -68.798 90.808 53.976 145.920 -23.054 89.376 38.752 145.237-149.237 96.342 77.979 101.718 -79.537 92.559 0.000 128.962 -76.295 # 253 total E -1.47232E+02 rmsd from N 0.000 %NC 0.00 92.991 -51.404 129.055 -87.919 101.023-115.620 120.266 -52.263 94.258 40.788 108.332 -82.303 93.030 51.318 128.758 -75.278 92.751 41.984 144.763 -9.540 91.905 45.873 65.234 -79.980 89.553 45.744 120.257 -50.710 89.224 51.319 128.193-100.437 88.157 62.402 140.280 -36.799 83.998 176.417 82.013 -97.903 92.871 68.277 137.756-152.044 94.952 48.398 92.212-120.852 92.347 51.134 108.433 -83.289 93.278 133.738 132.360 -85.232 117.391 32.935 144.927-171.356 113.680 6.547 154.014-145.057 94.642 52.835 135.293 -80.240 91.394 49.756 145.445 62.361 91.048 46.186 164.676 117.003 91.586 38.921 153.700 -25.835 93.287 45.270 0.000 0.000 89.812 49.323 141.655 -32.776 89.523 46.659 132.440-103.286 89.351 52.195 122.301-130.202 87.163 58.139 108.467 -73.885 89.355 53.918 128.529 -77.343 90.651 37.389 140.234-141.834 97.851-120.756 148.996 -26.642 109.780-176.067 152.336 -11.491 106.809-119.030 94.541 -90.514 93.573 51.785 114.386 -76.123 91.378 47.051 103.837 -15.651 90.592 49.080 126.315 -7.798 91.337 42.903 128.645 -76.624 90.329 44.460 100.799 -80.394 89.702 57.942 117.342 -31.085 89.278 44.817 136.460 -53.339 91.079 44.865 127.967 -76.119 93.070 54.423 115.139-105.543 92.256-120.032 130.927 -77.535 97.050 -19.800 140.250-118.944 98.532 -79.278 121.109 9.843 109.366-106.910 150.978 -26.976 92.004 16.200 134.459-131.665 110.900 36.659 101.990 -80.877 92.426 0.000 129.255 -76.216 # 254 total E -1.53263E+02 rmsd from N 0.000 %NC 0.00 92.578 73.464 134.765 -85.128 93.229 57.941 150.152 14.391 94.492 41.543 105.401 -81.082 93.187 45.638 130.617 -76.442 96.005 33.668 130.821-108.125 99.953 38.329 49.921 -72.289 95.387 39.861 125.514 -25.109 91.972 47.849 150.298 -99.443 88.906 46.420 129.742-134.777 90.170 47.178 76.447 -97.593 92.223 148.901 136.917 -69.579 92.792 94.910 135.642-163.287 87.786 111.089 102.201 -84.431 94.936 -32.123 120.164 -97.301 98.888-134.530 137.971-141.468 91.811 51.329 134.172 126.612 92.917 47.430 135.081 -83.419 92.488 40.127 117.303 -40.131 92.290 49.464 148.344 108.325 91.171 44.503 143.166-136.117 91.718 42.206 0.000 0.000 90.218 49.734 145.260-141.081 90.271 45.582 120.368-110.957 90.027 43.537 120.425-123.747 89.744 47.898 114.197 -79.246 90.943 49.618 138.016-108.086 91.772 46.737 128.073-150.950 94.283-102.106 142.047-121.888 111.904-173.030 151.555 -17.207 133.761 -55.818 110.040-103.378 105.832 -23.892 112.921 -78.926 93.360 -49.350 110.100 -54.950 92.389 -42.600 109.663 -70.028 91.882 -45.863 127.623 -76.540 91.097 -39.095 101.129 -81.238 90.323 -46.158 123.634 -22.319 91.233 -51.075 149.120 -37.974 89.039 -55.597 129.339 -77.254 89.543-129.805 135.803 16.572 90.184 53.372 132.509 -77.901 91.431 45.699 143.074-123.510 92.671 94.079 131.430 -45.293 90.937 -62.283 141.619 -59.248 97.844 -62.801 134.165-119.425 94.557 88.129 102.769 -78.634 92.490 0.000 129.036 -76.409 # 255 total E -1.50264E+02 rmsd from N 0.000 %NC 0.00 93.115 -74.711 122.580 -63.838 93.943 -53.658 116.417 -74.247 92.386 -42.835 103.983 -78.576 90.999 -46.937 129.058 -76.130 91.651 -39.388 134.944-122.333 91.882 -47.284 67.490 -66.133 89.757 -35.627 136.692 47.116 105.835 -41.191 164.139 -72.449 93.206 -20.710 128.039-108.230 113.547 178.629 80.361 -76.237 93.876 88.863 163.181-132.688 94.215 44.325 92.904-123.722 96.254 40.105 107.060 -85.627 96.168 132.605 143.200 -96.794 111.940 17.448 141.281-160.622 94.634 58.109 140.601-108.973 94.704 23.060 118.717 -90.223 103.507 104.997 143.684 163.417 94.569 47.003 102.088 171.460 95.674 37.142 108.266 -82.081 111.072 16.866 0.000 0.000 98.135 46.745 114.410 -86.620 91.009 46.300 150.448 -93.556 90.215 47.847 110.267-126.554 88.469 48.961 112.549 -75.070 90.505 50.065 139.059-100.299 90.732 47.027 131.669-149.294 93.746-102.710 104.074 -82.929 113.210-169.075 153.088 -18.937 95.485 -61.723 97.863-104.301 90.959 -50.275 110.403 -74.301 92.076 -66.133 102.416 -51.204 88.074 108.843 119.321 -76.906 94.268 44.473 128.660 -76.646 89.068 51.134 102.203 -75.712 88.935 79.626 140.062 -50.678 88.270 53.173 159.338-137.572 90.023 37.719 128.194 -76.319 90.611 52.496 115.287 -28.216 90.640 48.789 128.908 -76.541 90.643 45.122 141.569-154.927 92.821 75.072 131.426 -48.966 90.600 -87.825 134.591 -65.526 97.382 -34.832 105.120 -82.439 105.086 -90.654 144.897 -21.903 92.933 0.000 129.133 -76.818 # 256 total E -1.53303E+02 rmsd from N 0.000 %NC 0.00 93.148 -67.085 127.934 -79.329 94.330 -48.131 117.051 -79.149 90.763 -47.097 103.306 -77.381 90.437 -47.782 128.638 -75.958 91.038 -40.639 140.568-125.461 94.208 -41.797 62.626 -66.274 92.057 -38.370 131.714 -1.436 103.520 -32.121 168.941 145.343 95.694 -53.443 130.285-122.003 94.579-151.665 77.639 -82.864 94.920 57.538 158.204-179.723 95.709 39.221 93.254-123.129 93.849 46.073 140.115-136.859 93.750 98.725 135.838 -31.035 92.978 33.243 133.420-139.770 96.636 53.076 131.374-124.538 97.368 15.878 142.650 -81.681 106.215 146.331 162.917-179.603 105.425 39.781 121.417-173.157 97.443 47.955 108.522 -81.875 116.413 2.532 0.000 0.000 96.370 52.024 117.570 -84.156 92.376 42.235 141.627 -94.257 90.897 46.561 114.984-123.964 89.585 46.324 113.606 -76.964 91.125 48.872 138.986-103.414 91.290 46.558 130.611-148.819 93.562-106.598 103.727 -82.563 109.270-162.882 152.874 -20.088 94.179 -57.720 97.981-105.744 90.293 -50.431 110.547 -75.162 91.680 -64.720 106.020 -54.954 88.167 110.837 118.639 -76.930 94.598 44.498 128.334 -76.542 90.151 52.294 102.793 -77.720 90.216 88.407 137.718 -51.704 88.315 54.602 156.772-138.504 90.389 40.896 128.163 -76.281 90.967 49.014 118.990 -27.144 90.135 50.843 130.272 -76.404 90.364 43.386 137.130-119.532 90.944 47.781 128.787 -37.223 92.959 129.378 137.305 -53.703 92.747 70.260 140.210-178.174 94.125 105.210 97.680 -80.031 92.481 0.000 128.980 -76.181 # 257 total E -1.48587E+02 rmsd from N 0.000 %NC 0.00 92.905 152.207 139.669 -92.612 93.156 51.269 123.764 -32.252 93.869 45.016 105.341 -80.983 92.709 44.484 128.517 -75.188 91.626 44.770 104.741 -80.222 89.791 46.431 88.773 -65.789 88.224 48.841 117.245 -64.412 88.897 43.128 121.946-101.348 89.317 55.582 126.727-105.320 86.991 66.622 90.480-101.783 90.143 52.552 126.171 -92.844 102.760 -73.742 97.255 -91.344 114.531 157.883 108.082 -82.919 127.642-125.996 158.114-128.905 103.640-114.866 139.290-148.109 93.908 44.689 140.329 133.179 91.203 47.331 134.511 -85.403 89.940 53.324 124.793 -30.808 90.138 47.555 127.547 -27.076 91.214 40.978 153.671 -14.387 90.980 47.588 0.000 0.000 88.848 53.384 135.853 -36.457 88.425 49.764 141.461 -83.273 89.325 44.264 123.701-131.105 89.011 50.554 106.977 -73.568 89.809 50.100 134.190 -53.743 90.851 46.058 137.695-136.361 91.172 41.295 141.781-128.492 97.237 139.692 111.509 -83.111 115.318 171.384 132.147-146.143 99.071 -16.289 113.696 -78.302 95.000-125.468 118.067 -12.085 94.365 43.904 141.407 20.363 93.913 51.272 130.736 -76.233 93.899 32.389 103.100 -77.867 91.508 58.676 116.928 -31.322 88.417 59.806 133.023 -44.448 88.320 37.031 130.292 -77.678 92.157 95.338 110.734-107.120 93.088 -15.718 129.109 -76.564 101.571 -83.182 129.260-114.555 92.490-145.018 136.558 -64.088 129.624-144.545 164.432 -3.095 98.671 13.190 128.309-122.537 122.049 83.323 102.325 -78.382 92.558 0.000 129.633 -76.579 # 258 total E -1.50962E+02 rmsd from N 0.000 %NC 0.00 93.114 -67.850 125.597 -72.257 93.937 -49.441 110.368 -74.369 92.658 -40.636 103.401 -75.703 93.533 -40.125 129.277 -76.328 99.990 -21.715 136.489-110.475 105.802 -36.876 66.526 -71.267 93.666 -25.836 124.272 -44.572 109.157 -21.851 168.040-123.847 107.602 -76.478 121.956 -96.151 90.461 31.988 97.082 -98.670 119.959-164.327 135.075 -87.617 98.461 78.982 129.696-152.776 95.826-175.245 109.310 -83.179 124.932 176.042 152.508-155.137 117.574 -98.295 144.434-161.326 93.590 47.284 147.986 136.674 91.793 45.285 134.319 -85.393 90.502 50.245 126.718 -66.748 90.474 48.033 103.799 -24.489 90.930 41.901 106.574 -80.687 90.758 48.015 0.000 0.000 92.543 43.795 102.103 -84.386 89.178 48.284 157.656 -79.316 91.061 37.409 115.281-136.368 94.268 64.765 113.303 -78.814 91.750 -53.677 144.392-112.814 118.234 -71.774 125.639-149.564 94.472 -26.164 143.789-128.484 103.493-159.601 150.686 -14.475 117.014-137.078 111.872-116.384 92.980 41.826 113.882 -76.721 93.254 46.609 109.976 -38.011 92.819 43.478 128.104 10.600 92.238 41.787 130.179 -77.913 90.287 45.057 100.921 -82.451 88.814 61.589 138.039 -50.792 86.595 51.644 139.789 -51.043 88.497 43.209 128.364 -76.543 88.445 53.981 111.287 -35.483 89.089 49.065 128.495 -76.108 89.735 44.183 140.293-114.506 90.092 48.858 129.729 -42.013 90.025 52.892 136.207 -56.711 90.086 44.698 140.575-130.846 94.716 78.728 104.026 -80.629 92.529 0.000 128.923 -76.693 # 259 total E -1.49093E+02 rmsd from N 0.000 %NC 0.00 93.199 161.763 140.449 -97.948 93.227 54.446 152.555 -5.157 92.406 46.793 146.390 -27.800 90.900 49.039 129.730 -75.296 91.418 41.032 134.070-107.726 92.631 42.603 138.674 167.873 93.292 39.171 112.172 -59.083 94.746 42.812 141.172 -83.954 91.005 40.578 139.441-126.482 91.889 48.837 85.231-107.033 92.204 59.913 132.366 -92.856 96.111-100.142 98.909 -99.079 112.931-172.175 104.508 -82.726 138.728-144.725 171.347-166.507 101.968-111.323 136.547-148.018 92.137 50.015 140.782 137.160 92.002 46.603 135.120 -85.663 90.969 47.594 136.871 -59.814 90.721 46.537 124.223 -28.999 90.221 47.321 154.778 -27.186 90.580 46.349 0.000 0.000 89.527 48.947 139.262-109.718 89.768 45.561 139.654 -96.306 90.872 42.450 122.743-129.157 89.251 48.383 115.891 -78.387 91.176 46.707 132.104-106.345 91.972 56.957 131.855-150.951 91.945 -96.360 104.638 -84.977 109.200 144.515 154.675-137.388 101.814 -63.011 94.385-103.127 117.176 -64.507 114.998 -81.919 121.818 -96.832 117.125 49.535 97.616 46.772 112.805 -72.233 92.461 42.150 129.575 -77.010 93.034 43.475 103.587 -87.413 91.790 51.101 142.246 -27.516 89.677 44.621 130.952 -99.207 91.333 40.054 128.439 -77.161 94.540 94.776 115.918-103.153 87.163 -76.282 129.905 -77.741 91.351 -46.848 142.821-119.012 89.080 -46.967 120.608 5.507 92.348 -46.863 151.028 -32.089 92.609 -46.125 110.020 -84.105 95.169 105.391 105.879 -78.899 92.580 0.000 128.776 -76.617 # 260 total E -1.46443E+02 rmsd from N 0.000 %NC 0.00 93.194 -61.706 128.787 -83.512 94.210 -48.217 113.390 -73.664 91.113 -46.105 141.580 -32.471 90.966 -47.180 130.114 -76.678 92.761 -40.562 142.503-130.561 93.956 -44.820 65.298 -74.784 90.393 -43.296 133.357 30.423 111.531 -67.109 166.597 152.435 102.716 -17.284 121.576-107.354 104.716-137.790 83.678 -79.608 111.748 75.338 151.517 176.751 95.465 39.165 93.481-122.160 93.021 46.070 114.108 -89.703 90.241 58.496 146.957-141.613 89.234 50.903 131.000-114.805 91.271 50.887 128.817-107.922 96.566 -62.255 126.810 -65.722 127.510-159.015 135.996 -70.154 113.868 24.892 139.983 98.205 94.062 47.680 144.587-170.822 91.578 44.657 0.000 0.000 90.985 48.866 137.582 -24.033 89.214 47.617 149.168 -85.718 89.748 44.766 119.479-131.968 87.986 53.445 108.214 -73.055 90.605 46.813 138.040 -38.565 91.897 43.864 132.259-127.671 94.188 33.144 143.407-131.925 106.680-118.338 148.172-115.279 116.968 -47.921 115.779-123.337 94.354 103.389 104.377 11.145 92.068 47.530 129.692-119.126 96.790 38.598 111.187 -72.364 95.633 38.828 128.908 -75.364 92.370 43.882 139.551-145.613 92.696 42.361 96.467-118.523 91.826 45.420 124.607 -78.828 90.934 42.650 129.619 -77.684 90.201 48.229 105.337 -67.156 91.235 43.950 128.442 -76.424 91.872 46.617 135.753-118.685 91.795 50.336 128.325 -44.377 93.120-146.864 132.975 -96.497 94.306 43.434 139.138-144.639 116.650 121.469 101.848 -78.308 92.628 0.000 129.583 -76.766 # 261 total E -1.50285E+02 rmsd from N 0.000 %NC 0.00 93.150 -63.785 129.632 -85.125 94.486 -47.723 114.354 -74.756 91.104 -45.963 141.298 -31.418 90.910 -47.664 129.721 -76.353 92.029 -42.404 144.364-134.030 93.592 -44.463 68.733 -81.834 90.729 -47.221 133.735 24.889 111.849 -67.157 166.316 149.102 107.431 -17.244 124.934-107.820 100.066-139.125 86.800 -82.643 108.780 75.441 142.548-179.097 96.243 39.486 93.056-121.823 92.481 46.722 114.528 -88.220 90.176 61.048 145.788-132.126 88.662 48.572 126.556-130.860 91.840 51.333 130.028-107.234 96.460 -66.354 128.773 -66.101 123.569-165.456 149.212 -64.700 109.649 33.675 158.475 72.867 92.387 52.096 143.349-165.601 93.004 40.061 0.000 0.000 92.051 49.953 123.717 -77.242 89.130 43.469 145.441 -89.669 89.311 47.626 116.615-126.276 88.845 51.800 106.902 -76.733 89.116 52.353 140.285 -88.227 91.068 39.094 130.788-138.553 97.213-122.501 142.821-117.937 107.177 154.733 155.853-144.679 132.128 -75.301 111.692-107.633 91.748 57.408 113.031 -76.352 90.123 51.757 100.379 -29.810 88.977 51.549 109.931 -75.318 89.995 42.754 128.496 -75.988 91.621 41.651 100.935 -80.856 90.322 48.086 145.265 -48.698 89.367 50.806 142.048-110.321 89.379 41.241 128.182 -76.832 88.975 50.746 112.806 -48.302 90.564 47.185 127.005 -75.986 90.186 49.115 136.833-136.394 92.123 69.016 127.805 -43.419 89.552 -98.217 141.869 -96.530 97.615 -30.929 136.963-140.671 108.822-129.793 105.907 -76.607 92.922 0.000 129.551 -76.210 # 262 total E -1.48061E+02 rmsd from N 0.000 %NC 0.00 93.258 166.364 139.916 -97.466 93.211 55.048 135.832 40.783 91.557 44.104 105.977 -82.679 91.579 52.361 130.880 -76.562 90.712 42.330 150.633-146.914 91.136 44.606 63.623 -70.861 89.882 46.348 114.997 -40.562 88.133 52.254 137.619 -91.750 87.559 45.179 127.267-120.947 92.225 62.235 86.629 -98.588 91.678 -84.011 139.939 -92.569 102.288 -81.407 90.818 -81.168 89.514 -92.554 138.908 27.903 89.304 -30.475 150.413-148.621 99.830 -97.700 132.822-157.791 91.936 57.205 139.602-108.497 91.795 59.158 136.576 -77.895 90.056 56.179 165.169 -91.641 90.717 40.751 132.811 -1.208 91.673 44.351 151.581 -17.231 90.782 51.311 0.000 0.000 89.068 48.116 112.750 -82.634 90.834 42.071 132.312 -75.790 90.383 45.349 124.298-116.801 89.433 50.884 113.960 -78.772 89.957 49.602 140.036-111.261 91.510 38.490 128.770-147.461 99.384-122.904 149.124 -29.736 111.922 173.441 158.368-147.044 96.873 -51.233 93.263-100.934 88.378 -53.197 110.936 -75.645 89.059 -55.165 121.644 -32.373 89.059 -47.342 118.377 -74.958 90.625 -44.243 126.751 -75.564 89.460 -46.114 102.992 -79.475 90.631 -44.467 152.332 -22.458 92.719 -46.977 160.486-160.410 91.765 -43.542 128.766 -76.826 95.712-122.940 120.333 -62.217 90.910 54.114 130.462 -77.127 91.340 50.628 142.989-107.035 89.754 48.406 127.083 -28.064 91.224 51.221 131.747 -68.515 90.690 44.957 149.496-147.184 95.089 75.803 104.299 -80.829 92.527 0.000 128.969 -76.636 # 263 total E -1.48860E+02 rmsd from N 0.000 %NC 0.00 92.927 145.637 139.226 -90.153 93.352 53.859 164.348 -28.150 90.483 49.348 105.919 -80.959 91.439 50.308 127.996 -75.335 91.098 47.935 135.687-105.722 90.295 40.482 94.537-103.278 90.896 46.152 109.113 -84.630 90.953 46.152 125.414 -89.217 91.487-121.278 136.532-107.030 96.855-153.152 85.580 -81.223 95.217 57.595 164.293-166.670 95.733 36.806 94.341-119.743 94.509 43.476 146.489 -32.161 91.662 53.401 143.350 -42.569 90.981 41.097 109.449 -90.558 94.184 47.847 132.126-105.968 97.055 3.919 119.107 -63.467 116.707 169.488 140.211 -62.958 124.131 28.982 108.829 163.272 97.051 42.936 141.325-131.373 111.652 21.187 0.000 0.000 96.630 47.241 144.272 -6.120 91.086 51.853 152.441 -92.035 89.036 46.467 113.743-132.525 89.158 49.546 111.325 -71.267 91.074 41.072 141.515 -42.632 94.107 48.120 136.414-138.199 97.772 -54.898 107.878 -87.009 125.425-102.991 167.329-161.822 121.925-121.076 125.000-134.050 106.176 -30.353 114.744 -80.781 95.208-121.323 122.206 -21.083 93.891 47.266 124.936 -3.809 91.192 53.687 129.698 -75.706 88.391 45.482 103.298 -77.878 91.512 44.961 134.942 -40.007 90.629 44.108 148.338 -92.127 91.994 41.812 128.413 -77.092 90.803 47.128 110.883 -54.317 90.292 49.247 129.945 -77.279 89.561 44.672 139.222-150.006 89.576 48.183 130.726 -45.676 89.711 54.062 137.224 -55.220 89.720 44.355 140.053-127.192 94.614 81.341 103.934 -80.450 92.541 0.000 128.863 -76.722 # 264 total E -1.56188E+02 rmsd from N 0.000 %NC 0.00 93.079 157.550 139.741 -94.151 94.217 53.232 129.784 54.389 91.071 47.421 106.286 -75.911 92.377 43.546 129.633 -77.374 93.553 48.278 153.351-156.963 95.120 37.224 52.756 -66.875 92.842 46.705 132.632 -13.296 91.703 44.364 132.578-119.572 90.120 53.309 140.561 178.244 86.612 59.139 75.855-104.977 89.968 103.653 128.852 -76.833 92.828 42.909 97.633-106.443 95.163 57.707 102.961 -79.939 94.803 -4.608 144.005 -47.467 123.072-177.041 108.174 -83.265 98.099 37.016 147.560 129.020 93.937 44.609 135.802 -86.306 91.090 50.423 144.462 -68.130 90.407 49.970 119.059 -27.896 88.976 44.076 155.088 -16.623 89.065 49.653 0.000 0.000 89.657 48.241 107.729 -89.254 88.413 50.391 147.882 -82.901 88.612 50.881 122.531-135.937 87.198 51.174 105.283 -71.679 90.277 49.567 135.334 -52.852 90.703 46.742 138.683-142.796 94.818 -96.453 104.354 -83.440 115.325-168.854 153.774 -19.336 97.608 -54.158 98.370-105.999 91.689 -49.425 110.552 -74.534 91.828 -69.360 108.773 -58.396 89.250 108.782 117.638 -72.998 93.529 43.758 128.588 -76.421 88.555 50.100 103.170 -75.685 90.138 56.167 142.678 -35.259 87.232 47.888 164.367-157.467 90.138 41.322 128.094 -76.345 90.553 49.050 119.201 -39.719 89.407 48.068 130.815 -77.807 89.870 47.013 138.646-120.475 89.236 50.562 127.097 -39.167 88.746 60.243 141.600 -91.480 88.594 47.624 132.628-129.324 92.796 94.810 102.228 -80.197 92.589 0.000 128.617 -76.861 # 265 total E -1.50115E+02 rmsd from N 0.000 %NC 0.00 93.042 -74.231 123.646 -62.842 122.303-102.079 128.948 -36.989 93.755 41.287 109.713 -80.565 93.843 49.332 129.904 -76.350 93.672 41.855 153.170-146.691 92.065 44.477 64.393 -86.880 91.408 41.827 117.695 -53.041 92.191 45.929 135.977-101.193 89.288 56.426 144.132-163.353 86.774-173.498 84.703 -91.330 94.705 91.828 145.900-179.713 92.472 48.478 92.153-124.148 94.440 46.480 107.730 -89.112 100.753 -92.688 158.106-133.908 116.081-109.828 145.452-165.079 96.442 46.285 152.442 160.995 93.383 43.858 132.140 -84.685 90.470 52.459 136.645 -65.080 91.357 51.971 90.365-127.901 91.080 40.261 130.920-169.298 90.009 47.856 0.000 0.000 90.059 57.767 103.048 -86.580 86.739 48.588 144.213 -79.985 89.435 44.544 119.090-130.100 89.350 50.178 112.256 -73.678 90.425 49.390 137.879-100.455 91.069 44.205 131.922-156.679 94.257 -96.557 142.539-123.660 117.993-166.797 153.805 -17.744 99.207 -81.957 98.411 -97.088 93.917 -29.053 116.669 -77.617 111.724-104.677 118.223 -4.196 90.248 73.289 118.204 -16.146 91.205 49.179 131.001 -77.647 89.375 43.403 95.994 -78.661 89.058 56.553 119.058 -26.974 87.668 54.605 139.702 -40.386 88.178 43.290 128.146 -76.330 88.873 51.666 120.307 -50.142 89.963 46.141 128.537 -76.078 90.293 46.965 151.315-150.987 89.992 46.569 127.967 -43.713 90.207 53.391 135.577 -93.117 90.150 43.141 132.568-130.436 95.630 73.152 104.158 -80.572 92.509 0.000 129.024 -76.725 # 266 total E -1.48095E+02 rmsd from N 0.000 %NC 0.00 122.754 -89.606 149.965 -75.598 101.274-122.226 119.619 -61.044 92.778 41.033 103.745 -79.428 92.248 54.622 128.154 -74.480 91.381 49.313 121.601 11.573 91.975 35.751 70.751 -81.712 93.636 48.471 153.026 -74.704 96.074-100.465 142.084 -96.250 131.980 -60.758 140.792-157.390 119.547 -96.160 141.314 -18.694 96.869 48.317 163.533-138.645 93.934 44.753 99.849-121.561 91.355 44.269 104.123 -86.459 90.736 55.700 135.995 -94.082 91.544 37.493 122.671-114.140 94.878 52.255 135.544-121.359 99.775 -20.242 116.126-102.920 119.077-175.871 147.308-103.615 143.222 30.906 106.542 148.050 99.916 34.508 144.005-154.140 98.329 40.941 0.000 0.000 94.609 42.261 141.952 -11.862 91.528 52.371 150.132 -87.498 88.691 44.734 117.969-133.401 90.140 47.351 108.200 -72.309 91.203 47.253 145.372 -44.451 92.872 71.371 139.709-148.840 88.762 -85.516 103.597 -85.812 95.346 -58.333 146.963-114.050 111.791-113.071 129.350-144.912 95.456 -32.883 115.117 -80.980 95.335-119.344 129.190 -34.599 91.588 50.963 133.868 25.327 91.868 52.718 129.485 -75.959 89.178 43.808 105.554 -79.276 90.218 47.684 145.116 -37.119 90.067 49.248 163.982-153.240 91.088 38.426 128.213 -76.729 90.765 51.939 111.765 -52.305 91.686 101.446 129.152 -76.955 89.890 47.359 143.904-161.568 89.626 47.985 135.554 -59.907 90.660 57.044 142.041 -38.750 88.951 46.681 145.132-152.483 93.152 90.200 102.754 -80.376 92.566 0.000 128.701 -76.797 # 267 total E -1.47855E+02 rmsd from N 0.000 %NC 0.00 117.413 144.180 153.527-105.907 93.432 56.212 147.570 30.277 92.743 43.904 106.044 -83.204 91.968 52.164 131.333 -77.149 92.690 44.507 146.473-125.909 90.337 43.382 67.201 -83.853 91.494 43.829 116.219 -58.654 92.838 43.828 125.380 -97.499 89.425 58.276 146.314-147.176 94.652-165.143 69.471 -90.631 94.738 87.965 146.491-119.732 95.080 39.859 92.600-116.696 92.065 49.392 109.740 -88.949 91.334 51.337 140.739-111.891 89.807 51.409 133.176-137.850 90.551 39.881 127.492-118.400 97.273-141.624 118.328 -76.487 126.571 160.021 129.867 55.911 114.435-158.343 111.744-127.189 97.630 44.512 109.899 -82.450 95.639 44.991 0.000 0.000 92.750 41.728 150.486 -11.242 91.411 53.604 151.838 -97.093 88.040 49.307 118.110-138.070 87.254 54.272 111.329 -75.091 90.630 54.666 161.451-138.721 91.882 69.578 118.628-167.324 91.948 -72.880 148.392 -29.877 97.346 -55.434 152.820 -19.663 93.012 -63.549 102.654 -88.227 92.405 -42.627 134.775-163.457 98.010 -17.925 145.465-119.610 123.708 -90.202 146.721 -14.566 93.220 65.198 130.289 -76.751 88.494 52.361 136.980 171.046 87.898 52.258 94.476 -86.362 88.397 57.303 137.622 -54.021 89.002 46.178 127.436 -75.559 90.870 114.158 97.792-102.633 90.757 -56.680 129.033 -77.623 92.846 -47.114 148.216-166.277 90.649 -48.396 130.573 -44.549 96.462-114.880 158.080-136.557 92.216 -25.600 130.563-139.036 108.336 45.477 101.931 -80.672 92.350 0.000 129.536 -75.778 # 268 total E -1.47651E+02 rmsd from N 0.000 %NC 0.00 122.540 -91.570 150.692 -84.134 101.011-113.714 121.034 -45.547 93.613 39.770 107.081 -77.896 92.728 54.791 130.343 -75.431 90.272 37.946 147.273 -24.249 90.615 50.752 61.323 -69.292 88.224 53.114 113.298 -35.443 87.136 44.853 130.378 -94.129 92.179 47.199 119.661 -93.416 92.157 176.670 97.608 -91.677 140.087 117.660 154.245-168.809 93.003 61.654 95.516-125.815 98.908 60.084 104.908 -88.299 94.870 -77.723 163.333-149.639 109.619-113.155 141.879-159.818 94.963 41.980 153.797-139.749 93.017 46.801 134.841 -81.401 90.905 47.249 127.352 -60.461 92.481 49.113 98.572-111.152 90.853 41.700 130.383-174.392 89.670 49.135 0.000 0.000 89.698 55.815 105.460 -83.490 88.562 45.504 145.566 -77.410 89.675 42.676 118.316-127.943 90.041 52.963 110.825 -78.250 89.680 52.734 139.718-101.286 89.673 43.140 129.486-163.236 95.421-109.820 104.795 -83.364 106.519-168.479 154.713-137.069 100.120 -53.392 94.180 -99.038 92.788 -43.799 111.414 -76.483 91.180 -45.465 116.815 -32.334 90.949 -51.466 109.691 -73.516 90.663 -40.100 127.881 -76.627 88.340 -50.252 137.938 -37.069 87.617 -71.183 135.834 -48.700 84.960 -48.958 145.186-111.066 90.223 -43.762 127.390 -75.829 88.795 -53.175 121.129 -38.411 89.105 -50.103 130.677 -77.126 89.249 -43.560 137.952-165.607 88.969 -52.495 129.722 -26.777 89.190 -52.990 151.403 -18.339 91.000 -44.296 144.200-148.567 95.842 95.998 104.867 -79.759 92.493 0.000 128.995 -76.332 # 269 total E -1.49509E+02 rmsd from N 0.000 %NC 0.00 124.079-116.325 148.434 -58.992 110.799-115.509 130.355 -42.952 93.159 40.859 108.075 -79.579 92.241 50.715 130.939 -76.357 92.814 38.941 141.584 -32.938 91.836 46.627 53.956 -63.940 88.642 55.901 116.808 -11.147 86.428 51.963 128.061-100.625 91.225 40.698 117.057 -98.188 94.053-176.841 99.497 -91.272 140.662 132.828 152.552-166.318 97.270 54.975 92.863-120.010 100.397 62.452 111.296 -84.587 93.442 -80.366 159.826-159.558 109.933-113.509 141.520-165.361 95.360 40.759 156.516-157.911 92.975 47.077 134.923 -83.056 90.463 49.365 128.826 -66.828 92.173 51.110 99.996-116.372 91.363 38.829 129.944-173.274 89.988 50.151 0.000 0.000 89.323 59.841 102.215 -85.009 88.859 48.684 143.382 -75.853 89.878 40.518 118.533-127.102 91.338 51.429 111.953 -79.419 90.450 52.671 138.125-103.135 91.574 54.476 135.070-161.816 93.107-107.488 106.641 -85.699 97.609 175.707 148.744-125.941 139.171-120.140 106.638 -95.202 86.268 70.524 121.645 14.273 88.876 59.459 111.323 -41.896 89.800 46.429 122.482 -33.662 91.476 41.054 129.515 -76.498 88.919 49.266 135.729-132.325 88.385 59.626 137.865 -50.085 87.310 48.178 161.683-144.116 89.970 38.945 128.249 -76.468 90.541 50.935 112.075 -34.168 89.981 47.734 129.382 -77.224 90.555 46.485 139.414-125.473 92.332 73.861 130.623 -44.679 88.898 -91.043 135.222 -66.216 96.744 -35.078 108.294 -84.460 109.375-119.135 145.956 -11.770 92.830 0.000 129.485 -76.290 # 270 total E -1.48618E+02 rmsd from N 0.000 %NC 0.00 92.869 149.149 136.381 -80.978 93.611 56.009 133.666 56.784 91.916 45.992 107.311 -78.475 91.879 44.747 131.835 -77.789 94.657 44.845 160.263-163.676 94.184 37.273 50.854 -70.007 93.662 45.231 158.790 113.726 92.660 39.620 137.566-100.700 93.461 52.160 146.024 161.991 91.289 91.207 102.767-131.112 95.827 -64.345 132.184-144.527 96.047 -52.719 89.257-106.423 86.704 -77.902 149.753 -12.541 97.731 -73.938 153.284 -34.205 93.305-109.630 138.698-160.071 95.019 42.593 156.855 147.533 92.401 48.909 133.565 -85.759 89.804 54.889 159.367 -48.334 92.242 46.788 128.490 -44.398 95.055 28.125 108.826 -82.527 99.703 39.239 0.000 0.000 95.158 45.259 142.555 -15.701 90.156 47.903 151.212-100.260 89.216 45.359 114.116-134.255 87.414 64.387 109.314 -74.402 88.654 57.411 143.860 -43.060 88.500 38.617 136.815-156.827 96.525 -94.954 106.372 -84.590 118.667-175.599 162.702-155.880 100.742 -58.947 97.186 -93.404 95.261 -43.916 111.989 -76.763 92.895 -40.892 115.927 -28.782 92.043 -48.755 107.367 -72.360 89.900 -45.193 127.613 -76.614 89.314 -42.866 102.501 -80.183 90.623 -45.722 137.606 -23.503 91.346 -42.769 145.607 -50.490 90.620 -46.744 128.603 -76.419 88.100 -49.696 132.157 4.994 91.109 -45.758 130.187 -76.825 90.996 -42.741 146.491-151.711 91.785 -75.810 124.054 7.498 91.816 103.079 153.726 -18.825 95.282 40.970 142.112-156.619 97.332 -2.380 103.548 -73.490 92.600 0.000 129.370 -76.945 # 271 total E -1.48833E+02 rmsd from N 0.000 %NC 0.00 93.136 -62.899 130.164 -82.633 117.272-109.743 130.594 -54.191 94.209 37.338 109.233 -80.750 93.235 51.879 127.421 -74.324 92.611 40.923 158.000 -11.026 92.670 46.510 74.703 -97.580 88.775 49.676 113.823 -77.526 87.494 67.556 131.066-101.076 88.991 50.267 108.547 -96.723 90.199 177.522 91.672 -79.832 106.961 77.108 153.168-156.991 95.550 40.337 92.828-125.222 92.719 46.193 109.569 -89.936 91.379 64.285 144.992-124.518 89.409 44.758 133.422-125.083 93.108 48.379 131.103-114.178 99.579 -14.405 132.377 -81.087 125.826-179.385 149.535 -73.464 106.171 42.756 148.482 -1.536 93.941 50.930 109.537 -82.106 91.412 44.029 0.000 0.000 90.811 54.337 108.189 -80.831 87.646 47.879 144.670 -77.739 90.107 43.107 120.354-130.070 90.177 50.213 111.913 -72.915 91.471 38.785 137.008 -93.282 94.948 54.171 134.321-150.864 96.295 -20.906 105.011 -85.235 121.606 179.673 151.343 -19.126 125.496 -89.682 120.574-124.198 97.345 -16.231 117.980 -80.176 97.671-128.637 128.159 -16.431 93.369 46.892 117.160 -73.782 93.606 49.331 129.394 -76.114 95.644 30.141 102.462 -75.013 93.570 52.549 154.825 -23.645 88.974 49.888 156.228-152.815 90.458 39.060 128.278 -76.799 90.710 48.085 116.610 -31.409 90.798 47.397 129.472 -77.436 90.499 51.302 139.605-119.047 91.601 68.261 127.917 -40.404 89.881 -98.018 139.018 -85.996 97.795 -26.023 105.584 -85.902 107.867-113.276 140.753 -19.266 92.963 0.000 129.407 -76.488 # 272 total E -1.47780E+02 rmsd from N 0.000 %NC 0.00 93.173 165.865 138.427 -92.464 93.644 56.566 136.745 55.423 92.329 43.634 105.914 -81.093 92.071 48.889 130.839 -77.390 92.523 45.418 156.827-162.035 92.711 39.309 61.076 -73.772 93.766 42.796 123.869 -37.765 95.300 36.365 137.007-101.824 94.901 48.900 146.314 167.025 92.477 83.761 92.359-102.154 92.221 -75.843 123.880-103.306 95.990 -45.600 95.078 -89.498 92.633 -47.554 150.133 -38.431 92.248 -53.190 138.318-112.324 91.203 -45.119 128.120-160.521 95.146 99.883 135.906-122.466 110.253-147.751 153.415 -78.823 148.084 -47.783 108.001 25.675 93.306 62.379 162.323-122.017 96.614 50.000 107.174 -82.418 114.769 -1.029 0.000 0.000 94.032 58.545 154.370-164.263 91.256 46.471 112.240-125.745 91.262 41.839 111.175-116.675 90.694 46.678 116.707 -74.021 91.593 42.334 135.427-104.098 95.145 62.522 129.680-132.577 93.036 -74.666 140.934-126.288 111.702-154.953 110.967 -79.337 128.741 -98.331 115.762-115.510 95.025 -35.617 112.030 -81.315 97.272-118.050 126.141 -26.748 92.078 50.292 129.870 -5.075 90.882 54.300 129.947 -76.271 88.403 46.680 106.052 -83.031 90.376 44.452 138.606 -42.687 89.744 48.564 144.398 -99.691 89.908 48.349 128.149 -76.981 89.385 79.123 120.061 -89.404 90.118-163.499 129.172 -77.383 92.419 58.824 141.865-115.352 90.549 50.484 130.239 -70.302 91.470 56.000 153.362-160.164 88.899 41.317 123.565-167.022 95.558 73.491 102.710 -79.693 92.469 0.000 129.130 -76.437 # 273 total E -1.47865E+02 rmsd from N 0.000 %NC 0.00 93.027 152.758 140.914 -96.946 93.080 52.049 143.614 49.620 91.008 48.378 106.491 -83.034 91.887 47.347 130.102 -77.526 95.924 46.257 151.489-133.056 93.792 40.683 60.494 -84.122 90.233 48.677 127.205 -51.948 90.306 60.216 127.228-112.325 86.007 58.653 140.581-176.624 85.602 167.345 81.383 -88.985 92.402 75.770 154.036-155.827 93.172 45.359 91.666-122.065 93.867 53.233 110.264 -87.705 94.612 -94.357 148.430-120.260 114.087-112.002 144.574-165.434 95.695 43.572 157.241 172.445 92.855 46.050 133.140 -86.276 90.636 49.965 131.635 -71.745 92.501 48.351 87.825-122.462 91.721 40.580 136.624 170.079 89.688 46.482 0.000 0.000 92.483 48.281 99.394 -86.167 87.997 47.404 155.175 -72.808 90.896 40.229 114.600-129.108 91.122 48.533 111.045 -77.561 88.855 58.546 140.737 -99.585 89.904 43.650 121.895-102.522 92.294 43.311 150.801 -23.716 98.113 39.018 146.643 -31.253 103.126 149.199 104.303-104.094 96.848 47.397 143.616 176.170 95.022 114.484 133.975-101.498 92.310 -47.672 114.380 -75.924 91.945 -47.187 126.720 -75.514 87.099 -46.960 100.941 -79.175 88.748 -58.082 138.561 -35.722 87.313 -45.275 139.524 -55.330 90.281 -45.345 128.096 -75.652 88.720 -53.434 125.722 -25.716 89.589 -50.957 128.381 -75.487 89.650 -40.537 141.135-140.863 90.770 -48.417 128.171 -23.996 90.521 -52.738 151.112 -22.001 91.092 -44.915 141.301-162.264 95.809 94.159 104.548 -80.096 92.599 0.000 128.958 -76.382 # 274 total E -1.46737E+02 rmsd from N 0.000 %NC 0.00 92.655 145.486 128.469 -58.456 93.532 65.474 133.687 57.716 93.698 43.929 106.728 -76.882 92.858 40.504 131.166 -77.503 94.689 47.194 153.176-165.044 97.080 39.579 52.026 -65.122 90.854 46.805 129.932 -13.551 90.104 50.103 125.348-113.644 90.355 51.592 117.995-101.951 89.519 60.617 93.084 -94.670 94.624-151.647 124.935 -84.920 97.575 71.955 124.780-145.837 94.294 45.549 110.965 -87.115 89.117 63.106 156.175-163.631 88.801 55.133 126.577-108.842 91.521 46.689 126.963-110.409 97.039 -94.825 132.047 -64.141 119.708-149.386 127.679 -12.341 95.841 48.495 126.681-149.460 91.416 45.428 151.824 -42.910 90.610 49.561 0.000 0.000 92.041 44.429 103.288 -85.068 90.954 43.522 173.844-148.066 91.653 45.865 106.102-140.781 93.716 80.395 113.066 -79.556 88.949 -72.394 156.616-148.393 98.982 -60.728 136.922-130.449 92.559 -32.315 154.118 -25.584 100.867-161.891 159.483-137.400 107.392 -24.487 92.866-110.373 110.718 -25.152 114.006 -79.222 93.127 -46.500 113.787 -48.262 91.924 -47.321 108.701 -75.141 90.010 -48.413 126.848 -75.867 88.265 -41.684 103.788 -79.650 90.153 -49.281 148.455 -33.123 88.866 -55.582 155.207-153.526 89.280 -39.241 129.269 -76.765 92.963-125.403 106.613 -51.287 91.714 47.746 132.405 -78.267 92.730 49.794 140.816-103.249 91.530 46.371 127.622 -23.110 97.216-179.702 111.416 -54.133 93.118 41.333 147.145-165.527 116.139-137.702 104.745 -77.775 122.628 0.000 147.585 -78.741 # 275 total E -1.48115E+02 rmsd from N 0.000 %NC 0.00 93.164 -68.943 127.713 -78.429 94.188 -49.763 119.331 -78.617 91.241 -46.412 103.695 -77.874 90.589 -47.813 127.905 -75.513 90.784 -40.703 142.423-133.819 92.982 -44.229 60.707 -56.090 90.388 -41.794 133.805 35.618 98.761 -42.897 166.242 168.444 90.292 -49.733 139.643-131.878 100.537-109.326 138.209 2.196 96.288 52.734 153.204-174.991 90.043 50.863 98.581-130.792 89.364 51.104 97.628 -85.625 91.909 49.959 144.678 -23.658 95.420 29.293 136.358-129.384 95.793 43.024 134.809-109.891 92.121 61.504 115.908 -81.437 92.659 47.863 119.282 -37.357 96.014 19.596 151.212 148.355 113.449 22.704 107.690 -82.811 98.774 44.752 0.000 0.000 91.715 48.315 138.430-127.742 90.664 41.733 117.740-121.388 91.195 43.321 116.029-122.312 89.999 51.480 115.107 -80.399 89.696 48.986 136.738-111.691 91.124 49.402 130.258-148.085 94.621 -93.187 103.210 -82.555 118.765 162.027 151.849 -16.582 126.656-166.074 116.308-119.228 101.550 47.510 116.461 -77.780 93.400 44.238 119.765 -7.452 91.204 48.490 116.533 -71.566 90.538 46.847 129.269 -76.566 88.204 46.101 136.393-138.029 90.096 46.009 113.249 -49.268 89.727 49.116 149.279 -33.588 88.797 45.251 128.016 -76.782 87.627 55.117 111.322 -89.578 89.505 50.571 127.186 -75.537 89.687 42.294 141.587-118.809 93.063 78.725 129.678 -43.753 89.269 -79.214 141.460 -59.741 98.836 -49.268 108.643 -84.063 100.446-144.995 147.932-129.327 92.930 0.000 129.338 -76.261 # 276 total E -1.48551E+02 rmsd from N 0.000 %NC 0.00 93.222 170.236 138.375 -93.534 93.404 57.655 146.183 8.024 93.826 43.219 105.397 -80.984 92.301 46.930 131.962 -77.438 95.334 41.715 133.614-105.466 93.159 41.064 57.537 -75.985 91.317 44.435 120.047 -40.568 91.365 47.233 134.852 -95.325 89.189 44.021 129.178-114.029 90.792 40.005 83.619 -97.340 93.906 50.248 144.921 -93.834 97.020 29.607 97.104-106.099 93.565 51.460 133.792-116.385 93.343 38.469 110.860-113.207 103.564-144.761 136.383-123.053 95.950 82.590 138.607-107.801 120.574-128.235 154.211 -62.513 143.716 -20.933 144.424 95.817 97.762 48.786 150.346 -16.783 94.833 42.905 153.933 -13.760 90.826 48.527 0.000 0.000 90.066 50.653 108.971 -82.665 90.159 46.870 145.872 -77.880 91.687 40.134 121.042-126.504 90.572 49.101 112.405 -77.291 90.426 61.196 140.251-102.115 89.947 43.997 143.832-136.923 92.395 38.879 115.606 -90.166 101.283 -5.227 117.126 -85.754 139.191-158.580 102.774 -85.881 94.559 54.769 115.387 -76.291 92.460 49.240 103.102 -27.713 89.869 49.067 134.873 -15.039 91.850 48.358 130.319 -76.700 91.479 38.379 101.907 -83.381 90.961 49.772 118.801 -56.271 90.997 72.786 134.760 -48.541 87.651 54.210 130.252 -77.960 89.056 177.801 74.077 -88.542 93.002 59.584 133.344 -78.674 90.537 49.180 141.593-104.756 90.998 56.375 127.489 -32.017 93.951-131.816 133.725 -53.534 97.653 28.597 128.723-121.226 125.009 83.852 104.900 -73.684 92.527 0.000 130.276 -76.732 # 277 total E -1.49902E+02 rmsd from N 0.000 %NC 0.00 93.614-174.395 142.330-112.717 95.340 48.320 137.608 14.691 92.300 45.822 105.108 -79.026 92.259 46.549 130.142 -77.660 94.708 45.915 129.894-108.499 98.673 34.206 55.661 -75.897 94.053 42.881 134.699 -44.009 92.552 55.401 133.736-121.328 87.080 63.194 135.474-172.759 84.706 164.806 81.758 -91.570 93.562 75.939 155.654-155.299 92.150 42.564 91.981-120.922 93.673 57.005 108.954 -87.577 96.488 -92.640 154.236-129.498 112.530-115.622 142.917-161.556 97.996 42.783 152.941 164.743 93.004 45.704 131.594 -94.264 90.372 54.185 153.265 127.047 90.907 50.234 91.847-130.533 91.137 39.667 133.021-175.813 90.749 46.323 0.000 0.000 90.760 51.526 104.593 -89.809 88.021 54.693 149.428 -83.286 87.784 47.357 119.334-138.468 88.697 49.698 106.369 -72.175 90.417 49.051 139.181 -47.688 91.268 45.589 138.235-144.560 94.172 -95.582 142.242-123.386 118.955-146.825 155.680 -19.434 117.266 -74.561 118.841-125.269 94.695 -40.153 114.816 -74.774 95.239 -82.991 118.518 -73.545 89.397 97.383 131.070 -7.765 92.220 52.644 128.800 -76.023 89.234 46.182 97.605 -70.087 91.291 49.254 148.913 -26.573 88.277 47.306 163.856-177.386 90.219 42.083 128.080 -76.560 90.252 48.400 114.949 -31.767 89.693 46.560 130.674 -78.025 89.913 47.108 140.122-125.199 88.879 52.101 131.436 -45.436 88.553 55.361 136.373 -57.072 89.683 44.029 138.584-124.333 94.635 81.177 104.059 -80.268 92.523 0.000 128.843 -76.756 # 278 total E -1.47990E+02 rmsd from N 0.000 %NC 0.00 116.841 136.461 152.477 -88.837 93.113 58.743 142.085 51.013 92.770 43.652 106.410 -82.995 92.154 49.715 131.113 -76.999 92.750 44.640 156.123-149.820 91.305 41.020 63.796 -77.541 93.652 44.252 122.879 -42.928 95.420 34.157 136.204-100.052 93.237 50.702 146.656-178.020 89.167 73.431 84.101-102.922 89.738-162.721 125.973 -90.272 92.944 79.895 127.219-152.088 90.686 50.540 107.522 -80.243 92.335 45.453 134.981 -42.093 93.625 36.116 110.804 -91.024 95.616 55.754 129.242-109.155 94.524 29.246 103.460 -59.996 96.876-142.765 102.583 -12.214 105.699 -42.807 81.306 118.842 100.589 71.145 147.002-159.708 97.363 38.153 0.000 0.000 90.559 47.551 147.919 -10.376 91.118 48.842 131.430-103.431 88.904 48.815 122.364-129.774 87.700 51.694 110.895 -72.197 91.503 37.580 132.379 -65.440 96.437 37.994 139.626-134.783 96.568 40.365 150.922 -24.895 93.610 61.410 155.446 -17.285 91.859 51.443 97.322-130.176 90.842 38.305 113.091 -79.069 99.102-103.036 138.775-118.878 128.028 151.924 120.921 -77.905 93.460 -82.749 127.407 -75.155 89.336 -54.863 97.608 -79.026 89.058 -57.815 136.352 -36.662 92.828 -24.055 167.140-141.789 101.356 -60.275 127.836 -77.020 116.451 -96.987 134.860 34.840 91.563 56.330 131.184 -76.618 93.119 39.198 140.578-107.552 90.694 48.341 125.898 -14.972 90.167 67.135 143.991 -56.396 87.134 50.275 138.884-158.474 91.423 107.999 101.821 -80.112 92.605 0.000 128.606 -76.864 # 279 total E -1.46461E+02 rmsd from N 0.000 %NC 0.00 92.848 110.607 142.812-111.726 94.132 52.427 145.533 1.149 92.619 44.465 105.394 -82.462 91.888 53.983 130.559 -76.416 92.424 42.560 134.001-109.980 90.364 44.465 70.908 -84.742 90.054 44.658 114.459 -63.051 93.088 47.741 131.849 -93.642 90.560 35.408 135.384-122.006 96.306 45.471 90.927-103.691 125.727-171.370 126.090 -82.768 95.963 73.407 131.392-155.134 96.657 48.475 108.950 -80.962 91.405 101.128 138.065 -30.564 94.886 46.399 130.948-143.324 95.861 44.232 131.546-110.621 115.978 0.171 144.816 -70.227 93.826 63.228 136.964 -68.857 92.722 54.574 127.967 -34.107 90.680 40.259 106.943 -83.719 90.016 49.115 0.000 0.000 90.771 53.538 104.307 -84.680 89.386 45.449 142.421 -71.337 91.737 40.064 119.474-123.831 91.636 50.387 112.517 -77.500 91.278 47.175 130.578 -94.981 92.123 51.423 136.335-122.536 93.881 13.630 108.046 -86.862 119.231 31.327 153.351 -16.603 138.018-174.659 108.157 -95.726 96.180 57.449 117.724 -77.327 92.882 123.196 103.832 2.079 94.686 -38.193 107.966 -74.415 91.551 -50.996 127.147 -75.687 89.850 -40.679 100.332 -80.750 92.057 -45.405 139.459 -23.800 91.174 -43.374 140.501 -61.027 91.377 -53.038 128.034 -76.221 90.835-120.704 123.334 -63.766 89.241 53.876 132.347 -78.101 91.984 51.639 142.757-115.800 94.089 79.236 125.633 -23.922 90.211 -78.843 149.521 -29.080 97.043 -40.586 140.992-135.389 104.150-179.956 105.237 -78.123 92.945 0.000 129.116 -76.765 # 280 total E -1.48820E+02 rmsd from N 0.000 %NC 0.00 92.499 67.715 130.163 -73.275 95.027 53.495 136.083 55.993 94.503 42.244 106.943 -75.546 93.082 41.123 131.201 -77.818 95.421 44.550 142.199-129.629 97.029 38.517 47.669 -65.337 92.637 45.093 127.323 -9.435 90.749 48.199 131.143-102.182 92.131 50.191 121.026-106.464 93.470 111.808 95.137 -97.243 119.677-113.285 145.069-111.407 94.829 44.782 94.978-100.813 95.047 44.517 102.427 -75.244 93.395 45.793 157.041 -27.226 90.141 48.465 130.589-139.548 91.980 46.406 122.355-118.726 94.731-112.237 128.836 -78.220 100.642 -40.436 140.836-105.189 119.758 73.809 149.278 -34.523 130.576 72.215 153.169-176.453 99.942 37.025 0.000 0.000 91.257 53.667 149.871-159.924 90.133 48.487 131.868-111.332 89.148 47.854 115.653-124.783 88.719 47.846 106.712 -71.409 93.237 46.327 121.761 -57.592 95.787 17.172 139.861-119.342 110.073 43.063 111.080 -85.597 100.530 20.366 147.568 -26.229 109.073-133.972 100.381 -94.412 93.730 -13.934 113.427 -77.143 106.436-112.310 131.224 39.487 149.628 135.358 132.499 -84.626 92.183 54.125 129.713 -76.353 89.304 45.471 97.905 -79.210 89.825 58.595 146.249 -27.041 86.765 50.387 159.664-146.154 89.515 41.500 128.072 -76.386 90.078 48.951 115.814 -25.070 89.718 46.585 129.961 -77.550 89.912 48.206 138.211-125.507 88.692 53.500 130.947 -44.514 88.722 54.054 135.351 -58.608 90.061 45.101 144.578-131.041 94.379 81.615 103.894 -80.447 92.539 0.000 128.854 -76.702 # 281 total E -1.52372E+02 rmsd from N 0.000 %NC 0.00 93.176 165.688 139.151 -94.327 93.082 56.742 141.370 34.720 92.221 44.969 105.997 -82.535 92.000 48.455 130.766 -76.978 93.209 44.910 147.404-130.155 90.991 41.991 60.695 -74.694 91.897 44.942 121.333 -39.044 92.801 41.220 132.995-101.545 90.313 48.312 143.799-156.837 88.824 54.234 78.857-101.977 91.128 161.725 127.806 -77.487 90.733 70.541 131.777-159.129 94.017 37.568 97.370 -78.226 92.730 50.931 150.733 -31.654 90.720 41.745 134.688-113.003 92.441 52.993 124.484-125.655 91.967 40.018 133.957 -87.704 94.081-120.000 151.459-142.488 102.413 -61.907 137.088 -99.551 92.066 117.061 149.566-149.136 92.778 51.134 0.000 0.000 90.838 50.322 115.231 -75.321 89.507 43.531 143.383 -83.607 89.943 47.148 117.735-125.246 89.109 51.657 110.310 -78.798 89.144 50.744 139.859-102.215 91.113 44.326 131.175-129.085 95.976-100.662 104.204 -82.842 112.642-171.457 151.474 -17.065 136.733-163.968 109.459-100.368 96.023 42.766 114.993 -77.359 92.133 48.229 101.544 -4.103 89.828 50.259 125.929 7.771 90.074 46.246 129.858 -77.288 89.249 43.206 105.211 -83.922 88.497 57.031 120.347 -11.744 86.189 57.195 145.226 -46.539 87.347 46.534 128.051 -76.660 86.468 56.811 112.144 -22.030 88.241 51.970 126.832 -75.659 88.224 47.598 135.850-114.377 88.613 55.898 131.830 -43.639 88.431 55.941 133.990 -51.715 89.711 44.182 137.568-112.044 94.677 80.521 104.119 -80.308 92.539 0.000 128.866 -76.717 # 282 total E -1.50095E+02 rmsd from N 0.000 %NC 0.00 93.044 -60.106 126.703 -76.583 93.921 -50.014 114.460 -75.955 91.358 -44.985 103.527 -76.033 91.205 -45.538 128.897 -76.219 91.725 -40.348 140.693-122.566 94.382 -40.690 62.580 -68.075 93.358 -38.626 142.602 -57.203 102.315 -31.980 170.528 162.618 96.471 -53.370 133.027-117.073 96.575-159.714 85.380 -83.751 141.101 68.583 172.002 175.772 94.999 37.320 96.690-113.952 96.225 42.704 100.606 -79.525 92.650 52.366 148.600 -46.315 91.102 47.342 147.041 -22.235 91.825 43.418 126.863-119.209 96.552 1.015 127.026 -89.370 137.387 174.735 130.857 -89.232 94.325 49.079 137.874 -7.883 92.423 54.216 147.042-162.448 90.493 46.842 0.000 0.000 89.982 48.438 113.817 -76.862 89.091 46.152 145.790 -81.256 90.961 44.401 120.656-129.768 89.320 48.368 111.594 -76.347 90.157 51.248 133.283 -96.144 92.672 66.859 134.172-141.815 94.045 -28.181 105.063 -86.388 115.387 136.446 149.259 -18.795 108.503 -66.700 91.890-102.099 100.988 -34.589 112.908 -80.801 96.222-123.627 128.096 -34.553 93.725 54.747 117.158 -73.320 91.481 48.190 129.545 -76.266 90.090 40.097 102.560 -76.833 91.843 53.102 149.917 -19.219 88.329 46.007 155.253-147.536 90.891 40.259 128.196 -76.607 88.867 57.372 116.567 -27.000 88.925 55.153 127.976 -75.790 88.001 43.314 137.013-141.780 91.325 56.836 130.176 -40.060 90.503-112.167 137.933 -56.109 100.547 66.918 107.152 -83.750 135.767 11.066 145.819 -26.627 92.408 0.000 128.628 -76.043 # 283 total E -1.50806E+02 rmsd from N 0.000 %NC 0.00 93.210 166.570 139.627 -96.382 93.299 55.600 137.704 36.095 92.058 45.006 106.048 -81.695 91.836 47.980 131.282 -77.536 92.868 44.805 148.229-130.720 90.929 43.829 57.809 -70.798 90.612 46.714 127.995 -31.483 90.094 47.081 128.503-104.429 88.029 47.236 138.336-139.766 91.949 88.855 81.127-102.323 89.221 -62.073 148.269-104.186 101.070 -65.181 92.518 -94.081 87.817 -69.812 146.324 1.572 113.895-124.215 161.374-178.929 105.546 -80.168 145.155-141.045 130.528 -5.732 153.097-158.411 97.049 51.930 137.164 -76.704 95.476 37.062 142.545 13.456 92.408 51.793 140.757-153.144 88.387 51.994 143.568-165.739 88.334 48.109 0.000 0.000 90.368 47.991 110.541 -76.738 89.217 43.852 144.798 -73.349 90.076 45.958 119.422-126.370 89.150 50.739 111.906 -77.312 89.878 47.415 136.709-102.180 93.222 48.695 132.072-128.077 96.418 -91.160 142.970-124.632 109.238-164.905 151.277 -19.524 137.021 -62.936 111.759-104.440 94.479 -47.958 110.225 -79.430 97.478-121.462 130.541 -74.579 87.907 72.387 119.511 -73.307 91.054 52.254 129.275 -76.213 88.220 44.900 109.055 -84.876 89.051 51.321 139.755-102.388 88.476 54.857 140.747-148.867 87.653 46.363 127.915 -76.406 88.301 51.163 100.980 -59.832 90.373 46.008 127.074 -74.925 90.610 45.266 137.660-148.227 90.694 48.863 128.363 -44.106 90.674 50.382 135.467 -94.745 90.974 44.890 141.284-147.978 95.308 71.562 104.191 -80.722 92.511 0.000 129.013 -76.621 # 284 total E -1.48183E+02 rmsd from N 0.000 %NC 0.00 93.232 166.184 140.424 -98.941 93.352 54.467 144.462 23.669 92.312 45.101 106.286 -82.433 91.777 49.342 131.558 -77.453 94.621 42.549 142.818-116.826 91.536 42.975 59.863 -78.780 90.074 46.532 119.940 -46.703 90.324 51.922 123.775 -95.471 88.484 40.116 131.792-115.750 97.590 101.372 88.246-100.167 119.345-128.734 155.170-101.129 92.361 58.077 100.336-108.408 89.439 50.320 110.059 -75.985 91.919 47.793 141.506 -35.798 89.949 46.181 135.252-121.943 92.556 44.956 125.050-118.445 95.173-109.949 121.373 -82.913 100.965 -90.362 139.903-103.622 92.921 84.128 131.102 -81.304 96.277 54.249 138.489-167.036 97.610 32.951 0.000 0.000 94.275 46.042 160.512-166.457 91.753 47.239 123.683-129.083 90.420 45.701 113.528-123.021 88.920 47.453 117.448 -77.389 90.713 50.661 147.133-125.682 89.869 45.764 117.940-151.215 94.043-124.049 104.784 -82.366 106.410 174.506 153.876-136.392 93.656 -61.608 93.857-102.897 88.702 -50.066 109.861 -76.061 88.939 -52.506 120.048 -39.017 88.543 -48.314 112.871 -73.832 90.500 -41.929 127.031 -75.683 89.042 -46.112 102.963 -79.287 88.421 -55.129 143.862 -42.492 88.011 -45.337 143.760 -97.337 89.860 -45.336 127.558 -76.152 88.381 -50.619 123.573 -26.615 89.496 -50.125 129.549 -76.457 89.509 -42.270 145.648-160.441 89.501 -49.953 126.777 -18.146 89.661 -53.799 152.871 -21.481 91.004 -43.949 143.440-168.219 96.125 93.937 104.724 -79.699 92.491 0.000 128.995 -76.345 # 285 total E -1.47342E+02 rmsd from N 0.000 %NC 0.00 93.151 -67.151 128.081 -79.737 94.377 -47.284 113.949 -79.870 90.637 -47.173 103.063 -76.917 90.508 -45.562 130.144 -76.442 92.807 -40.485 136.505-120.737 95.102 -40.325 63.470 -67.351 92.472 -38.702 133.355 7.239 104.716 -33.119 168.321 166.006 94.685 -62.702 119.878-110.510 89.068-110.604 79.026 -74.297 134.312 101.830 168.932 164.705 91.819 47.013 94.557-119.054 96.666 37.229 101.957 -82.585 94.902 49.143 167.566-173.670 94.367 31.673 152.015 -51.468 98.672 40.802 119.937-114.995 98.616 15.372 123.508 -70.060 114.539 153.011 129.056 -35.959 103.668 37.007 102.129 165.111 98.639 42.054 109.735 -81.469 112.586 12.385 0.000 0.000 98.107 41.669 167.595-169.158 98.179 38.644 153.314-169.899 91.104 50.219 114.081-144.366 90.792 41.237 111.657 -79.310 92.456 49.673 156.510-128.540 92.184 48.925 133.451-154.906 93.161-110.722 105.695 -83.949 104.909-174.022 152.906-133.540 125.012-153.814 113.791-116.668 98.947 40.068 115.466 -77.547 94.699 43.720 106.098 -9.064 94.431 40.682 130.969 -31.840 92.022 51.084 130.364 -77.315 91.386 73.950 102.958 -84.731 82.921 -94.530 103.643 -62.465 89.306 -52.723 141.589 -41.190 91.151 -39.970 134.111 -79.259 97.614-164.525 121.813 -12.827 95.417 47.960 129.046 -75.997 93.195 39.838 141.330-116.958 91.726 50.054 139.618 -48.301 90.760 56.383 132.389-125.902 88.479 38.801 127.789-152.725 96.046 64.950 102.823 -79.659 92.478 0.000 129.195 -76.490 # 286 total E -1.46967E+02 rmsd from N 0.000 %NC 0.00 93.296 170.076 140.312-100.423 93.718 53.390 130.492 26.619 91.741 45.979 109.072 -81.807 90.985 49.116 131.596 -77.476 91.895 45.768 144.384-125.691 91.046 42.289 57.940 -65.603 90.462 50.591 122.529 -29.431 87.928 53.227 128.157-104.181 87.973 39.324 122.773-116.818 97.133 100.277 84.744 -93.151 92.018 -66.744 149.560 -97.179 97.220 -41.413 92.370 -87.038 89.742 -48.659 149.874 -52.070 92.855 -49.045 137.751-162.762 91.116 -53.943 141.955-145.694 91.664 96.673 130.262-146.208 116.127-105.642 127.981 -85.720 118.242 -78.764 128.415 30.225 93.471 76.898 142.288 -87.696 96.436 47.096 107.214 -83.598 98.562 32.651 0.000 0.000 92.966 47.938 157.980-166.873 92.791 43.083 106.912-126.942 90.372 47.137 114.595-118.195 89.604 48.051 110.211 -78.509 90.378 51.846 134.421 -92.220 90.804 42.155 132.759-143.259 95.430-120.010 106.913 -83.988 107.273 178.295 154.626-138.026 127.466-129.779 115.836-117.221 95.778 50.473 114.619 -76.875 92.600 44.954 99.260 -18.625 91.831 46.116 123.011 -36.714 90.618 47.879 129.342 -76.561 90.060 44.404 101.970 -83.240 90.868 43.882 139.636 -43.426 90.611 50.944 141.913-101.114 89.636 42.088 128.823 -77.584 92.311 98.973 112.417 -94.363 89.073 -64.494 130.942 -78.478 93.832 -51.461 142.242-126.387 88.911 -49.818 130.785 -22.164 90.355 -54.594 150.335 -95.710 90.837 -52.152 104.796 -90.738 94.419 82.018 105.432 -79.200 92.513 0.000 128.963 -76.434 # 287 total E -1.47651E+02 rmsd from N 0.000 %NC 0.00 93.087 -64.855 126.633 -75.505 94.140 -50.149 115.802 -77.134 91.379 -45.460 103.623 -77.710 91.051 -45.614 128.861 -76.044 92.588 -38.805 139.238-124.949 96.723 -40.927 63.833 -69.307 92.179 -35.077 123.621 -33.694 104.473 -34.550 170.218 161.099 93.950 -66.592 130.565-109.644 92.217-155.478 79.579 -88.477 92.899 75.497 150.825-153.384 96.386 42.264 93.292-121.582 92.607 48.583 122.484 -75.443 90.639 45.494 143.152-103.556 92.133 43.857 120.750-119.108 93.567 57.049 127.623-115.719 94.990-104.694 123.712 -83.498 114.065 125.210 151.535 -59.518 104.637 157.337 131.413-139.964 95.049 49.161 155.040 -21.929 91.009 48.333 0.000 0.000 89.539 48.543 134.475 -34.182 88.981 54.531 139.099 -83.202 88.544 49.611 128.664-135.826 88.153 46.306 109.377 -71.568 92.017 45.174 135.567 -87.425 92.851 49.409 136.199-159.682 93.302 -91.313 150.043 -30.842 119.901-175.914 164.923-157.698 93.744 -53.682 95.557-109.385 90.281 -52.147 108.602 -75.553 91.513 -77.486 117.201 -26.999 86.452 94.674 113.956 -67.171 92.189 43.748 129.623 -77.224 90.315 46.328 142.345 176.992 89.068 47.476 118.849 -30.828 91.284 45.237 135.139 -58.083 92.044 41.915 128.201 -76.521 92.725 53.506 108.920 -89.402 95.321 177.477 128.954 -77.104 92.647 52.254 141.058-116.610 91.609 58.959 131.584 -47.606 90.152 81.432 142.287 -32.785 88.646 58.368 110.226 -87.572 92.573 107.325 99.539 -78.904 92.483 0.000 128.936 -76.108 # 288 total E -1.48394E+02 rmsd from N 0.000 %NC 0.00 125.858-119.828 143.445 -30.249 116.637-106.662 132.037 -26.804 93.381 44.829 111.132 -84.849 91.689 49.290 130.973 -76.983 91.837 46.801 148.139-135.354 91.309 42.048 58.858 -67.126 90.730 47.157 122.601 -27.725 88.671 49.606 131.874-103.456 88.413 46.886 121.236-112.158 90.319 57.300 87.920 -94.279 91.127-165.248 133.497 -82.300 97.426 79.316 129.057-153.204 93.959 39.086 108.230 -85.714 91.453 55.723 150.503-117.818 90.074 53.491 118.752-140.308 90.476 61.991 121.287-127.166 93.010 -65.176 117.593 -67.798 132.203-130.736 127.705 -35.075 92.984 44.825 134.207 -13.541 92.040 48.099 145.690-143.278 90.041 47.425 0.000 0.000 89.277 50.113 107.770 -80.330 89.963 42.576 128.074 -70.604 90.177 45.657 125.296-113.880 90.729 44.996 109.406 -80.215 91.541 48.439 138.497-100.270 92.498 44.775 133.795-148.176 94.543-116.243 149.492 -33.810 105.940-167.417 115.002 -75.985 122.563-123.456 112.592-116.117 97.499 41.572 114.410 -77.169 95.648 38.406 105.814 -39.408 95.381 43.438 144.288 -52.577 92.114 45.963 128.700 -76.963 90.360 43.918 103.992 -85.973 91.126 45.849 129.914 -81.050 90.662 47.704 135.581 -99.328 90.604 43.119 128.764 -77.357 93.181 97.484 106.387 -93.321 89.135 -70.892 129.854 -77.768 92.525 -47.499 142.528-121.509 89.029 -49.671 131.089 -22.331 91.325 -52.150 148.796 -93.911 91.231 -51.432 104.509 -92.028 94.791 81.238 105.598 -79.135 92.500 0.000 128.970 -76.409 # 289 total E -1.46620E+02 rmsd from N 0.000 %NC 0.00 93.130 161.959 137.850 -88.545 93.197 57.581 141.155 52.751 92.222 43.867 106.837 -76.812 92.396 51.046 132.113 -77.001 92.352 39.265 155.553-156.075 90.711 43.862 67.634 -72.638 92.195 46.824 102.250 -49.899 91.278 42.283 144.725 -87.868 90.146 41.461 141.909-151.025 92.368 46.976 81.982-101.245 91.371 141.823 148.750-110.135 88.240 85.901 105.244-154.972 87.249 105.595 100.362 -86.795 90.730 -69.735 125.024-101.824 98.963-122.481 139.598-153.867 91.756 48.353 140.656 138.284 91.139 48.554 133.788 -86.252 90.008 49.393 125.814 -58.891 90.583 48.696 120.636 -31.161 90.570 44.182 109.432 -82.449 89.725 47.346 0.000 0.000 88.694 59.234 111.449 -83.496 87.069 45.593 137.952 -83.416 89.554 45.243 119.990-124.744 88.482 56.136 112.048 -77.786 88.628 54.771 141.660-110.060 89.107 42.829 123.721-144.322 96.246-103.908 104.921 -83.587 111.356-177.637 156.952-141.117 108.850 -75.582 93.971-100.932 120.224 0.411 117.223 -80.199 92.641 -58.993 113.256 -51.482 91.332 -42.979 109.905 -73.026 92.656 -74.006 127.689 -76.524 80.154 112.262 101.621 -80.146 94.003 53.827 142.746 -47.220 89.658 43.866 172.408-154.314 91.459 42.658 128.305 -76.672 92.346 61.357 115.760 -49.834 89.948-119.703 129.923 -77.158 95.193 -37.933 143.178-122.964 91.879 -47.307 121.963 5.269 92.922 -50.574 149.129 -36.605 91.827 -44.198 141.489-161.392 96.843 90.217 104.716 -79.522 92.482 0.000 129.061 -76.252 # 290 total E -1.46650E+02 rmsd from N 0.000 %NC 0.00 93.167 -69.184 128.271 -76.693 117.359-109.445 128.243 -49.614 94.716 36.271 109.386 -81.197 93.265 51.892 128.107 -74.789 93.671 37.140 157.383 -16.721 93.031 49.198 63.929 -86.783 88.306 49.768 116.585 -52.623 87.475 57.301 126.575 -97.813 88.031 68.585 125.054 -96.473 82.145 170.419 92.504 -96.040 132.472 74.227 156.156-164.810 92.234 45.223 104.787-139.634 92.784 44.349 106.670 -88.608 90.608 65.361 149.604-120.499 89.170 45.399 130.074-107.607 93.161 50.224 131.752-111.797 98.227 -8.028 134.935 -80.900 121.614 178.725 152.168 -80.754 107.704 39.394 147.004 7.235 93.481 51.137 109.413 -82.092 91.514 44.959 0.000 0.000 91.018 50.017 108.917 -81.039 90.588 46.409 139.680 -73.384 91.049 42.129 121.014-123.162 90.497 49.239 112.534 -78.996 91.276 52.794 133.059 -99.920 90.262 61.383 137.289-152.871 92.280 2.367 103.974 -85.387 120.002 50.098 156.001 -8.691 131.123 178.565 115.565-111.538 94.703 52.043 115.137 -77.189 91.001 50.679 98.722 -12.184 89.557 50.761 129.032 -13.148 89.415 50.140 130.493 -77.265 87.275 47.733 104.194 -83.670 88.478 51.615 119.593 -27.472 88.451 47.916 140.003 -44.774 89.329 44.648 128.355 -76.598 88.404 53.862 123.291 -61.723 89.356 47.727 128.130 -75.867 90.445 43.817 131.267 -50.203 91.179 45.902 128.426 -35.726 91.034 52.232 135.895-104.511 90.623 42.719 132.499-142.065 96.144 72.574 146.911 -24.318 92.508 0.000 129.048 -76.569 # 291 total E -1.50363E+02 rmsd from N 0.000 %NC 0.00 93.066 162.061 137.553 -87.564 92.965 57.022 121.859 -37.079 93.818 42.904 104.715 -81.819 92.769 47.234 128.542 -74.610 92.033 41.099 110.040 -83.407 93.562 40.820 72.677 -66.924 93.116 41.599 117.674 -46.584 91.493 46.519 144.437 -91.459 89.771 42.533 136.641-131.823 91.663 44.969 80.819-101.757 92.683 38.244 136.383 -84.934 107.958-146.036 98.944 -92.990 106.755-157.688 105.037 -82.524 147.808-121.527 176.433-175.667 104.692-109.836 135.119-138.003 93.841 45.747 149.137 153.669 91.748 47.137 131.624 -83.843 90.159 54.138 126.595 39.062 89.151 48.947 125.034 -40.571 89.526 44.294 110.073 -82.450 91.148 45.821 0.000 0.000 89.371 49.386 137.779 -30.940 88.534 52.184 134.873 -95.383 88.583 50.615 124.586-133.953 88.473 46.570 108.513 -72.616 90.573 50.760 135.547 -79.770 90.897 46.121 133.305-140.907 94.008-116.602 105.333 -83.351 110.124 156.831 155.745-140.807 98.862 -68.283 95.044-107.265 99.559-138.800 112.778 -76.624 102.205 29.818 126.500 -64.486 96.885 46.777 138.486-163.196 114.079 10.307 139.295 -83.374 93.926 48.753 112.502 -84.520 93.638 37.849 97.175 -83.264 91.232 56.852 152.441 -35.272 88.138 48.534 127.975 -76.867 88.447 49.176 90.790 -90.195 89.909 52.707 129.428 -75.542 88.812 45.962 142.769-105.700 89.450 46.976 130.162 -41.461 90.298 54.669 137.826 -49.551 89.486 44.220 138.727-131.572 94.652 81.023 103.851 -80.342 92.531 0.000 128.849 -76.735 # 292 total E -1.46956E+02 rmsd from N 0.000 %NC 0.00 93.451-172.766 138.596 -96.297 93.527 57.538 146.739 7.237 93.609 41.478 105.443 -82.762 92.424 51.678 130.710 -76.307 91.362 44.530 136.908-109.836 89.917 43.650 69.779 -79.345 92.331 40.405 114.464 -57.790 93.504 42.009 133.990 -93.564 90.465 53.514 144.193-142.323 88.495-171.089 82.937 -93.432 91.143 94.741 145.673 178.218 93.780 43.800 92.503-123.562 92.756 42.667 108.134 -89.755 90.905 54.236 149.486-130.188 89.143 54.290 123.093-122.804 89.936 42.770 126.696-115.885 95.512-138.005 121.884 -68.311 126.720 154.178 129.101 56.535 115.729-155.671 109.883-122.168 95.913 50.129 109.326 -82.677 97.506 41.924 0.000 0.000 94.699 39.207 145.166 -7.533 92.976 47.023 142.090-103.280 89.515 52.898 117.224-129.582 88.386 47.691 110.252 -77.738 90.898 57.970 165.340 171.547 88.186 34.504 112.071-167.214 97.312-117.491 148.687 -27.246 106.243-169.193 153.455 -6.552 100.625 -59.042 94.830 -92.075 93.403 -42.912 112.800 -75.977 92.705 -39.404 119.561 -5.895 97.255 -42.017 112.957 -71.531 95.391 -36.632 127.815 -76.544 92.791 -41.903 99.722 -80.440 89.007 -55.416 122.012 -7.062 90.670 -47.160 148.012 -26.826 91.190 -42.167 128.901 -75.814 94.977 -53.214 124.927 -87.567 93.992 119.047 130.145 -76.160 95.275 32.650 138.007 -88.635 92.659 58.391 124.267 22.030 90.812 63.154 150.233 -31.288 88.098 41.388 137.990-146.633 95.167 116.593 143.599-124.650 120.210 0.000 146.288 -80.943 # 293 total E -1.52034E+02 rmsd from N 0.000 %NC 0.00 93.301 172.142 140.523-101.647 93.805 53.640 136.206 36.965 91.978 45.872 105.759 -79.685 92.103 45.478 130.103 -77.088 93.423 46.643 143.545-128.753 93.084 39.432 54.457 -69.674 92.825 44.920 132.764 -20.237 91.317 43.466 135.794-108.184 90.534 51.187 140.393-143.934 87.729 52.422 79.225-103.364 90.854 147.868 131.688 -81.767 93.524 87.953 125.929-149.173 93.633 99.675 99.225 -85.554 93.343 -70.700 145.362 -96.765 100.480-120.524 136.039-145.459 91.102 50.012 140.248 113.235 91.428 46.767 133.363 -85.940 90.621 48.648 134.279 -40.803 89.128 49.492 142.638 -22.428 88.439 49.832 111.012 -82.666 89.662 44.047 0.000 0.000 88.468 53.423 117.701 -78.909 87.173 46.398 134.036 -90.721 89.377 48.144 122.819-128.222 87.572 51.179 109.926 -73.309 89.640 46.522 133.535 -93.408 91.791 47.317 131.905-125.371 94.627 -86.877 106.356 -85.267 126.908 178.212 167.854-164.551 93.385 -53.865 96.380-105.959 90.183 -52.057 110.494 -74.774 91.250 -69.071 112.246 -67.242 86.210 114.624 115.336 -71.258 92.728 49.781 128.272 -75.567 92.491 41.029 107.592 -84.278 94.399 38.013 144.434-102.775 93.788 53.742 148.431-177.571 89.813 48.219 128.329 -76.961 93.326 161.537 79.885 -81.410 90.219 55.174 132.326 -77.640 88.812 49.406 141.011 -99.962 88.146 52.715 109.964 -16.942 89.833 52.062 140.674 -44.984 89.468 40.485 151.000-161.371 94.633 88.258 103.222 -79.998 92.551 0.000 128.706 -76.796 # 294 total E -1.47583E+02 rmsd from N 0.000 %NC 0.00 93.121 -61.046 129.936 -81.558 118.549-108.144 131.225 -54.023 94.334 37.097 109.218 -80.573 92.847 52.644 127.139 -73.636 93.015 38.279 164.688 -9.572 92.515 48.703 72.493 -98.991 88.386 50.830 116.877 -79.611 87.175 60.058 132.148-100.321 87.863 53.096 115.902-101.789 89.242 172.247 89.588 -86.820 114.922 69.565 155.119-158.428 93.520 45.834 96.361-127.709 92.705 43.337 103.085 -85.017 91.993 60.550 148.083 -97.127 90.331 42.519 129.412-122.983 93.539 40.875 131.870-118.764 99.198 -0.613 127.264 -89.172 137.366 175.165 128.638 -86.152 94.390 52.078 137.293 -12.235 92.880 52.547 110.415 -81.549 90.860 47.433 0.000 0.000 89.078 48.370 115.401 -80.321 92.863 47.705 128.710 -77.712 91.841 39.630 124.911-117.045 90.647 53.851 118.156 -76.625 90.136 44.607 134.537-100.382 92.645 52.715 131.468-141.511 96.315 -38.518 103.444 -83.721 126.235-158.139 151.880 -25.677 123.660 -98.354 120.862-123.832 97.979 -15.153 117.564 -78.331 95.812-122.526 123.989 -21.024 93.412 43.393 115.239 -76.051 94.155 55.806 129.694 -76.116 96.291 28.821 101.036 -73.919 93.636 50.416 149.382 -27.570 90.011 48.759 138.971-109.862 90.933 40.656 128.222 -77.144 91.577 44.102 126.506 -71.830 90.893 48.440 131.188 -77.329 94.084 37.811 140.490-124.368 94.716 41.296 128.884 -45.177 97.930 -9.612 128.049 -95.058 139.781 -83.643 105.666 -84.502 98.313 121.095 140.231 -33.080 92.597 0.000 128.610 -76.397 # 295 total E -1.49340E+02 rmsd from N 0.000 %NC 0.00 93.245 -81.584 125.855 -72.929 93.548 -52.966 116.140 -73.051 92.258 -42.487 103.478 -76.600 92.685 -44.869 127.592 -75.239 95.301 -26.817 148.875-148.766 104.750 -42.587 53.266 -80.726 94.586 -32.950 114.314 -47.370 115.216 -81.457 174.618-168.253 140.948 -63.182 133.982 -90.512 91.421 57.474 106.209 -81.757 94.406 44.257 134.333 -96.885 106.117 -54.208 99.722 -97.879 118.719-170.850 144.624-150.131 140.145-124.746 151.301-170.057 108.145-115.660 139.633-157.459 95.603 44.240 147.058 140.088 92.121 46.381 135.674 -84.675 90.556 50.174 125.581 -66.281 91.980 50.408 134.695 -37.125 92.489 40.975 151.876 -15.016 92.195 43.253 0.000 0.000 90.604 58.398 105.550 -84.501 87.291 50.121 139.721 -79.561 89.574 42.546 121.250-126.635 90.329 47.158 113.555 -76.236 91.251 49.283 138.335-103.079 91.767 47.404 137.974-155.318 91.668-116.735 140.439-116.843 109.479-163.471 152.188 -11.906 113.048-130.179 113.346-120.858 94.311 39.113 114.182 -77.051 92.543 49.849 104.799 -28.157 90.984 47.239 127.882 10.486 91.256 43.413 129.535 -77.272 89.685 43.944 101.586 -82.025 89.281 60.383 140.078 -42.074 86.586 52.358 140.917 -49.129 88.508 43.117 128.294 -76.484 88.423 53.011 111.005 -31.384 89.346 49.277 128.756 -76.349 89.072 45.864 142.759-116.222 89.412 50.380 130.451 -43.657 89.396 53.438 135.075 -56.889 90.030 44.507 140.822-129.421 94.794 78.845 104.030 -80.510 92.489 0.000 128.866 -76.804 # 296 total E -1.48571E+02 rmsd from N 0.000 %NC 0.00 93.089 -63.315 127.116 -77.270 94.151 -49.156 117.215 -80.001 90.957 -46.009 103.479 -78.126 90.414 -47.142 128.125 -75.565 91.376 -41.339 139.105-123.883 94.221 -39.399 68.820 -71.442 94.158 -39.944 130.791 -10.712 99.749 -34.790 173.759 166.363 100.313 -54.806 129.419-116.886 95.190-153.558 84.584 -89.067 118.707 66.466 158.066 174.634 93.252 43.208 92.319-120.246 93.577 47.532 106.210 -83.970 92.322 49.081 161.247-119.145 90.254 49.364 136.159-167.740 91.357 38.032 123.493-118.241 98.408-169.958 123.651 -63.033 113.180 178.860 125.325 70.959 109.005 -30.141 106.314-116.109 96.430 -40.548 106.809 -78.551 101.765 -27.306 0.000 0.000 109.992 -25.068 118.419 -88.852 95.016 -47.275 138.028 -88.615 92.045 -45.336 126.127-152.732 89.189 -46.644 115.587 -74.180 89.775 -56.724 124.912 -90.227 89.611 -47.496 160.029-158.882 93.554 -29.589 143.434-134.066 105.484 -44.714 116.548 -84.118 109.023-144.775 98.968 -79.208 99.113 -22.403 112.624 -77.946 98.274-122.276 147.756-143.223 94.595 47.980 123.712 25.260 91.696 52.053 129.200 -75.769 89.287 44.127 100.790 -78.085 91.806 48.429 145.839 -37.600 88.549 46.975 165.573-167.102 90.546 43.126 128.206 -76.623 90.025 47.838 111.467 -36.151 89.932 49.199 130.085 -76.939 89.622 44.148 139.863-124.306 89.883 47.216 129.844 -41.579 89.597 54.198 136.536 -60.636 89.749 44.054 137.066-127.997 94.812 78.809 104.047 -80.471 92.529 0.000 128.864 -76.679 # 297 total E -1.48742E+02 rmsd from N 0.000 %NC 0.00 93.071 161.659 137.534 -87.006 93.233 58.967 134.024 52.898 93.553 39.790 104.959 -80.399 92.148 49.097 131.801 -77.430 90.745 44.644 155.046-154.375 91.285 44.273 60.934 -66.174 90.863 45.269 119.334 -30.360 88.622 46.573 140.910 -98.310 90.924 54.096 115.057-104.904 89.455 60.877 94.019 -93.813 91.660-172.272 132.220 -93.031 96.541 66.373 127.482-151.461 93.472 38.389 98.158 -81.381 91.611 69.495 143.674 -32.923 93.939 51.402 134.684-138.965 96.317 16.727 124.900-126.973 113.637 26.555 151.938 -77.497 94.148 57.528 166.161-125.137 91.668 51.310 148.802 -31.223 91.170 36.209 106.104 -83.406 91.942 47.585 0.000 0.000 91.105 48.956 103.106 -87.289 89.316 50.618 144.961 -77.515 90.156 41.535 121.013-131.919 90.262 48.917 116.677 -76.794 90.933 47.142 141.138-114.135 91.948 53.794 136.966-159.196 91.917-102.656 102.998 -82.725 113.457-176.892 151.738 -17.889 124.122 -66.724 115.250-116.857 111.506 -17.535 113.644 -80.097 93.595 -48.602 111.163 -53.960 91.820 -42.560 110.389 -70.333 91.639 -47.904 127.830 -76.747 91.014 -38.003 101.947 -80.448 89.609 -47.761 118.719 -29.610 90.456 -53.518 151.042 -32.125 88.577 -57.062 128.646 -76.722 88.040-125.089 140.357 6.552 89.506 58.805 133.524 -77.711 92.232 42.709 143.190-122.651 94.380 104.121 131.374 -45.531 92.810 -67.116 144.959 -44.573 95.545 -37.586 135.455-113.949 102.936 168.785 93.819 -72.910 92.802 0.000 129.193 -76.419 # 298 total E -1.46952E+02 rmsd from N 0.000 %NC 0.00 93.043 155.121 140.984 -97.812 93.589 52.275 153.780 126.097 92.030 46.948 106.924 -79.672 91.178 46.830 130.055 -76.129 93.003 41.577 153.864-142.587 94.800 39.826 128.339 172.782 91.707 44.700 119.357 -41.680 91.807 48.534 136.428 -89.957 87.931 45.527 151.028-150.934 92.937 38.242 70.804-104.324 95.517 38.941 144.178 -83.884 96.699 47.673 101.805-103.154 88.086 60.722 137.880-119.270 91.259 58.024 107.997-126.474 95.974-159.869 134.853-147.361 95.948 55.144 147.269 175.232 90.937 52.792 135.088 -84.921 90.120 74.560 124.740 -72.497 94.664 50.171 123.016-159.005 100.485 13.816 144.381-144.547 104.649 40.333 0.000 0.000 95.662 43.544 147.138 -12.859 91.659 49.976 143.550 -92.252 89.035 44.449 117.569-129.771 89.873 50.539 107.567 -72.736 92.241 42.761 137.122 -54.871 93.855 39.620 140.494-147.159 94.335 45.125 150.565 -24.969 95.698 62.312 150.261 -18.841 91.500 52.601 101.209-122.828 91.247 35.506 113.194 -78.574 99.960-120.331 138.890-116.892 122.508 161.284 120.082 -77.124 92.881 -74.547 127.208 -74.893 89.381 -47.969 102.183 -78.498 89.651 -51.185 137.287 -48.462 90.327 -42.549 136.396 -74.632 90.502 -48.580 127.720 -76.010 87.209 -53.815 142.645 -4.193 90.567 -48.661 128.549 -75.374 92.660 -34.310 146.483-157.111 92.957 -48.719 124.019 -14.872 91.825 -66.466 155.111 -26.224 89.178 -58.514 133.002-138.468 92.470 84.194 102.959 -80.194 92.431 0.000 129.008 -76.582 # 299 total E -1.50048E+02 rmsd from N 0.000 %NC 0.00 93.016 151.581 140.102 -94.003 93.547 55.253 134.017 47.651 91.599 45.151 105.900 -81.817 91.916 48.704 129.615 -76.636 91.632 46.956 156.430-152.403 92.686 40.148 60.985 -70.807 93.552 42.923 125.786 -30.199 92.592 41.361 136.142-106.871 90.986 55.167 141.302 166.475 90.188 80.481 84.090-103.268 88.728 -79.279 134.614 -99.170 96.421 -49.698 95.130 -90.330 89.698 -53.588 112.120 -73.688 107.399-102.695 148.554-116.449 94.749-112.318 129.652-138.102 93.587 41.253 139.213-116.039 91.406 53.925 134.495 -75.223 90.126 56.378 120.977 -26.063 89.597 60.632 121.303 -1.325 89.211 19.660 141.007-128.361 106.532-114.787 0.000 0.000 123.194 -66.954 155.154 108.388 119.108-109.837 138.769 -91.701 93.211 48.218 111.100-119.388 94.747 41.684 107.644 -73.483 92.556 47.301 151.033 -41.725 93.652 42.399 128.528-132.375 93.322 49.832 152.261 -22.109 96.063 -2.629 113.942 -87.817 140.429-168.607 102.446 -85.134 94.486 46.605 115.350 -76.895 92.204 50.503 103.722 -8.148 89.125 50.917 132.511 -1.879 91.287 44.975 128.656 -75.917 91.176 41.647 104.296 -84.922 90.328 50.584 118.000 -22.358 90.143 53.035 131.979 -56.122 89.082 40.056 129.955 -77.372 92.384 118.146 110.929-109.156 90.823 -51.765 130.116 -78.524 91.165 -49.533 142.296-125.586 88.662 -50.066 134.438 -57.232 90.376 -54.015 156.922-134.140 90.395 -41.427 106.111 -87.064 96.965 90.618 103.858 -78.298 92.425 0.000 129.246 -76.012 # 300 total E -1.49337E+02 rmsd from N 0.000 %NC 0.00 93.274 -69.378 127.926 -79.151 94.177 -49.779 119.433 -77.385 91.302 -46.247 103.807 -78.756 90.623 -45.894 128.330 -75.598 91.042 -44.791 145.580-139.620 94.271 -38.028 87.090 -78.306 93.689 -45.846 127.267 -99.453 97.000 -36.033 170.460 156.677 96.545 -56.686 140.314-141.987 97.053-136.969 134.400 -14.643 118.883 57.006 126.043 153.485 92.288 43.154 92.344-124.043 96.420 39.313 102.238 -84.873 94.159 52.338 166.285-164.440 92.023 37.344 139.801-125.134 96.400 41.264 121.910-120.247 101.210 1.278 132.033 -77.418 123.875 164.014 137.353 -65.998 103.615 36.918 101.231 160.960 96.281 47.041 109.615 -81.419 111.260 10.784 0.000 0.000 99.385 42.503 166.436 170.699 98.167 33.673 152.831-170.172 91.900 56.208 112.853-151.484 86.661 64.530 111.838 -77.651 89.538 57.788 155.360-122.165 87.771 35.834 119.106 176.795 97.925-105.433 105.615 -82.820 114.932-162.925 153.609 -11.961 99.768 -56.255 98.571 -90.921 94.173 -42.840 112.354 -76.212 92.145 -43.855 113.142 -44.091 91.021 -48.602 105.748 -71.386 90.231 -45.262 127.567 -76.506 89.711 -43.167 101.607 -80.073 90.220 -46.261 137.534 -26.302 92.183 -43.264 142.946 -49.792 91.376 -44.808 129.213 -76.362 90.425 -58.214 130.437 11.053 92.897 125.653 130.035 -75.454 93.416 38.935 140.511-106.490 93.645 53.098 127.685 6.122 101.685-145.361 148.274 -36.950 97.899 38.214 136.160-142.518 117.305 80.071 106.864 -75.901 92.547 0.000 129.619 -76.575 # 301 total E -1.48981E+02 rmsd from N 0.000 %NC 0.00 93.341 174.486 138.670 -95.927 93.786 56.528 126.660 45.359 92.134 42.170 106.119 -81.671 91.381 49.406 131.534 -77.301 88.896 45.943 152.374-157.375 91.677 42.701 59.394 -59.595 91.249 44.064 117.127 -10.018 88.875 48.658 140.848 -98.019 91.390 44.070 110.496-101.236 91.742-173.467 95.169 -83.517 112.427 123.364 142.785-169.396 95.276 42.651 91.409-123.278 96.792 55.261 110.955 -88.906 95.443 -93.769 154.689-138.908 111.884-111.117 144.878-165.749 96.972 42.283 154.497 165.386 93.277 45.933 132.909 -86.432 90.782 50.216 133.550 -69.908 92.776 48.796 88.452-125.090 91.626 39.951 140.297-177.724 90.566 46.349 0.000 0.000 91.532 50.427 101.634 -82.546 89.305 46.316 149.156 -72.639 89.040 41.735 117.167-129.778 91.246 47.329 109.338 -81.823 91.345 46.527 141.453-103.248 92.250 50.683 135.423-165.812 92.894-107.778 105.289 -84.302 107.844 178.066 155.099-138.488 125.817-127.703 114.445-117.100 113.098 26.436 117.474 -79.402 94.478 47.180 113.654 -21.467 94.760 37.729 120.858 -70.115 92.527 52.955 130.479 -77.030 88.203 36.330 102.096 -84.125 93.074-134.471 104.618 -47.400 96.213 -46.223 148.005 -18.429 91.448 -38.642 129.679 -76.448 95.174-151.392 109.417-120.536 92.134 48.326 132.430 -79.029 90.656 49.005 140.690-108.230 90.956 57.885 132.057 -6.076 90.371-140.939 140.663 -92.130 96.468 44.867 138.734-141.574 114.524 49.476 99.062 -79.587 92.563 0.000 129.050 -76.667 # 302 total E -1.50674E+02 rmsd from N 0.000 %NC 0.00 92.849 -56.125 124.587 -66.557 118.786-105.594 132.676 -46.244 92.872 42.354 109.310 -81.085 93.527 50.210 129.878 -76.432 93.455 41.917 158.501-162.849 91.208 43.292 68.657 -98.347 91.344 44.152 114.402 -59.987 91.398 42.157 140.028 -97.913 89.839 52.421 147.189-167.233 87.796 50.130 78.152-106.295 90.858-171.422 127.804 -78.954 95.837 70.383 132.369-158.968 89.206-131.236 104.713 -83.678 132.393-107.372 152.621 173.641 115.009-141.540 136.534-144.140 124.345 15.727 137.975 151.595 95.632 45.162 134.789 -83.562 92.766 43.335 121.663 -47.576 92.032 53.709 122.928 -38.203 88.560 46.392 108.897 -82.322 89.603 46.486 0.000 0.000 90.392 47.539 107.974 -81.829 91.643 43.355 137.956 -79.194 92.889 42.827 120.642-120.839 90.565 50.113 112.054 -77.593 91.142 56.034 125.349 -89.455 91.313 46.105 135.750-138.452 93.671 28.075 153.391 -21.368 115.798 65.937 113.320 -83.283 139.211-179.961 106.694 -92.145 97.252 43.127 115.636 -77.668 91.874 48.707 102.339 -7.180 88.431 56.729 139.579 -8.062 89.500 52.018 129.531 -76.889 87.448 43.982 104.027 -82.150 88.648 59.247 142.067 -31.081 86.641 56.536 159.320-130.450 89.173 38.957 128.034 -76.602 88.866 51.759 111.030 -30.293 89.090 60.919 127.841 -76.154 88.022 46.942 142.246-139.199 90.427 54.350 129.920 -40.855 92.126 -89.864 134.746 -56.048 112.860 -31.935 114.578 -84.438 125.003-155.467 145.662 -8.878 92.794 0.000 129.773 -75.646 # 303 total E -1.47553E+02 rmsd from N 0.000 %NC 0.00 93.270 162.437 140.922 -99.642 93.366 53.930 154.350 62.213 92.088 46.126 107.040 -82.227 91.758 54.030 130.394 -76.592 92.612 41.755 151.355-146.524 92.065 44.469 72.915 -97.378 90.929 43.279 109.619 -73.782 90.078 55.902 135.668 -98.701 89.165 45.165 123.417-112.160 95.497 162.458 84.844 -96.213 112.855 71.706 157.389-128.009 96.568 40.294 94.859-118.673 92.370 48.143 107.624 -85.984 91.612 67.998 143.015-104.658 90.149 40.581 134.196-124.714 94.028 44.896 134.464-118.005 97.958 6.929 128.203 -91.708 123.500 166.561 146.391-110.434 113.012 38.670 157.326 49.491 96.584 54.575 110.068 -82.071 93.447 40.088 0.000 0.000 90.792 57.426 111.965 -80.530 87.464 49.991 144.181 -85.187 90.116 43.297 119.081-130.346 89.424 50.105 115.508 -73.996 90.406 48.657 137.121-105.342 91.831 54.567 133.921-149.345 92.363 -98.475 101.176 -82.368 106.574-175.332 152.697 -13.309 107.150 -7.504 99.156-110.987 116.893 -29.975 121.808 -81.965 112.716-121.488 135.534 -15.027 93.606 40.304 113.973 -75.358 94.428 50.530 129.143 -76.074 99.814 10.455 103.322 -74.130 103.542 49.468 154.541 -18.389 89.982 46.676 151.688-130.683 91.176 42.106 128.241 -77.066 90.393 48.113 114.910 -30.338 90.681 48.677 129.294 -76.852 89.918 49.473 137.418-127.540 91.665 68.632 129.066 -41.280 89.376-101.789 138.605 -78.010 98.197 -24.933 105.789 -85.734 108.348 -85.305 140.724 -21.541 124.425 0.000 145.845 -84.542 # 304 total E -1.48795E+02 rmsd from N 0.000 %NC 0.00 93.283 164.970 140.138 -97.739 93.117 55.114 149.530 22.389 91.912 45.737 106.254 -82.165 91.721 52.964 131.957 -77.376 93.749 40.199 144.920-123.869 91.360 44.027 65.147 -86.371 89.554 49.310 109.625 -57.037 89.116 54.699 125.466 -90.671 87.828 37.188 131.243-116.633 99.073 108.658 87.362 -97.844 123.575-123.954 158.311 -95.257 92.252 51.089 99.316 -97.838 90.954 51.375 111.297 -82.637 92.198 47.167 142.323 -28.561 90.438 45.662 135.853-122.861 93.211 43.867 124.836-117.154 97.138-108.261 121.208 -82.096 102.073 -89.198 140.597-103.753 95.203 81.994 128.495 -78.967 96.857 54.045 140.830-168.225 97.005 34.744 0.000 0.000 93.907 46.961 160.829-170.942 92.124 44.587 124.230-117.960 91.377 46.024 114.190-118.922 91.282 43.941 114.303 -79.996 91.073 51.497 155.989-140.531 91.666 48.451 134.009-124.095 93.584-108.417 106.283 -84.128 108.534 172.288 150.763 -16.106 126.902-159.733 117.497-121.166 96.995 54.281 115.624 -77.124 93.145 43.255 105.894 -9.256 90.902 50.196 116.737 -68.863 89.869 43.600 129.566 -77.565 89.107 48.284 103.452 -84.897 88.635 54.751 117.087 -27.376 88.334 46.294 132.554 -57.910 90.821 44.203 129.082 -76.593 92.986 119.913 113.468-113.261 91.338 -43.655 131.052 -78.142 92.375 -48.354 143.248-136.480 87.755 -51.159 122.692 -2.126 90.875 -53.108 160.718 -19.987 90.456 -44.160 139.743-141.973 95.768 103.634 104.771 -79.705 92.571 0.000 128.810 -76.330 # 305 total E -1.46751E+02 rmsd from N 0.000 %NC 0.00 93.136 -70.716 127.623 -77.901 93.763 -50.463 112.575 -75.455 91.702 -43.253 103.089 -76.604 92.567 -42.135 129.174 -76.298 98.493 -24.828 143.944-132.862 103.461 -37.220 61.266 -79.052 95.877 -25.981 130.273 -32.037 106.166 -39.453 172.028-122.970 97.495 -63.317 125.446-107.302 93.723-110.070 84.916 -85.014 120.537 76.870 155.932 163.178 92.938 46.590 91.308-113.231 94.101 48.958 94.888 -75.592 93.216 51.913 144.479 -10.567 91.080 40.553 135.364-128.375 94.952 37.451 129.791-116.401 102.126 -80.372 122.925 -84.415 132.047-134.282 100.383 -34.138 93.228 51.883 153.397 -46.349 96.282 47.128 146.803-136.942 96.722 35.973 0.000 0.000 90.353 53.629 156.571 177.278 92.177 45.778 103.703-115.545 90.556 41.790 119.611-112.689 89.983 52.086 115.145 -78.240 89.389 51.878 138.692-100.538 90.167 43.302 128.699-149.460 94.279-111.814 104.400 -83.199 105.410-166.428 154.092-135.057 96.020 -60.116 94.090 -98.994 90.980 -45.189 110.482 -76.061 90.931 -49.295 96.745 -65.955 88.327 -47.180 116.960 -73.563 90.900 -44.831 127.074 -76.061 87.945 -48.421 101.672 -79.432 86.547 -61.171 130.827 -63.257 86.332 -47.700 146.568-125.236 89.995 -44.178 127.427 -75.860 87.380 -54.384 119.833 -39.933 89.157 -52.741 129.277 -76.130 88.565 -41.825 140.020-175.938 89.789 -50.821 130.152 -30.142 89.864 -52.916 151.985 -18.792 90.983 -44.456 144.309-154.801 95.899 97.719 104.705 -79.757 92.535 0.000 128.917 -76.317 # 306 total E -1.47855E+02 rmsd from N 0.000 %NC 0.00 93.230 163.983 141.230-101.275 93.740 52.490 139.400 24.983 92.134 46.056 106.417 -81.331 91.592 46.863 131.631 -77.732 95.271 43.953 141.785-113.515 92.380 41.162 54.953 -73.485 90.109 49.006 130.992 -35.257 89.260 56.781 121.504 -95.273 86.821 38.908 132.112-116.808 97.833 112.534 85.007 -99.092 110.073-120.361 164.388-115.973 94.613 46.900 94.356 -97.889 91.653 50.543 97.396 -69.007 93.305 44.191 149.038 -36.175 90.523 47.560 136.664-134.416 92.465 42.907 124.221-119.189 96.198-116.982 120.035 -84.145 97.036 -45.533 139.359-100.487 98.293 120.610 144.916-143.698 120.967 24.543 149.929-158.270 101.398 38.812 0.000 0.000 96.151 40.930 155.335-165.853 92.083 48.494 147.636-106.611 89.915 45.236 111.574-130.066 89.031 48.180 116.284 -77.591 90.871 49.554 147.092-123.411 90.212 46.307 123.406-163.851 93.813-122.781 104.600 -82.359 107.707 172.722 154.436-137.829 93.433 -62.683 93.992-102.405 88.471 -50.589 109.721 -75.930 89.005 -52.903 117.588 -42.452 88.265 -47.303 116.252 -75.823 90.437 -44.040 127.060 -75.733 88.485 -47.607 103.148 -79.840 88.246 -52.626 146.932 -32.999 90.059 -42.976 158.139-149.624 90.823 -45.875 128.138 -76.497 90.621 -59.670 123.128 -55.952 90.351 118.840 131.968 -77.909 94.503 42.625 141.187 -98.321 93.747 80.068 129.835 -24.412 92.341 -72.309 145.850 -41.169 99.638 -54.789 140.149-128.018 98.295 123.546 103.808 -78.467 92.480 0.000 128.870 -75.987 # 307 total E -1.46391E+02 rmsd from N 0.000 %NC 0.00 92.602 82.563 133.972 -81.378 94.592 49.561 123.517 -31.749 93.811 43.644 105.452 -81.352 92.166 47.251 128.110 -75.022 91.385 45.346 107.796 -80.488 90.793 43.209 83.908 -66.191 89.261 45.766 112.720 -61.227 88.559 49.411 124.424 -89.656 90.435 45.750 121.582-100.072 90.136 41.241 122.846-120.436 95.586 70.781 112.117-118.019 107.355 -72.785 97.165 -95.118 93.972 129.170 99.925 -82.084 93.066 71.348 139.803 -48.530 91.902 36.937 135.534-127.629 95.363 44.825 138.180-100.352 100.476 -27.840 122.781 -65.504 141.604 168.096 111.008 -39.915 102.370 35.660 163.473 140.828 98.188 39.862 141.788-129.158 107.820 24.705 0.000 0.000 95.308 45.544 150.402 -5.611 93.238 47.389 169.743-166.387 90.277 47.651 114.612-149.444 89.335 47.550 108.158 -71.527 91.730 45.340 146.116 -39.021 93.256 59.230 139.348-150.086 93.266 -66.581 155.193 -26.687 115.220 -82.482 116.122 -79.476 113.121-106.002 128.592-141.455 96.317 -31.982 114.739 -79.801 95.248-119.459 129.598 -35.125 91.339 51.337 129.814 31.129 92.542 49.308 129.362 -75.932 90.575 39.912 105.283 -78.832 90.758 52.895 140.334 -24.869 88.480 48.043 141.051 -49.468 89.626 41.674 128.213 -76.613 89.100 52.602 117.931 -32.173 89.082 50.361 129.641 -76.432 89.159 43.125 142.945-113.594 89.974 46.435 129.449 -39.426 89.556 57.226 141.906 -47.688 88.548 45.424 139.914-141.494 93.681 95.110 103.591 -80.694 92.579 0.000 128.725 -76.779 # 308 total E -1.50698E+02 rmsd from N 0.000 %NC 0.00 93.087 -70.120 124.732 -65.424 122.406-104.580 131.495 -38.561 93.178 43.548 109.663 -80.985 93.593 48.093 130.500 -77.152 95.082 41.720 153.857-142.602 90.786 43.537 65.239 -92.773 92.642 40.610 117.979 -56.681 96.772 37.851 130.233 -94.579 90.614 43.878 149.099-158.888 91.571 56.689 78.545-106.519 90.241 135.788 132.257 -86.809 94.820 72.407 126.960-150.356 93.259-169.637 101.062 -85.768 136.716-141.201 160.933-155.099 104.255-112.327 152.163 -32.721 92.953 47.381 142.447-109.200 92.674 48.188 137.648 -73.296 91.752 43.506 126.765 -58.600 92.706 46.364 127.256 -11.598 91.598 44.592 141.077-138.092 91.478 46.193 0.000 0.000 93.727 41.252 103.390 -85.772 91.525 44.007 174.121-161.611 91.450 47.996 104.118-134.580 90.099 46.400 108.163 -76.237 90.338 51.709 150.098 -90.492 91.753 39.668 139.707-135.987 93.893 46.058 113.565 -89.162 96.928 2.580 139.008 -90.623 136.553-164.385 108.628 -98.857 94.014 48.934 114.728 -76.962 92.049 49.762 100.398 -7.954 89.890 48.050 116.462 -2.468 90.349 49.577 131.364 -77.446 89.362 41.609 104.387 -84.480 90.206 46.950 119.198 -26.143 88.514 54.989 141.235 -45.793 87.504 46.184 128.473 -77.152 89.264 85.575 116.609-111.373 85.073 -77.637 129.189 -77.061 95.216 -57.885 145.984-148.453 92.979 -37.099 110.652 32.783 91.671 -52.999 145.625 -46.829 94.546 -33.026 143.438-174.218 99.992 73.044 102.619 -79.275 92.502 0.000 129.074 -76.530 # 309 total E -1.47702E+02 rmsd from N 0.000 %NC 0.00 93.030 -53.808 126.159 -71.010 120.627-102.527 134.766 -44.243 93.921 41.097 109.670 -80.392 93.603 48.056 130.261 -76.482 94.615 38.694 154.346-151.572 94.608 42.332 67.918-100.549 89.039 47.686 107.144 -58.680 88.755 63.688 138.419 -84.756 85.355 47.147 131.345-123.592 90.303 40.534 72.410 -93.942 94.680 162.756 134.828 -55.448 93.796 75.488 139.675-169.322 90.212-132.757 108.417 -81.639 134.079-127.093 157.757-171.763 107.290-117.353 135.797-160.997 94.852 45.914 143.149 142.645 91.761 47.171 134.176 -84.879 90.499 49.958 119.767 -65.974 91.133 51.204 125.220 -33.487 91.259 42.149 107.886 -82.363 89.868 47.432 0.000 0.000 89.929 58.167 103.025 -84.535 86.746 46.629 142.500 -79.707 90.571 43.154 119.399-127.192 89.471 51.532 114.673 -74.661 89.947 49.419 134.374-103.146 91.011 48.188 132.573-149.890 94.621-108.671 104.492 -83.509 113.765-173.664 158.599-144.664 97.796 -51.917 96.830-108.558 92.339 -46.452 110.512 -77.424 88.310 -79.465 116.876 -29.848 89.791 -58.382 100.561 -66.654 91.601 -32.448 128.051 -76.714 94.758 -45.276 100.315 -80.863 92.048 -40.834 136.827 -16.132 95.091 -56.638 151.102 -25.617 92.851 14.902 130.204 -77.751 130.838-125.644 147.104-131.423 93.337 54.580 127.502 -74.764 93.244 59.225 140.794-108.201 96.058 30.370 126.405 -45.785 94.143 57.402 152.308 -6.018 89.835 37.087 132.791-143.304 97.081 61.318 102.702 -79.309 92.500 0.000 129.150 -76.636 # 310 total E -1.47943E+02 rmsd from N 0.000 %NC 0.00 92.610 76.032 135.117 -81.857 93.665 57.300 141.514 43.323 93.833 41.099 105.882 -81.949 91.897 49.918 132.026 -77.220 92.747 42.530 146.712-135.360 91.041 43.310 60.072 -72.382 90.937 45.090 119.443 -37.837 90.553 46.278 133.487 -96.903 89.977 47.202 133.222-123.671 91.681-174.613 84.880 -93.624 113.830 107.754 151.963-169.732 94.486 46.336 92.272-122.913 96.747 57.550 109.267 -87.903 95.291 -91.099 158.638-141.803 110.961-113.114 141.988-163.936 95.710 44.310 155.090 161.670 93.087 45.348 132.991 -86.538 90.797 49.961 130.366 -72.241 90.700 51.128 88.546-125.282 89.918 42.621 133.624-169.110 90.504 45.416 0.000 0.000 90.160 51.401 108.583 -88.856 88.244 51.126 146.202 -83.514 87.215 48.615 119.609-134.483 88.665 46.495 104.543 -70.026 93.948 48.003 129.658 -47.394 96.953 2.727 139.517-126.605 115.991 46.308 112.532 -85.538 100.804 26.343 148.709 -23.311 107.392-147.336 100.417 -97.710 93.278 -14.630 113.492 -76.989 104.929-118.427 138.873 102.510 157.698 156.184 138.437 -89.133 92.508 55.094 128.820 -75.966 91.025 46.819 97.749 -79.603 90.434 57.454 140.880 -22.850 87.409 49.877 143.740-103.984 89.753 42.254 128.071 -76.548 91.339 46.318 129.897 -51.635 90.444 45.164 130.865 -76.941 91.209 45.282 138.010-123.464 90.015 48.075 129.040 -44.310 89.785 53.593 135.381-104.719 90.084 42.896 130.461-131.955 95.518 74.062 104.040 -80.373 92.497 0.000 128.989 -76.678 # 311 total E -1.47301E+02 rmsd from N 0.000 %NC 0.00 126.575-115.231 142.423 -26.211 120.320-104.287 131.037 -43.255 93.109 44.955 108.227 -79.321 92.842 45.110 130.164 -77.073 93.594 44.826 152.121-155.300 92.856 43.163 52.889 -66.620 90.860 45.923 126.046 -19.606 88.498 46.748 131.185-109.540 92.640 58.531 123.158-110.850 89.392 78.586 120.545-125.838 94.991 -70.759 97.545-119.799 97.840 -58.010 95.471 -99.367 95.673 -67.351 143.228 14.214 113.856-161.424 162.760 -19.227 114.497-105.788 144.197-155.431 93.775 44.649 145.278 147.439 91.396 46.560 133.891 -84.697 90.729 49.346 135.662 -61.335 92.929 41.871 121.104 -34.140 99.084 25.566 109.127 -82.124 100.198 39.053 0.000 0.000 93.894 47.088 135.379 -22.383 89.338 54.346 144.680 -90.075 88.881 39.946 131.200 177.141 93.744 99.123 107.053 -74.641 94.953 -13.378 147.209 -47.614 98.486 -79.070 135.813-116.742 92.100 4.317 113.841 -90.854 109.418-156.689 159.137-131.451 104.323 176.697 90.596-100.402 94.755 47.221 115.096 -77.365 93.582 43.201 105.045 -20.146 95.252 39.093 125.212 -77.553 95.432 39.381 128.644 -75.924 96.247 37.499 101.688 -84.612 93.435 49.394 139.550 -26.983 91.982 44.259 125.831 -81.570 91.720 39.760 128.902 -77.235 93.873 82.551 110.727 -99.619 90.846 -89.969 129.184 -76.834 93.276 -42.836 144.255-125.578 92.440 -57.167 120.019 -7.155 94.539 116.612 147.961 -33.958 100.266 28.858 142.791-162.557 99.438 34.131 104.163 -78.377 92.450 0.000 129.304 -76.482 # 312 total E -1.47571E+02 rmsd from N 0.000 %NC 0.00 93.055 155.641 137.921 -87.259 93.250 56.730 141.915 50.424 92.573 44.219 106.556 -82.503 92.049 48.054 131.205 -77.402 93.889 45.581 156.357-140.743 91.903 41.018 61.189 -77.589 92.443 44.359 125.068 -46.339 93.623 39.785 130.641-107.670 91.373 51.154 147.333-174.826 87.530 53.934 83.494-110.427 92.420-176.164 135.339-105.166 91.129 95.637 106.722-156.060 85.298 79.608 105.922 -84.170 90.982 60.446 112.523 -95.813 88.742 41.023 142.201-136.347 92.952 61.073 134.037-103.054 95.073 -58.757 117.685 -76.941 125.483-144.429 143.187 -89.221 93.788 46.223 86.459 115.274 96.546 48.308 110.517 -81.405 101.371 21.487 0.000 0.000 109.005 29.586 174.195 163.482 95.841 43.756 155.093 164.663 90.702 47.994 109.915-143.500 89.541 46.682 112.654 -77.334 90.848 49.477 158.716-141.750 91.075 44.206 135.831-146.545 94.489-120.698 103.532 -81.450 108.173 176.962 151.146 -17.112 94.060 -61.071 94.255-100.875 88.315 -50.920 110.049 -75.835 89.380 -51.085 126.559 -46.701 88.508 -50.102 111.254 -71.082 91.081 -37.470 127.121 -75.418 93.617 -40.537 99.346 -80.002 93.137 -36.366 151.404 -23.654 97.749 -41.553 129.462 -75.121 93.534 -36.064 130.049 -76.620 94.055 -55.620 119.773 -55.324 94.087 127.609 130.068 -76.128 94.093 39.409 135.926 -82.752 94.131 53.363 122.812 11.562 94.679-136.764 147.874 -41.410 97.270 21.961 136.324-139.724 123.341 105.607 104.946 -79.860 92.464 0.000 129.745 -76.421 # 313 total E -1.46949E+02 rmsd from N 0.000 %NC 0.00 93.526-178.840 139.700-100.072 93.646 54.311 141.023 43.961 92.348 44.014 104.070 -78.065 92.191 49.283 131.122 -77.304 94.114 41.426 146.510-136.915 92.585 40.500 55.622 -75.222 91.515 46.692 165.844 -47.701 90.109 45.790 143.233 -85.924 90.026 43.374 133.331-123.558 89.748 45.922 86.749-103.365 92.303 155.491 136.277 -99.057 90.418 73.771 107.886-150.691 95.132-173.600 99.208 -86.457 114.101 177.177 151.845-160.117 123.278 -98.504 156.459 -20.857 93.590 47.835 142.707 -98.611 92.442 45.256 134.570 -72.751 90.983 49.562 103.830 -12.601 90.039 46.300 157.416 95.036 91.615 44.946 110.463 -82.652 92.859 41.002 0.000 0.000 91.095 49.886 139.496 -21.435 88.930 58.478 140.798 -96.056 88.433 51.705 124.741-130.942 89.721 46.029 110.426 -75.395 93.013 113.815 137.329 -84.806 97.079 64.989 141.122 165.181 96.770 78.156 152.683 -21.739 132.477 -41.011 119.666 -92.794 105.304 -40.526 97.607 -89.046 95.187 -35.873 115.062 -74.858 91.996 -56.413 106.715 -50.258 86.616 -49.732 112.644 -73.059 90.953 -41.684 127.367 -76.183 89.157 -47.531 101.642 -78.533 87.063 -59.214 145.902 -36.763 87.990 -47.534 147.907-115.172 90.869 -41.330 127.750 -76.149 89.292 -49.215 122.811 -11.267 90.632 -53.975 128.228 -76.262 89.362 -40.845 143.690-149.611 90.197 -46.230 122.557 -7.090 91.970 -53.024 151.240 -22.331 90.877 -44.228 143.192-167.475 96.269 94.957 104.465 -79.769 92.443 0.000 128.934 -76.322 # 314 total E -1.47305E+02 rmsd from N 0.000 %NC 0.00 93.185 170.918 139.585 -98.163 93.673 54.585 138.764 53.304 92.759 43.893 106.207 -81.485 91.958 46.696 130.994 -77.538 94.089 46.920 150.917-144.367 92.907 39.613 58.783 -75.000 93.007 44.220 124.947 -36.191 94.578 37.842 130.203-103.959 93.087 52.163 151.641-155.978 88.179 53.059 81.745-106.790 94.307 149.186 125.112 -84.803 93.867 53.318 130.742-154.315 106.488-144.482 100.270 -84.048 127.240-152.505 162.602-148.616 104.682-112.999 152.178 -30.516 93.421 45.567 147.107 149.952 92.297 47.028 136.858 -81.473 91.254 46.091 118.775 -48.663 91.267 48.052 112.143 -33.469 89.347 47.301 153.273 -22.086 90.192 47.178 0.000 0.000 91.122 44.251 110.909 -77.025 94.641 36.332 139.635 -78.849 96.200 40.706 132.652-128.630 93.515 43.735 114.096 -79.860 91.545 55.837 144.394-111.219 92.479 67.111 138.705-147.256 92.594 -26.687 155.231 -22.112 127.738 115.408 110.450 -73.635 110.099 -85.199 96.033 -86.523 116.660 -4.887 117.373 -79.260 92.298 -58.336 108.177 -55.482 91.358 -46.323 109.327 -71.691 89.835 -48.784 128.095 -75.103 90.556 -37.256 105.772 -84.130 91.880 -52.092 100.263 -60.194 86.819 -48.217 176.434-140.498 99.065-116.980 127.217 -77.177 86.043 130.852 121.696 -86.389 90.837 -50.590 129.654-102.236 90.068 -48.164 143.699-119.722 87.491 -58.560 134.273 -18.163 89.766 -57.523 150.607 -24.313 89.809 -29.339 132.735-115.405 103.591 102.220 97.960 -75.193 92.544 0.000 129.650 -76.103 # 315 total E -1.46651E+02 rmsd from N 0.000 %NC 0.00 92.514 62.268 137.587-102.237 133.896-174.024 135.104 -10.967 96.411 -41.636 106.258 -74.748 91.976 -50.477 128.417 -76.235 92.045 -35.967 136.588-114.481 93.168 -47.275 62.689 -55.540 90.055 -39.093 130.380 26.772 99.137 -45.231 169.486-170.281 90.683 -46.162 124.713-113.998 92.319 119.956 87.963 -84.715 92.088 156.504 152.795-109.136 91.853 65.431 99.094-143.022 95.049 165.699 94.988 -86.123 93.480 38.994 136.000-120.428 94.950 55.576 136.540-156.264 93.319 48.282 143.266-118.297 95.352 -97.825 153.474 -78.677 119.508-120.963 129.729 -49.378 93.108 42.609 133.966 -13.203 93.637 46.141 153.955 -18.496 90.195 46.462 0.000 0.000 89.414 51.453 104.046 -84.321 88.994 47.777 143.228 -74.255 91.141 41.440 123.946-126.872 89.816 47.529 114.116 -76.908 90.430 53.639 132.482-101.778 90.895 48.741 144.188-134.102 91.021 32.302 140.981-123.503 113.064 7.257 149.791 -24.990 114.079-159.786 96.467 -83.860 94.051 50.274 114.480 -76.939 91.053 74.050 93.849 -26.989 90.822 59.174 116.967 -3.606 90.216 47.027 131.146 -77.038 88.692 46.578 102.305 -82.301 90.671 90.303 131.379 -36.296 87.759 54.201 146.402 -49.336 89.403 44.675 128.393 -76.636 88.257 59.543 127.131 -19.370 88.446 53.693 128.493 -75.483 88.866 43.687 133.645-128.463 89.873 50.682 131.319 -41.195 89.732 53.539 136.778 -53.258 89.968 44.455 139.674-124.871 94.677 79.492 104.168 -80.492 92.515 0.000 128.927 -76.648 # 316 total E -1.48665E+02 rmsd from N 0.000 %NC 0.00 93.171 160.064 139.647 -94.489 93.261 56.134 135.577 49.277 92.187 42.946 106.563 -83.033 91.689 49.807 130.591 -76.850 91.639 45.865 152.060-152.564 92.715 42.674 62.905 -72.835 90.488 44.908 127.717 -45.604 88.967 57.979 132.046-114.226 87.614 63.590 116.752-113.352 83.452 167.226 88.912 -92.211 94.381 72.536 141.792-156.705 94.266 39.969 92.100-119.947 94.091 43.181 105.238 -83.120 93.613 45.818 143.418 -89.976 93.995 43.599 134.880-146.491 94.851 28.086 121.428-120.957 107.086 16.680 150.681 -77.363 137.057 -64.469 131.731 -67.792 129.180-161.811 87.158 -54.983 130.566 99.502 115.746 -81.648 95.791 38.921 0.000 0.000 89.651 58.420 117.989 -79.313 89.398 44.037 129.029 -92.814 90.173 51.247 135.293 173.312 87.235 55.177 112.455 -75.113 90.189 45.565 131.315 -99.295 91.679 53.999 132.752 171.746 93.244 -85.610 103.258 -83.624 121.055 157.882 151.598 -15.914 130.974-176.801 112.746-109.344 95.907 45.435 115.397 -77.364 92.110 47.768 105.153 -14.641 90.632 49.091 125.812 -16.512 91.173 44.347 129.432 -77.444 89.273 48.384 103.077 -84.005 88.715 67.921 120.214 -32.887 87.746 50.954 131.345 -53.226 89.561 42.559 128.211 -75.779 92.119 85.667 119.469-114.493 87.070 -87.614 128.575 -76.700 91.956 -49.095 143.097-121.453 90.518 -45.620 116.604 2.779 91.501 -48.847 145.673 -43.439 92.523 -44.442 112.289 -83.171 96.857 90.298 106.046 -78.853 92.447 0.000 129.191 -76.346 # 317 total E -1.48637E+02 rmsd from N 0.000 %NC 0.00 123.544 -94.779 148.360 -52.939 94.441 -51.779 115.022 -74.280 92.103 -43.413 103.644 -77.022 91.215 -45.079 130.136 -76.745 93.712 -37.458 136.939-121.605 94.342 -43.862 64.812 -68.610 91.833 -31.825 124.518 -33.697 107.341 -31.840 168.827 156.850 95.539 -46.122 130.996-108.249 93.101 125.409 87.367 -83.081 121.425-165.374 140.204 -86.318 93.496 29.780 99.629-115.004 114.828-130.773 148.118 -11.472 91.664 60.196 138.274-111.227 93.471 65.850 136.003-159.097 92.788 37.073 121.938 -79.766 99.959 -95.229 152.676 0.459 117.017-131.284 130.813 -44.197 93.611 45.490 151.357 -15.808 93.010 45.256 143.481-158.235 90.879 44.914 0.000 0.000 90.295 49.319 107.773 -83.751 90.918 45.270 138.998 -77.095 92.112 40.361 121.300-122.743 90.485 48.723 111.854 -76.417 91.339 56.048 131.462 -93.957 90.624 42.203 140.476-149.822 93.038 38.023 152.545 -22.215 102.732 -2.522 113.140 -85.923 142.031-158.643 101.713 -81.672 92.501 53.877 114.969 -76.231 91.352 53.513 99.016 -4.314 88.278 51.979 133.062 4.927 89.729 48.374 130.006 -77.166 87.969 46.793 106.147 -84.346 88.190 52.031 118.433 -20.468 89.208 52.000 136.800 -44.392 88.946 39.885 128.286 -76.431 90.424 106.608 122.764 -75.186 91.463 49.526 130.670 -78.117 90.635 44.720 142.468-121.200 92.102 54.420 128.990 -35.689 91.799-140.841 132.111 -66.523 95.081 30.785 107.536 -85.382 116.421-150.050 105.779 -76.727 92.869 0.000 129.613 -76.082 # 318 total E -1.46570E+02 rmsd from N 0.000 %NC 0.00 93.140 -72.442 128.572 -77.784 114.851-112.846 127.649 -49.275 93.897 36.119 106.944 -80.490 93.194 54.212 129.191 -75.819 91.710 42.338 147.062 -7.331 91.716 45.570 69.600 -89.045 90.488 45.434 114.694 -61.178 91.163 123.987 129.964 -98.734 103.802 -2.861 122.311-125.622 101.082-136.231 82.204 -92.905 92.488 75.377 155.985-172.573 93.825 40.914 99.413-132.809 90.916 46.863 143.245-128.668 89.163 70.941 135.264-145.367 87.814 54.950 130.752-147.873 89.820 46.457 131.052-103.832 95.712 -71.272 121.215 -67.855 127.307-158.320 146.930 -92.437 93.291 48.771 150.006 -11.812 90.887 47.932 109.874 -82.748 91.312 44.663 0.000 0.000 90.170 47.103 115.089 -78.042 89.755 44.998 142.975 -82.191 91.036 43.450 121.768-129.054 89.651 48.752 111.640 -76.097 90.532 42.980 130.711 -93.595 93.821 56.819 134.778-142.879 96.451 -38.226 105.830 -85.701 130.099 131.573 153.382 -14.788 119.079 -32.824 119.407-125.922 96.936 -46.752 114.503 -79.299 94.893-122.347 130.191 -48.319 92.163 59.859 123.170 -72.423 91.286 45.386 129.231 -76.170 90.055 41.400 103.642 -78.102 91.250 52.157 147.279 -31.122 88.011 48.630 161.888-158.861 90.293 39.793 127.860 -76.484 89.869 49.537 118.858-108.398 89.042 53.632 130.112 -77.587 88.152 45.753 141.617-131.659 90.249 55.649 128.865 -41.194 90.411 -95.120 136.360 -53.956 117.009 -5.390 115.744 -86.599 131.290 109.455 145.346 -17.600 92.504 0.000 129.982 -75.974 # 319 total E -1.49655E+02 rmsd from N 0.000 %NC 0.00 124.125-101.003 147.261 -47.696 94.274 -52.464 114.196 -72.993 92.671 -42.125 104.591 -75.209 91.727 -43.359 131.247 -77.645 95.719 -36.415 138.681-122.561 93.735 -46.611 66.457 -68.832 89.471 -32.319 124.771 -27.630 111.615 -31.768 167.482 139.714 93.591 -47.009 128.086-117.790 92.665 124.692 83.400 -83.585 114.036-163.974 137.173 -82.703 93.540 32.603 100.465-117.300 115.037-131.809 148.235 -12.747 91.957 61.526 137.399-111.677 93.251 64.747 135.846-157.946 92.638 34.733 123.791 -81.163 100.246 -97.282 152.971 3.499 116.380-130.871 130.699 -43.689 93.617 45.207 151.254 -17.824 92.974 45.756 143.076-163.015 90.576 44.698 0.000 0.000 90.369 50.637 107.184 -83.707 89.479 45.551 144.710 -79.096 91.768 41.062 119.658-126.999 89.795 49.669 111.696 -75.897 90.511 60.488 133.413 -96.399 89.718 41.339 140.831-150.430 93.093 40.241 152.430 -22.245 100.323 -11.296 114.398 -86.653 139.537-155.769 102.453 -84.930 91.987 57.760 114.495 -76.139 91.871 52.958 104.368 -33.661 88.761 49.798 135.016 -8.369 90.735 47.320 130.043 -76.851 90.283 42.371 101.859 -83.364 89.478 51.270 129.926 -63.200 89.297 67.068 133.869 -47.003 87.711 49.579 128.897 -76.824 90.343 177.308 98.383-102.036 91.272 68.330 168.611 -90.839 90.075 46.620 140.950-103.420 90.695 44.851 122.121 -26.672 91.632 56.327 147.894 -33.637 88.849 43.674 139.611-148.089 94.457 85.821 103.349 -80.019 92.536 0.000 128.840 -76.661 # 320 total E -1.46550E+02 rmsd from N 0.000 %NC 0.00 93.335 174.538 139.925 -99.250 93.499 56.282 144.965 22.675 93.118 43.695 106.254 -82.552 92.119 48.204 130.668 -76.504 94.315 41.601 138.817-116.054 93.040 41.261 58.169 -75.240 92.777 41.853 120.982 -35.831 91.619 46.282 135.008 -89.874 91.329 44.164 132.750-109.923 95.789 105.577 87.007 -99.414 108.144-111.981 150.085-104.009 95.137 55.942 123.246-144.905 94.443 39.711 104.092 -86.910 91.246 55.254 149.877-109.876 89.795 46.076 120.922-138.526 92.900 61.960 123.989-119.892 94.993 -65.655 124.587 -65.061 115.126-174.187 146.411 -68.158 96.976 51.622 157.409 -32.778 93.172 43.761 142.747-163.759 92.757 42.464 0.000 0.000 91.571 48.328 114.614 -84.800 90.745 45.393 140.310 -84.907 90.578 43.654 119.284-124.689 89.161 52.064 114.078 -81.860 90.166 54.157 133.438-106.523 90.780 50.170 131.292-153.383 93.741-103.113 141.075-120.472 105.397 166.035 152.061-134.502 139.351-106.901 105.735 -93.349 86.881 76.341 112.699 -74.289 89.676 58.523 130.474 -62.958 88.438 46.618 111.647 -71.646 90.859 43.040 127.630 -75.648 90.047 51.604 106.489 -85.391 89.322 46.740 126.001 -90.528 92.554 89.701 133.502 -95.877 88.879 -65.960 128.705 -77.108 113.903-118.055 115.354 63.443 91.319 52.735 130.582 -77.139 90.981 46.821 139.847-102.478 90.314 48.264 128.151 -36.316 90.727 51.561 136.227 -88.770 90.596 44.405 137.369-150.362 95.211 74.123 104.159 -80.264 92.534 0.000 128.989 -76.709 # 321 total E -1.47778E+02 rmsd from N 0.000 %NC 0.00 93.167 -65.392 129.559 -84.857 94.429 -47.048 120.170 -82.167 90.579 -47.744 103.243 -77.206 90.072 -50.968 128.176 -75.702 89.266 -39.890 140.751-131.994 92.326 -45.117 62.940 -65.989 91.178 -34.845 125.211 -16.438 105.258 -33.682 168.248 129.623 94.928 -45.817 129.559-120.163 93.069 123.990 83.998 -85.768 113.267-162.233 136.145 -86.869 94.293 28.131 99.424-116.786 115.092-130.423 148.484 -12.405 91.961 62.789 137.608-109.840 92.439 63.848 135.913-156.776 92.177 32.458 120.278 -80.202 100.436-101.116 151.245 0.141 116.722-128.971 128.206 -40.891 93.064 45.323 150.071 -23.882 92.443 47.073 143.199-162.359 90.123 44.889 0.000 0.000 90.135 52.550 106.862 -81.077 87.973 45.135 146.398 -78.278 90.832 42.550 118.975-127.267 89.773 49.884 109.043 -76.405 88.491 55.593 136.194 -89.703 91.192 43.059 137.639-129.262 93.086 40.268 108.153 -85.997 100.559 9.274 152.500 -29.851 135.400-108.924 112.305-104.772 128.531 29.090 119.843 -82.240 91.496 -65.045 111.412 -42.935 87.883 -52.803 116.173 -68.611 91.897 -40.983 125.876 -74.727 93.208 -32.200 99.067 -82.158 100.814 -31.443 138.826 -18.257 94.129 -54.094 151.730 -28.527 91.592 -39.022 133.257 -78.961 94.059-152.918 108.113-105.604 93.741 53.025 130.967 -77.069 92.906 42.563 140.503-114.467 93.974 57.988 123.641 -6.316 95.350 -80.069 137.543 -86.959 118.325 -46.641 103.181 -88.329 96.436 131.254 104.262 -77.432 92.565 0.000 128.547 -76.197 # 322 total E -1.52579E+02 rmsd from N 0.000 %NC 0.00 93.061 157.126 139.408 -92.760 93.825 53.979 133.654 50.265 91.407 47.827 106.914 -76.678 92.254 42.570 130.775 -77.636 94.950 46.623 151.720-143.002 95.209 36.517 50.565 -68.529 93.029 47.177 156.850 7.794 92.073 43.076 135.994-106.427 91.021 49.590 147.715-166.223 87.870 49.918 75.956-107.817 92.441 143.758 134.345 -84.479 89.134 77.639 104.639-132.461 91.934 108.785 98.130 -84.603 91.910 -60.971 140.016 -52.333 95.647-125.989 140.988-137.450 90.833 48.950 134.396 123.990 91.608 47.213 134.485 -85.354 90.762 45.772 144.951 -32.527 90.784 47.866 142.665 -24.063 89.377 46.666 142.622-147.924 89.899 46.632 0.000 0.000 88.964 53.858 120.729 -76.191 88.479 42.390 137.370 -93.396 89.419 49.303 119.396-127.828 87.254 69.075 109.693 -77.852 87.943 57.800 145.295-108.869 88.119 33.940 124.441-158.584 98.735 -99.016 107.325 -84.411 122.016-174.065 164.763-158.724 96.902 -58.800 96.499 -92.794 90.821 -50.554 111.679 -75.968 91.064 -45.260 114.918 -15.819 91.503 -43.822 112.907 -66.773 92.754 -44.820 128.649 -76.939 93.803 -35.872 103.687 -84.105 94.195-114.024 122.921 3.304 94.261 59.270 145.793 -20.082 89.706 48.661 130.362 -78.176 91.509 65.975 120.032-127.794 91.190-105.862 128.273 -75.807 94.545 -42.157 142.613-124.132 94.063 -45.340 151.532 136.119 92.087 -52.326 146.394 -46.619 91.807 -40.469 141.366-152.771 100.182 179.470 105.268 -78.916 92.795 0.000 129.214 -76.187 # 323 total E -1.47082E+02 rmsd from N 0.000 %NC 0.00 93.042 -62.648 126.941 -77.031 94.044 -49.280 117.034 -79.314 91.018 -45.681 103.933 -78.812 90.331 -47.142 128.284 -75.514 91.003 -43.177 138.960-123.112 93.344 -38.504 84.777 -86.049 95.039 -41.613 134.361 20.137 98.053 -33.526 171.984 167.784 104.026 -39.522 134.635-111.045 98.149-169.257 93.201 -91.976 140.344 58.582 158.163-176.703 92.902 43.604 96.424-118.823 93.278 47.173 99.807 -79.779 93.549 46.504 145.360 -37.470 91.178 50.766 148.490-140.214 91.576 34.279 123.371-121.873 99.285-134.546 117.374 -69.710 104.350-160.594 124.209 60.497 102.142 -40.754 126.386 -44.846 91.852 -51.430 104.443 -81.303 90.832 -44.219 0.000 0.000 93.834 -40.261 132.152 -94.819 92.619 -44.702 133.599 -97.525 92.069 -45.070 126.927-145.708 89.061 -47.895 117.663 -76.287 90.186 -55.458 123.853 -97.513 90.208 -47.827 150.784-155.256 94.232 -24.456 144.057-135.046 109.464 -49.635 116.034 -83.726 108.714-141.605 99.562 -78.077 99.237 -24.739 112.941 -78.491 98.755-120.165 148.375-142.329 94.397 48.123 119.330 29.649 91.399 51.590 129.005 -75.540 89.265 44.646 101.569 -78.709 92.202 46.846 146.895 -29.708 89.414 44.828 166.313-177.258 91.570 40.397 128.114 -76.544 90.171 49.947 111.751 -38.559 90.217 48.548 128.860 -77.471 90.201 46.876 142.084-127.889 92.993 74.770 127.698 -40.675 89.616 -83.449 147.177 -97.104 98.325 -42.533 105.119 -86.760 98.662-142.172 101.712 -66.233 93.087 0.000 129.160 -76.676 # 324 total E -1.49154E+02 rmsd from N 0.000 %NC 0.00 92.678 -16.549 128.909 -83.792 94.895 -51.094 113.536 -73.796 92.366 -43.065 103.754 -77.305 91.394 -45.607 129.163 -76.096 91.844 -41.305 140.502-132.538 94.053 -42.388 62.447 -64.322 91.318 -38.680 130.271 0.387 102.467 -35.250 168.172 147.958 96.547 -52.965 127.922-122.553 95.294-150.533 76.876 -83.594 95.598 60.422 156.321 177.569 95.508 39.067 93.535-124.051 93.326 45.303 139.087-133.047 92.073 57.605 146.429 -31.234 89.319 53.248 137.014-127.018 90.292 34.400 130.412-116.060 100.047-167.780 125.950 -72.058 103.354-173.787 135.493 53.248 110.824 -36.144 129.584-115.518 96.730 -40.070 105.469 -81.105 104.868 -21.373 0.000 0.000 99.987 -39.435 131.066-100.232 96.379 -41.906 118.591 -93.167 90.857 -46.732 119.814-120.020 90.398 -41.571 117.871 -69.603 95.508 -48.220 135.066 -91.803 94.519 -40.224 128.975-135.344 97.665 -75.890 145.019-127.675 137.181-143.409 172.225-179.844 117.766 -99.862 113.113-117.576 96.470 39.397 113.791 -77.341 92.185 49.531 122.765 -19.768 90.189 49.171 145.138-172.603 90.604 43.833 128.036 -75.667 91.765 38.077 101.673 -83.359 93.677 44.443 137.307 -38.330 94.627 35.942 134.245 -86.160 94.808 44.362 128.673 -77.345 94.554 65.286 105.745 -75.369 92.193-103.905 129.440 -77.520 95.942 -31.102 140.533-113.639 90.368 -62.396 116.597 18.241 91.279 -57.226 155.070 -28.743 90.215 -45.787 107.791 -85.059 96.186 91.453 105.240 -78.238 92.340 0.000 129.461 -75.578 # 325 total E -1.46829E+02 rmsd from N 0.000 %NC 0.00 93.140 164.630 138.258 -90.373 93.058 57.209 136.359 47.078 91.888 44.916 106.500 -82.530 92.000 48.407 130.184 -76.495 92.249 44.407 154.183-151.926 92.789 42.005 59.803 -70.649 92.141 45.375 123.325 -33.347 91.677 40.578 132.191-103.165 93.014 55.831 146.564-170.657 90.682 84.580 103.144-135.677 93.485 -67.916 117.260-122.817 99.990 -57.046 92.719-101.689 94.083 -69.512 143.015 -12.845 112.676-150.933 167.751 -16.824 118.629-104.206 147.409-155.478 94.614 41.202 142.875-120.688 92.240 45.548 134.982 -77.893 90.717 48.971 136.889 -64.527 93.525 42.579 106.338 -71.919 98.504 24.444 109.553 -82.104 101.005 36.258 0.000 0.000 95.677 45.224 137.084 -24.033 90.499 47.321 142.975 -81.729 91.218 48.954 133.888-162.199 93.920 111.411 108.130 -76.388 94.355 -34.731 142.651-102.942 95.577 -62.186 134.710-124.355 91.186 -27.205 111.710 -88.545 111.412-148.655 159.685-139.710 101.990-121.775 91.279 -79.524 96.249 36.321 115.618 -76.427 95.835 48.919 144.860 -44.749 101.991 18.698 131.205 19.488 96.262 52.901 131.685 -78.752 90.659 37.964 99.962 -84.930 93.068-119.048 110.501 -53.741 91.336 -49.130 140.721 -37.214 91.594 -36.292 132.013 -77.434 97.990-157.331 123.814-106.700 92.291 51.752 130.833 -77.664 91.633 43.467 139.634-105.851 90.991 46.692 129.718 -17.017 91.302 52.744 135.207-108.597 90.134 41.482 131.658-146.073 95.807 71.398 104.447 -80.309 92.501 0.000 129.071 -76.757 # 326 total E -1.49629E+02 rmsd from N 0.000 %NC 0.00 92.809 145.885 135.233 -77.427 93.473 58.029 133.113 62.177 92.845 42.668 104.006 -78.950 92.352 46.907 131.552 -77.774 92.827 47.364 160.533 178.216 94.185 34.766 57.708 -71.853 94.797 44.388 151.055 111.904 95.617 35.547 138.868 -99.658 92.560 49.434 136.264 139.868 91.327 82.190 78.112-115.245 86.504 -79.160 136.504-106.222 95.646 -45.853 93.030 -94.365 88.543 -51.767 109.086 -75.421 94.650 -35.385 140.943 -95.828 95.550 -49.123 131.274-175.573 99.620 -38.403 148.592-163.159 95.155 109.382 131.786 -86.170 92.735 45.430 113.840 -67.721 96.106 111.284 132.442 136.471 89.112 51.299 149.134-166.867 88.999 51.216 0.000 0.000 89.238 49.485 133.266 -29.819 89.329 48.692 141.492 -78.173 88.984 47.186 123.105-131.239 88.371 51.810 106.568 -71.329 90.891 44.986 134.074 -60.556 93.109 39.106 135.939-132.902 94.123 45.266 150.504 -24.856 95.011 64.267 149.674 -18.640 91.288 52.334 101.297-123.584 91.373 35.541 113.192 -78.402 100.463-121.554 139.246-118.098 123.315 162.937 120.253 -77.200 92.615 -71.303 127.117 -75.059 88.376 -48.830 102.785 -78.918 89.368 -53.246 133.098 -46.583 88.751 -45.849 137.421 -64.720 90.347 -47.255 127.710 -75.773 88.350 -49.395 124.328 -22.026 89.457 -52.713 129.697 -76.803 90.106 -39.896 154.184-143.326 89.816 -48.711 124.617 -15.386 90.319 -61.156 153.988 -21.982 89.670 -56.008 111.429 -85.622 92.315 88.702 103.028 -80.722 92.547 0.000 128.820 -76.700 # 327 total E -1.46409E+02 rmsd from N 0.000 %NC 0.00 93.086 -67.595 127.336 -77.312 94.182 -48.981 117.254 -78.523 90.987 -46.409 103.229 -77.620 90.432 -48.534 128.298 -75.848 90.432 -40.598 139.824-124.113 93.985 -41.631 64.490 -69.935 92.478 -38.489 138.716-101.062 104.218 -28.726 171.361 155.701 94.334 -49.765 131.163-119.842 95.670-159.405 83.057 -80.330 94.538 57.207 163.145-165.996 95.146 36.999 92.715-123.129 92.374 48.860 138.858-134.708 91.605 59.437 142.082 -28.259 89.876 41.603 133.473-120.164 94.135 38.226 134.829-113.292 101.987 -33.687 124.576 -81.984 137.602-168.675 127.502 -79.928 103.551 36.791 161.596 78.109 97.307 45.714 109.678 -81.611 98.050 33.462 0.000 0.000 98.630 36.072 144.900 112.133 100.058 32.406 163.201-171.463 96.823 41.560 121.499 169.886 95.247 172.129 115.318 -78.046 106.559 -35.282 142.221-142.433 91.865 -50.393 112.297-174.529 92.453 -41.441 143.151-127.893 103.981-160.733 152.319 -11.084 97.317-138.035 94.627 -87.729 93.740 46.272 114.510 -76.532 93.388 44.390 100.607 -30.137 93.393 44.439 133.332 20.420 92.784 41.219 129.163 -77.342 91.110 47.743 101.011 -83.480 90.530 63.405 135.968 -39.651 89.532 48.604 128.949 -66.329 91.537 34.928 128.282 -75.981 96.819 107.162 112.638-101.672 90.637 -73.966 130.607 -77.552 93.299 -43.010 144.356-126.039 91.427 -41.709 124.699 -14.822 94.976 -74.206 142.777 -44.196 90.058 -65.425 134.508-138.873 93.699 67.408 102.930 -79.309 92.502 0.000 129.404 -76.397 # 328 total E -1.49818E+02 rmsd from N 0.000 %NC 0.00 93.215 164.745 140.714 -99.695 93.586 53.444 134.279 37.393 91.425 47.019 106.112 -80.669 91.709 45.500 130.481 -77.349 93.850 46.482 147.779-129.804 92.927 39.670 53.760 -68.412 92.018 46.878 120.506 -18.303 90.591 43.242 130.022-101.931 92.581 58.279 140.046-128.569 89.547 108.525 108.897-130.312 95.594 -54.044 113.154-127.789 97.400 -49.651 94.983-101.812 92.866 -40.845 140.862 -13.652 114.038-126.839 156.963 -20.965 91.213-126.437 132.668-126.468 96.227 37.703 150.242 170.097 93.523 48.310 136.624 -89.114 92.087 45.694 157.421-133.553 93.558 44.808 92.521 154.510 95.826 30.512 108.060 -84.575 100.618 34.886 0.000 0.000 95.990 43.606 152.017-152.789 91.436 46.570 139.839-106.883 90.668 41.821 113.554-126.186 90.675 46.981 116.092 -79.236 90.767 50.601 141.467-116.769 91.590 52.290 134.799-132.640 91.864-109.372 103.819 -83.130 100.716 172.046 149.766 -18.400 105.676-164.238 91.248 -97.196 92.199 51.482 114.931 -76.837 91.620 48.797 103.064 -15.848 90.445 47.728 124.235 -12.582 90.318 44.125 129.950 -77.536 89.589 50.978 103.032 -84.850 88.404 54.843 118.722 -30.774 90.145 44.527 128.813 -61.179 91.801 41.167 128.373 -75.955 93.988 86.431 111.984 -99.273 90.310 -86.311 128.808 -76.479 91.998 -45.765 144.674-135.469 91.288 -52.264 141.010 -78.252 95.527 118.037 145.262 -27.874 100.537 27.066 142.854-170.828 100.251 32.598 105.036 -78.293 92.451 0.000 129.424 -76.365 # 329 total E -1.51543E+02 rmsd from N 0.000 %NC 0.00 93.094 -61.088 128.750 -82.757 94.682 -46.361 115.386 -80.301 90.624 -47.382 103.102 -77.054 90.231 -47.614 129.275 -76.341 91.696 -40.866 139.734-119.077 94.621 -40.118 62.589 -67.322 92.876 -39.109 133.982 12.633 104.130 -32.893 168.261 164.911 94.577 -61.852 120.921-111.325 89.293-109.549 79.139 -75.953 132.078 101.372 167.896 161.879 91.899 46.851 94.731-119.167 96.695 36.409 103.166 -82.846 95.395 48.371 165.630-164.575 94.207 32.904 152.128 -50.740 97.695 43.458 120.747-114.975 98.762 7.645 126.341 -74.664 117.744 158.828 146.329 -68.976 101.313 39.061 99.040 155.411 96.274 45.503 109.549 -81.334 111.530 12.085 0.000 0.000 99.825 40.074 164.826-179.430 98.397 36.264 154.288-172.934 90.999 52.921 111.657-142.683 89.766 45.027 109.847 -79.068 91.719 52.206 152.437-111.580 91.364 43.234 125.710-158.711 97.285-115.918 106.431 -83.818 94.924-165.434 147.321-120.649 109.239 -46.419 90.888-108.869 113.354 -12.600 115.334 -79.457 93.403 -51.992 111.655 -58.338 96.488 -32.112 114.666 -71.153 96.733 -45.998 127.567 -76.533 94.960 -31.323 102.508 -86.119 90.720 -55.405 102.350 -54.754 88.742 -57.485 151.645 -24.366 89.043 -53.379 128.081 -76.263 91.096-129.533 123.827-134.864 90.420 57.823 132.848 -77.516 91.331 45.782 139.887-104.152 90.223 46.782 124.309 -22.610 91.170 71.069 144.415 -35.371 87.539 55.602 138.209-143.111 92.153 106.635 100.304 -79.643 92.528 0.000 128.823 -76.413 # 330 total E -1.46507E+02 rmsd from N 0.000 %NC 0.00 93.007 156.857 140.332 -95.303 93.700 53.302 133.730 50.591 91.292 46.441 105.729 -81.357 91.697 47.383 130.367 -77.843 93.307 51.760 153.667-152.544 93.127 42.276 65.458 -75.157 89.330 50.072 146.786 -49.969 90.993 54.265 107.588-134.815 86.666 46.989 136.467-167.554 89.272-171.911 83.834 -95.516 124.244 114.622 159.343 175.897 95.604 49.440 92.642-120.641 97.945 38.663 107.370 -82.867 94.753 42.314 157.098-120.816 97.767 44.970 109.598 -85.977 96.028 33.418 130.476-107.298 98.150 55.813 139.577 -79.669 149.598 -89.739 116.944 -67.498 126.834-112.097 109.855 -81.236 93.787 60.198 110.436 -81.974 92.774 48.188 0.000 0.000 89.707 47.658 145.079 -9.581 91.724 49.075 170.043-135.404 90.618 46.290 113.516-144.496 89.514 47.312 108.656 -71.924 91.650 54.554 145.244 -41.177 89.599 44.142 140.947-178.464 93.388-120.138 105.144 -83.115 108.163-176.852 158.181-165.489 127.418-134.625 115.177-117.408 96.042 45.774 114.960 -77.214 91.792 48.335 101.593 -16.569 89.638 51.233 125.293 -18.803 91.617 43.932 127.341 -75.472 90.833 42.183 102.820 -84.066 91.066 50.532 119.207 -33.406 91.519 48.330 131.444 -55.200 90.627 37.758 130.860 -77.839 94.057 112.642 106.411 -96.971 90.681 -60.856 129.959 -78.172 92.650 -45.322 144.482-128.038 91.169 -42.810 131.748 -31.852 92.463 -53.767 147.256 -97.768 90.862 -50.230 123.267-156.985 95.737 102.631 105.740 -79.519 121.311 0.000 146.229 -85.582 # 331 total E -1.47452E+02 rmsd from N 0.000 %NC 0.00 123.610-105.356 148.633 -49.922 123.852-102.883 132.096 -31.890 94.370 41.463 107.196 -79.538 93.592 47.837 131.184 -77.754 95.749 41.692 148.995-124.779 92.180 42.421 60.745 -86.894 91.066 44.706 119.037 -48.625 92.470 43.768 132.087 -96.844 89.443 46.668 143.196-136.052 89.703 45.708 80.757-104.900 93.236 167.109 130.830 -84.309 93.110 80.503 133.618-161.766 88.893 149.724 100.083 -83.841 103.254 -26.140 128.287-106.918 92.493 -61.473 134.947-143.257 93.714 -28.786 132.932-104.259 97.190 110.656 147.047 134.720 91.833 47.918 100.269 -10.449 91.146 48.491 157.575 103.678 90.720 44.707 149.906-161.121 93.634 41.319 0.000 0.000 89.641 46.451 144.050 -22.384 91.206 50.392 126.724-102.233 90.128 48.450 124.328-133.258 87.569 49.944 107.053 -74.493 91.385 59.201 121.065 -70.124 90.153 60.968 143.423-143.658 92.843 -67.723 154.724 -26.981 129.556 137.475 113.782 -73.379 108.568 -86.417 96.593 -93.684 128.705 1.013 119.599 -81.338 93.199 -53.641 113.119 -49.573 90.861 -48.291 111.407 -75.345 90.624 -47.465 125.868 -74.412 88.959 -41.036 100.609 -80.552 93.032 -39.144 148.257 -25.693 93.867 -47.931 163.837-139.883 91.209 -42.963 130.161 -78.180 93.271-123.286 116.863 -53.610 91.221 48.791 131.862 -78.305 91.541 53.397 143.027-118.977 90.622 58.040 127.422 -23.981 91.555-130.297 131.234 -63.666 98.829 38.292 107.119 -85.295 121.271 78.644 106.764 -71.381 92.560 0.000 129.921 -76.799 # 332 total E -1.51816E+02 rmsd from N 0.000 %NC 0.00 93.204 -87.099 124.378 -66.996 115.798-118.853 127.787 -51.048 93.980 38.948 107.035 -80.916 92.985 51.506 131.247 -77.553 92.334 43.481 133.844 -7.471 90.966 43.789 64.267 -78.001 90.890 48.143 120.777 -39.224 92.246 38.141 129.196-102.191 91.450 53.057 133.844 138.875 88.837 78.148 83.631-107.457 90.276 -83.436 127.418 -95.806 102.694 -44.245 93.529 -79.256 97.345 -53.017 142.034 -53.168 107.526-146.927 163.387 -26.907 108.590-130.604 129.233-114.100 94.536 39.892 140.931 149.121 91.977 46.853 134.800 -86.626 89.290 55.141 162.411 -33.985 89.009 51.410 118.058 -34.685 89.421 41.987 148.942-145.446 90.271 46.024 0.000 0.000 89.525 52.890 105.396 -80.619 88.784 46.873 140.028 -70.954 90.275 40.445 122.868-125.484 91.181 46.298 109.225 -76.143 90.839 48.257 137.180 -86.817 92.519 42.031 145.123-136.797 93.859 39.600 113.814 -90.215 99.120 -11.725 144.101 -97.159 135.422-144.791 111.027-104.084 91.817 62.137 113.448 -76.429 91.277 63.601 112.238 -77.483 89.181 55.344 137.825-179.988 89.471 48.374 131.137 -76.976 86.614 49.225 101.807 -82.718 88.164 62.411 110.771 -28.657 85.719 52.784 143.737 -37.093 87.793 47.301 128.155 -76.534 87.508 55.410 113.464 -32.440 88.158 48.777 128.849 -75.731 89.608 44.970 135.768-105.993 89.419 49.389 129.782 -40.299 88.732 56.541 135.582 -56.795 89.308 43.379 127.789-115.025 94.872 80.644 103.988 -80.420 92.412 0.000 128.865 -76.863 # 333 total E -1.53397E+02 rmsd from N 0.000 %NC 0.00 93.486-171.743 138.343 -94.382 93.522 56.637 142.635 30.585 93.900 42.338 105.648 -80.586 92.481 46.065 131.188 -77.107 93.637 43.876 136.565-120.360 92.387 41.835 55.695 -71.238 92.162 44.292 127.142 -28.927 90.125 44.808 138.057-105.504 89.996 50.362 130.631-127.272 88.524 50.843 82.020 -99.824 90.154 146.752 135.994 -84.874 95.089 91.122 125.492-149.101 91.424 102.179 101.059 -87.225 93.752 -70.351 130.796-101.280 99.471-120.173 137.239-145.543 91.570 50.419 137.771 114.975 91.518 47.125 134.810 -85.658 90.761 47.665 130.043 -44.203 90.082 48.374 134.355 -18.290 89.516 47.442 151.750 -26.659 90.021 46.592 0.000 0.000 88.762 53.959 114.970 -75.761 88.174 45.490 138.819 -83.880 89.510 45.523 121.702-125.525 88.680 52.109 106.728 -74.923 89.535 50.113 138.383 -81.244 91.443 41.787 131.572-119.735 93.606 43.481 152.240 -21.120 97.364 149.448 108.234 -83.506 98.068 74.178 130.252-153.697 121.983 60.522 119.846 -81.531 93.330 -57.706 111.992 -55.997 91.909 -40.178 110.177 -72.709 90.689 -51.791 127.882 -75.739 88.397 -44.023 106.256 -90.724 88.382 -55.314 98.889 -67.337 85.983 -56.594 143.014 -30.445 89.563 -47.736 130.520 -76.776 95.364-144.700 107.026-114.015 91.994 49.639 130.863 -76.134 91.323 49.989 140.148-108.645 91.466 63.888 117.054 -3.193 91.594-109.246 141.642 -98.892 100.886 -14.652 101.798 -88.171 116.791 123.831 101.141 -75.786 92.667 0.000 129.398 -76.814 # 334 total E -1.46766E+02 rmsd from N 0.000 %NC 0.00 93.207 -65.479 129.327 -83.709 94.541 -46.456 117.156 -79.874 90.603 -47.521 102.797 -77.327 90.206 -46.915 128.980 -75.948 91.610 -42.365 145.253-130.504 93.041 -39.732 60.738 -66.929 93.099 -47.158 132.480 27.820 97.401 -38.241 171.084 151.664 94.582 -59.935 125.926-113.728 91.632-109.145 80.554 -82.239 128.834 98.045 154.255 174.168 93.768 46.053 93.914-124.178 93.202 46.198 105.542 -89.738 91.805 65.758 155.353-172.949 88.333 47.527 132.482-125.661 93.021 46.167 128.674-103.549 99.751 -58.292 138.958 -50.719 130.746-164.389 140.547 -77.619 105.650 41.073 126.217 97.462 92.473 50.798 109.228 -81.964 93.286 44.597 0.000 0.000 94.223 40.834 158.118 175.422 94.446 41.307 166.328 174.594 90.997 46.672 110.001-138.989 90.647 49.281 111.943 -80.573 90.147 49.907 154.307-119.495 91.678 46.099 134.970-151.877 95.532-109.571 103.414 -81.994 98.520-162.969 151.652 -19.290 106.120 -39.555 93.909 -99.926 98.438 -35.916 112.978 -77.234 95.155 -39.891 113.522 -55.023 94.546 -45.996 109.489 -74.489 91.155 -42.192 128.450 -77.506 88.709 -47.023 98.600 -80.187 86.169 -64.374 130.575 -33.941 86.777 -53.082 147.005 -36.279 89.441 -41.764 128.212 -76.019 90.120 -67.098 124.107 -24.416 92.154-118.669 129.653 -75.307 91.579 -16.312 140.884-122.537 109.723 124.268 107.986 -49.288 117.424-146.718 158.340 -13.808 100.771 45.334 138.861-140.236 99.324 65.479 107.687 -78.088 92.493 0.000 129.268 -76.265 # 335 total E -1.48416E+02 rmsd from N 0.000 %NC 0.00 124.513-104.659 146.175 -36.770 122.565-104.140 130.414 -39.342 93.779 42.055 109.621 -81.163 93.372 46.940 130.801 -77.046 95.748 38.647 154.327-148.554 93.675 43.494 55.996 -79.796 89.530 46.575 116.303 -34.623 89.494 53.193 134.003 -89.524 87.693 43.074 123.650-109.496 90.933 43.905 79.443 -90.888 95.001 170.162 130.333 -58.432 89.699 82.986 140.239-171.572 92.685-148.423 140.255 -43.478 128.914-125.227 156.333-167.067 112.122-112.996 133.686-161.782 93.639 46.657 139.953-107.364 91.686 49.097 136.000 -74.170 90.983 48.917 125.636 -66.039 89.592 48.057 152.332 -19.600 89.807 47.906 141.923-143.153 90.072 46.231 0.000 0.000 89.081 53.717 116.742 -86.987 87.099 45.706 136.492 -97.212 89.429 53.123 120.360-130.350 86.287 58.576 111.519 -75.626 89.201 53.302 135.706 -99.258 89.898 41.151 134.899-152.534 95.879 -92.221 149.873 -26.933 126.194 153.101 151.036 -12.753 104.931-163.969 97.362 -86.200 93.821 51.828 114.623 -76.864 90.128 59.697 107.264 4.679 88.061 53.820 114.620 4.585 89.492 44.962 129.521 -76.244 89.460 45.287 138.824-142.696 89.015 50.913 126.537 -21.540 88.770 50.378 148.477 -35.112 88.516 42.521 128.195 -76.814 87.366 60.161 118.852 -44.067 88.981 51.919 126.395 -75.113 89.047 40.883 137.812-114.094 91.858 47.173 128.907 -40.694 90.943 49.011 134.071 -60.321 91.237 46.204 112.097 -92.855 94.626 76.271 104.338 -79.915 92.509 0.000 129.024 -76.596 # 336 total E -1.49905E+02 rmsd from N 0.000 %NC 0.00 93.091 -65.959 128.117 -79.962 94.329 -47.697 118.116 -80.229 90.901 -46.810 103.634 -77.554 90.249 -49.044 128.199 -75.684 91.094 -38.986 141.449-124.003 92.924 -43.672 59.591 -52.437 90.438 -41.173 134.804 41.147 96.006 -45.491 170.637 162.453 92.172 -44.848 120.017-114.170 90.656 135.214 76.672 -66.883 92.288 89.398 148.067 -42.817 92.093 34.230 97.720-113.333 98.618 56.107 105.290 -84.132 96.732 -2.692 148.942 -95.661 121.637 179.507 144.264-138.154 99.882 39.925 143.541 159.438 94.539 44.216 134.985 -87.347 90.798 53.288 143.565 -67.713 89.624 54.901 115.710 -39.772 89.642 43.206 107.951 -82.427 90.706 44.683 0.000 0.000 90.151 53.299 109.146 -89.826 87.852 56.567 145.236 -80.207 88.007 46.421 122.648-137.575 88.499 50.076 106.636 -71.470 90.377 49.268 140.771 -49.788 90.982 50.898 137.811-141.512 92.807 -98.274 103.427 -83.123 112.646-171.649 152.876 -18.262 95.753 -58.938 99.068-107.345 91.679 -48.733 110.517 -74.336 91.825 -66.302 107.279 -49.401 89.476 107.530 111.828 -70.402 92.507 46.202 128.798 -76.365 89.032 49.536 108.427 -77.042 90.733 43.454 137.334 -38.571 92.467 41.702 146.437 -99.815 94.040 38.532 128.515 -77.068 92.493 53.100 105.473 -69.374 91.885 108.639 129.901 -78.036 88.505 55.557 139.735 171.370 92.069 76.428 134.415 -60.759 88.776 -97.209 129.442 -48.579 93.045 -20.505 135.463-119.159 113.978 -97.623 99.503 -85.793 92.836 0.000 129.518 -76.169 # 337 total E -1.49231E+02 rmsd from N 0.000 %NC 0.00 125.010-133.564 145.568 -42.076 112.075-121.085 136.341 -49.898 91.386 45.286 106.013 -80.962 92.126 51.685 129.005 -76.473 92.560 45.064 132.927 -27.483 91.347 45.308 61.376 -72.575 89.186 52.919 126.621 -34.910 89.923 48.363 125.177-112.064 87.854 50.979 139.759 158.478 90.732 80.885 79.204-106.365 90.142 -79.278 138.546 -93.406 97.832 -44.281 92.230 -81.595 88.583 -59.003 142.449 -40.744 92.130 -47.223 137.348-100.892 92.386 -48.816 128.003-163.484 106.121 -7.232 145.989 170.053 127.995 81.616 151.384 -68.658 92.762 47.174 127.429 -31.016 90.667 58.377 136.819 39.974 87.853 48.305 152.857 -38.908 88.812 48.505 0.000 0.000 88.405 53.591 152.222-148.458 89.512 47.266 134.380 -74.748 89.959 41.764 124.859-122.383 89.141 52.390 116.082 -80.237 90.222 52.574 136.193-111.610 90.852 46.668 132.235-156.272 94.307-107.918 148.612 -32.043 103.959-173.890 153.830-133.011 106.781 -55.436 93.368-105.366 114.217 -16.660 115.126 -79.711 94.222 -48.483 115.560 -56.843 93.020 -44.489 111.032 -73.234 91.617 -46.509 126.698 -75.886 89.107 -41.461 100.742 -81.549 91.254 -43.648 147.356 -26.009 93.559 -47.641 154.724-103.169 90.684 -43.079 129.645 -78.071 95.619-122.310 132.818 32.095 90.145 66.430 132.007 -76.900 91.086 45.904 141.955-107.182 91.001 41.852 132.239 -44.791 91.626 59.402 162.651-168.216 88.169 49.213 127.169-165.035 92.078 108.449 100.455 -79.343 92.552 0.000 128.719 -76.511 # 338 total E -1.51626E+02 rmsd from N 0.000 %NC 0.00 93.256 -79.265 127.992 -76.578 117.263-115.741 127.087 -47.734 95.152 35.140 106.778 -80.343 93.552 54.383 130.448 -76.291 90.203 45.070 132.453 -4.945 89.466 43.695 77.050 -87.800 92.652 47.401 116.301 -73.592 98.396 11.860 135.863 -92.423 106.568 45.759 156.899 176.478 88.854 81.195 96.962-106.513 91.370 -75.448 121.784-109.913 103.786 -65.944 89.810 -88.041 90.773 -61.413 151.837 -27.104 122.406-158.283 154.015-176.283 112.164-107.953 150.930-154.298 95.503 43.952 149.264 148.105 92.726 45.210 135.735 -84.146 90.757 48.316 119.504 -64.301 92.503 52.250 131.782 -40.409 92.039 40.827 150.893 -13.262 91.443 44.457 0.000 0.000 90.648 62.403 106.561 -82.778 86.931 49.253 142.144 -81.544 89.515 41.868 118.223-126.702 90.836 50.515 108.214 -73.566 91.263 39.820 139.989 -85.975 95.521 46.528 133.823-139.616 98.985 5.995 108.236 -86.203 110.120 57.373 157.018 -15.737 95.345 91.109 132.270-156.285 88.160 50.915 113.900 -77.834 91.429 65.250 130.796-105.576 92.442-178.979 108.806 -73.557 91.202 63.760 129.637 -75.884 89.678 43.136 101.435 -80.137 90.403 51.131 146.770 -18.164 88.094 48.189 151.719-135.116 90.362 41.452 128.115 -76.630 89.937 47.571 116.289 -31.401 90.995 45.199 129.151 -77.158 91.833 47.669 136.681-120.009 93.096 74.394 127.466 -41.021 89.996 -88.699 136.133 -86.287 96.508 -35.091 103.191 -86.124 104.464-100.856 142.067 -20.481 92.919 0.000 129.484 -76.493 # 339 total E -1.49356E+02 rmsd from N 0.000 %NC 0.00 93.439 177.363 140.704-104.280 93.997 52.589 135.975 26.510 91.859 47.522 106.131 -75.795 92.623 42.509 130.366 -77.340 95.328 43.357 135.035-115.414 95.194 39.055 47.893 -65.811 93.141 46.815 141.464 -14.363 89.518 46.126 135.835-104.073 92.518 56.255 120.430-111.699 91.485 118.591 119.069-120.529 147.673-152.342 152.596-160.043 122.292 0.302 114.913-119.760 98.261 105.119 112.073 -83.046 91.115 -60.448 146.900 -40.545 96.495 178.886 142.271-141.126 95.656 45.123 139.415 168.926 92.047 47.517 134.962 -86.153 93.131 127.786 127.199 -42.248 91.824 47.862 159.757 98.559 92.167 43.545 143.397-154.816 92.690 44.516 0.000 0.000 89.249 49.593 141.689 -16.134 90.025 47.399 131.839-107.145 89.153 46.891 120.386-133.271 87.069 62.458 111.665 -74.383 88.026 52.140 134.905 -55.952 90.766 39.006 136.284-131.897 97.869 -80.084 154.916 -27.057 125.131 169.755 113.869 -72.972 102.994 -23.690 99.415 -97.062 98.507 -66.051 113.375 -77.493 98.488-106.715 123.815 -73.248 89.091 58.245 127.312 -5.227 91.928 47.432 129.971 -76.159 90.157 42.149 146.406 -19.852 89.270 49.208 125.910 -30.216 88.889 53.218 145.893 -36.417 88.492 42.248 128.089 -76.687 88.653 49.970 111.468 -43.668 90.428 44.560 128.060 -76.954 90.667 51.020 139.988 -85.439 89.182 51.370 127.005 -39.721 90.203 50.696 131.312 -84.050 90.941 45.706 145.027-152.438 94.966 75.465 104.107 -80.533 92.517 0.000 128.983 -76.633 # 340 total E -1.51466E+02 rmsd from N 0.000 %NC 0.00 92.512 126.637 125.274 -52.301 94.432 47.259 151.850 0.965 93.297 45.184 108.884 -80.725 91.229 47.197 127.663 -74.767 90.485 45.551 120.502 -31.809 92.167 42.948 107.387 -73.842 92.516 39.168 112.210 -83.929 102.472 22.026 106.372 -81.631 95.024 43.852 145.565 -28.566 102.346 22.534 71.328 -98.021 96.826 41.706 154.103-150.051 101.902 20.502 85.008-105.618 96.068 53.805 146.559-139.018 90.544 44.076 122.588-105.745 91.367 49.613 138.527-122.092 90.856 38.582 125.889-126.873 95.544-121.809 118.572 -85.532 112.640 157.706 117.684 56.902 106.832-175.192 142.952-140.735 93.330 55.017 148.104-151.942 91.541 46.753 0.000 0.000 91.645 44.620 154.474-152.562 92.896 41.284 126.531-112.601 90.584 45.774 116.023-121.237 90.652 46.796 110.707 -81.397 91.265 52.802 141.091-106.450 91.587 41.779 128.813-150.887 97.728-119.092 146.933 -33.549 93.288-171.225 148.843-123.474 110.326 -38.464 89.619-107.328 111.216 -20.215 115.030 -78.889 94.270 -48.523 116.137 -69.175 95.219 -40.618 112.368 -71.797 93.377 -43.920 127.700 -76.831 90.610 -41.186 99.484 -80.618 89.723 -53.298 140.936 -45.989 90.239 -49.468 148.929-106.477 89.346 -49.152 128.226 -77.465 94.220-123.348 129.781 -9.879 89.975 53.762 131.917 -76.878 90.711 48.114 142.935-115.112 89.467 47.563 130.457 -37.971 90.171 58.589 142.063 -37.987 88.381 43.804 135.904-127.997 94.375 86.342 103.210 -80.021 92.546 0.000 128.796 -76.716 # 341 total E -1.47626E+02 rmsd from N 0.000 %NC 0.00 93.195 160.138 141.816-101.933 93.566 52.142 136.832 33.515 91.163 47.129 105.967 -82.502 91.481 48.281 130.605 -77.383 93.781 46.071 147.298-126.527 90.702 42.135 58.518 -73.686 90.690 47.466 126.895 -36.011 89.977 46.719 127.484-107.643 88.885 48.546 135.376-132.463 91.348 80.029 83.417-102.616 91.734 -61.155 141.957 -99.294 105.459 -71.467 91.863 -84.740 90.304-107.474 149.115 -0.790 114.164 -61.597 146.392-133.236 94.539-115.286 131.517-148.795 92.508 46.821 140.232-106.839 93.112 48.538 135.547 -73.197 91.440 44.755 131.694 -39.317 91.978 47.512 127.054 -24.897 88.988 48.461 146.795-160.876 90.252 46.017 0.000 0.000 92.608 41.502 113.265 -79.325 93.828 39.644 139.969 -78.931 92.056 45.281 117.655-117.306 90.524 47.767 114.812 -83.035 91.001 52.617 147.524-132.199 90.305 42.293 120.321-162.824 96.019-113.064 148.856 -31.947 100.505-166.210 152.179-129.809 108.475 -85.498 90.830-100.123 116.209 17.293 116.925 -79.830 94.119 -68.760 123.456 -84.952 93.353 -36.101 113.266 -72.895 98.995-122.346 127.274 -74.989 85.260 53.993 101.204 -82.613 92.474 43.927 118.536 -65.964 90.820 50.865 147.230 -26.387 89.959 50.516 128.977 -77.446 89.514 174.862 87.185 -67.368 92.765 76.079 132.432 -78.222 91.452 43.042 141.549-109.385 93.292 75.224 123.013 -32.544 93.565 -79.226 143.254 -49.238 98.788 -48.622 133.089-118.782 106.003 121.478 106.442 -79.135 92.570 0.000 129.531 -76.218 # 342 total E -1.51084E+02 rmsd from N 0.000 %NC 0.00 93.199 -80.481 124.819 -66.935 116.947-106.032 133.779 -31.849 92.281 46.400 107.725 -80.666 93.639 46.195 129.830 -77.562 95.071 44.838 146.075-121.113 91.524 44.375 59.476 -80.684 90.667 44.915 125.059 -43.051 92.501 43.359 121.499-105.714 89.716 47.929 143.730-143.209 91.946 78.200 83.678-105.754 92.137 -63.842 138.463-101.796 105.248 -71.686 90.600 -83.221 90.497 -73.845 152.101 -9.795 123.962-158.957 155.369 174.678 108.868-107.784 137.309-157.072 93.331 46.960 140.470-107.916 92.060 48.527 136.101 -73.884 91.094 46.743 128.947 -64.745 92.325 45.019 142.557 -12.492 93.295 42.023 141.928-167.051 90.406 47.127 0.000 0.000 90.108 54.634 102.838 -83.093 88.306 45.250 143.612 -73.829 90.683 42.021 119.535-125.765 90.650 49.433 111.197 -77.221 89.476 52.996 141.192-100.883 91.304 38.387 137.706-135.940 93.950 46.797 113.815 -89.614 95.594 25.341 141.259 -96.495 123.192-127.665 115.325-117.608 95.433 -9.566 114.100 -77.620 109.748-163.332 127.975 9.606 113.522 -12.940 119.710 -76.600 95.170 -55.199 128.860 -76.619 94.839 -28.532 99.117 -82.743 97.140-117.362 118.719 -16.590 104.294 54.549 148.263 -19.362 90.850 48.907 131.065 -78.139 92.003 121.134 128.041-130.888 91.339 -49.554 130.929 -78.561 92.177 -46.728 141.588-119.594 88.551 -49.851 126.487 -19.982 90.708 -60.039 151.622 -33.382 89.195 -54.400 106.342 -80.310 93.565 84.679 104.200 -78.613 92.436 0.000 129.185 -76.143 # 343 total E -1.48308E+02 rmsd from N 0.000 %NC 0.00 93.268 168.855 139.326 -95.924 93.261 56.193 134.313 43.019 91.991 44.238 106.098 -80.826 91.787 47.904 131.212 -77.417 92.130 44.001 150.615-142.823 92.059 43.896 56.771 -66.846 90.616 44.914 121.708 -28.015 89.625 49.467 131.505 -99.817 89.624 46.445 125.246-112.853 93.571 105.371 86.728 -95.722 93.977 -53.759 152.467-111.692 98.175 -47.182 97.644-102.549 91.070 -58.320 142.302 -17.102 109.546-118.011 166.148 -14.235 91.904-130.544 128.391-133.863 97.274 36.815 145.644 151.158 94.433 45.220 135.701 -87.652 92.244 45.995 154.112 -95.752 92.349 48.300 103.218 155.465 92.768 36.413 108.330 -84.143 96.600 37.266 0.000 0.000 92.790 48.764 150.862-157.286 90.027 47.297 129.778-110.576 90.434 41.069 117.365-125.976 90.367 47.863 116.556 -78.543 90.429 49.279 137.335-111.161 91.809 52.466 131.582-133.428 91.971-105.146 102.983 -82.816 104.301 170.298 149.867 -18.311 104.813-167.743 92.029 -96.339 92.506 50.957 115.002 -76.929 91.720 48.539 102.999 -14.619 91.208 45.714 120.289 -11.516 89.964 46.408 130.790 -77.207 89.525 48.271 103.114 -85.074 89.327 46.413 117.981 -31.243 91.251 46.969 131.844 -59.010 92.114 37.198 128.709 -76.622 96.325 129.772 105.462 -87.846 131.771 172.718 148.409 -94.998 92.863 48.576 141.271-112.402 92.421 44.562 129.203 -50.133 91.833 52.245 160.788-127.366 90.121 43.350 127.135-173.019 94.372 105.908 102.206 -79.553 92.549 0.000 128.617 -76.671 # 344 total E -1.54612E+02 rmsd from N 0.000 %NC 0.00 92.834 157.240 131.672 -68.841 93.624 64.230 135.726 56.881 94.412 41.172 106.563 -80.383 92.298 43.863 131.107 -77.266 93.709 46.292 153.387-158.163 94.662 41.959 53.617 -67.163 90.547 43.777 128.897 -23.111 90.014 50.312 128.866-114.696 89.098 50.249 123.923-105.007 88.186 41.500 86.514 -96.184 93.683 151.052 131.446 -79.810 93.291 84.141 135.207-162.834 90.457-171.745 98.004 -85.766 102.726-178.960 155.530-171.119 113.784-101.963 143.973-158.047 94.323 45.056 149.315 144.116 93.435 43.288 135.832 -84.357 91.366 46.043 123.546 -59.380 91.821 50.673 134.783 -42.024 91.156 42.496 153.346 -18.406 91.255 42.877 0.000 0.000 90.254 55.111 107.831 -82.812 89.253 49.106 142.912 -79.724 91.080 38.792 120.665-125.528 90.866 49.754 111.527 -76.884 90.673 65.858 140.387 -99.586 89.986 42.487 144.737-138.345 92.588 41.009 142.834-129.320 100.611 -7.880 139.812 -99.513 135.743-159.872 110.753-102.374 94.467 54.969 114.645 -76.845 91.749 52.368 100.662 -24.877 89.834 50.188 127.274 -21.666 91.726 46.318 129.682 -76.618 91.251 40.138 101.609 -83.522 91.067 50.427 118.238 -48.116 89.737 59.326 133.699 -52.701 88.216 48.453 130.118 -77.910 91.299-167.818 105.610-110.522 93.081 78.295 167.514 -90.081 90.816 47.059 143.341-127.483 90.184 51.745 146.300-104.432 90.673 58.684 145.212 -27.585 87.792 42.479 143.523-157.395 95.146 83.872 101.207 -79.290 92.500 0.000 128.975 -76.483 # 345 total E -1.54790E+02 rmsd from N 0.000 %NC 0.00 93.031 153.764 139.894 -93.506 93.199 50.836 117.136 -34.207 92.938 45.438 104.329 -81.101 92.216 47.624 129.627 -75.260 91.692 44.258 107.493 -79.345 89.061 42.397 76.553 -65.815 88.821 52.176 118.135 -57.876 88.226 45.173 124.726 -90.194 90.195 42.875 124.357-100.153 90.842 45.854 89.965 -93.866 93.101 172.062 126.991 -81.349 92.521 92.325 131.364-158.728 97.306 111.159 105.364 -82.497 89.850 -62.402 149.034-102.990 96.037-122.800 151.787 -31.824 91.580 44.340 136.551 125.620 91.081 49.623 136.234 -83.662 90.900 45.074 129.116 -62.234 92.960 45.067 124.489 -24.331 92.004 41.168 107.754 -82.788 90.024 50.164 0.000 0.000 90.931 49.011 103.907 -83.567 89.248 43.364 148.723 -80.608 90.451 44.377 116.820-128.926 89.469 52.435 112.675 -79.777 89.415 50.047 138.722-108.282 90.454 44.439 129.618-152.547 95.279 -96.977 105.286 -84.261 119.483 169.867 162.148-153.337 134.584-165.261 107.856 -99.261 96.083 45.851 115.134 -77.271 92.889 46.327 102.990 -4.592 91.608 47.084 127.354 1.674 89.925 46.489 130.034 -77.668 89.329 50.035 104.287 -85.668 88.921 51.013 119.114 -18.858 90.372 42.691 129.258 -61.748 92.471 44.124 129.102 -76.465 95.623 114.276 115.966 -99.842 89.039 -58.172 130.356 -77.685 91.937 -43.597 145.443-135.086 87.988 -50.961 121.757 -5.381 89.984 -60.935 158.104 -24.565 89.466 -53.762 138.993-138.525 92.957 90.153 102.747 -79.612 92.527 0.000 128.900 -76.574 # 346 total E -1.49689E+02 rmsd from N 0.000 %NC 0.00 93.030 158.207 136.805 -84.859 93.042 58.574 141.546 55.550 92.624 44.439 106.311 -82.127 92.225 47.326 130.840 -77.198 94.215 44.971 156.765-151.643 92.430 40.158 60.539 -77.336 93.922 42.937 123.452 -43.737 95.279 36.404 133.292-102.376 94.064 49.205 149.162-178.655 91.464 78.974 87.990-105.604 93.178 -64.818 135.521-106.785 105.384 -69.474 89.203 -83.926 91.743 -86.697 146.071 -21.977 128.879 -83.340 175.471-155.887 95.495-110.223 135.578-159.258 94.348 44.732 147.861 150.234 92.692 47.846 136.594 -85.163 91.349 46.123 134.856 -91.611 93.619 44.686 129.931 -45.766 95.626 33.279 141.944-133.583 101.934 28.990 0.000 0.000 97.974 46.083 116.764 -79.710 90.417 45.629 148.699 -89.214 89.783 43.450 109.865-123.613 89.931 49.361 112.114 -79.373 89.883 48.832 141.239-107.334 92.073 47.469 134.077-124.323 94.347 -98.376 152.468 -31.041 114.358 174.551 113.602 -75.108 135.491-167.685 108.302 -99.573 94.813 46.112 114.946 -77.211 93.253 44.938 103.971 -9.542 91.905 46.338 129.792 -2.501 90.157 45.563 129.989 -77.773 88.904 51.310 103.373 -85.478 88.476 54.232 119.919 -26.064 89.747 39.891 130.207 -63.112 93.370 45.551 128.435 -76.088 96.141 84.100 117.441 -93.997 88.700 -80.916 128.485 -76.270 90.173 -44.976 144.593-114.157 89.349 -47.880 112.994 30.059 93.587 -54.543 151.154 -22.898 93.614 -1.525 143.897-136.303 119.573 113.300 100.360 -77.668 92.677 0.000 129.525 -76.812 # 347 total E -1.46738E+02 rmsd from N 0.000 %NC 0.00 92.645 70.178 137.070 -94.753 94.356 55.919 150.694 37.917 95.754 38.659 106.883 -76.847 93.488 46.906 131.931 -77.501 95.071 32.205 133.396-115.394 101.020 39.360 47.792 -73.096 95.151 40.506 154.098 -45.294 90.512 50.238 149.065 -99.845 88.791 61.453 125.131-130.748 87.242 172.466 83.203 -92.095 108.935 79.346 157.582-161.346 92.508 44.663 93.310-121.114 93.925 44.364 110.045 -89.318 105.497 -73.777 152.967-123.013 129.266-128.886 145.126-162.144 124.485 29.292 150.872 166.370 93.576 47.868 134.787 -82.472 89.967 60.814 125.609 -25.875 90.973 54.277 144.619 169.687 90.497 38.513 136.403-160.696 94.385 43.318 0.000 0.000 89.780 53.210 139.421 -27.703 89.754 54.594 134.507 -92.777 87.974 43.515 123.504-133.709 89.590 49.978 107.528 -71.409 92.140 43.598 135.733 -57.536 93.248 40.178 140.910-147.978 92.953 45.229 150.344 -25.413 95.455 63.274 146.552 -20.022 91.485 50.460 102.202-115.848 91.954 35.202 113.581 -78.497 101.192-122.434 139.568-118.064 124.174 161.466 120.473 -77.468 92.398 -70.535 127.196 -75.113 87.792 -51.658 102.755 -79.022 89.389 -54.026 135.989 -45.618 88.392 -45.294 136.390 -70.431 90.201 -49.015 127.441 -75.852 87.741 -51.461 122.753 -22.009 88.901 -51.962 129.293 -76.191 89.907 -40.948 145.956-149.257 90.188 -47.901 125.474 -18.407 88.893 -62.916 153.129 -26.589 89.506 -57.590 108.644 -88.151 92.012 85.299 103.647 -79.843 92.528 0.000 128.796 -76.578 # 348 total E -1.50852E+02 rmsd from N 0.000 %NC 0.00 93.335 169.004 141.580-105.414 94.316 51.211 133.468 35.854 91.356 47.822 106.005 -76.215 92.236 42.963 130.094 -77.501 94.923 45.403 141.656-122.450 95.792 37.864 48.819 -66.013 92.742 46.165 126.386 -12.022 90.625 48.098 130.745-101.366 91.910 49.969 123.583-108.633 93.235 111.020 93.795 -98.373 119.709-114.597 144.635-109.362 94.833 44.960 95.290-101.055 95.380 44.229 103.160 -75.767 93.405 45.582 157.399 -25.961 90.235 48.506 130.559-140.114 91.987 46.878 122.392-118.785 94.516-112.125 129.146 -78.555 100.544 -38.583 140.751-105.163 119.233 72.767 149.322 -31.106 132.966 74.313 154.065-177.797 101.069 35.093 0.000 0.000 91.118 55.527 145.140-149.516 88.877 55.912 134.929-108.456 88.624 49.929 119.072-130.624 88.522 46.791 108.244 -73.124 91.240 48.874 134.441 -76.764 91.660 48.852 135.863-144.423 93.677 -89.958 153.054 -30.397 125.266-173.605 116.073 -76.072 109.664 -68.505 116.712-126.773 92.582 -45.618 113.050 -73.179 93.746 -74.729 113.737 -65.259 89.593 100.292 138.873 -39.253 93.468 48.495 128.867 -76.297 88.666 48.238 98.318 -68.470 90.294 54.983 146.122 -28.838 87.286 47.949 162.529-159.499 90.018 41.735 128.089 -76.382 90.469 48.836 116.195 -29.004 89.826 46.110 130.281 -77.660 90.105 47.363 138.898-124.813 89.085 52.958 130.452 -43.954 88.831 53.731 136.116 -60.572 90.147 45.175 144.932-134.352 94.393 81.440 103.899 -80.456 92.544 0.000 128.869 -76.709 # 349 total E -1.48450E+02 rmsd from N 0.000 %NC 0.00 124.492-114.270 146.715 -43.354 121.441-102.868 131.157 -34.626 92.946 45.988 109.129 -78.403 93.297 42.795 130.939 -77.627 96.369 43.134 145.311-127.553 92.919 41.737 50.569 -74.308 90.856 46.330 159.164 -21.095 90.550 45.248 135.260-102.306 89.719 46.997 135.510-132.544 88.463 52.520 82.927-103.792 90.093 140.190 136.140 -92.797 90.223 82.898 102.930-133.849 91.798 99.307 97.678 -85.395 92.982 -62.193 133.431 -82.763 100.803-124.718 135.056-142.932 91.642 49.329 139.049 120.366 91.407 47.539 133.378 -85.532 90.566 48.127 136.658 -48.909 90.630 47.180 136.464 -22.583 89.995 46.083 110.020 -82.554 89.449 47.324 0.000 0.000 88.572 55.251 111.164 -80.328 88.018 42.391 135.247 -85.656 89.795 47.439 120.198-123.043 88.411 55.559 109.547 -79.960 88.676 51.577 138.278-101.590 90.443 44.202 133.928-126.046 95.128 -98.142 104.013 -82.928 116.376 160.894 151.315 -15.689 104.068 -49.957 93.891 -94.568 111.887-174.263 116.189 -76.423 92.317 55.538 135.577 91.611 95.626 110.653 111.680 -74.914 89.800 -72.145 127.318 -75.054 89.647 -38.906 99.408 -81.531 96.330-108.262 135.748 -32.860 92.008 58.630 140.545 -35.842 91.227 46.742 130.864 -78.022 92.414 126.285 128.598-152.317 91.858 -45.753 131.222 -79.049 90.210 -52.831 142.853-114.568 86.670 -57.219 135.932 -1.242 89.850 -56.700 158.637-151.198 89.202 -34.419 106.029 -87.243 103.193 171.298 147.767 -20.494 92.763 0.000 129.331 -76.052 # 350 total E -1.47939E+02 rmsd from N 0.000 %NC 0.00 93.098 160.159 140.260 -96.716 93.337 53.654 150.513 58.866 91.672 46.603 106.713 -82.898 91.891 54.061 129.942 -76.247 92.697 41.709 153.027-145.776 92.771 42.824 69.789 -93.362 90.934 42.908 115.599 -56.749 89.332 50.345 135.016 -96.425 88.292 47.466 121.560-108.090 89.044 44.116 92.893 -99.619 92.658 60.682 133.044 -96.544 98.329 -63.644 99.896-100.510 115.440 156.924 109.796 -86.667 143.542-141.213 166.220-150.339 101.784-119.719 140.574-154.227 94.118 47.097 140.386 137.620 91.585 47.882 134.082 -86.018 90.587 49.158 122.221 -58.820 91.580 48.300 119.601 -29.562 90.753 44.054 109.006 -82.141 90.714 46.821 0.000 0.000 90.497 55.576 112.714 -80.658 87.876 42.993 142.246 -85.579 90.708 49.965 118.867-127.617 92.277 109.313 110.301 -76.563 90.903 51.779 152.716-135.064 92.346 45.669 139.815-137.446 98.065 -97.838 106.746 -83.297 117.931-164.358 155.459 -21.648 107.690-127.013 93.993 -94.518 97.200 43.695 113.769 -77.062 92.243 45.274 107.132 -12.641 91.319 47.401 134.591 17.314 91.210 46.071 128.006 -76.324 89.903 43.147 101.773 -83.931 90.392 51.293 121.745 -22.284 88.910 47.325 134.420 -57.406 89.916 44.485 128.142 -76.392 91.908 82.361 119.912-103.635 86.415 -87.514 129.986 -77.133 92.383 -49.444 148.438-130.063 89.756 -57.457 117.254 17.962 93.070 111.857 145.238 -29.937 98.300 36.447 142.071-158.407 98.342 24.211 102.957 -75.660 92.403 0.000 129.756 -76.144 # 351 total E -1.51990E+02 rmsd from N 0.000 %NC 0.00 92.936 158.242 138.424 -89.667 93.104 57.023 151.299 114.810 92.592 43.732 107.893 -80.730 92.618 50.816 131.010 -76.671 92.697 39.799 155.604-160.104 91.801 46.280 71.769-102.428 90.530 45.500 111.149 -75.481 89.029 52.410 139.715 -98.737 88.894 49.048 117.621-113.164 89.952 176.885 87.880 -92.706 110.669 48.232 143.893-149.909 93.867 60.365 98.748-128.960 91.875 66.402 105.998 -85.996 93.753-104.005 125.719 -90.266 102.567-117.478 140.882-154.187 93.088 48.589 140.931 146.121 91.815 46.508 135.392 -86.012 90.158 49.490 120.289 -56.942 90.694 51.751 117.619 -31.902 89.737 44.865 150.384-157.057 90.376 44.825 0.000 0.000 90.245 53.438 108.864 -82.608 88.877 48.493 142.262 -75.380 90.854 41.000 120.598-126.856 90.851 52.155 112.299 -77.674 90.980 79.475 133.394 -96.839 90.742 61.414 139.528-144.233 91.581 11.003 107.772 -86.421 115.441 106.048 147.284 -19.433 137.475 179.058 108.320 -96.923 97.787 42.725 110.960 -76.835 92.858 48.543 158.138 27.605 89.231 50.286 134.898 -20.271 90.166 46.191 127.888 -76.158 90.555 46.134 104.815 -86.163 90.547 42.593 132.325 -82.430 90.512 57.568 130.705 -76.593 88.749 62.037 128.515 -76.941 87.777-176.540 79.239 -89.030 91.616 68.479 130.902 -77.047 90.960 47.949 141.120-104.766 92.747 39.204 132.391 -35.636 93.161 50.538 165.446-152.647 91.364 40.960 131.181-151.625 94.975 57.299 103.278 -79.196 92.490 0.000 129.315 -76.428 # 352 total E -1.46951E+02 rmsd from N 0.000 %NC 0.00 92.964 153.631 139.448 -92.220 95.274 49.118 116.239 64.992 90.568 47.131 138.368 -17.551 91.133 48.407 134.176 -79.339 94.514 95.109 149.000 131.931 82.793 -60.779 66.681 -81.510 96.763 -54.976 121.440 53.416 99.933 -30.988 164.096 125.840 101.346 -47.909 140.017-131.950 92.942-106.291 84.033 -94.306 112.513 79.547 131.639 141.273 91.594 49.483 95.633-126.117 95.470 35.443 102.482 -82.882 94.008 52.986 166.499-164.497 92.075 36.251 134.155-123.892 96.325 45.562 121.460-120.414 98.636 -0.718 134.994 -81.710 122.637 168.858 142.692 -86.997 105.361 34.950 98.979 149.898 95.921 47.678 109.618 -81.309 111.826 13.026 0.000 0.000 101.712 37.408 165.417 176.307 98.381 37.053 154.389-179.600 91.197 52.296 111.752-143.956 89.659 46.099 110.651 -79.412 91.506 52.439 155.398-124.286 90.618 43.850 120.896-163.806 96.783-115.589 105.775 -83.540 95.372-163.475 148.010-121.822 108.924 -49.913 91.341-109.397 113.446 -10.996 115.260 -79.585 93.287 -52.886 110.809 -56.710 96.001 -31.199 116.704 -71.889 97.804 -46.619 127.661 -76.490 95.444 -30.334 101.606 -85.226 90.226 -57.186 103.239 -51.154 89.397 -61.121 150.386 -20.537 88.776 -50.318 128.581 -76.724 92.184-132.092 124.144-141.543 91.179 57.102 132.782 -77.264 91.622 44.903 140.157-104.035 90.811 45.389 124.807 -23.844 92.038 70.171 144.986 -31.608 87.256 54.663 142.503-164.127 92.741 106.745 100.236 -79.676 92.447 0.000 128.955 -76.249 # 353 total E -1.46937E+02 rmsd from N 0.000 %NC 0.00 93.154 156.935 142.120-102.698 94.080 51.118 125.320 44.814 90.029 45.758 106.276 -82.160 91.144 53.655 129.887 -77.260 88.016 48.552 154.324-166.834 88.762 48.843 69.513 -67.487 88.791 45.873 107.476 -44.440 87.655 58.075 151.123 -76.827 85.441 46.929 121.845-124.266 89.325 45.621 72.655 -88.464 90.793 51.805 143.458 -49.542 96.798 32.713 97.245 -98.038 92.499 56.071 136.893-112.865 92.809 42.983 113.421-116.902 103.060-148.326 140.283-131.281 95.277 68.873 137.861-107.885 99.664-163.570 148.063 -77.107 101.026 52.352 145.882-124.549 94.778 44.759 141.243 -0.585 95.149 39.928 146.570 -22.873 96.609 39.924 0.000 0.000 100.049 31.146 113.584 -89.890 99.300 32.233 170.044-164.491 100.230 38.806 119.470-147.132 91.297 53.152 114.884 -74.898 90.159 49.616 125.023 -92.920 91.011 48.848 136.577-126.807 96.361 -16.578 108.296 -89.137 137.299 78.734 176.418 178.712 102.095 -43.151 101.890 -94.702 111.816-175.414 118.563 -76.971 93.408 58.805 116.639 137.946 94.912 94.705 111.603 -74.908 89.663 -72.757 127.761 -75.535 91.766 -44.458 97.920 -81.023 88.219 -52.333 119.494 -35.435 94.065 -30.793 153.321 -17.239 99.187 -56.259 129.829 -77.382 122.547-106.170 136.632 34.193 92.217 54.524 130.362 -76.402 92.269 41.860 140.967-106.858 90.152 50.321 131.192 -39.831 90.242 67.499 141.331-107.397 85.799 43.043 129.022-166.335 94.602 94.035 99.344 -78.087 92.418 0.000 129.151 -75.956 # 354 total E -1.48233E+02 rmsd from N 0.000 %NC 0.00 93.112 -65.457 127.271 -77.499 93.973 -50.091 117.721 -79.006 91.103 -45.453 103.232 -78.038 90.547 -46.894 127.962 -75.448 91.426 -40.229 141.132-129.020 95.370 -39.667 64.818 -68.998 93.268 -37.538 126.732 -22.720 101.609 -34.449 174.425 164.920 98.561 -61.915 126.575-117.739 92.906-151.077 78.619 -89.762 102.542 69.379 155.066-167.176 98.109 34.223 90.028-118.327 93.423 50.631 111.301 -81.670 91.275 74.024 142.422 -29.221 89.778 43.430 123.388-121.484 94.370 38.611 134.371-104.008 102.934 -32.703 132.128 -64.713 139.681 167.098 112.987 -31.139 96.132 56.449 156.642-133.010 97.928 43.794 109.863 -82.238 112.036 14.681 0.000 0.000 95.301 49.650 132.922-101.291 91.896 45.133 137.774-110.398 90.600 44.546 116.084-128.610 89.577 46.682 115.438 -77.280 90.856 47.767 137.376-108.254 92.058 52.202 131.398-137.201 91.970-101.898 102.875 -82.777 110.052 170.584 150.948 -16.557 100.042-171.545 94.776-100.307 94.420 47.164 115.444 -77.335 92.127 46.772 111.574 -26.296 91.772 44.466 129.415 -18.667 92.823 42.433 129.503 -76.634 92.587 40.613 102.366 -84.650 90.245 51.291 115.606 -38.028 90.107 56.332 131.621 -51.303 89.411 33.878 130.667 -77.619 93.401 111.593 102.026 -98.824 94.242 -35.022 130.324 -78.574 96.020 -54.050 141.486-120.757 95.233 -16.201 125.158 -19.432 106.440 -57.638 155.749 -22.811 91.219 -40.328 141.219-113.678 97.397 78.812 101.171 -79.437 92.506 0.000 129.016 -76.558 # 355 total E -1.48248E+02 rmsd from N 0.000 %NC 0.00 93.054 -65.878 127.170 -77.201 94.220 -49.273 117.286 -78.541 91.098 -46.242 103.515 -77.883 90.607 -47.131 127.889 -75.536 91.415 -40.390 140.364-126.196 94.769 -40.492 65.448 -68.062 93.129 -39.659 128.589 -16.123 100.392 -36.772 173.544 160.352 97.936 -59.642 131.874-119.535 96.432-151.377 81.099 -94.919 113.031 57.942 151.788-173.924 94.889 41.080 92.200-120.809 92.699 48.214 108.487 -82.008 91.803 51.608 144.319 -34.102 89.482 45.236 132.771-126.323 92.866 50.348 128.430-113.450 96.501-108.028 128.294 -75.053 97.458 130.754 136.691 -90.807 91.962 111.003 143.671 171.645 89.523 63.021 139.840-154.056 90.219 46.563 0.000 0.000 89.374 53.042 120.720 -71.234 88.749 45.443 138.434 -84.676 88.777 48.016 120.425-126.937 88.008 54.100 108.251 -77.233 89.315 52.036 141.591 -95.568 90.404 39.240 129.909-148.074 96.429-111.220 143.678-125.095 116.038 177.924 153.038 -16.122 97.721 -58.124 94.347 -96.128 88.612 -51.581 111.374 -75.620 89.528 -52.011 119.833 -18.094 89.994 -45.838 115.179 -68.412 92.060 -39.689 126.993 -75.670 92.657 -42.067 100.942 -80.466 89.699 -47.663 127.307 -10.275 93.128 -41.213 152.257 -25.673 92.279 -44.493 128.937 -76.356 92.335 -59.919 124.492 -38.802 92.555 115.848 129.892 -75.545 93.993 40.673 140.482-104.683 93.486 52.422 147.853 19.961 94.697-139.072 143.194 -43.354 96.865 30.320 135.913-140.825 117.817 30.855 106.758 -79.928 92.343 0.000 129.106 -75.756 # 356 total E -1.49095E+02 rmsd from N 0.000 %NC 0.00 93.205 165.445 140.101 -97.936 93.768 53.999 134.846 42.995 91.759 45.410 106.109 -81.156 91.741 47.513 130.737 -77.571 92.703 46.823 151.972-138.847 91.793 42.182 57.777 -70.131 91.003 46.070 129.394 -29.416 90.972 46.820 129.412-110.219 87.111 50.828 139.164-174.767 88.627 54.836 77.268-105.906 87.461 157.968 138.383 -90.430 98.408 61.486 127.450-150.697 92.673 36.019 98.543 -81.601 94.139 52.884 144.057 -34.188 91.730 40.046 138.891-116.680 93.733 50.032 117.326-156.069 94.043 29.531 125.416 -83.019 101.048 153.431 149.341 -84.084 98.693 37.611 98.069 141.843 95.185 41.769 141.430-122.983 102.056 25.017 0.000 0.000 105.371 31.835 155.993 0.299 95.318 40.288 169.502-155.666 91.762 52.152 114.474-145.749 89.923 43.218 106.177 -70.189 93.955 48.142 136.491 -57.652 97.241 3.381 136.791-125.605 116.067 47.803 112.280 -85.378 98.850 58.541 148.374 -24.377 131.133 172.774 114.857-111.650 93.606 44.171 114.431 -77.669 97.077-178.328 117.356 -47.430 93.602 94.666 118.355 -76.397 92.033 53.342 129.377 -76.246 88.871 45.314 111.406 -85.546 89.251 51.313 139.003-109.861 88.386 55.614 141.539-158.570 87.475 46.733 127.828 -76.269 89.453 47.148 101.812 -61.256 91.143 44.075 128.332 -75.017 91.881 43.891 135.469-150.131 90.735 47.942 130.665 -48.137 90.245 52.405 133.122-111.325 90.629 42.470 132.297-138.677 96.103 72.757 146.894 -24.528 92.514 0.000 129.023 -76.627 # 357 total E -1.46742E+02 rmsd from N 0.000 %NC 0.00 92.827 136.850 137.835 -84.597 92.639 53.155 152.181 124.480 90.946 50.686 146.661 -26.790 90.840 47.189 128.899 -75.522 90.870 44.270 155.035-145.134 92.674 42.491 127.201-175.503 91.599 45.926 115.934 -61.535 90.651 47.013 132.257 -98.904 89.446 60.848 143.606-132.272 86.693 127.117 83.912-106.631 94.643-110.815 134.210-117.055 93.655 55.420 96.675-117.635 95.184 40.134 106.222 -87.440 91.149 54.376 158.529-145.656 90.413 43.430 121.509-129.796 93.819 53.594 124.243-115.769 97.960 -38.641 136.700 -64.889 126.460 176.181 147.017 -79.731 97.278 48.650 123.799 131.082 94.255 47.066 139.352-166.885 95.846 37.764 0.000 0.000 93.764 43.809 155.330-143.364 92.998 42.629 126.447-122.139 91.934 43.332 113.791-122.120 90.030 46.561 109.020 -75.837 91.354 52.927 131.763 -85.129 90.542 42.915 134.126-146.331 92.132 40.019 142.592-129.275 97.122 118.079 111.832 -90.115 94.707 96.733 137.510-164.655 92.104 26.814 112.291 -77.388 98.885-176.901 127.816-104.661 117.406 30.359 121.922 -79.495 92.355 48.381 129.558 -76.151 91.575 59.901 104.028 -85.712 96.360 -8.426 101.495 -69.868 112.037 63.599 153.783 -15.706 91.123 42.770 131.111 -78.112 93.751 114.702 80.369 -97.721 94.282 -39.429 128.701 -76.382 95.527 -48.321 141.855-117.231 94.497 -28.873 123.421 -13.050 100.537 -59.885 154.208 -29.456 90.050 -41.375 141.589-135.116 97.182 68.861 100.094 -79.612 92.497 0.000 129.104 -76.399 # 358 total E -1.49493E+02 rmsd from N 0.000 %NC 0.00 93.062 -75.509 123.163 -61.766 117.307-104.464 132.009 -36.847 93.087 42.381 108.488 -81.748 93.321 49.826 130.319 -76.885 93.348 40.791 153.329-146.065 91.318 45.609 60.422 -78.936 89.857 45.291 118.162 -40.013 89.430 48.520 136.466 -96.834 88.011 45.964 128.956-120.655 89.798 48.359 80.810 -97.056 91.056 170.074 131.223 -72.443 94.704 96.053 130.732-156.905 93.944 108.158 106.596 -81.389 91.209 -64.765 148.492-107.042 97.299-126.122 134.490-143.437 92.413 42.889 139.171 137.600 91.126 49.533 133.006 -83.224 91.269 45.620 107.287 -21.683 93.479 39.778 127.694 -33.028 98.380 27.709 109.898 -82.742 103.090 29.696 0.000 0.000 97.871 38.059 146.625 -13.531 95.556 39.901 136.951 -98.915 91.776 49.567 131.981-159.989 88.032 53.000 105.404 -75.781 89.907 55.076 110.595 -60.567 90.647 44.101 126.280 -9.606 93.040 44.986 152.228 -22.652 99.928 31.200 112.063 -86.448 141.242-177.276 104.154 -85.989 99.079 108.661 115.577 -77.931 93.766 -49.635 104.627 -81.643 88.024 -51.665 109.442 -71.923 89.063 -58.351 127.791 -76.247 86.657 -51.514 104.948 -81.189 85.095 -63.084 101.290 -55.122 86.919 -56.787 145.823 -21.257 89.195 -51.955 127.908 -75.020 91.474-136.318 119.699-129.624 90.975 53.393 132.450 -77.178 90.728 48.067 140.726-108.554 91.194 56.343 118.611 -15.540 92.261-105.185 136.395 -58.098 110.967 -21.314 107.399 -85.126 111.130 118.096 100.237 -73.386 92.613 0.000 129.533 -76.676 # 359 total E -1.49605E+02 rmsd from N 0.000 %NC 0.00 92.899 153.050 136.855 -83.328 93.056 59.447 130.915 49.263 92.328 42.688 106.717 -81.289 91.983 47.288 129.934 -76.245 90.874 44.277 155.622-160.835 92.590 43.096 58.137 -61.903 91.321 43.484 121.462 -17.417 89.129 49.152 135.913-100.253 90.683 47.811 114.936 -98.336 91.230 170.144 93.864 -87.643 93.597-177.072 137.169-159.159 94.218 51.695 95.404-133.363 95.468 56.048 108.190 -89.104 95.169 -88.113 153.631-130.131 112.859-109.837 143.466-160.955 96.137 39.578 153.075-138.496 93.898 47.661 135.268 -81.709 91.651 45.646 124.174 -59.781 92.863 48.757 94.427-105.198 91.614 41.672 131.098 158.973 89.832 45.855 0.000 0.000 91.970 45.940 95.926 -80.835 91.271 45.368 161.465 -40.849 90.898 41.057 114.618-135.765 90.791 47.511 110.822 -77.470 90.703 50.394 141.591 -98.987 91.209 40.635 145.273-102.207 93.617 40.409 152.458 -21.966 97.243 41.812 111.306 -84.237 104.596-145.721 97.847 -87.657 126.052 33.718 120.465 -81.534 128.174-102.232 135.701 -45.389 90.967 57.662 114.192 -72.333 91.388 48.329 129.492 -76.440 89.234 44.641 142.403 -24.723 89.265 53.743 151.462 -16.234 88.507 48.657 145.643-139.272 89.596 39.197 127.643 -76.431 89.218 83.647 133.098 -53.148 89.465 54.334 128.512 -77.220 88.556 40.573 141.551-116.239 91.580 49.596 125.630 -31.930 90.810 48.594 137.913 -58.616 91.341 42.600 148.536-159.465 95.939 70.724 103.311 -80.368 92.471 0.000 129.084 -76.704 # 360 total E -1.50430E+02 rmsd from N 0.000 %NC 0.00 93.212 165.667 137.704 -89.369 92.925 58.761 146.335 34.759 92.884 43.334 106.277 -83.040 92.150 50.333 131.636 -77.160 92.731 43.564 149.697-128.455 90.380 43.237 64.452 -78.875 91.943 43.748 121.042 -49.896 93.803 39.791 130.068 -97.313 91.362 45.081 147.469-156.821 92.486 87.319 85.040-105.525 91.615 -59.404 141.634-110.666 101.871 -71.480 91.796 -93.334 87.035-110.877 145.911 1.269 106.268 -80.410 144.334-116.381 99.417-105.551 111.581 -85.811 93.475 47.971 154.741 177.549 92.675 45.913 137.354 -84.745 90.530 50.648 141.702 -71.320 90.498 47.224 122.770 -49.333 91.320 41.328 108.012 -82.971 95.765 37.683 0.000 0.000 93.389 46.170 140.584-104.254 90.570 44.110 129.147-122.827 90.624 43.560 113.310-127.063 89.538 49.174 114.992 -78.785 90.018 50.083 141.076-116.171 91.532 46.375 131.767-134.982 94.091-101.840 141.881-121.771 115.720-176.100 152.061 -17.725 131.127 -69.012 112.428-108.248 112.175 -20.204 114.157 -79.750 95.073 -42.971 117.182 -53.927 100.745 -25.209 117.525 -72.291 99.161 -43.760 128.004 -76.387 95.804 -32.067 103.220 -86.031 93.604 -45.647 105.073 -58.964 90.870 -46.095 152.375 -26.579 92.164 -60.863 127.997 -75.772 90.630-112.807 127.326 -32.533 91.453 54.370 130.094 -76.277 91.817 54.624 143.527-118.325 91.080 54.320 132.297 -39.025 92.104-124.490 143.143 -37.137 97.298 18.390 134.630-133.072 123.184 100.599 103.472 -79.887 92.523 0.000 129.498 -76.605 # 361 total E -1.48063E+02 rmsd from N 0.000 %NC 0.00 93.175 -64.015 128.858 -83.290 94.612 -46.284 115.188 -80.716 90.550 -47.505 103.121 -76.762 90.274 -47.123 129.599 -76.365 92.658 -39.052 139.371-117.154 95.375 -40.678 61.709 -63.032 92.329 -38.532 133.225 -5.479 101.894 -38.960 169.241 168.706 92.063 -68.239 118.311-109.121 87.312 -98.945 85.678 -85.678 124.029 106.073 157.862 171.402 96.221 40.329 92.277-115.952 94.131 44.341 108.822 -84.539 91.825 52.628 162.796-166.020 92.639 38.137 106.066 -85.005 95.459 40.151 139.575-104.185 101.103 -13.257 131.334 -92.927 131.108 165.981 130.781 -74.493 96.874 48.148 125.048 143.548 96.330 43.293 109.416 -81.417 108.488 19.183 0.000 0.000 99.836 38.263 160.315 174.777 97.724 38.761 161.004 174.937 90.700 49.756 112.334-145.213 90.251 45.525 110.544 -79.781 91.660 51.198 154.642-118.973 91.830 45.577 132.137-161.471 95.360-114.195 105.880 -83.865 94.027-163.033 146.762-118.989 106.948 -42.097 90.978-108.006 106.473 -25.669 113.826 -78.544 95.933 -41.864 117.081 -61.973 98.104 -37.623 113.302 -74.328 93.845 -44.908 127.997 -76.820 92.773 -38.066 102.473 -81.051 90.730 -46.251 123.800 -23.285 108.283-169.658 159.428 0.658 124.036 18.103 127.266 -96.075 93.335 58.251 125.535 -29.019 91.027 49.962 132.020 -77.131 89.511 44.415 146.496-111.005 89.962 48.675 130.280 -42.890 89.965 54.452 137.223 -55.571 89.694 44.119 137.118-124.224 94.731 79.425 103.877 -80.545 92.520 0.000 128.833 -76.669 # 362 total E -1.50519E+02 rmsd from N 0.000 %NC 0.00 93.149 -65.252 128.352 -81.096 94.430 -47.655 116.753 -79.826 91.047 -46.322 103.366 -77.266 90.609 -47.446 128.444 -75.563 90.886 -41.181 141.409-126.965 93.577 -41.084 58.378 -55.822 91.822 -43.351 132.632 29.960 95.567 -41.541 168.931 173.585 91.563 -60.827 120.846-116.785 87.382 -80.392 80.562 -81.550 108.584 165.652 150.386 163.483 106.162 -24.501 92.240 -94.819 94.881 91.226 108.164 -81.152 95.465 136.433 151.417-111.967 123.908 -3.046 164.269 -4.331 95.958 45.260 138.201 -89.163 91.780 48.208 107.197 -36.035 92.245 52.998 82.309 -21.399 93.603 34.939 165.715-178.814 103.421 18.752 109.194 -81.820 100.524 45.533 0.000 0.000 93.507 47.431 151.774-148.924 91.664 40.314 163.767-160.705 90.916 44.240 107.879-133.446 91.128 51.338 112.367 -80.122 89.291 51.795 151.369-120.456 90.761 44.704 132.413-149.690 95.472-109.116 104.222 -82.989 99.972-161.896 150.227-125.899 106.370 -43.017 93.255-101.081 100.093 -34.544 113.009 -77.615 95.267 -39.882 114.220 -54.166 95.484 -43.232 111.585 -72.722 92.628 -42.393 129.106 -77.633 91.204 -43.796 99.539 -81.460 86.951 -55.977 122.005 -15.061 90.851 -50.966 150.570 -14.194 89.843 -51.774 128.072 -76.104 92.941-135.624 137.904 16.503 90.901 56.570 132.000 -76.828 90.638 44.682 142.380-113.171 89.814 47.353 129.248 -38.758 90.896 58.915 140.313 -44.782 88.142 46.731 145.448-147.372 93.253 94.617 102.782 -80.153 92.614 0.000 128.721 -76.722 # 363 total E -1.51861E+02 rmsd from N 0.000 %NC 0.00 92.837 143.145 136.626 -82.570 93.472 52.018 130.447 -40.743 92.054 46.308 105.175 -83.314 92.089 47.231 128.057 -75.312 90.899 48.473 112.038 -78.120 89.540 43.649 69.024 -66.113 88.143 49.091 121.181 -37.836 87.891 49.308 114.416-100.268 88.953 51.560 122.037 -95.478 88.452 63.584 91.858 -96.585 91.393-163.447 123.057 -86.542 96.384 72.055 128.692-152.233 93.550 41.321 103.263 -81.477 91.356 57.680 142.558 -29.115 90.360 44.080 127.029-118.966 92.947 49.067 121.055-146.437 94.320 31.141 131.047 -89.230 101.947 146.173 157.896-126.573 96.129 46.503 142.254 135.034 93.981 46.539 142.772-161.152 94.250 40.464 0.000 0.000 92.024 49.197 147.158-124.746 90.615 43.856 124.084-124.559 91.266 40.884 115.016-125.854 92.174 45.337 110.803 -75.023 93.115 41.701 138.247 -92.296 96.239 36.462 130.638-136.164 108.601 13.305 108.960 -85.557 100.055 55.936 154.353 -20.090 97.526 88.324 129.583-152.136 87.798 50.452 114.515 -78.248 91.551 63.099 130.660-106.232 92.492 179.701 109.384 -73.795 91.508 64.167 129.498 -75.803 90.203 43.549 101.050 -80.384 90.404 48.786 148.633 -28.448 89.495 48.359 146.633-123.210 90.219 42.090 128.223 -76.813 89.644 49.219 113.754 -34.326 90.541 47.777 128.834 -76.544 90.321 46.919 136.430-125.370 92.161 71.509 129.844 -42.357 88.676 -97.429 137.983 -67.701 97.310 -28.937 106.748 -85.193 105.923 -87.060 141.772 -20.641 92.814 0.000 129.511 -76.330 # 364 total E -1.48228E+02 rmsd from N 0.000 %NC 0.00 93.124 -61.933 127.715 -79.403 93.827 -49.027 116.634 -78.119 90.876 -46.895 103.334 -77.432 90.700 -46.738 128.323 -75.669 91.044 -40.781 141.235-127.012 94.414 -41.150 62.433 -65.884 92.812 -39.042 128.626 -24.065 100.536 -34.887 168.676 165.753 95.543 -58.313 135.550-117.317 94.892-158.623 86.448 -83.813 138.268 65.138 169.069 172.530 94.945 38.205 96.318-115.812 96.124 42.126 100.077 -79.536 92.665 53.806 147.866 -45.252 90.819 46.936 146.625 -35.823 91.999 43.835 128.003-118.184 96.864 1.264 127.398 -89.437 138.258 177.360 132.173 -89.188 94.968 49.555 131.391 -10.877 92.312 53.999 148.729-164.317 90.272 47.497 0.000 0.000 90.472 45.964 113.690 -78.293 90.340 45.426 147.057 -79.323 91.216 43.079 119.710-128.479 89.036 50.188 110.395 -77.217 89.637 51.972 137.499 -95.974 91.671 57.713 133.881-146.055 93.602 -4.482 105.680 -86.203 113.978 125.685 143.008 -25.898 110.536 -92.995 95.505 -99.526 101.590 -18.823 111.970 -81.277 97.418-122.382 124.102 -22.294 94.613 46.426 114.103 -76.546 92.356 53.704 129.203 -75.854 94.126 32.697 101.663 -77.026 95.638 47.487 142.782 -19.446 93.676 33.983 130.538 -94.527 95.176 45.757 128.667 -77.380 96.270 82.319 114.784 -71.527 88.696 -87.477 129.598 -76.568 92.384 -39.850 141.603-117.538 89.299 -49.327 132.390 -10.997 91.486 -55.356 151.743 -98.983 90.274 -54.907 101.453 -94.729 92.071 87.488 104.284 -79.115 92.467 0.000 128.881 -76.631 # 365 total E -1.46372E+02 rmsd from N 0.000 %NC 0.00 93.191 -73.942 123.767 -63.411 119.375-104.341 127.733 -36.769 92.943 43.316 109.746 -80.858 93.830 45.650 130.823 -77.340 96.225 38.962 153.140-139.978 93.385 44.901 55.282 -81.054 89.454 46.159 121.133 -37.520 90.340 49.529 126.502 -98.785 87.372 46.317 131.589-118.741 90.827 60.290 83.142 -98.780 91.876-170.815 132.854 -81.855 93.822 72.100 100.675-121.492 95.254 38.647 106.164 -81.552 91.080 51.266 148.264 -33.978 91.314 46.852 124.226-125.728 90.893 49.279 122.674-124.361 91.754 41.224 130.935 -81.537 96.101-110.681 146.203-118.582 108.103-113.403 130.821 -42.257 90.646 60.291 115.054 -80.656 91.215 45.658 0.000 0.000 89.822 50.544 116.170 -78.546 90.810 40.199 137.724 -83.129 92.722 47.552 138.301-165.243 88.486 52.934 111.405 -78.113 89.937 54.287 129.194 -95.089 90.490 52.998 110.262 8.511 91.894 20.968 152.932 -23.134 112.071 61.476 110.483 -81.237 142.789 167.963 103.342 -84.299 95.667 41.196 115.872 -77.427 91.918 52.803 101.966 -4.873 88.343 54.791 128.283 -4.643 91.509 46.042 128.877 -75.903 90.787 39.265 105.367 -84.742 90.549 67.313 115.299 -22.055 90.136 62.060 132.626 -45.279 88.316 33.369 131.231 -77.653 94.968-169.732 113.183-111.752 117.933 104.655 168.446 -88.505 93.911 48.157 139.797-108.272 92.397 45.955 127.797 -22.520 91.517 56.920 150.370 -27.397 89.231 44.519 138.406-148.107 94.285 84.918 103.086 -80.193 92.549 0.000 128.772 -76.664 # 366 total E -1.54042E+02 rmsd from N 0.000 %NC 0.00 124.246-106.398 147.026 -42.328 119.456-105.125 131.263 -41.815 92.017 44.869 107.631 -80.798 92.877 47.887 130.754 -77.536 95.205 41.550 155.827-146.892 93.636 41.808 55.870 -79.374 89.577 46.971 118.885 -35.419 89.209 55.770 132.766 -98.426 86.694 47.367 131.284-118.195 89.745 40.061 78.935 -97.914 94.143 173.155 131.053 -69.574 95.109 63.406 137.563-166.305 96.205-136.578 101.789 -82.621 110.713-129.312 160.485-145.113 100.143-119.683 133.646-160.295 92.730 47.141 138.645 130.272 91.622 47.587 135.105 -84.594 91.162 45.085 120.036 -61.918 92.773 46.558 128.858 -26.691 93.625 42.452 153.142 -12.587 91.125 44.540 0.000 0.000 90.219 56.327 104.186 -84.135 88.425 51.045 146.376 -74.377 90.452 39.770 120.500-128.320 90.750 48.511 111.640 -76.948 90.301 62.904 143.020-103.151 90.056 45.623 146.728-128.023 91.936 39.249 152.779 -21.940 100.550 -6.619 115.467 -89.114 138.504-158.419 104.108 -88.847 95.523 51.773 115.066 -76.858 91.846 52.760 99.608 -14.244 89.949 50.991 117.186 -7.439 90.494 49.417 129.771 -76.029 89.469 43.469 103.010 -84.628 91.827 43.016 121.130 -37.429 92.318 52.681 135.308 -50.049 90.319 58.478 130.953 -78.600 91.958-163.915 106.780-117.640 92.534 67.625 158.912 -92.531 90.425 48.424 143.681-130.783 88.708 67.189 148.363-112.609 89.124 64.668 143.911 -36.234 86.872 40.317 143.854-156.485 95.931 81.797 99.583 -78.322 92.497 0.000 129.120 -76.453 # 367 total E -1.47522E+02 rmsd from N 0.000 %NC 0.00 93.133 151.600 142.787-104.406 93.388 54.671 131.854 45.399 92.025 42.742 106.091 -81.529 91.687 49.680 130.952 -77.082 90.423 44.883 153.017-146.094 91.196 44.650 60.274 -65.796 89.999 46.221 124.608 -29.352 88.419 48.606 133.085-105.932 88.840 52.398 119.816-112.019 88.858 72.977 90.880 -96.208 87.973-164.445 140.398-101.100 94.199 68.157 98.341-129.541 92.674 40.525 99.461 -81.703 94.743 103.031 143.879 -38.463 95.995 40.764 138.602-163.213 93.507 40.063 131.379-101.841 92.566 49.958 139.572 -37.370 93.149 44.191 109.364 -35.345 95.731 28.434 154.182-171.747 106.732 22.422 107.420 -83.055 100.559 39.741 0.000 0.000 93.384 44.800 140.820-125.462 92.070 42.008 120.562-117.217 91.275 41.760 115.199-120.311 90.596 49.212 114.963 -79.399 90.482 49.726 134.295-106.566 92.169 47.701 129.934-146.343 95.080 -99.830 152.204 -31.660 107.535-172.176 114.705 -76.924 105.620 -43.399 95.929-108.683 101.923 -40.915 111.485 -79.437 94.481-116.404 120.117 -57.982 93.726 49.837 106.348 38.333 91.023 51.719 130.898 -76.063 92.649 37.623 145.338 -32.180 94.137 40.279 120.988 -13.537 93.428 44.313 144.813 -40.100 92.599 41.532 129.479 -77.788 92.476 112.758 109.714 -61.533 92.246 -43.337 130.559 -78.373 96.399 -52.320 146.361 163.822 97.090 -75.133 123.332 -1.989 93.380 79.501 153.627 -30.251 93.768 46.303 147.170 176.998 94.117 72.443 95.759 -75.823 92.486 0.000 128.982 -76.609 # 368 total E -1.56007E+02 rmsd from N 0.000 %NC 0.00 93.247 167.778 140.074 -98.560 93.370 55.251 138.737 33.932 91.933 46.085 105.929 -81.897 91.998 46.426 130.178 -77.036 93.691 46.851 144.543-127.745 92.336 40.603 57.892 -73.005 92.259 44.496 125.385 -32.286 92.412 41.849 131.003-108.208 90.932 51.819 141.742-140.540 87.576 51.426 79.476-103.191 92.658 151.735 128.731 -78.896 91.419 76.982 128.885-153.731 94.226 110.746 98.012 -83.297 92.011 -65.886 139.323 -52.600 94.084-123.357 140.807-135.879 90.478 49.037 134.106 122.986 91.611 47.643 134.401 -85.771 90.976 45.378 147.424 -10.827 90.128 48.982 138.578 -22.480 88.719 49.544 142.755-149.525 90.515 44.133 0.000 0.000 89.578 48.841 121.380 -75.339 89.524 46.475 136.874 -84.691 88.700 46.417 121.952-126.081 88.811 48.913 109.528 -79.935 89.919 48.624 138.075 -99.190 91.700 48.291 132.291-126.258 93.717-100.960 103.150 -82.683 110.314-177.997 150.902 -17.021 132.018-162.246 110.021-104.948 96.450 44.170 115.030 -77.268 94.354 42.379 105.309 -15.162 93.592 43.775 131.322 -8.426 90.019 48.586 129.834 -77.270 88.638 49.444 102.058 -85.096 90.354 44.593 130.646 -39.265 92.061 40.280 132.875 -79.934 93.229 44.296 128.646 -77.134 91.745 54.913 110.038 -81.640 92.359-153.457 128.952 -77.293 94.902 12.353 141.004-116.811 103.937-110.023 133.167 -21.241 124.271 119.851 159.735 -10.132 96.743 74.726 140.513 174.025 96.254 83.583 98.411 -78.191 92.456 0.000 129.095 -76.260 # 369 total E -1.50254E+02 rmsd from N 0.000 %NC 0.00 93.022 168.751 135.486 -82.756 93.156 61.491 143.104 51.491 94.113 42.365 105.790 -81.507 92.497 45.673 131.779 -77.804 94.212 45.303 149.199-140.335 92.017 43.482 57.846 -74.016 90.996 46.193 125.918 -36.106 92.113 42.203 126.077-105.989 91.029 49.101 145.469-152.177 91.416 79.929 86.153-104.806 91.735 -70.391 131.320-100.109 101.732 -63.533 93.345 -85.434 95.015 -67.886 154.070 -21.040 112.719-165.760 151.840-146.427 117.375-103.792 150.953-168.126 95.992 41.680 144.803-111.289 92.136 46.394 136.741 -75.287 90.352 52.023 120.971 -72.223 91.323 50.729 136.664 -37.590 91.654 39.127 141.977-164.532 90.591 47.616 0.000 0.000 90.281 57.846 102.561 -83.613 88.515 46.322 143.272 -79.282 90.717 40.872 117.381-124.597 90.890 51.919 109.808 -75.992 90.056 56.786 139.295 -94.019 90.606 35.395 134.914-126.890 95.515 46.117 114.228 -89.608 97.865 5.950 141.636 -95.058 127.899-141.660 113.996-111.874 94.978 19.571 114.068 -77.228 116.160 163.621 122.041 19.856 108.826 -13.698 118.984 -74.302 93.892 -57.231 126.598 -75.218 90.316 -30.114 103.089 -84.654 98.247-116.352 120.037 31.912 90.974 51.752 144.938 -29.814 91.488 49.447 129.035 -77.227 90.159 85.559 114.458-124.733 93.587 174.715 128.853 -77.175 91.840 51.112 140.480-103.398 90.916 47.757 127.938 -34.115 90.352 60.937 146.591 -23.178 87.874 45.491 138.185-145.313 94.024 101.542 101.761 -79.931 92.489 0.000 128.866 -76.643 # 370 total E -1.47258E+02 rmsd from N 0.000 %NC 0.00 124.056-104.281 147.667 -43.727 123.900-103.102 130.670 -34.174 94.098 40.650 110.558 -80.651 93.476 50.065 131.320 -77.153 93.739 39.809 153.163-142.284 91.170 45.189 64.699 -85.542 90.085 44.870 116.794 -55.500 90.183 48.074 135.550 -97.622 90.228 40.958 111.667-102.533 89.650 49.338 102.929 -86.752 92.005 54.965 133.360-101.082 94.181 29.981 98.943-106.749 96.195 63.873 140.714 -49.548 96.472 -1.870 127.403 -99.522 123.421-157.992 150.104-151.006 116.251 19.710 146.154 154.925 96.686 44.245 136.691 -82.569 92.059 44.230 113.819 -36.611 91.386 63.121 120.705 -70.180 87.813 46.353 142.499-135.534 90.882 41.255 0.000 0.000 90.307 56.030 118.959 -79.012 88.113 47.207 134.731 -88.039 88.454 45.188 120.688-125.220 89.815 49.809 109.098 -78.613 90.029 49.350 142.946-101.118 92.437 46.519 132.300-139.533 95.453-102.041 142.527-126.729 106.948-164.969 109.816 -78.836 136.761 -63.087 109.377-100.751 105.318 -20.366 113.549 -78.652 93.699 -51.447 112.505 -57.650 95.896 -34.820 113.575 -69.919 95.174 -44.272 128.316 -76.748 94.394 -33.212 103.647 -86.265 91.001 -52.679 103.743 -59.434 88.308 -55.163 150.867 -31.149 88.996 -53.343 128.404 -76.491 90.255-131.188 125.348 -42.477 91.039 53.686 132.464 -76.791 90.335 49.100 143.509-119.701 91.622 62.589 129.005 -34.715 91.465 -98.778 145.635 -41.943 101.602 -28.788 134.960-120.661 112.146 93.012 103.845 -76.174 92.532 0.000 129.491 -76.478 # 371 total E -1.48315E+02 rmsd from N 0.000 %NC 0.00 92.718 143.234 133.267 -71.781 93.568 57.644 131.225 61.086 91.965 44.931 107.052 -78.909 92.173 45.517 131.198 -77.428 93.046 47.452 160.871 168.730 93.791 35.113 57.227 -69.908 95.817 42.406 157.545 85.078 95.502 37.153 138.747-104.980 92.769 51.806 131.041 134.359 90.333 80.062 79.471-111.394 87.527 -81.807 136.266-103.036 96.107 -44.655 93.402 -93.902 89.044 -52.423 107.982 -75.899 94.216 -33.801 142.595 -94.786 96.176 -53.148 130.250-177.743 97.963 -34.583 137.135-144.695 96.239 110.161 131.795 -86.109 92.819 38.952 112.084 -59.366 96.189 112.693 139.176 140.628 90.016 50.945 149.972-171.108 88.030 52.480 0.000 0.000 89.127 51.994 132.755 -26.309 88.976 48.165 147.473 -83.723 89.238 46.198 120.238-135.187 87.212 67.609 109.158 -74.154 88.464 58.991 142.239 -48.571 88.776 36.987 137.166-155.191 97.451 -92.668 150.149 -26.248 120.063-175.812 153.033 -13.425 101.485 -59.482 98.032 -91.770 95.015 -43.697 112.250 -76.601 92.402 -42.277 115.993 -28.063 91.751 -49.226 108.456 -73.346 90.105 -44.631 127.669 -76.509 88.623 -44.151 102.885 -79.953 90.098 -49.190 139.550 -27.296 89.781 -44.156 143.184 -57.458 90.443 -45.734 128.291 -76.262 87.644 -51.901 124.135 -34.641 89.700 -50.537 129.261 -76.339 89.621 -42.403 139.782-137.885 89.471 -49.701 127.827 -21.027 90.804 -51.046 151.378 -22.854 90.988 -46.965 111.898 -84.352 94.869 96.570 105.811 -79.196 92.494 0.000 128.908 -76.447 # 372 total E -1.50305E+02 rmsd from N 0.000 %NC 0.00 93.257 158.490 142.970-106.758 94.261 48.031 156.129 116.525 91.063 49.218 106.427 -79.496 90.710 50.386 128.666 -75.938 90.800 45.048 151.824-146.820 95.464 41.302 130.273-170.970 91.461 42.073 111.365 -73.520 94.091 75.394 126.976 -97.385 86.842 75.506 154.245-173.784 85.460 120.459 95.690-142.208 94.184-123.766 133.836-129.424 94.760 53.776 95.472-120.113 96.061 40.533 107.359 -89.325 92.393 51.127 154.388-151.370 91.306 56.611 125.625-155.397 90.933 59.269 121.988-127.005 95.577 -75.433 137.004 -96.020 124.985-125.175 144.402 -67.804 105.461 29.545 140.986 7.916 94.240 48.123 146.528-168.391 89.714 46.383 0.000 0.000 91.085 50.360 102.039 -85.413 89.111 44.758 145.504 -70.294 90.575 41.889 119.332-126.317 89.788 50.608 109.229 -76.463 90.236 48.086 137.597 -91.164 91.093 46.730 136.636-145.307 90.463 48.772 141.921-127.686 96.146 179.271 105.149 -81.930 91.995 63.065 131.763-158.225 89.953 51.314 113.772 -76.317 90.117 49.109 146.462 -15.933 89.656 46.592 111.745 -73.720 89.829 45.798 128.294 -75.935 88.648 48.649 135.229-132.808 90.252 44.980 126.414 -75.313 90.035 43.682 137.417 -90.621 91.514 49.635 128.379 -76.983 93.053 83.272 99.664 -62.531 87.454 -80.766 129.740 -77.432 92.204 -46.794 142.439-119.977 87.772 -50.482 111.784 24.774 91.406 -49.898 150.086 -31.070 91.244 -47.292 110.138 -83.388 95.264 96.094 105.887 -78.861 92.585 0.000 128.935 -76.411 # 373 total E -1.50345E+02 rmsd from N 0.000 %NC 0.00 93.098 -64.126 127.005 -76.767 94.283 -48.333 115.617 -78.051 91.218 -45.922 103.262 -77.486 90.628 -46.632 129.083 -76.229 91.586 -40.993 141.162-121.037 93.786 -41.276 62.945 -67.411 92.558 -40.477 131.025 33.220 101.954 -37.530 168.083 162.007 93.329 -53.965 127.400-113.758 95.578-109.986 81.987 -83.657 116.796 74.156 155.984 178.287 92.404 49.095 96.775-126.579 95.206 39.668 100.039 -77.133 96.247 38.099 145.106 -28.142 98.352 40.833 113.388 -92.001 96.322 20.730 128.125-110.117 114.951 9.560 156.217 -82.002 135.561 6.167 137.793 -84.378 118.973 166.139 134.525-132.832 93.539 59.913 137.510 171.221 89.137 53.452 0.000 0.000 90.773 44.718 133.799 -28.013 90.104 49.945 144.374 -80.009 88.083 52.439 121.816-132.664 88.521 49.660 108.191 -74.300 90.384 49.853 146.617 -86.076 91.806 37.183 130.710-148.656 100.433-119.062 145.726-128.268 114.983 174.269 152.568 -17.285 97.599 -49.893 94.483 -98.731 88.353 -53.245 111.386 -75.518 88.811 -55.783 128.118 -21.059 89.530 -47.511 116.989 -74.854 90.674 -41.656 127.092 -75.463 90.235 -47.634 101.207 -79.210 92.323 -38.965 149.047 -20.071 95.546 -42.554 131.921 -75.810 93.949 -36.129 129.283 -76.578 96.053 -72.447 124.860 -40.048 94.811 136.206 129.991 -76.487 95.621 29.987 140.443-110.848 93.657 57.051 142.032 -76.556 92.797 72.684 149.547 -29.081 88.028 57.263 145.942-178.123 91.969 97.696 99.241 -79.948 92.465 0.000 128.987 -76.181 # 374 total E -1.46456E+02 rmsd from N 0.000 %NC 0.00 93.241 -65.296 127.261 -77.421 94.358 -49.097 117.364 -79.299 90.999 -46.427 103.598 -77.806 90.569 -47.410 128.132 -75.498 91.135 -40.689 139.833-125.566 94.708 -40.567 64.646 -64.863 92.764 -38.480 128.933 -16.936 100.247 -35.866 171.731 157.672 100.614 -55.067 124.314-116.385 94.626-153.709 79.461 -85.081 109.097 66.773 161.346 176.757 97.488 34.237 90.825-118.402 95.203 45.333 106.718 -79.587 92.031 60.532 147.761 -30.813 90.863 41.769 102.901 -88.491 93.973 40.652 139.285 -97.998 102.618 -12.141 126.885 -76.416 131.982 163.673 137.520 -73.542 96.412 51.324 147.616 159.122 97.246 43.305 109.292 -81.657 109.671 16.789 0.000 0.000 97.477 45.654 159.153-152.600 95.209 42.502 154.512-175.283 90.585 48.532 108.355-143.684 90.788 43.639 112.451 -77.422 91.934 49.646 151.280-116.258 91.537 50.841 128.498-167.012 93.200-108.218 104.417 -83.658 105.596-173.440 153.369-134.609 130.974-162.852 113.205-111.443 95.711 45.752 115.031 -77.152 92.853 45.216 104.498 -22.410 91.053 48.708 128.379 -19.557 90.277 45.451 129.138 -77.439 90.060 49.210 101.800 -83.701 89.921 48.628 129.051 -46.627 89.070 53.545 130.877 -80.852 89.620 46.774 128.535 -77.127 92.913-154.177 111.366-106.595 93.807 98.258 131.366 -76.538 93.207 40.818 139.193 -99.958 90.916 51.809 120.054 13.996 91.064 58.201 146.821 -33.293 88.833 37.688 138.397-139.702 95.961 92.912 108.867 -82.543 92.457 0.000 129.009 -76.111 # 375 total E -1.49628E+02 rmsd from N 0.000 %NC 0.00 93.199 -67.987 129.595 -84.790 93.824 -50.506 120.174 -77.011 91.217 -45.487 102.738 -78.296 90.240 -46.808 128.035 -75.373 90.660 -44.388 142.353-146.889 91.293 -42.700 60.119 -75.890 90.625 -81.084 119.096 -33.690 88.298 69.065 144.333-106.034 107.405 58.162 151.399-168.455 96.586 16.232 145.766 -13.299 104.069 56.816 149.463-108.836 99.392 29.140 95.344-104.549 96.414 101.524 145.166-150.843 108.013 -19.782 123.656-154.211 118.968-114.305 155.546 -23.980 91.802 56.519 143.004 -98.884 90.655 51.624 137.903 -71.068 89.896 48.255 126.508 -62.180 91.646 46.019 152.889 -18.197 91.672 44.379 141.567-169.033 91.206 44.839 0.000 0.000 90.669 49.511 109.202 -82.890 90.437 46.750 146.237 -79.431 91.839 40.164 118.926-127.357 90.762 50.433 112.348 -77.712 90.754 67.283 137.856-100.605 89.576 46.875 142.894-146.300 91.370 36.604 142.535-128.398 106.686 -3.469 114.813 -89.011 138.805-159.127 102.500 -85.600 95.351 57.111 115.343 -76.485 93.130 45.477 105.631 -32.653 90.169 48.811 141.708 -37.852 91.978 47.586 128.123 -75.402 91.055 42.377 102.250 -84.853 92.986 42.381 126.217 -68.731 93.189 50.584 127.604 -80.310 92.795 77.719 130.471 -78.708 94.254-168.344 106.824-120.220 93.088 52.926 130.256 -76.648 91.415 45.671 140.458-102.697 89.593 54.380 128.313 -11.898 90.471 58.930 141.620-110.489 88.082 39.158 132.083-165.891 95.711 87.168 103.525 -79.926 92.504 0.000 128.901 -76.489 # 376 total E -1.46656E+02 rmsd from N 0.000 %NC 0.00 93.179 -70.062 127.737 -78.548 93.988 -50.256 121.835 -81.661 91.274 -45.948 103.355 -78.308 90.442 -47.717 127.514 -75.150 90.604 -41.133 143.971-137.295 93.343 -43.520 61.791 -55.650 90.565 -40.573 132.954 36.668 97.185 -47.872 167.469 160.598 92.021 -44.532 146.395-132.300 102.524-126.136 69.431 -83.829 118.004 58.692 158.997-141.552 95.718 39.731 91.782-113.530 91.823 53.125 117.200 -90.118 90.771 51.880 140.694 -38.070 89.727 42.731 134.729-125.161 93.603 51.349 130.402-110.938 96.718 -86.366 125.841 -79.132 116.687-148.497 141.122 -80.848 95.669 48.719 141.709 -32.271 95.384 41.348 110.018 -82.562 97.562 36.723 0.000 0.000 94.388 44.383 146.715 -8.881 92.241 48.701 167.812-145.979 90.301 46.894 109.653-141.349 91.005 44.792 107.840 -70.856 94.733 38.216 140.960 -44.139 97.540 35.113 137.299-124.321 111.275 1.596 153.749 -21.912 116.161 59.278 152.557 -17.544 102.473 -85.692 98.738-111.447 138.183-156.855 121.103 -82.427 93.198 55.436 139.106 103.558 97.910 83.880 112.081 -75.322 90.512 -77.434 127.066 -75.073 90.576 -41.562 104.325 -83.368 88.016 -58.683 111.858 -66.743 86.672 -52.036 140.479 -55.554 89.695 -46.252 127.565 -75.396 88.728 -48.839 118.392 -46.190 90.088 -50.833 128.828 -76.315 89.262 -44.271 144.945-133.685 88.909 -50.675 128.147 -22.404 90.125 -53.020 150.014 -24.723 90.683 -44.626 144.473-140.941 96.373 93.998 104.779 -79.690 92.467 0.000 129.075 -76.221 # 377 total E -1.51106E+02 rmsd from N 0.000 %NC 0.00 93.231 -66.066 129.533 -84.709 94.573 -46.240 116.956 -81.202 90.759 -47.801 103.021 -77.732 90.247 -46.852 130.104 -76.340 92.482 -40.329 142.369-130.990 93.634 -43.507 61.409 -66.175 90.640 -41.908 129.723 46.107 103.545 -59.611 166.356 155.847 93.536 -26.027 128.619-107.607 110.086-129.687 79.753 -80.137 116.597 74.769 154.282-165.026 95.979 39.482 92.420-119.941 92.054 49.930 113.364 -90.486 89.820 62.958 143.818-135.410 88.198 47.999 127.884-125.314 92.111 54.419 130.726-105.708 95.765 -64.443 134.868 -73.696 123.013-168.720 150.547 -83.838 97.170 48.525 150.053 110.492 93.473 43.856 108.775 -82.167 94.054 42.892 0.000 0.000 93.663 43.543 140.206-117.773 92.677 42.362 163.788-178.914 91.344 44.056 107.550-136.333 90.703 47.456 114.637 -80.046 90.789 50.089 149.796-130.297 91.761 50.156 139.966-145.065 93.083-114.277 105.495 -84.212 95.001-164.720 146.785-119.124 103.215 -46.363 93.930-108.677 107.873 -24.840 113.318 -79.088 95.181 -43.046 112.165 -52.669 94.614 -41.841 109.262 -72.775 91.442 -47.429 127.362 -76.496 90.044 -40.440 101.520 -80.650 89.471 -46.884 121.368 -17.802 91.662 -48.300 151.546 -20.226 89.882 -54.198 129.066 -76.688 91.025-131.255 114.369 -46.730 89.998 55.429 132.010 -77.485 91.202 45.417 143.908-129.546 92.737 79.983 127.996 -28.706 90.438 -71.909 140.066 -61.252 99.707 -56.895 107.689 -83.406 95.457 88.510 104.600 -77.999 92.451 0.000 129.017 -76.259 # 378 total E -1.51134E+02 rmsd from N 0.000 %NC 0.00 93.265 -78.453 127.563 -77.386 93.277 -50.611 117.652 -75.537 91.892 -42.472 102.776 -76.571 92.457 -47.719 126.933 -74.524 100.403 -10.076 152.357-137.463 106.455 -41.718 64.649 -76.272 96.385 -16.268 137.965 -42.899 107.723 -38.357 134.817 -91.400 104.650 -56.834 145.492-147.833 86.296 74.520 90.889-105.964 123.273-127.554 124.667 -89.410 98.150 42.018 125.664-147.188 126.943 155.008 104.877 -82.411 124.213 -92.094 157.638 -14.942 93.796-126.591 145.925-137.279 92.987 50.635 132.892 152.252 92.233 47.356 135.086 -85.978 90.694 48.402 143.775 -53.153 90.358 49.078 119.162 -39.694 89.634 48.794 148.310-147.052 90.776 44.157 0.000 0.000 90.835 47.620 137.308-108.513 89.876 45.341 136.755-104.680 90.483 45.280 118.323-129.028 89.062 49.855 114.697 -77.873 90.370 47.590 134.228-105.180 92.335 50.058 129.440-148.479 93.701 -92.750 141.478-121.367 118.465 166.451 151.369 -16.795 131.447-170.095 111.578-107.776 96.376 47.038 115.284 -77.278 93.307 44.352 108.852 -30.506 91.775 47.221 130.033 -31.108 90.969 46.241 129.270 -77.654 89.701 50.054 101.594 -83.503 89.491 50.466 125.281 -61.573 90.278 58.493 128.981 -66.073 91.032 58.709 128.655 -76.613 94.330-171.721 87.021 -80.803 92.773 58.282 131.764 -77.422 91.416 44.640 141.398-111.618 88.574 64.521 137.470 -21.225 89.784 68.040 142.259 -50.591 86.923 39.224 145.666-164.803 95.442 87.744 103.275 -79.416 92.479 0.000 128.902 -76.512 # 379 total E -1.52498E+02 rmsd from N 0.000 %NC 0.00 93.188 -84.501 124.968 -67.489 115.593-103.121 134.591 -26.998 92.630 46.440 107.462 -79.693 93.625 46.906 129.864 -76.873 93.968 42.049 139.699-125.007 92.386 43.386 56.024 -73.791 91.787 43.894 125.432 -30.479 89.854 45.774 138.647-104.851 89.474 49.830 128.026-124.699 88.729 51.026 82.431 -98.915 90.119 146.548 136.410 -83.888 95.115 90.192 125.382-148.875 91.821 102.768 100.402 -86.868 94.020 -69.870 129.868 -98.743 99.039-120.448 136.915-144.971 91.382 51.206 137.861 117.207 91.696 46.872 134.891 -85.736 90.784 47.373 131.249 -46.466 90.028 48.810 134.874 -19.106 89.852 47.120 151.592 -27.914 90.483 45.297 0.000 0.000 88.863 54.018 113.498 -77.167 88.782 47.576 137.829 -81.598 89.691 43.139 122.166-124.546 89.123 51.014 108.205 -75.424 90.317 52.897 142.107 -90.669 90.868 42.327 133.782-101.611 93.124 39.802 152.294 -21.871 100.254 138.652 109.274 -82.846 93.992 73.275 139.682-168.327 111.281 63.384 117.598 -79.892 92.577 -64.285 110.816 -53.907 89.423 -45.474 110.108 -72.034 90.313 -54.560 127.577 -75.185 87.268 -44.176 104.387 -89.483 88.270 -57.201 99.462 -62.772 86.085 -57.432 145.032 -26.777 89.297 -49.373 129.712 -76.246 93.818-140.830 116.688-126.388 91.634 50.956 131.395 -76.589 90.825 51.025 140.473-108.147 91.288 61.392 117.662 -14.545 91.875-110.125 140.840 -89.169 101.494 -14.350 101.353 -86.902 118.161 119.242 101.200 -75.568 92.722 0.000 129.437 -76.832 # 380 total E -1.51920E+02 rmsd from N 0.000 %NC 0.00 93.430 170.821 142.271-107.830 93.352 51.747 140.383 30.587 92.428 44.488 106.331 -81.936 91.885 44.989 130.094 -76.949 95.142 45.259 137.972-112.217 93.963 40.130 55.214 -72.430 91.310 44.300 127.125 -29.294 89.866 50.248 128.579-106.606 88.257 50.925 119.977-111.782 87.649 42.459 91.130 -99.766 93.448 58.705 131.586 -91.286 98.958 -60.952 100.882 -98.048 117.155 177.882 106.698 -84.772 145.075 171.413 167.107-173.647 106.930-109.441 143.923-161.488 93.802 46.837 139.670 141.029 91.250 47.631 135.747 -85.678 90.073 51.190 121.148 -67.945 90.773 48.290 127.176 -31.311 91.068 42.803 147.017-163.036 90.809 45.063 0.000 0.000 90.850 50.698 107.768 -85.021 88.712 47.330 147.208 -75.720 90.595 41.074 120.004-130.459 90.115 50.135 112.869 -77.222 90.129 48.015 138.746-103.224 92.717 63.661 138.469-150.900 91.185 -80.665 140.268-125.462 121.987 167.908 111.389 -77.728 97.279 -53.688 97.099 -95.962 94.952 -40.253 112.017 -76.883 91.974 -44.406 111.629 -47.327 89.910 -52.315 111.659 -76.102 89.379 -47.077 128.367 -76.328 88.874 -44.100 100.764 -80.384 90.911 -46.950 142.793 -33.938 91.946 -40.607 162.615 159.404 94.376 -50.560 129.153 -77.143 102.214-115.020 135.367 25.333 90.764 56.940 129.869 -75.534 91.644 42.895 141.095-105.789 90.748 44.568 128.584 -30.013 91.183 56.267 141.905 -51.687 88.890 44.483 137.558-136.810 94.042 87.377 103.274 -80.297 92.567 0.000 128.779 -76.708 # 381 total E -1.51105E+02 rmsd from N 0.000 %NC 0.00 93.169 -71.074 129.573 -84.375 94.173 -47.287 120.535 -82.422 90.403 -48.582 103.384 -77.228 89.686 -52.359 127.716 -75.453 90.516 -37.017 137.638-132.157 91.662 -49.209 64.420 -61.784 90.735 -30.204 127.125 -15.479 104.512 -46.769 171.997 163.196 92.264 -37.544 136.503-120.207 96.165 120.828 72.721 -79.071 93.499-168.242 146.584 -45.248 101.737 53.846 127.133-148.154 122.550 147.157 106.554 -85.807 133.817 -99.579 169.501 0.072 103.853-120.244 143.757-146.371 95.152 44.670 147.641 145.709 91.923 46.836 135.388 -86.032 90.669 51.882 143.379 -76.566 89.620 49.303 136.438 -42.136 89.691 43.695 143.240-141.372 91.022 46.433 0.000 0.000 89.420 52.316 141.103-117.787 89.515 43.268 129.893-102.223 90.442 43.165 119.283-123.417 90.565 48.457 111.374 -80.734 90.449 51.108 134.763-101.255 91.986 50.561 130.429-139.106 93.809-115.400 147.764 -37.735 94.868 174.367 115.393 -80.725 103.463 -19.412 95.182-123.107 98.095 -72.705 111.998 -77.547 93.576 -87.570 118.577 -53.368 89.706 87.620 112.853 -73.690 92.991 48.868 129.102 -76.228 89.646 44.329 149.762 -22.689 89.889 51.673 128.912-123.338 88.041 55.526 136.523 178.990 88.414 44.589 127.591 -76.305 89.790 46.559 100.584 -68.369 89.942 52.150 129.756 -75.833 89.058 45.189 135.837-136.589 89.336 46.989 130.641 -43.254 89.811 54.982 136.285 -51.601 89.466 43.973 135.613-127.931 94.674 81.008 103.845 -80.488 92.512 0.000 128.761 -76.833 # 382 total E -1.48335E+02 rmsd from N 0.000 %NC 0.00 93.290 171.870 138.474 -93.787 92.959 57.225 143.918 39.711 92.559 43.920 106.345 -83.194 92.132 49.398 130.679 -76.576 93.037 43.535 149.384-131.863 91.811 41.185 62.383 -76.806 92.889 42.898 121.624 -42.000 92.688 41.222 135.148 -95.924 92.813 46.380 146.156-141.855 94.491 100.007 85.640-105.379 95.231-136.905 143.798-114.758 92.516 57.038 96.358-120.545 93.582 42.321 100.838 -79.219 91.647 52.479 150.851 -27.929 91.360 40.003 131.902-135.103 94.177 43.350 125.692-117.500 98.418 -20.407 125.811 -74.739 133.192 150.162 130.728 -73.342 97.255 40.363 124.448 -12.453 91.904 49.182 142.879-125.160 94.235 45.036 0.000 0.000 94.589 37.231 140.474 -15.108 92.952 45.063 150.730 -92.425 90.541 48.977 116.050-129.472 89.211 44.503 105.784 -73.429 93.873 42.385 134.263 -53.170 96.965 22.409 136.623-125.612 107.303 40.898 110.675 -85.644 95.925 15.090 155.464 -21.694 124.232-132.497 114.424-115.601 95.495 -20.381 113.632 -77.411 107.030-153.116 143.201 51.210 144.805 176.603 124.562 -79.284 92.692 54.712 129.464 -75.947 92.566 40.084 99.528 -79.628 90.894 50.921 154.433 -32.608 87.723 53.361 157.088-165.676 88.497 46.267 128.153 -76.589 88.638 48.014 112.555 -32.949 89.517 49.611 128.988 -75.286 89.299 44.548 135.620-152.084 89.519 47.155 131.262 -45.481 88.838 56.642 137.111 -52.473 89.322 43.650 129.016-124.393 94.524 83.366 103.792 -80.578 92.589 0.000 128.818 -76.754 # 383 total E -1.49046E+02 rmsd from N 0.000 %NC 0.00 92.564 124.244 124.140 -50.347 94.980 46.328 148.315 4.884 92.334 47.158 108.638 -80.564 91.359 48.249 127.997 -75.385 90.983 43.256 123.097 -30.741 94.414 40.746 102.319 -74.256 93.243 38.875 108.635 -78.209 107.348 15.811 104.815 -75.087 95.760 44.603 145.396 -36.881 98.563 28.755 74.829 -99.728 95.472 45.424 154.197-141.840 101.520 19.837 85.047-104.162 95.533 55.792 144.773-100.773 91.051 42.816 117.120-108.309 91.603 49.971 138.354-129.139 91.628 35.524 120.887-124.854 97.069-121.601 129.988 -91.094 114.028 161.118 119.430 56.770 107.937-174.677 133.091-147.334 95.460 51.745 148.119-157.235 91.775 45.874 0.000 0.000 91.088 47.822 145.413-125.587 90.627 45.232 134.841-112.353 90.900 41.366 116.957-128.347 90.385 48.337 115.074 -79.034 90.693 49.410 141.388-114.654 91.823 55.281 129.894-147.408 92.238 -90.675 150.812 -34.076 112.486 125.263 114.604 -75.854 134.824 149.534 108.220-100.849 96.917 43.845 143.587 133.687 92.967 47.094 148.003-168.856 93.744 74.592 115.568 -74.244 87.147 -89.351 129.374 -76.777 90.800 -47.036 102.672 -85.026 87.064 -52.805 122.454 3.575 89.617 -48.527 145.565 -33.264 89.296 -52.037 128.498 -75.634 90.803-131.307 122.201 -30.313 90.059 49.478 132.770 -78.029 90.898 49.455 142.984-115.780 89.883 47.202 128.865 -32.566 90.063 59.208 144.448 -32.912 88.508 44.474 134.191-125.040 94.337 88.905 103.460 -79.925 92.570 0.000 128.792 -76.687 # 384 total E -1.55471E+02 rmsd from N 0.000 %NC 0.00 93.073 157.194 139.659 -94.187 94.237 53.034 129.613 54.633 91.036 47.421 106.245 -76.233 92.300 43.752 129.545 -77.316 93.496 48.620 153.875-158.204 95.177 36.721 53.025 -67.397 93.081 46.452 133.914 -14.272 91.697 44.499 132.810-118.442 90.146 53.745 142.067 174.079 86.647 57.351 79.846-107.132 90.928 122.108 131.341 -88.377 92.395 70.498 98.657-116.597 91.676 103.343 99.487 -83.782 93.278 -71.566 107.693 -77.443 97.037-111.553 139.308-138.140 90.136 59.838 145.106 125.600 92.811 46.260 134.022 -84.983 90.407 45.671 149.538 -1.974 90.590 51.730 132.264 -23.487 88.312 51.704 142.596-168.248 88.951 45.438 0.000 0.000 90.808 46.098 111.212 -85.735 89.029 51.712 149.447 -84.455 88.593 50.912 119.640-136.937 87.083 50.795 106.040 -72.051 90.374 49.699 135.992 -49.427 90.657 47.232 138.723-143.262 94.335 -97.889 104.902 -84.387 114.610-167.495 159.513-147.552 97.431 -53.155 96.428-109.278 91.796 -48.837 110.551 -74.422 91.959 -69.333 108.813 -58.271 89.279 108.086 117.535 -72.491 93.306 43.710 128.574 -76.394 88.515 50.385 103.255 -75.063 90.258 54.874 143.933 -31.825 87.326 46.697 162.955-154.813 90.010 42.256 128.094 -76.363 90.384 49.601 116.987 -32.133 89.594 45.890 130.407 -77.543 90.383 45.445 137.544-123.785 89.590 52.401 130.284 -43.580 88.700 56.000 136.663 -60.465 89.563 43.833 134.041-116.017 94.743 81.098 103.963 -80.277 92.539 0.000 128.869 -76.719 # 385 total E -1.46438E+02 rmsd from N 0.000 %NC 0.00 93.106 169.580 133.742 -78.255 93.598 62.602 136.071 62.725 94.670 38.772 103.826 -78.415 92.538 47.312 131.890 -77.580 93.159 44.360 151.560-163.627 93.504 41.865 56.516 -69.528 90.388 46.052 125.738 -32.352 88.472 55.462 137.212-110.783 87.118 49.647 120.696-113.308 88.798 42.983 85.977 -95.803 92.737 165.354 136.342 -82.292 113.206 82.166 134.215-153.348 90.128 131.148 103.164 -85.291 119.231 -14.609 129.985-112.302 93.609 -62.177 130.763-132.222 94.220 7.629 135.010 -98.910 116.597-137.471 145.011 -3.947 92.335 58.386 110.417 -38.853 93.119 43.180 150.982-169.743 98.467 31.798 143.308-161.587 100.170 36.408 0.000 0.000 91.448 51.467 144.232-153.429 88.823 52.111 111.534-117.981 88.624 48.256 122.501-125.683 88.888 45.765 111.697 -73.622 91.425 49.885 139.392 -96.578 91.664 46.944 132.206-146.877 92.773-103.376 151.886 -31.307 109.491-152.717 114.457 -76.968 93.948 -57.291 100.298-111.411 91.475 -48.859 110.703 -74.044 92.314 -64.174 106.750 -61.169 89.383 105.198 142.365 -69.093 93.314 46.525 128.647 -76.241 88.114 52.919 110.701 -74.655 88.960 49.798 142.327 -28.205 89.132 43.276 145.224-112.770 90.842 43.211 128.093 -76.631 89.241 53.555 117.974 -41.589 89.586 48.401 128.949 -76.726 90.734 39.779 136.901-128.205 91.510 54.780 129.262 -39.780 90.450 99.281 136.272 -57.789 88.986 54.577 136.554-158.026 94.367 113.972 99.812 -79.396 92.537 0.000 128.998 -76.161 # 386 total E -1.52816E+02 rmsd from N 0.000 %NC 0.00 93.318 177.087 137.631 -91.943 93.029 58.583 146.320 20.685 93.559 42.121 105.838 -82.663 92.283 49.729 131.747 -77.123 92.697 43.558 140.109-117.497 89.683 44.300 63.065 -77.023 90.751 45.913 121.412 -46.050 91.364 42.123 129.283 -96.764 89.665 46.321 136.214-125.862 91.740 80.668 85.629-100.972 86.573 -85.344 140.372-103.920 102.982 -79.578 94.738 -96.875 92.134-135.361 134.921 169.315 109.370 -43.180 141.506-112.238 94.693-116.505 108.333 -88.575 91.625 51.655 139.326 121.117 92.612 45.785 137.838 -85.226 91.002 45.755 141.408 -44.649 90.935 49.703 145.567 -26.251 89.247 46.355 144.512-151.475 90.854 42.948 0.000 0.000 90.588 49.569 117.712 -81.523 89.483 44.469 138.861 -88.149 90.458 45.398 119.556-125.593 88.988 52.470 110.902 -77.854 90.036 45.741 133.346 -94.512 92.358 50.754 130.398-129.718 96.771 6.607 108.516 -87.177 131.999-160.018 153.706 -6.875 95.686 61.598 131.495-156.364 91.066 45.668 113.483 -77.047 89.736 77.204 136.826 -79.453 89.649 54.251 108.613 -73.273 90.759 40.820 128.804 -76.019 89.535 47.509 111.888 -88.361 89.449 52.510 131.136-105.495 87.496 50.871 145.244-158.941 88.052 46.062 127.882 -76.256 89.251 49.724 103.446 -56.878 90.096 44.045 128.782 -75.803 91.056 46.145 136.303-142.841 90.316 50.895 128.132 -44.237 89.612 52.094 136.875 -99.368 90.742 43.917 136.406-138.535 95.348 72.811 104.169 -80.612 92.506 0.000 129.080 -76.705 # 387 total E -1.53045E+02 rmsd from N 0.000 %NC 0.00 93.322 179.493 137.222 -91.295 93.569 58.616 145.017 22.874 94.357 41.737 106.124 -82.224 92.458 46.878 131.428 -77.063 93.612 44.412 137.772-112.410 92.354 41.642 58.336 -73.848 92.252 43.389 125.911 -34.535 91.020 43.306 133.418-105.483 90.938 52.836 127.169-117.132 88.603 72.745 92.081-101.998 89.814 -17.523 139.253-112.440 127.063 -94.954 110.049-105.535 105.384-144.278 103.199 -82.276 139.944-128.108 172.366-170.036 114.131-105.525 138.762-148.924 91.955 55.649 142.258 124.748 91.809 45.491 134.572 -85.548 90.356 48.443 159.727 -5.282 89.808 48.008 140.906 -20.797 90.363 47.333 143.746-143.883 89.877 45.717 0.000 0.000 89.283 51.436 109.127 -81.199 89.734 48.042 135.223 -77.366 90.652 41.295 123.967-123.781 89.490 51.804 115.849 -77.637 90.652 50.088 146.042-122.172 91.773 58.517 134.488-144.177 93.572 -19.916 142.117-129.498 121.538-155.393 114.351 -81.781 121.667 33.942 128.682-138.942 96.059 40.347 115.144 -78.272 92.450 47.026 130.470 -44.028 92.045 49.368 111.710 -69.245 91.452 41.130 130.215 -76.124 92.179 38.723 103.202 -85.294 92.455 45.945 113.746 -65.139 90.386 51.883 132.289 -58.221 90.384 35.599 130.602 -78.257 93.768 112.158 95.770 -97.069 93.423 -41.089 129.783 -78.183 95.303 -49.201 141.737-115.747 95.692 -19.574 125.050 0.686 104.392 -55.301 157.101 -18.036 91.208 -40.934 144.463-147.087 96.568 95.370 104.881 -79.221 92.480 0.000 129.036 -76.287 # 388 total E -1.48461E+02 rmsd from N 0.000 %NC 0.00 93.285 171.398 140.453-100.579 93.534 53.421 137.457 29.945 92.111 45.334 105.951 -81.553 91.802 46.936 130.874 -77.687 93.453 46.054 142.268-121.926 91.077 44.100 57.346 -71.066 90.395 45.765 127.410 -30.972 91.266 47.545 120.728-107.652 87.235 46.564 132.639-123.780 92.193 103.201 81.014 -97.974 85.501 -84.761 150.342-104.833 104.582 -74.403 93.820 -95.564 92.457-157.269 138.464-147.647 109.204 -57.444 130.197 -93.086 92.660-113.928 108.674 -86.349 90.046 58.835 132.484 110.391 92.303 46.471 139.742 -84.516 91.058 44.405 152.230 0.310 90.269 50.433 152.653 -6.484 88.642 51.893 144.451-146.628 90.115 43.868 0.000 0.000 89.899 46.027 126.533 -88.814 91.090 46.935 135.486 -98.357 90.764 45.965 120.232-127.773 88.600 49.880 113.975 -77.493 91.211 49.232 132.774-101.445 92.348 56.505 131.051-135.368 95.932 8.822 152.062 -24.825 131.377-156.379 153.952 -7.904 94.849 53.549 129.994-154.496 88.867 53.272 113.431 -76.859 89.139 69.753 99.561 -43.474 90.318 46.941 108.597 -71.961 91.603 40.569 129.141 -76.262 92.029 42.987 102.470 -81.404 90.981 49.980 146.103 -39.983 89.350 46.789 154.996-135.077 90.176 39.549 128.126 -76.686 90.729 50.887 118.948 -51.971 90.829 42.858 128.311 -76.339 92.199 47.645 136.980-161.619 93.569 75.491 128.149 -46.432 89.165 -90.196 142.066-112.334 94.514 -35.843 136.617-138.133 103.765-121.900 104.258 -67.896 93.134 0.000 129.257 -76.772 # 389 total E -1.47656E+02 rmsd from N 0.000 %NC 0.00 93.249 169.835 140.718-102.153 93.853 52.668 133.555 37.890 91.609 45.469 106.113 -80.546 91.526 47.711 131.159 -77.798 93.072 44.594 148.156-131.484 92.307 42.990 55.153 -67.645 90.052 47.285 127.450 -26.190 88.998 54.481 124.046-102.688 87.242 42.723 127.591-115.789 94.749 103.817 82.237 -96.201 91.877-133.131 157.786-104.478 92.962 56.509 96.130-113.561 91.182 50.677 100.302 -77.179 92.068 47.552 145.131 -34.894 89.780 48.722 139.630-137.475 91.759 43.064 124.804-118.872 95.526-117.139 122.195 -74.925 97.880 -51.758 139.266 -98.823 116.809 111.511 153.268-119.112 133.339 41.951 151.475 178.380 99.668 34.502 0.000 0.000 91.557 52.707 135.588-111.021 91.197 48.580 127.513-108.120 90.448 41.935 117.374-121.749 90.127 47.765 113.841 -77.271 90.884 48.005 134.610-101.114 92.340 52.168 130.937-142.214 93.214 -94.816 152.773 -30.544 118.394-172.999 114.890 -75.810 96.390 -60.229 95.435-103.922 91.940 -42.901 112.685 -72.761 93.683 -77.916 113.688 -60.516 90.231 99.785 112.736 -73.503 94.576 46.700 128.824 -76.190 93.370 40.526 100.187 -69.645 92.695 48.028 153.424 -24.927 89.712 47.175 159.122-172.206 90.359 41.039 128.274 -76.587 90.637 49.679 120.411 -42.684 90.719 44.418 128.562 -76.112 91.770 47.602 139.084-165.367 93.400 75.910 128.580 -46.736 89.197 -85.984 141.584 -98.807 94.992 -40.268 135.622-138.147 102.536-111.214 107.996 -72.460 93.114 0.000 129.181 -76.843 # 390 total E -1.53279E+02 rmsd from N 0.000 %NC 0.00 92.530 128.562 126.095 -53.952 94.155 48.172 154.208 -0.618 93.714 43.909 107.885 -80.782 91.628 47.643 127.699 -74.816 90.431 45.832 122.338 -31.886 92.592 42.288 101.793 -78.222 92.408 39.559 111.432 -81.366 108.103 14.802 107.486 -80.112 94.795 44.858 146.893 -31.469 99.716 27.252 73.470 -99.259 95.604 43.027 153.708-138.207 100.849 23.435 84.576-102.531 95.373 52.574 145.248 -39.546 92.145 42.427 113.313-110.549 91.494 49.259 138.792-137.811 91.358 42.537 118.649-124.075 97.295-112.586 124.326 -84.119 118.016 141.999 151.240 -61.340 119.104 172.265 129.929-131.122 97.058 49.378 146.841-159.723 92.515 45.865 0.000 0.000 89.927 49.333 142.919 -21.945 89.641 55.121 137.819 -90.884 88.651 49.075 124.568-135.901 88.598 49.225 108.704 -72.019 90.894 46.625 138.053 -80.164 92.717 53.454 134.878-147.092 94.848 -73.431 142.472-125.245 120.205-147.334 155.670 -19.463 137.488 142.934 113.635-103.669 98.378 36.680 115.928 -78.364 92.742 47.730 109.447 -25.990 89.198 57.876 118.836 -74.370 90.325 42.547 128.252 -76.302 91.677 43.421 101.334 -83.015 91.762 46.188 130.120 -58.069 92.314 59.008 126.805 -85.509 90.548 62.318 129.397 -77.370 91.383-171.571 70.443 -93.297 91.595 56.983 132.348 -77.972 90.513 46.417 141.139-107.941 88.312 61.988 140.654 -45.327 88.901 67.439 141.554 -45.851 86.602 36.894 137.521-137.122 96.765 80.317 102.700 -78.925 92.476 0.000 129.089 -76.377 # 391 total E -1.47609E+02 rmsd from N 0.000 %NC 0.00 93.141 -64.324 126.529 -78.027 94.102 -49.252 117.100 -78.313 91.053 -46.280 103.552 -77.682 90.571 -47.519 127.991 -75.543 91.086 -40.865 139.664-125.232 93.868 -42.056 60.808 -66.389 92.456 -40.864 129.529 -20.279 101.834 -33.824 168.924 173.014 93.662 -66.868 135.613-119.710 95.739-129.374 144.731 -11.394 95.932 52.047 139.875 160.092 89.629 61.928 100.022-139.354 88.375 64.660 94.716 -80.259 92.768 132.542 145.606 -37.532 102.119-101.157 136.495-168.077 96.723 47.256 139.937 155.886 92.556 44.493 136.970 -88.547 90.113 73.510 128.941 -83.147 89.940 54.343 137.086 -41.399 90.277 39.307 142.637-159.554 92.203 46.007 0.000 0.000 90.297 52.548 109.943 -82.815 90.240 46.232 137.679 -78.690 91.760 39.512 121.286-122.987 91.526 48.860 111.456 -76.959 91.434 51.309 129.940 -90.405 91.317 49.191 139.258-144.052 92.919 22.797 112.781 -92.569 112.746 16.145 158.035-121.925 133.014-169.341 116.601-114.196 95.813 62.076 115.494 -76.642 91.830 49.534 107.240 -36.507 88.749 55.630 114.543 -73.370 90.141 49.339 129.076 -76.465 88.602 45.229 134.070-132.237 89.991 48.251 115.990 -82.634 89.458 61.857 133.485 -53.314 88.608 58.346 128.571 -76.792 89.728 172.812 99.816-108.040 91.890 61.573 132.114 -77.619 91.060 45.549 140.615-102.826 90.310 47.704 122.966 -17.002 91.403 53.241 136.947-106.625 90.069 46.079 133.535-168.679 94.287 93.805 146.575 -24.557 92.491 0.000 128.830 -76.510 # 392 total E -1.47211E+02 rmsd from N 0.000 %NC 0.00 93.099 -77.837 121.340 -60.917 93.515 -55.659 116.528 -73.014 92.936 -42.125 103.799 -77.873 91.684 -44.605 129.571 -76.141 92.453 -38.837 138.537-131.652 92.862 -46.944 65.891 -67.787 90.449 -32.874 121.697 -28.735 106.718 -34.581 169.228 145.813 94.769 -46.058 134.583-120.770 94.253 121.328 88.296 -89.523 107.866-159.257 137.240-100.454 95.658 15.424 99.400-125.205 116.459-104.600 148.575 -17.491 116.828-152.897 160.445-131.607 111.465-117.430 103.052 -93.773 95.520 39.513 142.985 138.570 91.408 47.967 134.709 -87.408 89.649 55.197 168.177 -42.480 90.358 47.465 122.504 -29.146 90.572 39.856 107.106 -82.354 89.711 51.980 0.000 0.000 90.208 51.397 101.988 -83.972 88.039 42.161 146.771 -75.848 91.364 43.242 117.972-126.737 90.586 49.802 111.223 -75.851 90.614 42.816 133.618 -95.970 95.088 42.504 132.586-123.504 98.945 24.424 108.724 -86.774 121.509 69.283 156.553 -14.943 127.532-116.258 121.957-124.965 129.611 39.346 120.256 -82.683 91.971 -59.946 107.723 -59.894 86.545 -54.318 110.028 -69.422 91.664 -53.610 123.649 -73.097 91.361 -28.757 102.357 -91.680 94.019 -49.603 96.863 -62.891 88.197 -57.790 150.121 -22.361 88.761 -52.035 132.349 -78.413 92.073-135.307 110.607-125.736 90.063 53.046 132.366 -77.381 90.051 53.156 140.534-105.973 90.121 56.678 114.373 -5.874 90.071-125.951 142.672 -83.537 99.038 9.270 109.419 -89.129 122.358 119.287 102.136 -72.687 92.613 0.000 129.416 -76.833 # 393 total E -1.49973E+02 rmsd from N 0.000 %NC 0.00 93.347 -80.862 130.451 -87.275 94.678 -47.022 129.861 -80.519 91.497 -50.585 101.060 -79.584 90.154 -45.255 127.807 -75.045 91.794 -44.440 147.687-178.817 91.763 -53.437 113.587-138.016 88.885 125.379 150.064-118.703 95.355 46.866 141.706 -90.147 90.101 47.581 152.528-155.960 89.216 49.563 74.004-109.789 92.629 144.243 137.354 -90.230 89.453 84.164 104.148-136.849 92.531 106.589 98.190 -85.619 92.354 -61.606 129.685 -88.845 97.417-124.703 137.332-146.070 91.223 50.204 138.736 127.335 91.710 47.115 133.718 -85.980 90.835 46.673 132.690 -54.547 90.529 48.334 131.395 -25.352 90.471 45.923 109.436 -82.956 90.160 44.569 0.000 0.000 89.401 51.905 106.811 -82.773 88.599 49.270 138.240 -76.503 89.418 42.897 123.319-127.200 89.236 49.399 115.016 -78.265 90.132 48.414 137.019-109.293 91.650 51.958 135.942-119.691 91.761-104.367 102.728 -82.792 106.510 170.621 150.336 -16.543 102.341-167.152 92.711 -95.279 92.917 49.873 115.063 -76.902 92.377 46.725 109.211 -24.508 92.143 42.847 129.586 -11.071 92.392 43.623 129.864 -76.047 91.715 40.528 102.533 -84.991 90.998 46.196 116.941 -34.726 90.565 51.074 135.670 -46.561 90.388 36.024 130.342 -77.861 93.468 112.891 103.300 -97.300 93.010 -39.479 130.223 -78.499 95.457 -49.794 141.293-116.813 95.567 -19.334 124.390 -15.995 104.016 -54.773 154.600 -18.631 91.799 -34.444 147.106-144.357 98.877 90.870 101.878 -80.901 92.513 0.000 128.973 -76.493 # 394 total E -1.51586E+02 rmsd from N 0.000 %NC 0.00 93.071 161.793 137.831 -88.543 92.985 56.813 119.457 -32.444 93.993 42.516 104.690 -82.376 92.885 47.178 128.619 -74.811 91.185 44.586 110.459 -83.706 91.805 41.700 69.217 -67.065 91.860 42.330 121.412 -43.018 91.534 47.127 138.952-101.899 88.074 44.286 138.647-144.810 90.445 49.647 78.533-103.465 90.006 38.526 143.663 -95.054 124.587-141.296 110.832-108.242 104.318-158.909 103.220 -83.237 143.025-142.864 174.169-173.266 110.809-101.162 139.512-148.530 93.697 48.307 146.328 139.553 92.104 44.515 132.794 -86.000 90.364 52.702 138.282 32.807 88.698 49.509 139.833 -33.564 90.495 42.901 109.218 -82.489 92.976 42.165 0.000 0.000 90.232 48.501 144.099 -27.037 89.687 56.628 163.302-127.438 89.117 51.379 114.749-147.583 88.767 44.102 111.773 -72.139 91.990 49.065 148.788-103.331 91.443 53.416 132.597-159.265 91.897-105.137 103.591 -83.609 109.790-171.694 155.830-138.460 93.556 -60.497 95.002-112.197 90.520 -52.736 110.540 -74.948 92.263 -63.221 107.491 -49.087 88.484 109.507 111.600 -72.692 92.401 51.686 128.696 -76.114 90.390 46.325 107.944 -81.049 92.044 39.429 132.498 -89.374 92.083 52.304 133.533 -88.401 90.604 59.052 128.390 -77.217 90.337 176.704 92.419 -91.943 90.765 67.338 131.466 -77.031 89.942 46.349 140.819-100.739 90.317 44.406 124.973 -24.285 91.488 54.627 151.195-107.781 89.207 42.339 130.442-157.852 94.010 98.503 102.399 -79.262 92.524 0.000 128.809 -76.478 # 395 total E -1.49791E+02 rmsd from N 0.000 %NC 0.00 92.960 -63.196 128.828 -82.616 94.809 -46.159 115.836 -79.988 90.772 -47.434 103.095 -77.159 90.396 -46.075 129.995 -76.414 92.636 -41.369 141.825-126.048 94.370 -40.656 61.341 -65.206 91.770 -43.333 130.390 22.782 101.304 -47.496 168.644 155.795 93.959 -56.828 114.766-108.983 93.839-118.487 84.877 -80.433 130.553 124.167 142.913-154.415 100.014 30.223 90.596-117.733 93.506 56.556 117.981 -88.670 90.164 56.709 144.275-146.790 89.503 46.781 133.406-111.622 92.498 50.192 130.344-104.034 97.629 -63.751 129.170 -64.022 130.321-157.648 132.834 -71.311 113.469 27.531 137.730 101.955 94.513 46.916 110.266 -82.378 92.993 44.984 0.000 0.000 91.553 47.202 140.176 -22.009 89.617 49.010 147.105 -83.760 89.163 47.472 120.337-131.739 89.262 49.163 108.353 -75.727 90.059 48.568 139.944 -52.215 92.302 50.758 133.859-131.258 95.179 -96.693 103.112 -82.848 107.706-169.338 151.547 -17.757 133.765-163.796 115.295-113.283 110.092 32.952 117.551 -79.243 92.901 47.462 106.707 -4.487 89.793 51.175 115.438 -72.873 89.153 50.142 130.268 -77.085 88.030 44.287 137.880-147.412 88.839 46.331 113.351 -40.356 89.711 52.899 139.937 -48.846 89.740 42.239 128.382 -77.084 88.112 51.079 106.824 -93.643 90.238 76.624 127.750 -76.596 89.494 51.644 141.333-106.948 91.229-167.699 133.140 -49.570 130.987 -98.049 171.000 -1.778 97.842 -43.331 140.235-132.385 99.370 61.623 104.556 -79.157 92.471 0.000 129.305 -76.310 # 396 total E -1.47138E+02 rmsd from N 0.000 %NC 0.00 123.337 -97.251 149.041 -58.773 94.470 -52.748 118.993 -76.537 91.901 -44.123 103.967 -78.084 90.711 -48.876 127.513 -75.392 90.506 -39.128 138.720-128.204 92.224 -46.919 61.887 -57.802 91.444 -34.345 135.704 29.302 99.716 -41.739 172.003 173.153 92.995 -45.297 137.045-117.534 92.700 120.629 89.923 -90.983 101.421 164.047 146.506-112.606 92.214 72.518 102.133-147.705 92.661-160.348 102.289 -88.373 145.066 22.083 160.777-178.999 102.046 34.322 143.653-172.500 95.006 41.673 134.682 -97.009 92.470 50.563 143.424 -1.591 92.096 45.660 117.763 -72.602 91.907 39.380 142.108 115.229 94.417 41.877 150.493 -29.440 92.291 47.135 0.000 0.000 88.958 49.431 140.414-131.860 91.377 40.766 112.505-115.081 90.959 44.152 120.085-116.417 89.113 51.258 115.807 -83.159 90.100 53.209 138.019-118.266 89.775 44.652 123.890-152.155 95.324-110.520 103.384 -81.927 102.643-172.060 151.574 -18.829 107.205 -52.301 94.830-101.923 114.514 -16.564 114.815 -79.439 94.186 -48.406 108.069 -63.652 94.539 -37.873 109.661 -72.383 92.634 -47.609 125.949 -74.784 93.160 -30.766 129.465-124.617 93.919 -48.168 83.883 -82.328 87.376 -52.587 146.959 -32.836 89.805 -49.235 131.789 -78.076 91.941-135.396 77.935 -83.582 91.305 47.411 131.218 -76.975 90.921 47.136 139.741-103.414 89.673 49.641 127.989 5.203 90.425 58.346 143.776 -33.782 88.203 35.458 138.563-136.826 96.726 81.449 106.060 -79.958 92.478 0.000 129.071 -76.386 # 397 total E -1.48519E+02 rmsd from N 0.000 %NC 0.00 118.093 148.724 153.246-100.598 93.497 55.861 143.641 26.975 93.208 44.257 106.034 -81.993 92.030 46.770 132.069 -77.900 94.662 45.275 144.413-110.833 90.596 42.825 58.476 -75.622 89.946 48.660 128.062 -41.672 90.634 46.405 123.362-105.173 87.467 46.834 141.851-150.788 89.037 55.211 79.067-104.660 89.713 137.620 135.417 -87.879 96.003 74.718 122.779-143.519 93.946 106.961 99.168 -84.366 93.281 -65.611 129.138 -80.494 96.176-119.312 134.741-141.065 89.965 53.363 135.372 110.087 91.637 46.989 134.135 -85.577 90.591 45.643 145.026 -11.029 90.635 48.896 135.145 -11.574 88.505 49.904 151.548 -29.673 89.164 48.909 0.000 0.000 88.753 49.808 125.332 -77.348 90.246 43.522 136.658 -84.825 89.989 46.773 122.963-124.129 88.193 55.559 110.136 -78.125 89.990 50.380 138.920 -98.506 92.508 34.677 131.203-137.759 98.970 27.494 153.880 -20.183 131.711 178.683 109.321 -78.632 99.065 87.018 134.537-159.215 125.630 58.139 120.492 -81.974 94.700 -51.017 111.355 -55.120 91.542 -40.616 110.388 -71.738 91.676 -50.362 131.070 -76.445 92.618 -38.151 96.860 -74.703 95.204 143.283 109.524 -37.935 88.172 60.683 143.571 -22.728 89.293 51.025 128.051 -76.456 87.825 55.013 156.361 2.073 89.664 46.128 128.237 -74.991 90.366 46.814 144.802-129.808 90.119 49.529 129.573 -33.039 89.813 51.642 135.587 -80.074 90.842 44.549 139.118-144.053 95.126 74.581 104.274 -80.748 92.548 0.000 128.998 -76.634 # 398 total E -1.55376E+02 rmsd from N 0.000 %NC 0.00 93.260 174.611 137.507 -90.919 93.138 58.594 150.005 53.323 93.528 42.722 106.306 -79.057 92.895 49.123 132.337 -77.796 94.138 41.222 148.385-135.465 91.840 41.856 62.423 -82.066 93.042 41.912 117.497 -52.703 95.900 37.826 135.436 -93.408 92.622 43.182 146.958-141.473 91.371 44.315 81.068-104.651 94.253 165.228 128.182 -82.720 91.439 90.777 130.934-158.064 95.249 109.437 103.520 -83.802 89.447 -65.540 148.850-106.571 99.150-124.349 137.562-164.723 92.978 43.909 142.070 137.109 91.206 48.462 135.377 -85.431 90.078 49.603 128.190 -65.378 91.128 48.588 128.751 -32.555 91.144 40.858 144.787-160.466 89.998 48.274 0.000 0.000 89.549 57.646 105.359 -83.443 87.554 44.080 142.670 -81.437 90.097 44.017 117.836-125.739 89.182 56.660 110.197 -76.391 89.340 54.054 141.168-100.544 90.990 34.982 131.000-133.059 97.396 45.053 116.048 -89.136 134.875-174.893 109.992 -76.675 95.483 63.747 131.873-156.520 91.163 48.877 113.745 -76.889 89.778 56.544 127.636 -19.974 88.805 51.340 114.074 -69.565 90.402 41.598 128.589 -76.221 89.252 47.597 102.133 -81.633 89.481 56.048 136.789 -43.020 87.619 46.922 147.675-109.657 90.558 40.151 128.222 -76.684 90.829 48.623 113.013 -36.920 90.253 47.949 129.722 -77.563 90.062 44.900 138.312-126.403 89.915 48.942 129.650 -42.480 89.914 53.770 135.972 -61.337 89.828 44.327 138.509-125.194 94.866 78.842 104.041 -80.355 92.564 0.000 128.925 -76.685 # 399 total E -1.46798E+02 rmsd from N 0.000 %NC 0.00 93.654-168.072 142.333-106.419 93.572 55.509 136.685 30.305 91.105 48.682 104.668 -77.408 92.714 45.716 130.147 -77.414 93.478 45.911 133.301 -4.670 93.058 39.929 56.621 -70.241 91.651 49.790 155.527 98.598 94.964 35.922 125.903-101.436 90.730 50.452 132.844 134.839 87.549 54.974 74.850-117.273 90.251-161.885 123.448 -84.128 97.081 60.745 125.798-147.714 112.097-156.628 101.779 -84.753 100.678 154.921 143.913-155.349 131.962 -93.261 158.993 -13.694 95.038 47.328 144.381 -96.975 93.244 42.587 135.331 -74.467 90.887 51.556 139.302 53.746 90.038 48.116 116.652 146.238 93.103 37.637 145.390 -53.159 100.186 34.122 0.000 0.000 94.605 45.652 143.006 -9.321 91.065 52.257 139.766-102.944 90.248 52.747 121.658-138.017 92.240 94.689 110.335 -75.815 90.587 -70.865 144.077 -99.989 96.129 -47.439 136.814-116.569 94.411 -58.509 152.403 -27.676 130.413-140.996 175.019-175.981 96.983 -40.652 94.042 -98.926 92.390 -43.597 111.822 -76.015 90.829 -49.598 113.507 -48.237 88.506 -48.477 119.708 -74.872 90.963 -44.272 128.002 -76.690 88.600 -48.882 100.967 -79.789 87.239 -58.020 150.066 -34.121 89.199 -52.852 151.614-151.588 89.447 -42.415 127.817 -76.280 94.194-125.164 126.857 2.322 90.974 54.957 132.045 -77.566 90.668 47.752 144.245-137.074 89.636 48.205 130.740 -40.423 90.834 52.706 135.704 -54.270 90.082 44.653 146.136-138.234 94.427 82.341 142.673-122.953 92.527 0.000 128.901 -76.635 # 400 total E -1.48583E+02 rmsd from N 0.000 %NC 0.00 93.186 164.058 140.117 -96.864 93.580 57.073 134.765 26.764 92.589 45.037 106.762 -78.636 91.569 48.491 131.895 -78.133 91.349 48.516 140.290-130.011 92.354 41.316 60.248 -69.879 92.489 42.942 125.942 -34.065 92.374 43.467 134.766-107.386 90.352 49.557 138.513-139.489 88.837 50.152 81.512-103.481 91.393 147.108 132.925 -87.649 94.508 89.568 126.553-150.490 92.045 100.666 100.692 -86.723 93.522 -71.319 128.127 -98.845 101.123-120.928 151.411 -35.063 92.156 50.086 139.548 121.168 91.508 47.237 137.750 -83.900 90.606 48.355 128.221 -49.660 89.682 50.121 134.609 -23.174 89.488 47.413 150.678 -28.690 90.169 45.503 0.000 0.000 88.987 55.746 113.052 -79.468 87.045 47.707 137.590 -85.430 89.163 46.366 122.274-127.300 88.645 51.369 109.996 -75.925 89.278 46.749 140.312 -96.943 91.957 53.898 131.371-117.319 94.225 -80.206 104.103 -84.764 119.906 131.213 161.729-151.337 127.870 -22.144 111.998-110.542 120.119-166.060 117.074 -84.072 142.900 73.564 122.046 126.020 105.378-114.739 115.282 -73.497 92.835 49.786 131.963 -77.899 90.240 43.737 103.567 -82.985 89.594 52.500 120.853 -19.683 89.904 52.745 137.478 -46.771 90.074 35.964 130.163 -77.516 94.493 114.963 112.107-103.358 93.027 -40.892 129.513 -77.610 94.829 -47.788 141.486-116.798 95.435 -16.768 123.481 -16.204 106.956 -53.159 157.010 -15.046 92.306 -34.765 147.542-123.956 97.178 94.549 97.425 -80.382 92.574 0.000 128.746 -76.788 # 401 total E -1.49662E+02 rmsd from N 0.000 %NC 0.00 93.639-156.917 137.539 -95.530 93.333 58.623 137.711 51.408 93.324 43.706 105.888 -80.200 92.368 44.307 131.642 -77.810 93.959 45.859 149.227-142.490 92.807 42.873 54.698 -69.737 90.652 46.756 132.199 -25.761 90.447 46.106 124.740-111.957 89.904 49.313 137.434-136.067 90.644 75.795 84.408-103.174 92.229 -61.927 138.742 -98.431 106.493 -74.111 93.313 -85.001 93.940-116.125 149.080 -2.660 112.993 -81.324 146.598-134.979 97.808-115.153 110.124 -86.154 91.697 52.713 137.726 119.227 91.843 46.326 138.429 -84.687 90.578 47.584 132.500 -47.856 90.374 48.916 141.339 -18.932 90.449 45.407 143.046-137.187 91.080 43.997 0.000 0.000 89.630 52.225 108.681 -79.281 89.331 47.181 127.720 -73.161 91.227 40.200 126.427-117.499 93.103 44.162 113.916 -77.635 92.690 41.645 142.015-106.638 94.642 63.486 134.432-149.775 93.272 -56.281 141.418-124.444 132.289 140.064 152.794 -15.297 132.568 160.510 111.646-104.756 98.778 106.398 115.930 -78.455 91.932 -52.667 106.933 -63.113 90.353 -44.842 109.448 -72.080 90.958 -46.276 127.248 -74.766 89.932 -42.799 109.652 -92.633 88.617 -53.014 97.471 -70.903 87.027 -54.639 145.969 -27.478 90.213 -48.022 130.006 -77.120 93.557-141.369 107.728 -41.916 93.104 48.284 130.621 -76.154 92.517 48.531 142.302-120.465 92.610 65.565 130.397 -37.168 94.375 -95.309 132.306 -73.435 101.094 -28.815 104.987 -88.208 120.929 138.130 106.805 -77.353 92.740 0.000 129.404 -76.415 # 402 total E -1.48618E+02 rmsd from N 0.000 %NC 0.00 93.100 -69.561 126.950 -76.255 94.045 -49.382 117.065 -77.974 91.108 -46.555 103.386 -77.755 90.581 -46.781 128.754 -75.789 91.739 -40.227 140.621-128.510 93.061 -43.383 62.346 -65.830 92.135 -40.156 132.414 36.493 102.614 -36.496 167.895 164.056 93.630 -44.170 138.906-130.174 105.663-148.491 128.753 -4.166 118.152 40.597 162.269-153.773 95.604 39.720 95.146-114.475 93.074 46.987 111.333 -85.954 91.907 50.507 131.715 -99.513 89.706 49.231 138.404-140.076 90.979 39.781 125.102-119.604 97.314-152.460 114.296 -70.362 120.966-168.918 127.808 76.645 97.317 -49.400 112.016-115.805 91.164 -46.038 139.515 -18.209 91.809 -81.616 0.000 0.000 82.567 99.722 106.545 -86.452 93.946 50.094 132.866 -92.509 91.078 44.417 138.185-152.552 90.105 45.806 105.555 -72.144 91.902 58.324 131.028 -61.655 89.437 42.497 141.842-148.905 92.286 45.478 113.703 -88.666 99.840 -14.648 115.552 -81.289 142.807-153.351 101.027 -79.270 90.556 57.193 114.877 -75.770 91.342 53.202 110.599 -82.665 87.658 60.713 121.237 12.709 88.167 54.413 129.427 -76.368 88.127 45.398 101.881 -83.871 88.912 49.260 118.309 -14.921 88.986 53.704 137.923 -40.801 88.680 43.026 128.232 -76.609 90.392 83.912 117.595-112.047 88.946 -75.825 128.972 -77.218 95.896 -64.801 144.989-153.214 93.163 -40.762 114.383 21.503 95.369 114.195 141.859 -40.864 97.626 17.128 142.580-161.186 99.001 38.973 106.276 -77.075 92.414 0.000 129.373 -76.280 # 403 total E -1.46554E+02 rmsd from N 0.000 %NC 0.00 93.213 -63.549 129.783 -79.811 128.319 -99.040 130.774 -48.159 92.775 44.862 142.797 -39.229 92.864 49.373 129.598 -75.778 91.600 40.175 154.683-154.405 93.015 43.313 87.747-112.862 90.131 43.599 110.003 -41.493 88.803 54.305 138.135 -75.832 87.142 46.559 122.387-103.197 90.812 39.722 88.376 -95.137 93.867 64.207 133.448 -84.227 101.212 -46.444 101.259 -99.346 109.947 121.193 112.279 -91.807 132.534-138.751 147.127-121.190 111.513-104.918 141.577-154.945 94.984 42.355 141.797-113.166 91.880 48.266 134.346 -76.824 89.994 55.393 125.551 -26.382 90.547 47.947 132.496 0.460 88.964 42.863 109.437 -81.969 90.535 53.399 0.000 0.000 90.897 45.242 140.031 -34.748 90.164 43.016 172.786-162.509 89.856 55.670 110.094-139.959 87.726 55.958 108.905 -77.315 89.208 52.601 156.624-109.426 89.348 38.093 121.700-157.776 98.270-111.131 106.369 -83.389 117.239 179.535 161.688-153.162 97.466 -57.165 92.795-100.383 86.789 -59.028 111.280 -75.025 88.556 -68.371 122.830 -32.742 89.138 -48.116 106.554 -68.831 90.539 -40.727 127.040 -75.257 90.618 -47.859 103.682 -79.523 91.541 -47.470 146.812 -30.956 89.924 -43.914 142.859 -89.385 91.645 -51.645 128.318 -76.518 94.118-131.490 125.043 8.378 90.340 51.614 131.451 -76.841 90.530 48.038 146.360-137.101 89.397 47.514 130.702 -41.994 90.171 54.383 137.088 -52.247 89.597 43.878 143.007-130.857 94.783 80.275 103.772 -80.538 92.484 0.000 128.929 -76.694 # 404 total E -1.48695E+02 rmsd from N 0.000 %NC 0.00 93.149 -82.665 121.353 -57.167 124.695 -98.144 130.662 -41.841 95.912 39.114 109.432 -80.412 93.379 46.628 131.259 -77.616 94.179 43.131 151.782-146.193 91.703 45.333 57.897 -77.052 90.071 44.392 127.479 -35.168 90.812 45.602 128.801-109.598 87.376 51.027 139.222-167.885 88.413 56.788 78.614-105.717 86.148 157.857 136.774 -91.362 97.455 62.324 128.972-153.577 92.670 35.418 98.392 -81.435 93.939 50.860 145.233 -39.375 92.162 42.221 143.678-120.961 92.929 48.919 125.601-140.644 93.415 26.658 124.980 -82.666 103.359 154.194 142.587 -82.358 97.589 37.653 148.130 133.598 95.158 43.619 141.160-124.167 102.483 27.000 0.000 0.000 102.315 33.978 154.874 1.409 95.448 40.160 170.154-165.703 91.378 51.651 114.936-148.124 90.003 44.037 106.487 -71.833 94.444 40.892 138.395 -51.088 98.699 15.505 134.536-120.201 110.736 44.797 111.334 -85.436 94.722 27.039 152.792 -22.911 121.150-140.470 113.066-115.501 93.076 -19.947 113.462 -77.098 110.179-155.812 126.446 94.790 145.191 178.106 125.541 -83.422 93.751 60.511 129.345 -75.897 91.722 42.572 107.860 -87.913 89.823 51.616 151.534-130.332 88.765 54.676 136.154-167.843 88.233 46.406 127.886 -76.321 90.248 45.728 106.148 -55.208 91.418 44.240 129.026 -75.416 92.009 44.302 135.341-149.443 90.752 47.701 130.701 -49.455 90.411 51.958 133.317-111.767 90.525 43.383 132.131-141.638 95.513 71.302 103.975 -80.549 92.519 0.000 129.007 -76.669 # 405 total E -1.48720E+02 rmsd from N 0.000 %NC 0.00 93.093 160.606 140.043 -95.480 93.237 54.205 139.148 35.701 91.644 46.338 106.223 -82.755 91.776 48.358 130.470 -77.045 93.613 44.927 148.528-129.104 91.221 43.429 59.837 -74.287 90.425 46.952 125.873 -38.366 91.438 46.211 125.563-106.123 87.476 47.315 145.115-162.152 88.914 54.771 76.480-105.154 89.569 127.133 135.754 -83.929 90.448 79.104 100.540-128.514 89.013 99.080 98.010 -85.673 91.411 -74.777 106.882 -77.401 97.865-111.900 139.586-138.840 89.419 57.864 149.434 108.537 92.180 46.711 132.871 -87.310 90.579 46.190 150.689 0.014 89.785 50.432 131.130 -21.290 88.769 51.091 109.582 -82.583 89.405 44.839 0.000 0.000 89.892 48.235 110.392 -81.466 88.355 49.703 136.595 -73.337 90.631 42.667 131.466-141.471 94.114 95.663 110.401 -77.539 94.681 -11.548 152.921-120.066 98.851 -82.586 129.982 -69.726 91.203 6.631 111.448 -85.597 110.779-152.944 152.490 -20.323 121.962 -32.962 111.035-112.330 94.169 -45.830 109.192 -80.748 91.744 -45.577 105.930 -57.571 89.407 -45.669 112.300 -65.836 91.291 -46.436 124.794 -74.139 90.205 -37.742 106.077 -87.841 91.057 -49.200 101.744 -63.184 88.079 -54.388 153.284 -28.496 89.049 -52.912 129.865 -77.072 91.767-131.333 136.725 -59.741 90.327 54.354 132.074 -76.972 90.698 45.810 141.136-107.560 90.236 45.767 126.652 -28.197 90.960 56.693 143.242 -40.588 88.903 43.750 138.461-135.203 94.448 84.756 103.721 -79.950 92.548 0.000 128.862 -76.752 # 406 total E -1.54685E+02 rmsd from N 0.000 %NC 0.00 93.169 167.323 138.950 -93.922 92.866 57.402 147.421 19.208 92.624 44.411 106.207 -82.689 92.077 50.103 131.666 -77.210 93.744 42.409 142.454-117.669 90.005 44.384 63.180 -80.045 89.961 47.311 116.927 -51.170 91.087 45.577 127.498 -99.171 87.810 44.956 142.485-147.138 89.850 52.623 78.313-103.356 90.463 145.023 137.528 -85.792 95.219 77.197 122.629-144.286 97.428 106.155 98.914 -85.128 92.076 -60.354 147.586 -90.921 99.058-122.570 135.699-145.783 90.353 49.933 138.368 121.589 90.971 48.199 134.767 -85.306 90.081 48.148 138.369 -45.561 90.530 46.758 133.974 -20.382 89.829 45.475 143.948-157.057 89.054 49.445 0.000 0.000 88.922 53.296 110.242 -80.086 88.321 43.261 138.265 -78.893 89.829 46.138 120.834-123.029 89.315 52.208 110.762 -78.845 88.788 50.982 141.356-105.184 91.047 43.817 131.959-124.821 95.975 -99.001 104.166 -82.987 114.616-175.944 151.630 -16.668 136.756-167.571 108.686 -98.953 96.004 44.814 115.049 -77.476 92.574 46.887 100.826 -4.597 90.822 48.158 121.819 0.845 89.600 48.002 129.911 -77.048 89.335 45.365 104.767 -83.893 89.285 48.021 121.912 -20.419 88.803 48.151 138.201 -54.585 89.169 46.383 128.347 -76.693 88.138 53.171 119.157 -46.199 89.662 43.894 127.867 -75.549 92.274 47.775 136.146-128.923 93.607 77.620 127.818 -42.442 88.924 -85.973 141.429-101.876 94.986 -38.846 105.544 -85.721 102.245-110.423 145.778 -13.409 93.124 0.000 129.343 -76.903 # 407 total E -1.47755E+02 rmsd from N 0.000 %NC 0.00 93.429 173.056 140.551-103.059 93.350 55.311 144.626 6.626 92.815 43.272 105.745 -82.617 92.120 51.889 130.994 -76.058 92.895 39.786 135.725-110.376 92.856 42.635 63.481 -78.299 91.179 44.006 114.506 -46.093 89.590 51.027 142.345 -87.606 89.024 41.561 120.124-115.913 92.114 42.569 88.806 -97.316 94.328 56.376 135.633 -88.148 99.500 -73.460 103.774-103.613 117.974-154.919 105.721 -89.956 132.558 130.648 153.152 170.458 111.204 -99.268 144.770-162.502 95.381 46.008 148.502 145.803 92.326 44.900 135.090 -86.068 90.503 51.801 115.216 -67.369 90.189 51.348 138.270 -40.977 90.278 42.226 108.510 -82.473 91.973 42.682 0.000 0.000 90.762 53.668 110.065 -82.880 87.260 49.615 149.638 -83.928 89.382 42.368 119.150-135.477 89.234 49.220 112.288 -76.310 88.890 52.857 143.817-107.973 88.740 49.152 130.626-174.212 88.658 44.733 140.222-123.895 91.436 85.607 120.401 -85.644 91.987 62.888 126.973-149.307 92.965 33.323 113.072 -77.768 94.359 149.403 129.473 -95.016 165.227 50.195 149.356 -98.557 93.678 45.298 130.240 -76.447 93.883 42.513 104.008 -83.835 93.274 42.503 124.053 -71.622 93.497 49.116 124.557 -78.915 92.454 74.611 131.599 -78.738 90.848-174.100 101.525-118.748 92.427 58.455 131.105 -76.878 91.145 44.473 141.022-113.297 90.952 46.775 128.710 -31.325 91.827 51.895 136.167-104.983 90.185 42.710 134.893-159.584 95.307 76.493 103.895 -80.370 92.542 0.000 128.852 -76.699 # 408 total E -1.49420E+02 rmsd from N 0.000 %NC 0.00 93.327 -78.961 130.366 -86.662 94.741 -46.724 128.459 -77.151 91.451 -49.968 102.038 -79.182 90.615 -44.925 127.036 -74.714 90.980 -46.580 151.307 179.652 92.970 -46.910 115.972-131.583 90.981 122.495 79.018 -93.156 95.560 49.250 139.046-102.659 87.079 49.400 144.703 177.839 88.836 52.487 74.912-106.150 91.275 129.862 140.053 -86.644 92.495 77.703 98.649-123.280 93.609 104.959 96.896 -83.483 93.616 -64.014 125.589 -83.739 96.125-118.522 135.664-139.087 89.748 55.310 137.124 114.825 92.166 46.449 133.146 -85.601 91.023 44.588 145.865 -14.355 90.434 49.959 138.150 -17.797 88.773 50.831 110.572 -82.738 89.674 43.764 0.000 0.000 89.258 49.512 117.624 -80.535 89.677 47.857 134.028 -79.880 89.168 45.393 124.207-124.227 88.456 49.430 113.281 -80.252 90.135 51.007 137.353-108.547 91.001 48.598 133.533-129.491 92.364-105.416 103.044 -82.653 104.100 170.056 149.550 -15.756 106.290-164.592 90.154 -84.848 90.198 56.730 114.900 -75.956 92.861 45.350 104.197 -26.739 92.405 42.850 131.772 -11.170 91.395 43.500 129.554 -76.915 89.976 49.511 101.821 -85.496 89.719 48.367 122.504 -38.207 92.789 38.831 130.157 -67.043 94.787 38.038 129.171 -76.913 95.754 79.873 102.240 -77.861 96.868-175.866 128.822 -76.697 89.220 54.702 141.479-105.834 91.152 47.956 126.487 -32.426 90.312 49.902 148.336 -30.951 90.884 42.720 141.603-147.429 94.320 108.134 102.179 -79.801 92.556 0.000 128.776 -76.488 # 409 total E -1.50550E+02 rmsd from N 0.000 %NC 0.00 124.589-113.603 146.461 -41.673 121.698-103.960 131.366 -35.783 92.888 46.031 108.676 -80.260 93.326 43.491 130.338 -77.607 96.167 45.338 147.484-128.018 93.059 41.092 55.048 -77.439 91.833 44.697 126.615 -32.103 92.792 40.911 126.975-103.933 90.877 52.327 142.379-132.037 89.306 43.829 76.534-103.246 93.684 148.436 150.634 -99.649 89.192 80.377 102.806-144.529 91.717 109.064 98.411 -84.594 91.929 -61.895 127.626 -84.607 96.008-124.519 136.311-140.963 90.290 51.375 138.756 119.135 91.825 46.905 133.446 -85.615 91.050 45.551 136.785 -42.578 90.473 48.127 134.097 -20.281 89.538 48.326 109.953 -82.744 90.073 44.858 0.000 0.000 89.370 48.191 117.247 -82.357 90.734 47.021 135.858 -80.965 90.169 42.948 122.761-124.197 88.961 52.531 114.702 -78.029 89.560 49.640 134.400-105.607 92.060 49.066 131.775-126.531 94.923 -95.645 149.739 -31.900 108.971-170.749 157.454-139.820 102.344 -49.332 91.870-109.191 93.756 -46.220 111.514 -77.781 96.036 -86.566 118.520 -59.602 90.101 82.610 111.557 -76.802 92.843 56.952 129.637 -76.366 90.525 43.253 142.603-176.241 91.343 46.729 176.449-142.811 90.737 44.378 127.765-140.208 91.936 44.192 127.829 -76.740 94.214 78.124 125.390-114.519 87.784 -83.619 130.696 -78.006 93.163 -46.067 141.295-112.785 85.929 -59.502 108.315 26.612 89.942 -52.067 150.971 -21.589 90.712 -46.998 105.894 -81.516 94.947 100.908 104.427 -78.400 92.630 0.000 129.000 -76.327 # 410 total E -1.49890E+02 rmsd from N 0.000 %NC 0.00 93.323 -78.811 128.330 -80.684 93.319 -50.304 118.066 -74.473 91.603 -43.096 103.293 -76.027 92.524 -47.484 126.600 -74.264 100.856 -10.314 152.793-143.939 106.341 -40.738 61.948 -80.089 96.347 -17.833 128.078 -62.213 108.941 -44.816 132.444 -88.871 95.836 -70.585 143.331-136.282 86.768 90.456 86.544 -94.330 103.288-138.759 134.377 -82.805 97.411 41.465 124.425-146.193 120.980 167.721 101.063 -82.243 119.887-104.505 154.415 -18.877 95.103-116.949 141.833-142.031 92.074 48.512 135.186 134.767 91.561 47.316 135.100 -87.465 90.434 49.766 154.643 -78.213 90.211 46.266 130.048 -27.839 89.983 45.956 145.404-159.319 90.568 45.670 0.000 0.000 90.665 46.461 146.961-134.056 90.015 44.574 142.618 -94.408 91.105 41.540 119.345-129.555 90.307 48.220 114.554 -76.824 91.773 40.396 134.612-103.292 94.581 55.794 131.766-147.486 93.586 -72.206 140.986-121.501 122.420 127.981 151.206 -18.022 123.688 -74.022 114.349-115.962 111.644 -65.328 114.089 -83.729 123.245 -94.162 121.192 47.193 96.369 46.107 113.684 -72.571 92.989 44.806 129.437 -76.389 93.008 41.174 104.243 -90.824 90.868 47.027 141.101 -46.258 89.909 50.959 135.490-103.169 89.025 46.646 128.387 -77.173 89.054 66.450 114.570-106.764 91.040-167.253 128.709 -77.186 93.356 59.388 141.134-113.134 90.252 55.249 134.111 -54.852 90.596 58.250 152.012-165.517 88.571 44.123 129.808-169.150 93.959 92.659 101.575 -79.450 92.531 0.000 128.810 -76.447 # 411 total E -1.52087E+02 rmsd from N 0.000 %NC 0.00 93.027 158.556 137.829 -87.584 93.308 57.244 135.472 50.717 91.915 44.594 106.089 -82.170 92.122 48.258 129.742 -76.649 91.798 47.502 155.429-158.514 92.777 39.416 61.916 -72.621 93.930 42.814 125.639 -33.662 94.569 36.964 135.055-106.257 92.983 55.705 143.262 173.335 87.661 70.997 87.018-104.859 90.480-166.028 135.413-104.278 91.814 70.921 99.056-132.122 89.832 51.641 99.782 -81.251 91.274 56.164 138.040 -31.620 91.653 38.157 102.577 -89.324 95.374 42.303 138.618 -97.348 101.041 -4.652 118.028 -68.135 135.868 149.977 123.865 -43.997 95.756 47.410 135.274-170.586 97.254 36.209 140.366-127.064 112.861 20.100 0.000 0.000 96.571 44.029 146.526 -13.663 92.199 48.370 143.850-104.264 89.571 53.085 114.206-129.923 87.641 48.012 107.890 -74.808 90.468 52.541 134.188 -76.840 90.850 44.473 134.831-136.521 93.635-113.566 140.951-116.607 112.613 170.309 151.387 -14.887 124.749-135.593 118.833-122.912 93.994 59.660 114.596 -76.352 92.278 44.791 103.388 -48.863 90.719 51.503 115.470 -70.621 90.754 41.835 128.271 -76.450 90.491 46.977 104.653 -85.181 90.652 49.049 127.008 -81.541 89.294 53.940 134.121 -95.384 89.818 53.229 128.464 -77.049 93.539-176.435 87.991 -71.573 91.754 66.753 131.765 -76.850 91.120 43.834 140.353-102.337 89.210 53.594 132.110 -11.829 89.604 68.512 143.681 -42.943 86.621 43.064 138.057-144.769 95.172 103.527 102.892 -79.585 92.483 0.000 128.974 -76.174 # 412 total E -1.50458E+02 rmsd from N 0.000 %NC 0.00 92.929 131.754 141.761-100.469 93.574 55.432 129.243 47.535 91.750 43.371 106.434 -81.499 91.667 48.992 129.867 -76.407 90.263 46.082 154.319-155.191 92.049 42.764 60.678 -64.162 91.280 44.641 123.881 -23.710 88.539 47.439 135.338-105.404 91.238 56.831 113.066-101.109 88.253 69.517 97.727 -93.924 92.097-159.637 125.331 -96.708 94.488 69.390 98.658-121.696 94.753 37.804 101.575 -80.776 92.842 99.410 149.339 -36.876 95.538 45.154 135.691-161.445 92.481 38.600 130.961-101.488 92.362 49.612 141.922 -45.036 93.693 43.649 104.209 -49.564 96.606 25.996 152.478 172.119 107.461 24.312 142.555-164.397 99.251 40.013 0.000 0.000 92.929 44.368 134.413-114.669 93.960 41.610 117.753-109.656 91.660 40.896 116.542-114.236 90.759 50.767 113.587 -80.025 91.117 50.799 135.127-103.803 92.114 38.422 130.500-145.063 96.325 40.952 144.963-132.014 137.877 177.411 106.438 -81.835 96.381 44.658 129.825-153.082 91.623 47.622 113.383 -76.836 89.617 69.068 158.302-110.881 88.996 49.536 108.747 -72.865 90.915 39.842 128.543 -75.887 90.367 47.234 112.256 -88.496 90.011 47.892 128.425-103.158 88.108 50.277 149.222-171.019 88.398 46.645 127.925 -76.288 89.161 47.719 101.472 -58.645 90.121 45.591 128.813 -75.223 90.778 44.098 132.720-156.102 90.644 46.487 127.838 -42.970 89.237 55.367 136.062 -91.521 89.821 42.608 121.558-129.487 95.445 76.326 104.086 -80.566 92.503 0.000 128.955 -76.724 # 413 total E -1.46993E+02 rmsd from N 0.000 %NC 0.00 93.281 170.837 139.682 -98.070 93.147 56.465 151.983 35.947 92.275 44.718 106.474 -83.045 91.902 54.610 131.087 -76.844 91.831 42.942 146.308-137.511 90.360 46.151 70.840 -91.155 89.714 46.967 115.319 -68.935 88.987 51.318 132.902 -98.464 87.848 55.386 132.404-127.317 90.689 173.290 81.818 -91.473 116.084 67.360 161.475-154.522 93.657 43.631 95.075-120.076 92.345 46.192 99.040 -80.060 93.684 52.312 140.554 -33.832 89.599 51.990 145.632-134.422 91.414 32.146 121.624-127.278 100.027-127.642 119.495 -70.468 106.321-148.548 128.853 53.666 98.401 -51.990 133.322 -39.568 91.225 -52.659 105.188 -81.159 91.097 -42.770 0.000 0.000 92.355 -46.177 147.990-139.176 92.523 -41.873 143.070 -89.496 92.737 -53.139 121.123-130.838 92.667 -70.241 138.656 -3.390 118.956 149.364 170.558-157.678 93.976 82.467 142.561-125.150 112.639 -85.132 141.686-138.730 117.989 147.042 105.873 -77.545 136.630 -41.449 104.387 -93.391 92.017 -47.234 114.426 -80.000 96.941-128.799 125.730 -69.387 89.008 55.019 119.011 -71.040 90.386 48.609 129.624 -76.196 89.014 43.731 142.992 -20.121 90.139 46.558 140.528 -39.217 89.445 49.068 148.665-110.270 90.066 41.127 127.953 -76.731 89.265 48.849 113.404 -50.514 90.393 47.446 127.944 -76.690 90.205 45.619 138.430-130.154 90.288 46.087 127.484 -41.131 90.469 52.745 136.142 -90.586 90.293 43.513 134.349-137.367 95.532 71.936 104.273 -80.352 92.522 0.000 128.933 -76.614 # 414 total E -1.47959E+02 rmsd from N 0.000 %NC 0.00 123.864-101.128 147.904 -51.209 94.065 -53.046 116.458 -75.157 92.168 -41.257 103.098 -79.670 91.909 -48.396 126.762 -75.263 94.529 -22.733 140.316-115.261 105.104 -36.332 59.198 -65.826 95.439 -23.126 130.814 19.532 108.921 -27.443 138.954 -76.549 99.420 -50.506 127.427 -86.028 91.174 54.518 123.017-133.529 141.587-148.309 137.797-125.387 96.041 83.050 124.045-147.548 92.601 58.595 110.066 -85.776 92.991 163.232 133.117 -99.897 137.375 -1.492 150.122 171.677 113.363 21.372 144.991 138.765 93.190 47.553 137.718 -89.222 91.721 47.137 133.338-106.856 93.262 46.996 102.479 -34.315 94.880 32.822 106.946 -79.802 97.827 38.211 0.000 0.000 95.557 46.825 112.033 -84.561 89.909 43.960 150.460 -90.117 89.636 44.574 111.982-127.616 89.438 53.204 109.978 -80.925 89.368 50.851 143.206-107.580 90.941 43.778 124.025-155.171 95.341-101.957 142.709-123.163 116.576 175.529 151.859 -13.529 131.654-136.562 109.218-105.056 100.714 37.354 115.199 -77.832 93.745 45.796 119.965 -5.518 91.026 47.264 146.153-144.582 89.657 51.630 130.725 -77.703 85.787 49.193 102.952 -83.741 87.682 52.811 116.600 -42.210 87.749 49.887 141.531 -30.660 88.845 42.531 128.168 -76.430 87.991 52.630 109.594 -46.333 89.214 48.440 127.251 -76.418 89.491 47.278 138.474 -90.000 89.940 48.294 126.837 -37.875 89.991 52.962 136.709 -82.674 90.289 43.808 135.883-131.497 95.323 74.824 104.216 -80.630 92.550 0.000 128.983 -76.616 # 415 total E -1.47304E+02 rmsd from N 0.000 %NC 0.00 92.946 -52.643 129.215 -85.750 94.791 -48.974 114.918 -76.333 91.526 -44.495 103.963 -78.112 90.638 -48.100 128.626 -76.062 90.435 -42.348 139.583-124.658 93.896 -39.050 79.169 -87.109 94.487 -38.446 130.527 37.300 104.602 -30.936 170.284 158.117 97.243 -49.221 123.598-117.695 96.697-112.534 87.415 -86.796 111.523 75.284 144.468 158.437 91.961 48.614 97.249-131.358 97.027 34.212 99.521 -77.004 96.633 38.409 147.846 -32.803 102.206 27.604 113.951 -88.313 98.847 39.195 130.108-104.422 99.125 5.782 142.502 -81.798 131.890 -27.446 143.320 -88.068 139.314-158.311 123.857-106.357 91.572 71.608 145.098 170.460 90.318 52.855 0.000 0.000 91.985 42.649 134.894 -17.046 90.078 47.771 148.969 -87.367 89.697 52.373 118.459-132.669 88.861 44.989 106.998 -69.399 94.071 43.474 132.754 -55.369 97.828 12.146 135.390-123.510 112.031 43.893 111.557 -85.438 95.738 30.238 153.000 -21.655 120.815-147.042 113.891-116.594 92.495 -26.281 113.478 -77.178 111.654 178.592 122.880 55.782 133.349-152.775 123.115 -82.406 94.028 60.764 129.265 -75.935 91.330 44.808 108.268 -88.775 89.485 52.824 152.288-138.266 88.912 53.166 126.080-146.597 87.973 49.516 127.879 -76.401 88.230 55.891 132.624 -65.245 89.913 44.361 127.432 -74.361 90.704 45.305 141.915-166.235 90.742 50.144 128.330 -45.533 90.305 50.022 135.420 -90.730 91.193 45.418 139.025-159.495 94.975 75.210 104.084 -80.814 92.486 0.000 129.005 -76.636 # 416 total E -1.48105E+02 rmsd from N 0.000 %NC 0.00 92.401 126.032 125.005 -51.771 94.678 46.870 148.281 6.006 92.880 45.915 109.571 -80.039 91.209 47.857 127.963 -74.811 90.568 43.842 123.808 -30.342 91.900 43.509 104.860 -71.205 91.659 44.065 119.423 -18.129 98.775 28.541 111.614 -82.206 93.941 41.578 144.164 -33.140 104.353 16.218 73.951 -98.253 102.876 41.037 154.557-148.068 100.106 25.002 86.393-109.767 95.066 52.108 138.069-119.955 91.897 44.071 118.168-112.018 91.486 51.152 138.876-132.390 91.120 34.417 122.204-126.480 98.031-123.847 123.718 -88.720 112.872 161.791 122.243 53.749 113.163-168.576 140.190-139.083 95.951 52.958 145.896-164.260 93.562 43.432 0.000 0.000 91.879 43.713 152.003-136.268 94.167 44.036 135.123-103.002 91.481 41.444 116.911-121.965 91.395 46.971 112.475 -79.152 92.269 48.322 138.435-102.266 94.082 43.351 132.912-136.681 96.466 37.520 153.492 -20.859 141.819 179.029 108.099 -81.271 95.872 42.863 134.081-159.125 93.173 42.321 114.013 -77.186 89.439 62.209 159.175 -54.687 88.512 54.129 110.077 -74.431 90.109 40.352 129.766 -77.333 89.104 47.513 108.341 -86.293 88.159 59.993 133.758 -98.012 87.158 52.041 145.040-159.899 87.876 42.442 128.100 -76.431 88.605 55.099 105.206 -49.132 89.638 48.726 126.857 -74.685 89.780 44.145 137.488-137.029 93.566 75.663 128.873 -43.454 88.447 -88.682 142.508 -81.969 96.438 -38.755 105.573 -85.764 103.129-107.814 146.824 -14.902 92.933 0.000 129.343 -76.636 # 417 total E -1.51103E+02 rmsd from N 0.000 %NC 0.00 93.242 167.601 140.027 -98.232 92.972 56.000 135.606 49.570 91.956 43.750 106.147 -81.932 91.852 48.791 130.993 -76.949 92.503 41.373 152.263-152.018 93.811 42.733 57.026 -68.852 89.058 47.949 117.624 -30.416 88.720 59.349 135.673 -97.448 85.993 43.802 127.943-122.191 90.967 42.723 75.948 -94.688 92.909 153.554 134.377 -60.673 94.854 96.653 139.472-168.339 89.430 169.565 104.179 -82.383 100.268 179.374 157.054-160.522 116.744 -98.352 154.854 -24.415 95.116 42.410 149.812-108.758 92.967 43.922 136.368 -75.321 90.552 50.849 122.282 -36.821 90.898 49.092 143.607 -42.450 91.296 38.749 152.915 -19.114 91.891 45.051 0.000 0.000 89.454 54.578 134.669 -41.604 87.500 50.389 135.625 -93.095 88.825 46.619 124.021-132.858 90.806 60.672 107.539 -74.449 90.391 -94.824 136.053 -65.239 115.942-123.548 129.615-132.382 95.391 42.397 157.313 -10.955 96.438 120.682 144.560-108.318 92.065 -48.465 97.793 -93.677 92.804 -44.372 112.146 -76.451 92.202 -41.318 111.284 -50.298 90.863 -47.906 110.847 -71.224 89.928 -46.813 127.428 -76.768 88.281 -44.706 103.501 -81.142 88.951 -48.408 146.662 -31.458 90.712 -49.077 156.400-141.410 88.925 -47.670 128.752 -77.384 92.537-121.868 135.131 11.574 89.184 53.503 133.548 -78.334 90.397 47.773 141.812-103.126 88.423 52.231 129.485 -33.062 88.913 61.488 139.904 -44.915 87.831 46.532 146.808-155.764 93.023 95.894 102.308 -79.910 92.569 0.000 128.749 -76.748 # 418 total E -1.55597E+02 rmsd from N 0.000 %NC 0.00 117.842 147.710 153.492-111.442 93.611 54.136 139.277 33.404 92.086 45.558 106.041 -81.888 91.807 47.792 131.079 -77.623 93.688 45.833 146.360-124.862 91.079 42.935 58.726 -73.897 90.526 46.554 126.812 -38.402 91.392 46.175 126.029-106.938 87.661 47.453 140.761-154.029 89.091 54.561 78.577-104.420 89.848 137.891 136.363 -87.502 95.421 74.966 123.258-144.524 92.468 108.209 98.110 -84.109 93.576 -69.137 127.398 -78.763 95.349-118.258 133.866-139.108 89.496 54.634 137.528 116.346 91.751 47.442 134.357 -85.457 90.462 45.717 148.323 -17.701 90.377 48.964 137.320 -16.344 88.902 49.701 142.998-152.057 89.714 45.232 0.000 0.000 89.648 50.007 117.480 -78.338 88.890 45.247 138.799 -80.275 89.522 46.317 121.727-125.512 88.999 50.264 111.644 -77.248 89.915 47.485 135.851-100.129 92.774 53.561 131.182-127.674 95.259 -94.941 104.481 -86.883 102.561-161.941 112.726 -78.654 135.704 -60.076 114.797-110.570 96.088 -44.470 110.676 -80.392 98.259-121.301 130.893 -66.495 89.741 66.051 137.116 -32.458 91.230 56.218 129.421 -76.106 88.040 45.444 109.143 -83.888 89.254 49.950 142.744-103.205 88.074 54.372 143.420-157.275 87.523 48.038 127.891 -76.367 88.895 47.478 103.238 -57.080 90.550 44.484 128.534 -75.150 91.071 45.225 135.048-153.254 90.290 48.395 128.182 -44.000 89.516 52.515 136.401 -97.514 90.569 43.675 134.546-140.214 95.350 73.326 104.147 -80.537 92.519 0.000 128.991 -76.657 # 419 total E -1.51243E+02 rmsd from N 0.000 %NC 0.00 93.231-173.158 132.141 -75.347 93.944 64.307 142.351 68.316 96.124 35.493 104.931 -79.408 92.711 50.960 132.476 -77.647 91.922 43.540 148.692-156.754 91.641 45.237 63.707 -76.621 90.400 44.074 125.265 -52.431 88.832 51.170 134.881-113.164 86.950 56.418 122.195-118.036 87.206 64.855 85.766 -97.824 88.783-170.430 139.844 -91.687 94.470 71.031 99.723-129.934 92.404 43.514 99.609 -79.459 95.408 113.003 140.346 -38.922 94.758 41.214 139.420-166.217 93.232 42.313 129.887 -99.774 91.618 50.622 142.248 -18.202 92.614 43.995 100.568 -46.217 94.933 30.446 152.071 169.855 104.966 25.015 106.811 -83.399 99.726 41.433 0.000 0.000 90.216 48.100 135.387-127.524 89.704 48.292 112.422-113.138 88.769 49.829 123.271-124.637 88.333 47.481 110.912 -74.492 90.962 49.780 134.957 -93.367 91.726 45.484 134.508-145.773 93.207-104.664 141.645-124.572 107.328-150.282 110.544 -79.043 96.476 -49.742 99.944-103.688 92.474 -49.919 110.235 -76.287 93.267 -66.385 110.571 -67.407 88.521 97.442 139.047 -36.612 92.161 50.511 128.403 -75.968 88.124 51.176 138.986 -36.057 89.097 50.959 142.002 -24.524 88.766 45.184 146.821-111.336 90.672 42.300 127.953 -76.549 89.690 52.123 118.128 -38.629 89.771 49.845 129.464 -76.633 90.547 39.767 136.740-129.712 91.213 52.825 129.152 -38.941 90.795 96.326 137.147 -56.338 88.650 57.151 140.480-170.935 92.764 117.728 99.611 -79.539 92.564 0.000 128.764 -76.423 # 420 total E -1.47581E+02 rmsd from N 0.000 %NC 0.00 92.897 150.235 138.650 -88.079 93.317 51.448 123.286 -32.424 93.923 44.911 105.662 -80.920 92.783 44.407 128.004 -74.823 91.323 45.279 105.318 -75.960 89.830 45.651 89.187 -65.148 88.537 46.600 116.084 -58.945 88.765 46.083 123.136 -95.873 88.341 48.335 133.789-113.501 89.054 48.728 87.528-102.561 91.836 57.090 131.677 -94.209 99.769 -57.386 101.277 -98.085 116.217 149.323 110.936 -87.439 144.486-142.297 161.647-135.477 103.171-118.891 141.713-158.709 94.896 46.968 140.098 133.924 91.487 47.863 134.263 -86.248 90.377 50.750 117.388 -63.466 91.373 50.725 122.532 -28.042 90.838 42.726 109.094 -82.489 90.482 48.019 0.000 0.000 89.782 60.250 113.339 -84.454 87.442 46.479 140.724 -84.378 90.791 43.199 118.442-125.746 89.750 55.353 111.880 -72.447 90.375 45.414 134.705 -94.988 92.598 49.438 130.221-137.775 96.029 -17.664 142.972-125.827 131.273 55.970 156.908 -18.380 134.049-118.345 115.052-108.694 137.269 -27.150 120.947 -83.054 134.986 -50.179 116.269 58.313 142.816 7.900 136.054 -79.493 94.779 40.175 130.787 -77.533 90.573 44.303 101.924 -82.398 90.092 61.699 109.152 -58.633 87.620 47.507 141.560 -50.191 89.619 39.663 128.426 -76.615 89.486 54.936 110.432 -55.874 88.913 49.248 129.402 -77.238 89.460 44.738 142.541-127.615 90.500 46.716 127.965 -41.198 90.148 52.803 136.499 -77.550 90.259 44.018 136.523-131.671 95.238 75.397 104.223 -80.534 92.491 0.000 128.995 -76.672 # 421 total E -1.55040E+02 rmsd from N 0.000 %NC 0.00 93.185 -71.339 127.486 -77.701 93.991 -48.945 120.357 -80.677 90.959 -46.531 103.471 -77.510 90.266 -51.167 126.709 -75.198 88.678 -40.176 140.198-131.454 91.555 -46.438 63.876 -62.515 91.139 -35.276 123.949 -16.639 102.486 -36.589 170.377 138.260 95.558 -44.189 129.911-117.241 94.149 120.860 85.513 -87.161 106.251-169.217 137.017 -95.113 93.441 60.443 100.110-129.343 118.225 135.610 102.079 -83.068 114.415 -87.258 159.818 -18.618 100.526-123.148 145.262-145.161 92.851 46.522 150.531 158.790 92.162 47.347 135.577 -85.410 91.348 46.996 143.092 -68.005 90.513 46.710 125.602 -44.898 89.792 47.805 145.613-157.692 90.942 45.249 0.000 0.000 90.799 43.975 127.903-101.414 90.959 47.163 132.307-112.768 89.381 52.331 117.641-131.119 87.220 54.133 110.921 -78.638 89.747 47.893 134.545 -97.194 91.675 51.761 137.252-143.765 93.496 -94.460 103.224 -82.921 114.293 167.262 150.657 -16.839 133.865-173.078 110.485-104.271 95.272 47.852 115.020 -77.083 93.276 44.027 110.605 -37.285 91.599 48.151 131.223 -25.125 91.218 42.927 128.841 -77.374 91.646 49.515 101.487 -83.891 90.374 48.569 128.355 -64.962 91.977 55.152 124.004 -77.391 92.449 69.379 129.629 -77.218 97.002-168.228 99.601-116.125 92.657 53.416 130.845 -76.749 91.055 47.078 141.502-112.710 88.704 63.604 143.487 -40.616 88.795 65.883 150.788-111.962 86.788 36.472 130.620-172.459 95.658 86.268 102.112 -79.005 92.523 0.000 128.882 -76.593 # 422 total E -1.46864E+02 rmsd from N 0.000 %NC 0.00 93.235 -84.500 123.687 -63.843 122.458-101.823 124.946 -21.507 94.123 40.871 140.170 -59.972 94.075 45.986 130.795 -77.511 96.779 43.535 142.503-116.427 92.561 43.075 51.200 -73.969 90.915 45.343 125.157 -18.435 91.020 43.853 126.931-106.166 91.174 52.682 127.759-117.384 89.447 110.569 91.676-101.223 92.602 -24.483 129.855-117.025 111.743 -70.995 115.093-122.191 94.593-128.416 103.817 -82.195 122.002-127.221 159.057-169.289 107.122-111.981 138.001-149.277 93.690 44.833 149.198 149.236 92.337 45.457 133.171 -85.061 90.733 49.747 125.758 -22.711 89.648 50.399 128.073 -37.694 89.009 44.228 109.651 -82.352 91.437 45.371 0.000 0.000 90.680 43.539 133.301 -46.550 89.770 52.239 145.546 -90.350 89.593 50.487 122.400-137.761 87.487 46.612 111.609 -72.957 91.718 48.348 137.402 -98.333 91.018 51.536 131.671-155.921 92.720 -92.521 105.168 -84.853 121.713 170.469 163.798-156.179 93.982 -65.187 96.356-105.995 90.065 -58.264 111.186 -75.619 91.947 -56.595 114.869 14.990 93.486 107.052 109.224 -73.851 92.965 49.904 128.918 -76.011 90.941 47.811 106.935 -80.555 91.752 41.646 132.169 -78.764 91.799 48.414 132.924 -92.589 93.231 77.204 128.318 -77.203 93.069-173.293 115.501-123.254 92.326 56.578 130.165 -76.526 91.700 43.349 140.426-103.452 90.238 48.028 132.286 -22.969 91.149 54.008 132.809-125.329 89.174 42.889 129.895-155.221 94.711 99.153 101.738 -78.997 92.458 0.000 129.026 -76.271 # 423 total E -1.48461E+02 rmsd from N 0.000 %NC 0.00 93.173 -70.259 127.240 -77.002 93.540 -50.554 109.010 -73.707 92.351 -39.283 104.364 -73.127 93.926 -42.870 127.673 -74.977 100.347 -14.282 147.420-117.680 109.612 -36.737 57.196 -79.010 96.822 -20.950 118.463 -55.068 109.819 -34.168 166.632-173.368 99.667 -63.032 136.673-150.923 91.474-145.848 74.938 -92.439 96.261 69.318 152.358 169.657 99.924 27.734 91.624-118.818 96.017 47.104 113.791 -78.645 91.419 60.048 148.461 -33.731 90.430 43.037 103.752 -89.691 93.590 40.971 138.797 -98.815 101.013 -11.242 127.271 -77.095 132.326 161.773 126.219 -47.771 109.584 35.563 150.876 138.127 96.536 44.871 109.560 -81.801 109.841 19.163 0.000 0.000 97.316 44.474 149.720 -2.987 94.092 45.322 171.228 176.630 89.874 49.037 111.958-145.440 90.306 45.215 108.427 -75.494 91.931 46.228 148.107 -38.308 93.146 50.229 139.864-143.199 93.810 -97.782 148.770 -28.508 110.439 171.158 151.401 -20.344 100.313 -34.981 93.998-103.612 103.793 175.975 114.346 -77.861 91.924 55.097 123.343 126.992 94.134 85.051 111.988 -74.898 89.462 -80.737 126.957 -74.481 92.698 -42.712 103.351 -79.496 91.789 -43.673 130.103 -75.746 92.134 -42.400 137.043-104.101 91.599 -46.117 127.774 -76.260 87.702 -50.503 111.463 -50.985 90.048 -51.401 127.133 -75.874 88.902 -42.458 137.317-152.234 89.316 -50.967 129.343 -27.850 89.719 -52.869 151.427 -19.062 90.703 -45.698 143.064-144.875 95.366 96.952 104.963 -79.685 92.507 0.000 128.949 -76.385 # 424 total E -1.46485E+02 rmsd from N 0.000 %NC 0.00 93.049 160.398 138.102 -88.864 93.356 56.132 137.271 54.866 92.671 44.070 104.984 -80.316 92.144 45.988 130.934 -77.456 94.161 46.169 155.960-148.986 92.961 39.134 56.730 -72.358 93.005 45.094 129.418 -28.918 92.693 41.486 132.960-106.963 90.071 53.247 143.231 171.179 88.041 52.323 76.870-104.364 91.197 164.700 135.604 -82.983 91.087 69.298 106.772-140.740 95.662 34.912 98.344 -81.387 92.660 49.953 146.342 -33.977 92.247 44.523 136.302-131.158 92.214 50.522 121.284-136.752 92.986 27.172 127.552 -88.746 102.507 154.523 146.245-111.372 104.278 33.631 143.287 131.455 95.520 42.208 141.901-125.906 101.622 29.726 0.000 0.000 102.636 30.545 155.448 -1.090 97.568 39.721 171.188-168.842 92.200 47.845 116.617-148.914 89.313 50.482 105.852 -73.848 91.460 44.734 140.899 -44.838 93.848 42.049 135.175-129.413 96.663 37.436 151.149 -23.094 98.371 104.599 154.824 -4.736 90.850 62.989 99.636-129.617 91.870 44.193 113.119 -78.346 98.419-141.772 150.772-135.186 95.385 101.860 114.511 -75.320 93.600 47.303 128.415 -75.708 90.064 53.826 112.139 -71.178 89.561 44.426 140.173 -99.714 90.709 45.234 130.071-105.036 90.562 44.194 127.551 -76.119 89.725 49.712 104.691 -62.823 90.730 45.018 129.162 -77.077 92.087 40.143 136.695-123.275 90.704 51.728 135.059 -47.175 89.972 61.180 128.770-134.995 87.112 40.359 127.775-150.408 95.236 79.012 101.710 -79.249 92.493 0.000 128.963 -76.522 # 425 total E -1.48794E+02 rmsd from N 0.000 %NC 0.00 93.364 178.845 141.003-105.592 92.939 54.766 146.902 25.532 93.277 41.675 106.212 -82.526 91.991 49.769 130.866 -76.550 93.640 39.693 136.705-114.556 93.312 42.839 59.724 -76.015 91.622 42.551 118.486 -37.850 89.863 49.346 138.881 -91.646 87.905 47.382 123.835-121.202 89.404 44.991 86.639-101.024 92.072 56.917 135.924 -90.133 99.548 -67.011 98.716 -99.999 117.116 178.120 106.324 -84.804 144.473-178.023 168.353-169.578 105.402-112.001 143.280-159.252 93.580 47.629 140.447 138.108 91.378 47.550 134.275 -86.207 90.484 49.107 121.112 -66.003 91.095 48.281 122.997 -29.009 91.106 42.946 108.150 -82.421 90.772 46.111 0.000 0.000 90.647 51.692 107.607 -85.153 87.864 46.236 148.822 -76.710 90.005 43.386 119.303-131.398 89.565 49.295 109.051 -76.302 89.239 50.169 141.036 -91.410 90.150 48.344 136.180-160.329 90.073 44.398 141.264-127.489 93.404 135.644 111.218 -84.243 96.395 88.000 135.006-160.855 99.794 62.240 115.345 -78.373 92.268 -76.063 109.933 -49.562 89.635 -43.858 110.141 -70.887 91.319 -49.360 126.855 -73.782 91.926 -33.369 108.988 -89.503 92.197 -49.416 97.135 -69.087 86.710 -56.590 149.803 -17.876 90.266 -44.015 130.513 -77.014 97.036 138.654 105.900-118.961 92.803 42.954 130.432 -75.286 92.163 45.454 140.247-127.218 92.467 56.861 131.293 -83.423 92.959-150.586 133.289 -92.727 94.809 56.267 108.052 -85.310 110.698 71.729 101.256 -76.221 92.570 0.000 129.302 -76.617 # 426 total E -1.48042E+02 rmsd from N 0.000 %NC 0.00 93.417 176.484 139.279 -99.402 93.158 54.599 141.923 5.656 93.049 44.377 105.163 -81.810 92.494 45.877 130.698 -76.627 94.968 42.842 130.268-101.969 92.132 40.902 57.240 -73.336 91.669 45.900 132.098 -38.218 90.173 44.357 133.075 -99.029 92.240 46.687 118.013-105.552 93.911 93.119 96.061 -95.151 104.946-139.512 145.991-112.441 91.461 63.266 95.146-115.844 89.820 59.263 107.608 -84.418 90.518 52.291 137.084 -29.282 90.753 39.016 137.511-119.952 95.019 44.422 132.098-105.737 99.002 -66.550 118.172 -66.341 131.039-163.189 92.176 -32.668 104.088 34.532 148.985 -41.542 96.424 44.436 141.843-169.614 96.831 35.984 0.000 0.000 92.894 46.550 143.783 -13.212 90.222 48.923 135.992-106.770 89.793 50.449 118.585-130.141 87.244 53.247 108.916 -70.674 89.991 44.697 132.446 -68.919 93.222 42.904 134.861-114.308 93.697 40.747 150.288 -25.394 94.527 63.515 153.384 -12.089 91.227 54.317 100.238-130.068 90.624 36.750 113.045 -78.316 99.143-118.857 138.920-118.239 120.897 160.678 119.493 -76.910 93.228 -75.085 127.222 -74.974 89.967 -44.900 102.554 -79.065 89.811 -51.406 136.120 -45.846 89.343 -46.211 136.870 -66.242 90.754 -45.521 128.027 -75.943 88.724 -46.311 161.608 17.188 90.175 -54.741 131.295 -77.535 90.881 -51.274 148.104-113.636 90.267 116.912 135.658 -75.978 93.104 71.570 154.409-132.658 89.905 42.405 124.704-179.005 94.552 93.199 103.533 -78.890 92.534 0.000 128.769 -76.603 # 427 total E -1.49245E+02 rmsd from N 0.000 %NC 0.00 92.614 82.486 134.669 -83.931 94.594 50.670 152.987 142.819 92.637 45.724 145.667 -22.488 90.578 49.605 129.976 -75.968 90.540 46.627 149.511-140.158 91.655 39.872 133.499-168.240 92.490 47.104 118.222 -20.032 89.483 47.014 137.056 -92.081 93.378 59.331 131.497-117.781 89.175 106.867 122.676-150.528 107.005 -30.385 110.946-130.183 97.582 -67.473 91.429 -91.953 89.990-116.160 147.804 -34.333 95.771 -42.589 154.171 -38.082 95.976-117.380 146.681-155.039 94.676 40.393 130.300 -89.944 93.937 49.814 136.112 -66.639 92.121 42.980 133.820 -71.434 93.358 49.020 138.376 -36.118 91.971 39.972 107.435 -82.942 92.368 44.170 0.000 0.000 92.367 47.793 107.504 -87.219 88.881 47.015 150.013 -80.895 89.801 43.593 117.173-131.650 89.401 50.540 111.758 -74.964 91.772 40.335 141.166-102.203 94.799 46.069 131.736-151.700 97.010 2.459 144.511-133.607 120.082 179.377 111.459 -82.000 113.125 51.948 134.249-151.426 98.942 31.800 115.295 -78.079 96.929 39.446 128.477 -50.231 93.718 47.760 112.083 -70.017 91.844 44.232 129.036 -77.176 90.437 43.298 109.135 -88.798 91.131 45.239 122.939 -91.998 90.492 56.362 138.313-101.418 88.840 41.537 129.123 -77.605 92.185 106.843 97.890 -98.483 90.886 -63.402 128.974 -77.301 93.042 -45.641 143.012-118.435 90.555 -45.907 118.744 -3.324 93.596 -49.615 151.490 -38.060 91.363 -46.979 133.115-118.551 95.318 92.576 101.864 -78.196 92.420 0.000 129.148 -76.357 # 428 total E -1.50422E+02 rmsd from N 0.000 %NC 0.00 93.318-158.314 132.821 -77.887 94.148 61.351 150.934 -1.190 96.278 37.223 106.407 -81.676 92.714 49.727 131.770 -76.416 93.306 37.254 127.844-105.228 95.211 41.394 60.033 -74.007 93.810 39.327 120.889 -37.159 92.125 47.063 149.531 -93.730 88.696 42.248 133.950-133.115 92.475 46.390 75.277 -98.013 90.738 48.425 137.402 -70.762 106.185-147.418 92.674 -93.428 97.910-123.279 104.366 -82.650 147.378-171.252 176.453-177.879 101.731-106.714 138.389-146.230 92.144 55.778 144.214 137.618 92.215 46.924 135.265 -85.211 91.006 48.343 138.192 -57.204 90.749 44.705 128.558 -30.788 92.341 47.043 146.671-158.482 93.046 40.103 0.000 0.000 91.228 48.877 117.922 -82.752 89.392 49.745 144.541 -91.215 89.768 43.759 119.576-132.893 88.521 49.920 112.683 -75.141 91.312 46.938 142.143-105.900 92.550 57.896 130.999-157.157 93.899 -12.999 142.285-130.404 117.893-165.084 114.603 -82.858 121.091 38.902 131.173-143.403 96.007 37.648 114.884 -78.175 93.090 46.976 132.401 -58.340 92.627 47.687 110.249 -70.627 91.578 41.952 129.882 -76.153 91.079 40.990 106.439 -87.600 92.549 44.068 120.008 -81.946 91.427 49.046 135.390 -83.015 90.171 39.956 131.331 -78.877 92.796 118.386 97.931 -99.344 92.576 -48.265 129.914 -78.410 91.917 -46.469 143.291 -80.722 90.599 -63.968 124.882 2.151 94.535 106.847 163.149 -24.013 99.821 42.622 139.304-170.974 98.029 48.274 105.952 -77.220 92.463 0.000 129.372 -76.336 # 429 total E -1.50332E+02 rmsd from N 0.000 %NC 0.00 92.789 -6.921 136.902-111.714 96.333 -47.587 121.027 -78.667 91.997 -44.858 102.589 -78.125 89.866 -48.829 128.925 -75.715 92.099 -42.797 142.823-157.528 91.614 -43.063 59.314 -83.733 90.435 -78.372 114.632 -43.766 88.217 71.270 142.513-110.737 106.629 60.919 148.667 167.957 92.617 13.744 147.936 -13.824 110.814 51.601 158.267-119.601 100.171 19.663 100.221-115.464 97.359 61.181 150.213-161.820 91.130 32.267 100.901-123.276 110.510-175.550 101.570 -88.131 93.237 41.395 139.068-116.420 90.278 55.388 137.009 -77.902 88.708 60.666 155.969 -83.519 89.860 44.710 143.273 -16.660 91.001 40.629 141.302-170.915 90.725 49.085 0.000 0.000 89.557 48.780 108.143 -83.915 90.466 43.715 144.335 -77.919 92.207 39.874 119.765-125.297 90.470 50.613 110.964 -77.205 89.735 59.126 133.809 -93.754 90.113 40.321 139.765-139.050 93.377 40.846 143.490-130.885 99.755 -4.999 114.552 -90.231 136.982-159.233 104.097 -89.091 92.043 57.946 114.474 -76.274 92.079 50.742 103.906 -19.273 91.164 44.263 132.485 0.892 90.795 48.015 129.831 -76.265 88.152 46.186 102.499 -84.998 91.098 45.386 126.248 -34.046 93.064 39.273 134.145 -59.915 94.211 37.142 129.423 -77.232 97.770 117.218 102.621 -75.837 89.434 -59.821 130.380 -78.213 91.680 -43.080 147.416-142.022 90.190 -44.260 124.793 -12.937 91.515 -55.089 153.564 -28.674 90.961 -45.071 139.202-179.838 95.823 85.771 103.484 -79.969 92.500 0.000 128.998 -76.468 # 430 total E -1.47084E+02 rmsd from N 0.000 %NC 0.00 93.151 164.626 139.779 -96.480 93.398 56.000 136.924 44.535 92.126 44.030 106.791 -82.456 91.527 49.862 130.981 -76.874 92.390 42.999 151.611-147.285 91.349 43.893 60.399 -69.987 89.730 47.794 126.551 -37.115 88.916 50.585 140.066-108.906 88.432 46.128 133.061-134.213 87.608-128.584 83.710 -96.086 111.573 124.997 136.025 141.870 102.789 24.386 116.787-133.888 115.382 120.284 102.420 -76.992 107.670 -46.450 154.481 -39.990 95.721-117.680 147.767-138.745 93.616 43.956 148.343 148.846 92.957 46.094 135.521 -85.490 90.771 48.234 144.683 -61.995 89.954 52.617 139.514 -53.679 88.141 44.122 142.482-145.476 92.272 41.860 0.000 0.000 90.586 47.589 137.207-102.269 90.875 44.828 129.051-105.710 90.006 44.087 119.189-124.877 89.813 47.968 112.643 -79.704 90.822 48.345 132.075 -99.927 92.353 47.550 131.884-143.781 94.213-100.362 141.977-121.839 112.377-176.760 151.201 -17.486 133.986-162.368 110.275-104.487 96.772 44.257 115.071 -77.348 93.304 44.208 104.393 -21.541 91.228 49.042 131.565 -15.597 89.959 47.581 128.965 -76.918 89.245 47.771 101.660 -83.091 90.155 44.007 133.224 -53.047 91.243 55.602 134.042 -77.348 90.934 60.348 128.983 -77.292 90.461-172.636 66.500 -84.577 92.962 59.277 131.418 -77.614 90.514 46.511 142.689-164.916 88.421 62.016 141.304 -60.414 90.028 63.417 142.892 -40.906 86.682 38.124 145.835-163.574 95.741 87.090 101.371 -79.093 92.479 0.000 128.955 -76.549 # 431 total E -1.46397E+02 rmsd from N 0.000 %NC 0.00 92.810 145.263 137.400 -84.076 93.489 50.193 118.387 -29.427 93.472 45.800 106.248 -81.072 92.657 44.605 127.726 -74.806 91.009 46.507 105.868 -72.455 90.290 44.553 87.206 -62.459 88.698 45.557 115.748 -64.012 88.460 49.911 116.701 -94.312 90.917 128.076 121.017 -88.298 83.975-139.681 120.999-153.226 96.409 41.744 137.471-157.598 96.392 44.247 91.972-117.224 92.082 49.230 111.521 -86.904 91.392 50.995 135.876-104.836 89.489 42.805 125.416-129.400 93.279 51.250 128.780-112.336 96.356-110.090 121.278 -73.643 102.001 134.274 142.615-108.004 94.307 145.414 156.412-152.370 94.487 67.299 144.473-155.075 93.176 41.056 0.000 0.000 90.414 51.931 125.712 -72.879 88.907 46.215 141.714 -89.644 88.841 46.706 119.646-129.052 88.406 49.496 108.704 -77.198 90.114 49.511 139.522 -92.016 90.909 42.082 131.510-151.897 94.356 -94.936 142.496-123.270 124.300-173.832 154.662 -9.372 117.700-121.849 114.575-118.761 113.462 19.033 117.363 -79.622 93.847 52.784 114.421 -10.175 94.144 39.046 132.059 -11.522 90.483 53.882 130.667 -76.930 87.724 45.675 102.678 -84.632 90.495 43.464 122.569 -36.643 93.136 39.991 138.799 -56.199 93.007 44.984 128.515 -76.722 91.048 58.822 106.571 -74.485 91.727-122.827 129.244 -77.443 95.812 -23.346 140.259-110.965 99.259 -83.231 121.557 22.045 117.150 99.853 158.738 -18.539 97.444 48.342 141.148-161.298 99.072 38.149 100.354 -79.477 92.441 0.000 129.421 -76.265 # 432 total E -1.48083E+02 rmsd from N 0.000 %NC 0.00 93.279 171.477 138.557 -93.863 93.229 57.203 144.340 21.594 93.217 44.221 106.531 -82.456 92.189 46.528 131.652 -77.333 94.465 45.488 140.546-111.886 91.141 41.386 58.927 -75.571 91.253 45.898 123.959 -38.080 92.072 42.480 129.917-103.058 89.877 48.222 140.443-138.858 89.844 48.761 77.251-101.625 92.226 151.617 134.922 -77.311 93.411 90.584 127.004-151.234 94.934 103.166 100.045 -83.799 93.323 -70.890 141.743-102.517 98.940-118.950 151.303 -37.783 90.738 51.591 138.955 123.082 91.745 46.476 136.685 -83.235 90.491 46.988 133.395 -36.860 90.617 48.318 136.899 -22.422 88.984 48.237 110.714 -82.527 89.232 46.395 0.000 0.000 88.867 54.259 117.616 -75.851 87.510 43.442 139.592 -89.354 89.683 48.053 120.053-128.536 87.347 57.076 110.556 -76.440 89.031 48.169 139.673-101.895 91.316 41.909 131.764-140.626 97.473 -60.058 156.311 -26.430 134.910 98.963 122.368 -79.204 129.544 166.212 112.661-107.835 91.979 64.007 133.294 135.529 90.568 49.508 119.934 -53.800 90.277 46.119 122.473 -25.498 92.870 42.372 129.168 -75.179 95.115 30.862 105.564 -87.283 107.073 23.743 112.020 -68.773 94.847 51.280 143.424 -37.038 92.207 71.729 128.623 -76.946 85.018 175.083 100.986-120.599 93.017 49.063 131.178 -78.686 91.964 49.335 139.638-110.196 91.754 48.626 127.111 -30.690 94.012-146.133 132.333 -95.933 93.828 42.910 138.800-143.947 117.274 126.687 100.483 -77.085 92.615 0.000 129.643 -76.432 # 433 total E -1.47572E+02 rmsd from N 0.000 %NC 0.00 93.151 165.490 139.501 -95.351 93.671 55.212 135.592 31.983 92.308 47.199 106.285 -77.350 91.924 42.977 130.784 -77.535 94.443 48.678 142.357-121.635 94.563 36.403 52.578 -68.924 92.587 47.983 160.359 12.093 92.020 41.834 132.797-101.987 91.479 48.528 142.228-134.447 89.067 51.002 79.257-105.980 91.426 150.227 132.528 -84.679 93.495 88.461 126.208-150.363 94.144 103.605 99.133 -85.871 93.112 -66.401 130.699 -93.804 98.492-122.138 150.874 -37.575 91.673 49.983 136.872 116.694 91.468 47.378 136.599 -84.014 90.783 47.164 131.746 -40.593 90.671 47.510 135.055 -18.507 89.244 48.050 111.150 -82.331 89.330 47.459 0.000 0.000 88.449 53.953 123.247 -75.632 88.688 43.018 135.206 -92.710 89.410 48.731 120.580-126.893 87.246 64.867 109.096 -80.085 88.158 58.293 143.133-105.876 88.088 37.805 126.015-155.843 97.687-101.795 105.066 -82.615 116.516 175.170 152.474 -15.716 103.982 -51.835 94.096 -94.688 93.328 -62.650 111.435 -74.623 92.185 -20.539 116.689 -31.980 106.653-139.103 121.372 -76.788 134.317 14.774 133.099 -95.364 90.927 50.218 96.152 -81.058 91.409 89.679 106.899 -53.472 91.978 39.391 138.951 -61.973 93.267 50.196 128.814 -76.610 96.328 60.483 115.767 -53.214 92.865 -97.534 130.960 -77.651 95.587 -33.158 140.760-116.937 90.492 -67.509 126.895 -3.084 89.879 -54.485 153.602 -26.825 90.993 -43.234 107.831 -84.570 96.811 100.043 105.874 -78.516 92.507 0.000 129.125 -76.220 # 434 total E -1.52678E+02 rmsd from N 0.000 %NC 0.00 93.193 -67.422 129.524 -84.560 94.451 -46.532 118.503 -81.827 90.359 -48.557 103.177 -77.297 89.836 -49.943 129.028 -76.146 91.602 -37.989 139.183-129.675 93.599 -45.037 64.436 -70.094 91.192 -32.243 121.315 -29.814 108.874 -32.993 167.443 140.076 93.891 -47.299 132.176-119.489 93.071 123.284 87.571 -88.166 111.799-169.119 138.089 -96.670 94.224 76.435 98.824-124.623 117.114 99.104 109.037 -85.775 109.879 -95.484 156.977-114.182 105.076-117.390 138.534-150.481 92.955 47.366 151.180-101.533 92.081 46.968 134.129 -77.448 91.103 47.344 129.531 -48.957 91.034 46.269 110.739 -67.971 89.814 47.608 110.063 -82.571 90.561 45.703 0.000 0.000 90.980 45.566 115.630 -77.399 93.688 35.806 136.989 -79.204 95.464 41.952 120.705-116.117 93.915 44.028 112.654 -78.971 91.449 50.719 151.710-116.932 93.020 38.593 116.766-155.458 95.229 41.824 144.031-132.732 100.947 2.770 143.038-110.510 132.378-114.452 119.247-118.687 145.627 59.790 126.884 -86.048 95.985-139.844 123.727 -24.327 98.420 41.840 111.905 -73.039 93.771 45.156 129.469 -76.534 91.832 44.168 150.184 -24.525 91.977 44.857 110.885-107.913 90.781 52.226 131.535-100.308 88.732 43.953 129.679 -78.504 93.255 110.432 86.198 -76.090 89.734 -58.769 129.978 -77.622 91.006 -48.814 143.974-126.402 87.834 -52.099 130.200 -11.758 90.599 -52.817 159.963-164.490 90.320 -41.759 124.398-135.689 95.666 103.550 102.998 -79.106 92.526 0.000 128.860 -76.435 # 435 total E -1.52741E+02 rmsd from N 0.000 %NC 0.00 93.102 157.454 140.444 -96.457 93.576 52.710 136.952 43.225 91.627 46.664 106.466 -82.200 91.673 45.867 130.147 -77.295 94.393 48.603 151.092-132.036 91.728 40.385 58.334 -73.574 92.103 44.838 130.508 -31.319 93.467 42.846 123.649-110.470 88.352 49.196 144.041-169.121 88.724 58.636 75.863-103.020 89.376 141.691 132.597 -77.259 94.335 77.422 128.642-152.001 92.425-169.608 99.838 -85.787 126.226-155.221 154.871-152.981 108.290-107.287 153.154 -29.795 92.785 47.413 145.069-113.241 92.371 46.779 137.066 -75.435 91.183 46.979 125.635 -48.135 91.214 44.859 106.011 -77.442 89.700 49.879 126.666 152.727 88.304 47.801 0.000 0.000 90.431 43.370 105.392 -82.534 91.619 45.317 176.415-164.318 91.821 43.413 108.756-136.687 90.421 45.104 111.653 -77.910 90.397 55.037 151.366-116.710 90.826 45.910 146.851-117.265 91.820 38.785 142.593-128.663 99.906 -1.067 115.093 -90.507 139.004-158.677 103.539 -87.950 95.394 46.934 114.996 -77.010 91.718 52.956 100.163 -8.628 89.601 52.004 109.933 9.239 90.218 47.697 130.648 -76.613 89.859 41.548 104.710 -84.998 92.622 41.728 118.574 -17.274 91.518 51.207 142.816 -23.257 89.680 39.208 130.428 -78.365 92.081 113.668 108.436-102.059 91.964 -38.707 130.559 -78.097 95.920 -49.990 141.345-123.165 96.656 -26.100 124.633 -14.688 96.513 -54.828 152.087 -25.818 91.659 -36.764 142.323-150.252 97.859 77.412 101.094 -81.711 92.509 0.000 129.000 -76.572 # 436 total E -1.47961E+02 rmsd from N 0.000 %NC 0.00 93.138 154.143 140.214 -93.900 93.077 51.098 126.046 -29.533 93.774 44.546 105.190 -80.593 92.484 44.755 127.861 -74.297 92.798 42.500 107.234 -80.469 91.425 44.590 82.972 -64.664 89.546 44.700 118.623 -51.228 89.429 48.206 128.583 -99.053 86.482 48.732 128.574-113.030 89.274 44.450 86.853 -99.717 92.172 59.478 134.398 -92.514 99.999 -48.175 99.436-100.060 113.808 152.573 111.284 -86.988 147.271-157.603 167.517-153.257 102.554-117.118 141.999-157.155 93.976 47.427 141.410 128.208 91.269 48.061 134.125 -86.457 90.378 49.602 121.947 -63.095 91.704 48.020 120.594 -24.032 90.869 42.691 108.520 -82.456 90.703 47.831 0.000 0.000 90.934 51.260 106.879 -81.789 88.964 42.395 144.081 -73.063 90.799 43.592 119.171-124.589 90.973 49.504 107.985 -76.517 91.009 42.567 131.452 -78.303 93.023 44.047 136.050-136.955 92.884 49.042 143.340-128.456 95.445-123.214 105.021 -81.441 111.852 112.987 120.923-133.165 98.504-126.724 111.776 -75.740 90.280 -54.380 118.808 -42.917 91.692 -44.946 110.674 -73.045 91.675 -43.873 127.404 -76.007 89.394 -47.586 102.363 -79.339 88.857 -55.094 142.066 -48.254 88.519 -45.292 159.591-154.585 90.460 -50.406 127.980 -76.200 91.853 -75.131 125.186 -18.863 87.839 95.755 156.712 -89.273 91.653 55.594 141.345 -99.627 90.146 58.320 116.118 -35.745 92.560-137.837 135.864 -51.470 98.604 36.969 107.467 -85.462 119.754 79.541 107.050 -75.743 92.514 0.000 129.767 -76.899 # 437 total E -1.48724E+02 rmsd from N 0.000 %NC 0.00 93.019 -60.959 122.899 -65.439 93.954 -51.169 115.071 -73.661 92.128 -44.056 104.180 -78.370 91.159 -44.472 129.144 -76.042 92.249 -42.388 132.394-112.891 90.877 -45.487 67.619 -54.921 89.450 -43.663 127.186 40.336 96.663 -43.770 133.377 -93.598 90.955 -57.087 131.490-110.245 91.580 116.801 93.632 -92.047 92.468 123.054 158.117-146.358 93.907 75.991 95.291-137.330 91.974 112.421 104.260 -87.556 114.846 -66.231 130.742-108.013 102.625-117.141 151.605 -36.448 93.088 48.946 144.437-109.620 92.794 47.039 136.582 -74.836 91.232 45.448 132.346 -55.018 91.966 48.301 133.055 -26.361 91.101 45.018 108.948 -82.675 90.530 45.109 0.000 0.000 90.200 52.465 110.950 -83.688 88.971 44.977 141.536 -76.739 91.136 42.337 120.709-125.312 90.123 49.926 109.959 -74.856 90.960 48.224 131.903 -89.285 92.262 42.752 132.934-141.982 93.978 31.396 115.720 -90.625 108.014 -7.323 116.454 -83.739 141.220 176.870 100.540 -80.870 94.935 105.235 119.342 -76.488 92.699 -53.986 118.618-110.771 92.560 -72.527 113.066 -69.263 96.893-171.719 126.023 -73.426 89.701 44.702 104.697 -81.892 94.146 41.324 105.313 -63.348 92.696 49.582 144.516 -25.497 89.128 46.060 129.280 -78.347 91.429 83.090 98.719 -98.388 88.100 -91.260 128.193 -76.384 91.543 -50.946 142.286-115.554 88.993 -49.739 133.077 81.295 91.166 -48.913 144.473 -34.509 92.219 -43.871 111.631 -80.852 97.592 107.177 105.385 -77.920 92.378 0.000 129.185 -75.837 # 438 total E -1.53371E+02 rmsd from N 0.000 %NC 0.00 93.369-165.901 134.093 -81.388 93.812 61.166 154.814 12.513 97.126 37.386 105.868 -81.123 93.201 45.789 131.953 -77.302 94.690 43.142 128.985-102.557 92.673 40.972 60.816 -76.856 92.254 42.944 124.230 -46.446 92.900 40.213 133.397 -98.118 92.373 47.544 133.314-114.855 89.277 45.173 86.687-100.688 92.964 165.690 127.009 -84.971 92.053 96.387 131.740-159.420 92.794 106.634 103.168 -83.543 91.556 -74.314 148.163-118.776 97.579-119.968 139.636-153.466 91.336 47.330 141.376 133.550 91.472 47.896 135.185 -85.310 90.532 47.116 124.419 -53.824 90.596 48.226 131.405 -30.118 89.811 45.736 144.012-160.844 90.104 45.232 0.000 0.000 89.961 50.830 110.359 -81.108 88.509 45.639 144.904 -84.558 89.803 44.711 119.243-130.074 88.386 53.077 108.185 -75.112 89.905 46.956 142.208 -91.267 92.624 47.082 131.254-135.179 95.858 10.792 144.060-132.787 114.244 171.829 110.525 -82.527 122.995 47.732 130.677-141.036 97.812 35.262 115.377 -78.441 93.928 46.064 117.128 -27.865 92.973 47.821 112.652 -71.636 91.385 44.172 130.568 -77.280 89.521 42.690 101.879 -83.940 90.434 51.907 112.648 -50.271 90.243 50.083 133.395 -50.439 91.091 34.393 130.140 -77.231 94.764 112.953 99.924 -94.112 93.175 -41.951 130.298 -78.511 95.513 -48.724 141.545-117.214 95.598 -18.723 123.731 -17.931 104.259 -57.807 152.308 -21.951 90.703 -39.663 146.227-140.890 97.142 66.283 98.277 -80.423 92.521 0.000 129.009 -76.702 # 439 total E -1.47467E+02 rmsd from N 0.000 %NC 0.00 93.211 167.808 140.554-100.620 93.966 53.230 135.309 34.280 91.895 47.746 106.592 -75.490 92.319 41.638 131.555 -77.907 95.682 45.086 140.594-119.827 94.459 38.606 48.233 -65.189 92.374 46.874 153.299 28.905 90.793 44.077 130.382-102.586 92.310 54.833 127.632-112.456 93.083 124.804 113.673-119.419 141.078 170.844 155.831-156.761 95.225 67.000 122.168-143.992 93.472 52.049 100.150 -78.964 102.736-116.707 140.555 -41.303 102.394-108.685 140.364-144.600 92.983 50.303 136.670 144.984 91.947 45.197 133.697 -85.763 89.371 54.472 133.180 26.812 89.062 51.906 124.691 -29.560 89.017 43.753 145.710-152.989 89.906 47.697 0.000 0.000 88.846 53.071 133.610 -34.928 88.543 50.317 140.821 -82.534 88.619 45.484 122.951-131.448 88.641 50.799 105.840 -76.228 89.939 53.787 137.987 -54.228 90.295 44.270 136.163-137.178 93.670-110.554 108.217 -85.543 110.281 124.948 150.775 -15.230 99.889 80.077 95.156-107.964 138.229-120.450 129.374 -81.717 95.863 -41.465 113.638 -61.035 92.475 -45.307 112.685 -70.034 96.761-125.122 127.329 -75.242 87.344 48.290 96.162 -83.901 91.597 50.391 112.989 -46.906 90.178 46.389 148.093 -27.101 89.893 41.692 128.329 -76.871 89.723 51.186 109.347 -64.758 90.623 45.552 128.153 -76.519 91.061 43.735 141.825 -89.841 91.158 45.932 130.332 -44.012 91.028 51.783 133.948-109.446 90.565 43.411 131.851-142.162 95.665 70.321 104.351 -80.318 92.584 0.000 129.153 -76.614 # 440 total E -1.47599E+02 rmsd from N 0.000 %NC 0.00 93.044 -66.932 122.265 -63.305 94.091 -51.835 115.400 -73.833 91.856 -44.913 104.089 -78.055 91.141 -44.472 129.315 -76.644 89.662 -50.955 131.481-113.789 88.341 -49.923 66.308 -54.423 92.375 -37.760 127.087 44.664 95.716 -42.895 143.256 -74.729 94.875 -39.580 140.760-115.852 107.533-127.876 80.862 -77.525 124.894 173.503 154.629-116.443 101.792 -27.076 93.530-110.477 119.453 151.342 106.206 -84.320 108.904-101.809 155.039-146.716 101.804-120.880 152.706 -27.306 93.738 44.498 141.077 144.425 91.952 46.969 136.179 -84.423 90.568 47.470 118.597 -60.419 91.392 51.978 127.167 -34.412 90.604 42.210 108.090 -82.560 89.698 47.310 0.000 0.000 90.129 55.096 102.939 -83.474 87.750 47.383 148.188 -75.716 90.285 41.398 118.669-129.998 89.665 52.048 110.290 -75.998 88.952 55.354 144.608-102.000 89.937 44.485 133.613-143.694 89.863 42.098 112.273 -89.986 93.211 62.286 138.437 -96.423 91.593 53.166 101.459-121.242 90.659 40.696 113.166 -78.384 98.762-136.559 134.229-110.606 132.453 164.455 123.460 -78.696 92.839 -62.826 126.947 -75.100 89.155 -44.805 102.535 -78.456 89.933 -50.462 133.662 -36.900 89.627 -47.564 137.003 -58.641 91.244 -43.434 128.289 -75.670 90.240 -46.142 106.782 -61.844 90.383 -51.606 129.713 -77.332 90.453 -42.436 147.566-116.085 89.688 -46.265 126.615 -24.717 90.340 -59.839 149.157 -27.343 90.483 -52.549 134.745-177.774 93.640 78.116 101.290 -80.274 92.530 0.000 128.916 -76.689 # 441 total E -1.48655E+02 rmsd from N 0.000 %NC 0.00 92.891 147.011 137.906 -85.946 93.615 54.745 134.574 40.413 91.074 48.597 106.749 -82.642 92.193 47.419 129.481 -76.681 94.603 41.600 156.584-143.144 93.774 43.294 56.008 -72.426 90.920 45.510 124.860 -34.092 89.435 49.969 131.151-102.569 88.613 47.940 125.736-112.602 88.804 42.781 88.166-101.006 93.160 57.912 132.142 -88.126 98.621 -72.700 100.781 -94.955 118.617 159.726 104.145 -87.369 144.154-143.936 174.385-167.582 99.961-120.860 138.639-149.103 92.739 49.416 141.234 122.668 91.917 46.915 133.703 -85.632 91.306 45.740 124.825 -55.213 91.437 48.410 108.733 -17.160 90.198 45.510 107.136 -81.682 91.440 46.389 0.000 0.000 93.602 39.433 107.499 -81.793 94.141 41.755 175.766-162.111 93.725 40.489 106.552-136.583 92.365 47.048 113.056 -78.946 91.406 43.823 139.129-102.306 93.918 59.318 143.289-168.722 92.940 8.704 141.561-125.643 113.069 39.890 156.537 -16.527 132.143 179.157 114.012-111.931 98.333 53.373 116.205 -77.403 92.526 50.015 104.275 3.650 88.829 56.209 118.140 -73.188 90.661 49.668 129.799 -76.648 89.662 79.242 139.422-154.551 87.180 -80.015 93.612 -69.260 91.380 -51.828 142.330 -45.960 91.353 -43.175 131.620 -76.292 96.347-148.157 101.008-108.370 91.722 49.929 130.708 -76.845 90.984 49.602 140.355-107.984 91.694 65.118 125.280 -1.591 89.582-104.498 146.715-101.268 99.591 -20.613 109.221 -87.821 115.562 125.668 106.224 -76.252 92.629 0.000 129.456 -76.613 # 442 total E -1.51669E+02 rmsd from N 0.000 %NC 0.00 93.203 164.187 140.454 -98.693 93.623 53.688 135.031 38.616 91.453 46.362 106.037 -81.221 91.673 47.340 130.692 -77.583 93.061 46.566 149.293-134.388 91.627 42.751 57.162 -70.289 90.671 46.747 129.095 -29.676 90.763 47.340 127.894-110.711 87.149 49.198 138.997-162.428 88.684 55.389 76.481-103.956 88.077 149.770 136.088 -82.188 94.390 65.802 128.471-153.301 92.140 37.787 97.557 -81.497 93.215 51.600 147.866 -33.441 90.673 41.060 139.692-118.731 92.577 51.891 122.599-127.064 92.329 42.617 132.164 -76.460 93.080-119.046 133.087 -80.810 95.953 -44.257 139.541-115.981 95.971 137.833 144.073-150.558 98.046 41.253 0.000 0.000 91.488 48.763 138.329 -97.085 90.720 43.090 135.461-108.619 90.553 45.336 116.187-124.213 89.832 47.253 113.209 -78.620 90.740 47.934 136.583-104.828 92.971 53.174 130.195-132.124 94.665 -97.326 103.547 -83.316 103.238-168.727 150.455 -19.333 132.876 -54.240 113.989-111.627 94.441 -50.275 111.041 -79.737 97.998-120.542 131.013 -72.588 88.103 70.080 117.469 -72.335 91.045 51.663 129.301 -76.175 88.401 44.831 109.771 -84.928 89.320 48.828 135.373 -98.190 88.570 55.268 142.871-139.794 87.534 47.198 127.909 -76.469 88.702 47.517 100.143 -61.861 91.047 44.510 127.564 -74.887 91.693 44.315 135.331-149.036 90.607 47.571 130.578 -48.874 90.327 52.171 132.839-110.911 90.487 43.320 132.481-138.298 95.558 71.490 104.003 -80.548 92.521 0.000 129.012 -76.671 # 443 total E -1.48509E+02 rmsd from N 0.000 %NC 0.00 93.090 -63.387 127.218 -77.674 93.832 -49.775 116.636 -77.576 91.066 -46.449 103.480 -78.082 90.644 -46.611 128.594 -75.750 91.859 -39.714 139.623-128.066 93.672 -43.264 60.936 -66.868 91.987 -38.565 131.492 41.668 102.934 -36.764 169.857 159.907 94.907 -40.039 135.696-121.018 109.416-117.466 67.165 -83.727 101.676 51.707 153.877-145.852 93.249 45.390 99.018-121.273 89.752 52.929 145.198-157.969 91.150 47.297 137.749 -44.636 92.123 47.661 136.557-121.813 95.967 11.235 126.035-132.442 120.246 173.096 155.321-160.284 113.082 40.484 157.117 -54.466 94.327 50.619 139.963 93.992 93.700 42.649 110.444 -80.828 90.666 48.318 0.000 0.000 88.500 60.781 144.042-157.924 88.795 45.648 106.757-110.304 91.329 39.721 99.964 -71.726 91.647 46.989 118.141 -81.189 91.263 52.990 132.117-109.024 91.730 50.122 129.492-140.854 93.339-113.257 144.822 -38.357 92.412 177.911 146.345-116.851 106.313 -41.990 90.742-118.021 107.517 -45.600 115.582 -81.924 113.148-121.942 136.298 -19.646 92.155 52.853 111.266 -72.553 91.341 49.086 128.928 -75.802 89.843 42.931 106.115 -82.491 91.381 45.423 135.876 -88.292 90.222 47.352 139.891-117.115 90.298 45.136 127.869 -76.684 89.376 49.095 111.651 -96.057 90.266 48.171 128.636 -75.706 90.263 42.922 136.751-122.935 91.299 46.126 127.149 -41.731 90.918 51.500 135.862 -93.427 90.531 44.218 135.412-150.058 95.153 75.346 103.987 -80.459 92.518 0.000 128.971 -76.658 # 444 total E -1.50075E+02 rmsd from N 0.000 %NC 0.00 92.898 145.779 137.749 -86.184 95.655 48.453 111.574 62.160 89.257 51.746 108.742 -68.255 91.206 41.878 130.846 -78.728 93.354 91.369 145.349 141.970 81.713 -70.851 58.129 -77.011 96.929 -48.248 117.407 57.446 97.092 -39.077 143.305 -93.287 92.938 -60.138 135.840-122.587 89.842 105.432 87.737 -93.210 106.710 155.418 147.182 -95.836 94.988 78.580 125.989-150.643 94.040 123.768 97.308 -84.406 94.906 -60.487 135.106 -89.202 96.657-120.524 135.565-143.051 91.030 49.319 142.997 151.046 92.147 48.070 135.021 -85.304 90.578 47.281 139.295 -48.797 89.752 49.403 122.732 -39.861 88.607 49.519 145.884-146.616 90.570 44.514 0.000 0.000 90.224 45.988 130.343 -97.112 90.157 46.778 132.633-109.989 89.575 49.948 118.545-131.063 87.669 51.425 111.595 -77.477 90.060 48.579 134.688 -98.948 91.958 48.457 133.956-137.266 94.114 -92.734 141.901-122.458 118.557 167.308 151.208 -16.596 134.145-171.236 109.843-102.962 95.891 47.220 115.155 -77.216 93.209 44.373 109.257 -33.819 91.331 49.616 131.464 -24.596 91.177 42.303 129.039 -77.581 92.194 50.704 101.194 -83.446 90.323 51.389 128.048 -60.257 92.578 58.312 121.309 -77.913 92.416 69.218 129.960 -77.388 96.999-167.554 98.423-115.233 92.462 52.228 130.798 -76.588 91.132 46.654 141.342-111.690 88.609 61.005 142.933 -33.949 88.828 65.815 148.933 -97.907 86.486 37.217 132.614-173.625 95.409 87.538 102.219 -79.141 92.555 0.000 128.973 -76.635 # 445 total E -1.46661E+02 rmsd from N 0.000 %NC 0.00 93.110 -65.829 128.233 -80.413 94.276 -48.283 117.342 -79.772 91.284 -46.012 103.361 -78.175 90.399 -48.060 129.353 -76.047 91.887 -38.214 140.169-128.658 93.847 -45.228 63.066 -61.248 89.044 -36.215 129.747 47.791 104.957 -40.735 165.427-176.056 90.108 -51.722 127.482-123.938 91.485 106.002 86.386 -91.336 120.008 160.583 140.625 -81.135 95.099 70.200 127.726-152.287 101.321 132.484 99.675 -82.485 101.846 -52.161 148.598 -42.791 94.331-123.458 145.309-140.461 92.428 46.690 139.423 132.230 92.462 46.584 134.955 -85.392 90.873 46.417 143.276 -47.002 91.184 48.915 142.100 -34.511 89.528 45.478 143.893-154.362 90.124 44.642 0.000 0.000 90.291 54.609 119.315 -80.134 86.877 43.229 144.758 -92.740 89.758 48.770 117.039-129.413 87.274 59.368 110.451 -76.210 88.457 48.238 140.939-102.863 91.236 43.454 133.658-131.586 96.947 -64.372 143.797-126.211 133.847 101.667 153.292 -14.546 130.000 163.331 111.093-105.398 92.591 62.909 122.989 -76.863 90.793 47.712 120.609 -53.252 90.063 45.704 121.082 -25.078 93.131 42.239 128.359 -74.875 94.863 32.142 108.286 -92.257 106.116 24.379 110.737 -68.823 93.556 51.111 139.771 -36.317 92.359 74.503 127.458 -77.090 84.679 176.547 102.823-123.007 93.149 48.139 131.169 -78.659 92.182 48.971 139.632-113.655 91.827 47.981 127.548 -33.515 94.393-145.564 131.536 -96.958 93.868 45.031 138.813-144.986 118.286 110.935 100.934 -77.436 92.583 0.000 129.614 -76.516 # 446 total E -1.47378E+02 rmsd from N 0.000 %NC 0.00 93.061 160.276 139.389 -93.672 93.542 54.064 138.954 49.528 91.699 47.463 106.547 -77.441 92.055 44.049 131.583 -77.970 96.467 43.334 153.113-135.111 93.955 37.483 49.921 -74.195 92.242 48.025 161.234 125.038 92.496 42.627 139.508 -96.154 90.431 44.820 147.690-156.232 89.263 51.392 75.872-112.114 90.895 141.133 136.666 -94.841 90.018 86.900 103.330-136.119 91.742 103.018 99.548 -86.703 92.578 -64.121 133.527 -97.736 98.261-122.690 136.455-145.002 91.303 49.554 138.246 123.972 91.575 47.218 133.438 -85.930 90.617 47.437 130.271 -42.136 90.460 48.855 133.026 -22.993 88.560 48.646 110.821 -82.517 89.185 47.328 0.000 0.000 88.626 52.503 121.232 -80.679 88.544 42.710 133.476 -91.483 90.138 49.289 121.497-125.851 87.674 57.043 112.106 -75.166 89.034 50.546 130.071 -98.059 90.574 41.197 133.903-147.296 97.264 -88.486 105.838 -83.902 119.634-154.515 154.703 -18.837 134.715 155.594 112.534-104.943 99.881 38.636 118.772 -78.572 95.394 105.801 134.326-112.117 101.999 -20.624 116.369 -73.847 93.900 -63.089 129.855 -77.341 90.586 -32.737 99.737 -82.949 98.028-118.465 146.672 -8.116 90.637 60.809 139.505 -89.152 90.135 41.783 136.861-116.709 92.197 113.470 122.135-133.977 90.857 -52.671 130.819 -78.630 91.930 -48.605 145.637-107.951 90.337 -52.887 124.174 -2.890 93.514 109.805 156.441 -26.340 107.482 36.905 146.078-177.925 96.862 100.012 104.062 -71.580 120.904 0.000 145.937 -84.951 # 447 total E -1.47611E+02 rmsd from N 0.000 %NC 0.00 93.163 -64.154 129.768 -85.441 94.194 -47.576 116.537 -78.464 90.621 -47.635 103.097 -75.099 90.656 -46.416 129.129 -76.105 92.342 -39.872 142.207-135.633 94.243 -41.950 59.691 -66.308 91.796 -42.328 143.797-118.734 102.889 -35.748 171.596 161.382 91.486 -47.352 138.406-142.427 102.576-145.581 127.099 5.318 117.002 34.151 163.395-139.056 96.531 38.309 94.454-111.702 95.087 43.187 109.675 -84.843 93.308 46.148 120.897 -86.664 90.952 49.466 112.413 -91.349 90.918 38.688 129.481-111.227 97.055-132.660 115.495 -75.310 113.187-164.155 128.755 66.369 99.401 -50.237 119.551 -78.866 91.857 -55.812 148.163 -34.159 96.305-115.446 0.000 0.000 86.058 65.933 113.851 -79.562 89.133 50.670 140.116 -85.317 90.067 46.725 120.272-130.063 89.295 47.519 110.144 -74.838 90.877 58.821 129.371 -88.150 91.701 76.572 136.962-144.678 92.974 -51.756 103.778 -86.023 115.826 142.772 150.380 -17.620 107.415 -45.711 93.404-101.816 106.180 -41.053 115.414 -80.459 93.980-126.155 124.902 -29.056 95.562 52.065 137.524 33.913 91.877 51.646 129.705 -76.323 88.610 43.929 102.036 -75.934 90.992 54.887 147.757 -28.010 88.621 48.276 162.703-150.076 90.766 39.328 128.251 -76.578 89.244 61.031 112.916 -29.096 89.362 59.130 127.550 -76.032 87.998 42.463 136.811-149.318 92.145 56.322 130.151 -40.876 92.846-105.358 137.248 -52.556 116.541 33.558 106.005 -80.887 126.145 30.508 145.648 -24.148 92.399 0.000 128.183 -75.919 # 448 total E -1.47860E+02 rmsd from N 0.000 %NC 0.00 92.654 -14.786 134.999-107.092 95.322 -50.474 121.092 -77.498 92.152 -43.490 102.683 -78.381 90.279 -48.148 128.607 -75.188 90.262 -44.790 142.068-155.080 91.089 -42.514 58.980 -77.014 91.261 -80.626 118.957 -33.587 89.048 70.120 146.939-100.985 106.939 55.646 150.401-167.409 100.190 21.179 144.540 -14.310 97.730 55.697 150.835-110.289 98.922 36.249 98.131-109.677 96.195 102.668 144.467-152.600 119.794 -26.836 125.602-153.414 117.505-110.496 155.136 -25.682 92.471 52.829 139.662 -97.512 91.702 48.787 137.111 -70.580 90.346 47.903 130.479 -48.982 92.092 45.416 151.827-123.657 90.264 47.606 132.497 168.485 89.750 48.895 0.000 0.000 92.417 41.840 108.459 -80.807 92.590 42.701 150.770 -74.386 92.633 41.103 115.619-124.631 90.658 49.145 111.691 -77.900 91.236 47.883 132.498 -94.307 92.509 41.978 137.970-120.013 94.337 32.106 153.600 -21.075 106.762 -8.798 114.970 -88.765 139.522-161.424 103.158 -86.191 92.302 63.712 117.714 -76.001 92.761 123.179 115.547 -95.670 95.894 -35.332 109.167 -71.126 91.949 -52.713 128.572 -77.338 91.357 -39.411 100.060 -80.377 91.149 -46.264 144.716 -30.105 91.333 -45.373 135.595 -80.851 91.428 -52.663 128.802 -77.277 92.785-116.773 133.374 18.210 91.192 48.436 130.998 -77.135 92.588 54.824 141.779-114.782 92.432 68.698 128.988 -32.546 91.354-103.375 141.569 -37.794 96.855 -6.799 136.680-133.907 119.938 69.834 99.747 -76.116 92.364 0.000 129.940 -76.231 # 449 total E -1.47039E+02 rmsd from N 0.000 %NC 0.00 126.580-114.154 141.908 -24.936 118.526-105.359 129.625 -39.780 92.078 44.490 104.269 -78.065 93.689 48.718 128.427 -76.352 91.356 43.751 152.123-162.020 92.689 42.644 57.926 -67.311 91.591 44.878 124.590 -23.726 88.655 47.269 136.475-104.634 90.639 53.827 112.910-100.459 89.501 72.820 96.721 -92.708 91.379-162.873 133.975-100.611 93.537 66.914 98.653-127.523 93.045 39.988 100.118 -81.459 92.653 78.409 146.266 -28.257 93.627 55.049 133.587-142.282 112.395 -3.322 151.086-149.791 97.145 53.055 138.134 -93.920 92.114 51.200 149.245 149.901 90.878 49.099 158.253 169.636 91.986 35.637 107.761 -83.128 98.875 35.889 0.000 0.000 95.074 43.403 117.302 -81.069 92.586 45.111 138.432 -82.732 91.600 40.497 118.621-121.165 91.550 47.400 111.402 -76.783 93.155 39.940 132.794 -90.621 94.583 54.708 135.270-139.337 95.957 -8.183 107.419 -86.459 126.282 70.347 154.812 -14.281 133.935-140.716 114.934-110.357 126.621 37.380 120.181 -81.873 92.117 -62.071 111.245 -49.556 91.041 -42.955 114.037 -71.650 92.485 -46.851 125.240 -74.381 91.810 -33.774 99.255 -81.505 94.169 -41.944 131.358 -25.474 95.515 -37.604 160.646 -16.940 92.906 -50.655 129.543 -77.397 90.009 -57.706 122.435 -44.999 91.292 115.074 130.217 -76.584 94.220 39.850 140.032 -95.457 90.309 51.004 120.733 6.179 91.432 55.629 148.410 -39.027 89.199 38.206 139.782-140.887 94.665 75.261 104.671 -79.461 92.586 0.000 128.914 -77.011 # 450 total E -1.47098E+02 rmsd from N 0.000 %NC 0.00 93.075-173.699 125.394 -59.946 105.198 59.441 132.516 67.891 95.021 42.420 107.083 -76.244 93.106 40.935 131.549 -77.756 94.225 47.210 151.721-155.628 96.653 39.258 51.047 -64.692 90.860 46.024 131.202 -11.116 90.257 48.652 128.172-112.671 90.199 52.090 120.257-102.686 87.897 51.368 91.817 -96.119 91.690-174.044 124.753 -81.991 94.923 74.472 132.724-159.353 93.621 41.114 103.215 -80.939 91.627 51.490 147.440 -36.829 92.455 42.287 137.828-132.723 93.347 48.140 123.056-129.730 95.119 -0.038 125.192 -89.417 121.742 146.719 145.668-108.374 94.570 44.316 143.795 -5.438 92.386 48.159 155.481 -24.561 91.430 46.842 0.000 0.000 89.987 47.271 108.010 -82.045 90.686 48.228 139.038 -76.928 91.837 42.124 126.098-124.618 90.035 46.420 119.898 -76.945 91.800 47.471 132.887-110.722 92.484 53.682 139.301-151.813 90.959-115.680 139.840-117.139 111.000-173.855 151.577 -18.244 121.248 -59.755 110.630-111.239 98.357 -32.038 110.231 -78.632 92.251 -47.646 110.290 -48.477 89.193 -50.030 115.468 -75.132 90.446 -52.355 128.231 -75.930 86.806 -35.077 108.428 -81.402 98.394-119.381 143.969 -17.453 90.868 53.051 140.146 -75.584 89.964 46.192 129.533 -78.000 88.918 50.027 142.408 -98.606 91.162 44.021 126.951 -75.210 92.121 40.931 137.854-129.670 92.279 46.418 132.290 -57.152 91.463 48.734 128.566-112.929 91.657 43.851 108.746 -91.777 96.139 67.982 146.757 -24.614 92.449 0.000 129.081 -76.600 # 451 total E -1.47930E+02 rmsd from N 0.000 %NC 0.00 122.414 -90.553 151.208 -78.275 94.829 -47.297 116.872 -80.929 90.455 -47.675 103.285 -77.504 90.131 -48.992 128.326 -75.757 91.053 -39.769 137.572-123.353 94.141 -41.661 63.127 -66.863 92.846 -36.022 134.806 -4.621 104.559 -31.973 171.290 158.246 94.912 -51.628 126.477-112.205 96.644-162.544 81.815 -83.576 93.708 75.386 157.913-161.010 94.617 9.165 93.361-121.338 106.670-153.012 109.659 -83.180 125.707-110.100 152.377 -15.195 94.540 -24.902 139.372-128.396 109.907 -18.929 153.933-144.617 122.150-105.065 152.341 -22.418 93.644 44.113 131.060 -75.206 94.105 51.187 141.431 -2.875 94.823 37.024 102.064 -79.828 95.391 43.389 0.000 0.000 100.457 25.658 104.691 -87.120 97.727 40.344 170.341 165.232 95.555 35.291 90.811-125.802 92.020 51.837 115.960 -74.734 90.716 39.135 143.018-112.573 94.323 60.092 142.853-110.872 95.108 -64.042 149.492 -28.893 121.851 100.062 150.538 -18.176 96.135 -3.830 97.232-107.914 108.358 140.217 115.764 -76.900 92.981 59.441 122.835 162.586 95.598 72.320 112.496 -75.124 90.387 -84.939 127.248 -75.240 89.912 -43.083 101.683 -80.202 88.112 -59.721 116.797 -49.892 85.561 -52.334 142.483 -44.285 89.653 -47.641 127.486 -75.335 87.547 -48.850 120.813 -30.504 89.946 -50.315 129.679 -76.680 89.549 -43.577 146.712-136.602 88.781 -49.966 126.376 -16.418 90.334 -52.498 151.840 -22.053 90.871 -44.990 147.648-146.220 95.811 95.785 104.526 -79.946 92.500 0.000 128.966 -76.378 # 452 total E -1.53476E+02 rmsd from N 0.000 %NC 0.00 93.002 -60.950 123.809 -67.982 94.380 -49.083 114.524 -75.346 91.546 -45.130 103.998 -77.910 90.793 -45.690 129.619 -76.822 89.760 -49.242 129.392-112.261 88.459 -49.891 66.731 -53.417 90.161 -35.649 122.782 37.700 99.179 -43.124 135.696 -79.343 93.794 -44.973 135.834-104.538 93.372 103.394 118.713-124.675 124.746 145.379 146.814-169.724 91.032 74.982 97.248-148.914 92.014 113.985 98.090 -84.083 93.655 -59.255 126.249-100.218 94.633-122.512 135.119-144.292 91.032 48.976 139.995 140.066 92.660 47.810 133.552 -85.455 91.584 43.677 127.152 -41.521 91.365 48.490 110.261 -30.261 89.328 48.912 108.690 -82.055 90.826 44.623 0.000 0.000 91.531 44.888 118.222 -79.976 90.492 45.176 148.457 -86.048 89.913 46.928 117.164-129.205 88.197 51.836 112.431 -80.105 89.723 50.988 138.456-107.706 91.295 45.723 126.233-142.239 95.000-100.968 142.290-123.446 111.485-173.623 155.858-142.720 134.852 -52.658 109.352-101.983 104.493 -27.296 113.092 -78.587 94.172 -46.684 115.208 -57.810 94.158 -41.495 111.565 -71.545 92.996 -42.710 127.816 -76.357 92.689 -37.181 100.666 -80.910 91.916 -44.325 126.808 -31.039 91.293 -55.548 150.578 -30.328 89.385 -46.631 131.181 -77.819 95.789-142.252 98.238 -57.785 90.249 57.888 131.670 -76.558 90.618 47.281 141.422-112.050 89.303 48.926 125.606 -18.269 89.978 59.822 141.765-103.494 88.421 43.945 132.857-146.503 93.712 96.922 102.753 -79.604 92.527 0.000 128.820 -76.505 # 453 total E -1.52498E+02 rmsd from N 0.000 %NC 0.00 93.139 163.062 139.214 -93.760 93.167 55.906 142.766 33.815 92.297 45.298 106.203 -82.332 91.916 47.929 131.543 -77.668 94.253 44.769 148.874-122.773 90.994 42.722 59.639 -76.500 90.559 46.939 122.738 -43.421 91.597 44.566 127.125-105.665 88.973 47.586 142.259-151.684 88.479 53.690 79.755-103.694 90.861 116.948 129.439 -82.207 91.382 49.470 101.225-116.210 96.052 57.811 101.023 -81.494 94.901 0.862 143.571 -38.439 121.534 174.485 107.702 -83.241 97.892 35.542 144.166 124.091 94.812 43.192 135.818 -85.248 91.814 46.575 136.990 -61.679 92.008 49.098 129.158 -28.699 90.360 42.277 153.291 -15.793 89.993 46.775 0.000 0.000 89.820 52.496 109.168 -84.151 88.772 46.758 140.325 -74.886 89.349 43.044 122.218-124.731 89.806 50.280 112.305 -79.979 89.547 48.234 140.769-108.476 91.508 50.771 135.041-124.752 93.099-100.021 103.815 -84.018 110.388 173.727 155.800-139.675 134.350-169.568 108.422-100.366 94.291 48.381 114.851 -76.960 93.686 43.960 104.809 -11.957 93.359 43.223 129.602 -5.976 90.165 47.220 130.367 -77.731 88.403 52.349 102.877 -85.962 88.809 52.778 120.538 -31.157 92.291 30.057 132.608 -63.038 97.231 48.536 128.958 -76.377 97.646 73.804 108.488 -71.878 89.862 -90.965 129.146 -76.748 91.047 -43.106 142.361-109.049 90.727 -48.544 124.072 17.039 94.432 -41.053 176.412-157.514 97.689 -26.100 130.563-141.432 113.947 123.713 103.433 -78.273 92.632 0.000 129.413 -76.662 # 454 total E -1.49910E+02 rmsd from N 0.000 %NC 0.00 93.004 149.851 139.361 -90.968 93.391 53.970 140.984 50.400 91.207 48.516 106.834 -82.987 93.118 43.788 129.838 -77.235 95.885 42.148 151.563-126.079 93.183 42.818 55.094 -75.222 91.120 45.845 123.587 -32.250 91.092 45.094 125.519 -98.901 89.733 48.844 134.703-114.623 90.483 64.829 84.455-101.332 92.224-167.951 126.477 -83.954 95.633 71.384 127.250-150.562 93.524 41.281 103.720 -81.444 91.390 54.739 142.599 -28.412 90.828 42.268 126.248-114.901 93.418 50.321 120.961-145.260 94.077 32.752 129.594 -87.265 101.765 150.080 157.379-114.406 95.540 45.141 139.021 132.475 92.842 47.685 108.766 -82.423 93.156 43.074 0.000 0.000 91.870 47.671 154.299-150.173 90.695 42.099 116.950-129.301 91.632 42.979 115.045-126.224 91.295 49.511 112.492 -75.118 91.920 37.131 138.304 -95.993 96.080 48.831 134.707-149.619 97.802 -7.354 106.595 -85.822 122.420 148.817 149.355 -20.054 126.545 -81.623 119.179-121.809 101.265 -19.864 113.383 -78.840 94.230-120.177 124.478 -27.242 93.080 47.206 116.155 -77.092 94.112 55.268 129.659 -76.366 94.855 30.456 102.760 -76.680 91.899 56.928 153.847 -20.160 88.370 51.647 145.335-131.314 90.012 39.319 128.239 -76.793 90.347 48.771 116.113 -24.761 90.481 49.311 129.518 -76.988 89.841 48.849 138.152-126.921 90.928 68.640 130.851 -42.733 88.983-102.475 135.202 -61.262 97.337 -20.378 108.193 -84.561 109.069 -86.906 141.546 -21.815 92.835 0.000 129.443 -76.307 # 455 total E -1.51727E+02 rmsd from N 0.000 %NC 0.00 93.221 -74.845 127.417 -77.487 93.781 -48.721 118.204 -80.038 91.093 -46.492 102.434 -77.780 89.960 -50.681 129.439 -76.435 92.287 -34.846 138.564-125.263 93.275 -47.355 65.194 -68.293 91.330 -27.713 136.382-136.598 108.706 -38.656 168.338 122.594 93.843 -40.808 130.215-110.576 94.753 132.983 87.172 -79.933 89.115-173.554 148.306-111.454 94.429 75.125 98.766-142.576 107.928 145.587 103.923 -89.647 119.655-125.856 157.979-142.051 111.041-114.632 140.597-157.948 93.560 47.474 141.563 123.251 91.523 46.053 134.294 -85.061 90.667 48.460 126.164 -67.530 91.261 49.273 145.246 -26.656 92.638 41.036 107.740 -82.415 90.495 45.551 0.000 0.000 89.970 59.738 103.051 -86.956 86.617 51.559 146.604 -80.708 89.748 41.444 118.206-130.273 89.463 51.660 115.321 -75.090 89.634 51.520 139.919-111.135 90.949 49.776 136.317-116.064 92.199-102.770 140.857-123.182 115.026-174.129 111.013 -78.349 96.612 -68.986 98.463-101.298 92.141 -46.501 110.486 -73.069 91.990 -67.004 106.368 -50.721 89.247 106.109 108.475 -69.091 92.708 44.080 129.627 -77.444 90.361 48.786 108.425 -75.996 89.393 46.816 121.673 -32.960 92.628 38.613 132.458 -64.477 94.020 45.004 128.527 -76.423 94.799 70.689 107.872 -74.432 90.370 -93.531 129.534 -77.569 93.980 -37.529 141.494-115.354 89.043 -56.361 117.852 4.760 90.884 -49.287 154.814 -23.693 91.543 -41.366 108.112 -85.155 95.960 113.673 105.615 -78.480 92.526 0.000 128.747 -76.375 # 456 total E -1.51133E+02 rmsd from N 0.000 %NC 0.00 93.075 -62.451 127.215 -77.309 94.894 -45.238 112.415 -78.348 90.715 -46.371 103.771 -77.468 91.418 -42.903 129.087 -76.201 94.056 -37.373 130.454-106.388 104.173 -18.574 77.448 -65.765 97.784 -46.491 120.146 -44.223 97.377 1.995 138.884 -71.645 118.105 -72.073 114.136 -77.827 87.592 26.796 123.916-117.998 124.053 -34.850 140.105-130.886 136.758 -76.631 102.752 -91.520 109.876 -90.903 108.564 -80.765 128.350 158.896 154.545-168.724 110.761-105.815 141.912-161.158 95.468 43.348 146.945 149.785 92.029 46.081 134.934 -86.289 90.164 53.764 130.674 -73.312 90.840 50.869 130.607 -38.975 91.450 38.547 107.425 -82.563 90.538 48.940 0.000 0.000 89.819 57.351 103.734 -85.132 88.581 46.390 141.739 -77.941 91.478 40.132 119.096-124.695 90.646 52.304 110.211 -75.234 90.926 62.647 135.340 -92.537 89.118 41.553 137.518-154.173 92.925 40.495 152.401 -22.316 105.903 -7.920 114.854 -85.154 140.782-157.693 102.302 -82.952 91.687 58.297 114.678 -75.856 91.864 47.684 95.662 -42.248 89.879 50.227 132.838 -5.398 91.508 45.725 129.229 -76.479 90.362 41.826 106.888 -87.192 90.018 53.575 133.928 -94.078 89.107 66.012 135.085 -47.392 87.812 49.703 128.917 -76.875 91.175 178.517 76.661 -89.194 92.039 59.722 166.369 -92.503 90.661 45.802 140.884-103.758 89.750 49.481 119.161 -20.962 91.494 58.828 146.559 -38.950 87.551 44.343 144.753-167.554 93.877 102.963 102.614 -79.793 92.496 0.000 128.911 -76.281 # 457 total E -1.46497E+02 rmsd from N 0.000 %NC 0.00 92.581 132.637 127.183 -55.526 93.280 56.428 146.073 -11.973 94.064 40.902 106.779 -81.789 92.905 51.120 129.146 -75.229 92.208 34.193 129.010 -45.179 95.915 46.261 66.595 -72.788 94.566 42.564 119.153 -43.438 92.338 43.268 152.225 -92.947 89.258 45.815 138.954-146.421 90.092 46.873 76.616-101.520 92.606 49.351 141.562 -81.728 97.951 25.893 98.659-103.211 95.690 54.448 135.223-116.634 95.552 35.494 108.676-112.242 114.837-176.364 142.563-130.844 93.121 46.937 145.181 129.931 90.890 48.001 133.894 -84.933 88.599 62.327 124.099 -11.438 87.802 54.737 148.977 -24.348 87.780 43.112 144.068-145.805 91.003 46.417 0.000 0.000 88.833 48.663 137.241 -38.866 88.891 50.907 134.503 -87.739 88.027 49.523 125.956-131.612 87.506 49.735 108.991 -74.740 90.306 48.757 138.921 -87.373 91.394 43.355 133.245-146.199 94.182 -96.243 142.546-123.424 121.805 171.450 153.250 -13.380 98.016-154.496 96.052 -98.402 97.064 47.814 124.264 44.577 92.981 42.459 105.467 -19.303 93.743 44.194 143.741 -25.740 93.325 42.750 127.227 -74.946 90.035 43.556 145.306 -33.071 92.977 47.982 145.868 -34.577 89.157 44.226 162.355-139.595 91.400 41.332 128.230 -76.826 90.426 51.411 114.202 -43.097 90.235 47.560 128.398 -76.650 90.422 44.579 138.185-143.125 93.627 77.430 127.958 -42.203 89.604 -81.425 146.669 -92.125 98.596 -48.076 105.465 -87.315 100.397-167.819 106.667 -76.902 92.936 0.000 129.029 -76.506 # 458 total E -1.48118E+02 rmsd from N 0.000 %NC 0.00 92.707 163.509 122.825 -48.277 92.848 79.637 136.928 -70.799 97.521 39.377 105.559 -79.170 93.533 42.211 131.046 -75.833 94.536 40.513 109.234 -84.796 91.382 42.999 80.519 -68.148 90.408 46.689 114.575 -63.099 89.358 41.967 134.905 -92.988 92.187 45.024 116.140-100.861 89.921 53.533 97.206 -92.527 90.675 174.467 127.298 -92.809 90.358 75.225 131.943-160.801 90.997 44.473 98.025 -79.775 91.947 50.147 143.251 -33.519 91.331 39.833 134.076-120.738 93.356 47.681 122.621-127.965 93.295 42.048 126.153 -89.272 94.749-108.046 150.427 176.798 114.693 -85.974 86.077 -99.393 88.268 90.202 152.059 -19.860 90.057 60.858 0.000 0.000 90.137 47.467 111.407 -75.145 89.840 44.900 152.549 -77.565 90.351 44.374 119.757-131.292 88.157 53.994 109.923 -75.675 90.056 46.105 143.815-100.785 92.311 45.060 130.407-135.354 96.217 19.513 112.295 -92.171 110.257 162.332 154.112-112.215 98.036 51.089 135.410-160.847 98.901 25.196 115.163 -78.268 103.861 36.145 141.579 -0.798 94.324 47.066 112.520 -71.852 92.106 47.258 129.605 -75.760 88.839 40.656 102.708 -85.335 93.144 41.505 109.979 -59.013 92.903 48.784 140.713 -36.796 91.348 34.859 130.685 -78.623 94.094 113.024 93.029 -91.093 92.643 -49.116 130.011 -78.425 95.128 -46.440 142.938-124.608 94.968 -31.054 132.270 -40.321 96.656 -56.044 157.121-140.301 90.689 -43.522 128.890-159.558 95.258 87.734 103.093 -79.319 92.520 0.000 128.909 -76.625 # 459 total E -1.47940E+02 rmsd from N 0.000 %NC 0.00 93.040 160.964 137.333 -86.581 93.191 59.107 136.735 46.371 92.885 42.864 106.767 -81.659 91.999 47.495 131.573 -77.400 92.537 43.789 152.823-144.807 92.576 45.974 57.720 -68.026 89.403 45.753 128.619 -33.451 89.664 53.310 120.446-111.316 87.482 41.718 126.734-115.615 95.350 88.513 84.857 -96.747 95.020 -46.536 150.218-100.262 104.956 -68.961 93.837 -87.796 91.635-121.859 144.582 -1.244 91.971 51.218 141.106-139.331 94.596 50.189 110.915 -88.141 95.260 30.146 124.380 -73.356 100.471 51.434 145.515 6.566 139.012 -92.874 146.506-123.926 117.963-114.013 117.974-143.022 94.422 50.822 145.787-167.126 92.518 45.943 0.000 0.000 90.367 46.045 141.168 -22.512 90.535 55.585 141.969 -86.412 87.596 50.629 124.286-137.379 88.176 48.150 108.637 -76.300 91.311 49.995 146.494 -92.985 91.076 49.427 130.433-168.087 94.397-102.803 103.287 -83.437 106.333-171.716 156.533-147.631 135.310 -46.866 109.179-102.608 100.920 -27.515 112.252 -78.299 93.033 -49.933 114.804 -40.246 92.078 -45.375 114.628 -73.848 91.020 -47.153 127.474 -76.469 88.862 -42.808 101.774 -81.072 91.898 -41.756 141.290 -20.136 92.493 -51.392 141.292 -50.071 89.931 -42.137 130.659 -77.730 95.399-125.426 131.467 34.723 91.545 47.944 129.977 -76.170 93.348 50.053 141.224-114.377 95.344 30.526 124.633 -26.821 95.071 56.465 153.288 -14.133 89.665 42.967 137.671-148.122 95.595 84.412 103.431 -80.011 92.520 0.000 128.910 -76.579 # 460 total E -1.54005E+02 rmsd from N 0.000 %NC 0.00 92.680 143.444 130.615 -64.027 92.547 62.804 123.847 -28.506 94.358 43.893 104.772 -82.388 93.216 42.462 129.362 -75.772 93.175 49.976 115.359 -75.502 90.598 42.028 63.319 -69.093 90.022 46.841 127.312 -37.822 91.213 44.015 121.525-106.839 90.059 49.412 144.967-144.380 90.624 76.569 84.295-105.715 91.407 -63.701 139.483-103.689 106.890 -71.885 91.638 -84.719 92.888-119.776 145.963 -6.420 104.539 -38.188 145.546-129.253 95.037-120.262 131.138-147.981 91.962 47.439 133.757 -99.246 93.790 50.259 135.524 -69.770 92.837 40.232 121.200 -36.397 92.354 47.396 138.710 98.912 91.017 46.395 140.200-160.038 91.747 43.033 0.000 0.000 90.948 45.871 151.973-157.192 90.835 46.609 134.899-104.370 90.552 44.295 119.364-128.456 88.686 49.512 116.883 -78.702 90.560 49.967 135.718-110.787 90.492 48.018 127.567-153.574 93.927-101.345 103.328 -82.630 114.931-178.993 151.807 -17.044 130.799 -57.240 111.933-107.650 108.287 -25.119 112.704 -79.569 93.419 -47.391 112.879 -54.064 91.619 -45.118 109.191 -72.430 90.543 -48.494 127.853 -76.861 88.589 -42.763 103.235 -80.305 89.535 -48.282 143.854 -38.235 90.242 -50.611 153.393-123.629 89.055 -46.383 129.649 -77.841 94.188-125.375 135.412 7.283 89.631 54.130 133.270 -77.498 91.153 45.315 142.077-109.257 89.555 47.680 129.853 -36.463 89.896 67.420 141.338 -43.793 87.216 51.008 136.669-141.896 91.807 110.322 101.290 -80.084 92.612 0.000 128.579 -76.787 # 461 total E -1.48619E+02 rmsd from N 0.000 %NC 0.00 93.221 -71.020 129.215 -83.235 94.258 -47.227 120.193 -80.951 90.549 -49.393 102.835 -79.497 89.855 -48.894 128.604 -75.496 91.861 -40.246 141.590-138.712 93.032 -43.905 59.998 -74.991 92.925 -53.836 135.640 70.253 109.928 -73.507 169.654-123.473 91.974 12.428 125.547-114.792 117.759-167.925 89.999 -87.824 130.710 52.936 156.105-158.515 92.214 57.624 95.873-118.837 93.721 54.170 102.476 -84.176 95.882-115.764 135.967 -83.181 101.153-114.194 152.073 -37.006 92.368 49.670 117.843-167.591 91.670 50.086 136.657 -83.356 90.059 51.654 126.540 -44.141 90.088 46.868 92.822 -68.345 89.269 49.911 110.062 -80.628 89.580 49.995 0.000 0.000 90.808 44.754 111.095 -77.881 90.779 44.293 149.643 -75.228 91.745 42.755 116.966-126.730 89.745 50.211 111.956 -78.072 89.635 54.638 140.941-104.046 91.812 37.341 135.507-104.327 95.993 39.329 153.953 -21.012 101.838 -10.267 142.297-100.306 135.496 -75.553 110.084-101.838 122.879-116.121 116.363 -80.240 128.737 122.653 145.013 45.110 122.835 -97.324 116.923 -77.008 92.082 56.759 129.754 -75.366 92.026 39.754 103.435 -82.845 91.046 44.878 115.925 -43.188 91.066 53.640 137.870 -36.273 88.562 48.415 130.822 -78.201 89.644 116.158 106.130-105.696 91.066 -43.231 130.639 -78.501 92.626 -51.184 142.514-128.027 87.244 -53.522 120.596 -1.079 90.051 -55.336 155.111 -28.716 89.194 -46.673 129.461-104.679 94.763 82.984 103.221 -79.249 92.502 0.000 129.007 -76.481 # 462 total E -1.48074E+02 rmsd from N 0.000 %NC 0.00 92.623 133.640 130.138 -63.314 94.333 47.959 139.954 16.616 93.987 41.744 107.026 -82.745 92.873 47.178 128.052 -75.471 92.535 45.018 128.898 -33.768 91.454 44.979 64.849 -71.044 90.022 49.031 124.174 -35.952 90.916 41.688 117.593-102.654 89.430 55.544 150.386 164.054 85.922 62.306 81.010-111.410 87.800 124.318 129.084 -95.103 94.041 79.599 99.656-120.579 88.794 117.100 130.885-123.759 105.000 -65.779 113.492-105.183 102.172-109.481 137.261-144.532 91.306 55.199 135.336 119.699 90.892 47.154 134.301 -85.453 89.315 52.103 139.630 12.706 89.375 49.578 139.994 -12.211 89.154 45.260 145.017-154.783 89.565 48.116 0.000 0.000 89.136 48.895 126.796 -49.179 89.596 47.913 138.791 -78.620 90.308 46.091 123.791-126.072 89.755 46.757 106.194 -75.154 90.525 55.384 124.177 -69.214 90.814 43.432 133.890-121.797 92.945 43.651 108.142 -86.379 98.987 32.083 151.758 -24.631 131.851 -34.920 115.077-109.610 145.536 -52.869 124.823 -85.838 101.142-111.200 121.648 -66.269 92.443 51.327 131.977 -17.730 91.648 48.412 129.409 -75.921 88.876 46.130 145.739 -29.595 90.051 48.884 134.812 -38.079 90.040 48.083 148.579 -90.262 91.684 37.415 128.010 -76.736 91.050 48.979 111.818 -82.280 90.004 57.601 129.937 -77.550 89.158 44.248 142.755-116.276 91.379 47.718 127.383 -35.793 94.963 -81.182 139.797 -58.028 127.822 -5.704 106.810 -81.305 131.031 118.835 105.876 -71.864 92.697 0.000 129.568 -76.802 # 463 total E -1.47586E+02 rmsd from N 0.000 %NC 0.00 93.003 149.824 140.037 -93.439 93.255 52.225 119.130 -19.416 93.270 46.177 105.075 -80.863 92.261 41.197 129.006 -76.138 94.822 51.335 112.182 -84.508 91.644 39.658 60.025 -66.607 89.897 49.152 127.018 -26.440 91.058 49.398 117.676-109.981 88.650 48.457 136.586-125.260 90.044 167.664 86.326-100.604 124.589-134.553 157.934-153.189 99.354 -71.718 98.655-113.409 99.499 172.179 146.279 -26.043 108.002 -54.933 148.159 -94.950 96.186-129.437 135.583-142.347 92.663 46.553 139.678 -98.460 92.816 49.263 135.205 -71.637 92.098 43.192 118.903 -32.867 91.270 47.640 137.168 97.704 90.910 46.555 141.072-153.943 91.565 43.452 0.000 0.000 90.315 48.126 153.852-159.782 90.408 46.962 133.411-104.101 90.563 42.942 120.496-129.206 90.374 46.651 115.053 -76.780 91.049 49.121 142.880-110.826 91.992 48.203 130.257-149.726 94.047-100.409 141.523-125.213 113.610-173.781 110.928 -79.328 132.710 -65.563 112.012-106.981 110.707 -19.116 113.467 -79.775 93.697 -48.983 110.308 -57.049 93.410 -39.533 111.839 -69.735 93.083 -44.547 127.275 -76.166 92.411 -36.132 103.833 -84.424 91.493 -48.828 106.831 -57.598 88.463 -54.981 152.557 -34.886 89.143 -53.256 129.284 -76.873 90.826-128.387 123.485 -35.731 91.193 51.104 132.026 -76.940 90.853 50.591 143.761-120.820 91.090 56.622 128.936 -33.906 91.651-111.446 135.494 -52.063 97.480 -32.640 129.456-116.045 108.016 -22.479 103.954 -78.427 92.419 0.000 129.335 -76.120 # 464 total E -1.46495E+02 rmsd from N 0.000 %NC 0.00 93.220 170.467 138.466 -93.124 93.097 58.374 141.931 35.292 92.499 42.993 106.264 -83.264 91.922 52.888 131.368 -76.551 90.694 42.931 148.025-140.593 90.144 44.770 66.722 -75.739 91.996 43.417 117.435 -45.803 92.036 41.310 138.938 -93.829 89.340 46.882 137.382-130.415 90.199 47.017 79.251-101.819 91.781 48.018 140.465 -88.286 99.083 24.456 96.428-104.153 95.760 59.273 135.661-119.444 93.520 39.087 108.797-112.621 96.692-123.831 139.288-145.912 96.030 -7.556 136.927-111.573 100.892-158.762 146.992 -80.973 101.637 -21.578 125.314-121.414 102.656-117.908 126.199-124.028 90.292 57.516 109.007 -81.915 93.399 50.491 0.000 0.000 91.915 38.442 138.538 -24.845 92.570 51.245 146.276 -87.455 89.386 50.845 121.573-132.998 89.803 42.799 110.356 -75.558 93.523 47.428 148.824 -99.281 93.445 37.942 133.546-152.940 94.924 64.864 115.506 -87.796 138.233-133.621 104.603 -81.380 126.862 -72.929 109.557-107.652 92.466 56.664 115.842 -76.194 92.238 43.136 108.529 -30.722 89.634 49.607 112.000 -73.713 89.946 48.213 129.724 -76.815 88.641 45.440 103.515 -88.304 88.847 50.284 112.203 -62.426 87.889 56.844 131.731 -51.552 89.662 38.273 128.768 -77.057 92.063 110.498 98.884 -98.790 94.443 -33.513 129.707 -78.139 96.359 -55.544 142.274-119.080 92.856 -19.980 124.889 -15.990 107.098 -86.444 157.909 -18.413 91.719 -56.512 136.999-125.064 95.600 63.163 102.941 -79.428 92.461 0.000 129.225 -76.394 # 465 total E -1.49409E+02 rmsd from N 0.000 %NC 0.00 93.182 161.691 140.893 -99.489 93.362 54.760 134.340 39.896 91.460 43.766 105.783 -82.464 91.497 53.463 131.344 -76.908 89.682 43.796 150.618-148.504 90.254 45.657 66.577 -71.056 90.010 45.992 113.824 -46.367 87.965 50.439 139.288 -96.194 87.787 50.305 118.011-112.613 89.822 64.119 84.907 -92.287 90.380-172.216 137.543 -79.183 96.283 67.626 128.640-153.181 93.034 38.058 101.000 -78.393 91.339 58.104 149.077 -26.786 91.934 39.555 132.247-139.267 94.368 43.337 122.160-129.323 99.278 -8.720 126.735 -85.277 118.945 116.086 145.117-101.476 94.877 47.035 146.364 -13.171 89.925 45.925 153.756 -23.015 91.099 47.411 0.000 0.000 90.222 47.829 116.002 -78.449 90.706 42.020 134.909 -80.404 89.912 46.528 123.089-118.696 89.326 50.477 112.109 -78.858 90.059 48.851 141.048-108.178 92.085 36.972 128.818-146.725 101.013-119.302 145.665-130.489 115.388 170.251 111.217 -78.918 96.836 -51.824 93.514 -98.548 87.598 -55.356 111.271 -75.238 89.174 -55.604 118.946 -39.081 89.260 -45.098 117.583 -75.404 90.486 -44.868 126.912 -75.720 89.321 -45.888 98.332 -79.156 90.957 -48.952 146.529 -25.245 92.990 -24.601 167.511-163.211 106.802 -48.407 128.428-106.576 111.139-105.409 142.040 -14.094 90.381 54.245 131.540 -77.455 91.822 46.525 141.009-103.175 89.026 57.646 125.217 -15.446 88.684 82.989 143.736 -91.886 86.951 44.375 132.798-151.678 94.209 111.141 146.774 -23.482 92.568 0.000 128.704 -76.546 # 466 total E -1.46497E+02 rmsd from N 0.000 %NC 0.00 93.240 166.801 139.997 -98.858 93.557 52.384 118.135 -22.394 92.953 44.943 104.907 -76.524 93.650 43.408 129.228 -76.781 92.816 44.232 109.725 -86.400 99.069 30.862 56.693 -65.773 98.789 40.234 136.127 -25.195 95.361 38.777 140.308-105.044 92.834 49.699 131.741-128.606 91.013 71.961 87.121 -97.574 91.052-123.292 124.631 -87.493 97.543 -27.343 98.156 -98.773 129.337-146.652 149.559 -9.551 93.856 -22.532 139.049 -93.698 105.647-110.407 142.412-152.588 92.921 47.294 135.351 -95.947 91.396 52.321 139.342 -73.842 90.029 51.199 144.381-102.218 91.158 46.226 162.013 98.921 91.114 39.961 142.881-143.337 92.272 46.870 0.000 0.000 89.944 50.912 140.985-119.711 90.978 40.245 120.117-111.921 90.664 42.878 117.785-120.633 90.518 53.299 112.164 -78.274 89.763 49.265 138.420-104.428 91.824 41.994 130.958-161.471 97.689 -93.677 143.976-130.056 112.548-146.456 111.058 -79.083 137.251 -75.900 113.628-105.464 116.269 -12.123 115.314 -80.325 93.520 -47.704 116.947 -59.604 104.706 -20.626 114.239 -71.119 97.127 -47.444 127.306 -75.901 95.089 -29.921 107.104 -93.965 92.892 -51.304 96.221 -68.025 85.911 -59.367 149.657 -28.748 89.983 -44.641 132.081 -78.154 95.966-143.364 105.730-115.353 91.903 52.919 130.832 -76.126 91.501 50.673 140.216-109.375 91.873 66.416 123.629 -10.658 91.303-101.836 140.779-118.972 98.147 -28.440 134.667-140.625 110.988 165.480 106.856 -78.476 92.749 0.000 129.377 -76.381 # 467 total E -1.48066E+02 rmsd from N 0.000 %NC 0.00 92.765 -12.347 135.957-110.192 96.078 -47.145 119.796 -79.234 91.669 -45.632 102.561 -78.022 89.790 -48.352 129.632 -76.104 92.886 -42.540 142.571-152.214 91.241 -43.915 59.645 -80.363 90.079 -82.578 119.972 -36.672 88.640 72.839 140.356-112.493 103.617 58.573 145.371-179.334 92.682 14.872 148.806 -12.402 112.566 48.332 159.816-123.697 100.462 21.675 98.376-112.425 96.501 58.826 147.193-148.461 92.214 32.486 101.532-123.610 114.785-176.936 101.763 -87.514 93.800 42.192 139.253-113.363 90.995 52.374 136.897 -76.912 88.874 60.005 151.381 -77.220 90.178 46.822 139.934 -21.184 90.639 40.467 142.125-170.560 90.647 48.823 0.000 0.000 89.963 49.298 107.151 -83.860 90.402 44.377 144.961 -76.740 92.133 39.706 119.573-125.514 90.626 50.935 110.852 -77.046 90.063 59.888 133.551 -92.474 90.144 39.809 140.458-141.345 93.689 41.431 152.909 -21.562 99.846 -5.651 114.659 -89.174 137.617-159.488 103.953 -88.309 92.249 58.518 114.574 -76.279 92.103 49.923 103.883 -22.960 90.767 45.113 132.930 -4.141 90.862 48.118 129.943 -76.383 88.537 45.064 102.073 -83.782 90.538 45.839 128.292 -41.998 91.364 42.890 137.154 -57.514 92.405 40.722 128.968 -77.231 90.734 48.941 107.242 -59.803 90.791 49.849 128.645 -77.157 88.662 49.581 119.822 174.675 90.697 66.602 133.838 -55.903 89.352-109.121 127.111 -57.660 96.862 -13.222 137.758-137.265 119.332-126.929 105.186 -75.720 93.091 0.000 129.235 -76.644 # 468 total E -1.48482E+02 rmsd from N 0.000 %NC 0.00 93.176 167.676 138.331 -91.734 92.310 58.671 143.365 51.993 93.270 41.966 107.026 -82.752 92.259 46.754 131.060 -76.499 94.103 42.306 149.291-136.998 92.179 43.174 57.693 -74.146 91.144 44.665 122.445 -33.780 91.053 44.407 132.857 -98.446 89.194 50.122 137.102-130.782 88.583 54.999 80.308-103.348 90.215 48.272 132.052 -82.889 103.785-112.488 92.509 -88.764 115.928 174.077 106.775 -85.040 142.056-113.016 169.350-165.119 107.041-119.706 139.427-151.741 95.531 45.302 147.479 149.895 92.760 45.848 134.551 -85.136 91.047 48.006 129.039 -63.101 92.251 50.680 123.484 -37.388 92.424 40.511 107.771 -82.404 90.993 45.812 0.000 0.000 90.569 57.385 102.498 -82.780 88.361 48.625 143.512 -70.630 90.732 38.529 118.588-124.568 91.700 48.853 112.013 -77.556 90.283 53.405 140.254-101.325 91.244 44.013 135.442-100.041 92.858 38.532 142.131-126.029 100.009 15.035 151.092 -23.043 137.307 135.656 105.902 -92.048 95.928 45.206 118.927 -79.186 92.735 48.055 132.278-105.881 92.827 117.122 110.644 -77.359 92.674 61.530 130.287 -76.254 89.936 81.808 137.438 169.529 82.862 -84.773 97.240 -62.415 90.292 -57.211 144.304 -37.583 90.899 -37.564 133.321 -78.385 96.881-141.923 116.882-127.036 94.332 48.149 130.292 -76.698 94.524 42.134 139.583-107.239 93.714 39.918 118.734 -8.226 94.176 65.310 153.435 -28.945 87.676 52.232 137.049-157.566 93.688 93.088 101.100 -79.166 92.469 0.000 129.100 -76.134 # 469 total E -1.46642E+02 rmsd from N 0.000 %NC 0.00 93.165 -69.197 127.488 -77.961 93.121 -53.710 111.846 -71.224 92.247 -40.309 105.980 -77.720 93.579 -43.484 128.109 -75.781 97.223 -23.318 148.726-142.638 105.330 -36.595 43.723 -77.857 96.167 -29.288 115.813 -38.016 106.098 -50.811 155.832 -34.248 95.801 148.266 142.560 -83.669 88.663 86.465 124.503 168.584 95.212 23.441 127.387-105.928 106.440-110.937 100.996 -86.541 119.079 165.651 106.744 -84.313 131.816 -79.872 161.036-134.069 97.178-121.630 136.051-145.295 93.500 46.395 154.247-129.566 93.523 46.677 134.374 -80.483 92.231 43.279 125.538 -41.851 91.934 48.694 102.769 -66.770 89.797 46.485 109.373 -83.135 91.054 46.085 0.000 0.000 93.182 38.632 99.041 -74.169 93.748 45.078 159.913 -9.524 91.835 41.347 111.393-134.374 91.267 46.139 110.947 -78.126 90.406 50.665 139.510 -96.563 92.115 46.896 137.813 -78.588 93.270 34.221 142.274-125.682 101.533 5.310 153.288 -22.980 137.135-163.599 107.676 -97.656 96.635 52.541 115.675 -77.168 92.363 53.369 100.676 7.254 89.221 52.834 137.014 -39.107 91.023 54.281 131.612 -77.102 90.528 77.572 139.037-152.149 88.165 -77.965 97.667 -63.892 89.446 -54.771 142.941 -46.856 91.357 -43.522 133.600 -77.249 97.022-143.368 105.330-110.127 93.118 46.524 130.104 -76.557 93.471 49.613 140.010-110.774 93.299 69.417 119.946 -4.900 93.216 -93.590 135.288 -99.415 99.310 -31.679 102.987 -91.188 115.346 143.470 105.859 -76.491 92.643 0.000 129.315 -76.334 # 470 total E -1.49153E+02 rmsd from N 0.000 %NC 0.00 93.200 -65.446 128.804 -82.021 94.737 -46.434 116.046 -80.950 90.383 -47.815 103.242 -77.016 90.272 -47.452 129.812 -76.449 91.936 -40.274 138.747-121.749 94.664 -41.010 61.680 -58.425 91.226 -41.030 133.683 -5.494 97.905 -47.731 166.236-177.409 88.129 -68.293 114.952-109.552 86.155 -79.214 93.606 -90.343 114.314 119.616 139.047-177.843 99.195 42.572 93.691-107.953 94.653 42.950 113.681 -77.022 92.326 44.509 145.433-102.252 94.993 41.290 105.212 -93.840 95.256 39.048 131.024-106.027 95.729 47.285 123.430 -75.147 144.912 -95.364 107.041 -81.848 116.268-108.776 99.322 -86.798 91.481 68.292 149.246-167.843 91.108 49.124 0.000 0.000 90.207 46.513 138.251 -13.056 89.771 51.314 148.073 -84.433 89.114 47.035 121.997-136.530 88.099 50.370 109.322 -70.753 90.650 45.473 136.251 -50.745 92.200 43.442 138.685-141.872 95.801 -77.247 143.043-129.957 130.750-175.057 113.670 -78.138 93.549 -49.724 100.461-107.132 90.780 -50.933 110.358 -75.256 90.684 -68.875 102.069 -37.603 87.134 112.629 137.909 -63.477 92.706 51.571 128.661 -76.202 90.421 42.877 103.290 -78.546 91.968 46.814 132.729 -30.561 92.393 41.215 138.821 -80.959 92.742 44.520 128.688 -77.275 93.114 62.025 113.292 -74.046 91.920-108.362 129.409 -77.606 95.793 -31.997 140.568-114.767 90.298 -64.975 119.811 8.126 90.433 -57.047 153.598 -29.275 90.468 -45.722 108.425 -84.826 96.539 91.855 105.193 -78.213 92.446 0.000 129.219 -75.996 # 471 total E -1.46660E+02 rmsd from N 0.000 %NC 0.00 92.988 -59.603 124.399 -69.853 94.447 -48.231 114.012 -76.056 91.406 -45.721 103.951 -77.927 90.692 -44.745 130.184 -76.939 90.984 -48.251 128.677-111.492 88.726 -49.234 71.560 -54.990 89.110 -39.365 122.152 41.128 98.772 -62.767 126.691 -74.275 90.713 -7.695 133.177 -96.605 121.779-154.715 74.518 -77.022 108.336 77.668 144.212-111.235 96.977 50.586 91.214-109.350 96.624 70.716 107.662 -80.468 115.418-116.830 133.059 -86.014 100.729-112.037 151.310 -33.547 92.858 51.326 145.107 148.527 92.864 46.094 136.209 -83.649 91.182 46.454 126.379 -48.006 90.891 49.682 104.483 -30.568 89.593 48.149 108.628 -81.477 90.729 44.819 0.000 0.000 91.373 47.065 116.017 -82.268 89.700 45.993 147.534 -82.861 90.918 45.505 118.594-129.820 89.125 50.623 110.785 -76.834 90.441 47.938 132.424 -92.978 92.224 57.938 131.415-137.459 94.171 -28.264 107.864 -88.869 125.681 168.642 168.597-163.030 133.019-148.237 116.391-112.803 100.855 -11.187 115.361 -78.267 97.807-147.241 112.003 -45.157 97.908 45.630 117.678 -74.914 92.894 46.184 130.580 -76.831 93.573 39.712 140.563 166.045 95.219 104.359 105.843 -71.428 94.325 -51.572 131.774 -75.148 92.735 -56.584 129.283 -77.440 95.698-129.271 123.645-123.755 90.323 52.828 130.733 -76.697 89.983 47.284 141.002-101.316 90.127 46.589 123.930 -16.622 91.097 49.073 142.820 -43.259 91.360 42.281 145.744-142.663 95.539 88.708 104.307 -80.374 92.509 0.000 128.787 -76.668 # 472 total E -1.49129E+02 rmsd from N 0.000 %NC 0.00 93.165 -64.821 126.931 -76.862 94.299 -48.935 116.846 -79.372 90.957 -46.357 103.712 -77.978 90.617 -46.788 128.369 -75.795 91.292 -41.291 139.208-123.472 95.457 -38.678 72.216 -68.697 93.288 -38.340 137.813 -74.886 99.365 -36.953 173.179 150.868 101.462 -49.533 122.499-109.256 95.965 171.924 83.916 -83.834 92.318 72.904 142.290-132.341 97.441 43.070 89.909-116.068 99.460 102.182 108.039 -80.468 133.737-116.455 147.803 -88.388 99.622-114.449 109.609 -85.335 94.162 50.446 142.871 154.496 93.518 45.547 138.041 -85.108 91.379 46.211 132.341 -53.518 91.256 50.546 97.914 -34.175 90.840 45.825 151.314 -35.694 91.785 43.853 0.000 0.000 91.283 48.180 110.204 -86.674 89.575 54.602 148.120 -86.489 88.411 48.181 122.603-135.690 88.112 49.524 107.965 -73.512 90.634 48.690 138.255 -45.249 91.043 47.561 138.372-145.166 94.127-100.401 104.714 -84.236 113.474-166.795 158.831-146.580 97.048 -51.399 95.621-109.603 91.413 -48.451 110.180 -74.713 91.563 -69.818 107.876 -49.545 89.040 108.895 116.796 -75.086 94.068 45.322 128.860 -76.727 89.002 48.120 101.995 -75.884 89.583 63.536 144.929 -41.223 86.829 52.611 161.283-146.695 89.599 40.477 128.078 -76.419 90.026 50.292 114.063 -29.144 89.482 51.734 129.877 -77.108 88.641 46.010 139.202-129.634 88.888 50.173 131.644 -44.971 89.287 55.050 135.024 -52.850 89.524 44.207 138.396-122.247 94.639 82.076 103.785 -80.390 92.525 0.000 128.997 -76.738 # 473 total E -1.51274E+02 rmsd from N 0.000 %NC 0.00 93.220 -65.436 128.264 -80.472 94.366 -48.626 114.891 -78.210 91.310 -45.141 103.298 -76.917 90.641 -47.290 129.676 -76.451 92.389 -37.527 137.333-127.687 94.721 -44.001 64.103 -68.997 92.020 -28.031 123.575 -30.788 109.023 -32.669 167.005 153.688 95.185 -49.972 131.582-106.256 91.385 122.996 86.658 -79.880 107.320-170.157 135.312 -86.261 95.472 51.907 123.713-146.311 117.083 160.428 99.207 -81.766 115.169 -80.512 153.872 -25.628 95.831-117.336 146.701-143.185 92.751 47.314 144.591 144.568 92.501 46.470 136.076 -87.252 91.358 46.824 150.381 -86.209 91.075 46.324 135.728 -42.153 91.346 44.271 143.997-150.588 92.432 42.361 0.000 0.000 90.682 48.722 135.873-114.542 89.808 46.283 129.551-113.602 89.641 43.774 117.878-127.676 89.828 48.350 112.425 -78.626 90.025 48.617 135.618-101.241 92.028 50.833 130.297-133.234 93.653-100.839 103.173 -82.658 109.209-176.883 150.898 -17.647 133.018-170.518 111.993-107.591 96.244 44.014 115.159 -77.336 92.992 44.851 106.838 -21.562 90.820 50.083 138.038 -24.204 90.578 43.219 128.588 -77.168 90.769 49.158 101.441 -82.736 90.780 47.988 131.141 -42.989 94.755 42.890 124.800 -81.871 103.094 3.475 146.525 -95.163 116.583 117.021 146.615-153.715 93.127 -57.377 128.218 -75.755 94.180 -41.983 142.234-115.455 94.927 -33.779 121.142 -11.597 98.735 -51.439 154.104 -31.698 91.663 -43.544 142.219-152.753 95.861 86.879 103.652 -79.101 92.469 0.000 129.043 -76.463 # 474 total E -1.50971E+02 rmsd from N 0.000 %NC 0.00 93.159 -74.047 125.912 -68.116 125.732 -96.011 135.077 -32.043 96.684 36.249 109.395 -79.167 93.563 50.650 132.443 -77.569 93.578 38.845 146.915-136.082 89.790 46.826 66.020 -91.548 89.544 45.985 114.786 -59.337 90.276 43.193 136.318 -83.166 90.718 40.588 129.926-114.093 91.887 48.815 86.350 -98.180 91.640 163.627 129.365 -83.492 91.167 95.018 130.447-158.436 92.851 111.070 102.648 -82.681 90.502 -66.942 146.321-113.750 95.225-121.995 151.696 -30.942 91.078 45.924 137.302 126.527 91.300 49.149 136.357 -84.163 91.224 44.664 121.791 -58.290 91.520 46.425 124.683 -24.728 90.228 45.029 108.342 -82.883 90.462 47.502 0.000 0.000 91.173 42.770 107.429 -83.233 91.983 44.107 145.042 -81.094 92.609 42.440 118.788-126.816 89.734 50.161 116.701 -78.407 90.586 47.338 130.432-105.338 91.675 55.808 133.201-152.124 93.606 -73.864 105.729 -86.018 127.905 166.198 168.445-165.618 128.351 -74.979 113.245-111.790 101.604 -22.667 113.632 -79.195 100.744-144.545 122.333-125.628 110.359 28.752 117.401 -74.662 92.870 53.558 130.749 -75.942 88.818 43.374 107.530 -88.642 91.428 41.448 101.275 -72.252 93.101 51.689 135.023 -41.936 90.410 39.162 131.246 -78.302 92.288 110.771 91.686 -95.165 92.921 -43.549 129.688 -78.038 96.813 -48.747 141.922-120.138 96.662 -23.288 124.007 -19.027 99.308 -60.862 151.258 -30.690 90.768 -46.125 142.272-149.756 95.860 62.247 98.177 -80.568 92.518 0.000 129.050 -76.700 # 475 total E -1.51149E+02 rmsd from N 0.000 %NC 0.00 93.159 -65.888 129.244 -83.694 94.645 -45.213 118.102 -82.643 90.158 -49.227 103.126 -76.942 89.713 -49.494 128.748 -75.971 90.850 -41.605 141.352-121.874 93.357 -39.656 60.245 -62.029 93.865 -43.366 133.565 10.355 97.870 -34.487 169.730 153.910 97.689 -52.799 126.542-119.357 97.035-150.199 80.827 -81.424 111.766 74.115 157.130-174.339 95.595 39.155 91.111-121.030 92.313 50.023 110.184 -85.472 91.526 59.038 157.626-139.486 88.509 53.269 137.520-137.011 91.281 36.573 131.595-115.386 97.949-179.845 132.991 -87.875 140.893 15.260 130.018 97.981 96.027 43.493 135.413 96.428 94.823 42.000 146.289 -34.888 95.923 45.388 0.000 0.000 98.829 30.483 152.607 -1.983 95.702 43.132 169.841 134.891 91.532 45.723 117.356-156.748 90.814 43.847 107.282 -77.478 90.867 51.007 150.606 -34.849 90.474 43.087 147.670-169.703 92.203 50.449 113.319 -88.606 95.673 -33.561 122.906 -86.958 133.037-130.448 109.972-102.501 91.907 62.907 112.617 -76.428 90.681 70.292 115.229 -85.288 88.789 57.569 111.758 164.506 88.626 47.323 129.766 -76.036 89.158 47.003 100.751 -83.690 89.192 48.865 118.877 -29.503 91.173 45.765 133.285 -54.296 91.324 40.669 128.293 -76.206 92.432 80.919 109.505 -95.319 90.977 -92.458 128.507 -76.746 93.267 -47.596 144.973-131.442 93.269 -51.214 118.191 13.718 94.476 116.157 144.459 -33.746 99.384 23.489 142.065-160.598 99.820 34.339 105.621 -78.355 92.301 0.000 129.854 -75.600 # 476 total E -1.52821E+02 rmsd from N 0.000 %NC 0.00 93.352 -72.789 132.973 -96.346 95.608 -42.454 135.331 -90.020 90.695 -54.162 101.213 -79.163 90.143 -47.289 126.882 -74.562 89.702 -48.729 151.080 171.901 94.198 -45.294 116.887-152.433 91.288 118.135 97.728 -78.106 95.584 48.931 124.223-113.106 89.186 52.753 147.315-179.754 89.517 74.583 81.692-108.003 92.063 -74.404 131.373 -93.079 106.444 -66.417 89.792 -75.294 92.647 -67.400 147.754 -30.065 118.355-158.628 155.363-163.285 109.515-108.647 148.184-158.170 94.446 45.253 143.362 147.830 91.876 46.483 135.686 -84.419 90.381 49.636 119.303 -67.879 91.352 50.800 133.791 -39.347 91.942 40.890 143.437-162.095 90.920 44.882 0.000 0.000 90.600 58.253 103.375 -83.971 88.110 49.570 146.111 -78.207 90.851 39.193 117.744-127.894 91.281 51.206 111.067 -76.716 90.277 70.178 142.201-100.091 89.630 44.551 143.969-144.769 92.427 42.183 142.967-128.868 100.598 -9.878 117.905 -88.572 137.434-159.443 106.093 -92.695 96.192 53.611 115.077 -76.974 92.604 48.015 100.720 -30.753 89.771 51.641 128.250 -27.436 92.164 47.800 128.605 -76.062 91.796 39.742 102.603 -84.311 92.354 45.883 121.109 -66.971 91.398 62.279 131.295 -62.764 88.678 56.876 130.444 -78.174 89.852-179.822 75.914 -91.943 92.133 63.246 133.051 -78.298 91.482 44.351 140.131 -99.901 90.232 52.743 118.952 -24.065 92.211 91.102 137.272 -52.630 87.868 52.587 141.196-158.586 95.420 90.908 100.707 -79.245 92.416 0.000 129.189 -75.981 # 477 total E -1.46952E+02 rmsd from N 0.000 %NC 0.00 93.321 173.368 139.737 -99.275 93.513 54.020 133.428 40.390 91.675 45.317 106.220 -81.426 91.730 47.110 130.793 -77.223 92.695 46.211 148.456-135.135 94.498 41.935 57.088 -68.555 90.467 45.304 131.661 -28.356 89.092 56.388 124.802-117.935 86.626 44.835 119.645-115.445 90.532 50.314 83.498 -93.424 92.557 31.753 139.179 -75.599 108.073-129.332 102.549 -93.140 110.406-149.078 104.879 -83.110 152.296 174.673 176.465 174.169 106.721 -87.690 140.529-151.577 94.098 56.280 138.504 126.996 91.403 46.328 132.692 -86.118 89.929 61.048 131.589 32.111 88.400 48.324 144.092 -20.822 90.416 40.571 108.503 -81.676 93.949 113.940 0.000 0.000 89.029 64.003 115.540 -75.874 88.929 44.997 140.993 -84.419 90.726 42.823 116.022-122.469 90.020 49.390 105.949 -72.362 90.222 53.737 135.122 -64.679 90.973 36.170 134.123-127.642 94.944 44.322 115.980 -89.729 99.727 -33.326 117.576 -87.757 134.296-153.858 109.378-100.240 93.590 62.708 130.780 139.803 92.678 106.359 110.865 -83.327 98.665 -15.546 113.752 -70.699 95.997 -71.057 127.984 -76.712 92.123 -36.035 98.507 -80.404 90.055 -50.865 126.087 -26.842 91.693 -49.268 142.705 -42.808 90.127 -55.194 129.216 -76.965 90.958-128.831 132.294 6.438 91.031 51.827 131.509 -77.260 90.583 52.260 143.263-120.736 90.362 55.978 132.058 -45.176 90.984-124.091 128.732 -55.413 96.284 -10.517 136.981-138.394 117.641 -85.509 102.060 -75.065 92.809 0.000 129.341 -76.346 # 478 total E -1.47106E+02 rmsd from N 0.000 %NC 0.00 93.078 159.648 139.295 -92.504 93.292 56.543 135.272 50.034 92.004 43.879 106.934 -82.104 91.591 48.863 130.616 -76.559 92.897 41.796 154.309-157.079 92.761 42.367 57.640 -68.376 90.208 46.040 120.577 -29.616 89.409 51.731 143.580-100.023 88.279 43.381 128.183-112.393 88.729 44.246 74.377 -90.562 92.018 67.424 141.542 -53.615 94.587 15.236 101.230-103.404 98.383 68.281 137.654-133.824 117.676 38.389 116.844-121.811 128.070-145.353 146.678-143.261 94.875 44.540 142.093-107.462 91.961 46.522 134.810 -76.947 89.166 57.856 131.940 60.550 89.189 48.927 150.836 141.819 91.188 39.752 143.015-155.182 95.277 40.273 0.000 0.000 90.495 48.235 147.853 -20.969 89.805 50.103 128.162-108.381 89.356 52.042 121.488-131.344 86.874 55.679 110.126 -73.934 89.413 53.006 126.809 -80.471 90.149 43.760 140.508-144.278 94.340-119.096 103.803 -81.538 113.652-178.007 152.031 -9.536 119.719-123.471 117.459-123.794 95.642 43.913 114.038 -76.664 91.734 49.033 105.575 -17.201 90.735 49.958 128.968 -20.349 91.386 42.485 128.739 -76.904 90.530 45.826 101.845 -83.324 89.508 60.604 113.444 -34.020 89.706 46.761 133.251 -56.702 91.733 42.278 128.298 -76.130 94.693 54.750 115.891 -86.018 96.999-169.605 131.199 -77.628 92.721 62.137 139.675-112.104 90.920 63.618 129.192 -8.660 88.260 78.374 161.686-144.728 88.612 46.499 134.008-113.905 94.363 93.472 102.594 -78.630 92.459 0.000 128.750 -76.356 # 479 total E -1.54499E+02 rmsd from N 0.000 %NC 0.00 118.250 150.919 153.443-112.897 93.517 54.802 140.811 35.958 92.309 45.034 105.900 -81.974 92.049 47.557 130.421 -77.130 93.740 45.963 145.232-127.531 91.987 40.508 59.367 -75.183 92.314 44.353 124.036 -37.962 92.666 41.547 133.826-105.128 91.213 50.585 142.650-141.892 87.949 50.479 81.471-104.473 93.012 151.244 127.405 -82.797 92.916 83.592 127.950-151.739 97.114 105.995 98.180 -84.602 93.599 -63.302 142.715 -84.620 96.285-124.014 133.958-140.940 91.000 48.978 135.426 122.573 91.416 47.386 134.464 -85.317 90.777 47.990 134.794 -32.400 88.845 50.258 138.518 -21.473 88.325 49.756 142.390-145.711 90.624 43.549 0.000 0.000 89.194 49.998 120.832 -75.767 88.716 48.472 136.638 -82.618 88.791 45.512 123.546-127.472 88.917 48.031 111.367 -76.812 90.547 46.457 135.217 -97.988 93.227 55.737 132.473-115.952 93.378 -96.624 103.627 -83.749 103.183-169.581 150.464 -19.535 127.508 -41.816 113.884-114.812 93.529 -49.298 109.274 -80.320 95.923-106.992 124.201 -74.751 88.664 60.918 126.577 16.902 91.099 53.289 129.614 -76.075 88.779 44.632 146.779 -12.063 89.975 48.156 148.582 -18.857 87.856 48.940 163.064-167.728 90.606 41.183 127.892 -76.547 87.797 54.232 114.323 -31.192 87.928 67.418 128.531 -77.719 87.215 46.885 139.287-156.311 91.044 74.328 132.360 -47.813 90.033 -78.902 135.366 -54.252 100.822 -40.177 110.131 -80.716 119.541-144.756 107.649 -81.255 92.994 0.000 129.351 -76.473 # 480 total E -1.51086E+02 rmsd from N 0.000 %NC 0.00 124.296-105.282 146.681 -38.793 123.579-104.595 130.721 -36.401 93.471 42.545 109.433 -80.787 93.694 49.148 130.203 -76.796 93.831 42.210 153.297-145.025 90.787 43.204 64.184 -85.964 93.261 42.584 120.786 -50.122 93.316 38.353 140.223 -95.182 91.536 48.042 145.204-163.151 91.182 82.129 84.276-105.533 88.733 -67.326 141.902-108.831 104.954 -71.299 90.271 -85.073 91.888-120.131 150.192 -13.282 106.516 -61.273 147.153-121.566 94.827-115.109 131.757-156.691 94.461 43.545 157.994 -95.189 92.310 46.684 133.850 -78.211 90.530 51.556 124.351 -56.884 89.278 51.351 108.477 -57.365 88.479 44.287 108.645 -82.405 93.099 39.496 0.000 0.000 90.988 48.977 141.637 -98.444 90.241 40.920 120.006-118.370 90.326 48.095 115.877-122.858 89.075 49.206 109.209 -81.061 90.482 52.079 133.611 -99.218 91.825 48.280 134.812-128.377 94.786-114.346 146.102 -35.636 93.695 178.717 147.618-120.298 106.993 -18.309 90.796-116.079 101.636 -59.849 113.853 -80.203 98.565-112.506 126.594 -73.790 89.917 76.809 119.957 -75.892 91.664 48.679 129.022 -76.282 87.675 48.934 112.978 -87.808 88.278 55.954 140.091-115.085 87.366 52.908 137.996-153.866 87.091 46.835 127.732 -76.131 88.783 53.024 122.355 -64.439 89.422 42.528 128.688 -75.284 91.392 45.487 138.413-136.397 90.667 51.898 127.778 -43.899 89.212 51.766 134.342 -92.071 91.074 44.609 132.563-146.116 95.182 73.736 104.209 -80.774 92.509 0.000 129.056 -76.656 # 481 total E -1.47186E+02 rmsd from N 0.000 %NC 0.00 122.036 -84.532 151.947 -88.247 94.334 -44.832 119.707 -94.889 89.710 -50.488 102.921 -77.801 89.406 -49.930 128.187 -75.262 92.139 -37.035 138.131-124.778 94.243 -40.282 58.259 -59.389 92.326 -44.020 128.390 42.807 97.081 -42.795 143.079 -84.888 92.243 -38.797 144.418-114.376 96.036 -52.812 118.372-134.365 93.332 116.389 138.878 169.755 106.073-118.970 116.965-132.005 101.950 -56.136 108.570 -80.793 102.789-131.200 148.145-150.181 97.585-119.746 129.735-160.676 94.207 42.804 136.010 132.376 90.844 48.519 134.485 -89.239 89.931 55.980 147.605 -90.622 89.518 48.198 129.130 -26.886 91.285 39.149 107.696 -82.552 90.859 48.661 0.000 0.000 89.319 53.081 104.946 -85.216 89.248 47.956 144.880 -73.756 91.205 38.838 120.695-127.822 90.992 49.671 111.988 -77.366 90.042 62.602 139.664-100.946 89.959 44.267 145.255-131.827 92.361 39.492 152.451 -22.054 100.371 -5.671 114.539 -88.054 139.014-158.571 102.528 -85.922 94.582 54.638 115.081 -76.669 92.561 49.860 106.713 -28.487 89.849 48.260 130.794 -14.782 91.615 48.158 130.247 -76.778 90.988 39.996 101.802 -83.889 90.951 46.726 120.237 -55.306 90.452 59.422 135.052 -51.110 88.249 49.533 130.267 -78.234 89.124-177.552 102.336-103.285 94.449 84.439 167.888 -91.329 92.365 41.712 140.865-107.585 91.819 46.327 126.588 -31.967 91.999 65.579 151.809 -31.669 87.986 55.756 141.420-175.626 90.594 106.766 100.383 -79.959 92.600 0.000 128.688 -76.781 # 482 total E -1.47512E+02 rmsd from N 0.000 %NC 0.00 93.006 153.126 141.349 -98.163 92.918 53.194 138.272 41.113 91.216 47.218 106.389 -82.682 91.868 46.783 130.113 -77.005 94.342 44.534 150.301-132.034 92.653 41.808 57.097 -73.237 91.039 46.731 126.380 -33.156 90.956 46.428 130.907-106.292 88.514 49.145 143.613-154.007 88.791 45.296 76.775-104.030 92.406 177.354 130.802 -76.144 95.425 67.355 133.325-159.934 92.019-133.671 101.052 -83.152 109.936-126.116 149.416-178.963 110.812-114.372 155.615 -40.408 92.873 45.479 140.806-101.981 91.886 48.807 137.230 -72.691 91.314 46.081 118.397 -50.623 91.394 44.748 154.441 65.538 92.008 45.667 154.628 -23.342 90.933 46.269 0.000 0.000 89.159 51.040 141.408 -19.054 88.904 51.530 140.791 -99.954 89.729 45.940 123.617-134.717 86.652 57.696 110.028 -71.700 89.549 57.329 138.714 -51.120 88.881 47.837 138.864-149.894 94.620 -88.809 149.966 -27.025 134.175 152.082 153.692 -11.080 98.249 -71.590 98.042 -94.358 89.939 -52.420 110.365 -75.579 88.332 -67.763 112.680 -46.427 86.011 -55.970 106.103 -68.246 91.367 -30.545 127.466 -76.145 97.551 -42.728 96.769 -78.331 95.211 -14.411 145.428 -17.168 109.713 -45.143 139.853 -74.201 93.938 -30.003 129.484 -76.794 99.868-152.350 80.497 -78.815 91.703 54.175 131.089 -77.765 90.765 50.411 141.536-109.068 90.352 57.333 126.228 0.022 91.347-125.331 135.242 -51.478 98.583 25.817 136.181-135.343 130.345 101.839 104.943 -77.292 92.599 0.000 129.675 -76.725 # 483 total E -1.47335E+02 rmsd from N 0.000 %NC 0.00 92.484 134.774 119.842 -39.084 94.359 60.162 153.100 32.617 98.010 35.772 106.204 -80.398 93.071 47.254 130.596 -75.994 94.576 40.708 140.879 -24.672 91.947 46.755 57.726 -73.803 89.516 50.713 120.895 -36.780 91.381 42.567 125.604 -99.138 89.606 48.796 157.067-172.908 88.767 50.965 75.014-104.374 93.150 172.004 122.869 -69.556 93.798 53.763 131.024-155.032 122.947-151.565 100.209 -85.020 117.715-177.812 163.315-157.654 117.955-100.287 155.060 -24.516 94.443 44.485 144.068-100.301 92.509 45.365 136.260 -72.811 90.668 51.003 126.648 -35.202 89.791 48.095 151.913 4.549 92.020 40.053 149.253 -26.824 91.861 45.757 0.000 0.000 88.360 57.193 129.873 -43.574 88.502 53.789 130.734 -78.576 88.754 42.243 127.154-125.339 90.252 48.227 105.922 -72.237 91.868 43.014 136.415 -56.333 93.666 51.285 137.998-126.469 93.607 11.901 141.945-127.406 117.182 5.046 160.429 -13.964 136.817 -42.082 112.092-102.461 144.338 -44.932 121.656 -83.913 113.018-111.049 130.988 -18.018 96.756 36.021 113.592 -74.727 93.705 55.881 129.459 -76.309 93.598 22.743 101.737 -77.739 104.390 106.772 139.586 -4.520 78.044 -75.530 149.871-133.869 91.883 -41.091 130.651 -78.278 94.503-117.360 121.767-132.176 90.263 50.205 131.187 -77.117 90.788 50.064 140.510-101.378 90.057 45.466 117.366 -13.599 91.448 55.025 148.986 -25.732 88.714 36.732 140.925-153.604 97.114 79.560 103.689 -79.681 92.509 0.000 128.973 -76.588 # 484 total E -1.49606E+02 rmsd from N 0.000 %NC 0.00 93.248 175.075 137.104 -90.077 93.838 58.942 131.030 53.782 93.139 40.193 104.713 -79.735 91.953 49.467 130.287 -76.434 90.061 45.297 152.257-165.296 93.018 40.959 60.560 -65.376 92.372 41.599 123.273 -28.954 89.700 46.575 139.319-104.958 91.067 51.318 113.610 -91.424 88.310 41.321 95.495 -90.259 93.892 164.079 128.876 -85.256 93.636 85.681 134.799-162.553 92.958 179.814 101.117 -87.139 105.330 153.888 152.383-166.524 124.001 -88.219 156.664 -19.700 94.826 46.299 147.146-100.435 92.942 43.116 136.944 -74.316 90.869 51.193 130.611 -65.228 89.666 49.341 159.184 -75.674 91.306 41.963 149.554 -22.149 91.093 45.693 0.000 0.000 88.712 61.623 107.690 -82.264 88.482 49.871 139.141 -80.408 90.425 39.650 120.022-124.032 91.412 48.717 109.899 -75.828 90.989 54.145 141.053 -92.469 90.844 51.369 140.669-124.233 92.244 19.481 151.400 -25.178 114.116 -10.871 158.808 -16.559 138.064 -54.182 108.510 -95.840 132.443 -46.763 119.220 -80.328 123.115-132.645 131.201 4.037 93.605 51.048 115.256 -69.125 91.942 41.337 128.939 -76.285 91.484 43.117 109.450 -85.916 91.768 43.151 118.365 -88.007 91.695 49.123 132.814 -88.862 89.819 49.417 128.325 -77.151 90.689 63.264 94.036 -74.962 92.116-105.851 127.393 -75.264 95.899 -31.185 141.859-116.819 91.883 -53.845 116.587 16.042 92.300 -52.843 152.038 -31.583 91.004 -45.226 139.692-150.345 96.465 100.733 104.165 -79.310 92.420 0.000 129.181 -75.925 # 485 total E -1.46894E+02 rmsd from N 0.000 %NC 0.00 92.744 143.233 135.779 -78.814 93.554 49.384 123.740 -31.995 94.285 45.830 108.069 -80.281 92.720 42.643 127.891 -75.232 90.377 50.436 101.364 -65.466 90.558 41.529 98.389 -64.843 92.202 42.215 115.605 -75.700 96.444 34.161 104.566 -91.365 90.601 51.729 146.971 -79.496 90.486 38.326 87.873-101.474 94.354 46.021 140.524-109.261 106.647 -7.186 92.453-104.307 105.798 63.970 109.056 -83.755 91.743 102.981 130.874 -96.527 96.203 29.466 132.725-142.890 95.073 55.922 138.949-104.556 95.220 34.748 129.035 -85.120 101.009-101.672 157.103-143.244 108.803-110.837 122.799 -57.315 93.596 68.791 152.979 -12.062 94.295 41.831 0.000 0.000 91.512 49.024 118.715 -79.682 89.387 48.458 147.113 -98.224 88.155 63.138 130.137 171.473 84.812 64.269 106.651 -77.129 89.243 45.663 133.024 -84.125 92.021 54.477 145.886-169.300 93.227 -89.679 104.224 -84.663 114.673 166.322 158.604-145.291 133.325-177.624 110.636-104.987 96.408 45.283 115.180 -77.345 93.604 44.629 107.914 -27.956 92.645 44.145 124.083 -20.799 91.419 47.682 130.793 -76.831 91.098 40.976 101.926 -84.833 91.417 43.724 119.026 -54.297 90.026 53.847 140.781 -55.492 89.004 45.864 129.397 -77.816 91.069 117.827 103.853-102.930 90.733 -50.043 129.690 -78.118 91.246 -51.005 144.102-123.575 87.894 -52.248 127.367 -10.787 91.141 -51.116 167.626-144.421 90.883 -41.178 122.439-135.638 97.703 151.976 103.984 -78.873 124.695 0.000 144.594 -86.848 # 486 total E -1.52482E+02 rmsd from N 0.000 %NC 0.00 93.025 155.992 138.733 -90.203 93.344 55.488 141.295 33.661 92.899 45.094 105.598 -81.648 92.284 44.532 130.878 -77.343 94.627 48.931 146.817-112.505 92.058 39.187 57.715 -74.492 92.509 45.067 128.187 -31.527 93.206 41.002 128.955-107.080 90.290 53.630 144.663-163.521 89.223 78.693 83.834-104.941 90.348-157.307 138.042-101.445 94.099 69.901 97.705-124.891 92.397 44.898 101.256 -81.215 94.167 99.753 136.680 -41.876 96.894 53.106 134.458-137.409 121.872 -6.102 152.251-143.873 97.722 49.524 138.846 -80.443 95.649 38.759 166.771-133.833 93.573 46.514 123.539 124.612 93.293 37.973 108.666 -83.861 95.221 40.210 0.000 0.000 91.578 47.788 150.666-163.218 90.375 47.047 133.145-102.305 90.577 42.558 119.664-127.080 89.243 49.823 117.533 -78.188 90.397 49.619 136.055-111.181 90.609 48.235 128.019-152.460 93.651-100.863 103.357 -82.696 115.835-178.950 151.992 -17.042 129.523 -57.761 112.097-108.509 107.914 -26.362 112.493 -79.570 93.672 -46.355 112.717 -54.687 91.895 -44.490 110.075 -73.002 90.614 -49.008 128.215 -77.173 88.441 -43.498 103.481 -80.294 88.698 -50.003 144.255 -39.088 90.010 -51.423 152.902-138.217 88.729 -45.620 128.997 -77.315 93.570-122.291 135.775 4.920 89.312 55.886 133.600 -77.694 91.178 45.471 141.924-107.510 89.660 47.143 129.953 -35.225 89.832 68.043 142.652 -43.000 87.384 52.111 135.225-139.429 91.660 106.793 101.195 -80.070 92.612 0.000 128.576 -76.836 # 487 total E -1.47015E+02 rmsd from N 0.000 %NC 0.00 93.127 -88.727 120.956 -58.058 114.236-105.628 132.459 -28.540 92.881 47.195 108.532 -76.552 92.217 47.700 131.749 -78.056 92.272 47.006 144.701-135.781 93.260 43.279 55.707 -67.794 90.165 45.765 132.326 -29.130 88.659 52.963 129.292-123.721 86.912 52.035 125.714-130.346 87.600 47.331 80.913 -99.825 89.867 171.732 134.703 -79.020 97.443 99.060 134.074-161.170 87.210 79.631 104.656 -84.915 104.239-113.598 125.721 -91.719 100.767-113.625 152.117 -27.740 94.593 43.740 138.782 167.109 92.209 48.585 136.607 -85.893 90.416 49.137 115.243 -62.874 91.861 50.190 94.522 -45.346 91.233 42.295 114.584 -80.206 91.529 43.503 0.000 0.000 90.624 53.564 105.858 -81.358 88.308 48.034 140.789 -75.486 89.857 41.380 122.064-130.864 90.783 48.238 107.994 -75.449 90.952 44.681 135.584 -80.573 93.258 48.425 138.663-137.450 94.584 17.111 112.246 -92.540 112.782 7.980 159.283-126.840 131.354 66.530 113.663-110.734 153.200-162.470 134.170 -89.718 133.728 16.007 133.147 -96.557 122.576-101.708 115.018 -77.566 92.223 51.086 131.549 -77.004 89.717 44.335 104.215 -83.220 89.189 54.834 118.078 -19.914 89.073 49.512 135.321 -48.052 89.646 41.600 129.835 -77.263 92.636 123.322 116.098-111.637 90.221 -49.866 130.417 -78.409 90.695 -49.619 143.165-120.480 88.270 -47.364 131.602 17.416 91.593 -48.221 162.671-165.530 91.524 -46.252 125.204-114.185 93.258 118.468 103.395 -79.305 92.588 0.000 128.652 -76.413 # 488 total E -1.49234E+02 rmsd from N 0.000 %NC 0.00 92.526 128.989 125.596 -52.954 94.592 48.274 138.074 8.821 93.725 42.937 109.274 -80.057 91.788 47.294 128.131 -74.823 90.848 43.779 124.266 -25.778 90.553 46.817 85.133 -58.163 89.080 45.643 119.111 -65.857 92.030 41.531 121.938 -96.963 90.737 43.874 137.532 -30.353 90.637 38.489 124.676-119.743 97.978 41.758 117.784-132.075 100.365 25.807 92.208-101.149 95.179 47.912 143.993-131.365 92.028 46.837 109.103-127.062 89.519 48.524 126.552-130.545 90.828 53.312 121.636-123.085 93.443-116.499 118.912 -78.939 101.804 132.933 142.033-110.160 120.108 173.860 127.512 -76.292 96.595 71.452 147.112-158.415 95.418 42.709 0.000 0.000 90.358 46.741 142.867 -9.644 92.507 45.657 131.936-104.490 89.478 48.763 118.999-125.770 88.097 53.378 108.977 -79.504 89.840 52.175 136.691 -46.196 91.024 44.207 139.469-144.095 95.721 -99.067 152.532 -31.150 109.479-178.443 114.588 -76.385 111.021 -19.531 94.444-104.518 139.112 -51.537 121.635 -82.193 97.749-112.191 120.780 -65.215 92.372 51.368 123.992 -10.209 91.811 49.263 130.411 -76.276 89.980 42.482 144.356 -22.337 89.802 48.944 117.317 -32.884 88.975 51.372 146.906 -41.614 88.559 45.160 128.147 -76.796 88.277 51.060 113.501 -49.385 89.503 48.970 129.042 -75.970 89.114 45.598 147.661-127.350 89.307 48.109 130.449 -44.280 89.198 54.675 136.586 -56.121 89.652 43.924 136.193-127.589 94.758 80.859 103.958 -80.927 92.586 0.000 128.841 -76.690 # 489 total E -1.50062E+02 rmsd from N 0.000 %NC 0.00 93.468-102.184 132.985 -93.748 96.243 -36.245 148.596-130.126 99.822-100.703 112.951 -77.628 90.953 65.819 129.826 -76.892 94.575 56.394 145.817-137.403 94.076 36.430 53.250 -69.282 93.123 46.755 127.682 -23.579 92.749 41.885 130.905-109.770 91.174 51.901 147.559-165.099 87.868 45.935 76.040-103.081 94.778 151.250 132.246 -75.063 89.187 78.735 106.670-131.068 94.530 112.773 99.165 -81.720 91.090 -63.107 139.594 -54.008 93.527-121.606 113.018 -82.742 90.037 49.559 136.070 120.991 91.989 47.342 136.443 -86.206 91.513 43.639 149.928 -9.702 90.728 47.812 138.590 -26.044 88.965 50.119 110.862 -83.087 90.220 44.165 0.000 0.000 89.166 47.493 124.837 -79.045 90.841 44.811 127.595 -90.686 89.058 46.694 122.906-120.991 88.577 49.677 111.185 -81.798 90.196 49.808 137.450-106.895 92.290 47.832 131.899-126.137 94.990-106.248 141.841-121.809 102.375-166.815 150.294-131.069 135.971 -52.986 108.582-100.902 100.816 -25.705 113.108 -77.963 94.681 -48.145 113.241 -59.360 96.988 -34.431 113.752 -70.624 95.102 -43.520 128.303 -76.696 94.123 -33.463 105.386 -88.395 91.516 -52.270 101.105 -63.706 87.918 -55.851 150.746 -28.496 89.003 -49.854 129.771 -77.052 93.118-135.244 121.659-127.814 90.367 55.976 132.222 -76.443 91.035 43.814 139.711-102.763 90.807 44.441 119.728 -12.384 91.145 56.267 145.204 -44.352 89.105 45.765 136.610-136.180 93.591 102.934 146.762 -24.006 92.606 0.000 128.771 -76.615 # 490 total E -1.51577E+02 rmsd from N 0.000 %NC 0.00 93.211 164.512 140.870-100.092 93.733 54.755 139.453 24.990 92.573 44.980 106.206 -82.297 91.876 47.287 131.365 -77.506 93.502 47.383 141.072-117.050 91.094 42.789 59.525 -73.493 90.830 45.546 127.333 -35.582 92.150 44.904 120.884-107.221 88.970 46.630 143.106-144.833 92.060 84.000 82.180-103.586 91.850 -57.683 139.692 -98.783 105.174 -74.042 91.194 -83.349 91.605-110.849 145.190 9.676 92.279 49.679 143.064-140.212 95.042 57.618 109.222 -87.518 93.282 19.668 130.221 -82.168 105.279-149.851 152.106 -14.139 140.090 -61.298 119.785 78.348 120.116 46.770 173.176 175.103 96.418 41.947 140.214-176.048 94.335 40.098 0.000 0.000 92.473 49.057 109.452 -83.683 89.871 48.245 149.027 -81.586 91.130 41.117 117.264-128.449 90.218 47.814 111.851 -77.153 90.395 61.326 141.119-102.800 89.978 45.385 145.474-137.219 91.784 38.727 142.784-129.013 101.167 -7.876 115.149 -90.619 138.223-157.300 104.513 -89.657 94.838 54.089 114.902 -76.715 92.038 52.123 94.942 -26.310 89.850 51.127 129.575 -16.524 91.245 49.728 130.329 -76.687 91.075 39.156 101.617 -83.106 91.261 47.281 118.415 -55.158 92.126 74.641 135.248 -42.378 87.761 58.108 130.741 -78.166 88.322 166.454 79.987 -95.188 92.498 60.384 163.698 -93.404 91.814 41.370 140.312 -98.591 90.967 47.812 123.207 -25.621 91.351 69.168 145.188 -45.240 87.593 53.755 140.807-157.523 91.845 99.353 100.905 -79.574 92.573 0.000 128.665 -76.649 # 491 total E -1.50030E+02 rmsd from N 0.000 %NC 0.00 93.114 153.578 142.128-101.674 93.573 52.421 141.637 39.999 91.172 47.316 105.966 -82.451 91.681 50.194 130.196 -77.500 94.242 47.091 150.216-134.524 91.714 42.800 63.385 -83.087 90.507 45.958 127.147 -57.769 91.233 53.614 124.571-114.369 86.428 56.311 141.570-174.004 86.939 171.352 79.464 -90.594 94.276 72.105 156.689-162.507 94.525 38.885 92.811-123.388 93.185 45.271 102.196 -80.604 92.132 56.933 142.029 -33.824 90.270 44.221 109.631 -93.984 93.418 36.412 136.670-102.252 102.035 -37.000 123.234 -72.502 134.935 167.969 116.186 -51.650 96.344 51.143 168.109-106.223 98.738 34.394 142.272-136.113 102.245 32.199 0.000 0.000 95.551 43.712 149.247 -1.916 93.089 46.213 165.692-134.358 90.272 48.285 112.360-141.990 89.816 46.349 109.268 -74.183 91.473 46.700 139.508 -43.149 92.720 38.746 136.539-139.640 94.364 52.924 113.752 -89.369 94.593 14.663 139.672 -95.628 131.993-164.300 114.123-109.440 92.367 53.109 114.832 -76.809 92.239 145.916 101.539 -8.365 92.665 -43.167 112.851 -78.737 91.830 -48.197 126.013 -74.855 90.983 -38.415 101.622 -79.813 92.588 -43.172 147.836 -39.524 90.957 -52.754 156.926-144.433 90.248 -40.843 131.116 -78.189 94.428-125.435 133.817 24.795 92.419 48.979 131.478 -77.724 92.548 51.363 141.779-112.993 92.795 67.728 128.334 -38.374 93.668 -94.744 129.759 -75.567 100.535 -25.078 103.482 -84.977 120.905 133.218 100.106 -71.882 92.647 0.000 129.481 -76.546 # 492 total E -1.46841E+02 rmsd from N 0.000 %NC 0.00 93.106 -74.034 122.723 -61.690 117.153-103.908 131.197 -31.801 93.488 40.457 107.921 -80.647 93.433 54.439 131.356 -76.482 90.470 40.266 152.853-150.050 89.912 46.828 66.222 -80.673 90.335 45.785 114.708 -48.609 88.451 44.280 140.673 -90.415 91.023 44.055 115.431-106.155 90.762 50.066 90.343 -90.837 91.285 168.685 129.036 -79.497 92.616 97.073 129.515-156.437 93.693 110.475 105.429 -82.426 89.927 -61.247 139.190-104.667 95.951-124.144 152.106 -27.326 91.341 46.620 129.413 113.267 90.742 50.109 136.803 -83.716 91.667 43.694 123.994 -67.141 92.590 43.796 134.613 -14.551 92.415 42.219 107.711 -82.834 90.760 48.841 0.000 0.000 91.553 41.570 103.947 -84.818 92.227 46.452 149.276 -77.192 91.980 40.728 117.940-129.595 89.973 49.920 115.736 -78.750 90.940 48.342 134.699-106.858 91.650 61.535 134.560-165.085 92.090 -74.106 105.891 -86.242 129.041 156.621 169.130-167.236 131.659 -66.720 111.210-105.880 106.930 -25.990 112.307 -79.298 92.413 -49.194 110.503 -50.923 90.271 -47.514 112.349 -73.128 90.435 -47.304 127.769 -76.846 87.498 -43.802 101.914 -80.041 88.227 -57.081 127.822 -37.912 86.723 -52.614 141.663 -52.931 88.843 -46.478 127.666 -75.824 87.009 -52.336 120.810 -26.196 89.328 -54.810 128.392 -75.585 87.947 -42.960 142.985-141.172 89.025 -49.994 128.307 -22.333 89.205 -55.056 149.908 -15.526 91.087 -43.500 141.532 175.508 96.098 92.739 104.540 -80.417 92.604 0.000 128.959 -76.355 # 493 total E -1.46825E+02 rmsd from N 0.000 %NC 0.00 93.249 -72.943 126.893 -72.057 119.729-101.996 130.566 -32.717 92.839 42.649 109.208 -80.825 93.642 50.582 130.313 -76.889 93.148 41.461 149.475-135.901 89.742 45.587 67.237 -91.343 90.566 44.121 111.675 -54.819 91.129 42.869 137.656 -85.485 90.784 43.157 132.191-115.892 90.892 47.547 85.232 -99.417 92.113 162.034 129.487 -82.417 91.036 90.589 131.157-159.352 91.785 112.844 101.914 -83.357 90.178 -63.196 130.150 -93.315 95.378-124.715 150.792 -36.113 90.732 47.414 137.516 117.680 91.277 49.297 136.565 -83.920 91.435 44.500 129.475 -54.660 91.665 45.316 124.807 -19.428 90.381 46.532 108.314 -82.809 90.174 48.464 0.000 0.000 91.086 42.364 109.980 -84.781 91.835 44.582 143.785 -83.469 92.063 43.406 118.955-126.997 89.531 50.226 117.768 -76.591 90.879 43.842 132.460-105.541 92.186 48.153 130.643-150.242 95.476 -64.035 104.953 -85.236 132.284 134.851 172.227-171.773 113.281-104.004 124.991-136.876 126.875 8.161 124.384 -82.832 101.575-145.774 132.679-134.952 97.493 47.822 115.039 -72.390 94.092 40.833 130.194 -77.342 91.214 48.371 117.024 -89.741 90.394 47.843 115.412 -99.911 89.857 58.456 130.672 -90.867 88.676 46.964 128.431 -77.158 92.403 164.097 87.427 -91.435 91.722 58.728 133.247 -77.783 90.938 42.730 140.483-101.434 89.877 50.535 126.413 -27.656 90.327 64.281 143.118 -45.737 87.201 44.927 141.315-153.510 94.025 92.061 103.079 -79.842 92.553 0.000 128.925 -76.551 # 494 total E -1.46767E+02 rmsd from N 0.000 %NC 0.00 93.247 -79.785 121.436 -58.363 118.748-102.833 129.922 -44.029 92.998 42.890 108.132 -82.412 92.979 49.704 130.327 -77.774 91.558 51.897 154.780-163.984 86.690 53.991 70.907 -79.662 91.040 40.299 104.639 -53.390 91.887 44.745 151.155 -69.252 89.996 43.578 138.117-135.411 91.041 48.462 79.291-101.027 90.767 153.321 135.631 -80.194 91.793 91.387 129.032-156.063 90.242 110.823 100.232 -84.152 90.550 -68.630 141.335 -96.129 95.578-122.217 150.967 -37.072 91.271 45.650 141.622 137.884 91.618 48.558 135.885 -84.970 90.964 47.329 126.586 -46.097 89.546 48.335 118.566 -31.788 88.183 49.368 110.068 -82.829 90.727 44.732 0.000 0.000 89.666 45.249 124.740 -77.871 90.958 44.039 136.982 -90.463 91.318 45.871 121.574-126.785 88.120 50.163 115.407 -77.859 90.516 47.238 129.227-102.330 91.151 50.092 131.271-148.705 94.142 -83.564 104.127 -84.642 123.398 153.433 164.532-157.755 123.403 -46.280 115.332-117.700 105.074 -50.646 114.059 -80.578 108.772-115.036 132.592 -21.950 92.071 47.857 111.993 -71.191 92.140 49.154 130.336 -77.292 92.340 40.097 104.198 -81.313 90.819 47.583 143.148 -27.627 90.075 48.967 137.134-103.750 89.708 40.181 128.331 -77.058 90.005 48.549 115.058 -42.076 91.535 43.316 127.463 -75.868 92.199 45.252 138.678-168.356 94.025 80.349 130.870 -52.267 89.260 -81.808 137.740 -83.177 94.696 -41.484 134.724-136.919 105.790-111.926 108.314 -74.214 92.929 0.000 129.224 -76.996 # 495 total E -1.47431E+02 rmsd from N 0.000 %NC 0.00 93.171 -69.887 126.165 -74.011 93.535 -52.244 111.504 -73.589 92.606 -39.106 104.261 -76.352 93.188 -44.723 127.275 -75.034 99.644 -15.660 143.171-118.910 106.204 -35.626 58.326 -73.849 95.710 -24.520 125.366 -61.393 107.821 -30.344 133.773 -91.029 101.177 -44.059 135.020-108.840 91.307 47.081 119.015-134.048 142.359 -46.572 134.756-141.945 130.018 -75.376 109.451-105.360 126.790 -83.990 110.477 -83.313 129.268 137.285 171.069 177.613 104.387 -99.739 141.136-156.811 93.859 49.337 141.397 149.976 92.015 45.695 134.059 -85.648 90.363 51.889 119.520 -56.491 89.779 49.622 112.936 -33.088 88.735 45.376 108.016 -81.858 90.111 47.777 0.000 0.000 91.365 45.580 109.676 -82.001 90.028 44.161 147.890 -83.703 91.958 44.473 117.442-127.941 89.343 50.309 112.199 -77.690 89.969 53.679 131.773 -97.449 90.696 55.585 133.672-141.350 94.865 -20.866 107.708 -88.796 136.905 109.873 176.417 179.370 130.934 -61.078 113.192-109.132 100.036 -38.340 112.750 -78.562 96.814-147.489 142.078-137.983 93.434 58.337 117.682 -73.303 90.638 45.446 128.661 -75.816 90.484 43.985 104.167 -81.835 92.068 42.573 124.207 -74.214 92.577 45.324 133.928 -84.555 91.459 46.017 128.409 -77.120 92.457 79.039 99.442 -78.644 90.503 -87.702 128.884 -76.330 95.058 -41.679 142.001-108.502 93.767 -39.275 113.619 28.459 95.081 -58.254 142.068 -46.866 91.462 -43.411 140.629-153.566 97.878 46.504 98.826 -81.099 92.475 0.000 129.286 -76.333 # 496 total E -1.48479E+02 rmsd from N 0.000 %NC 0.00 93.222 -81.325 124.849 -66.912 121.063-105.301 129.379 -33.526 91.343 49.085 109.571 -73.880 94.900 41.118 131.597 -78.260 98.532 36.517 144.073-121.003 94.821 38.957 48.960 -80.609 92.830 46.780 171.665 -89.444 91.181 42.485 142.363 -87.221 91.208 41.753 135.660-126.718 91.548 46.413 84.487-102.005 92.315 158.152 131.459 -87.537 91.816 90.891 130.514-158.332 91.551 110.842 101.040 -85.815 90.995 -67.137 132.438-100.350 96.255-122.973 151.670 -31.953 91.625 46.143 140.735 134.389 91.416 48.865 136.531 -84.624 90.731 46.527 123.682 -58.578 91.129 47.103 118.950 -29.221 90.732 44.733 109.147 -82.775 90.866 44.874 0.000 0.000 90.054 50.616 110.552 -80.744 88.987 46.239 141.281 -78.106 89.127 44.013 120.696-126.570 89.779 49.153 111.151 -79.466 89.969 48.118 139.599-103.302 91.809 49.153 134.307-119.290 93.674-104.504 103.958 -83.628 107.036-162.037 154.434-136.199 129.438-117.898 114.217-112.867 123.458 70.537 119.348 -81.347 93.016 -56.720 111.099 -60.702 93.913 -38.214 110.014 -72.710 92.653 -47.317 126.842 -74.977 89.945 -39.868 109.924 -93.087 89.383 -59.232 97.610 -73.963 85.027 -57.365 144.702 -26.087 90.009 -40.122 130.452 -77.183 96.474-158.929 110.854-124.461 93.427 47.998 130.309 -75.194 90.714 44.547 139.839-108.999 92.327 71.105 130.924 -6.612 88.926-102.643 152.050-116.687 98.049 -28.168 131.764-153.906 110.496 147.696 106.906 -78.248 92.585 0.000 129.312 -76.348 # 497 total E -1.47142E+02 rmsd from N 0.000 %NC 0.00 92.788 -26.252 134.056-103.525 98.133 -46.362 116.885 -84.632 91.981 -44.056 103.144 -77.386 90.285 -50.542 128.226 -75.773 89.553 -42.617 139.239-133.644 92.348 -41.489 58.130 -58.324 92.224 -40.857 132.205 31.364 97.530 -42.122 169.132 171.915 91.375 -54.106 125.027-121.925 89.254 -75.030 77.954 -81.092 108.939-174.233 150.906 164.063 98.334 -62.811 95.187-108.593 100.795 168.533 103.030 -81.798 103.777 -97.190 152.211-101.228 96.554-121.100 151.750 -33.085 91.759 47.137 138.978 142.964 91.520 48.182 136.294 -84.747 90.508 47.561 122.805 -56.811 90.427 49.328 117.266 -33.044 89.577 46.397 109.751 -82.161 90.117 46.172 0.000 0.000 89.259 50.383 130.678 -94.387 90.249 45.595 138.980 -91.465 89.641 42.163 120.404-127.334 89.972 50.265 109.819 -81.194 89.571 52.925 137.003-100.892 91.245 48.845 133.251-148.900 92.572-119.732 138.611-108.253 97.087 162.279 148.205 -15.064 132.948 -87.787 108.991-103.655 88.223 65.591 112.408 -75.158 90.719 49.850 117.040 -52.151 90.109 46.476 110.075 -71.018 90.295 41.755 128.031 -75.641 91.285 46.637 103.241 -85.653 92.367 37.960 133.701 -81.552 94.625 48.543 124.791 -92.683 94.077 68.242 128.896 -77.531 98.486-172.770 105.270-116.702 92.376 46.403 129.567 -76.430 90.706 50.533 140.539-102.696 88.678 60.514 127.535 -12.193 89.059 57.879 143.752-106.069 87.943 34.915 133.898-153.748 99.068 82.715 104.196 -76.849 92.388 0.000 129.425 -75.908 # 498 total E -1.46993E+02 rmsd from N 0.000 %NC 0.00 92.613 140.118 128.089 -57.244 93.472 54.730 147.135 38.625 95.178 39.445 105.471 -80.868 93.088 46.901 127.055 -73.963 93.549 43.992 148.116 -30.207 91.092 46.646 60.417 -74.218 89.849 48.137 121.657 -39.304 90.857 42.699 126.400-104.069 90.608 51.276 148.369 161.593 89.942 71.583 84.218-106.904 91.802 -72.350 134.133 -99.516 105.229 -73.471 90.520 -82.122 89.122 -70.260 114.925 -75.487 134.078-153.353 158.975-175.548 106.602-107.171 134.445-158.487 93.063 48.439 138.906-107.328 91.889 50.561 136.421 -74.063 91.603 45.764 131.423 -72.938 92.598 42.503 147.355 3.455 94.833 41.239 141.340-167.326 90.813 46.737 0.000 0.000 89.848 55.785 103.448 -84.419 87.903 46.926 144.539 -73.668 90.649 41.011 118.996-127.530 90.774 55.416 111.471 -77.420 90.200 94.937 138.320-100.293 92.018 38.767 138.936 -92.727 93.451 56.006 143.776-129.528 96.577 24.109 140.171-103.658 124.949-110.375 121.701-125.242 108.827 -2.808 114.076 -79.401 94.204-159.334 109.798 -9.569 108.283 54.447 121.555 -77.315 93.444 41.998 129.645 -76.402 90.713 44.801 116.000 -85.378 93.892 81.499 121.041 -96.345 88.662 -80.505 154.825-137.456 92.746 -46.034 128.895 -77.096 94.927-125.208 123.157-113.020 89.497 55.526 132.888 -77.992 90.886 45.356 140.247 -98.384 89.341 48.402 123.758 -18.384 89.653 61.827 139.757 -50.232 88.126 48.238 144.201-144.400 92.691 104.398 102.603 -79.928 92.513 0.000 128.583 -76.731 # 499 total E -1.50626E+02 rmsd from N 0.000 %NC 0.00 93.078 174.461 132.491 -74.995 93.390 63.163 144.126 58.047 95.160 37.795 106.319 -81.478 92.288 51.238 132.766 -77.377 91.749 40.616 153.183-150.755 91.161 46.341 63.809 -74.026 89.447 45.725 112.359 -46.473 89.906 49.624 139.914 -86.385 88.369 42.451 130.735-123.005 91.127 44.857 84.969-100.512 92.656 107.680 138.913 -93.728 89.950 68.594 131.459-158.528 91.127 46.029 99.200 -83.104 94.566-178.531 117.902 -49.522 121.164 9.539 152.435-170.293 96.753 52.821 136.571 131.751 95.428 35.384 131.597 -85.572 92.640 50.126 145.858 74.788 90.993 47.206 126.092-147.532 90.392 48.193 137.245-179.645 89.162 45.147 0.000 0.000 91.107 50.236 103.764 -79.501 88.378 46.960 153.155 -74.345 91.114 40.986 117.060-130.366 90.424 48.194 111.247 -77.473 89.112 61.309 144.141-104.050 90.055 45.336 143.708-123.822 92.091 39.791 152.579 -22.085 99.062 -2.826 115.371 -88.062 137.446-160.756 101.821 -86.741 95.942 49.473 125.571 36.299 92.149 50.640 104.839 -3.919 90.228 47.813 122.436 -1.628 91.473 47.556 130.278 -76.439 89.935 40.543 138.797-149.152 91.880 44.708 118.833 -22.025 91.872 46.176 136.957 -47.150 89.941 44.653 130.522 -78.107 91.298 120.051 110.132-106.331 89.560 -50.694 130.986 -78.605 92.439 -47.231 145.325 161.253 93.283 -82.244 122.828 10.796 90.395 76.852 154.927 -33.645 94.807 51.009 144.107-151.147 94.015 85.735 95.280 -77.910 92.518 0.000 128.894 -76.570 # 500 total E -1.49668E+02 rmsd from N 0.000 %NC 0.00 93.164-175.765 131.288 -72.160 94.976 63.803 147.573 28.726 96.851 36.131 105.881 -80.164 92.896 50.167 130.067 -75.532 90.860 45.304 139.767 -7.834 90.485 44.481 64.232 -72.486 90.755 47.394 120.597 -34.240 91.398 38.188 131.965-101.945 91.187 56.152 128.627 134.337 86.223 56.959 78.735-105.566 89.777-160.061 123.333 -79.195 97.409 58.318 126.401-148.019 120.801-166.839 103.329 -85.334 95.927 163.577 153.509-164.649 121.854 -95.639 155.749 -21.028 96.408 41.824 153.218 156.884 93.502 42.766 136.281 -82.740 90.697 50.808 119.939 -45.996 91.630 51.035 133.347 -47.226 92.284 37.205 151.595 -15.292 92.279 44.137 0.000 0.000 89.907 59.354 124.450 -51.427 87.293 51.751 138.196 -86.616 88.797 43.134 121.411-127.391 90.534 48.458 105.994 -73.367 90.990 43.491 139.009 -54.699 94.469 46.287 132.604-111.197 95.198 21.825 151.983 -24.511 114.997 -8.252 160.879 -14.272 137.832 -0.001 111.037-100.672 145.707 -69.501 124.596 -82.087 105.483-134.355 137.773 -15.766 93.739 56.727 113.570 -72.597 91.899 46.099 128.932 -75.846 93.587 35.386 104.424 -80.123 94.705 45.263 172.764-149.719 90.300 45.840 135.862-171.441 91.484 41.016 128.113 -76.718 90.683 47.270 124.515 -43.797 90.038 47.415 130.008 -77.636 90.370 47.538 136.581-130.147 89.470 47.525 128.155 -42.358 89.842 54.380 137.135-100.889 89.819 42.575 131.059-121.720 95.566 73.918 104.048 -80.489 92.525 0.000 128.973 -76.689 # 501 total E -1.53552E+02 rmsd from N 0.000 %NC 0.00 93.088 -60.472 128.643 -82.515 94.682 -47.946 115.204 -79.568 91.441 -45.050 103.320 -77.386 90.729 -47.285 128.972 -76.012 90.724 -41.361 139.718-123.991 93.723 -41.166 60.276 -61.127 91.931 -39.527 131.620 26.261 100.758 -37.841 167.734 166.653 92.336 -58.033 117.768-118.109 87.058 -81.888 76.999 -76.620 112.393 179.622 158.915 151.768 92.704 -73.081 95.525-102.582 97.239-178.666 107.835 -83.390 91.755 -74.112 154.018-103.981 93.894-129.863 127.617-169.685 93.354 44.177 136.263 136.558 91.123 48.608 134.093 -87.373 89.872 52.167 130.471 -70.053 90.661 50.153 112.232 -29.707 91.597 39.551 107.570 -81.993 89.784 50.553 0.000 0.000 89.269 60.926 104.008 -85.879 86.519 46.528 144.883 -75.601 89.388 44.249 118.234-127.188 89.054 53.966 109.067 -75.646 89.614 46.745 143.513 -95.890 92.385 42.589 130.463-136.238 96.881 1.615 115.069 -91.230 132.563-146.774 111.196 -72.255 94.937 88.453 137.202-164.645 89.983 51.807 113.444 -76.577 89.249 66.137 125.650 -33.109 88.612 50.229 106.885 -72.032 89.678 43.159 128.701 -76.017 88.081 50.921 101.381 -81.646 89.213 50.523 127.265 -52.504 88.643 43.588 144.441 -93.443 91.168 42.018 128.305 -76.820 89.782 50.404 107.188 -45.502 89.801 49.241 129.119 -77.135 89.432 43.266 136.287-135.880 90.412 48.702 129.758 -43.670 89.548 54.243 136.393 -63.723 89.823 44.029 135.329-123.801 94.957 78.607 104.071 -80.348 92.530 0.000 128.917 -76.689 # 502 total E -1.46713E+02 rmsd from N 0.000 %NC 0.00 122.697 -96.585 150.963 -74.653 95.066 -48.186 116.490 -75.842 90.922 -49.023 103.780 -77.344 91.108 -38.448 128.295 -75.429 94.365 -53.947 148.299-151.683 93.896 -36.853 95.502-100.616 95.359 112.432 101.060 -77.951 97.958 37.273 165.406-159.887 89.072 62.800 131.722 155.035 87.000 56.262 77.450-106.241 90.600-178.833 142.710 -93.557 93.101 91.436 105.802-150.265 89.650 53.967 105.717 -84.045 94.368 123.330 122.227 -81.660 115.373 50.149 147.834-149.484 123.500 -4.028 153.409-142.343 97.195 48.486 137.039 -74.276 95.549 37.656 138.782 -61.100 93.262 47.772 137.218 121.370 91.917 42.115 109.085 -83.524 93.530 40.527 0.000 0.000 90.726 48.099 149.048-149.352 90.554 46.046 124.601-109.551 90.614 42.993 120.288-125.476 89.206 48.560 117.385 -79.251 90.706 49.704 136.362-113.230 90.607 49.215 125.735-151.778 93.471-102.755 103.087 -82.570 113.501-178.276 151.642 -17.319 128.333 -55.791 113.036-111.085 109.136 -24.501 112.901 -79.866 94.095 -45.502 112.216 -54.829 93.286 -41.607 111.506 -71.345 92.471 -44.542 128.126 -76.611 92.392 -37.212 101.348 -80.928 90.394 -46.079 119.600 -29.810 90.880 -55.189 151.055 -27.871 88.499 -52.205 130.718 -77.924 91.517-133.749 137.209 11.306 90.169 54.598 132.934 -77.217 91.035 44.796 142.020-111.772 90.097 46.275 128.848 -36.179 90.413 66.986 143.955 -40.860 87.430 52.164 136.681-140.746 91.679 105.902 101.069 -80.134 92.584 0.000 128.536 -76.802 # 503 total E -1.51965E+02 rmsd from N 0.000 %NC 0.00 93.153 -64.450 128.421 -81.234 94.400 -47.202 116.231 -79.505 90.924 -47.018 103.110 -77.731 90.458 -46.251 129.867 -76.453 92.321 -40.828 142.494-127.185 93.716 -42.399 63.094 -67.881 91.244 -41.485 129.753 37.942 103.479 -40.740 166.644 155.653 92.443 -50.845 128.137-120.131 97.686-108.061 77.713 -83.240 120.864 73.632 156.840 179.264 91.666 63.068 94.239-121.330 94.632 53.242 107.471 -84.053 109.127-114.872 154.343-105.550 110.630-114.700 134.258-160.463 95.044 48.343 141.810 154.603 92.077 46.840 135.729 -85.150 89.951 52.141 123.073 -69.500 92.512 55.103 117.371 -36.755 93.312 38.451 151.528-151.491 89.733 48.556 0.000 0.000 91.102 61.003 100.692 -88.204 86.159 48.798 148.135 -76.346 89.315 44.833 116.194-129.109 89.516 52.205 109.714 -73.895 89.375 49.614 142.292 -95.054 91.547 45.898 133.067-142.398 94.877 -94.030 142.675-124.098 117.334-169.733 154.172 -20.095 98.357 -50.821 99.201-108.891 93.178 -56.542 110.600 -77.375 91.905 -61.152 93.766 -35.675 91.105 115.033 120.361 19.892 92.163 55.388 128.811 -76.054 89.525 48.959 106.471 -80.004 90.319 49.697 140.516 -17.449 88.944 44.490 142.483-108.229 90.975 43.894 128.153 -76.758 89.643 50.481 117.605 -36.716 89.882 48.639 129.368 -76.214 89.879 41.994 135.432-134.315 90.923 48.181 129.847 -42.914 89.780 53.808 139.362 -57.549 89.909 44.155 137.828-132.536 94.743 79.378 104.057 -80.309 92.504 0.000 128.900 -76.702 # 504 total E -1.50388E+02 rmsd from N 0.000 %NC 0.00 93.312 175.274 138.447 -94.592 93.064 58.441 145.674 30.301 93.380 43.152 105.944 -82.281 92.492 47.421 130.732 -76.797 93.558 44.131 142.167-121.472 92.255 40.646 60.338 -75.752 92.855 43.325 121.695 -39.371 92.106 41.112 139.845-100.415 91.485 52.085 139.212-131.443 88.236 50.181 83.849-103.807 91.717 177.151 129.202 -87.196 92.776 73.950 132.070-159.738 91.712 43.806 100.345 -81.806 91.698 53.515 141.316 -33.045 91.631 38.721 130.494-122.200 94.676 48.654 121.915-132.042 95.895 23.415 124.406 -91.115 104.850 151.735 149.971-147.533 106.900 36.434 89.680 133.791 96.494 39.154 142.271-124.479 100.391 29.208 0.000 0.000 106.558 28.024 160.238 174.498 96.279 43.594 163.608 161.509 91.405 44.690 111.349-146.915 90.619 46.116 113.480 -78.614 91.445 47.910 152.405-128.227 92.406 51.109 142.555-128.320 92.746-109.111 140.427-121.196 105.004-168.835 110.068 -79.507 129.123 -55.774 111.669-109.571 106.786 -22.204 112.805 -79.320 94.746 -46.954 111.298 -58.983 94.619 -37.219 114.789 -73.788 92.220 -50.572 127.266 -76.018 89.253 -39.401 108.804 -83.849 90.704 -48.555 116.536 -77.042 88.548 -56.031 150.631-142.864 88.596 -41.722 137.419-128.691 96.130-127.102 120.613 -35.064 92.445 46.326 130.994 -76.241 92.467 52.433 142.988-122.057 92.475 65.377 126.473 -33.905 92.393 -99.848 128.467 -85.267 97.596 -26.769 99.977 -84.811 107.230 -76.675 142.481 -26.450 92.740 0.000 129.514 -76.238 # 505 total E -1.51569E+02 rmsd from N 0.000 %NC 0.00 92.904 147.528 138.044 -86.473 93.257 52.604 128.116 -31.250 92.564 45.181 105.020 -83.552 92.639 46.502 128.286 -75.510 91.237 47.806 111.944 -79.602 90.013 43.883 69.457 -67.724 88.377 49.905 121.900 -44.300 89.485 45.224 112.862 -99.631 89.556 49.173 133.838 -97.846 88.213 49.357 88.716-102.034 91.758-175.214 125.266 -86.549 95.887 91.610 131.887-158.095 91.045 121.463 105.059 -84.019 93.919 -65.047 122.894-107.318 97.432-122.221 151.007 -35.841 91.390 50.226 140.249 127.130 91.490 47.393 137.943 -83.609 90.048 48.463 124.072 -43.165 90.116 50.955 128.251 -23.894 89.280 46.264 149.671 -27.948 89.860 47.814 0.000 0.000 88.662 59.196 118.465 -74.616 87.664 42.346 138.268 -87.510 90.813 47.777 119.701-125.483 88.284 64.755 104.991 -73.757 89.038 56.463 119.932 -69.647 90.535 36.254 143.142-134.748 95.482 43.948 108.394 -86.048 98.206 17.787 154.888 -28.237 123.365 134.923 118.397-119.063 90.338 59.269 116.419 -78.014 91.509 71.230 129.154-105.087 90.793 177.225 110.548 -74.693 91.724 62.009 129.534 -75.806 89.970 42.902 100.831 -80.100 90.918 46.928 149.106 -35.800 89.508 49.334 145.933-120.333 89.876 44.383 128.179 -76.849 89.120 48.779 117.083 -43.044 89.841 48.772 129.816 -77.083 89.823 45.435 136.871 -91.875 89.586 49.030 128.835 -39.441 89.698 54.863 136.541 -58.796 89.551 43.984 136.434-123.367 94.797 80.406 103.863 -80.347 92.536 0.000 128.883 -76.715 # 506 total E -1.50697E+02 rmsd from N 0.000 %NC 0.00 92.779 141.289 135.014 -77.981 94.919 49.186 116.542 66.873 90.665 47.872 138.950 -8.598 90.777 49.079 130.197 -76.463 93.677 116.274 144.578 120.572 82.818 -53.219 71.763 -90.295 95.985 -40.061 118.572 55.912 108.604 -30.573 163.803 -68.178 94.169 -40.344 148.519-139.353 102.351-125.602 137.914 -10.851 108.382 46.720 142.882-155.939 91.796 57.215 96.253-124.909 92.969 74.983 103.925 -85.472 93.790 -80.163 145.957-104.322 104.687-119.246 131.355-147.927 95.271 40.252 149.490-160.302 93.047 46.615 136.503 -88.917 90.697 50.549 147.629-105.775 90.260 51.812 106.450 -57.362 89.980 40.205 107.655 -82.271 91.151 46.045 0.000 0.000 89.620 49.440 119.153-105.092 88.947 50.775 131.442-109.014 88.529 49.832 120.580-134.626 87.952 51.591 107.151 -72.823 90.042 48.914 132.650 -68.706 91.073 48.603 139.137-140.947 94.321 -99.658 104.107 -83.192 114.568-170.575 153.604 -19.293 97.040 -54.542 97.650-106.239 91.644 -48.465 110.763 -74.439 91.604 -72.958 108.632 -47.117 89.313 108.251 116.967 -73.055 93.482 44.906 129.000 -76.704 88.563 48.758 100.350 -75.010 89.931 60.118 140.516 -41.237 87.110 50.007 164.032-143.562 89.594 40.971 128.136 -76.389 91.029 48.346 116.244 -34.285 89.892 46.587 130.801 -77.466 90.185 46.660 140.368-123.458 89.271 50.171 130.117 -43.847 89.258 53.469 134.636 -63.078 90.125 44.512 141.515-131.185 94.780 79.033 104.004 -80.680 92.531 0.000 128.909 -76.689 # 507 total E -1.50610E+02 rmsd from N 0.000 %NC 0.00 92.890 -39.245 132.043 -99.013 94.663 -49.080 120.589 -78.482 91.234 -46.510 103.213 -77.120 90.452 -50.889 126.505 -75.348 88.273 -44.311 144.092-137.933 90.091 -43.226 52.112 -60.784 93.766 -86.603 129.950 1.484 86.619 107.841 146.131-100.923 93.706 59.826 145.901 177.743 88.906 54.723 96.870 -55.664 93.826 152.469 140.790 -53.856 95.625 76.730 125.099-146.433 95.265 111.374 101.339 -81.359 93.054 -70.600 139.157 -50.208 94.529-119.586 141.041-139.023 90.400 50.019 140.211 134.900 92.142 47.290 134.375 -85.767 90.551 45.927 153.349 -8.819 89.884 50.953 135.807 -34.960 88.405 49.242 140.840-135.859 90.539 44.966 0.000 0.000 89.007 49.792 136.487 -89.515 90.220 45.764 127.663 -98.317 88.775 44.829 122.032-124.507 89.749 47.782 110.741 -80.237 90.810 48.722 137.506-101.815 92.719 47.786 130.917-141.760 94.838-104.120 142.206-124.790 104.341-165.985 109.652 -78.804 135.954 -54.818 108.477-100.344 100.019 -26.670 112.581 -77.934 94.479 -49.072 113.095 -58.250 94.169 -39.614 115.332 -72.545 92.123 -48.689 128.603 -77.287 88.667 -44.665 102.840 -82.404 88.078 -55.459 124.092 -74.968 88.695 -51.642 144.014-144.483 89.264 -44.217 128.690 -77.147 95.642-122.769 130.759 -42.092 90.294 54.508 131.717 -76.615 90.441 46.465 143.050-115.053 89.448 48.115 127.771 -30.959 90.395 54.226 138.782 -53.444 89.366 44.130 144.068-138.443 93.785 99.419 102.799 -80.048 92.519 0.000 128.673 -76.753 # 508 total E -1.46553E+02 rmsd from N 0.000 %NC 0.00 93.080 -66.256 126.162 -74.272 94.210 -49.464 114.948 -76.789 91.416 -45.793 103.351 -77.441 91.068 -43.638 130.353 -76.572 93.963 -40.172 140.887-125.853 94.439 -42.371 63.666 -64.378 91.562 -40.836 132.875 -6.513 102.120 -37.553 167.719 156.646 95.028 -56.070 131.621-120.931 99.788-150.788 125.507 -12.211 121.334 50.704 155.440-175.509 94.508 42.660 95.886-122.535 93.045 46.185 101.305 -80.771 92.112 68.255 141.990 -42.121 87.004 56.154 142.023-144.337 90.708 40.499 130.954-110.608 97.169 174.581 132.810 -75.689 143.019 31.770 150.755 83.028 96.866 51.927 131.617 109.547 97.235 36.735 146.683 -26.279 97.449 45.111 0.000 0.000 109.110 7.524 160.581 -3.017 99.935 49.653 172.666-171.061 93.837 42.410 115.710-148.884 90.145 50.139 112.323 -74.479 91.638 51.406 149.028-107.244 90.957 41.546 144.193-163.275 93.550 39.256 115.254 -89.920 103.377 -12.641 117.051 -84.640 140.622-154.976 103.006 -85.040 92.428 56.026 114.648 -76.241 91.378 53.012 98.990 -12.736 88.252 53.854 135.543 -8.088 89.816 46.248 128.755 -76.865 89.671 48.956 103.547 -84.606 88.861 52.476 121.650 -33.217 91.314 43.859 126.559 -60.395 91.756 43.178 129.323 -76.240 92.533 53.182 111.047 -97.472 93.689-125.385 128.235 -76.263 92.317 125.441 139.252-117.926 93.016 54.175 136.420 -51.245 91.945 56.230 149.565 -23.415 89.270 38.349 142.045-146.476 96.290 61.156 102.520 -79.086 92.366 0.000 129.147 -76.306 # 509 total E -1.46924E+02 rmsd from N 0.000 %NC 0.00 92.671 135.231 130.914 -65.357 94.762 47.817 137.903 37.868 92.809 42.399 107.279 -81.702 91.580 52.168 128.239 -74.488 92.293 41.235 149.624 -17.423 91.959 44.438 61.712 -71.505 89.984 46.896 116.349 -35.644 89.388 50.537 131.302 -90.811 87.117 47.470 140.029 -54.342 88.167 46.564 78.068 -94.356 92.043 43.921 134.113 -64.361 96.518 38.383 96.066 -82.910 91.539 40.367 140.843-110.632 104.397 23.356 101.237-110.758 96.569 51.087 134.944-118.126 92.982 99.429 132.798-131.548 88.845 52.753 130.603-132.926 90.795 49.239 136.008 -96.171 95.741-173.229 99.690 -56.139 98.373 81.177 148.681-162.129 96.731 40.898 0.000 0.000 91.022 47.750 144.373 -14.944 91.174 52.862 137.074-106.679 89.192 50.335 120.235-131.945 88.591 48.413 109.484 -74.305 90.584 52.293 133.977 -74.677 90.887 43.570 137.210-142.551 93.713-121.063 140.772-113.372 108.676 171.610 151.309 -12.955 124.359-129.693 119.349-123.736 93.267 58.800 114.275 -76.453 91.959 45.504 104.020 -47.642 90.505 52.121 121.183 -71.234 90.952 39.909 128.626 -76.026 92.435 44.039 102.979 -84.271 90.898 51.016 125.430 -72.733 90.299 55.136 130.725 -87.875 91.787 66.294 131.317 -78.308 94.188-172.496 74.779-100.084 93.113 59.660 130.956 -76.292 91.705 41.507 140.808-107.223 89.881 52.250 133.040 -29.328 90.759 63.399 143.065 -48.025 86.820 41.268 141.335-153.614 95.165 86.943 102.961 -79.620 92.449 0.000 128.965 -76.389 # 510 total E -1.47149E+02 rmsd from N 0.000 %NC 0.00 93.008 -60.831 122.175 -63.781 94.005 -50.911 115.209 -73.212 91.975 -44.368 104.167 -77.899 91.225 -45.186 129.105 -76.810 89.079 -50.113 130.305-112.862 87.790 -50.596 67.060 -51.696 90.499 -38.731 127.055 30.813 96.432 -39.687 137.950 -78.270 92.690 -45.439 141.117-116.889 91.316 -68.995 83.809 -80.495 101.333-148.688 159.174-149.349 90.034 -71.853 103.157-130.778 98.827 161.453 113.306 -79.957 123.947 -99.540 155.226-102.236 96.634-122.585 150.714 -37.679 93.370 47.106 139.525 147.703 92.390 47.180 136.010 -84.538 91.214 46.224 122.810 -45.030 91.046 49.308 105.080 -32.468 89.428 47.621 108.821 -81.133 90.020 46.071 0.000 0.000 90.743 49.378 110.979 -76.592 89.060 43.316 146.268 -78.154 90.514 45.013 118.515-126.702 89.560 49.236 107.990 -75.325 90.256 49.474 135.011 -85.028 91.647 38.190 130.705-132.922 93.904 54.210 143.793-129.429 95.596 -56.173 112.157 -90.237 128.641 -80.494 108.536-104.110 93.891 4.327 113.424 -76.277 110.926-162.712 130.904 27.865 117.991 -16.326 117.122 -77.835 94.072 -48.228 126.426 -75.153 97.308 -28.712 101.566 -81.044 94.871 -45.931 111.900 -53.157 90.016 -46.750 148.644 -42.342 91.364 -49.326 128.793 -76.401 89.957 -40.854 127.859 -14.484 92.447 -48.053 128.030 -76.315 91.424 -40.864 144.210-136.108 89.281 -48.393 124.508 -9.966 91.042 -52.925 152.687 -21.944 90.802 -44.326 142.527-162.285 96.104 95.528 104.748 -79.714 92.393 0.000 128.990 -76.347 # 511 total E -1.49214E+02 rmsd from N 0.000 %NC 0.00 93.067 155.575 140.158 -94.793 93.166 55.006 142.825 39.174 91.695 46.532 106.495 -83.427 92.394 47.583 130.092 -76.843 93.962 43.762 148.373-126.378 91.608 42.773 60.409 -75.962 90.978 46.134 122.389 -39.070 91.428 44.014 129.092 -98.885 89.151 48.231 148.153-151.821 89.171 47.251 77.646-104.747 91.771 177.904 127.510 -76.612 96.312 83.496 132.607-158.517 94.801-176.786 104.288 -83.767 122.959-113.423 155.678-147.882 114.660-101.503 154.341 -29.216 93.655 45.420 142.696 -99.373 91.732 47.164 135.616 -72.761 90.401 51.619 136.096 20.725 89.068 47.574 151.861 9.840 89.745 45.496 151.115 -27.834 90.170 48.850 0.000 0.000 88.457 48.848 133.181 -37.490 89.614 48.963 132.778 -84.910 88.529 49.722 127.094-126.647 88.960 47.185 107.229 -76.667 90.771 48.234 139.103 -79.595 91.932 50.040 133.738-141.815 94.216 -96.059 102.504 -82.611 111.043-175.955 151.482 -15.644 132.611 -28.165 114.500-111.232 112.795 -17.789 116.836 -82.927 96.466-148.982 93.152 -55.234 95.211 44.713 136.241 157.873 93.748 42.764 129.376 -76.079 92.494 41.484 150.746 -9.114 90.615 53.712 143.563 -32.442 88.498 48.684 142.472-108.511 90.573 38.290 127.738 -76.502 91.103 49.410 121.175 -99.307 89.844 52.742 130.351 -78.058 89.148 46.456 139.672-137.320 91.057 85.535 129.297 -43.145 89.313 -93.233 135.970 -59.285 97.792 -16.127 109.925 -85.568 120.998 143.468 98.914 -71.611 92.683 0.000 129.383 -76.517 # 512 total E -1.49349E+02 rmsd from N 0.000 %NC 0.00 93.289 -80.085 128.360 -80.448 93.248 -51.175 116.289 -70.846 91.872 -42.836 102.110 -76.493 92.467 -46.758 126.563 -74.234 100.672 -12.010 151.942-150.569 106.102 -38.762 61.491 -88.338 95.958 -22.036 141.862 -30.280 110.588 -34.690 133.562 -91.722 93.399 -46.442 148.392-148.785 92.986 -44.890 94.737 -79.886 107.972 122.133 150.978-178.465 96.371-140.638 98.648-117.934 113.521-178.638 110.178 -85.786 133.311 -82.650 146.893-137.138 97.371-118.791 110.168 -85.946 94.318 49.129 140.522 148.494 93.229 45.133 136.192 -85.769 90.979 48.149 126.210 -42.420 90.477 54.202 125.483 -36.996 89.260 47.598 110.128 -82.602 90.397 42.555 0.000 0.000 89.689 56.466 112.253 -81.416 87.563 48.569 135.978 -83.220 89.427 44.760 121.971-125.647 89.409 49.436 109.052 -76.063 89.616 51.083 135.154 -88.963 90.546 45.353 133.734-136.914 91.367 48.275 142.309-126.665 96.332 -90.338 108.225 -83.291 125.168-163.989 109.768-108.411 142.064 41.876 176.428 -67.935 94.236 70.053 145.321 123.228 121.098 47.543 116.055 -78.411 93.212 -65.511 127.059 -75.223 93.232 -33.740 100.004 -78.667 90.098 -52.769 141.098 -41.272 89.765 -44.889 141.910 -82.028 91.114 -43.932 128.276 -76.552 88.786 -47.799 122.868 -14.538 90.745 -53.430 128.885 -76.952 90.144 -40.045 148.750-134.581 89.622 -49.744 123.552 -11.168 95.854-100.655 154.364 -13.749 93.193 -56.555 137.889-138.550 96.245 59.906 102.228 -79.605 92.442 0.000 129.304 -76.297 # 513 total E -1.51057E+02 rmsd from N 0.000 %NC 0.00 93.160 -66.796 129.737 -85.374 94.652 -45.739 117.759 -84.136 90.357 -48.363 103.166 -77.292 89.817 -49.026 128.643 -75.748 89.834 -42.591 138.925-126.877 91.827 -42.703 63.553 -59.255 90.253 -44.610 127.786 -23.761 96.525 -43.140 162.986-137.482 89.121 -48.466 134.225-119.628 93.053 97.559 98.720-101.565 124.341 -78.071 138.430-107.271 128.134 -75.565 98.861 -89.416 96.358 -49.406 154.480 -1.781 133.607 177.981 172.974-164.901 104.528-113.400 136.530-161.861 93.676 47.551 139.942 132.713 90.905 48.630 135.133 -83.847 90.179 50.986 120.255 -69.665 91.048 47.473 130.406 -27.661 92.781 41.589 145.539-165.827 90.770 45.132 0.000 0.000 90.847 55.288 103.340 -85.822 87.729 49.628 149.864 -76.305 90.365 40.857 117.493-130.066 90.388 48.717 110.354 -75.323 90.683 61.369 142.645 -99.553 89.741 44.775 142.191-124.903 91.634 36.588 142.777-130.053 107.275 -13.737 117.273 -96.480 132.880-157.346 114.163-108.798 98.059 62.918 129.868 148.462 91.424 49.339 106.036 -22.966 89.007 58.044 110.842 -71.236 89.815 49.035 128.636 -75.125 89.205 42.614 102.451 -83.922 92.403 40.119 114.823 -62.739 92.922 54.744 133.063 -57.001 89.204 62.157 131.043 -78.683 88.063-175.533 70.049 -87.087 92.212 66.463 131.913 -77.489 91.039 44.586 140.905-103.246 91.133 44.514 128.702 -33.179 91.763 59.229 150.800 -32.339 88.006 44.779 136.769-149.841 94.048 92.635 102.847 -79.809 92.525 0.000 128.893 -76.388 # 514 total E -1.54323E+02 rmsd from N 0.000 %NC 0.00 93.104 152.257 142.387-102.483 93.238 51.700 119.634 -5.967 90.663 47.308 105.085 -82.711 90.865 54.356 129.949 -76.468 90.512 46.182 133.223-110.229 88.924 43.106 66.503 -74.375 90.147 47.268 116.972 -44.333 89.680 43.909 130.671 -97.259 89.802 47.779 131.213-117.139 88.860 50.890 83.023 -98.658 91.105 152.814 131.856 -80.404 92.575 86.592 127.475-152.494 94.680 108.298 97.061 -82.436 92.605 -64.001 133.323 -88.057 94.741-121.894 134.784-140.771 90.325 49.814 135.460 119.855 91.883 47.912 134.694 -85.660 91.515 44.581 136.308 -31.427 91.121 45.940 130.131 -17.640 89.037 50.256 145.378-162.324 90.085 46.654 0.000 0.000 90.385 43.203 120.452 -76.019 92.265 43.886 139.052 -84.623 89.935 46.720 120.038-124.282 88.522 50.746 112.008 -81.426 90.266 50.028 136.813-106.256 91.815 44.672 130.322-146.656 96.164 -98.640 142.901-127.415 109.989-168.507 110.119 -78.394 138.056 -59.163 108.363 -97.938 102.319 -25.814 113.450 -77.930 94.476 -49.315 118.598 -65.472 94.209 -41.754 112.788 -72.238 92.397 -45.200 128.113 -76.692 89.559 -42.441 101.534 -80.944 90.688 -47.428 147.327 -35.926 91.285 -50.621 157.492-125.108 89.771 -42.922 129.830 -78.056 95.644-132.461 136.908 20.483 90.743 55.038 131.873 -76.828 90.727 44.447 141.724-106.712 90.447 45.335 124.155 -27.415 91.066 54.486 140.237 -54.435 89.328 46.497 141.152-140.369 93.362 99.041 102.326 -79.794 92.519 0.000 128.827 -76.450 # 515 total E -1.51728E+02 rmsd from N 0.000 %NC 0.00 93.027 160.241 137.230 -86.047 93.485 57.615 137.775 57.733 92.657 43.213 106.085 -81.547 92.185 48.381 130.727 -77.157 92.795 45.829 158.686-162.876 92.270 39.666 61.591 -74.616 93.898 43.462 124.132 -38.674 94.297 37.674 137.482-105.179 91.557 54.924 140.417 163.529 87.395 67.955 83.020-104.593 89.938-173.199 136.823 -97.610 90.411 68.916 101.777-139.664 89.137 53.311 102.517 -85.462 89.632 56.084 121.961 -18.796 92.218 35.446 102.454 -84.622 95.906 45.244 140.509 -96.383 99.401 -4.667 119.694 -74.117 126.727 145.025 143.243 -70.700 94.805 48.765 154.320-156.566 96.418 34.032 145.488 -42.816 112.044 22.577 0.000 0.000 98.019 42.946 144.293 -17.463 91.433 52.763 152.261 -96.182 89.262 52.142 112.301-135.499 88.547 45.985 110.305 -73.458 91.561 48.327 140.622 -92.501 93.412 57.212 132.991-134.158 94.141 -94.030 104.708 -84.241 103.025-171.145 150.307 -19.535 131.669 -52.242 117.705-118.082 99.787 -47.016 111.374 -79.279 97.107-115.342 123.310 -68.344 90.647 54.308 128.647 -11.280 91.087 52.766 130.142 -76.440 88.099 45.681 143.302 -23.285 89.813 49.381 144.412 -39.915 87.924 51.713 157.256-134.690 89.177 46.807 127.956 -76.631 88.526 64.043 114.899 -47.150 89.535 116.051 128.742 -76.410 91.274 48.945 142.219-110.356 93.267 75.371 129.068 -39.359 91.466 -71.760 147.059 -39.820 100.080 -54.162 104.411 -79.283 95.199 112.760 107.504 -79.422 92.440 0.000 128.932 -75.885 # 516 total E -1.50249E+02 rmsd from N 0.000 %NC 0.00 93.365-158.630 134.170 -81.387 93.161 62.445 153.479 24.669 95.551 38.499 105.931 -81.210 92.543 50.054 133.162 -77.752 93.513 38.842 135.715-121.178 91.449 47.960 60.794 -76.983 88.358 51.983 120.481 -48.403 90.477 47.011 123.399 -99.934 87.678 43.026 145.792-157.038 91.244 54.916 76.674-103.369 91.767 126.270 133.976 -80.082 93.703 53.442 128.201-150.629 95.652 40.787 100.244 -81.338 97.665 150.351 142.596 -38.537 109.144 41.039 149.301-171.198 95.917 40.097 133.332-113.143 95.898 40.237 148.461 -84.765 92.785 47.974 156.041 116.159 91.295 46.951 165.180-113.391 92.102 43.108 140.756-161.656 92.112 42.288 0.000 0.000 90.792 53.226 110.530 -83.535 89.577 49.208 143.835 -80.749 91.098 39.774 119.613-127.698 91.127 49.951 111.461 -77.063 91.071 70.731 138.975 -97.502 90.186 44.166 144.492-145.586 92.644 41.655 152.811 -21.697 101.199 -5.746 115.804 -89.179 138.359-161.513 104.487 -89.090 96.031 53.737 115.299 -76.952 92.780 47.157 105.295 -27.173 89.795 50.601 132.498 -24.244 91.059 49.676 128.961 -75.820 90.462 42.832 102.306 -84.234 92.269 41.152 126.715 -67.438 91.924 56.298 131.118 -77.367 89.669 59.041 130.147 -78.509 88.559-176.472 78.014 -87.496 93.418 64.710 156.578 -92.242 91.794 51.609 141.160-106.589 93.581 67.518 123.982 -22.331 93.242 -95.417 143.258 -84.762 97.682 -24.680 126.930-123.892 111.085 43.980 102.489 -77.795 92.449 0.000 129.358 -76.079 # 517 total E -1.47678E+02 rmsd from N 0.000 %NC 0.00 93.472 -89.536 131.529 -89.685 98.654 -37.434 147.311-117.030 94.344 -69.333 96.331 -81.096 92.875 -89.382 129.944 -76.435 92.718 77.483 142.164 173.170 92.452 49.657 82.428 -58.529 92.236 41.716 157.015 -2.661 92.125 47.019 153.927 -78.886 89.275 43.757 143.342-136.277 91.194 46.707 72.100-100.400 90.620 53.504 146.215 -80.360 96.185 32.136 96.881-108.502 93.255 54.097 138.855-117.289 92.329 24.096 109.097-119.198 117.394-175.970 101.705 -88.604 93.053 47.774 143.640 127.480 90.871 49.824 134.927 -86.616 88.487 62.064 148.642 -62.161 89.457 49.929 134.798 -26.858 89.634 41.469 142.706-169.333 90.545 47.281 0.000 0.000 89.952 51.426 107.416 -81.155 88.955 46.343 148.305 -76.607 91.140 39.824 119.152-129.134 90.415 49.972 111.048 -77.181 89.356 59.622 138.884 -97.901 89.993 42.363 142.784-134.373 92.594 40.530 143.029-129.544 99.433 -5.089 115.505 -90.551 136.610-159.179 104.737 -90.680 92.926 54.337 114.314 -76.582 91.736 52.602 99.397 -15.454 91.444 45.083 128.752 1.902 91.847 44.756 129.801 -76.320 89.369 43.503 103.231 -85.250 91.015 52.367 119.831 -19.142 90.646 40.019 135.802 -55.549 93.573 41.764 130.012 -77.592 96.813 122.539 111.863 -99.688 91.358 -50.844 129.276 -77.228 92.196 -40.774 144.775-127.466 89.862 -46.368 124.903 -9.323 92.390 -54.025 161.097 -17.217 89.964 -45.691 138.255-154.278 94.836 98.164 104.711 -79.729 92.500 0.000 128.842 -76.476 # 518 total E -1.48316E+02 rmsd from N 0.000 %NC 0.00 92.980 152.951 138.011 -87.487 93.744 55.068 131.640 54.419 91.462 46.180 107.071 -78.144 92.055 45.636 130.545 -77.199 93.268 45.646 156.998-163.711 93.771 37.818 54.604 -67.597 93.735 44.561 156.671 54.838 92.851 42.015 139.357-107.226 90.236 50.690 142.142 161.584 87.262 56.375 72.183-113.210 88.887 158.183 136.045 -88.767 90.067 70.538 104.154-138.774 93.579 37.854 96.485 -81.340 93.443 47.626 146.579 -34.854 91.528 41.150 138.459-133.961 92.502 53.293 119.709-132.233 91.592 42.870 129.369 -79.378 92.830-119.129 130.456 -85.120 96.744 -57.624 139.226-118.790 91.986 117.173 117.780 -83.600 92.034 51.882 0.000 0.000 89.487 47.606 137.536 -19.599 90.272 48.564 144.317 -93.888 89.313 47.661 125.788-132.138 86.843 52.930 108.562 -74.390 89.738 50.370 138.169 -51.378 89.978 44.349 136.783-143.109 94.622 -89.714 104.944 -84.284 125.271 169.268 166.941-163.062 114.561 -63.621 110.429-115.212 90.542 -53.822 108.961 -77.094 90.976 -45.887 116.492 -24.537 89.729 -48.003 112.726 -71.349 90.410 -45.950 126.833 -75.804 88.816 -44.352 104.547 -79.746 89.583 -47.959 152.352 -29.217 90.241 -51.752 152.381-144.694 89.558 -42.027 128.807 -76.694 93.581-122.224 142.581 30.795 91.395 49.696 131.724 -77.848 92.115 52.314 142.489-120.411 92.826 76.503 130.175 -41.991 89.699 -86.403 132.544 -79.068 95.462 -47.154 106.146 -85.625 96.266 -9.207 106.466 -77.774 92.517 0.000 129.789 -76.446 # 519 total E -1.48025E+02 rmsd from N 0.000 %NC 0.00 93.135 -67.923 126.848 -76.080 93.772 -48.980 116.681 -78.841 90.781 -47.272 103.284 -77.458 90.628 -46.009 128.565 -75.744 91.866 -40.584 140.916-125.195 94.070 -40.891 61.614 -63.773 92.743 -40.722 133.647 0.138 99.806 -35.495 170.109 156.726 97.733 -53.184 128.609-117.447 96.739-148.911 79.920 -81.993 108.868 77.066 157.836 177.963 95.771 38.157 91.737-121.943 92.511 49.495 111.707 -87.591 90.923 68.403 153.888-146.536 87.907 56.191 131.584-125.262 90.936 36.415 133.867-112.146 97.787-174.439 133.152 -91.400 142.573 -5.671 127.924 99.969 96.048 44.385 151.970 80.675 95.430 39.358 148.266 -38.979 92.649 50.418 0.000 0.000 91.975 42.951 144.058 -28.318 90.167 48.669 175.143 173.509 89.691 49.317 112.813-146.790 90.453 45.012 109.818 -77.777 91.139 43.995 155.089-103.597 93.894 67.861 139.459-153.860 92.702 -81.864 101.875 -83.971 117.526 159.437 152.135 -16.575 97.144 -80.364 103.335-122.755 117.344 4.151 117.827 -80.585 93.949 143.178 95.823 -23.072 95.311 55.537 107.542 -75.530 91.132 46.945 129.027 -76.011 90.170 44.483 141.996-153.686 91.527 46.838 134.177 -28.896 92.126 40.331 140.647 -83.002 92.994 43.431 128.399 -77.087 92.981 57.354 114.294 -80.064 92.131-118.273 129.041 -76.558 96.485 -25.245 142.487-127.185 95.421 -61.117 123.130 19.406 104.648 148.531 159.367 -15.114 96.598 75.770 136.530-151.097 95.928 38.362 105.696 -78.349 92.470 0.000 129.433 -76.465 # 520 total E -1.51499E+02 rmsd from N 0.000 %NC 0.00 93.132 -59.925 130.041 -86.860 94.384 -47.969 117.221 -80.659 91.128 -46.010 103.140 -77.219 90.337 -48.791 129.058 -76.065 91.122 -38.993 139.759-128.970 92.723 -44.846 62.885 -65.284 90.480 -36.085 127.900 -9.288 105.334 -35.351 169.548 149.679 93.113 -43.726 131.937-123.590 94.783 118.651 87.739 -92.242 132.363 169.550 138.144 -87.746 93.082 56.753 100.546-116.774 116.939 136.074 101.928 -82.785 103.609 -54.837 150.378 -37.750 92.787-120.054 114.311 -80.824 92.298 49.138 136.598 122.199 93.074 45.467 136.620 -86.024 91.600 44.128 149.693 -55.085 91.662 49.801 146.243 -28.713 89.420 46.121 108.593 -82.314 90.173 45.510 0.000 0.000 90.183 47.852 123.218 -97.621 89.975 45.657 141.333 -96.364 90.206 44.586 118.960-129.352 88.903 50.590 111.286 -77.213 90.883 48.425 137.179 -98.361 92.200 43.885 131.102-139.154 95.802 26.232 143.673-128.712 131.802-168.717 152.358 -16.552 93.089 59.991 133.686-160.672 88.651 53.337 114.311 -76.458 88.736 63.745 110.047 -16.387 88.127 48.218 107.403 -73.940 89.258 45.555 129.159 -76.197 87.724 51.681 139.211-146.011 88.319 47.455 119.612 -31.165 90.895 43.242 136.612 -55.575 92.056 38.820 128.236 -76.434 91.543 97.018 108.294 -61.825 91.330 52.867 131.603 -77.923 90.187 42.538 141.799-123.006 93.579 61.937 128.423 -35.903 91.218-102.891 145.179 -50.639 97.996 -33.749 105.357 -82.563 104.788-123.893 147.351 -2.690 92.911 0.000 129.366 -76.373 # 521 total E -1.47006E+02 rmsd from N 0.000 %NC 0.00 92.598 134.618 128.728 -59.891 94.020 51.293 143.642 19.934 93.398 41.866 107.281 -81.744 92.012 51.489 130.383 -75.855 93.096 39.038 141.541 -32.113 91.746 46.217 61.718 -74.055 87.424 58.473 114.770 -44.020 87.935 55.040 131.076 -99.718 87.793 41.325 126.011-108.461 89.080 47.941 82.414 -90.543 91.051 60.640 141.291 -75.255 93.773 36.271 101.220-107.983 90.302 47.548 135.530-123.404 91.158 56.410 111.678-122.354 89.952 46.567 109.577 -88.614 91.760 49.658 135.815-106.527 96.367 2.429 118.967 -84.543 130.956-171.382 142.894 -55.313 114.454 26.709 144.376 65.843 95.862 48.171 147.548-158.366 90.297 48.637 0.000 0.000 89.847 56.235 128.339 -36.952 87.849 48.770 143.035 -84.834 89.826 46.637 120.262-129.684 88.694 54.565 107.410 -73.540 89.407 52.271 130.946 -53.639 91.784 41.932 136.002-123.437 95.458 33.502 151.571 -24.117 112.781 -0.021 160.021 -16.342 133.484 -60.032 112.615-104.466 135.816 -22.604 121.420 -83.034 118.284-130.033 137.948 -11.936 93.777 50.671 113.504 -71.347 92.382 44.561 128.941 -75.825 93.805 36.399 108.546 -83.570 93.964 43.848 160.317-137.091 91.031 46.719 145.207-163.191 90.759 42.424 128.015 -76.648 89.216 50.607 130.288 -76.296 89.695 50.251 130.282 -77.110 89.419 44.700 137.514-124.887 90.102 48.278 128.607 -39.817 90.216 55.326 140.806 -45.220 89.241 43.954 139.057-133.162 94.497 82.098 103.686 -80.119 92.506 0.000 128.861 -76.782 # 522 total E -1.49018E+02 rmsd from N 0.000 %NC 0.00 93.209 -67.428 130.046 -86.195 94.569 -46.161 118.545 -81.034 90.510 -48.600 103.064 -77.985 89.918 -49.040 129.599 -76.380 92.936 -37.120 142.839-129.814 94.817 -44.139 66.541 -77.930 91.477 -35.673 129.804 47.270 110.025 -48.236 169.239 164.981 93.571 -27.465 126.395-116.447 108.576-131.479 73.138 -79.082 108.305 56.736 159.651-166.366 94.684 42.692 94.573-120.282 95.078 39.440 138.943-127.082 93.591 49.872 136.937 -37.861 92.533 39.293 112.280 -89.816 93.496 52.142 130.838-103.658 93.645 33.776 119.332 -61.198 98.220-117.724 122.229 -72.441 93.240 -69.388 137.125-115.615 94.740 109.672 153.587-163.049 96.511 44.836 0.000 0.000 92.640 44.981 138.011 -12.523 90.954 49.104 144.435 -97.385 89.176 50.599 118.536-129.781 88.782 46.657 106.231 -75.866 91.162 51.570 137.588 -47.838 91.456 42.989 136.658-139.469 95.987-124.569 146.536 -33.596 95.307 170.046 150.056-131.024 105.866 -6.986 94.251-112.460 107.320 -54.171 116.418 -78.655 114.441-117.309 138.363 -27.152 90.382 62.497 120.356 -76.227 91.756 46.501 129.000 -76.232 88.317 48.052 113.825 -89.237 88.602 56.523 132.631-114.192 88.112 58.911 136.570-146.567 86.610 50.276 127.588 -76.134 88.209 56.149 115.685-107.522 89.888 44.601 126.886 -73.652 90.435 44.850 137.614-152.593 91.167 51.781 127.366 -43.932 90.301 48.357 137.927 -88.463 91.728 46.271 141.396-169.829 94.885 73.462 104.212 -80.925 92.518 0.000 129.007 -76.630 # 523 total E -1.50380E+02 rmsd from N 0.000 %NC 0.00 92.626 92.305 135.331 -84.962 93.793 54.001 120.193 -25.558 94.621 41.841 105.604 -80.992 92.556 46.105 130.461 -76.350 92.721 47.730 112.706 -78.054 91.625 39.470 63.170 -70.182 89.840 49.276 176.205 -95.270 90.969 44.257 123.456 -95.753 90.865 41.709 141.663-119.234 93.862 58.075 86.183-104.809 94.360 -28.183 145.033-110.073 129.274 -87.857 113.336-109.620 108.656-167.869 105.089 -83.481 126.838-110.107 153.346-147.497 102.196-119.685 139.025-155.267 94.247 45.222 143.548 150.781 92.423 46.198 133.846 -85.810 90.568 48.985 117.761 -52.820 90.612 53.884 120.593 -37.832 89.572 44.659 109.794 -82.953 90.168 44.673 0.000 0.000 89.645 58.297 106.095 -79.820 86.898 49.291 143.457 -78.532 89.529 41.892 120.210-129.898 90.027 51.313 110.644 -74.280 89.728 44.306 138.455 -95.808 93.580 62.904 134.184-150.172 93.580 -79.685 103.690 -85.404 113.242 166.874 160.983-145.109 100.049 -41.591 95.577-114.818 96.401 -48.481 113.016 -78.650 95.317-120.238 129.351 -41.383 92.071 58.587 116.585 -73.656 90.937 46.377 129.144 -75.891 91.229 40.940 104.133 -82.037 93.331 44.313 133.513 -34.527 92.066 43.035 132.094 -80.712 92.656 48.889 129.460 -77.740 93.128-150.082 109.069-102.556 95.538 120.002 130.936 -77.059 95.108 36.088 137.204 -94.960 91.103 53.047 134.294 -22.675 90.945 56.599 138.951-142.123 88.987 47.295 138.205-155.280 92.366 89.971 101.007 -79.707 92.562 0.000 128.653 -76.845 # 524 total E -1.50591E+02 rmsd from N 0.000 %NC 0.00 93.077 -61.759 127.605 -78.813 95.004 -44.625 112.859 -79.702 90.125 -47.522 103.574 -77.440 90.563 -46.132 128.414 -76.174 92.290 -39.600 128.550-105.100 101.989 -22.240 70.667 -62.673 95.237 -48.068 121.559 -33.995 99.109 2.896 138.536 -61.844 113.975 -69.293 124.698 -76.801 85.094 20.128 122.971-126.707 127.334 -16.220 130.455-123.510 139.495 -86.004 100.077 -84.748 109.444 -97.681 109.414 -80.218 135.995 150.939 160.386-168.362 116.327 -98.724 144.155-164.457 95.107 45.154 147.878 143.926 91.608 46.137 134.653 -85.618 90.130 53.607 123.435 -69.334 90.753 49.326 116.735 -30.687 91.778 39.432 107.250 -82.040 90.220 49.402 0.000 0.000 90.364 56.323 100.987 -82.689 87.190 45.745 146.540 -72.748 90.423 41.368 118.175-127.165 90.486 51.460 108.720 -74.084 90.732 40.879 140.741 -89.696 93.860 54.483 132.948-111.199 95.501 -15.284 108.104 -89.687 122.318 49.635 166.439-152.968 128.468 -48.232 118.796-119.938 148.341 -42.988 125.621 -88.864 104.806-156.035 126.151-117.608 113.555 43.196 116.425 -71.772 91.924 46.509 129.625 -76.330 90.069 43.145 107.650 -85.669 90.787 47.402 131.103 -89.732 89.811 47.159 146.474-124.542 90.276 42.757 128.058 -76.731 89.205 50.268 109.861 -82.273 89.785 50.269 129.758 -76.822 89.529 43.430 136.434-131.672 90.206 47.744 129.652 -43.015 90.066 54.151 137.433 -57.309 89.661 44.123 137.070-125.402 94.741 79.959 103.810 -80.574 92.539 0.000 128.888 -76.714 # 525 total E -1.46985E+02 rmsd from N 0.000 %NC 0.00 120.402 155.863 148.959 -48.835 93.352 70.266 150.162 24.455 95.884 40.691 106.743 -80.766 92.524 45.160 132.331 -77.108 95.514 40.697 140.529-119.713 92.659 42.788 52.490 -71.758 91.118 45.606 136.716 -31.446 88.765 51.569 133.937-101.571 88.059 40.668 122.010-113.473 96.505 102.180 84.833 -93.715 92.737 -46.757 157.597-107.189 101.686 -60.367 90.167 -89.314 90.682-114.803 144.001 -5.071 92.326 42.879 143.130-141.828 96.150 55.863 109.857 -87.562 95.347 5.781 127.935 -71.268 113.957 50.778 151.604 8.533 125.927 -73.032 152.001-107.717 134.397-117.837 123.487 -76.258 92.597 56.153 146.222-150.934 91.995 47.694 0.000 0.000 89.525 45.964 139.557 -24.898 91.151 50.950 131.247 -85.849 88.502 50.199 126.037-126.625 89.380 45.403 108.677 -72.549 91.731 50.525 130.525 -72.884 92.695 39.222 137.038-137.766 96.471-121.433 103.865 -81.073 91.814-132.359 156.058 -7.010 105.456 -31.852 97.091-101.043 94.324 -47.808 112.499 -76.336 93.149 -58.713 105.209 -66.871 91.773 110.365 115.404 -75.489 93.576 42.463 128.735 -76.611 88.511 53.795 137.896-134.286 89.387 55.934 138.986 -35.822 88.380 46.224 146.877-107.874 90.880 39.902 127.962 -76.418 90.905 51.093 120.752 -96.213 89.508 51.608 130.050 -77.696 88.801 47.465 138.221-136.018 91.059 80.116 134.636 -59.677 88.046-116.854 134.008 -58.308 97.429 25.300 136.322-138.207 121.565 86.119 104.378 -78.855 92.484 0.000 129.758 -76.669 # 526 total E -1.48231E+02 rmsd from N 0.000 %NC 0.00 92.932 -57.824 128.667 -83.120 94.688 -47.018 116.145 -80.744 91.002 -45.741 103.424 -77.543 90.277 -49.503 128.062 -75.471 90.948 -38.330 138.053-120.665 93.675 -41.370 60.462 -57.472 91.711 -40.864 135.894 38.533 97.054 -39.868 144.320-117.738 92.075 -45.569 150.866 -98.913 90.911 -56.354 77.959 -78.441 96.504-151.272 150.320-175.631 95.979 -48.508 99.242-112.659 101.152 156.798 101.864 -85.169 135.211-144.701 176.427-169.689 111.360-102.713 153.158 -32.691 93.893 48.251 144.241 145.700 92.402 44.384 135.525 -85.061 90.307 51.048 154.305 -50.693 89.749 49.802 134.024 -34.477 88.675 46.206 109.621 -82.324 89.627 46.991 0.000 0.000 89.795 50.024 153.480-147.280 89.569 42.882 134.968-108.639 91.270 43.107 117.479-127.792 88.870 56.383 114.088 -75.627 89.289 46.779 136.571-103.754 92.439 45.051 130.875-126.929 96.742 6.456 114.888 -91.284 122.878 176.550 111.112 -74.982 97.840 56.788 138.018-163.438 99.220 33.280 115.339 -78.261 94.829 42.051 118.961 -21.009 91.990 54.775 114.878 -73.558 89.521 44.738 129.164 -77.001 90.163 43.926 101.705 -83.320 91.627 43.032 125.998 -61.059 92.047 58.621 129.910 -83.311 89.515 58.443 130.219 -78.417 88.710-169.939 74.556 -88.139 94.380 60.100 131.631 -77.933 94.026 48.380 141.175-114.249 95.249 138.714 133.507 -40.361 94.403 -67.856 161.982-122.908 92.166 -45.741 126.597-150.060 95.955 96.633 104.980 -79.533 92.468 0.000 129.248 -75.919 # 527 total E -1.52113E+02 rmsd from N 0.000 %NC 0.00 93.258 -72.999 129.718 -84.826 94.304 -47.178 116.947 -80.073 90.717 -47.340 103.196 -76.777 90.569 -46.911 129.435 -76.106 90.963 -41.567 140.924-133.462 93.712 -42.330 62.033 -65.607 91.239 -40.280 128.837 -3.300 103.152 -35.371 168.543 141.507 94.817 -49.090 128.734-122.593 98.724-168.416 84.098 -87.552 135.825 96.431 167.400 178.644 90.693 80.086 97.107-126.407 97.221 76.428 99.177 -85.656 94.915 -74.623 147.615 -91.906 110.253-108.865 138.697-148.819 90.755 55.450 145.253 134.821 91.661 46.552 134.589 -85.244 89.831 48.778 155.393 0.256 89.448 50.243 133.729 -27.274 89.015 48.521 144.093-148.394 89.606 45.102 0.000 0.000 89.589 50.335 110.861 -82.002 88.809 48.367 141.281 -82.692 90.098 44.685 122.413-130.101 88.040 51.856 113.265 -75.418 90.980 49.711 139.120-106.636 91.658 54.982 131.416-151.765 94.143 -12.035 142.737-130.641 122.100-167.246 113.226 -81.354 120.093 44.246 131.705-143.262 97.099 35.815 115.686 -78.128 94.156 43.726 134.310 -67.935 94.155 45.307 110.671 -71.174 92.423 41.583 129.696 -76.095 91.752 41.531 110.588 -92.049 92.583 42.041 118.067 -91.293 90.931 51.946 134.397 -88.117 90.079 45.426 131.026 -78.639 91.615 114.138 98.461-105.153 92.392 -48.119 128.965 -77.524 92.477 -46.074 143.689-125.052 88.573 -53.744 130.448 -29.018 92.022 -56.874 157.620 -19.669 89.624 -36.078 134.752-126.029 99.144 85.544 99.195 -78.826 92.386 0.000 129.381 -75.864 # 528 total E -1.46877E+02 rmsd from N 0.000 %NC 0.00 93.168 -70.026 127.341 -77.370 93.739 -50.444 116.675 -76.729 91.200 -45.846 102.840 -76.656 90.911 -46.974 128.361 -75.482 90.947 -40.466 139.534-132.193 93.529 -42.852 59.046 -61.609 92.151 -40.885 151.266-142.407 99.226 -40.646 175.183-174.848 90.510 -47.353 135.591-127.927 99.327-110.838 136.932 -4.111 95.403 46.781 147.656-157.972 91.662 55.368 102.017-141.646 86.630 58.600 96.102 -84.726 89.448 54.420 126.631 -51.793 89.808 46.071 109.862 -89.024 92.099 39.395 142.134-105.226 98.761 172.077 113.798 -91.145 116.942 22.716 132.285 52.752 91.968 57.993 135.723 102.398 92.292 50.114 110.887 -81.247 93.859 39.441 0.000 0.000 90.360 46.574 151.196-176.129 94.014 41.260 99.874-100.708 91.108 44.806 103.070 -56.542 92.751 41.607 109.832 -86.011 91.758 46.687 152.827-160.794 92.491 44.251 130.961-127.962 94.543-101.006 147.411 -35.746 121.202 128.743 164.252-158.065 98.651-126.231 102.732 -96.483 135.299-108.953 118.659 -81.444 93.703 38.941 141.997-113.071 98.833 120.921 110.948 -75.122 94.823-119.719 127.827 -75.225 88.640 49.531 102.417 -80.695 91.393 49.738 123.280 -32.509 87.849 51.014 147.975 -32.900 87.940 47.734 128.442 -76.941 87.414 52.403 112.368 -38.481 88.829 47.296 129.051 -75.955 89.497 45.572 141.688-115.559 89.201 49.129 129.774 -40.940 88.477 55.612 136.778 -54.867 89.587 43.632 131.607-124.707 94.654 81.939 103.953 -80.567 92.545 0.000 128.852 -76.739 # 529 total E -1.48431E+02 rmsd from N 0.000 %NC 0.00 92.550 147.634 114.382 -30.274 93.844 76.901 141.505 48.459 96.718 37.445 108.017 -81.171 92.561 45.843 131.167 -76.857 91.974 45.677 153.344-160.131 93.313 45.093 57.703 -66.735 89.651 43.484 134.728 -29.623 89.027 51.161 125.468-122.462 88.118 56.722 125.379-114.051 85.286 52.429 81.965 -98.204 90.338 148.497 127.537 -73.609 93.383 92.044 134.451-159.959 90.623-169.031 101.089 -86.934 112.514 166.815 149.673-174.567 121.061 -94.006 155.792 -22.029 94.514 45.371 146.133-102.479 92.480 44.484 136.969 -73.775 90.518 51.786 128.134 -63.139 89.473 48.893 145.582 -29.647 90.603 43.495 142.654-155.327 90.729 44.262 0.000 0.000 89.565 57.361 106.376 -79.800 86.835 49.056 145.343 -77.706 89.901 41.482 120.368-129.841 91.122 46.589 108.907 -72.227 91.705 44.891 140.018 -88.580 92.917 73.107 138.318-108.150 91.774 -30.133 104.285 -86.020 115.535 57.380 152.592 -17.514 135.090 -54.495 112.206-105.872 129.737 -72.351 115.351 -82.630 129.656-105.172 113.835 9.452 90.648 64.515 138.164 12.590 90.034 52.918 128.756 -76.096 88.075 45.568 95.048 -73.503 90.524 49.646 142.438 -26.131 89.567 46.174 150.035-105.412 90.452 40.061 128.111 -76.847 89.873 51.989 124.892 -76.356 90.303 47.284 128.354 -76.139 90.605 41.296 137.248-134.485 91.966 45.735 128.436 -44.787 91.321 50.838 134.621 -99.192 90.798 44.107 134.348-146.533 95.480 71.594 104.114 -80.485 92.584 0.000 129.006 -76.692 # 530 total E -1.49414E+02 rmsd from N 0.000 %NC 0.00 93.338 171.143 141.064-103.648 93.666 53.422 159.451 130.940 92.937 44.616 107.128 -80.211 91.126 48.409 130.516 -76.086 90.810 44.287 146.810-133.607 90.195 44.241 126.031 168.598 90.924 46.102 118.345 -43.714 91.644 41.063 135.564 -94.949 89.559 50.843 144.242-146.985 88.196 61.142 77.730-108.438 89.763 44.832 131.805 -83.527 102.526-118.868 97.611 -91.374 107.341-138.390 143.427-167.638 117.163 24.986 160.217-137.315 95.532 50.379 136.473-151.121 94.756 31.976 138.936-108.896 102.443-157.453 125.157 -81.109 130.650 -60.808 125.664 72.915 95.864 49.068 146.249 -18.104 94.767 40.393 107.733 -82.628 90.668 50.759 0.000 0.000 89.630 50.112 108.373 -84.035 89.535 46.642 148.830 -81.416 91.733 40.324 118.996-130.182 90.364 50.765 113.897 -76.297 90.120 66.290 143.359-112.884 89.106 44.239 142.221-143.624 92.757 40.286 113.915 -88.837 100.693 -9.205 119.837 -82.196 139.308-156.302 103.204 -86.756 94.768 53.527 114.810 -76.659 92.430 49.128 94.232 -24.161 90.445 48.538 125.111 -14.328 92.992 47.500 130.157 -77.132 92.731 34.382 101.394 -83.597 91.774 55.064 113.518 -46.166 90.834 75.970 136.627 -37.607 87.202 46.663 130.932 -78.253 91.013-176.418 94.559 -99.693 93.394 75.567 134.000 -78.707 90.570 51.180 141.366-104.170 91.536 53.921 124.541 -30.265 95.245-139.410 138.180 -46.294 97.850 41.782 135.330-136.563 114.506 34.160 109.933 -72.190 92.392 0.000 129.184 -76.046 # 531 total E -1.47370E+02 rmsd from N 0.000 %NC 0.00 125.761-112.498 143.614 -29.209 120.745-103.578 131.548 -35.852 93.971 41.072 108.971 -81.415 93.176 51.786 130.389 -76.538 90.616 42.997 152.272-156.107 89.489 47.325 65.677 -73.823 91.685 43.598 116.248 -44.355 89.520 40.719 141.762 -88.593 96.315 41.350 110.233 -99.254 97.481 111.710 104.460 -89.408 93.916 -66.862 126.783-125.731 98.802 -75.548 91.876-100.240 93.159-143.354 145.578 -9.863 94.206 -41.385 145.795-100.244 96.926-116.343 135.928-149.400 92.386 43.453 129.965 -80.576 92.975 52.026 135.650 -64.817 92.036 45.279 136.853 -48.838 90.556 45.738 147.177 -5.230 89.910 47.852 141.231-161.741 91.384 45.069 0.000 0.000 89.885 45.034 119.068 -77.346 91.817 44.549 137.879 -83.089 91.096 43.377 120.872-123.099 89.610 47.660 108.977 -76.309 91.481 47.247 129.207 -83.849 93.096 41.843 132.894-115.664 95.433 36.167 108.789 -85.909 101.917 10.866 148.980 -24.277 139.860-149.856 104.349 -88.971 96.230 60.549 114.639 -77.131 92.893 -96.768 99.328 -54.367 89.596 -66.964 111.971 -71.799 90.190 -49.610 126.144 -75.527 89.701 -41.098 99.890 -80.225 89.603 -49.188 121.426 -14.851 92.201 -40.524 153.772 -15.519 92.039 -50.108 128.675 -76.512 91.204 -58.316 124.481 -38.721 91.834 112.948 129.590 -75.777 94.351 37.276 139.954 -99.692 91.170 52.096 126.476 10.569 91.491 55.059 148.062 -37.772 89.706 39.030 141.606-143.940 94.622 82.222 106.231 -81.657 92.655 0.000 128.763 -76.877 # 532 total E -1.50828E+02 rmsd from N 0.000 %NC 0.00 93.105 163.035 138.319 -90.778 93.192 56.037 137.076 39.222 91.983 45.331 106.466 -82.488 91.919 47.379 131.031 -77.491 92.750 45.450 151.017-133.833 91.624 44.532 58.705 -70.122 90.035 47.115 130.359 -29.827 90.978 46.105 123.215-115.661 87.794 48.380 138.491-157.021 88.180 61.841 74.281-101.137 88.617 138.355 133.331 -71.159 90.776 88.066 128.077-152.457 92.326 106.629 98.107 -84.474 92.308 -53.567 128.058 -81.486 96.444-121.444 139.127-148.759 91.277 49.215 139.770 136.841 92.788 49.583 135.238 -84.814 93.274 39.369 137.841 -77.818 93.473 44.448 144.843 14.378 93.472 40.583 107.193 -83.237 94.526 40.316 0.000 0.000 103.899 20.594 103.173 -86.124 98.711 40.567 175.100-176.401 98.859 33.647 103.787-133.578 92.061 50.732 114.848 -74.565 88.858 55.071 133.407 -95.983 91.348 54.034 134.530 -91.888 91.825 18.402 107.942 -86.862 117.304 73.605 148.344 -20.316 139.474 -96.028 108.616 -94.931 113.537 -9.651 115.270 -79.535 92.154 -59.029 95.170 -40.294 89.881 -52.237 129.160 -32.751 90.348 -41.855 128.749 -76.993 88.719 -52.112 96.707 -80.002 85.285 -65.712 114.150 -13.561 88.473 -40.073 151.340 -6.386 93.395 -56.572 128.205 -75.955 104.934 -78.063 138.839 10.740 89.627 77.468 131.344 -76.687 91.030 44.790 140.639-103.672 88.562 53.894 126.396 -14.903 90.011 58.854 138.355 -37.741 87.879 42.601 147.297-149.158 94.564 94.193 102.662 -80.058 92.518 0.000 128.848 -76.493 # 533 total E -1.48381E+02 rmsd from N 0.000 %NC 0.00 125.875-109.270 143.280 -26.064 124.247-102.809 127.816 -38.557 95.447 38.984 108.735 -80.354 93.772 47.334 130.769 -76.940 93.935 40.096 154.036-152.006 93.062 45.446 56.490 -74.522 90.307 44.816 122.600 -30.744 88.963 48.531 129.497-100.491 90.359 47.641 119.695-103.781 92.568 94.965 90.727 -93.758 93.360-135.234 141.862-104.624 91.978 65.975 96.855-117.231 92.196 48.477 107.266 -81.880 91.929 46.429 141.465 -40.022 92.837 41.135 135.137-122.405 95.562 59.957 128.152-117.027 97.922-104.195 124.552 -90.969 92.424 122.161 119.270 -34.296 88.644 66.755 148.866-155.940 89.301 51.898 144.586-128.566 91.484 40.657 0.000 0.000 89.280 55.292 118.201 -72.589 88.039 47.837 129.990 -84.795 89.220 44.484 124.212-124.983 89.569 48.075 106.545 -75.236 90.676 46.088 128.489 -70.874 93.620 43.524 134.469-127.801 95.397 34.217 108.957 -86.532 117.365 60.824 150.109 -20.255 137.028 -96.539 111.626-100.705 108.330 -16.458 113.413 -79.259 91.099 -56.113 110.466 -45.549 89.865 -50.860 115.255 -72.332 90.963 -43.162 128.400 -76.971 88.627 -47.783 98.240 -78.358 86.731 -78.764 129.868 -49.884 85.394 -52.508 145.599-110.004 90.451 -41.700 127.663 -75.956 91.953 -58.258 122.238 -37.105 91.017 122.681 132.345 -77.405 92.492 46.913 140.699-104.266 91.125 47.388 125.420 -5.650 91.852 54.558 147.260 -26.302 89.220 40.125 141.809-150.961 95.668 77.870 103.031 -80.435 92.508 0.000 128.889 -76.683 # 534 total E -1.46912E+02 rmsd from N 0.000 %NC 0.00 92.633 71.840 134.359 -84.246 93.577 58.019 144.085 41.655 94.454 38.987 104.710 -81.096 91.993 52.435 133.150 -78.227 91.242 43.157 145.196-134.068 90.402 46.956 66.087 -76.039 89.053 47.763 113.620 -53.384 88.101 55.402 128.614 -97.946 86.362 45.433 119.892-111.054 93.221-170.309 81.684 -87.638 93.778 91.775 151.649-175.260 94.546 48.129 92.922-123.453 92.488 47.229 106.026 -86.335 90.041 62.261 154.176-111.953 89.286 41.541 120.339-118.708 94.612 58.534 130.443-102.666 99.193 -26.819 121.698 -50.542 117.045-166.391 148.378 -20.799 114.681 34.899 92.472 144.401 97.825 36.756 142.687-132.906 100.382 33.382 0.000 0.000 96.305 42.949 156.657-166.093 94.279 45.099 162.307 177.233 90.521 44.047 111.321-147.584 90.918 45.162 115.080 -79.671 92.180 49.973 149.522-128.189 91.307 52.437 124.173 171.791 91.762-116.370 138.684-114.559 96.024-167.024 109.416 -79.848 125.192 -43.157 112.018-113.281 98.837 -33.977 111.100 -78.634 98.405 -34.289 119.820 -38.299 98.562 -38.499 118.051 -77.592 93.392 -47.543 128.667 -77.262 88.468 -44.012 102.287 -80.388 87.831 -52.991 144.979 -35.893 90.814 -54.040 155.275-147.420 87.512 -42.051 121.560-116.262 94.481-121.585 135.302 5.977 90.957 52.347 132.645 -77.608 91.170 51.278 142.358-109.744 91.673 65.430 129.617 -37.844 90.063-101.499 138.045 -57.365 97.727 -28.278 108.745 -84.307 111.268-122.999 147.738 -16.778 92.894 0.000 129.574 -76.134 # 535 total E -1.51355E+02 rmsd from N 0.000 %NC 0.00 93.177 176.906 134.402 -81.362 93.157 61.111 145.866 52.463 94.518 39.131 106.206 -81.806 92.180 51.679 132.863 -77.425 92.061 39.935 151.624-143.502 91.169 46.005 63.572 -75.812 89.378 46.098 113.708 -48.151 89.890 49.333 136.970 -90.157 88.390 41.874 128.422-119.141 90.973 46.454 86.527 -99.336 92.294 104.601 138.894 -94.295 89.059 66.153 131.805-159.034 91.231 47.698 99.242 -83.050 93.980-176.059 116.946 -45.692 125.334 6.136 155.132-174.446 96.203 53.949 131.849 132.594 95.000 35.722 129.059 -83.934 92.811 48.958 147.650 73.215 91.301 46.906 127.472-145.468 90.180 48.766 136.376 177.658 89.225 44.552 0.000 0.000 91.521 48.193 104.616 -79.644 88.771 46.454 154.790 -76.530 91.267 41.441 116.131-130.531 90.151 47.855 111.390 -77.687 89.023 60.302 143.462-104.166 90.130 45.298 143.450-124.134 92.041 39.717 152.580 -22.099 98.825 -2.260 115.269 -88.133 137.334-160.999 101.788 -86.912 95.844 49.027 125.176 36.905 92.064 51.022 104.674 -4.041 90.262 47.803 122.299 -0.426 91.544 47.171 130.476 -76.502 89.843 40.599 138.607-148.593 91.738 44.606 118.443 -20.678 92.253 46.885 137.614 -44.678 90.789 39.683 130.648 -78.173 92.454 118.045 106.780-100.661 91.184 -47.136 130.191 -78.259 93.849 -45.693 143.573-128.143 93.594 -35.984 125.104 -12.851 93.401 -53.270 159.083 -30.803 91.905 -44.997 144.293-155.339 93.968 86.334 101.791 -80.378 92.543 0.000 128.837 -76.701 # 536 total E -1.48972E+02 rmsd from N 0.000 %NC 0.00 122.010 -91.243 151.970 -82.789 94.960 -47.033 117.207 -81.577 90.508 -47.946 103.127 -77.446 90.336 -47.794 128.751 -75.733 91.269 -40.899 140.829-126.906 94.043 -40.605 60.553 -62.711 93.172 -40.948 133.205 13.305 99.067 -40.976 170.526 155.182 96.642 -48.659 126.937-115.228 102.711-153.116 115.968 -34.835 123.569 59.467 156.493-168.444 94.779 42.629 95.481-120.851 92.316 47.903 107.754 -84.255 91.317 60.317 149.283-104.953 88.008 53.173 134.256-141.185 90.947 38.949 132.263-114.846 96.617 177.442 129.108 -85.836 141.813 22.647 132.593 105.827 94.681 45.714 127.843 125.642 95.796 38.560 146.409 -30.482 97.446 38.384 0.000 0.000 103.118 24.209 154.327 -5.096 98.684 42.136 173.412 173.053 92.056 44.820 119.081-154.826 91.484 45.608 107.378 -76.582 91.361 46.389 146.538 -40.711 91.986 42.067 144.005-162.954 93.163 51.093 113.698 -88.554 94.725 -6.898 119.578 -85.775 137.230-175.629 105.878 -94.168 98.938 39.360 115.662 -78.002 92.877 49.562 107.953 -18.119 89.342 56.509 140.368 -30.243 91.173 48.149 127.623 -75.229 91.652 37.840 102.299 -83.133 92.639 49.990 120.635 -55.298 92.907 105.424 129.883 -58.423 88.674 62.784 130.716 -77.622 90.979 119.392 85.857-102.058 90.736 -49.763 129.797 -77.135 92.000 -44.832 145.809-139.309 88.628 -51.009 122.554 -4.788 90.304 -60.753 157.644 -23.405 91.101 -34.044 147.978-148.346 98.835 78.978 95.994 -78.252 92.401 0.000 129.019 -76.484 # 537 total E -1.46710E+02 rmsd from N 0.000 %NC 0.00 93.237 -83.354 124.169 -65.595 118.683-103.182 130.849 -29.223 93.071 44.940 108.485 -78.783 93.352 45.766 131.036 -77.981 94.654 44.803 144.270-124.976 92.247 42.353 57.901 -77.900 91.461 43.510 124.960 -36.298 92.551 41.113 128.839-106.290 91.295 51.031 137.842-126.898 87.738 51.007 82.867-102.851 92.099 153.226 127.108 -82.813 92.025 88.220 128.108-152.765 96.108 103.619 97.780 -83.492 93.153 -70.606 142.873 -93.398 96.212-117.669 150.857 -38.373 90.272 51.734 136.323 116.409 91.668 47.059 136.536 -83.743 91.053 45.988 140.943 -20.446 89.972 48.443 137.644 -19.750 88.435 51.247 111.097 -82.662 89.861 44.399 0.000 0.000 89.029 49.148 122.182 -76.339 89.343 44.464 133.036 -87.763 89.363 47.657 122.716-124.313 88.005 50.379 110.249 -78.459 89.879 47.006 134.029 -97.729 92.024 47.290 131.284-127.883 94.513-102.522 108.641 -86.519 110.668 109.941 152.427-134.744 119.407 31.297 113.469-118.759 94.377 169.306 116.041 -78.182 139.394 55.362 134.824 146.874 106.499-114.775 112.261 -75.816 90.440 56.803 131.445 -76.886 89.215 45.351 105.695 -83.627 89.694 46.995 117.108 -21.165 90.163 47.775 138.121 -44.826 90.444 44.607 129.820 -77.181 91.143 117.350 114.629-104.713 91.191 -44.758 130.021 -78.576 92.306 -48.433 144.973-131.602 88.973 -47.481 121.859 -6.637 91.343 -54.738 154.806 -25.129 90.050 -37.234 138.431-136.337 98.330 76.190 98.572 -79.506 92.392 0.000 129.199 -76.336 # 538 total E -1.49682E+02 rmsd from N 0.000 %NC 0.00 92.991 -54.073 130.242 -89.088 95.154 -46.262 115.012 -80.959 90.991 -46.489 103.100 -77.400 90.329 -47.152 129.532 -76.091 92.036 -41.180 139.755-124.569 94.200 -40.136 61.382 -64.338 92.476 -40.946 130.173 24.957 100.866 -41.290 169.910 162.527 91.559 -62.670 115.513-116.663 88.181 -82.408 83.475 -90.393 109.159 161.289 141.570 164.928 105.521 -26.207 93.342-100.168 101.276 121.929 108.219 -82.083 95.770-125.665 153.606-137.661 110.573-112.801 154.006 -23.547 93.719 44.337 143.917 159.343 91.990 46.634 136.388 -84.499 90.142 49.643 118.623 -65.827 90.940 51.877 112.250 -38.598 91.171 41.450 108.716 -81.671 90.240 46.281 0.000 0.000 89.519 62.510 107.943 -85.884 86.248 48.164 142.289 -80.451 89.055 44.029 118.282-127.079 88.898 53.601 108.503 -75.378 89.746 45.446 143.786 -93.616 92.571 45.148 129.975-135.136 96.536 -8.034 114.497 -91.730 130.678-137.050 112.286 -72.352 96.327 98.496 136.915-163.419 91.196 49.827 113.564 -76.216 89.515 65.897 130.749 -52.400 88.062 51.541 105.501 -71.635 90.149 43.083 128.039 -75.550 90.338 47.315 103.739 -83.770 90.736 45.174 121.602 -76.983 90.420 48.228 132.823 -83.874 89.858 49.352 128.215 -76.884 91.519 71.333 97.631 -67.010 90.756 -92.690 129.145 -76.255 95.920 -41.048 142.460-118.698 94.488 -41.128 117.104 23.734 93.701 -51.197 144.543 -44.801 92.216 -43.235 140.947-162.075 97.356 69.443 104.693 -79.701 92.475 0.000 129.287 -76.350 # 539 total E -1.48731E+02 rmsd from N 0.000 %NC 0.00 93.116 155.795 141.427 -99.274 92.953 56.148 144.839 15.049 92.458 44.866 105.715 -82.955 92.252 48.875 130.624 -76.717 93.475 44.935 138.673-112.184 89.475 42.967 63.313 -78.422 90.925 46.785 121.338 -47.162 92.308 39.911 128.965 -97.346 90.703 46.919 145.559-146.425 89.443 56.667 79.064-104.347 91.043 144.367 129.798 -82.322 92.352 63.785 129.531-154.419 97.581-146.479 100.416 -85.145 136.080-144.973 155.347-157.248 102.023-124.941 151.897 -34.587 94.244 46.280 140.459 140.809 91.906 47.164 136.966 -82.671 90.845 48.361 122.310 -35.981 91.238 47.810 124.420 115.875 91.828 40.728 146.441 -38.150 96.093 39.327 0.000 0.000 96.655 39.427 156.702-177.286 94.097 41.776 166.525-171.176 91.832 46.292 116.943-156.917 91.005 44.900 111.129 -76.551 91.096 46.595 145.544 -95.910 94.097 38.183 135.764-166.508 95.719 45.455 151.063 -23.765 96.455 25.835 153.989 -23.741 125.688-121.148 114.453-114.378 99.013 -14.851 114.283 -78.041 94.877-120.408 114.032 -18.858 103.253 -33.257 117.412 -76.914 96.274-106.365 127.335 -75.957 83.450 83.645 103.111 -81.303 91.963 53.669 117.167 -40.064 89.814 46.611 144.704 -24.264 90.091 44.997 128.572 -76.610 92.549 90.914 116.991 -75.241 85.143 -83.118 129.659 -77.599 90.430 -52.268 144.051-126.373 86.671 -53.303 111.654 4.553 90.493 -53.139 141.978 -26.181 91.185 -36.158 136.168-102.148 99.719 89.394 99.147 -79.189 92.399 0.000 129.363 -75.904 # 540 total E -1.48321E+02 rmsd from N 0.000 %NC 0.00 93.279 -84.610 121.678 -59.492 117.360-103.476 130.925 -38.190 92.178 47.070 107.157 -76.942 93.042 44.312 130.576 -77.895 94.361 44.725 147.001-142.271 93.696 42.708 52.610 -70.867 90.173 45.778 126.744 -27.351 90.309 48.978 132.472-107.863 88.144 50.827 131.987-129.126 87.981 49.038 83.526-102.204 91.617 175.021 137.312 -91.227 91.995 71.447 105.708-145.204 93.130 41.843 99.482 -82.105 95.693 110.958 135.187 -28.130 95.866 37.690 141.888-162.276 96.919 35.364 132.571-117.401 111.700 18.767 142.853 -72.023 93.220 54.788 162.276 155.775 91.055 47.353 134.711 -44.911 90.782 42.430 106.737 -83.196 91.846 43.767 0.000 0.000 88.709 56.666 134.656-111.265 89.004 44.502 112.790-109.781 90.233 41.719 121.384-118.209 90.679 48.428 113.589 -79.221 90.207 50.007 138.664-107.539 90.644 46.030 126.685-147.711 93.831-105.339 103.556 -82.286 115.656 178.397 151.782 -16.804 125.861 -76.627 110.313-108.230 93.299 -44.972 109.748 -77.695 90.807 -48.848 109.627 -43.025 89.646 -46.547 118.766 -72.097 91.634 -44.136 127.787 -76.007 90.129 -45.008 99.924 -81.072 88.042 -53.568 124.318 -13.196 92.188 -36.320 153.577 -9.352 93.765 -52.208 128.697 -76.313 97.200 -66.582 135.235 23.170 91.424 100.915 129.586 -75.631 93.530 37.669 140.271-106.749 90.976 51.277 134.192 -1.087 91.193 55.749 145.843 -39.324 89.295 44.015 143.257-147.966 93.793 90.707 104.564 -81.071 92.602 0.000 128.801 -76.802 # 541 total E -1.49800E+02 rmsd from N 0.000 %NC 0.00 92.464 122.915 120.313 -42.291 93.831 54.083 149.449 45.443 94.739 42.752 108.643 -76.735 92.971 44.228 130.355 -75.906 96.631 40.456 145.864 -21.160 94.407 41.803 52.158 -79.504 88.692 53.880 152.302 148.226 89.437 47.297 137.012 -94.072 86.909 53.043 149.433 159.397 87.545 56.319 65.667-111.239 88.265-177.951 134.240 -77.006 99.892 99.099 130.161-153.886 88.893 104.074 108.236 -86.940 124.582-134.731 137.518-104.254 102.960-111.247 152.042 -28.368 93.896 45.306 143.168 142.141 91.764 47.540 137.011 -84.181 90.264 49.775 116.536 -55.319 90.736 49.896 107.856 -31.286 89.735 44.496 153.271 -13.364 89.507 48.993 0.000 0.000 89.194 55.233 106.971 -79.158 87.854 45.210 142.562 -76.570 90.135 44.308 121.439-128.397 90.032 50.281 109.587 -75.037 91.461 41.146 135.066 -92.157 95.016 46.183 137.323-178.086 94.905 27.349 151.421 -24.510 108.662 20.438 153.624 -20.578 135.893-170.191 109.375-100.328 130.366 81.147 122.473 -81.518 117.923-108.189 130.067 -33.399 93.731 46.188 117.507 -72.933 92.516 43.520 128.251 -75.602 88.918 49.754 117.443 -85.001 91.077 42.276 126.490-108.242 91.177 49.957 143.474 163.346 88.994 48.965 128.413 -76.543 89.817 49.933 97.660-112.881 89.730 45.401 130.772 -75.785 91.616 39.713 136.162-107.463 91.995 46.445 129.814 -45.408 90.308 52.057 133.099-108.487 90.436 43.503 133.078-133.152 95.361 72.941 103.908 -80.993 92.601 0.000 128.928 -76.623 # 542 total E -1.51992E+02 rmsd from N 0.000 %NC 0.00 93.371 176.605 139.540 -99.139 93.499 54.907 144.796 38.021 92.429 43.328 105.800 -82.203 91.714 54.108 132.506 -77.769 91.738 42.462 148.982-138.137 90.467 45.166 66.994 -81.577 89.716 49.981 121.185 -59.415 88.922 47.846 133.087-105.536 86.757 54.267 139.571-169.126 85.818 72.134 85.616 -86.006 88.437 61.536 136.140 -82.123 94.826 31.452 101.364-106.269 98.166 126.047 112.750 -87.450 143.953-105.109 173.690-159.510 106.439-120.840 140.989-148.492 94.709 46.906 150.321 164.653 92.711 46.144 135.686 -84.862 91.029 48.215 134.528 -60.016 91.375 47.753 123.682 -45.417 90.872 45.375 147.583-159.932 91.708 41.862 0.000 0.000 91.606 50.260 113.771 -81.427 88.780 44.507 144.460 -83.169 90.785 44.367 118.606-126.996 89.962 48.109 107.289 -75.591 90.208 50.850 131.677 -75.404 92.406 42.217 136.444-138.489 96.147 30.335 143.822-134.774 125.322 63.759 164.324-152.153 133.466 -70.030 116.082-110.567 116.415 -11.805 114.599 -80.599 92.064 -53.209 109.809 -56.141 91.783 -44.986 109.701 -71.585 90.444 -46.629 127.336 -74.883 88.581 -42.287 107.666 -88.681 90.445 -53.589 104.660 -76.049 86.323 -52.369 157.172-130.398 89.490 -46.599 129.968 -77.336 94.975-126.540 120.904-123.007 90.242 48.927 131.739 -76.712 90.992 51.100 140.489-107.381 89.286 54.069 108.253 -9.282 91.591-140.129 130.935 -66.405 97.567 31.174 103.118 -86.702 123.020 10.227 103.674 -77.651 92.482 0.000 128.723 -76.443 # 543 total E -1.48624E+02 rmsd from N 0.000 %NC 0.00 93.203 162.644 139.563 -94.826 93.329 55.649 140.217 31.198 92.376 44.672 106.247 -82.067 91.816 48.637 131.865 -77.872 93.182 44.332 147.229-123.584 90.902 44.341 59.414 -73.083 89.625 48.224 128.544 -40.789 90.929 47.118 123.395-105.746 87.289 45.592 141.945-157.495 89.208 53.748 79.297-102.837 89.779 130.079 137.161 -88.283 90.201 79.401 102.071-129.348 91.123 97.877 97.736 -85.279 92.389 -68.390 117.738 -78.781 100.595-117.911 150.152 -40.839 90.827 53.499 138.766 119.500 91.334 47.845 137.955 -82.972 90.172 47.521 148.962 -10.980 90.014 49.559 137.090 -19.917 88.825 49.140 142.627-150.994 89.324 46.908 0.000 0.000 89.041 52.970 117.749 -77.917 88.253 45.472 140.097 -84.800 89.507 46.889 121.058-127.569 88.122 54.529 111.476 -77.649 88.970 54.838 143.596-109.875 88.728 41.880 122.738-147.675 95.967-116.175 104.719 -82.634 109.492 175.916 155.817-139.608 99.885 -60.917 92.902-101.314 91.572 -49.927 109.885 -75.508 89.603 -55.047 143.825 8.325 95.336-128.631 131.386 -24.239 90.442 40.939 128.822 -76.593 90.388 54.362 99.620 -77.861 89.970 53.862 140.863 -26.040 88.649 42.827 131.325-101.650 90.838 43.339 127.959 -76.491 90.080 54.600 131.829 -81.282 89.601 47.320 128.809 -75.867 90.401 40.377 138.234-122.896 92.121 47.320 128.392 -42.700 90.707 51.783 137.161-101.582 90.642 42.741 133.287-143.563 95.975 106.473 146.778 -24.460 123.668 0.000 144.737 -91.995 # 544 total E -1.51276E+02 rmsd from N 0.000 %NC 0.00 93.092 -58.313 130.033 -87.781 94.398 -46.591 117.280 -81.595 90.282 -48.695 103.157 -77.407 90.137 -47.799 128.683 -75.714 91.547 -41.029 140.122-128.555 93.806 -41.057 60.942 -63.647 92.872 -41.619 133.182 3.677 99.657 -37.821 170.309 158.390 96.998 -54.895 127.996-118.533 96.836-145.047 81.503 -79.038 120.179 79.919 158.757-174.522 95.741 40.044 90.629-118.851 92.405 50.364 132.187-113.435 92.280 55.395 134.981-153.521 88.928 57.282 142.688-170.524 89.829 42.070 127.636-122.928 96.428-156.755 126.527 -93.138 143.721 -20.124 123.994 52.900 96.848 44.000 148.267 86.747 94.688 40.006 148.610 -36.713 92.570 50.312 0.000 0.000 91.395 43.706 149.777 -13.036 90.988 45.037 173.636-167.486 90.363 47.940 114.270-146.784 90.751 44.995 110.209 -75.489 91.716 42.648 145.326 -47.490 94.432 38.728 140.268-146.632 95.728 51.744 107.585 -85.280 93.859 25.036 150.548 -31.186 125.458-121.158 112.430-112.680 96.698 -18.625 113.722 -77.874 97.679-135.281 117.885 -7.331 103.390 -38.601 112.148 -73.837 93.298 -42.201 127.064 -76.229 94.381 -37.315 99.930 -81.590 90.447 -47.981 125.842 -11.793 93.740 -38.303 155.390 -9.374 92.674 -49.902 129.222 -76.789 92.298 -59.248 130.224 24.484 92.659 114.638 129.660 -76.646 95.726 33.320 139.889-107.985 91.980 57.903 124.985 1.576 91.458 71.547 145.139 -40.074 88.336 47.215 139.131-145.921 95.614 76.226 103.174 -79.399 92.394 0.000 129.362 -75.966 # 545 total E -1.49275E+02 rmsd from N 0.000 %NC 0.00 93.005 -76.273 120.330 -54.985 121.119-102.117 128.151 -35.441 94.813 38.282 110.021 -81.434 93.935 52.037 130.068 -75.924 90.273 41.903 152.532-158.279 89.536 48.108 66.908 -78.843 91.219 44.294 116.070 -44.472 89.076 39.642 143.240 -93.784 92.956 50.627 115.638-105.290 89.058 64.840 93.823 -93.023 87.404 150.791 129.676 -94.269 92.498 91.539 124.684-149.370 89.935 92.670 100.592 -86.669 91.174 -71.684 128.793 -96.618 100.669-118.410 151.388 -34.925 91.174 50.610 131.681 72.964 90.971 48.539 136.312 -81.881 91.066 47.930 136.425 -52.384 89.975 45.520 138.756 -12.270 89.080 49.433 110.172 -80.244 90.021 46.813 0.000 0.000 89.299 46.351 117.657 -79.137 90.567 42.291 138.119 -86.275 91.015 47.210 121.832-126.519 89.404 55.253 111.409 -78.298 90.458-120.851 129.035 -94.922 95.619 -90.962 135.033-104.276 94.368 20.631 142.574-162.794 106.384 151.067 151.986 -14.399 105.679 -38.583 91.310 -99.267 96.586 -38.389 112.751 -76.401 93.585 -44.701 106.294 -56.180 90.674 -48.981 111.347 -72.776 90.843 -43.196 128.130 -77.115 92.126 -40.712 100.076 -80.853 88.976 -49.385 123.050 -12.869 93.002 -38.280 156.781 -10.284 92.738 -50.355 128.835 -76.737 92.245 -60.913 124.348 -41.247 91.445 109.272 129.605 -75.880 93.805 38.179 139.812 -96.460 91.036 50.996 125.934 9.114 91.497 53.325 147.936 -38.046 89.951 39.390 141.413-143.266 94.520 83.585 105.762 -81.304 92.606 0.000 128.689 -76.870 # 546 total E -1.52412E+02 rmsd from N 0.000 %NC 0.00 93.225 172.603 138.260 -92.275 93.739 55.712 146.003 49.798 93.677 45.064 107.635 -77.394 92.677 41.595 132.597 -78.390 97.519 42.766 144.569-121.083 93.441 38.589 49.306 -76.809 91.812 46.861 160.283 136.773 93.165 40.252 136.554 -94.373 92.485 42.918 141.564-129.022 89.941 50.971 86.029-109.115 91.396 152.815 127.809 -95.059 92.382 88.826 128.618-154.709 91.862 108.250 99.434 -85.188 92.387 -69.075 129.884-103.331 96.864-121.469 151.200 -34.705 91.111 49.460 139.604 126.759 91.517 47.928 136.651 -84.092 90.782 46.437 126.261 -54.736 90.589 48.070 126.701 -24.407 90.135 46.425 109.391 -82.849 90.318 45.010 0.000 0.000 89.695 49.802 109.809 -81.772 89.313 48.190 142.417 -76.926 89.528 42.843 121.805-129.070 89.029 50.497 114.071 -77.599 90.230 48.800 138.648-107.747 92.269 49.647 136.226-128.323 93.454-104.658 141.381-121.031 105.536-170.051 151.355 -19.474 102.507 -44.962 96.723-100.621 100.534 -33.356 112.433 -77.785 93.680 -43.401 111.117 -54.670 91.381 -49.641 107.691 -72.469 89.348 -46.907 127.752 -76.363 89.889 -40.634 100.381 -80.890 90.274 -47.180 122.343 -19.434 92.456 -36.352 159.101 -11.754 93.108 -53.459 128.860 -77.032 90.201 -53.478 123.811 -39.866 90.573 120.925 129.528 -75.957 92.867 43.614 142.601-105.550 92.160 45.721 122.636 -3.304 93.856 37.698 146.784-114.580 97.847 46.805 134.599-150.105 99.664 -1.954 104.228 -79.987 92.517 0.000 129.561 -76.509 # 547 total E -1.47993E+02 rmsd from N 0.000 %NC 0.00 93.265 -66.961 129.879 -85.699 94.744 -45.574 116.471 -81.261 90.424 -48.602 102.839 -77.395 89.997 -47.170 130.172 -76.484 92.984 -40.438 140.909-129.786 93.834 -43.535 62.292 -71.127 91.392 -41.084 131.446 43.279 105.923 -59.222 165.939 160.142 95.761 -23.640 129.469-102.605 109.693-133.193 80.700 -77.337 111.761 53.388 151.505-168.911 95.216 41.290 93.295-119.563 94.127 42.256 137.125-121.969 92.938 54.090 138.177 -34.643 90.683 40.850 110.183 -93.799 92.562 47.027 133.728-102.322 93.398 45.751 124.500 -67.236 94.002-126.636 114.890 -63.573 95.007 -65.775 138.152-124.181 96.081 103.640 151.923-158.781 95.675 39.486 0.000 0.000 92.688 46.072 176.439-175.646 93.534 48.563 147.269-177.723 90.349 47.443 124.382-102.990 89.990 44.579 116.197 -76.926 91.903 47.970 154.895-139.696 92.355 53.346 130.163-154.983 92.852 -91.240 151.268 -33.340 116.891 115.315 115.502 -76.873 133.499 151.971 108.006-100.818 97.981 39.514 145.805-140.048 93.533 47.538 132.783 127.344 94.884 86.248 116.333 -74.725 86.328 -78.840 129.635 -76.589 91.707 -43.336 105.400 -87.194 88.153 -55.207 102.828 -60.400 86.212 -52.581 152.349 -41.816 90.488 -56.343 127.096 -74.303 90.055-127.606 122.792-124.541 90.058 56.974 132.537 -77.439 91.333 45.890 139.858-105.043 90.003 46.947 123.890 -20.434 90.686 67.256 145.346 -38.586 87.690 53.299 136.984-137.894 91.811 102.565 100.866 -79.911 92.573 0.000 128.686 -76.569 # 548 total E -1.55626E+02 rmsd from N 0.000 %NC 0.00 93.185 -79.738 124.701 -65.487 118.523-106.442 133.485 -33.951 92.410 46.035 107.532 -80.767 93.599 47.201 130.362 -77.680 95.199 44.337 149.391-124.037 91.149 43.670 61.133 -84.513 91.158 44.544 123.387 -47.982 93.766 41.197 121.909-102.987 90.215 46.987 147.723-154.680 92.458 79.568 83.717-106.818 92.169 -63.796 137.815-103.319 104.226 -70.356 89.794 -83.702 89.536 -74.867 148.185 -11.068 122.172-155.036 161.863-172.380 99.510-113.959 135.433-152.260 91.041 53.592 132.813 120.573 90.738 47.852 135.078 -85.042 90.471 47.966 127.461 -61.694 90.673 45.814 140.531 -15.601 92.048 44.549 143.529-164.892 89.944 45.156 0.000 0.000 89.953 54.263 103.450 -82.316 87.127 48.330 149.068 -72.591 90.040 41.189 119.473-130.432 90.120 47.916 109.744 -76.454 88.682 56.676 141.955 -95.619 90.525 43.132 143.124-121.426 92.259 41.933 142.563-129.137 97.718 -1.546 139.812-103.520 132.743-161.635 110.354-104.944 94.384 50.775 133.965-162.673 91.791 54.070 106.674 -24.568 90.976 47.836 128.382 -13.324 91.397 45.293 130.220 -77.052 89.510 45.046 102.293 -83.783 90.964 49.681 123.653 -38.510 91.564 45.635 131.916 -62.708 92.192 35.413 129.532 -77.449 97.053 115.067 103.355 -90.421 91.104 -65.977 129.974 -77.889 92.211 -42.415 143.464-124.268 90.225 -46.534 127.585 -26.291 92.362 -57.513 149.316 -36.383 89.671 -55.230 136.327-121.311 92.945 82.601 102.986 -79.448 92.454 0.000 129.140 -76.246 # 549 total E -1.46987E+02 rmsd from N 0.000 %NC 0.00 93.141 -67.172 129.769 -85.362 94.666 -45.549 115.558 -79.673 90.438 -47.895 102.450 -73.434 90.427 -46.736 130.421 -77.135 95.956 -35.697 142.820-126.333 96.815 -40.143 60.098 -70.563 92.805 -40.166 136.875-152.884 103.566 -46.732 176.425 178.494 93.195 -30.420 127.023-112.296 107.851-130.416 74.366 -79.107 115.276 75.977 162.764-162.641 94.881 41.580 93.932-119.807 93.367 45.405 112.519 -87.624 91.962 48.582 146.324-125.451 90.165 51.625 109.376 -89.548 90.271 43.211 130.731-106.239 95.244-121.824 119.457 -70.119 110.613-168.073 141.532 13.960 102.524 -55.487 159.774 -35.404 97.389 -51.824 99.784 -80.309 94.386-104.862 0.000 0.000 137.892 -20.818 167.098 137.024 91.979 52.245 147.069-105.787 92.739 39.085 114.688-132.886 90.607 54.199 113.047 -74.123 89.296 47.266 137.702 -99.457 92.806 50.810 132.412-145.685 95.639 -88.465 150.267 -31.449 116.538 173.975 162.626-151.564 105.399 -29.489 95.296-111.337 97.934 -50.877 113.167 -77.404 94.717-127.705 129.728 -65.449 90.410 71.133 120.087 -77.818 90.918 49.064 128.879 -76.041 88.601 45.866 107.273 -83.107 89.830 52.861 139.394 -96.720 88.194 49.185 139.667-134.501 88.644 46.383 128.181 -76.633 88.468 54.656 109.269 -54.008 89.798 44.817 127.604 -75.615 90.514 46.742 139.099-123.707 90.924 53.380 127.608 -41.902 90.692 46.646 136.426 -89.896 92.186 47.431 143.803-179.840 94.829 71.717 104.201 -81.464 92.486 0.000 128.906 -76.505 # 550 total E -1.46408E+02 rmsd from N 0.000 %NC 0.00 93.370-160.721 136.320 -88.735 94.631 57.330 137.340 50.992 94.520 41.191 106.415 -80.853 91.858 46.264 132.355 -78.279 92.802 46.295 146.554-141.585 93.137 43.755 57.109 -68.935 89.364 46.441 127.834 -29.088 90.659 51.629 123.730-113.639 87.019 48.737 138.939-176.470 92.919 83.276 80.307-104.395 90.983 -72.427 139.726 -95.225 95.645 -44.220 97.073 -91.139 87.807 -64.442 109.233 -76.621 92.267 -51.046 124.765 -83.542 90.028 -38.402 131.027-165.599 96.765 -51.341 136.033-102.602 96.012 112.052 154.545 -60.482 94.499 42.217 113.766 -65.143 93.493 50.201 157.476 -25.692 93.426 42.506 155.269 -9.643 90.405 43.267 0.000 0.000 90.278 52.221 104.652 -85.736 88.815 49.603 145.224 -79.266 90.453 40.206 122.410-132.843 90.431 49.176 111.589 -77.334 89.595 63.550 135.724 -96.488 89.995 44.437 133.519-114.581 91.625 43.225 113.372 -89.639 97.358 18.591 139.656 -91.168 134.507-138.935 109.371-100.725 132.045 53.439 121.283 -82.360 124.931-110.061 134.698 -32.481 92.812 51.470 118.897 -71.990 91.297 45.259 128.693 -75.808 88.526 47.881 109.544 -80.491 91.223 43.730 129.179 -90.376 90.437 47.204 157.914 174.407 90.569 41.740 127.845 -76.429 90.365 48.104 104.981-103.745 90.324 46.869 130.245 -77.604 90.486 44.896 137.808-109.700 90.632 47.071 127.934 -42.156 90.477 52.345 136.816 -99.832 90.411 43.507 132.968-139.256 95.456 72.925 104.062 -80.538 92.582 0.000 128.982 -76.659 # 551 total E -1.49949E+02 rmsd from N 0.000 %NC 0.00 93.017 -55.530 130.563 -90.691 94.679 -46.642 116.652 -80.661 90.743 -47.472 103.032 -78.015 89.958 -49.042 129.349 -76.094 92.113 -38.632 139.136-128.508 93.298 -44.039 63.458 -70.991 91.472 -38.093 132.746 53.111 106.472 -43.243 171.443 172.370 92.104 -33.173 128.991-120.226 106.050-117.279 71.634 -79.177 123.341 87.568 172.569-176.517 91.048 48.010 96.582-120.403 93.097 45.688 98.185 -83.358 90.820 55.334 121.682 11.775 89.956 44.250 110.153 -88.218 93.091 40.734 132.464-101.638 99.510 -62.668 135.704 -73.978 131.433-172.151 120.604 -76.965 97.185 48.065 159.348 -42.960 98.884 33.627 147.919 -40.271 98.292 40.667 0.000 0.000 91.879 48.146 150.609 -5.533 91.550 48.767 165.833-131.514 90.089 44.945 112.834-142.330 89.721 49.682 111.135 -73.084 91.523 43.131 144.663 -36.419 93.999 43.656 136.070-135.615 95.458 28.025 115.855 -90.552 108.722 163.628 111.535 -80.962 114.607 43.089 129.921-143.999 98.839 36.139 115.491 -78.408 96.715 37.545 115.757 -19.450 93.384 50.468 116.148 -66.831 91.763 41.047 128.247 -77.385 90.777 42.810 102.123 -84.663 91.170 49.835 116.424 -42.105 92.171 46.672 131.689 -58.558 90.616 36.150 130.894 -78.127 94.049 96.443 101.003 -96.409 90.879 -71.924 129.288 -77.750 92.461 -55.131 144.423-154.268 92.083 -40.199 142.726-100.129 96.258 122.602 141.963 -38.262 99.742 16.685 141.416-163.033 100.207 39.819 107.110 -77.917 92.465 0.000 129.382 -76.406 # 552 total E -1.48470E+02 rmsd from N 0.000 %NC 0.00 92.758 138.570 135.494 -78.888 94.454 50.718 124.864 76.026 90.617 46.682 107.217 -79.335 91.134 57.194 129.747 -77.138 92.330 132.690 139.034 118.007 88.337 -41.293 65.180 -63.178 94.477 -43.729 133.948 -32.905 98.333 -38.963 132.972 -84.192 91.225 -49.226 143.371-143.477 90.192 -59.652 70.844 -80.508 98.487-168.136 146.087 -32.453 96.369 -75.539 104.315 -92.714 103.309 147.671 107.581 -82.152 101.410 -83.164 162.303-142.668 110.019-114.961 153.839 -23.878 94.615 41.968 156.867 137.347 92.088 47.276 135.934 -83.218 91.088 45.910 123.649 -68.958 92.862 49.126 106.962 -26.475 91.994 38.803 106.515 -81.420 90.234 50.878 0.000 0.000 92.109 45.770 102.478 -85.846 91.558 44.366 152.915 -77.305 92.273 39.084 115.195-128.693 90.248 57.768 113.936 -78.709 91.085 60.536 142.397-112.220 88.161 41.966 125.370-173.259 94.937 40.210 114.876 -88.799 122.775-171.251 110.260 -74.755 94.968 67.494 133.300-158.849 90.307 51.472 113.307 -76.658 89.430 60.816 136.811 22.635 87.898 50.571 110.679 -70.648 90.366 42.508 128.623 -76.109 90.187 46.297 139.980-144.148 89.918 50.598 137.073 -31.730 88.640 46.105 140.720 -98.928 91.312 40.003 128.248 -76.888 91.394 46.412 113.050 -41.523 90.626 47.773 129.991 -77.730 90.070 47.172 139.826-139.588 89.750 47.101 127.755 -41.872 90.082 53.490 135.027 -84.489 90.096 43.545 134.574-128.063 95.444 74.784 104.271 -80.414 92.514 0.000 128.928 -76.562 # 553 total E -1.46634E+02 rmsd from N 0.000 %NC 0.00 93.258 -79.757 127.272 -77.101 93.142 -51.805 114.231 -71.419 92.162 -40.906 103.824 -75.473 93.046 -45.479 126.576 -74.231 99.843 -13.715 153.603-142.761 108.120 -34.716 56.761 -81.283 95.789 -27.068 124.149 -56.544 109.161 -26.089 141.544 -91.341 97.616 -39.941 154.787-161.575 99.328 -43.034 104.275 -99.933 96.604 112.969 128.345-132.680 108.484-147.791 89.315-108.211 107.470-172.584 107.377 -83.448 118.895 -69.145 146.128-128.392 96.493-121.502 110.618 -85.055 94.809 47.557 143.451 151.426 93.889 44.763 136.248 -85.410 91.256 46.135 127.107 -42.856 91.937 54.509 112.611 -34.172 90.137 44.628 109.322 -82.003 89.628 46.039 0.000 0.000 89.982 58.541 106.466 -79.926 88.298 46.722 138.770 -74.654 90.336 41.096 119.622-122.304 90.551 51.198 107.530 -75.053 90.714 49.204 134.767 -78.974 92.205 42.355 134.811-127.071 93.557 30.893 143.459-131.637 110.500 -23.121 115.018 -93.222 137.853-174.763 107.564 -95.153 96.766 38.358 139.814 144.248 106.816 137.864 125.373 117.398 124.059 -34.278 115.848 -80.184 94.346 -36.331 128.117 -75.680 96.232-102.465 100.652 -74.371 91.091 62.401 145.748 -28.485 91.947 57.241 150.236 -15.768 89.218 41.684 128.034 -76.186 90.341 50.508 110.908 -37.418 89.525 47.193 130.750 -77.403 89.663 48.559 140.915 -77.404 89.317 48.686 126.427 -37.211 89.285 55.006 137.599 -82.138 89.797 43.037 130.659-120.737 95.341 76.362 104.178 -80.395 92.529 0.000 128.952 -76.689 # 554 total E -1.49978E+02 rmsd from N 0.000 %NC 0.00 92.937 142.050 140.624 -95.040 93.838 50.433 148.238 58.091 91.009 50.005 107.197 -79.902 90.665 48.618 128.853 -75.773 91.929 44.765 154.810-143.319 92.820 40.820 123.103 150.475 92.316 43.434 124.698 -25.214 92.770 42.233 134.533-101.948 90.215 55.622 143.893-172.416 86.230 63.189 78.631-110.919 91.415 28.790 127.472 -84.322 108.343-127.382 98.645 -80.127 114.413-125.330 109.929 -82.372 139.654 37.397 176.419-169.610 96.161 46.508 144.262-160.335 94.452 38.947 138.501-104.878 101.420-168.358 124.420 -75.775 129.493 -58.912 129.298 54.406 96.077 52.630 148.171 -25.168 95.718 38.401 106.936 -83.018 91.010 49.324 0.000 0.000 90.559 51.074 103.467 -83.738 88.752 47.925 152.316 -78.784 91.456 39.435 117.430-131.575 90.625 50.530 114.731 -76.909 90.325 72.312 141.799-114.043 90.109 44.734 146.450-146.523 92.650 41.420 152.470 -22.158 99.907 -1.128 117.139 -89.851 135.132-169.303 107.090 -95.693 97.331 43.027 115.290 -77.585 92.159 49.933 104.247 -17.579 89.778 52.161 127.797 1.398 91.865 44.986 129.211 -77.068 90.333 41.586 102.261 -83.149 90.942 63.159 132.075 -38.938 89.603 59.506 132.212 -52.753 89.799 28.323 129.511 -77.350 96.623 122.922 106.473 -98.595 93.421 -61.367 130.234 -78.098 93.232 -43.890 143.452-130.377 92.036 -43.558 131.486 -47.616 93.868 -58.368 138.804 -47.110 90.120 -49.654 139.648-135.305 97.096 47.506 103.885 -79.787 92.377 0.000 129.584 -75.945 # 555 total E -1.48073E+02 rmsd from N 0.000 %NC 0.00 93.212 -76.008 127.208 -73.432 117.726-103.809 130.818 -26.589 92.295 44.549 108.001 -79.759 94.052 49.564 130.355 -76.795 94.141 39.374 144.588-124.045 92.348 43.898 62.664 -86.735 91.267 43.488 117.168 -51.638 89.974 49.570 133.492 -97.838 88.892 40.763 124.788-112.723 95.883 97.512 86.852 -96.014 93.666 -49.359 153.604-111.893 103.678 -61.693 89.787 -89.266 92.215-113.967 145.108 -6.759 92.951 45.750 141.779-145.586 95.495 54.557 110.643 -88.889 95.335 5.427 127.869 -74.487 114.742 49.945 152.947 5.588 123.378 -74.710 154.436-115.973 135.272-117.755 124.945 -74.754 92.878 54.957 146.573-152.912 91.216 48.210 0.000 0.000 89.550 48.307 135.730 -25.907 89.626 52.163 135.070 -84.259 88.494 50.560 125.948-130.494 89.299 45.104 109.494 -70.859 91.744 49.558 131.602 -74.222 92.721 40.861 137.144-139.409 95.366-120.326 103.750 -81.225 92.764-129.005 156.446 -7.638 103.747 -34.582 97.104-101.294 93.553 -46.887 112.201 -76.385 92.688 -60.453 104.615 -63.819 90.860 113.112 116.239 -76.439 94.152 42.271 128.629 -76.583 89.410 52.063 134.915-125.514 89.747 65.180 142.735 -36.709 88.244 49.191 150.145-110.416 90.119 39.772 127.914 -76.291 90.525 53.784 128.385 -98.694 89.717 49.421 128.708 -76.172 89.599 43.649 137.170-131.300 91.156 47.979 127.084 -41.350 90.812 51.152 137.647 -83.611 90.628 44.960 138.798-153.695 94.873 76.831 103.971 -80.438 92.521 0.000 128.955 -76.661 # 556 total E -1.46785E+02 rmsd from N 0.000 %NC 0.00 92.857 150.218 134.030 -81.596 125.734 100.038 139.535 42.077 113.694 -0.053 111.498 -82.589 118.618-129.187 130.411 -71.576 93.475 45.428 145.361-152.282 93.870 42.521 120.762-168.080 91.783 43.419 124.769 -51.397 93.676 44.578 129.269 -98.903 88.339 46.369 144.168-135.110 89.929 49.227 82.862-111.244 92.920 61.315 132.585 -93.736 96.227 -70.597 103.530-103.136 112.921 157.001 110.099 -86.890 148.579-142.377 170.731-162.398 102.694-121.845 140.453-154.613 94.883 45.761 141.807 155.200 91.406 50.232 135.249 -85.011 90.323 51.100 124.127 -58.715 91.860 46.560 117.524 -44.848 91.257 43.551 150.175 179.816 90.106 47.888 0.000 0.000 91.911 44.532 100.232 -79.022 92.643 44.931 163.630 -39.042 91.840 40.078 112.520-132.710 90.597 50.399 114.184 -78.952 90.667 53.635 141.967-112.538 90.514 42.809 151.803-141.147 93.063 39.474 143.023-129.994 99.905 10.466 115.661 -90.029 137.108-143.151 105.075 -91.019 131.187 60.080 121.196 -81.798 126.368-108.424 133.357 -33.575 93.355 48.966 113.262 -71.383 92.058 45.339 129.153 -76.190 88.578 46.482 108.593 -81.073 90.522 46.837 127.980 -89.131 90.098 46.330 144.872-111.577 90.513 41.598 128.116 -76.768 90.119 49.406 104.161-109.109 90.154 47.027 128.746 -76.508 90.877 44.071 135.124-141.695 91.222 45.435 127.081 -42.429 90.974 52.224 136.195 -88.445 90.396 43.891 135.072-140.021 95.314 74.596 104.053 -80.703 92.521 0.000 128.975 -76.666 # 557 total E -1.47405E+02 rmsd from N 0.000 %NC 0.00 93.297 166.486 140.144 -97.762 93.325 55.046 137.306 36.012 91.696 45.561 106.208 -82.668 91.877 48.549 131.114 -77.347 92.335 46.919 147.512-133.642 91.670 41.244 60.780 -72.807 92.105 45.239 125.864 -32.807 92.357 40.957 129.614-106.816 90.545 53.505 141.540-156.361 88.867 75.527 83.961-104.606 89.320-160.898 139.337-102.948 92.163 68.375 98.047-128.123 91.009 47.716 101.260 -82.548 92.100 52.300 134.570 -29.746 91.786 40.029 107.414 -91.503 94.431 43.260 135.261-102.847 100.610 -9.086 118.244 -71.072 140.905 160.164 118.200 -41.833 104.911 38.058 138.437 179.180 96.965 40.395 145.029 -47.110 111.280 21.664 0.000 0.000 96.467 47.834 143.964 -8.085 90.250 50.723 147.544-103.278 90.307 49.436 114.663-136.029 87.762 51.847 110.875 -70.172 89.582 46.525 137.322 -57.448 92.138 57.092 133.567-108.165 93.338 -76.702 102.542 -83.563 119.750 151.012 151.465 -16.786 123.434 -79.168 121.539-127.678 131.507 -26.946 121.354 -82.598 98.832-127.561 117.858 -53.427 95.368 44.175 125.167 -9.048 91.955 46.984 131.173 -76.969 90.563 41.898 145.972 -15.711 90.370 49.023 119.931 -39.963 89.981 46.063 140.115 -51.774 90.610 40.332 128.312 -76.800 89.279 53.736 108.317 -48.619 90.956 45.357 127.218 -75.962 90.794 45.990 140.581-155.951 91.600 50.144 129.465 -43.765 93.096-138.605 129.225 -68.679 95.748 33.928 107.584 -85.348 122.761 159.842 106.815 -76.151 92.606 0.000 129.517 -76.383 # 558 total E -1.48359E+02 rmsd from N 0.000 %NC 0.00 93.294-101.583 127.638 -75.808 94.515 -50.447 125.717 -23.244 95.558 -40.546 116.210 -82.599 102.923-159.634 126.622 -74.706 91.983 48.643 141.257-117.395 90.633 44.402 133.884 173.700 90.631 46.105 120.597 -33.001 91.047 42.913 133.897 -96.215 90.073 52.077 137.916-139.941 87.598 55.564 80.245-107.065 90.879 46.062 129.843 -84.428 104.220-112.521 94.744 -86.075 116.071-161.326 104.845 -83.082 149.566-166.842 176.453-178.951 108.298 -96.319 140.093-149.629 93.920 51.219 143.560 140.528 91.755 45.990 133.776 -87.414 89.856 55.070 159.740 -51.751 88.986 47.579 130.647 -30.536 89.267 46.515 109.973 -82.265 90.336 47.166 0.000 0.000 89.369 48.124 157.136-159.731 91.145 42.787 130.272 -92.151 90.734 43.325 121.781-121.021 90.233 50.627 113.069 -75.388 89.664 51.624 137.584 -96.469 91.777 34.966 130.592-144.673 99.113-126.521 144.581-122.774 111.741 175.241 153.157 -3.916 126.496 -92.113 116.125-117.210 96.069 43.739 113.984 -77.363 91.305 47.821 100.122 -20.832 89.737 55.219 119.890 -35.886 88.114 48.433 129.349 -76.310 87.831 45.798 101.526 -81.621 90.002 44.749 135.334 -54.292 90.115 49.208 151.807-105.827 89.579 43.231 128.111 -76.788 88.650 50.058 110.893 -63.693 90.295 46.995 127.649 -75.949 90.851 43.180 136.379-114.360 91.231 46.111 129.250 -44.125 91.005 51.766 134.794-104.474 90.546 43.480 132.193-141.680 95.653 71.223 104.208 -80.356 92.497 0.000 129.091 -76.626 # 559 total E -1.46538E+02 rmsd from N 0.000 %NC 0.00 93.602 -83.926 136.314-109.249 97.993 -35.102 147.669-141.270 91.576 -65.291 100.992 -78.895 90.129 -56.303 129.506 -75.528 94.554 129.628 135.041 139.425 91.957 52.441 127.295 174.954 95.128 34.327 111.869 -48.247 93.836 46.831 148.663 -69.122 91.663 41.503 141.120-133.369 91.335 48.022 85.363-108.599 92.387 38.638 133.786 -95.737 104.094-127.044 93.463 -89.268 91.619 -60.383 105.883 -79.031 101.392-170.116 159.150-127.564 98.958-135.285 141.104-145.357 91.887 51.915 138.284 130.589 92.393 45.720 135.194 -84.377 91.774 42.581 129.100 -52.944 92.605 47.482 150.582 -29.697 92.746 45.052 143.865-160.890 91.020 42.216 0.000 0.000 90.777 51.645 105.827 -84.204 89.710 49.257 144.780 -79.736 91.053 40.516 119.383-128.159 90.603 49.209 111.725 -77.209 90.890 68.544 138.465 -98.710 89.994 45.454 145.157-143.586 92.008 39.665 142.855-129.411 102.056 -5.965 116.063 -91.390 137.709-160.555 105.896 -92.095 96.626 53.448 115.317 -77.072 92.291 49.807 102.544 -14.459 89.722 51.367 128.287 -23.554 90.666 51.153 128.587 -75.901 89.762 44.448 102.116 -83.828 92.957 40.006 131.573 -50.178 94.363 48.557 130.598 -83.443 94.611 89.661 129.624 -78.091 92.905-166.177 114.045-131.035 92.546 49.323 151.236 -87.232 91.579 44.638 140.420-104.152 90.292 49.605 131.503 -14.568 90.292 55.595 138.760-117.808 89.102 39.117 129.941-149.660 95.906 75.728 103.915 -79.974 92.464 0.000 128.996 -76.532 # 560 total E -1.48256E+02 rmsd from N 0.000 %NC 0.00 92.988 151.283 139.772 -92.450 93.430 53.617 147.048 32.206 91.328 48.445 106.320 -83.885 92.444 48.624 129.444 -76.539 94.056 44.622 145.430-113.058 91.296 43.191 62.639 -79.838 89.907 46.541 120.949 -41.501 90.759 45.262 122.368 -97.789 89.061 49.257 137.509-114.109 89.004 59.439 85.202-104.206 91.247-171.709 127.619 -86.466 93.178 73.675 100.343-121.471 94.069 40.934 104.453 -82.815 92.656 49.940 137.914 -27.736 91.594 42.092 111.936 -95.287 93.054 50.411 128.013-137.659 94.135 34.893 125.811 -82.938 98.413 157.327 147.600 -84.526 108.534 32.539 136.220 118.926 96.110 45.418 154.967 -28.746 94.874 41.511 0.000 0.000 90.596 51.169 141.479 -21.579 89.812 52.099 137.236 -92.427 89.121 46.345 124.877-128.485 89.546 47.742 108.973 -72.178 93.025 40.197 132.811 -54.876 96.438 37.345 135.982-124.048 99.016 33.526 154.025 -20.309 115.909 41.375 116.010 -85.547 139.723-179.748 106.094 -90.649 93.698 48.157 114.915 -77.248 91.909 49.446 105.883 7.870 89.039 48.879 131.977 -10.280 89.629 48.331 130.544 -78.030 88.649 47.251 148.840 -20.742 87.739 49.991 116.681 -26.846 88.975 51.475 136.774 -45.939 89.338 42.834 127.956 -76.331 89.627 58.595 120.331 -74.951 91.959 159.434 127.982 -76.436 90.496 65.150 122.178 102.503 91.473 73.714 132.566 -53.147 90.973-114.387 140.685 -51.940 102.089 -50.314 105.383 -82.081 94.989 42.043 103.269 -70.742 92.446 0.000 129.326 -76.299 # 561 total E -1.47260E+02 rmsd from N 0.000 %NC 0.00 93.324-110.679 128.513 -75.498 96.395 -45.869 146.665-100.055 94.770 -52.890 148.808-142.538 98.880-119.496 127.890 -75.278 90.703 48.687 132.949-131.214 90.828 47.853 128.514-173.913 88.831 48.594 119.107 -50.925 91.250 45.730 127.654 -84.445 88.721 43.632 149.131-119.143 90.536 48.383 80.183-105.863 92.212 53.079 133.404 -85.380 97.740-127.433 101.939 -94.989 112.578-174.309 107.199 -82.956 132.247 -94.988 165.666-157.543 101.517-113.388 134.710-148.552 92.677 46.712 146.107 134.917 91.904 46.574 134.152 -86.163 90.908 48.860 142.028 -68.460 90.090 47.167 140.399 -38.680 89.663 45.794 109.209 -82.309 90.914 44.732 0.000 0.000 88.944 50.493 142.313-117.197 90.338 40.957 114.580-111.929 90.420 45.265 120.160-119.745 89.855 47.123 110.014 -81.214 91.100 50.752 129.596 -97.163 91.872 47.231 133.734-146.482 94.884-118.728 146.046 -35.188 94.127 174.685 148.227-123.691 106.677 -17.185 91.571-113.609 101.267 -57.252 114.315 -79.390 106.575-117.706 136.209 -23.211 89.819 64.565 117.746 -73.836 90.393 49.401 130.156 -76.956 87.609 46.607 108.872 -86.578 88.250 53.879 139.358-104.294 87.181 54.167 141.634-152.028 86.899 46.613 127.824 -76.300 88.222 51.546 110.084 -56.559 89.457 43.819 127.806 -74.979 90.543 46.568 135.389-151.840 90.034 51.998 127.993 -43.907 88.548 53.632 137.272 -90.202 90.529 43.724 132.915-133.185 95.206 74.132 104.261 -80.490 92.516 0.000 128.969 -76.653 # 562 total E -1.48794E+02 rmsd from N 0.000 %NC 0.00 122.992 -95.568 149.865 -62.981 94.071 -50.898 112.021 -74.816 91.934 -41.182 103.987 -77.038 92.703 -44.569 128.603 -75.921 97.217 -22.006 137.944-117.814 105.726 -36.599 57.762 -68.203 92.898 -24.957 128.294 -32.105 110.536 -28.087 162.437 -74.126 97.328 -58.402 122.287 -86.963 89.343 25.944 122.845-126.382 131.872-135.140 126.529-114.948 93.245 62.910 97.164-120.121 118.021 140.726 106.193 -81.317 94.607 -36.962 148.600-107.386 99.051-116.756 111.716 -85.627 92.397 50.561 136.247 105.523 92.423 44.914 137.030 -85.758 90.557 47.058 138.676 -57.865 90.917 53.421 157.464 -22.567 88.777 43.516 109.021 -81.333 90.126 45.848 0.000 0.000 88.284 56.943 134.639-107.279 89.317 42.582 113.734-107.143 89.591 43.683 120.947-116.884 89.970 53.431 110.903 -77.813 89.269 51.467 139.502-102.616 91.352 41.745 129.358-152.227 96.988 -96.397 143.576-126.577 108.990-142.880 155.032-138.795 138.178 -72.180 112.848-103.444 114.828 -13.915 115.171 -79.906 93.974 -46.874 116.363 -55.288 108.460 -14.121 113.519 -75.430 97.941 -47.861 127.755 -75.752 94.940 -30.849 106.729 -91.334 91.226 -53.358 97.271 -65.649 87.318 -55.458 153.465 -27.114 89.705 -50.383 130.809 -77.213 92.987-135.316 116.166-126.944 91.049 52.958 132.106 -76.906 91.065 43.996 139.571-102.620 89.623 49.611 120.646 -8.299 90.511 63.711 140.849 -43.501 87.060 41.914 138.768-138.795 95.179 81.188 146.456 -24.371 92.364 0.000 129.083 -76.367 # 563 total E -1.49227E+02 rmsd from N 0.000 %NC 0.00 92.869 146.298 138.788 -89.281 93.551 52.621 148.992 56.701 91.278 50.154 107.109 -79.705 91.024 46.971 129.068 -75.894 92.516 43.495 154.819-141.284 94.039 41.149 125.256 150.382 92.426 42.670 124.456 -36.940 93.927 42.051 131.658-100.549 90.195 51.389 145.204-166.157 87.866 59.230 78.797-109.584 91.815 27.932 130.441 -85.867 109.637-134.601 96.809 -83.003 114.646-125.182 148.282-168.316 141.597 45.201 176.437-171.754 96.241 41.890 142.725-155.602 94.587 42.752 138.668-103.686 102.094-169.003 122.010 -77.764 128.930 -64.896 124.428 45.064 95.686 51.406 140.673 -22.774 94.645 40.155 107.146 -82.822 90.768 50.235 0.000 0.000 90.524 48.308 104.992 -83.001 89.946 47.209 151.722 -78.439 91.777 39.374 117.651-130.657 91.025 51.496 114.688 -77.778 90.998 80.390 139.810-111.160 90.582 43.467 145.994-155.298 93.012 44.891 115.844 -89.741 99.122 -0.587 121.350 -89.820 132.365-172.495 109.921-101.827 99.722 38.045 115.593 -78.099 92.038 50.205 102.384 -5.121 89.670 52.911 125.992 -0.186 91.011 48.008 129.579 -76.662 89.366 40.843 104.385 -84.111 90.243 55.381 120.251 -26.253 88.394 60.077 134.922 -46.527 89.037 34.117 128.671 -77.084 95.627 145.777 109.522-104.395 132.125-152.416 151.311 -93.827 94.247 46.816 138.962-105.602 91.846 47.290 112.529 -19.276 91.727 59.115 150.190 -26.093 88.216 43.321 135.169-142.233 95.261 83.637 102.554 -79.619 92.419 0.000 129.078 -76.309 # 564 total E -1.48644E+02 rmsd from N 0.000 %NC 0.00 92.883 144.512 137.604 -85.199 93.397 53.804 146.764 55.563 91.291 49.378 107.328 -79.934 91.118 47.509 128.913 -75.501 92.180 42.154 157.701-145.106 93.459 41.924 121.769 148.253 92.391 42.541 123.347 -24.171 92.057 42.673 137.688 -99.227 90.333 55.933 141.123 178.657 86.222 64.567 77.322-109.892 90.729 16.337 127.593 -80.920 112.848-135.200 91.006 -73.366 98.808-123.036 145.481-167.341 104.365 24.475 147.344 -96.181 95.162 62.415 140.500-152.127 93.569 31.414 138.828-124.050 100.969-110.977 148.882 -96.197 123.303-100.185 130.702 -5.252 94.135 45.155 142.350 -16.633 94.701 42.334 108.626 -82.276 89.807 47.919 0.000 0.000 90.111 52.411 101.571 -85.849 88.145 48.408 149.996 -79.428 91.138 40.716 118.742-131.710 90.547 48.372 113.254 -76.039 89.902 64.411 146.621-114.256 89.422 48.538 145.686-134.702 91.583 36.231 113.507 -89.043 101.514 -2.343 115.878 -79.361 141.836-159.281 98.866 -78.108 94.325 50.898 115.387 -76.131 93.392 47.379 95.607 -20.508 90.670 46.544 128.571 -5.848 93.254 45.043 128.914 -76.644 90.451 39.376 101.768 -84.556 92.152 49.876 117.401 -32.150 90.291 53.009 138.078 -40.751 89.421 35.429 130.364 -78.100 95.705-166.171 105.544-100.465 112.652 101.250 172.305 -87.948 93.124 47.679 139.477-103.562 90.771 51.783 127.238 -5.599 90.888 61.508 145.665 -25.457 87.867 39.616 137.346-141.586 96.151 75.423 103.637 -79.870 92.407 0.000 129.281 -76.392 # 565 total E -1.47051E+02 rmsd from N 0.000 %NC 0.00 93.129 157.245 141.321 -99.651 93.709 51.821 154.809 122.172 91.829 47.050 107.071 -79.950 90.990 48.864 129.844 -75.745 91.224 43.074 152.727-147.136 92.793 42.041 125.490 172.294 92.098 43.435 122.481 -35.860 92.750 44.369 137.680 -99.499 88.639 47.282 148.273-144.766 90.059 54.153 72.879-103.830 89.949 43.429 132.303 -69.604 109.182-142.856 88.775 -81.985 100.923-133.315 103.116 -81.795 116.740 18.743 155.142-122.466 95.470 61.157 137.649-154.304 93.917 33.172 143.615-123.296 102.444-108.001 159.509 -79.427 121.359-109.170 131.829 -71.144 95.382 40.244 127.851 -13.422 93.282 46.582 110.482 -82.262 89.599 48.558 0.000 0.000 90.723 49.789 104.482 -84.530 88.834 44.081 149.350 -81.201 90.962 43.913 117.600-129.722 89.295 52.212 109.362 -76.115 88.759 58.927 141.998 -96.737 90.131 34.155 133.405-149.389 94.884 52.558 143.966-130.503 96.271 29.229 138.731 -97.756 116.805-120.702 121.939-129.964 98.868 -3.583 131.057-132.207 94.831-130.430 110.477 -25.235 97.071 -51.674 117.072 -76.244 93.454 -40.628 128.541 -77.590 92.857 -43.304 99.523 -80.204 89.185 -55.532 136.661 -58.503 89.348 -52.994 143.171-120.817 89.280 -47.719 127.866 -76.869 94.687-118.205 127.125 -16.560 91.176 50.719 131.187 -76.755 91.720 53.748 140.775 -87.449 90.512 56.214 129.628 -34.608 92.100-141.578 126.369 -61.927 95.558 35.033 137.428-141.208 113.797-144.833 106.857 -74.039 92.929 0.000 129.544 -76.255 # 566 total E -1.47579E+02 rmsd from N 0.000 %NC 0.00 124.424-106.560 146.712 -40.594 124.527-101.964 128.917 -42.275 93.626 42.573 109.485 -80.335 93.190 45.478 131.397 -77.651 97.036 38.602 154.484-148.721 95.118 41.354 53.267 -81.475 89.606 46.584 114.641 -33.220 89.758 57.129 136.219 -88.383 87.006 44.281 131.779-119.162 92.078 37.121 77.059 -96.758 93.868 75.745 131.295 -66.030 113.043 166.325 95.671 -93.616 87.428 121.790 101.791 -84.426 106.484 -71.363 124.677 -87.911 95.434-117.682 149.634 -40.854 91.293 53.198 143.186 110.450 92.823 46.664 136.864 -83.260 91.915 43.611 140.182 -27.030 91.386 47.717 110.440 -13.635 89.066 52.017 112.827 -84.613 91.089 44.185 0.000 0.000 92.468 40.724 111.925 -79.729 92.172 44.355 174.133-159.839 92.374 45.314 105.011-134.514 90.044 45.138 111.426 -78.399 89.793 54.646 143.679-103.752 91.251 54.631 138.861-106.216 90.838 25.257 107.833 -86.604 110.596 57.420 147.777 -22.819 139.599-107.169 108.521 -95.171 117.877 1.569 116.826 -80.295 92.277 -60.264 105.221 -33.880 90.887 -49.346 124.798 -33.546 89.926 -45.803 127.498 -75.957 88.980 -42.341 102.851 -81.055 88.792 -51.085 124.476 -8.220 89.655 -46.955 149.522 -30.718 89.248 -47.568 128.430 -76.324 88.586 -58.647 130.178 10.366 90.516 119.019 131.808 -76.877 93.752 43.779 140.601-108.714 90.262 48.733 124.938 7.748 91.357 54.110 146.599 -36.577 89.743 40.010 140.943-147.049 95.666 79.762 104.574 -81.035 92.557 0.000 128.946 -76.656 # 567 total E -1.47745E+02 rmsd from N 0.000 %NC 0.00 93.380 175.672 140.725-103.176 94.025 53.729 163.931-175.335 91.586 44.740 105.868 -79.492 91.081 50.119 131.805 -76.465 91.286 40.761 144.330-127.279 93.353 41.232 128.716-171.792 90.254 63.570 108.042 -32.425 85.913 69.201 131.570 -82.916 88.086 46.709 110.363-100.699 89.554 41.796 96.679 -88.533 93.593 60.066 135.687 -87.645 97.447 -75.519 101.494-100.078 112.898-162.030 101.469 -83.735 107.421 22.476 144.076-148.350 94.883 58.461 134.205-153.652 93.784 37.722 136.959-125.756 99.159-108.438 157.999 123.435 100.585-119.489 124.662 -91.122 92.935 46.899 144.262 -18.936 92.533 48.068 110.560 -82.713 90.790 43.862 0.000 0.000 89.814 52.360 109.218 -82.364 88.858 46.626 139.280 -75.864 90.236 42.848 123.085-126.499 89.775 49.270 113.303 -77.439 90.247 47.819 137.209-103.289 91.819 53.562 132.941-152.978 92.176 -97.919 103.971 -86.208 111.105-178.368 114.748 -77.634 126.604-106.559 115.271-116.096 92.370 58.450 113.153 -75.910 94.188 37.875 99.588 -49.239 93.965 46.277 118.273 -71.469 92.236 41.859 128.827 -76.593 90.655 44.744 110.961 -90.183 90.434 46.308 132.702-107.224 89.589 53.611 140.224-125.163 89.357 47.721 128.154 -76.803 91.223 171.972 88.965 -70.902 92.201 66.934 132.522 -77.845 90.378 53.373 141.196-104.329 91.137 45.877 121.096 -23.482 94.401-130.961 137.112 -81.272 96.518 25.118 135.431-142.696 125.015 86.755 101.166 -76.092 92.569 0.000 129.982 -76.746 # 568 total E -1.50671E+02 rmsd from N 0.000 %NC 0.00 93.006 152.256 139.327 -91.275 93.576 53.350 137.268 53.216 92.047 45.665 104.994 -78.670 91.685 46.855 131.637 -78.216 94.991 48.022 157.732-144.309 92.711 38.112 57.847 -76.599 93.738 43.911 128.466 -38.866 94.525 40.761 132.133-107.993 89.553 50.199 142.479 162.475 87.884 51.696 78.844-106.597 91.430 177.262 135.409 -90.765 90.971 96.254 107.109-147.653 88.212 100.572 106.617 -82.223 89.421 -83.555 124.922-102.515 98.301-129.157 138.366-148.390 90.235 49.861 144.557 124.808 90.927 48.503 133.121 -85.443 90.149 48.243 114.276 -39.276 89.817 48.221 143.029 74.642 89.403 49.375 111.164 -83.296 90.145 44.879 0.000 0.000 88.646 50.354 153.056-152.804 90.093 45.451 121.089-101.858 90.745 44.090 123.857-122.379 88.776 50.419 117.187 -78.330 90.205 50.622 136.419-111.484 90.064 46.539 125.403-151.683 94.507-100.811 104.614 -83.919 116.739-177.830 160.330-149.295 129.516 -51.796 111.567-108.187 105.908 -28.967 112.105 -79.378 93.403 -45.976 111.848 -53.176 92.061 -44.239 111.101 -70.631 91.909 -45.424 128.484 -77.043 92.729 -39.607 103.642 -84.820 89.176 -45.820 121.075 -14.507 100.728-130.815 153.362 -8.246 91.390 44.348 127.471 -76.634 92.040 62.742 116.059-105.971 90.163 49.728 130.737 -75.517 92.805 30.547 149.283-125.190 96.631 47.785 127.993 -45.807 95.563 -30.068 130.032 -97.630 132.309 -86.493 103.455 -85.413 98.866 138.608 106.617 -78.787 92.548 0.000 128.890 -75.780 # 569 total E -1.50090E+02 rmsd from N 0.000 %NC 0.00 93.201 -70.026 129.026 -83.031 94.214 -47.510 119.207 -81.116 90.550 -48.001 103.310 -77.228 89.944 -50.321 128.654 -75.942 91.327 -37.375 139.342-130.812 92.945 -46.866 65.336 -65.637 90.557 -30.824 124.211 -17.770 107.754 -38.311 166.262 126.875 95.402 -42.590 129.250-122.457 94.777 118.051 82.083 -88.377 106.064-165.747 134.976 -89.195 98.306 70.050 125.841-148.537 118.157 124.601 104.952 -86.490 134.034 -93.241 174.005 2.727 111.379-130.121 143.431-134.279 97.970 40.070 152.997 173.491 92.500 46.315 136.862 -89.218 90.238 56.154 163.210-119.912 89.478 50.513 130.953 -56.547 91.450 38.998 142.799-148.279 92.014 45.139 0.000 0.000 89.342 60.802 111.751 -88.532 86.873 48.265 137.750 -88.171 89.475 43.790 119.344-126.153 89.138 52.986 112.532 -75.804 89.313 51.621 140.125-105.579 90.639 46.940 128.923-142.781 94.029-103.618 104.856 -83.909 108.324-165.696 155.222-137.766 99.848 -48.827 97.970 -99.488 97.471 -37.891 111.550 -77.865 92.675 -43.620 112.188 -49.868 90.756 -51.685 108.359 -75.432 89.475 -54.885 128.592 -76.325 88.359 -34.208 102.553 -81.011 97.479-110.676 141.423 -30.191 91.331 54.533 140.336 -91.110 92.372 50.813 129.708 -77.639 93.947 79.184 136.524-145.163 88.954 -82.521 128.722 -76.676 90.155 -46.071 145.445-123.133 88.276 -56.230 111.582 33.598 89.383 -56.483 145.065 -31.192 89.225 -29.210 142.590-131.411 103.928 168.413 105.084 -78.853 92.696 0.000 129.380 -75.858 # 570 total E -1.50634E+02 rmsd from N 0.000 %NC 0.00 93.112 -64.072 127.978 -79.963 94.523 -46.451 114.260 -80.122 90.699 -46.530 103.424 -77.348 90.452 -47.037 128.207 -75.453 92.261 -38.692 135.758-117.531 95.491 -37.296 61.400 -62.276 91.103 -47.721 131.674 -35.802 96.322 -41.471 140.106-102.574 92.092 -46.023 134.009-109.405 92.785 84.976 119.442-130.752 136.538 -61.900 137.836-140.457 126.751 -94.401 108.020-105.301 112.177 -84.024 109.100 -81.199 143.889 162.113 175.717-175.572 103.593-104.176 140.120-154.276 92.750 50.265 142.478 135.405 91.864 46.130 133.832 -85.713 90.543 49.416 124.189 -57.417 90.415 48.227 120.169 -26.442 89.895 44.679 108.181 -82.758 90.632 46.628 0.000 0.000 90.935 46.145 107.644 -81.746 91.228 45.598 144.770 -77.040 91.762 41.877 118.476-124.014 91.804 51.328 112.934 -78.212 94.347 112.082 131.613 -95.945 93.305 39.908 140.953 177.920 95.274 62.508 110.942 -86.197 117.898 15.819 151.881 -29.961 136.514 -69.250 106.866 -94.894 96.685 -35.082 111.840 -77.327 90.919 -53.066 113.541 -36.209 92.075 -45.042 109.371 -68.978 93.433 -38.484 127.649 -76.436 96.415 -35.328 99.428 -81.496 91.089 -49.834 116.178 -38.422 90.308 -54.251 152.258 -33.377 88.662 -55.873 127.689 -76.102 89.967-125.557 135.209 -8.869 89.775 56.504 132.629 -77.346 90.095 48.566 142.617-101.180 89.768 46.492 131.069 -42.335 90.392 56.992 144.620 -32.514 88.913 44.383 136.533-132.000 94.149 86.003 103.123 -80.000 92.543 0.000 128.810 -76.710 # 571 total E -1.49410E+02 rmsd from N 0.000 %NC 0.00 93.022 157.076 138.191 -89.260 93.863 54.623 128.205 55.799 91.024 46.545 106.184 -78.171 92.200 45.466 129.314 -76.964 91.976 48.800 155.638-174.145 93.768 37.099 55.665 -66.948 94.354 43.920 150.523 4.622 92.843 41.437 138.564-108.827 90.332 53.185 133.033 149.066 86.816 56.152 75.703-108.148 88.915-177.743 137.755 -91.216 91.860 96.508 104.188-142.672 89.207 56.689 110.360 -85.520 93.662 36.053 128.546 -97.771 93.320 50.808 142.399-172.505 91.858 61.825 120.761-124.435 91.934-112.045 113.387 -82.768 94.004 123.696 138.519-100.702 118.823 158.508 106.883 -38.117 90.930 85.743 152.140-159.229 92.713 47.999 0.000 0.000 90.899 43.652 140.933 -9.695 90.978 46.153 143.243 -96.927 90.031 49.807 118.301-130.314 87.107 53.975 108.957 -75.370 88.929 48.801 134.258 -59.353 91.188 47.800 133.710-119.525 94.815 -87.095 103.353 -83.219 118.688 178.355 152.506 -16.301 123.308 -33.424 114.242-116.201 94.756 -53.682 113.829 -80.075 99.937-118.591 132.322 -47.480 90.848 56.811 127.505 -32.397 91.396 51.605 129.078 -75.842 89.976 46.595 105.211 -81.868 91.331 40.599 126.729 -67.292 91.799 54.008 132.050 -80.317 90.321 62.628 128.527 -77.162 90.323 178.984 95.189 -89.932 90.595 69.335 131.196 -76.803 90.463 46.732 140.812-102.661 90.871 43.984 124.164 -24.029 91.617 49.810 139.275-101.762 91.448 47.861 133.981-156.908 94.798 103.642 101.814 -79.193 92.492 0.000 128.877 -76.362 # 572 total E -1.47973E+02 rmsd from N 0.000 %NC 0.00 123.294-107.553 150.163 -74.384 95.696 -46.909 115.482 -77.122 92.996 -50.553 100.717 -75.863 91.557 -28.126 129.493 -76.063 109.848 -47.498 156.774 168.562 138.926 -56.629 104.538-106.544 91.803 62.161 115.433 -45.024 92.014 48.014 137.738 -96.996 88.132 52.156 138.720-125.483 87.530 51.913 76.608-102.373 91.550 50.884 134.080 -77.599 99.310-121.297 100.988 -90.639 110.453-136.420 109.548 -82.369 117.777 28.725 164.361-144.612 95.556 51.306 136.870-163.786 94.649 29.376 144.493-113.974 103.172-159.326 137.816 -70.951 129.971 -63.237 124.991 61.395 95.859 50.751 149.055 -19.620 94.196 39.346 107.607 -82.618 91.213 49.566 0.000 0.000 89.837 49.134 109.009 -83.185 89.974 45.996 149.085 -80.537 91.934 39.548 118.610-129.694 90.353 50.683 113.600 -77.134 90.169 64.920 138.574-107.002 89.427 43.816 143.100-144.815 92.804 39.223 152.268 -22.555 100.781 -10.256 115.864 -84.192 140.286-156.484 101.178 -82.913 93.442 57.787 115.148 -76.189 92.903 47.314 94.519 -39.089 90.413 49.907 134.674 -28.197 92.575 44.525 128.323 -76.351 91.847 42.471 102.167 -85.063 91.980 46.546 120.938 -67.442 92.648 51.945 126.576 -66.349 89.398 39.693 130.282 -77.996 92.900 95.186 95.179 -94.754 92.320 -88.215 128.772 -76.982 96.001 -39.890 142.759-145.157 93.385 -47.573 136.921-106.787 91.666 -61.672 143.253 -46.376 90.668 -51.658 138.815-151.315 96.573 61.837 104.485 -79.492 92.388 0.000 129.573 -75.585 # 573 total E -1.54341E+02 rmsd from N 0.000 %NC 0.00 92.555 94.556 132.810 -77.008 93.358 53.818 126.809 -45.923 94.090 44.775 104.971 -80.429 92.326 43.663 128.455 -74.824 91.554 48.581 104.698 -75.792 88.234 43.832 97.278 -70.132 88.926 46.570 111.168 -88.245 90.408 45.136 120.525 -97.765 89.249 54.732 145.452-138.371 91.072 175.584 85.227-101.317 128.736 70.306 152.320-146.978 95.869 46.331 95.509-119.842 91.902 47.768 105.021 -83.855 91.572 64.161 139.896 -89.827 88.477 45.857 133.926-139.864 92.859 47.450 131.912-105.828 98.849 -80.609 119.602 -61.970 117.009 174.653 136.498 -48.779 96.283 63.412 139.439 -49.894 91.805 45.845 140.446-169.063 92.011 42.133 0.000 0.000 91.617 49.474 111.783 -82.009 88.642 46.687 145.085 -81.564 90.009 44.927 119.573-129.682 89.918 46.911 108.033 -75.895 90.063 47.471 134.616 -81.829 93.177 44.416 136.390-140.786 93.864 39.405 143.219-130.278 97.552 43.392 115.907 -88.972 136.438 179.485 107.566 -97.635 97.708 42.301 115.615 -77.736 92.428 48.594 101.373 -7.848 89.427 53.565 125.551 -21.773 89.672 51.022 129.095 -76.495 88.385 44.719 103.505 -83.595 91.835 42.722 133.702 -40.171 91.884 46.857 137.372 -86.987 91.235 42.888 128.761 -77.537 92.994 100.416 109.043 -88.441 89.177 -72.834 129.381 -77.434 93.577 -43.408 146.112-138.936 90.446 -45.549 123.667 -12.514 92.400 -69.707 148.974 -37.679 90.365 -50.211 138.263-153.116 96.668 52.716 100.203 -79.978 92.430 0.000 129.395 -76.245 # 574 total E -1.48827E+02 rmsd from N 0.000 %NC 0.00 93.209 165.394 140.163 -98.070 93.740 54.414 135.416 46.785 91.868 45.996 106.074 -80.833 91.935 45.204 130.038 -77.192 93.916 48.141 151.005-140.681 93.517 38.179 55.874 -71.242 93.180 44.480 128.662 -25.286 92.925 41.370 132.449-108.203 90.724 54.465 146.049-170.923 88.244 50.944 77.192-103.864 92.226 169.601 129.383 -77.295 94.740 69.766 129.906-154.748 95.133 36.630 99.227 -81.972 92.619 53.080 143.897 -28.655 91.572 40.222 132.780-126.131 93.756 50.751 116.016-156.557 94.062 27.812 127.154 -86.717 100.333 150.502 153.767-104.712 102.432 36.530 97.964 143.235 95.679 39.445 142.194-124.134 101.825 26.463 0.000 0.000 106.521 27.701 158.251 0.075 97.252 40.377 169.968-156.675 91.778 50.024 114.568-144.824 90.317 44.107 106.266 -72.657 93.734 49.047 136.811 -58.594 97.146 2.358 137.326-122.333 116.065 48.829 112.252 -85.311 99.768 72.958 146.148 -26.138 133.297 168.712 114.763-109.823 94.125 37.573 114.445 -77.784 96.229 178.575 120.708 -39.062 95.192 87.235 117.943 -78.514 92.252 51.181 128.437 -75.774 91.956 45.298 107.543 -80.305 91.885 45.369 134.109 -85.202 90.591 48.374 127.830-102.575 91.437 61.561 128.862 -77.496 94.312 81.827 92.717 -72.916 89.594 -77.131 129.713 -76.518 91.738 -47.439 140.457-115.134 87.366 -60.523 131.711 -11.696 89.330 -55.095 155.241-147.739 90.241 -45.061 100.777 -87.326 94.950 104.849 105.234 -78.702 92.490 0.000 128.832 -76.363 # 575 total E -1.47997E+02 rmsd from N 0.000 %NC 0.00 93.259 -81.250 126.683 -75.443 93.083 -51.833 114.555 -71.961 92.187 -40.980 103.685 -75.484 93.000 -45.359 126.561 -74.287 99.793 -14.100 153.582-140.698 108.173 -33.751 58.344 -80.453 95.985 -28.096 126.188 -55.930 107.927 -24.775 139.677 -92.983 99.688 -41.661 151.017-160.650 95.936 -33.886 95.167 -88.449 103.783 114.041 141.778-134.934 122.798-147.706 117.242-121.792 105.231-174.931 107.518 -84.276 120.923 -70.761 139.947-127.025 93.223-119.872 110.028 -85.321 92.576 51.360 137.103 141.971 93.001 46.099 136.634 -85.212 90.950 45.451 128.609 -46.896 91.850 51.449 118.946 -31.114 90.877 45.144 108.404 -82.619 89.980 44.805 0.000 0.000 90.662 53.284 103.249 -82.844 87.509 47.761 146.666 -73.979 89.508 43.374 119.866-130.915 89.636 48.844 108.421 -75.840 89.696 47.858 141.575 -90.071 91.017 49.554 136.973-155.378 90.105 40.390 141.582-125.609 95.314-112.771 106.142 -79.044 112.361-102.722 122.601-134.464 91.628 55.848 143.790 10.333 92.903 50.240 117.797 -97.312 91.515 46.458 113.382 -72.939 91.250-126.389 127.651 -74.938 85.092 -55.337 102.308 -78.857 89.991 -50.950 139.122 -41.692 90.168 -44.770 133.556 -69.099 89.982 -54.893 127.714 -75.708 89.498 -87.982 145.304 -11.182 87.937 93.105 130.915 -76.813 91.498 57.837 140.934 -99.408 91.646 37.168 111.977 -33.670 93.150 57.314 148.531 -15.184 89.410 43.818 137.661-143.906 95.319 82.339 102.894 -80.185 92.520 0.000 128.933 -76.596 # 576 total E -1.50352E+02 rmsd from N 0.000 %NC 0.00 93.265 167.734 140.034 -98.393 93.450 54.657 138.351 40.275 91.936 44.818 106.003 -81.855 91.813 48.805 130.949 -77.425 92.841 45.170 149.703-136.388 91.526 42.438 59.720 -73.142 91.102 45.577 125.966 -37.325 91.586 45.482 130.672-105.669 87.769 49.451 141.113-169.291 89.143 52.661 79.107-105.849 88.983 160.323 134.921 -89.684 98.381 54.812 126.982-149.109 94.284 37.947 134.264-132.516 93.981 49.773 151.163 -26.806 91.843 44.679 115.023 -80.635 92.294 46.365 131.617-122.393 94.269 37.051 126.636 -92.948 95.771 149.001 150.983-166.064 96.072 47.552 139.235 149.842 97.179 39.184 108.112 -81.454 100.477 24.973 0.000 0.000 109.495 28.527 117.112 -88.796 96.821 36.835 168.310-163.833 94.634 42.291 109.124-138.007 90.515 52.203 116.375 -76.369 89.527 48.694 141.753-114.151 91.394 43.561 135.850-140.067 95.878 -99.530 104.962 -83.311 112.766-157.035 153.755 -20.615 99.140 -61.546 98.645-100.544 93.619 -32.762 115.762 -76.212 99.334-100.612 124.314 -71.228 90.485 86.301 112.844 -73.552 92.303 55.002 129.609 -76.416 91.243 38.570 96.480 -75.564 91.301 51.343 150.571 -26.294 89.133 50.048 154.614-140.190 89.559 41.199 128.168 -76.800 89.916 49.584 118.302 -37.649 90.881 45.256 127.821 -76.098 91.065 45.887 135.435-166.480 90.755 54.855 130.690 -45.775 91.786 143.415 132.377 -68.126 92.928 66.077 139.986-161.314 95.192 120.682 97.970 -79.785 92.486 0.000 128.884 -76.275 # 577 total E -1.46427E+02 rmsd from N 0.000 %NC 0.00 93.326 172.841 139.913 -99.680 93.662 56.286 137.408 41.923 92.475 41.982 105.800 -81.966 91.514 53.364 132.477 -77.692 90.121 43.895 150.288-147.783 89.307 46.085 67.663 -72.436 90.456 45.268 109.556 -48.228 88.681 47.693 149.340 -87.203 89.480 43.881 123.207-120.467 89.681 45.877 90.023 -99.251 90.731 88.449 141.531-106.144 88.546 76.491 127.353-153.283 87.316 61.952 101.694 -86.136 89.982 115.243 131.990 -86.171 90.973 73.487 136.843-156.028 90.483 45.730 134.125-114.172 95.067-160.823 129.215 -99.580 137.231 -2.888 134.676 61.435 94.690 47.210 144.676 113.645 95.405 37.702 143.269-139.979 94.121 45.256 0.000 0.000 93.249 39.741 153.808 -9.077 93.809 43.625 171.788-155.333 90.339 47.211 110.285-137.951 90.729 45.897 107.211 -78.299 91.401 45.278 144.003 -45.245 93.846 36.198 139.952-143.407 96.249 52.972 108.362 -85.602 95.240 23.560 155.184 -29.316 120.899-115.066 115.964-119.097 96.755 -24.525 113.826 -77.829 97.000-131.451 115.072 -13.331 101.191 -36.118 116.382 -72.161 94.644 -41.805 126.885 -76.334 94.805 -36.634 100.408 -81.506 90.598 -47.502 125.011 -10.628 93.113 -42.100 151.836 -19.515 91.448 -47.465 129.605 -76.858 91.806 -55.011 130.312 24.266 93.148 117.319 129.934 -76.650 95.564 32.569 139.936-105.872 92.019 60.563 101.308 18.853 90.625 69.176 147.490 -36.966 87.513 45.087 137.108-146.951 96.127 72.476 145.167 -25.232 92.375 0.000 129.482 -75.898 # 578 total E -1.47540E+02 rmsd from N 0.000 %NC 0.00 93.067 -68.829 126.364 -70.171 121.835 -99.061 132.041 -28.054 95.255 36.776 106.514 -77.786 93.717 53.879 131.935 -77.122 92.397 38.365 148.913-137.229 89.887 45.680 66.696 -92.164 90.004 46.925 117.218 -61.815 90.171 43.642 136.446 -81.926 90.866 38.320 129.297-113.256 93.230 49.121 86.015 -96.938 92.637 163.717 128.971 -80.818 90.902 91.755 129.927-157.428 95.461 112.918 102.367 -81.125 90.312 -60.268 143.059-103.554 94.398-123.526 151.534 -31.483 91.401 44.529 136.262 125.326 91.648 49.191 136.308 -84.248 91.829 43.076 122.152 -56.002 92.261 45.723 118.055 -23.034 89.844 45.756 108.391 -82.476 90.467 48.321 0.000 0.000 91.953 40.770 109.212 -82.401 93.677 40.321 144.175 -79.571 92.676 44.943 118.460-123.990 90.356 57.292 111.926 -78.647 93.247-161.001 135.197 -98.226 96.396 -94.106 136.223-105.593 97.062 42.246 143.995-151.583 99.404 128.244 147.963 -20.825 100.088 -39.737 95.080 -99.062 96.010 -42.945 112.523 -77.173 94.052 -37.073 113.396 -57.299 93.097 -51.711 109.945 -71.568 92.501 -36.088 128.145 -76.535 94.599 -41.520 98.718 -81.737 92.675 -31.934 133.519 -24.448 107.118-120.629 153.593 -24.273 91.475 43.601 129.451 -77.317 95.593 142.061 117.158 -83.703 91.943 51.848 154.858 -99.190 91.361 42.534 140.196-102.550 89.887 51.658 114.103 -13.784 90.327 62.240 141.995 -44.078 87.429 41.309 139.091-140.202 95.275 79.980 103.786 -79.614 92.451 0.000 129.184 -76.329 # 579 total E -1.50105E+02 rmsd from N 0.000 %NC 0.00 93.107 -65.832 127.220 -77.401 93.722 -49.855 110.964 -75.594 91.568 -42.059 103.536 -75.905 92.800 -43.907 128.622 -75.855 98.163 -20.229 139.624-118.654 106.678 -38.436 59.487 -75.889 93.230 -24.352 119.465 -51.841 111.748 -25.471 167.761-122.926 105.487-106.296 134.768-109.571 89.670 77.196 99.779 -90.758 91.203-178.893 143.221-105.738 91.861 63.219 128.919-156.331 88.926 53.356 98.026 -82.450 90.210 57.836 114.035 -9.740 90.896 37.716 110.319 -84.266 95.193 47.567 136.716-109.145 95.829 32.822 123.500 -67.032 100.166 149.385 135.096 -30.193 103.957 36.124 114.096 177.061 98.584 39.647 142.509-126.853 115.895 10.968 0.000 0.000 94.252 51.422 146.477 -10.883 92.832 48.473 162.655-148.263 89.533 48.439 109.091-142.583 88.963 47.745 111.141 -73.256 91.631 42.963 144.635 -32.598 92.666 49.202 137.062-146.905 95.513 -65.697 104.074 -83.817 128.827 112.682 152.687 -14.082 122.025 148.891 111.928-113.188 123.468 134.658 148.512-156.265 93.773-137.341 126.459 -11.358 94.194 50.529 114.817 -72.539 92.954 45.833 129.411 -76.013 91.655 39.734 112.642 -84.216 91.253 48.587 143.230-112.291 89.671 50.127 140.872-168.386 89.799 40.717 127.784 -76.356 90.884 46.430 113.965-102.815 90.930 45.818 129.155 -76.606 90.868 46.399 137.284-149.743 90.075 46.402 127.773 -42.279 90.175 53.594 137.723 -96.671 90.219 42.194 133.086-134.086 96.023 75.925 146.932 -24.501 92.516 0.000 128.993 -76.620 # 580 total E -1.54101E+02 rmsd from N 0.000 %NC 0.00 93.082 151.051 142.119-100.967 93.169 52.009 119.119 -17.591 91.380 46.225 104.726 -82.462 91.131 53.099 130.818 -76.650 91.723 44.804 125.251-100.959 88.911 42.438 66.866 -75.196 89.807 50.254 119.934 -50.781 87.433 46.584 133.156 -98.717 88.751 46.878 123.826-113.608 88.952 52.892 85.135 -95.873 89.604 149.416 133.467 -81.538 93.743 88.314 126.466-150.942 91.965 105.652 98.717 -85.660 93.249 -66.248 124.184 -90.216 96.442-121.649 135.549-140.588 90.791 51.099 139.001 115.377 92.074 47.997 134.708 -85.376 91.612 44.664 134.282 -34.993 91.462 45.496 130.621 -15.880 89.682 50.137 145.461-166.853 90.263 46.044 0.000 0.000 90.709 43.896 117.901 -76.262 91.665 45.121 142.512 -83.973 89.821 45.994 119.515-126.764 88.698 50.285 112.594 -80.894 90.350 49.673 137.998-108.339 91.938 46.303 131.472-146.268 95.272-100.178 142.351-126.331 109.447-170.887 110.084 -78.558 136.953 -58.266 108.912 -99.596 103.857 -25.583 113.382 -78.256 94.533 -48.118 118.142 -63.373 94.359 -41.552 112.165 -72.731 92.157 -45.397 127.782 -76.324 90.013 -40.853 101.207 -80.744 91.548 -45.196 144.865 -38.871 91.553 -47.495 157.483-118.768 90.302 -46.743 129.486 -78.019 92.355-125.964 133.444 10.103 90.866 51.814 132.304 -77.179 90.698 47.935 142.852-116.180 91.396 67.027 129.904 -37.367 90.341 -97.654 134.455 -54.761 98.354 -27.727 132.234-135.907 119.911 108.859 110.519 -86.569 92.454 0.000 129.840 -75.955 # 581 total E -1.48235E+02 rmsd from N 0.000 %NC 0.00 93.129 151.146 144.121-109.647 93.392 50.428 157.842 121.411 92.004 47.035 106.977 -80.093 90.459 49.345 129.883 -75.930 91.338 44.517 148.043-137.455 91.042 41.427 128.439 174.301 92.487 41.753 111.699 -63.290 94.902 40.703 135.010 -85.726 92.382 40.796 144.534-121.859 92.153 47.558 85.352-107.857 92.040 52.651 128.522 -91.073 105.753-127.208 91.500 -89.964 102.693 -99.410 107.411 -81.065 138.220 47.360 161.218-170.201 114.986 13.909 145.164-166.070 93.766 51.927 136.607 -96.633 92.751 48.083 141.024 -52.678 92.664 46.796 114.837 -52.970 103.289 8.244 139.853 130.812 112.993 40.345 145.001-178.673 98.114 33.806 0.000 0.000 93.208 55.453 112.505 -83.333 88.014 47.401 147.845 -86.378 90.714 40.894 115.308-126.363 90.524 47.693 111.343 -76.732 89.420 58.604 143.440-103.866 89.985 41.428 142.593-134.386 92.174 47.121 116.538 -89.974 98.475 -23.705 120.647 -92.442 129.630-145.679 118.631-117.759 98.516 58.709 115.251 -77.133 91.680 57.307 108.722 -33.986 90.160 52.693 108.376 -74.158 90.522 50.422 130.122 -76.119 87.656 44.149 103.283 -84.380 91.171 45.538 112.758 -68.204 89.875 53.188 140.938 -40.285 89.288 51.103 129.739 -77.996 89.952-176.664 87.409 -70.971 93.790 73.276 131.988 -77.756 91.450 48.835 141.212-107.716 91.668 53.897 128.077 -23.793 94.216-139.347 139.213 -53.490 97.682 41.194 135.287-136.370 115.597 47.868 108.995 -75.907 92.400 0.000 129.344 -76.041 # 582 total E -1.49798E+02 rmsd from N 0.000 %NC 0.00 93.178 -67.346 129.034 -83.086 93.596 -49.064 120.345 -79.986 91.022 -47.348 103.458 -77.800 90.804 -46.785 128.156 -75.497 90.196 -42.008 144.348-142.734 92.450 -44.775 62.755 -53.267 89.180 -45.618 129.690 42.262 96.372 -48.397 165.605 159.197 91.343 -46.674 131.040-122.308 97.375-109.899 140.047 -12.224 107.057 66.314 142.979-152.870 92.986 60.070 94.501-122.521 93.369 57.728 103.590 -85.119 101.923-102.729 133.437 -81.600 101.526-120.798 138.225-149.506 94.438 48.702 139.969 164.829 93.613 45.180 134.314 -85.925 90.996 46.672 118.017 -52.476 91.608 58.939 96.670 -38.909 90.923 43.741 107.519 -80.053 89.624 45.326 0.000 0.000 90.494 57.965 103.732 -86.569 86.742 50.648 142.579 -71.120 88.801 43.972 120.902-129.090 89.775 49.057 110.736 -73.792 90.593 46.231 139.671 -94.730 92.568 48.490 137.160-149.481 92.940-103.281 141.242-124.402 112.761-165.283 111.186 -79.069 94.148 -55.666 97.940-105.927 90.741 -46.688 110.589 -73.218 91.810 -68.053 108.396 -58.105 87.823 107.001 117.398 -73.530 94.767 42.727 128.554 -76.229 91.638 42.863 105.328 -74.662 90.178 51.367 119.234 -26.172 90.739 40.966 136.783 -55.651 93.074 46.435 128.470 -76.502 95.194 65.679 116.845 -79.084 91.284 -95.718 130.017 -77.391 93.691 -38.515 140.770-113.569 91.610 -90.377 131.202 -8.234 88.396 -59.285 152.832 -28.287 92.242 -29.614 136.306-119.875 103.271 121.333 101.381 -78.452 92.555 0.000 129.247 -76.351 # 583 total E -1.47083E+02 rmsd from N 0.000 %NC 0.00 93.048 -53.268 130.792 -91.860 95.025 -44.452 115.607 -84.118 90.112 -48.976 102.998 -77.293 89.867 -48.163 129.347 -76.008 92.340 -40.659 138.225-122.614 94.611 -39.836 61.394 -63.691 93.316 -40.330 134.982 9.354 99.408 -45.339 168.891 169.317 92.214 -62.276 120.862-108.101 93.555 -92.570 88.728 -89.150 111.163 62.873 135.500 171.149 90.935 57.010 96.757-128.788 88.863 63.805 135.615-143.759 91.682 48.805 137.147 -33.505 93.526 36.962 139.746-117.573 97.139 36.855 138.324-106.511 105.737 172.327 106.229 -72.679 123.946 -21.752 132.861 28.554 96.994 58.433 161.043 166.311 96.901 40.524 107.968 -82.786 98.183 36.258 0.000 0.000 95.357 45.085 115.451 -84.509 89.793 44.738 148.555 -95.552 90.460 49.775 113.213-128.317 90.178 50.451 109.546 -76.576 93.265-110.493 132.879 -86.301 111.505-112.062 120.758-133.150 96.272 44.127 146.019-168.529 96.508 118.816 147.385 -21.995 95.643 -43.322 94.955 -96.831 93.590 -45.203 112.272 -76.494 92.489 -40.424 110.668 -50.939 91.662 -50.144 109.834 -73.789 89.208 -45.372 128.599 -77.015 89.305 -47.981 98.719 -81.350 87.437 -54.468 116.579 -19.330 92.354 -30.584 152.224 -7.561 96.335 -58.682 128.757 -76.602 105.599 -84.699 135.374 29.032 89.376 78.086 130.079 -75.682 90.925 44.104 140.386 -98.756 90.178 44.577 110.750 -20.336 92.032 52.203 145.299 -43.721 90.125 44.803 139.698-136.248 93.128 84.016 101.913 -79.444 92.595 0.000 128.672 -76.980 # 584 total E -1.46750E+02 rmsd from N 0.000 %NC 0.00 93.358 -76.929 129.255 -83.038 93.517 -48.769 115.873 -76.752 91.614 -43.327 103.167 -72.894 93.066 -41.101 128.203 -74.877 102.160 -15.924 156.744-150.821 109.640 -35.190 67.337 -79.184 95.837 -25.314 118.047 -63.338 105.807 -55.227 160.306-166.301 89.990 -73.560 128.738-139.771 86.204 -71.777 95.264 -87.639 103.685 153.433 118.847 168.609 101.518 -33.467 96.090-104.741 110.578 172.282 104.228 -82.532 143.790 155.429 173.636 179.606 103.284-107.612 152.588 -26.757 93.949 46.286 142.736 145.753 91.975 46.649 135.967 -85.438 89.995 51.077 114.508 -63.355 90.479 52.996 111.537 -32.498 89.619 42.519 108.738 -82.085 90.150 47.101 0.000 0.000 89.733 55.301 108.157 -83.741 88.069 46.004 141.902 -72.581 89.872 42.517 120.936-126.043 89.872 50.798 108.432 -75.758 90.043 48.774 137.519 -84.563 90.593 46.577 136.179-141.248 90.699 51.454 113.295 -87.947 95.404 179.748 106.642 -77.712 92.603 63.323 131.202-157.253 90.247 50.108 113.836 -76.623 90.243 49.335 141.647 -5.582 88.715 50.775 118.065 -72.770 89.899 42.800 128.366 -76.083 88.617 47.259 102.488 -82.649 88.449 51.839 136.780 -56.575 89.381 49.263 148.548-112.263 90.431 37.259 128.202 -76.627 89.118 57.418 113.136 -78.396 89.328 61.938 128.567 -77.196 87.134 44.741 137.654-139.623 90.216 47.870 130.811 -43.581 90.443 54.485 139.991 -42.639 89.527 44.577 141.028-135.556 94.368 115.964 104.346 -80.818 124.680 0.000 144.265 -93.532 # 585 total E -1.50680E+02 rmsd from N 0.000 %NC 0.00 93.152 -78.592 124.600 -66.176 120.628-103.065 129.866 -33.624 93.438 43.051 109.764 -80.591 93.418 46.964 131.418 -77.854 95.361 42.181 150.310-128.032 91.020 44.912 59.222 -82.946 89.926 45.864 123.158 -45.777 91.157 45.310 126.670-103.741 87.916 46.855 140.041-144.867 89.200 54.832 79.579-104.196 89.612 138.641 135.211 -87.522 94.152 77.015 123.760-145.893 92.531 103.584 98.596 -85.047 92.741 -70.619 125.305 -77.958 98.743-118.388 150.082 -41.852 90.452 54.015 138.389 118.542 91.579 47.189 136.555 -83.063 90.469 46.525 149.019 -9.966 90.121 49.219 135.994 -20.210 89.084 49.836 110.004 -82.803 89.493 44.776 0.000 0.000 89.249 51.145 112.763 -80.708 88.538 47.043 137.843 -80.930 90.143 44.838 122.724-126.493 88.914 49.091 114.293 -75.698 90.324 48.898 136.682-104.559 91.970 47.652 133.552-124.236 93.377-105.314 141.530-121.809 111.469-167.196 152.381 -18.783 96.059 -52.138 98.626-100.910 93.683 -43.694 111.146 -77.524 90.854 -48.356 116.226 -51.697 91.870-111.133 116.654 -69.652 91.225 -42.063 129.282 -76.724 89.798 -48.719 100.705 -79.165 90.019 -53.021 139.709 -36.934 89.478 -44.855 154.963 159.552 92.375 -50.808 128.148 -76.650 101.030-107.854 132.399 -2.044 90.779 53.640 128.890 -75.645 91.839 49.937 135.844-161.128 89.029 54.439 132.558 -26.508 89.302 53.304 132.933 -71.721 90.448 44.049 140.572-129.159 95.173 74.737 104.408 -80.668 92.466 0.000 128.919 -76.600 # 586 total E -1.48092E+02 rmsd from N 0.000 %NC 0.00 93.298 -86.221 127.181 -76.780 93.032 -52.653 117.322 -69.343 92.573 -40.534 103.311 -76.309 93.323 -45.749 126.130 -74.245 99.158 -13.458 155.448-165.355 106.555 -38.399 61.333 -75.628 96.370 -22.145 132.581 -53.331 108.195 -34.404 134.808 -89.032 94.369 -42.814 147.856-170.240 92.883 -49.748 96.687 -66.842 98.397 125.802 144.549 -19.529 92.634-150.389 104.682 -99.778 112.287-175.051 111.874 -90.692 128.372 -73.908 138.196-131.479 94.139-118.259 109.923 -85.492 93.164 51.007 137.515 145.092 93.109 45.983 136.698 -85.499 90.842 46.353 127.483 -45.880 91.727 52.319 119.098 -33.152 90.420 45.339 109.316 -82.479 89.923 45.156 0.000 0.000 89.950 55.494 105.791 -81.677 88.481 45.685 136.774 -74.852 90.169 43.135 121.203-121.866 90.453 50.142 108.964 -76.092 91.193 45.253 130.783 -83.937 93.959 41.360 133.437-125.364 95.706 34.540 144.422-132.810 115.779 39.113 117.051 -88.886 137.944 -95.719 107.489 -93.457 96.936 -34.524 111.523 -77.437 91.137 -55.082 118.164 -35.930 90.398 -61.508 109.350 -74.302 90.569 -30.611 128.503 -76.247 95.736-100.998 100.147 -77.007 90.110 61.648 124.077 -18.580 93.958 55.675 149.955 -23.522 90.404 42.577 127.886 -76.108 90.396 54.222 110.881 -39.276 90.923 49.253 130.325 -76.956 91.291 38.997 140.940 -91.974 92.185 51.670 127.075 -35.413 93.373 104.141 133.938 -56.317 89.226 53.158 143.692-171.200 96.750 98.047 100.932 -79.471 92.389 0.000 129.243 -75.772 # 587 total E -1.47341E+02 rmsd from N 0.000 %NC 0.00 93.206 164.641 140.692-100.128 93.782 53.641 133.275 39.127 91.518 45.591 106.611 -82.122 91.519 48.734 130.655 -77.261 91.781 46.883 149.569-139.326 91.226 43.299 59.299 -68.735 90.427 46.509 129.891 -25.204 90.672 46.054 127.754-115.344 87.969 49.948 139.155-158.816 87.576 61.863 73.079-101.884 87.665 141.955 132.502 -69.124 92.281 104.493 129.493-153.936 90.369 83.608 105.144 -88.236 91.052 -68.339 136.008-108.366 101.985-118.508 152.398 -24.961 93.122 43.092 149.025-107.290 91.723 50.503 136.879 -75.347 91.601 44.318 121.861 -67.198 93.059 44.546 130.373 -19.479 92.372 42.655 113.018 -86.634 90.639 46.140 0.000 0.000 90.159 51.207 106.071 -85.265 87.893 46.869 147.631 -75.016 90.270 41.701 120.341-133.810 89.802 50.691 109.216 -74.053 89.622 43.810 138.574 -90.047 93.438 70.548 132.361-126.387 92.322 -68.402 104.516 -85.198 112.258 103.853 149.606 -20.392 97.832 -6.721 94.490-104.945 101.137 121.846 118.708 -75.726 91.501 52.245 123.687 175.841 90.638 67.588 112.108 -74.856 91.353 -96.298 127.304 -74.791 98.458 -35.212 98.969 -80.398 92.878 -40.238 147.755 -35.178 97.222 -38.709 128.276 -76.278 92.872 -46.005 129.664 -76.436 91.710 -47.962 127.578 13.192 93.415 123.409 130.834 -77.666 94.263 40.767 142.451-113.778 90.413 53.419 127.368 12.580 90.333 62.419 145.454 -36.559 88.663 38.968 134.649-136.936 95.556 89.902 107.407 -82.470 92.498 0.000 128.827 -76.375 # 588 total E -1.46990E+02 rmsd from N 0.000 %NC 0.00 93.254 162.857 141.668-103.727 93.644 50.992 145.962 12.094 91.800 47.035 106.477 -79.727 91.043 48.392 130.171 -75.951 93.333 38.926 136.812-109.147 94.969 39.925 135.423 155.536 93.254 39.333 114.276 -52.842 95.080 45.996 138.394 -85.578 89.394 41.043 144.403-142.857 92.286 47.192 78.021-108.370 92.654 51.495 134.992 -86.812 101.662 -94.952 95.426 -94.908 108.250-117.698 106.225 -83.428 133.120 125.890 152.500-166.127 124.871 -91.520 145.909-169.207 94.197 53.452 153.940 167.266 92.582 44.085 133.756 -82.465 91.195 49.479 113.850 -35.891 90.393 46.734 132.297 -48.344 91.970 46.276 108.985 -82.350 92.854 40.658 0.000 0.000 89.885 51.544 152.455-159.880 90.812 45.599 107.844-119.213 90.233 43.176 120.281-119.646 89.772 48.802 115.474 -79.756 90.490 53.654 144.646-118.894 89.770 43.428 119.142-152.625 95.059-110.045 149.048 -31.329 104.391-167.861 154.456-134.359 105.159 -55.284 94.501-101.129 113.256 -16.004 114.627 -78.720 97.814 -46.309 120.225 -73.435 95.698 -9.719 115.451 -71.483 127.870-119.397 138.813 -81.708 85.374 59.416 99.351 -85.573 89.747 53.813 111.818 -46.862 89.331 48.906 141.949 -28.357 89.543 40.957 128.113 -76.279 89.848 51.958 109.855 -63.548 90.653 45.847 128.023 -76.358 90.933 43.846 143.902 -88.399 91.078 45.428 130.133 -43.250 91.167 51.996 134.269-107.476 90.673 43.132 132.235-141.140 95.437 74.250 143.434-122.135 92.482 0.000 129.019 -76.531 # 589 total E -1.46701E+02 rmsd from N 0.000 %NC 0.00 93.315 171.083 139.287 -96.518 93.324 56.054 142.955 23.420 92.741 44.356 105.880 -82.263 92.088 48.422 131.259 -77.238 93.532 44.695 142.378-115.955 90.429 43.204 60.577 -75.903 90.965 44.779 122.225 -41.760 92.553 44.083 124.541 -97.716 89.489 43.589 143.239-135.337 93.811 98.657 81.180-101.791 91.172-141.129 147.607-105.846 91.019 61.521 96.514-118.960 92.835 49.015 105.177 -81.364 94.116 37.140 144.334 -30.622 95.338 46.054 140.726-122.749 93.613 39.930 125.764-118.017 97.865-124.313 115.732 -80.398 96.281 177.436 139.967-100.573 104.535 154.798 176.494-160.573 90.927 64.721 141.045-176.916 91.056 47.740 0.000 0.000 90.681 43.551 139.497 -24.222 89.936 52.310 142.657 -91.525 89.335 52.977 121.720-134.392 87.799 47.132 111.486 -73.582 91.091 48.234 137.334 -96.036 93.020 56.735 131.944-128.745 94.056 -93.316 103.725 -83.808 104.804-170.835 150.592 -19.432 130.825 -54.248 117.263-117.709 98.679 -43.887 111.091 -79.363 97.080-116.286 123.020 -64.879 91.315 51.117 128.143 -23.116 91.175 52.712 129.957 -76.196 89.212 44.694 143.957 -24.516 90.853 45.602 138.064 -29.314 90.702 46.307 144.232 -94.913 91.092 40.141 128.189 -76.982 90.012 50.450 111.895 -45.696 91.198 45.316 128.156 -76.243 90.902 47.577 137.649-143.306 91.567 52.631 128.002 -40.803 92.518-123.216 132.933 -80.195 97.276 -0.495 107.252 -85.972 120.373-154.349 107.483 -71.160 93.046 0.000 129.373 -76.694 # 590 total E -1.47339E+02 rmsd from N 0.000 %NC 0.00 93.083 -64.532 124.888 -69.995 94.236 -49.082 114.809 -76.547 91.207 -45.900 104.073 -78.138 90.682 -45.884 129.507 -76.567 89.859 -48.427 131.652-115.234 89.178 -48.864 65.064 -51.929 89.311 -38.693 121.099 39.740 97.214 -46.529 140.757 -81.324 92.769 -47.191 133.300-114.741 91.861 111.060 111.940-125.466 113.970 135.950 145.947-173.775 88.927 73.261 97.965-151.030 90.478 109.937 99.087 -85.904 91.172 -64.645 124.290 -99.246 95.890-121.474 110.166 -83.734 91.813 49.358 140.629 144.636 92.547 47.598 136.691 -85.743 90.886 45.618 130.314 -42.531 91.605 48.986 108.244 -32.017 89.708 46.752 108.697 -81.474 89.503 47.480 0.000 0.000 90.541 51.444 111.958 -80.830 88.425 42.463 147.123 -83.527 90.206 47.792 117.157-127.962 88.078 59.583 111.744 -78.310 88.472 54.491 140.856-108.563 89.434 38.043 120.246-149.040 97.891 -95.095 144.076-127.736 121.849-172.768 163.285-157.905 135.068 -52.968 108.231 -99.035 106.805 -25.373 114.153 -78.595 93.838 -50.841 112.122 -57.498 95.111 -33.982 114.920 -69.594 94.723 -53.511 127.360 -76.495 91.241 -63.906 98.933 -83.005 88.329 104.619 110.110 17.956 91.030 45.828 134.609 -37.069 93.949 39.425 131.087 -77.890 121.645-120.634 140.635 146.087 132.977 81.512 151.838 -75.896 94.179 41.099 139.197-109.868 92.309 48.218 121.660 -40.051 91.723 54.723 145.037 -51.467 89.482 43.749 140.654-141.760 94.606 80.560 103.424 -80.279 92.582 0.000 128.850 -76.761 # 591 total E -1.51992E+02 rmsd from N 0.000 %NC 0.00 93.185 165.689 139.328 -94.969 93.521 55.144 138.833 57.928 92.045 45.315 105.384 -81.014 92.111 47.401 130.745 -78.037 94.491 50.495 152.530-154.092 93.571 42.777 64.178 -81.389 89.021 51.386 146.062 -65.890 89.845 60.718 111.824-138.601 85.354 47.189 133.183-172.394 90.277-153.705 79.864 -91.787 106.260 108.612 152.695 135.801 93.823 48.676 93.118-119.476 99.566 38.175 98.119 -84.420 95.408 40.614 164.919-129.097 96.688 56.382 134.885-156.319 93.782 13.827 124.124-114.835 112.849-143.263 150.735 0.162 93.687 23.811 134.249 57.291 104.716 162.997 132.974 139.930 143.399 -68.079 114.179 -91.191 96.468 45.756 0.000 0.000 91.630 49.216 113.407 -78.029 90.638 47.652 144.929 -80.055 91.365 41.360 118.396-126.143 90.663 48.887 111.843 -77.554 90.249 67.536 142.245-102.887 90.098 46.359 143.544-138.762 91.869 39.398 142.760-128.977 100.957 -1.426 115.356 -89.077 138.742-162.718 103.114 -87.212 96.552 50.877 115.420 -76.999 93.006 47.287 106.453 -23.977 90.035 50.838 137.940 -23.064 91.279 47.440 128.961 -76.304 90.639 44.507 101.335 -83.613 92.161 43.286 130.107 -57.531 93.442 53.614 125.913 -77.835 92.704 74.186 130.803 -78.110 93.228-170.486 101.748-118.831 92.529 51.962 131.628 -77.677 91.166 46.539 140.941-105.730 88.926 60.771 133.898 -22.527 89.153 66.991 146.583-106.307 86.917 38.321 132.225-169.869 94.999 85.870 102.673 -79.367 92.553 0.000 128.789 -76.749 # 592 total E -1.48083E+02 rmsd from N 0.000 %NC 0.00 93.341 171.539 140.871-102.942 93.533 54.360 158.101 147.447 92.858 43.881 107.040 -80.427 90.520 49.916 130.483 -76.068 90.117 46.012 146.409-136.146 90.340 42.973 129.363-176.785 91.703 42.510 112.049 -60.517 93.508 41.611 137.322 -85.495 91.715 42.548 139.925-121.071 91.051 48.443 86.621-108.223 92.246 57.333 128.767 -92.164 100.215 -80.647 100.019 -95.161 114.867-172.774 99.802 -83.695 115.144 10.977 151.752-142.882 96.130 61.074 135.551-149.389 94.944 9.633 130.484-119.256 112.352-149.998 161.889 175.980 135.720 -39.306 134.608 87.387 96.868 48.770 143.762 -15.840 95.207 42.269 153.034 -10.181 90.171 49.625 0.000 0.000 89.470 52.816 109.962 -83.586 89.194 46.641 145.791 -83.315 91.398 40.573 120.313-127.796 90.163 52.022 111.899 -75.998 89.792 66.649 143.608-106.874 89.043 39.468 138.884-146.584 93.660 44.983 115.227 -89.457 99.602 -19.668 124.238 -89.151 131.667-151.622 115.119-110.889 97.960 60.478 115.302 -77.171 92.029 52.312 100.754 -23.616 90.170 54.959 110.604 -68.595 92.001 42.506 128.476 -76.249 91.803 40.171 101.646 -83.454 93.532 46.695 128.798 -40.948 93.329 45.873 128.664 -70.320 91.524 36.787 130.280 -78.183 93.952 60.160 101.279 -89.730 98.503 174.286 128.634 -76.743 90.666 58.448 137.267 -93.918 91.504 71.484 130.741 -47.935 90.095 59.912 143.636 -32.777 89.709 47.073 151.323-160.470 93.389 91.916 102.801 -80.125 92.537 0.000 128.692 -76.732 # 593 total E -1.48461E+02 rmsd from N 0.000 %NC 0.00 93.146 -61.194 128.804 -82.812 94.166 -47.470 116.567 -79.944 90.563 -47.617 103.157 -77.301 90.335 -47.602 128.853 -75.872 91.782 -39.297 139.395-125.379 94.607 -41.068 60.971 -63.051 93.259 -38.279 130.690 -8.327 99.915 -35.971 171.744 166.773 95.861 -58.014 126.406-113.920 94.510-153.578 77.852 -81.418 103.528 75.832 158.977-153.858 97.267 40.054 92.506-119.816 94.843 46.040 111.084 -80.831 93.359 111.967 143.364 -86.766 93.063 51.821 132.920-155.245 92.760 36.131 136.790-110.734 98.871 149.872 132.735 -92.203 114.515 28.927 157.303-153.490 94.612 45.778 160.481 150.544 98.599 36.102 107.587 -83.402 95.477 41.291 0.000 0.000 94.734 43.213 109.813 -86.508 92.711 44.651 150.121 -84.185 92.704 38.051 111.328-123.248 90.836 53.106 114.150 -79.919 89.832 57.977 134.798-104.291 90.734 55.642 136.832-126.174 92.680 2.002 142.265-128.745 121.002 107.183 107.949 -78.054 139.944-112.262 106.914 -92.061 97.192 -29.258 111.907 -78.711 106.650-141.946 133.630 3.389 93.381 52.726 114.908 -71.548 90.909 47.703 129.391 -76.023 89.572 43.702 107.739 -83.383 91.300 43.928 129.681 -88.885 90.433 51.437 139.993-111.035 89.961 44.636 128.505 -77.224 92.060 104.242 92.589 -70.477 91.205 -58.348 130.562 -77.839 94.170 -55.188 148.703-171.688 92.255 -66.757 130.850 -4.345 92.713 105.008 160.318-177.354 93.388 31.697 141.716-146.732 98.634 24.675 100.052 -76.277 92.466 0.000 129.633 -76.097 # 594 total E -1.47942E+02 rmsd from N 0.000 %NC 0.00 93.132 -65.941 127.735 -78.772 94.296 -49.976 120.103 -80.510 91.724 -46.041 101.477 -81.460 89.809 -50.601 128.952 -75.953 91.094 -38.079 139.860-131.165 93.349 -45.344 61.566 -63.165 91.333 -32.049 157.609 153.310 105.880 -36.094 167.966 158.884 93.436 -46.999 133.786-121.458 93.202 118.619 86.713 -90.018 114.844 174.061 138.017 -91.793 93.754 71.540 127.836-153.590 92.739 46.317 100.112 -79.787 91.359 56.687 141.884 -24.413 91.573 36.586 128.596-121.417 95.767 46.943 124.707-122.030 95.728 23.639 123.241 -74.696 109.000 144.501 143.300 -39.901 101.234 39.425 108.106 168.905 96.743 39.085 141.422-124.603 113.239 15.736 0.000 0.000 95.941 47.138 151.249 -6.191 93.065 46.401 166.811-149.402 90.744 49.123 107.601-137.631 88.700 47.454 109.492 -71.453 90.868 50.711 145.003 -45.585 91.711 47.636 135.586-139.901 94.126-102.558 149.695 -30.790 108.103-161.629 157.344-141.037 102.247 -47.562 97.237-104.419 102.463 -30.240 111.975 -78.492 92.717 -46.652 110.239 -49.932 90.072 -52.699 119.701 -82.092 91.037 -49.121 130.333 -76.127 89.779 -41.803 100.226 -82.711 95.943 -99.429 137.900 -24.946 92.929 86.964 155.532-123.302 90.479 39.764 136.656-118.427 94.012 112.414 122.003-153.502 91.047 -54.949 130.357 -77.737 92.632 -47.881 143.216-124.035 88.106 -52.964 120.426 -3.967 91.247 -60.623 148.293 -35.573 88.847 -52.000 132.140-109.698 95.327 68.443 103.059 -79.282 92.416 0.000 129.322 -76.091 # 595 total E -1.50117E+02 rmsd from N 0.000 %NC 0.00 93.132 164.851 138.160 -90.808 93.344 56.663 143.271 39.263 92.799 45.365 106.791 -78.841 92.284 44.857 132.708 -78.064 95.720 43.091 146.616-123.903 92.726 39.705 51.505 -75.371 91.703 46.408 161.421 134.331 92.516 42.940 138.522 -96.809 90.472 42.990 142.111-142.266 90.546 52.312 79.543-109.725 89.811 144.918 135.422 -96.350 94.282 87.624 126.019-150.725 89.444 105.951 101.723 -86.989 92.615 -69.975 122.618-103.553 99.033-121.557 151.339 -34.265 91.605 49.794 140.528 124.095 91.344 47.958 136.603 -84.017 90.441 47.639 124.873 -52.443 90.736 48.682 128.169 -22.856 89.754 46.479 109.868 -82.574 89.268 47.654 0.000 0.000 88.947 55.000 112.800 -81.791 87.914 44.590 141.275 -86.005 90.288 46.120 120.035-128.671 87.726 60.372 111.092 -77.082 89.042 52.985 140.755-105.321 90.150 49.997 129.165-148.553 96.294 -45.986 108.137 -87.450 128.049-131.890 169.738-166.764 130.727 112.554 120.543-119.855 94.156 51.088 115.142 -77.561 91.781 51.599 99.014 -16.388 91.717 47.304 117.736 15.252 90.389 44.726 129.978 -76.786 90.111 45.482 103.205 -84.252 90.768 49.936 119.706 -17.507 91.424 38.554 139.379 -57.007 94.349 43.478 129.556 -77.227 97.125 119.136 114.596 -81.886 91.166 -50.351 129.782 -77.349 92.047 -43.262 145.170-129.401 89.237 -47.928 123.603 -5.603 92.074 -52.876 159.227 -18.404 90.463 -43.789 139.917-150.923 95.955 103.536 104.835 -79.635 92.512 0.000 128.884 -76.355 # 596 total E -1.46613E+02 rmsd from N 0.000 %NC 0.00 93.054 -58.321 128.166 -81.440 94.467 -48.943 118.105 -80.672 91.487 -46.310 101.655 -80.479 89.789 -50.675 128.876 -75.901 91.090 -39.276 137.438-127.089 92.910 -44.980 62.309 -62.533 91.499 -34.136 152.392 179.504 104.372 -35.337 169.218 150.304 94.329 -49.476 132.763-117.521 92.142 124.025 85.904 -87.657 109.810 174.614 136.760 -92.828 92.768 69.511 127.589-153.598 92.900 43.848 100.888 -82.020 91.350 54.673 140.572 -20.942 92.060 35.983 129.302-123.665 96.055 46.289 123.069-122.177 95.191 24.839 121.197 -71.688 109.320 145.030 126.870 -32.974 101.391 36.303 111.012 171.530 97.062 40.677 141.974-125.155 112.355 15.242 0.000 0.000 95.490 47.332 152.101 2.779 95.158 39.381 163.373-140.306 90.158 51.467 114.027-144.385 87.912 58.078 110.598 -77.135 88.592 52.393 139.097 -44.202 91.071 36.797 136.154-129.764 99.219-122.625 104.754 -81.023 113.554 177.615 154.285 -3.996 127.263 -90.744 114.930-115.477 97.405 40.516 114.039 -77.755 91.528 48.456 103.542 -5.140 88.521 58.160 128.619 -30.383 87.833 50.194 128.663 -76.311 87.371 46.167 103.933 -82.051 90.011 44.892 135.840 -41.119 90.406 46.294 144.297 -95.048 90.896 41.750 128.143 -76.945 88.325 51.765 107.199 -51.498 90.330 50.221 125.951 -75.707 89.712 42.923 137.056-137.204 91.496 44.672 127.611 -40.740 91.460 51.955 137.366 -91.331 90.589 42.910 134.881-142.957 96.019 74.845 146.922 -24.398 92.516 0.000 129.062 -76.635 # 597 total E -1.51191E+02 rmsd from N 0.000 %NC 0.00 93.179 -83.002 122.264 -61.148 115.330-104.556 131.519 -44.641 90.517 49.124 106.387 -76.242 93.525 44.271 130.825 -78.241 94.588 46.499 150.363-145.485 93.272 42.361 54.394 -71.579 90.498 47.104 136.328 -28.776 89.529 50.661 123.636-121.323 87.788 48.849 133.130-134.889 90.633 73.426 81.237-102.160 91.953 -60.964 143.536 -92.727 109.327 -72.454 95.748 -85.915 98.292-117.787 108.520 -78.800 122.396 -94.382 154.705-153.836 105.162-114.828 133.687-152.951 91.602 50.731 143.860 133.528 91.189 47.902 135.052 -84.695 90.606 48.585 136.519 -57.497 89.789 46.929 152.159 -50.404 90.730 45.805 141.632-152.363 89.406 48.382 0.000 0.000 88.923 50.985 105.074 -85.340 88.999 48.176 133.716 -74.236 90.330 45.107 125.741-123.887 89.540 47.621 114.577 -75.596 91.247 50.272 132.515-100.478 91.736 49.622 135.891-148.704 93.448-119.225 104.147 -82.371 97.059-164.452 150.445 -19.659 101.760 -51.137 97.427-101.674 101.578 -28.803 112.132 -78.059 92.108 -48.817 109.620 -48.605 89.666 -52.198 119.564 -75.465 91.565 -51.539 128.963 -75.614 90.856 -27.321 135.414-140.926 98.203-112.962 126.052 -4.903 94.642 66.420 154.932 -27.231 91.037 53.124 132.180 -78.554 90.153 112.653 111.901-113.519 92.314 -43.577 130.200 -78.198 93.275 -50.760 144.512-132.745 87.756 -57.225 119.228 2.563 90.936 -60.236 151.695 -30.593 89.217 -36.464 138.077-134.135 100.401 70.813 104.552 -78.770 92.272 0.000 129.761 -75.356 # 598 total E -1.53424E+02 rmsd from N 0.000 %NC 0.00 93.146 -64.255 129.613 -84.917 94.700 -46.463 116.961 -80.524 90.808 -47.546 103.082 -77.626 90.306 -46.836 129.749 -76.315 92.205 -40.892 142.841-130.522 93.909 -41.844 61.390 -66.574 91.734 -41.812 130.057 35.381 102.053 -43.099 167.041 156.686 92.563 -51.913 128.635-117.996 97.570-107.435 78.979 -84.735 119.187 74.705 151.602-177.414 92.242 62.011 94.675-122.701 93.649 53.041 109.111 -84.633 109.267-117.126 153.742-108.474 108.358-116.027 138.351-154.007 95.025 47.974 141.280 167.384 93.070 45.336 135.733 -84.403 90.280 50.296 121.107 -58.562 91.550 57.583 114.157 -42.498 91.327 41.917 150.250-144.330 90.058 45.029 0.000 0.000 90.818 61.208 103.168 -86.075 86.065 50.908 144.809 -75.639 88.956 43.640 118.424-129.478 89.921 49.967 110.968 -74.773 90.054 45.711 141.755 -99.658 92.859 51.335 135.808-143.550 93.323 -90.431 141.326-124.987 119.884 165.803 111.719 -78.960 131.389-175.969 111.501-107.169 95.215 47.707 115.007 -76.866 93.541 43.440 119.554 -53.382 92.969 43.763 133.112 -32.486 93.598 40.822 129.148 -76.909 93.675 43.446 104.033 -86.044 90.687 48.021 116.299 -73.127 90.722 62.410 124.958 -64.983 87.576 51.888 130.542 -77.668 90.168-174.307 72.599 -87.215 91.903 69.621 166.983 -89.153 90.790 46.440 140.628-103.516 90.805 46.353 128.703 -23.377 91.215 56.306 148.175 -37.038 88.979 42.605 138.507-148.252 94.646 81.785 103.683 -80.047 92.560 0.000 128.834 -76.760 # 599 total E -1.47644E+02 rmsd from N 0.000 %NC 0.00 93.020 150.982 140.565 -95.841 93.373 52.635 155.135 23.840 91.181 49.451 106.985 -80.033 90.475 49.759 129.540 -75.738 90.543 45.254 145.250-122.896 90.628 42.920 127.820 160.454 90.794 46.630 121.042 -33.018 91.259 42.149 132.625 -98.691 89.478 54.429 145.675-157.332 86.630 63.086 77.778-109.333 90.307 36.210 128.241 -81.622 105.894-119.429 97.899 -79.704 115.136-164.999 103.927 -82.262 146.380-142.181 176.444-175.391 109.078-100.692 139.102-147.010 93.866 49.295 147.922 145.000 92.435 44.669 133.497 -86.758 90.352 52.026 163.775 -24.759 88.908 50.205 135.370 -36.661 89.163 46.765 109.545 -82.707 91.115 43.490 0.000 0.000 90.085 48.024 154.535-152.741 90.228 47.185 137.684 -94.518 90.928 41.655 121.225-128.026 90.007 46.917 118.212 -78.525 91.395 49.237 135.104-112.690 92.634 58.591 136.282-130.774 90.802-108.111 145.603 -37.410 93.845 173.403 147.237-119.612 100.243 -46.196 94.919-118.943 109.899 -45.360 114.085 -81.750 109.535-111.602 131.043 -21.450 94.042 43.447 108.969 -73.475 91.457 51.778 130.730 -77.538 89.973 45.356 105.183 -82.612 89.669 48.891 142.028 -26.723 89.099 46.965 140.606-109.597 89.907 42.179 128.322 -77.030 89.163 51.452 126.216 -60.294 89.781 45.085 127.276 -75.763 91.522 45.362 134.169-122.462 92.089 55.029 128.787 -43.560 91.756-116.635 135.643-105.193 97.094 109.218 139.440-142.926 112.138 40.511 108.946 -77.270 92.419 0.000 129.348 -76.191 # 600 total E -1.50358E+02 rmsd from N 0.000 %NC 0.00 92.909 147.319 138.202 -86.938 93.184 51.750 130.568 -90.748 93.941 47.703 104.955 -81.143 91.281 49.405 131.100 -76.323 96.016 31.589 94.443 -83.775 93.584 47.052 152.338 136.584 94.823 30.245 110.370 -61.967 97.577 50.340 136.379 -75.740 96.144 -1.343 138.776-112.427 108.705 61.603 134.600-151.175 95.440 43.098 99.896-132.261 102.244 -92.212 99.429 -90.556 116.755-163.058 106.142 -82.743 119.918 -90.599 151.209-156.633 99.875-121.163 132.485-149.121 96.072 39.540 148.389 158.123 92.942 46.129 135.453 -88.697 90.955 50.295 146.627 -92.159 90.544 51.283 115.453 -40.684 90.181 39.277 106.930 -82.379 91.704 45.551 0.000 0.000 91.905 45.885 107.346 -89.870 89.064 50.269 150.582 -87.946 88.352 48.651 117.128-135.228 88.137 50.346 106.269 -73.151 90.302 48.981 136.804 -53.916 91.512 43.268 137.656-140.980 95.788 -99.547 150.211 -30.094 116.230-165.172 162.341-152.744 97.918 -49.326 95.212-107.253 91.242 -47.891 110.594 -74.790 91.572 -72.286 109.264 -49.699 89.004 109.380 117.756 -73.904 93.439 45.776 129.208 -76.865 88.613 48.414 101.967 -76.533 89.646 59.836 141.367 -40.731 87.513 50.294 162.760-151.149 89.693 40.433 128.121 -76.369 90.641 49.328 117.836 -40.875 89.872 48.965 129.902 -76.492 89.649 45.513 141.539-133.421 90.082 45.902 127.849 -41.323 90.168 53.649 137.035 -81.546 90.001 43.603 136.628-138.870 95.091 78.005 103.995 -80.746 92.529 0.000 128.926 -76.683 # 601 total E -1.47032E+02 rmsd from N 0.000 %NC 0.00 93.048 -64.986 125.761 -73.045 93.936 -49.256 112.103 -75.428 91.782 -41.594 104.150 -76.821 92.548 -45.283 127.096 -75.304 95.909 -22.987 136.988-106.395 107.956 -29.560 59.677 -67.505 94.468 -33.052 129.751 -48.358 107.821 -15.794 133.241 -84.281 103.337 -56.948 126.164 -77.246 88.665 25.295 129.267-130.949 134.930 -24.231 129.115-135.352 135.980 -76.708 103.337 -93.161 105.051-103.028 108.780 -79.574 134.467 159.212 155.108-154.943 114.047 -99.242 143.501-163.984 94.389 46.090 145.418 134.710 91.509 45.828 134.539 -85.774 90.174 52.865 122.759 -68.809 90.121 49.299 140.738 -32.343 91.114 41.113 108.319 -82.514 90.204 47.498 0.000 0.000 89.065 58.491 104.637 -84.126 87.569 46.079 136.288 -79.360 91.045 42.011 120.932-122.202 90.471 49.527 109.679 -75.172 90.600 53.893 130.845 -87.599 91.127 52.937 136.173-136.473 93.919 9.582 107.948 -86.954 128.410 74.551 150.339 -18.232 138.729 -82.481 109.864 -97.035 116.155 -14.594 115.081 -80.097 92.265 -53.492 108.397 -55.727 92.743 -41.359 111.584 -68.296 92.145 -44.433 126.896 -74.838 94.053 -32.553 105.812 -90.772 93.204 -49.200 99.040 -62.892 85.950 -56.116 149.555 -26.834 90.772 -53.975 127.617 -76.663 88.705-121.274 117.260-133.043 93.004 36.583 131.562 -77.662 96.180 57.324 139.748-110.891 106.590 6.159 123.427 4.662 96.710 79.513 152.127 -11.994 88.473 57.990 131.204-155.629 94.104 131.967 97.988 -79.597 92.593 0.000 128.727 -76.230 # 602 total E -1.48886E+02 rmsd from N 0.000 %NC 0.00 93.329 -77.974 130.633 -87.654 95.286 -45.749 130.880 -93.030 91.096 -52.667 101.307 -78.907 90.520 -43.270 127.714 -74.870 91.582 -49.158 148.747-178.428 95.310 -45.865 110.511-142.511 91.199 112.522 93.983 -79.234 93.486 45.868 135.719-106.994 90.050 54.137 143.720 154.211 88.636 69.452 83.066-105.095 92.265 -71.463 136.031 -95.284 108.837 -75.228 93.666 -84.107 100.522-132.284 110.336 -79.010 129.042 -81.481 151.833-123.631 95.284-120.186 133.164-147.486 92.515 48.285 139.164 140.515 92.207 47.549 135.389 -84.779 90.976 46.093 130.300 -57.709 91.999 47.411 126.375 -34.269 91.832 44.044 146.608-154.163 91.816 42.638 0.000 0.000 90.899 52.048 112.632 -82.796 89.088 47.686 138.593 -79.340 89.030 43.638 121.039-126.009 89.815 49.945 111.110 -79.344 90.211 47.229 137.745-100.313 92.431 50.191 133.377-143.355 93.355 -96.478 141.235-124.272 112.718 174.379 110.258 -78.522 134.606-169.271 109.281-101.921 95.698 47.887 114.819 -76.999 94.353 42.057 110.976 -36.879 93.005 44.602 132.368 -27.697 91.178 46.513 129.604 -77.505 89.825 48.720 102.374 -84.313 90.009 46.230 125.621 -69.619 89.900 51.958 131.077 -72.160 90.564 59.659 128.732 -77.020 90.812-177.703 84.678 -72.957 92.668 65.940 159.145 -86.494 91.523 43.129 140.498-104.562 90.787 47.172 127.936 -17.880 91.262 58.537 147.403 -42.201 88.395 43.531 137.783-147.405 94.205 89.638 103.544 -79.943 92.556 0.000 128.788 -76.721 # 603 total E -1.56369E+02 rmsd from N 0.000 %NC 0.00 92.595 98.675 134.677 -82.914 93.247 54.478 124.234 -40.354 94.049 43.980 104.102 -80.882 92.674 44.809 128.178 -74.774 91.416 48.546 106.433 -78.568 88.232 43.967 88.419 -69.306 89.045 45.955 112.274 -76.417 90.172 48.391 123.536 -98.468 87.922 52.562 145.565-151.607 89.834 179.000 85.053 -95.930 112.955 55.903 145.332-154.369 92.818 58.264 94.932-122.895 92.658 55.778 103.718 -84.320 96.801-116.379 126.241 -81.490 103.823-112.398 140.173-152.785 93.149 50.592 144.609 157.674 92.275 45.843 134.101 -86.327 90.295 50.281 124.293 -56.301 90.427 51.477 111.805 -36.766 90.248 45.466 109.804 -82.921 90.851 43.363 0.000 0.000 89.858 56.191 110.005 -81.802 87.322 48.467 139.550 -77.269 89.465 43.546 122.030-127.849 90.237 47.640 107.591 -75.419 89.778 48.572 134.373 -79.648 92.708 44.621 137.077-141.054 93.446 40.028 143.056-130.692 97.759 40.292 115.796 -89.052 136.436-178.904 107.194 -96.771 97.812 43.033 115.638 -77.709 92.605 47.905 102.157 -7.887 89.525 52.956 128.550 -24.159 89.874 50.582 128.770 -76.474 88.613 44.750 103.314 -83.788 92.146 42.958 133.915 -40.201 92.134 44.950 134.594 -86.411 91.432 45.095 128.985 -77.666 92.780 97.528 110.760 -88.493 88.199 -75.514 129.008 -77.210 92.296 -45.138 145.366-133.234 89.509 -47.243 131.800 -28.480 91.215 -58.181 151.126-112.620 90.183 -45.879 127.494-156.647 96.523 71.066 102.682 -79.644 92.417 0.000 129.292 -76.206 # 604 total E -1.48865E+02 rmsd from N 0.000 %NC 0.00 93.218 174.208 135.532 -82.684 92.446 61.154 133.367 -93.796 96.138 41.295 101.986 -80.653 93.292 51.203 130.033 -75.627 110.335 0.642 100.858 -84.960 98.850 51.659 146.065 160.122 98.241 22.345 112.893 -62.811 97.191 56.278 148.875 -80.421 95.900 4.832 125.591-117.541 103.199 67.867 141.128-123.045 95.738 17.124 99.562-126.887 107.843-109.416 97.875 -82.723 109.800-161.432 104.593 -82.344 105.924 -47.561 151.243-129.518 97.682-121.401 137.142-152.390 92.636 47.256 150.009 129.794 92.364 47.084 133.723 -84.001 91.285 45.097 120.206 -49.603 91.563 49.926 139.693 -46.548 90.296 45.472 109.353 -82.649 92.361 41.526 0.000 0.000 90.741 48.421 139.715-111.019 91.195 45.684 127.035-105.910 89.968 40.723 119.619-124.891 91.269 46.726 113.915 -79.641 91.547 45.375 132.513-101.349 93.558 57.338 131.795-145.324 93.201 -98.799 105.482 -87.339 98.633-163.536 112.113 -79.118 131.435 -53.652 114.556-113.396 94.594 -42.552 111.396 -81.179 96.125-119.131 128.627 -33.210 91.638 52.967 131.393 -22.850 91.408 54.005 129.447 -76.057 89.372 44.918 105.524 -82.394 91.420 43.226 137.881 -38.369 91.138 47.546 138.871 -97.642 90.475 45.333 128.517 -77.431 91.906 89.905 115.047 -90.291 87.358 -79.045 129.211 -77.422 92.882 -45.562 142.746-120.971 88.669 -50.228 122.034 -5.488 90.571 -60.908 147.107 -45.161 89.711 -57.720 108.330 -82.607 93.831 76.170 104.253 -78.506 92.364 0.000 129.176 -76.271 # 605 total E -1.48474E+02 rmsd from N 0.000 %NC 0.00 93.018 141.057 142.926-103.894 93.106 52.611 118.644 -21.849 93.805 44.083 104.734 -80.695 92.203 43.108 130.670 -76.597 95.037 45.111 110.962 -87.273 94.737 37.971 54.837 -65.030 91.449 47.709 156.951 -14.312 89.925 50.072 139.133-103.418 89.078 45.140 126.615-120.184 89.969 47.353 86.906-101.055 91.889 125.739 138.247 -94.133 94.619 69.240 127.105-149.553 95.908 99.364 99.195 -83.544 95.051 -32.322 138.648 -73.804 107.495-138.662 147.025-148.187 92.094 54.104 136.854 118.309 92.041 46.386 134.056 -84.577 90.518 44.777 117.541 -51.388 92.618 51.172 161.475 164.107 92.468 43.380 108.788 -82.828 96.091 33.262 0.000 0.000 93.795 50.797 117.682 -80.598 89.663 48.100 140.793 -92.551 90.609 42.175 117.434-126.986 90.466 47.809 112.873 -76.493 90.321 47.871 140.564-101.730 92.157 50.448 134.621-143.722 92.982 -94.623 150.077 -31.066 119.710 169.497 163.670-156.819 105.230-105.616 96.267 -94.348 124.384 -96.360 113.805 -78.873 93.909 38.933 141.455-105.542 95.983 125.046 110.629 -74.926 97.776-115.963 127.430 -75.874 86.546 54.572 102.000 -80.747 91.003 48.043 115.226 -39.228 88.094 50.894 146.497 -30.943 87.639 46.239 128.194 -76.784 87.348 54.642 111.059 -46.335 87.971 49.905 129.527 -76.154 89.767 43.427 140.156-110.894 89.288 51.126 129.086 -35.853 88.147 75.138 138.079 -51.503 87.530 53.417 135.163-144.965 91.467 104.317 140.934-117.969 92.639 0.000 128.654 -76.706 # 606 total E -1.50309E+02 rmsd from N 0.000 %NC 0.00 93.144 -85.972 120.820 -57.456 118.409-105.673 131.161 -42.860 91.936 48.233 108.156 -77.818 93.289 42.506 130.991 -77.898 95.438 46.532 152.335-135.624 94.095 39.015 52.593 -71.896 92.460 46.818 135.521 -17.594 92.928 40.834 128.301-106.968 90.987 50.031 145.083-151.311 88.889 50.303 74.767-102.527 93.033 153.398 132.087 -72.342 91.287 75.004 128.466-153.267 94.772 113.592 99.631 -82.401 92.079 -63.804 145.913 -37.577 93.963-124.670 142.827-136.830 90.504 48.505 135.481 122.222 91.957 46.483 133.446 -85.422 91.005 44.811 146.067 -34.541 91.315 47.462 140.963 -23.738 89.145 47.296 110.583 -82.673 89.391 46.421 0.000 0.000 88.756 52.372 122.865 -79.045 89.413 41.063 134.064 -92.777 90.060 48.884 120.707-125.726 87.425 72.020 111.453 -78.787 88.320 58.112 144.130-116.309 88.466 32.287 123.878-168.662 99.104 -97.906 150.984 -28.397 123.624-171.429 167.715-163.379 96.003 -56.580 96.971 -91.412 91.087 -50.061 112.247 -75.952 91.867 -42.393 115.910 -12.300 92.303 -43.995 112.774 -70.060 91.926 -46.031 128.448 -77.133 89.558 -44.400 103.057 -86.015 94.574-107.938 144.456 -11.862 91.195 67.816 145.085 -81.997 89.363 42.637 129.712-115.218 91.008 73.349 114.235-136.101 93.918 168.046 128.368 -76.462 91.284 54.727 140.669-105.482 90.767 51.157 128.510 -37.499 89.756 61.354 150.234 -25.010 88.300 50.715 145.554-134.773 92.090 114.599 101.140 -79.851 92.641 0.000 128.468 -76.755 # 607 total E -1.47219E+02 rmsd from N 0.000 %NC 0.00 92.994 146.151 142.467-101.621 93.366 53.846 136.559 39.184 91.060 45.860 105.979 -82.874 91.361 53.283 130.383 -76.475 91.470 42.430 151.521-147.655 90.201 45.362 64.832 -73.989 90.611 45.914 112.509 -43.265 89.544 47.409 145.265 -81.516 89.190 44.188 126.889-118.495 90.908 42.848 81.945 -95.958 93.308 159.859 133.238 -73.319 91.876 70.008 135.545-165.204 87.874-120.741 101.910 -84.344 126.422-133.762 144.601 165.778 119.267-120.339 156.419 -48.088 94.900 45.679 150.922 144.400 91.535 47.860 134.958 -81.241 90.743 48.896 99.342 -34.689 91.415 47.812 134.819 -43.112 92.294 41.961 109.134 -81.853 92.154 43.936 0.000 0.000 89.058 59.589 149.893-173.235 89.409 45.862 109.281-118.598 90.726 41.786 118.595-119.003 89.505 66.689 119.710 -74.627 87.846 56.927 145.015-120.117 88.188 34.090 121.865-162.167 97.672-103.238 106.703 -83.752 132.517-169.335 174.464-176.276 118.589-118.971 113.354-115.386 110.533 6.780 111.374 -78.694 90.904 70.674 145.748 -15.979 90.577 49.745 112.296 23.198 91.294 40.634 129.551 -76.448 94.655 31.991 103.897 -84.584 106.319 27.602 134.747 -27.842 94.367 47.756 150.855 -23.189 92.142 34.636 129.106 -77.597 93.342 112.620 93.735 -84.672 92.729 -37.583 131.726 -79.196 96.570 -51.552 144.796-143.140 94.967 -30.765 124.916 -17.272 94.533 -59.211 156.232 -28.706 90.927 -39.867 140.672-179.025 97.756 75.350 104.368 -79.760 92.592 0.000 129.254 -76.353 # 608 total E -1.50014E+02 rmsd from N 0.000 %NC 0.00 93.167 -66.627 128.941 -82.496 94.591 -47.581 117.437 -80.150 91.147 -46.775 103.124 -77.721 90.516 -46.595 129.359 -76.157 91.528 -41.954 143.460-132.530 93.080 -41.697 60.248 -64.942 91.790 -45.307 128.537 38.764 99.777 -46.386 168.160 159.092 92.637 -50.735 123.324-113.651 97.559-109.699 83.475 -81.843 122.821 70.796 144.479-168.872 92.116 65.287 93.583-124.006 95.333 54.576 102.816 -88.930 101.513-101.317 143.425 -94.731 102.839-120.906 152.345 -30.585 94.593 47.175 138.596 158.654 92.859 45.993 136.343 -84.643 90.863 46.649 115.671 -56.443 91.784 55.715 100.783 -35.000 90.905 43.116 108.089 -80.525 89.350 47.487 0.000 0.000 90.042 62.830 105.807 -84.877 86.481 49.043 143.497 -72.180 88.635 44.310 117.993-126.277 89.428 52.729 109.992 -77.774 89.282 50.386 142.754-103.843 91.367 47.951 133.144-145.324 95.325-103.200 103.423 -82.450 108.819-173.753 150.860 -17.409 136.840 -72.216 110.605-102.544 110.827 -8.256 114.398 -79.305 92.012 -60.672 108.272 -60.907 90.041 -42.966 114.854 -74.056 93.529 -67.731 127.249 -76.102 79.141 119.567 100.474 -79.106 92.030 60.786 151.446 -38.896 88.647 44.469 162.927 179.803 91.033 40.273 127.739 -76.302 89.806 58.535 132.263 -68.450 89.722 49.947 127.402 -75.390 89.986 38.772 137.389-137.877 92.779 45.837 127.878 -43.023 91.741 50.020 136.304 -94.737 90.929 44.724 135.726-149.422 95.274 73.144 104.110 -80.515 92.515 0.000 129.006 -76.635 # 609 total E -1.46800E+02 rmsd from N 0.000 %NC 0.00 92.852 142.122 137.587 -84.993 93.503 53.919 145.484 71.403 91.858 47.618 107.074 -79.462 91.071 47.489 129.870 -75.981 92.145 43.085 159.095-162.012 93.855 41.452 121.061 144.328 91.879 43.420 126.494 -25.086 92.876 43.221 137.327-105.890 89.505 54.594 140.901 169.191 86.675 63.363 76.059-109.032 89.320 106.241 134.649 -86.181 90.677 54.872 101.358-118.651 89.298 46.780 134.130-124.030 90.944 54.682 136.843 -29.860 89.794 50.831 128.613-111.021 91.546 36.360 131.403-113.260 98.388-130.103 121.316 -69.875 102.766-169.820 127.358 58.240 106.065 -36.557 133.544 -28.482 95.047 -47.104 102.815 -80.388 93.696 -38.433 0.000 0.000 93.597 -47.221 131.328-101.689 89.601 -50.784 124.510-109.134 90.988 -46.208 112.215-133.217 91.989 -41.596 116.911 -69.448 101.844 -18.799 153.068-131.184 107.460 -39.520 127.415-174.777 95.993 -45.410 142.121-118.904 104.506-155.167 156.582-133.755 97.043-123.788 90.853-113.320 96.636 39.382 114.351 -77.113 93.156 47.528 120.589 -50.281 91.326 46.854 142.118-170.384 91.359 46.116 129.314 -76.904 90.575 42.741 106.877 -87.565 90.837 48.090 138.259 -99.495 89.633 57.851 133.485-114.899 90.045 53.977 128.291 -77.015 91.186 175.844 100.483 -94.969 93.493 52.762 130.738 -77.236 92.361 51.355 140.681-106.304 91.637 46.737 112.743 -11.590 95.985-126.882 121.194 -69.857 95.024 -22.234 127.019-134.080 119.593 30.870 106.506 -76.425 92.392 0.000 129.211 -76.074 # 610 total E -1.47148E+02 rmsd from N 0.000 %NC 0.00 92.972 -60.975 127.831 -79.864 94.882 -45.914 114.329 -80.879 90.964 -45.898 103.583 -77.548 90.298 -48.356 128.133 -75.520 89.240 -44.975 134.236-115.676 91.556 -40.962 62.870 -54.630 90.068 -46.452 137.057 -21.955 92.980 -47.736 140.131-106.065 90.712 -48.939 143.965-101.156 91.246 107.150 116.120-123.732 120.764 -75.160 148.449-150.564 129.943 -94.288 106.397-102.006 103.823 -84.126 106.583 -80.433 140.468 166.722 165.836-172.747 105.572-107.214 142.274-158.722 93.961 47.616 138.333 140.429 91.435 46.883 134.325 -86.274 90.045 52.387 121.093 -66.240 90.287 50.226 125.106 -30.173 90.962 41.824 107.955 -82.548 90.188 47.663 0.000 0.000 89.762 57.394 105.510 -84.714 87.427 46.611 146.039 -79.268 91.378 41.452 117.945-127.229 90.424 51.394 111.269 -75.327 90.169 65.223 132.932 -95.542 89.668 47.631 138.563-138.489 91.701 36.215 108.415 -86.315 110.285 20.904 150.251 -28.925 136.738-115.290 109.080 -97.868 123.170 32.404 118.542 -81.143 90.873 -70.889 103.235 -50.662 91.241 -30.988 114.379 -65.523 95.248 -70.492 126.101 -74.650 90.047 -7.320 100.803 -83.716 107.857 116.010 106.503 -49.544 92.357 70.433 141.315 -20.728 90.769 53.687 129.447 -76.382 90.033 174.554 126.516-132.312 91.927 79.003 133.023 -78.141 89.879 44.585 141.215-101.403 90.361 47.176 131.710 -46.450 90.802 56.035 144.703 -39.920 89.177 46.076 138.332-136.374 93.336 89.914 102.825 -80.136 92.506 0.000 128.782 -76.713 # 611 total E -1.46630E+02 rmsd from N 0.000 %NC 0.00 93.089 -62.056 128.988 -83.253 94.682 -45.739 114.552 -80.103 90.314 -48.202 103.356 -77.598 90.211 -46.075 130.113 -76.591 93.779 -39.693 137.971-122.489 95.610 -36.976 71.315 -78.339 96.389 -38.269 137.513 9.192 103.824 -28.439 173.041 178.324 101.057 -50.926 126.957-116.204 96.648-151.523 84.440 -78.921 115.870 71.792 157.505-179.942 95.100 39.757 91.064-120.513 92.877 49.486 109.834 -86.054 92.196 54.445 157.754-143.860 88.437 53.590 143.233-160.518 90.744 42.124 127.199-119.231 96.361-164.662 135.028 -87.232 142.858 -1.757 133.831 77.775 94.860 50.061 140.939 122.963 95.197 37.105 145.792 -36.575 96.748 43.143 0.000 0.000 98.645 29.919 152.861 -17.154 95.955 45.204 171.293-174.645 91.615 50.822 116.951-154.155 89.599 45.175 109.653 -77.947 91.504 52.299 146.192 -94.594 92.137 70.882 135.956-164.119 93.466 -72.479 103.080 -84.925 117.401 156.061 151.261 -16.950 104.680 -49.756 95.217-103.140 106.827 -33.217 112.507 -77.700 95.245-157.210 100.340 -55.345 94.129 59.957 119.807 -72.468 92.394 40.366 129.288 -76.189 91.777 43.034 144.885-175.723 90.652 47.429 123.958 -64.244 89.315 50.653 135.412 -68.634 90.398 41.072 127.977 -76.799 92.305 45.965 102.304 -69.682 93.958 135.270 129.922 -77.196 94.806 42.725 151.029-176.594 91.751 44.438 128.515 -38.904 92.932 64.579 150.505 -26.900 88.319 53.059 146.901-162.274 91.392 116.498 99.833 -79.532 92.637 0.000 128.525 -76.809 # 612 total E -1.49540E+02 rmsd from N 0.000 %NC 0.00 93.201 -70.619 128.502 -81.066 94.118 -47.895 118.748 -80.613 90.586 -47.703 103.298 -77.262 90.058 -49.850 128.552 -75.949 91.364 -37.203 139.674-128.448 93.438 -46.095 65.102 -66.171 90.776 -30.829 124.108 -16.934 107.308 -38.330 166.880 126.525 95.921 -42.739 127.584-118.570 94.117 117.060 83.007 -89.936 108.451-163.981 133.343 -88.103 97.858 67.005 125.756-148.318 121.462 125.762 104.952 -84.981 130.477 -97.252 171.842 -1.530 113.122-123.121 147.744-157.508 97.109 42.153 152.711 172.277 92.596 46.274 136.601 -84.174 90.667 50.404 130.258 -77.727 92.413 51.315 128.314 -54.636 93.770 37.127 144.296-159.861 91.699 45.953 0.000 0.000 90.746 63.504 103.703 -87.369 88.184 50.193 141.279 -79.924 91.049 39.055 115.915-122.984 91.177 53.701 111.125 -76.260 90.272 65.427 138.911 -98.412 88.955 43.621 134.952-133.848 91.303 44.181 152.948 -21.955 96.324 46.165 141.213-102.151 92.674 50.772 108.345-132.220 90.946 43.894 113.110 -78.888 94.157-120.006 108.677 -49.691 103.643-172.449 115.797 -74.429 91.163 -70.838 127.445 -75.746 89.115 -46.972 105.211 -82.450 88.666 -53.728 109.613 -60.481 88.247 -46.684 147.196 -40.410 89.871 -57.101 127.269 -75.489 87.540 -73.586 121.332 -42.166 88.691 112.565 132.127 -77.012 92.903 48.051 139.322 -86.847 89.597 46.507 124.224 -31.523 91.513 70.030 144.143 -35.014 87.629 54.889 138.156-142.307 92.058 104.711 100.120 -79.752 92.543 0.000 128.760 -76.532 # 613 total E -1.48654E+02 rmsd from N 0.000 %NC 0.00 93.253 -72.235 128.430 -80.131 93.997 -48.179 118.863 -80.699 90.602 -47.572 103.567 -77.099 90.186 -49.845 127.261 -75.050 90.441 -38.644 139.379-128.258 93.114 -44.678 60.885 -55.321 91.113 -37.159 131.520 23.009 98.398 -44.500 170.813 150.329 92.788 -45.715 123.011-119.375 94.025 119.832 79.433 -82.706 96.084 173.456 140.997 -81.333 96.391 94.511 127.276-151.988 97.312 140.628 102.777 -81.591 137.398-136.466 174.278 4.353 105.908-120.082 139.524-153.044 94.201 46.771 143.584 142.844 91.819 47.831 135.340 -84.569 90.998 47.679 130.605 -69.611 92.144 46.505 125.620 -34.398 93.385 42.190 148.351-152.471 92.652 41.888 0.000 0.000 91.268 54.031 112.321 -86.640 88.260 47.352 138.572 -76.414 89.833 41.815 120.780-124.632 91.231 49.574 109.837 -75.861 92.507 35.426 133.844 -88.488 97.068 51.782 131.337-119.332 96.357 -2.787 143.555-128.804 125.786 70.597 151.433 -18.804 138.894 161.935 109.352 -96.559 92.824 43.140 114.728 -77.459 92.047 51.961 131.786-103.427 89.553 58.772 120.364 -0.395 90.893 108.588 130.121 -77.305 94.899 -28.809 96.717 -83.058 90.368 -66.441 112.599 -49.262 84.822 -50.515 149.566 -28.979 89.891 -53.038 128.523 -76.347 87.585 -65.857 123.239 -49.868 89.086 112.945 132.085 -76.824 92.354 48.741 138.933 -90.183 88.891 49.744 126.017 -6.638 90.778 57.668 142.087 -31.725 88.504 39.392 137.671-133.532 95.489 76.544 103.544 -80.329 92.548 0.000 129.060 -76.671 # 614 total E -1.46885E+02 rmsd from N 0.000 %NC 0.00 93.264 -61.460 129.487 -85.112 95.205 -43.496 115.670 -84.357 89.854 -49.674 103.068 -77.768 89.427 -49.712 129.386 -75.954 92.971 -38.341 135.518-116.846 95.177 -41.767 61.605 -57.867 90.225 -39.864 134.534 46.737 98.023 -53.836 158.797-164.573 88.392 -56.679 133.804 -90.427 89.020 120.456 86.881 -76.171 92.389 127.059 144.323 -88.723 90.365 79.027 124.939-151.113 93.514 57.766 100.018 -85.898 92.833-156.113 139.217 -82.489 127.014 -15.188 147.412-169.941 94.485 53.082 136.409-103.358 94.979 36.628 112.716 -55.084 92.873 51.267 86.243 19.869 90.780 42.119 116.865-144.821 91.882 49.440 140.938-158.669 93.245 41.417 0.000 0.000 92.701 44.165 150.971 1.785 91.730 45.160 167.455-147.824 91.288 47.741 110.060-137.664 88.540 50.676 110.791 -71.847 91.559 42.858 141.740 -38.818 92.948 46.160 135.659-135.650 97.757 -34.163 107.069 -85.457 135.098 65.260 154.842 -12.494 133.948 146.107 109.068-100.221 123.258 105.106 155.704-104.269 98.866-111.794 129.534 -62.027 89.411 60.063 116.295 -73.040 91.902 44.259 128.389 -75.757 89.237 47.538 109.547 -81.777 89.585 47.618 134.659 -96.918 89.612 49.118 138.479-109.473 89.598 42.479 127.820 -76.572 89.439 50.117 112.537 -91.244 90.210 48.589 128.320 -76.255 89.935 44.159 136.282-133.436 90.012 50.321 129.268 -40.065 89.997 53.359 139.319 -55.867 90.032 45.284 146.768-144.954 94.467 86.687 146.936 -24.452 92.566 0.000 128.798 -76.684 # 615 total E -1.48681E+02 rmsd from N 0.000 %NC 0.00 92.968 152.216 138.562 -88.019 95.934 46.448 111.052 63.311 89.171 52.038 110.250 -71.336 90.282 42.867 148.599-115.213 95.851 86.962 138.980 138.994 83.607 -63.675 65.527 -79.713 98.413 -57.659 122.499 55.603 98.989 -44.914 164.059 142.268 99.770 -43.301 135.578-130.057 93.653-109.615 135.967 -33.408 104.816 53.973 123.612 169.380 91.064 59.359 95.895-130.120 92.970 78.825 97.660 -84.757 92.106 -84.390 136.940 -57.147 103.088-111.197 140.399-146.842 92.896 44.860 148.480-179.974 92.458 46.504 134.643 -86.245 90.307 50.555 148.620 -80.746 90.474 47.387 116.301 -50.739 91.893 39.792 107.559 -83.179 95.914 38.002 0.000 0.000 92.685 46.279 146.395-122.619 92.436 42.735 121.051-121.286 91.117 41.600 114.546-123.013 90.188 49.367 111.163 -77.828 91.578 48.060 137.818 -98.691 92.250 41.707 130.890-146.155 93.970 28.329 143.662-130.517 116.292 163.723 103.997 -82.925 93.779 54.913 137.367-165.637 92.231 40.878 113.511 -77.269 91.797 100.449 143.447 -83.961 91.916 51.554 108.595 -75.966 89.781 44.367 129.923 -76.756 90.070 46.329 106.998 -85.579 90.162 45.308 128.032 -86.853 89.409 50.157 137.650-107.303 89.220 54.618 128.504 -77.192 88.402 68.247 98.958 -70.012 90.623-174.945 129.102 -77.091 93.857 52.625 140.247-108.241 90.242 50.723 125.250 -23.063 91.208 57.543 148.548 -31.758 89.032 46.595 141.482-155.072 93.603 91.838 102.862 -80.007 92.543 0.000 128.765 -76.647 # 616 total E -1.49035E+02 rmsd from N 0.000 %NC 0.00 93.290 164.260 141.190-101.444 93.806 54.008 130.679 39.710 91.787 43.402 105.885 -81.401 91.515 50.846 131.476 -77.261 89.647 46.812 150.827-141.662 90.806 46.305 62.423 -66.354 89.593 45.180 126.058 -33.986 88.820 50.349 129.842-112.958 87.448 53.051 120.372-115.743 88.617 71.570 88.512 -96.894 86.546-166.483 144.551-102.349 94.355 67.884 98.725-132.805 91.523 45.751 98.717 -82.152 94.030 83.729 143.604 -42.933 96.914 56.168 136.740-144.289 115.235 -10.550 152.140-147.348 94.941 61.019 139.095 -89.974 91.234 58.399 156.460 164.849 91.049 45.388 149.470 127.246 90.606 42.403 108.485 -82.660 92.981 45.917 0.000 0.000 90.943 48.547 148.215-137.596 90.199 40.322 118.598-125.616 90.877 47.548 114.879-125.238 88.853 55.263 113.014 -77.620 89.120 50.001 137.882-103.891 90.510 40.795 133.953-151.006 96.458 -96.283 105.342 -83.205 121.353-159.287 155.073 -17.924 120.268 -62.263 113.882-115.573 95.142 -31.146 113.746 -77.319 97.400-121.000 125.187 -23.633 92.956 47.796 117.592 -78.248 92.786 54.369 130.929 -76.706 97.155 31.449 101.627 -78.686 95.018 45.274 139.777 -29.413 95.946 36.550 117.943 -89.899 109.502 94.941 154.067-102.083 90.214-151.124 109.504-143.031 92.828 49.335 131.852 -77.264 91.240 43.043 141.974-114.943 90.264 50.543 142.113 -64.730 90.049 57.856 139.042-125.164 87.594 37.409 126.856-166.683 95.866 78.148 102.186 -79.178 92.529 0.000 128.915 -76.703 # 617 total E -1.46698E+02 rmsd from N 0.000 %NC 0.00 93.122 -67.899 125.239 -71.308 93.957 -48.435 114.423 -78.293 91.200 -45.108 103.641 -78.263 90.916 -45.796 128.536 -75.699 94.398 -34.766 134.807-115.678 96.502 -38.782 63.539 -55.368 90.104 -46.970 140.921 22.392 93.974 -48.257 137.564-106.066 88.838 -58.011 130.956-102.915 91.364 110.808 92.714 -91.180 110.005 166.298 159.470-109.529 91.610 71.446 100.194-140.550 92.110 54.107 101.234 -80.752 93.207 129.681 128.883 -38.566 95.680 46.941 138.702-144.682 121.911 3.186 150.577-137.826 98.464 40.357 138.454 -84.251 103.367 27.910 164.768 179.714 96.008 46.102 132.730 117.090 92.971 39.741 107.092 -85.084 92.233 42.528 0.000 0.000 90.928 48.309 146.771-150.755 89.899 45.056 133.507-102.037 90.591 43.464 119.161-124.198 89.181 51.229 116.581 -79.770 89.789 50.217 137.593-114.398 90.969 50.214 117.742-134.905 93.384-107.273 103.361 -82.343 107.264-173.213 150.909 -18.071 129.846 -56.192 112.519-109.983 108.591 -21.638 113.029 -79.472 93.954 -47.338 110.657 -58.702 93.789 -38.810 111.752 -69.649 93.794 -44.505 127.319 -76.093 92.273 -36.632 104.533 -86.785 90.904 -50.784 103.742 -61.956 88.766 -52.311 148.600 -33.914 88.965 -55.310 128.610 -76.390 91.135-130.788 138.011 -77.484 89.246 57.591 132.761 -76.801 90.666 45.403 140.621-106.356 90.459 44.030 126.336 -27.461 90.282 61.157 148.952 -35.728 88.417 50.591 134.444-128.310 91.665 108.393 100.762 -79.890 92.693 0.000 128.526 -76.947 # 618 total E -1.48886E+02 rmsd from N 0.000 %NC 0.00 93.122 -63.517 125.237 -72.329 94.324 -49.264 111.047 -73.595 92.434 -42.835 104.480 -73.423 92.309 -40.403 131.062 -77.472 96.863 -37.767 141.481-120.044 93.755 -42.761 61.720 -67.736 92.048 -44.181 130.314 -69.437 100.893 -37.784 173.280 148.762 94.517 -38.647 139.705-117.729 97.924 130.042 117.981-134.965 131.816 -61.916 142.679-141.054 127.923 -67.917 109.873-107.484 104.313-108.395 107.806 -82.953 123.685 127.060 149.211-170.174 128.250 -82.458 145.678 179.977 96.514 44.832 143.730 129.654 90.750 46.035 135.066 -86.894 90.136 60.592 120.929 -79.094 88.649 48.849 128.984 -25.045 90.859 40.599 107.926 -81.977 89.927 50.413 0.000 0.000 88.386 55.545 105.198 -86.141 88.853 46.384 132.667 -77.861 91.375 41.526 123.464-120.657 90.657 49.484 111.850 -76.386 91.089 55.697 132.227 -94.953 91.381 65.195 136.522-148.820 92.892 -26.327 106.195 -86.553 123.289 138.971 149.114 -16.737 140.853 -85.508 106.988 -91.512 103.587 -30.974 111.670 -81.392 91.914 -50.477 102.903 -59.032 88.374 -46.909 111.485 -65.775 91.361 -49.306 125.301 -74.600 90.787 -33.933 106.473 -84.718 92.179 -49.587 99.345 -61.731 88.588 -56.943 152.519 -26.445 89.024 -51.691 131.149 -77.996 91.698-128.639 121.436-133.146 90.655 53.260 132.042 -77.078 91.001 46.270 139.523-100.528 90.285 46.535 118.122 -1.684 90.649 61.905 146.106 -29.740 87.763 41.531 133.406-135.935 96.242 128.470 104.874 -80.275 121.902 0.000 145.792 -83.898 # 619 total E -1.47243E+02 rmsd from N 0.000 %NC 0.00 93.260 -77.706 127.745 -78.564 93.287 -50.856 114.984 -72.295 91.996 -41.829 103.604 -75.489 92.859 -45.215 126.627 -74.209 99.825 -14.653 154.657-141.424 108.425 -33.300 58.686 -80.569 96.495 -27.753 125.421 -57.436 107.552 -25.177 138.709 -91.772 100.377 -41.178 150.342-166.473 96.038 -35.254 99.928 -89.401 101.271 115.259 139.417-134.641 122.937-148.105 116.334-120.936 107.782-179.284 108.309 -84.719 114.812 -67.960 136.156-129.218 94.109-119.280 111.246 -84.088 93.405 48.880 140.881 148.661 93.165 46.157 136.477 -85.737 90.831 46.846 124.591 -42.393 91.387 52.861 111.706 -34.103 89.902 45.735 109.860 -81.867 89.815 45.223 0.000 0.000 89.748 59.511 110.889 -78.101 87.001 46.318 140.593 -77.236 89.470 43.581 119.488-125.044 89.667 51.383 107.599 -75.282 89.142 49.556 136.126 -83.352 91.095 41.271 134.213-141.635 92.731 50.311 142.898-127.533 96.044 -81.298 110.596 -86.456 122.742-139.630 112.625-114.565 120.047 26.485 125.626 64.575 93.042 106.253 128.779 141.276 121.243 15.286 115.186 -78.854 93.426 -59.489 127.103 -75.345 93.528 -33.824 100.217 -78.272 91.061 -53.064 138.417 -53.541 88.534 -44.877 152.941-164.601 90.288 -51.877 128.302 -76.386 90.073 -74.021 119.826 -22.063 87.719 99.445 132.247 -77.300 91.331 51.517 142.356-111.192 88.157 48.937 106.417 -36.577 90.417 56.648 140.231 -39.292 89.009 43.599 136.731-126.065 94.565 82.433 103.324 -80.283 92.551 0.000 128.816 -76.771 # 620 total E -1.46433E+02 rmsd from N 0.000 %NC 0.00 93.286 179.920 134.973 -84.204 92.543 62.633 148.839 25.869 93.852 41.380 106.369 -82.672 92.414 51.737 131.760 -76.204 91.942 39.777 142.465-128.619 91.245 45.472 63.859 -77.154 91.477 43.551 116.762 -46.034 91.120 43.830 141.303 -93.841 90.273 43.100 131.923-125.345 91.399 51.070 80.546 -97.436 91.449 163.378 130.418 -73.443 92.180 101.377 131.590-158.730 92.385 111.699 106.093 -80.288 91.120 -51.893 142.258-114.378 95.915-124.372 133.043-153.091 93.543 39.811 138.953 132.379 92.101 49.841 136.588 -90.164 92.222 43.189 146.493-109.676 92.925 45.368 130.507 3.889 93.123 35.442 107.122 -82.882 94.556 44.061 0.000 0.000 100.373 21.967 101.357 -85.226 101.095 40.811 173.943 164.573 96.749 33.192 113.065-143.105 92.833 49.995 115.081 -75.928 90.098 57.108 138.313-101.620 90.532 42.604 141.685 -93.153 93.269 39.094 152.800 -21.892 99.766 1.555 113.492 -86.975 139.465-164.279 100.826 -83.250 94.793 51.278 131.769 41.882 92.702 48.168 104.338 -6.648 89.532 48.079 124.386 -3.145 91.025 49.741 130.421 -76.226 91.054 38.067 136.704-142.227 92.529 42.170 119.057 -33.625 91.454 48.165 133.629 -41.726 92.285 38.807 127.740 -76.396 94.794 32.479 104.223 -80.121 109.893 22.132 128.454 -92.221 98.360 35.720 142.082-129.516 97.015 40.942 110.657 36.519 93.346 43.857 118.278-129.595 95.208 33.477 131.160-137.549 114.984 -24.847 107.352 -77.866 92.424 0.000 128.964 -76.121 # 621 total E -1.47630E+02 rmsd from N 0.000 %NC 0.00 93.088 -63.870 126.541 -75.564 94.163 -49.215 116.236 -77.453 91.050 -45.838 104.023 -78.621 90.567 -46.713 128.150 -75.610 91.064 -43.145 139.243-120.549 93.613 -38.534 79.469 -81.030 94.899 -42.790 134.106 22.602 98.684 -31.887 171.554 165.914 98.671 -57.723 131.677-113.055 94.410-150.207 85.091 -80.472 109.738 70.741 137.889-153.333 97.735 47.199 89.752-114.901 95.139 63.438 111.122 -78.392 109.367-122.235 135.234 -86.071 103.412-109.779 138.242-150.566 93.667 50.066 144.214 124.863 92.974 44.611 133.735 -85.808 91.461 46.699 124.763 -48.973 90.699 51.538 112.331 -17.970 88.967 47.287 107.889 -82.652 90.864 45.809 0.000 0.000 91.724 42.657 113.883 -81.824 93.612 44.076 176.431-168.481 93.063 39.508 107.469-137.704 91.934 46.893 114.714 -79.515 91.337 50.868 142.378-111.706 90.941 52.685 147.244-109.320 91.494 25.120 108.021 -86.671 110.762 17.051 154.750 -17.896 135.752-120.825 109.542-100.213 128.680 36.815 120.347 -81.917 92.323 -66.095 103.334 -39.901 88.352 -51.216 124.532 -44.547 91.514 -44.815 125.730 -74.657 91.634 -36.588 100.432 -80.937 90.862 -46.895 125.333 -18.104 91.682 -46.398 156.136 -21.083 89.881 -49.571 129.022 -76.991 88.630 -55.220 133.787 16.294 92.001 115.298 130.879 -77.062 94.514 41.338 140.546-109.969 89.670 57.179 133.209 11.326 90.320 64.145 142.273 -30.453 87.942 34.772 137.555-137.833 97.018 84.653 107.816 -81.683 92.445 0.000 129.157 -76.166 # 622 total E -1.46983E+02 rmsd from N 0.000 %NC 0.00 93.088 -68.404 123.384 -65.978 93.973 -51.372 115.342 -74.748 91.703 -44.790 104.084 -77.947 90.864 -45.766 129.270 -76.593 90.114 -46.701 130.359-112.590 88.953 -48.667 67.359 -54.500 90.556 -40.048 124.322 34.320 98.317 -36.987 137.478 -80.740 92.428 -47.716 139.537-121.523 92.163 -69.103 85.134 -81.814 99.011-151.844 158.966-160.547 94.658 -55.100 101.129-125.979 101.124 158.993 107.140 -84.153 138.913-119.592 173.789-164.878 104.156-124.931 151.260 -37.184 95.022 45.854 137.654 156.347 92.070 47.096 135.975 -82.817 90.149 51.617 129.790 -54.685 90.910 52.920 115.611 -39.652 91.367 41.180 106.950 -82.332 89.289 49.223 0.000 0.000 91.014 61.205 100.536 -82.985 86.905 44.698 148.960 -74.917 91.174 41.441 114.051-125.450 90.265 52.846 108.952 -75.210 90.525 56.439 141.619 -91.763 89.736 48.300 131.532-147.977 90.943 35.086 142.025-126.743 103.500-109.992 106.340 -81.362 113.922-112.450 124.697-137.618 101.291 43.419 122.238 16.626 93.395 50.204 134.736-163.748 92.523 42.598 115.074 -73.515 93.610-130.989 127.176 -74.426 86.833 -48.623 102.738 -78.455 89.935 -53.858 123.155 -66.289 88.156 -46.832 141.022 -89.744 90.141 -51.845 127.117 -75.953 88.919 -58.247 123.982 -31.400 90.380 117.610 131.033 -76.931 93.698 50.586 140.595-105.651 91.036 44.869 127.779 -16.071 91.540 56.475 148.445 -27.687 89.287 43.268 135.143-135.540 94.928 81.288 103.477 -80.355 92.495 0.000 128.901 -76.750 # 623 total E -1.47510E+02 rmsd from N 0.000 %NC 0.00 92.845 141.467 137.087 -84.380 94.583 50.310 123.052 65.485 90.300 48.037 106.705 -79.757 90.816 47.552 130.202 -77.995 94.444 59.006 152.612 140.923 95.660 21.105 61.888 -78.828 99.098 34.252 138.456 -46.386 146.897 -79.270 133.968 -94.922 118.464 -63.212 128.304 -87.507 107.494-161.724 89.784 -68.314 110.570 70.038 163.026-132.988 95.793 29.738 93.554-120.069 98.376 83.566 109.337 -81.603 95.473 -77.022 147.020 -36.501 101.548-130.523 142.410-137.989 92.834 49.773 144.527 156.894 93.423 47.178 134.984 -83.433 92.473 41.913 127.627 -35.181 91.643 48.896 140.444 99.370 90.543 46.138 136.310-148.458 90.805 45.345 0.000 0.000 89.526 50.508 149.999-156.894 89.781 47.252 129.544 -98.621 90.437 42.539 122.041-126.311 89.891 49.258 115.530 -77.850 90.631 47.392 133.004-103.356 92.710 53.829 130.966-146.143 93.550 -89.936 140.842-119.578 114.546 162.116 150.900 -18.145 130.096-175.204 115.410-116.118 98.444 51.494 116.001 -77.523 93.605 43.181 110.904 -29.959 90.904 50.210 112.673 -70.653 90.235 47.657 129.617 -77.551 89.650 45.945 102.808 -84.419 89.882 46.407 115.956 -67.890 89.553 57.292 133.104 -60.667 88.868 57.148 128.552 -76.715 88.841-177.145 79.085 -77.156 92.658 84.064 132.242 -77.326 91.159 43.964 141.637-108.899 91.153 45.292 129.100 -46.556 91.979 57.264 151.632-125.294 88.408 45.693 129.166-172.069 92.949 100.668 102.096 -79.962 92.622 0.000 128.606 -76.747 # 624 total E -1.47976E+02 rmsd from N 0.000 %NC 0.00 93.184 -77.111 125.124 -70.822 93.564 -53.700 109.706 -72.723 93.581 -38.120 105.042 -75.347 94.259 -40.239 128.533 -76.150 101.054 -20.395 145.245-131.694 104.413 -34.048 52.396 -71.095 94.974 -34.475 132.413 -55.836 103.563 -34.793 145.315-112.481 94.264 -60.326 143.866 -39.823 90.114 58.711 133.009-113.018 141.790-177.514 141.750-127.760 93.546 70.690 93.980-117.162 97.685 96.922 100.922 -79.774 92.450 -69.105 144.228 -46.718 94.652-125.647 112.703 -82.567 90.918 50.181 137.892 117.269 92.668 45.247 137.621 -85.942 91.467 43.409 138.618 -18.704 90.637 51.676 141.308 -24.180 88.228 50.469 143.683-156.830 89.784 44.089 0.000 0.000 89.885 47.507 115.185 -77.811 90.931 46.493 139.144 -75.618 91.185 42.143 121.873-124.068 90.074 47.436 109.592 -76.635 91.401 49.939 130.038 -85.949 92.106 47.315 133.114-110.665 92.065 25.429 153.493 -21.531 112.279 -16.464 113.260 -85.888 143.747-162.642 99.585 -77.184 90.577 57.720 119.591 -75.837 90.906 57.517 113.872 -87.503 86.522 69.213 121.120 -5.119 89.532 50.548 126.761 -73.561 89.432 39.505 103.442 -85.122 91.356 48.410 119.199 -9.308 89.467 50.511 137.943 -48.077 90.245 43.255 129.690 -77.312 90.882 115.569 115.238-115.968 91.834 -44.115 129.597 -78.116 92.880 -49.239 144.699-127.733 90.848 -42.464 120.151 -2.829 93.524 -51.259 156.272 -26.495 91.571 -35.024 140.023-143.845 99.361 107.866 103.184 -78.678 92.432 0.000 129.260 -76.034 # 625 total E -1.47818E+02 rmsd from N 0.000 %NC 0.00 93.230 -72.496 127.918 -78.612 93.921 -48.754 119.423 -80.616 90.611 -46.973 103.610 -77.550 89.972 -52.814 126.647 -75.510 88.373 -39.738 136.368-124.006 90.700 -48.364 65.035 -64.867 91.843 -30.009 127.415 -20.968 107.116 -33.296 173.679 157.100 96.167 -43.478 130.352-113.185 94.432 121.943 83.071 -80.856 105.913-170.503 135.875 -81.993 97.289 62.770 125.155-148.004 115.446 139.487 102.941 -84.528 120.823-100.354 163.132 -15.704 106.763-118.387 145.831-150.015 94.123 45.356 144.571 133.494 91.616 46.247 136.063 -87.101 90.499 50.679 143.808 -82.008 90.428 48.001 139.585 -29.744 90.588 43.119 143.471-176.613 89.740 47.264 0.000 0.000 89.124 55.094 143.491-129.220 89.980 42.796 163.452-139.339 90.479 42.634 109.943-137.848 90.107 51.737 115.456 -81.296 89.950 51.994 146.661-130.126 89.727 48.338 119.085-178.171 93.105-113.990 104.212 -83.421 96.637-166.001 148.264-122.679 100.471 -43.742 92.993-105.034 97.486 -43.214 112.220 -77.417 101.561 -19.509 119.175 -55.841 103.706 -41.846 111.067 -76.972 91.571 -44.900 128.635 -77.425 88.258 -48.787 100.592 -81.195 88.806 -47.597 142.982 -19.821 95.369 -30.953 175.606-165.625 96.705 -48.731 129.304 -77.356 94.593 -63.370 125.570 -46.672 91.181 109.891 129.401 -75.956 93.934 38.529 140.347 -96.181 91.779 48.706 133.739 -19.842 92.031 48.722 146.717 -46.240 91.331 47.294 143.005-138.990 94.238 67.866 102.665 -80.018 92.534 0.000 129.057 -76.648 # 626 total E -1.48246E+02 rmsd from N 0.000 %NC 0.00 93.189 -71.442 128.151 -79.712 94.233 -48.675 118.764 -76.751 91.266 -47.257 103.407 -77.104 89.944 -47.752 129.745 -76.598 91.612 -42.086 144.355-136.131 92.424 -45.491 64.772 -79.678 90.981 -56.917 132.975 45.162 120.424 -92.291 169.612-132.947 90.809 41.274 119.700-109.124 108.206 169.313 90.543 -90.844 104.469 51.829 153.451-166.478 91.508 46.349 93.983-120.863 91.599 49.337 106.666 -84.221 92.566 41.607 142.599 -40.615 95.121 40.623 135.383-120.923 98.426 6.075 122.936-114.033 128.028-144.469 140.754 -48.178 120.849 -11.190 143.223 30.760 141.647 57.232 161.901-141.618 101.538 31.774 107.450 -82.792 94.734 46.768 0.000 0.000 92.006 49.437 108.451 -84.762 89.656 48.114 150.583 -80.982 91.212 39.889 116.898-129.958 90.599 49.900 112.142 -77.240 89.844 63.285 142.018-104.641 89.549 44.297 144.363-139.730 92.212 41.327 142.795-128.556 100.299 -12.217 117.121 -89.364 136.916-154.126 105.851 -92.594 95.458 52.429 114.489 -76.895 91.766 54.165 121.698 -20.384 88.789 51.030 120.540 -14.096 90.784 49.078 129.893 -76.191 90.674 41.152 101.536 -83.461 91.516 41.994 122.429 -56.677 92.723 61.834 135.803 -44.705 88.306 57.431 130.857 -78.492 88.432 178.606 72.922 -87.186 91.354 64.718 166.014 -94.175 90.061 46.348 140.651 -98.518 90.164 46.833 122.085 -26.176 91.346 58.937 147.059 -33.745 87.960 42.739 138.298-143.707 94.578 82.287 103.389 -79.839 92.447 0.000 129.162 -76.275 # 627 total E -1.47223E+02 rmsd from N 0.000 %NC 0.00 93.084 155.195 140.014 -94.548 92.998 55.171 138.691 49.699 91.700 45.101 106.708 -82.422 91.557 49.821 131.032 -76.592 93.923 40.259 152.861-152.636 92.666 41.463 57.882 -73.109 90.482 46.478 115.925 -32.979 90.536 51.760 144.025 -85.241 87.132 41.511 141.558-134.783 92.995 40.405 69.099 -97.332 92.355 85.312 138.743 -55.030 94.893 138.820 101.303-111.209 83.228-130.761 102.291 -88.679 138.635 159.798 156.822 164.068 102.002-105.386 140.554-150.196 92.506 54.969 138.540 128.709 92.035 45.405 134.327 -85.558 90.847 48.588 126.579 -60.092 90.437 48.990 139.868 -25.811 91.286 45.578 108.612 -82.797 91.116 42.525 0.000 0.000 90.545 52.892 108.162 -87.438 87.989 51.840 143.700 -83.508 89.629 46.513 120.594-129.969 89.775 47.101 109.017 -75.218 91.441 73.351 132.444 -86.285 90.608 70.803 141.731-140.252 91.505 -1.930 107.261 -87.030 128.686 72.866 155.580 -8.817 134.311 -81.710 116.328-109.760 122.448 -11.211 115.928 -81.634 91.268 -54.106 109.682 -48.881 89.844 -48.281 111.780 -69.539 90.501 -49.683 124.859 -74.561 87.706 -43.160 101.440 -81.582 90.508 -46.226 126.242 -13.530 91.710 -47.845 146.376 -28.746 89.231 -51.849 130.428 -77.556 94.187-139.404 134.109 25.027 90.186 48.958 131.769 -77.241 90.457 49.668 141.654-106.603 89.293 50.429 127.892 -37.747 89.403 54.426 133.059 -68.078 89.866 43.771 140.263-127.791 95.007 78.345 104.011 -80.266 92.522 0.000 128.862 -76.736 # 628 total E -1.51076E+02 rmsd from N 0.000 %NC 0.00 93.293 -77.035 129.877 -85.256 94.067 -49.065 119.038 -77.152 91.525 -44.883 102.850 -77.636 91.347 -48.716 128.081 -76.302 95.848 -23.898 145.276-146.373 103.209 -35.247 53.858 -65.059 94.467 -33.684 133.351 28.145 100.467 -44.718 142.957 -93.461 91.783 -50.294 137.597-102.615 90.889 109.949 114.805-123.034 117.283 146.134 153.442-158.276 89.864 74.481 97.514-147.008 93.293 118.882 97.734 -84.243 92.705 -55.937 135.366 -95.876 96.019-122.850 107.921 -87.089 91.880 45.557 141.252 139.741 91.936 48.230 134.766 -86.379 90.646 47.861 119.029 -5.706 89.813 49.748 120.176 -32.499 89.033 45.620 109.898 -82.395 91.071 45.729 0.000 0.000 90.552 44.003 138.903 -32.782 89.729 52.719 148.446 -91.257 88.467 51.624 121.087-138.516 87.161 48.980 109.801 -74.791 90.644 49.852 142.898 -96.317 91.214 46.639 131.612-149.262 93.736 -95.871 141.858-122.970 120.147-179.972 161.616-155.134 126.584 -54.941 112.048-110.603 107.392 -28.373 112.524 -79.511 95.313 -42.768 114.018 -55.444 95.203 -39.077 112.946 -73.167 92.409 -48.549 129.733 -77.177 91.224 -36.784 100.579 -87.226 93.634-103.023 121.718 -9.214 92.862 57.372 150.364 -29.232 92.020 54.299 130.528 -77.250 90.228 119.468 122.570-142.314 90.505 -48.663 131.340 -78.824 92.115 -45.966 144.406-128.309 87.281 -52.513 118.627 -0.530 90.313 -58.911 156.271 -22.294 88.942 -47.830 134.068-127.871 94.907 82.691 102.039 -79.188 92.477 0.000 129.099 -76.346 # 629 total E -1.48441E+02 rmsd from N 0.000 %NC 0.00 93.165 162.345 140.162 -96.820 92.782 54.757 142.865 37.012 91.557 46.115 106.308 -82.902 91.984 48.678 130.299 -76.525 94.317 40.462 147.679-127.304 94.224 40.661 57.710 -75.960 91.655 44.098 119.283 -37.216 89.242 52.226 137.740 -91.584 88.861 44.421 123.273-111.687 90.933 40.542 87.596 -96.901 94.086 42.471 134.901 -85.741 109.370-143.677 95.087 -91.122 103.244-117.463 105.595 -82.073 147.342 132.306 176.056 179.664 122.831 -76.701 146.114-166.900 95.134 49.401 153.099-128.384 91.087 47.045 133.831 -80.046 89.970 62.108 142.163 12.206 87.099 50.321 131.695-102.364 87.248 51.572 135.876-176.217 87.983 54.197 0.000 0.000 87.581 49.190 110.960 -76.492 88.346 51.036 139.812 -72.503 89.436 43.479 127.478-134.926 92.112 58.116 111.505 -76.173 94.392 -58.128 139.225 -99.324 121.877 -67.713 127.140-129.924 96.140 -24.624 144.677-130.041 110.609-160.817 152.799 -13.728 117.758-129.584 111.711-115.999 95.311 41.613 114.265 -77.039 94.361 43.907 101.596 -21.684 94.625 41.522 132.394 -6.237 91.640 45.768 129.760 -77.397 89.546 47.235 101.500 -84.024 90.883 45.597 132.839 -39.950 91.196 48.173 137.200 -79.407 91.877 33.078 129.811-101.181 98.565 128.923 104.410 -81.791 134.209-141.133 157.672 -89.198 96.028 -33.501 141.720-122.681 92.731 -51.969 127.026 -25.914 92.955 -46.836 150.762 -30.369 92.714 -42.552 142.489-137.948 96.692 113.938 103.444 -78.976 92.517 0.000 128.827 -76.253 # 630 total E -1.51996E+02 rmsd from N 0.000 %NC 0.00 93.158 -64.740 128.732 -81.988 94.366 -49.231 115.915 -78.232 91.563 -44.644 103.285 -77.006 90.815 -47.510 129.146 -76.138 91.763 -38.167 139.265-131.517 94.138 -44.006 62.583 -69.031 92.234 -31.733 122.881 -30.517 105.292 -35.878 169.324 160.952 93.955 -45.666 135.342-114.683 93.782 120.635 91.162 -90.123 123.429-179.170 140.523 -96.771 93.818 58.259 97.605-117.010 121.359 135.524 102.170 -82.768 107.222 -64.421 140.853 -82.049 97.392-116.540 150.249 -42.519 92.110 48.735 144.826-110.619 92.400 47.805 137.029 -76.809 91.255 46.571 146.207 -68.370 90.469 46.712 135.485 -34.543 90.630 46.973 109.247 -83.048 91.336 43.335 0.000 0.000 89.673 49.849 133.348-105.597 89.031 47.145 133.946-107.587 89.680 42.942 119.680-130.170 89.547 47.921 114.005 -77.483 90.160 47.281 135.849-104.409 92.162 51.919 131.004-133.155 92.250-100.924 103.007 -82.733 109.475 170.197 150.713 -17.232 100.473-170.058 93.867-100.109 94.526 48.159 115.411 -77.309 92.599 45.437 109.869 -21.795 92.067 44.718 143.370 -44.801 91.768 43.889 129.259 -76.352 91.102 44.827 101.978 -84.651 90.753 49.267 136.933 -35.756 90.102 46.702 133.855 -93.878 90.572 41.773 129.027 -77.542 90.748 65.302 110.542-106.238 92.657 179.395 127.466 -76.374 94.582 39.486 144.674-149.155 99.831-139.500 117.188 19.316 130.319 109.156 160.722 -4.331 94.353 73.774 141.439 176.686 96.508 34.246 98.854 -77.921 92.488 0.000 129.415 -76.420 # 631 total E -1.46884E+02 rmsd from N 0.000 %NC 0.00 92.791 157.109 131.263 -67.281 93.438 64.556 143.022 63.867 94.269 41.381 106.413 -81.966 92.434 48.139 131.960 -77.833 93.766 44.465 154.158-166.912 93.192 41.113 61.749 -78.403 94.423 40.093 124.953 -46.187 99.716 32.119 130.636-100.622 94.651 47.853 148.769 177.978 91.355 79.256 88.671-106.935 91.171 -74.766 130.777-105.978 103.644 -65.122 89.986 -87.352 91.048 -64.363 151.220 -29.048 120.383-157.972 154.507-171.455 111.440-109.100 150.284-156.845 95.326 44.156 147.884 148.419 92.609 45.484 135.826 -84.293 90.578 48.697 119.211 -66.388 92.305 53.323 133.985 -41.993 91.906 39.957 143.181-158.923 91.468 44.642 0.000 0.000 90.835 61.673 104.601 -83.976 88.467 49.555 144.107 -82.309 90.735 39.307 116.012-125.831 91.363 52.157 109.884 -75.784 90.707 61.421 141.554 -93.926 89.816 43.671 137.676-135.147 92.709 37.197 143.161-130.366 108.929 -14.611 115.591 -91.342 135.433-166.484 105.497 -92.597 122.314 17.556 151.455-136.542 94.857 54.794 119.085 80.802 97.957 96.868 108.967 -71.204 92.101 -74.056 128.513 -74.405 94.552 -31.653 103.674 -88.698 91.477 -50.255 100.227 -60.989 89.523 -43.129 151.688 -25.237 92.381 -63.811 127.370 -76.153 81.395 119.160 146.773-150.058 93.679 42.697 128.877 -76.802 93.120 40.835 144.098-148.087 92.024 46.591 134.308 -58.212 91.185 50.512 124.798-115.584 90.913 43.630 131.367-140.470 95.755 67.761 103.649 -81.007 92.515 0.000 129.100 -76.604 # 632 total E -1.48099E+02 rmsd from N 0.000 %NC 0.00 92.516 129.702 125.086 -51.529 94.244 51.603 144.205 -96.738 94.416 47.346 107.063 -78.869 90.402 123.223 131.154 -77.495 88.081 -51.236 113.884-115.607 91.790 -50.646 72.481 -61.998 94.000 -27.989 132.893 13.335 103.928 -35.906 139.421 -82.119 94.284 -46.351 141.252-118.813 92.702 -72.621 92.607 -81.549 94.459-160.249 166.711-152.015 96.717 -57.436 96.694-119.553 101.252 160.759 101.205 -82.442 115.930-117.278 170.300-144.459 97.511-117.107 150.933 -37.639 92.562 46.684 138.035 144.555 91.995 46.617 136.780 -83.933 90.198 49.692 124.900 -13.205 89.677 49.994 121.975 -32.094 88.874 45.509 148.612-155.786 90.443 45.543 0.000 0.000 90.657 44.139 135.924 -41.155 90.003 51.052 145.881 -90.652 88.754 52.799 119.873-134.991 87.209 51.749 110.313 -76.424 90.484 46.693 139.653 -98.369 92.441 56.393 139.350 -85.256 92.793 -92.211 140.239-117.123 111.663 163.335 150.316 -18.206 130.525-172.331 114.247-113.689 96.436 53.297 115.459 -77.024 94.119 41.183 111.283 -32.563 91.670 48.863 120.241 -71.302 90.899 44.202 128.880 -77.007 89.078 49.608 101.652 -83.944 89.779 49.823 118.006 -62.582 90.009 51.409 130.092 -65.293 91.064 60.891 128.960 -76.770 93.857-168.693 86.518 -69.820 92.024 62.923 131.050 -76.631 91.208 43.728 140.853-107.206 88.678 56.666 148.361 -8.454 88.914 70.237 145.717 -46.526 86.495 39.962 139.125-159.880 95.959 93.732 102.620 -78.933 92.533 0.000 128.931 -76.133 # 633 total E -1.46746E+02 rmsd from N 0.000 %NC 0.00 92.478 132.754 122.981 -45.802 93.271 66.952 136.689 59.302 93.576 45.931 107.401 -76.655 93.153 39.047 131.429 -77.716 95.843 46.899 154.659-167.401 94.973 40.285 50.738 -67.788 91.661 47.993 147.898 -6.751 90.524 47.097 129.559-122.264 88.740 51.715 139.266 176.070 87.432 54.533 76.656-108.406 89.656 176.707 144.208-100.365 92.116 82.610 105.076-153.743 90.397 51.522 101.228 -85.171 93.985 127.320 127.801 -65.521 102.123 34.469 144.015-158.720 93.647 42.560 133.437 -99.671 92.148 47.989 129.750 -38.273 93.283 45.809 104.077 -26.747 95.722 26.213 157.388 163.807 106.235 25.309 107.353 -83.189 98.642 42.239 0.000 0.000 91.584 48.157 146.639-137.799 92.177 39.788 110.838-117.397 90.700 43.536 116.601-115.463 89.878 53.681 112.183 -82.541 89.189 54.725 142.900-115.852 88.787 40.450 121.465-153.128 95.742-110.452 105.008 -83.089 104.532-167.855 153.119-132.645 100.257 -62.927 94.142 -93.197 93.684 -43.128 112.384 -76.494 93.286 -40.346 117.257 -20.473 93.227 -45.897 113.383 -72.467 91.654 -44.004 127.497 -76.418 89.369 -43.573 102.658 -80.282 91.117 -44.449 145.783 -23.443 91.925 -45.806 131.224 -70.569 92.467 -37.940 129.122 -76.501 93.230 -42.739 131.463 23.803 92.616 -49.321 131.549 -78.366 92.669 -57.847 138.827-100.446 90.183 119.222 133.790 -56.794 107.323-162.932 143.826-120.115 94.493 57.728 139.779-144.937 97.684 72.677 99.656 -79.417 92.326 0.000 129.453 -76.101 # 634 total E -1.50493E+02 rmsd from N 0.000 %NC 0.00 92.576 84.347 134.215 -82.197 93.850 56.597 135.137 49.440 93.527 42.029 106.005 -81.297 91.954 47.127 131.359 -77.662 92.464 46.391 148.861-143.605 92.630 45.470 58.199 -68.350 89.055 46.765 132.546 -29.664 89.815 52.316 120.722-119.623 86.214 47.214 131.886-137.805 89.465 51.979 77.761-101.063 89.457 108.581 140.265 -81.963 95.453 83.932 124.662-145.398 91.771 114.468 106.174 -87.666 116.935-119.092 136.112-109.833 128.426 55.011 147.536-165.574 115.083 -18.541 154.666-124.705 96.904-127.724 122.332 -26.933 93.184 44.666 157.823 -6.513 94.197 47.856 129.272-153.252 91.272 46.864 139.978 173.347 89.856 51.960 0.000 0.000 88.749 48.160 113.041 -78.935 89.774 44.515 147.947 -80.149 91.920 42.501 119.115-128.304 89.698 48.670 112.491 -77.012 90.577 65.665 136.569-101.171 89.842 42.623 141.402-141.326 92.826 40.361 152.803 -22.068 100.257 -6.981 114.534 -87.980 138.476-159.113 102.322 -85.834 94.407 54.864 126.353 30.419 92.067 50.003 100.688 -15.253 90.072 47.680 130.658 -8.081 92.088 46.556 130.284 -76.356 91.089 39.799 139.976-149.281 91.274 44.457 116.379 -32.957 92.141 53.076 133.614 -47.427 88.896 39.055 131.187 -78.411 91.943 108.970 102.645-100.693 92.098 -42.085 131.313 -79.291 94.661 -59.338 145.003-139.757 91.443 -56.900 123.862 0.855 92.991 113.300 151.373 -33.409 97.447 50.449 141.256-160.431 97.163 7.661 101.779 -76.354 92.448 0.000 129.768 -76.223 # 635 total E -1.47337E+02 rmsd from N 0.000 %NC 0.00 92.479 130.347 125.843 -52.028 93.611 53.203 147.557 30.415 94.179 40.884 107.325 -82.746 92.537 49.743 127.945 -74.250 92.778 43.589 141.941 -20.964 90.984 45.193 66.179 -77.063 89.635 49.747 120.956 -53.267 90.533 40.703 128.908-102.457 91.321 65.321 149.493 155.722 85.011 -99.939 74.552-108.826 110.419 140.217 137.363 169.705 106.576 -15.802 91.378-100.220 100.628 112.001 109.823 -79.863 118.886 -19.271 150.101-121.182 93.076 68.159 135.455-165.730 94.136 43.233 102.448-122.302 105.154 -64.787 148.204 -62.590 124.300-123.500 136.231 -67.376 97.078 40.334 144.366 -9.543 94.997 44.493 110.485 -82.553 90.856 45.679 0.000 0.000 91.050 53.513 106.700 -84.554 88.725 47.216 148.753 -77.955 91.317 39.776 117.906-128.585 90.473 51.059 111.295 -76.680 89.962 64.971 142.371-102.189 89.029 42.939 143.023-145.521 92.604 41.460 142.840-128.190 100.921 -13.300 120.996 -86.710 136.591-155.876 109.084 -97.011 94.607 55.058 114.080 -76.793 91.744 51.268 106.241 -7.430 89.221 48.436 133.786 -16.031 91.689 46.120 128.818 -75.638 89.950 41.724 103.028 -84.784 91.053 47.445 117.574 -29.842 90.667 51.360 134.062 -51.603 89.972 37.315 129.867 -77.860 95.198-162.363 106.486 -99.464 113.297 103.156 171.570 -87.105 93.144 46.234 139.345-102.601 91.124 49.685 125.463 -1.106 91.219 58.570 147.792 -26.653 88.406 39.151 136.662-140.157 95.832 78.172 104.124 -80.163 92.486 0.000 129.062 -76.280 # 636 total E -1.49640E+02 rmsd from N 0.000 %NC 0.00 93.048 149.568 140.928 -96.259 93.276 52.427 160.101 32.031 91.110 50.257 107.019 -80.461 90.104 50.704 129.399 -75.544 90.864 44.562 144.844-125.705 91.492 41.680 134.811 173.514 92.014 41.679 110.529 -72.971 95.288 42.090 132.095 -83.246 93.499 38.065 146.336-113.091 92.574 46.220 122.259-144.926 93.854 53.192 112.086-120.565 102.449-146.057 95.746 -93.969 101.144-171.852 104.656 -82.541 101.701 -47.276 143.668-111.169 96.964-115.003 136.561-148.939 92.217 46.753 143.582-104.844 92.159 48.609 134.727 -76.539 90.773 47.630 138.013 -59.446 90.594 47.942 137.403 -36.935 89.167 46.158 109.949 -82.593 90.633 45.421 0.000 0.000 89.225 49.597 137.938-101.717 90.598 41.394 125.158-101.950 90.280 44.383 119.955-119.957 90.404 46.352 108.683 -81.333 90.934 51.553 131.766 -94.960 91.978 43.139 131.214-133.281 95.459-122.427 110.653 -87.648 96.283 170.514 147.787-125.192 105.483 -19.095 92.929-105.800 104.827 -59.449 115.995 -79.088 113.825-113.666 134.909 -24.479 90.606 59.668 114.246 -72.288 91.335 48.560 129.630 -76.562 88.950 44.590 109.941 -87.407 89.199 49.534 131.275 -98.620 88.486 61.743 144.430-138.990 86.718 53.036 128.143 -76.646 88.041 60.112 90.757 -80.713 91.301-163.086 129.464 -76.951 94.180 61.272 141.798-120.719 90.907 60.438 133.866 -77.666 91.321 63.400 136.737 179.633 87.382 43.669 124.893-170.312 96.092 76.387 100.711 -79.419 92.438 0.000 129.245 -76.112 # 637 total E -1.47735E+02 rmsd from N 0.000 %NC 0.00 92.593 40.429 133.911 -94.439 114.824 -41.800 158.069-101.013 97.092 -45.391 146.116-139.964 98.087-123.994 128.174 -75.423 91.015 50.118 137.072-155.081 91.200 47.319 126.244-161.670 90.677 44.191 112.304 -48.858 91.426 48.323 135.127 -70.406 90.185 40.782 139.748-109.104 92.911 43.642 84.675-101.843 94.029 39.727 133.511 -86.404 109.066-144.013 93.134 -88.828 105.087-160.236 104.675 -82.521 118.946 -63.005 161.581-135.630 99.218-117.988 135.929-152.247 93.859 44.597 147.778 140.307 92.604 46.485 134.294 -84.590 91.007 46.014 134.116 -63.896 92.982 49.624 130.679 -37.715 91.825 39.820 107.553 -82.455 90.460 47.485 0.000 0.000 90.833 54.338 105.348 -85.050 88.131 45.330 144.849 -78.418 90.332 42.511 118.172-126.909 89.940 52.509 113.931 -77.656 89.544 49.832 136.764-107.157 91.517 45.049 132.665-145.755 94.815 -95.134 142.501-123.942 118.028 177.961 151.471 -15.139 138.089-173.256 106.604 -94.190 94.659 47.701 115.126 -77.132 92.712 46.885 102.674 -9.405 91.419 46.505 126.092 -4.941 89.776 47.377 130.941 -77.792 89.212 48.014 103.627 -84.491 88.485 49.462 119.045 -27.952 89.375 46.910 133.797 -55.829 90.490 43.219 128.431 -76.482 89.404 50.142 117.440 -60.305 90.383 47.236 127.912 -75.933 90.860 43.860 142.585-137.952 90.925 45.092 130.147 -47.202 91.193 52.309 133.972-106.699 90.345 42.908 132.097-135.428 95.779 70.748 104.385 -80.756 92.516 0.000 129.020 -76.654 # 638 total E -1.48857E+02 rmsd from N 0.000 %NC 0.00 93.226 -73.282 128.176 -79.840 93.980 -48.294 118.431 -80.159 90.599 -47.579 103.367 -77.268 89.999 -49.970 128.661 -76.055 91.550 -36.980 138.490-126.926 92.685 -47.045 65.428 -67.007 90.610 -31.297 126.308 -15.479 109.188 -35.758 167.105 129.753 95.153 -42.534 129.442-116.070 95.044 118.269 82.523 -84.888 112.297-164.521 131.423 -84.478 97.572 65.450 126.385-149.036 121.179 126.555 105.004 -83.475 129.707 -97.489 171.593 -1.680 113.455-123.094 147.363-155.301 96.842 42.209 152.287 170.275 92.749 45.653 136.391 -83.935 90.764 49.740 130.446 -76.500 91.961 50.735 129.406 -53.992 93.136 38.583 143.853-161.305 91.325 44.634 0.000 0.000 90.827 59.402 103.469 -87.362 86.559 49.889 143.543 -77.084 89.648 41.711 118.749-128.108 90.575 49.911 113.516 -75.324 90.145 43.794 141.558-106.895 93.445 54.334 135.370-123.038 91.630 -93.134 140.295-119.827 119.956 171.704 152.281 -16.451 121.218-168.901 113.726-116.170 96.370 38.888 114.900 -77.608 93.442 48.218 131.853 -98.221 93.195 45.321 128.544 -0.575 93.490 114.989 132.002 -77.801 90.487 -40.982 97.093 -81.813 88.383 -59.130 117.518 -25.748 89.212 -56.442 146.406 -17.919 88.451 -55.307 128.558 -76.037 89.789-127.109 134.522 -4.344 89.768 56.616 132.760 -77.438 90.174 48.407 142.491-105.884 89.968 45.679 129.458 -36.444 90.546 56.763 143.770 -32.549 88.949 44.249 137.686-135.226 94.327 84.865 103.345 -80.062 92.546 0.000 128.805 -76.743 # 639 total E -1.51615E+02 rmsd from N 0.000 %NC 0.00 93.192 -66.075 128.895 -82.789 94.542 -46.729 117.996 -80.875 90.396 -48.335 103.312 -77.079 90.197 -47.908 128.959 -76.031 91.297 -40.935 140.994-128.089 94.250 -41.066 65.347 -65.601 91.889 -40.357 140.223 -77.147 100.345 -37.402 169.608 133.304 96.978 -43.962 126.809-108.178 97.823 168.885 86.696 -79.357 91.979 93.059 145.710-148.202 92.069 57.845 92.451-125.953 95.682 77.560 101.139 -83.641 95.399 -68.663 141.872 -88.576 106.191-118.310 109.301 -86.453 94.422 47.345 150.108 174.881 94.677 44.429 137.855 -83.988 91.875 43.658 130.011 -38.949 91.740 53.387 100.204 -40.476 89.409 46.815 153.458 -26.389 90.466 44.657 0.000 0.000 90.380 48.343 108.768 -80.573 91.799 48.045 138.413 -75.775 92.012 41.376 124.857-122.313 91.262 47.744 116.806 -79.923 94.274 101.396 126.630 -99.847 93.135 58.533 130.856 136.329 92.701 35.908 143.284-130.956 112.309 160.698 107.238 -85.798 99.871 43.309 134.043-155.795 97.176 37.707 116.919 -79.551 91.488 49.491 128.070 -40.518 89.535 55.077 96.647 -71.195 90.284 44.533 128.670 -76.877 89.700 43.126 106.338 -87.637 92.244 43.977 121.910 -83.526 90.817 50.782 140.323 -93.668 90.016 44.509 128.804 -77.182 91.216 108.114 100.146-100.594 90.422 -59.946 129.042 -77.697 92.049 -52.104 147.710-127.180 90.845 -55.134 132.330 -9.691 93.290 113.469 161.173-149.520 98.624 28.666 137.956-173.425 97.637 63.566 105.218 -75.890 92.509 0.000 129.129 -76.461 # 640 total E -1.48490E+02 rmsd from N 0.000 %NC 0.00 126.199-110.572 142.829 -28.538 123.462-104.386 127.559 -45.785 92.817 45.320 108.122 -79.678 93.410 43.567 130.115 -77.332 95.694 45.329 155.475-163.182 94.130 40.112 55.074 -76.961 92.562 43.157 130.387 -33.428 92.688 43.410 130.407-115.170 88.952 54.543 138.693 167.541 86.856 54.235 79.647-108.851 90.320 174.934 143.527-108.539 91.528 70.656 104.182-152.249 88.699 53.608 97.223 -83.565 90.636 61.560 116.414 -35.465 90.753 39.270 106.118 -81.473 93.258 50.074 138.147 -93.107 94.066 34.327 123.720 -71.699 100.934-109.442 158.211-129.520 111.892-108.049 99.233 -88.843 89.675 67.482 152.344-170.509 90.994 48.534 0.000 0.000 90.054 46.461 137.141 -10.263 90.355 46.367 144.727 -94.845 89.800 51.233 127.865-157.766 86.037 62.573 111.703 -74.615 87.586 49.474 133.604 -51.368 90.451 45.400 125.742 -26.635 91.647 44.494 142.178-121.283 95.689-109.123 107.017 -81.820 120.004 -98.097 113.188-116.924 91.326 64.662 133.509 15.568 91.408 58.575 118.641 -97.945 92.782 37.809 110.725 -75.522 94.017-116.259 128.217 -74.882 89.020 -45.178 99.814 -79.119 89.454 -54.119 130.427 -37.695 89.094 -47.072 140.624 -51.011 89.949 -55.618 128.282 -75.760 92.308-133.870 123.485 -23.530 89.575 52.618 131.920 -76.645 90.255 47.281 143.454-140.323 89.500 47.428 129.783 -37.598 89.768 55.607 138.902 -45.777 89.369 43.737 139.576-132.547 94.498 82.384 103.863 -80.205 92.548 0.000 128.826 -76.762 # 641 total E -1.48831E+02 rmsd from N 0.000 %NC 0.00 92.942 150.814 138.143 -87.025 93.445 55.450 134.677 52.522 91.659 46.756 106.763 -81.498 91.830 44.301 130.052 -77.075 94.928 46.772 156.103-150.998 94.832 38.822 54.287 -70.449 92.121 45.268 129.215 -22.223 91.498 48.561 129.683-112.242 89.051 52.589 144.442 168.487 90.707 102.610 82.198-104.850 92.619 -61.707 128.414 -99.146 94.066 -46.054 94.832 -82.921 89.756 -48.365 139.997 -1.006 93.222 -49.723 121.878 -73.992 91.234 -37.425 138.382-151.060 92.990 -45.701 125.427-150.521 94.028 -70.163 142.374-119.501 87.090 -80.283 153.830 17.860 90.576 38.797 77.919 134.138 116.827 -66.207 107.278 -81.182 116.335 146.683 0.000 0.000 92.500 56.666 145.821-139.050 90.052 47.623 137.372 -99.694 89.584 45.247 117.113-124.042 89.060 50.395 112.661 -78.478 90.250 50.361 138.656-104.396 90.781 46.382 128.674-150.939 94.955-101.424 103.677 -82.616 111.979-173.032 151.620 -16.867 134.120 -54.093 110.070-103.052 104.895 -25.992 112.706 -78.818 93.272 -48.745 111.853 -52.715 92.514 -42.726 111.404 -69.187 92.556 -45.464 128.093 -76.879 91.341 -41.294 99.418 -82.409 89.357 -47.297 122.768 -8.954 93.788 -44.662 151.677 -12.347 91.949 -49.889 130.289 -77.857 98.202-133.282 130.554 36.952 91.801 56.127 130.314 -75.595 91.259 42.359 141.994-111.805 90.836 44.913 129.972 -41.738 91.898 56.367 141.143 -47.671 88.488 45.474 144.256-151.893 93.553 90.784 102.946 -80.234 92.563 0.000 128.722 -76.765 # 642 total E -1.47187E+02 rmsd from N 0.000 %NC 0.00 92.809 152.695 130.331 -68.805 104.309 37.329 137.042 44.215 91.743 45.640 107.083 -82.188 91.286 54.316 129.583 -76.212 92.553 47.634 132.698 -8.555 92.651 39.266 69.016 -81.709 93.329 45.593 117.747 -50.692 115.156 -90.932 122.793 -87.096 113.598 -62.944 123.598-100.286 110.752-152.984 83.986 -71.246 112.252 70.908 161.826-121.155 96.214 31.607 93.117-116.205 97.233 76.369 107.783 -80.643 96.838 -76.179 146.241 -42.615 107.109-131.593 143.479-139.609 93.877 48.892 147.345 165.006 93.611 46.295 134.936 -83.399 92.067 43.988 123.440 -30.552 90.689 50.969 138.612 105.067 89.966 47.345 136.292-152.810 91.131 43.115 0.000 0.000 89.937 50.856 153.745-170.431 89.659 50.105 136.202 -92.757 89.914 42.214 122.263-129.672 89.626 49.423 116.651 -77.276 90.518 48.434 137.897-109.093 91.806 52.148 132.157-147.983 92.548-105.051 103.159 -82.659 108.124-173.746 151.035 -18.392 128.970 -62.989 113.186-111.479 109.781 -19.566 113.315 -79.752 94.121 -47.530 110.262 -58.539 94.175 -37.508 112.015 -69.994 93.497 -45.976 127.842 -76.531 92.713 -35.126 104.768 -85.731 90.913 -50.051 103.299 -58.695 88.004 -56.265 152.599 -31.798 88.921 -53.313 130.204 -77.345 91.933-133.693 125.322 -40.733 90.646 54.599 132.630 -77.171 91.096 44.509 142.717-116.014 89.707 48.587 128.234 -32.708 90.431 67.589 141.070 -45.075 87.150 51.649 142.115-144.908 91.969 110.204 101.533 -79.857 92.555 0.000 128.579 -76.805 # 643 total E -1.51908E+02 rmsd from N 0.000 %NC 0.00 93.322 176.204 138.492 -95.271 92.884 58.136 150.567 16.645 93.258 43.471 105.616 -79.068 93.070 47.739 131.519 -77.276 94.387 40.596 135.768-114.009 92.425 41.874 60.921 -78.803 92.499 42.685 120.008 -47.937 92.883 41.695 138.240 -97.180 91.573 44.852 132.549-119.917 89.690 46.953 86.324-101.389 93.174 161.864 137.021 -95.263 87.791 94.039 108.935-155.954 90.851 102.740 103.677 -82.769 89.456 -71.121 142.733-112.613 100.703-122.467 139.636-164.224 92.499 45.534 140.284 135.130 90.860 48.465 135.568 -85.594 89.866 50.550 128.242 -68.519 90.568 48.462 133.402 -31.092 91.687 40.895 142.805-164.645 89.887 47.343 0.000 0.000 89.756 56.642 101.919 -85.485 86.877 48.164 146.534 -80.995 90.021 42.632 118.333-130.287 89.161 52.846 114.286 -75.294 88.925 51.945 139.826-109.224 90.724 49.722 133.903-124.693 93.888-103.110 104.718 -84.213 109.540-168.560 155.320-137.303 101.945 -53.060 97.801-101.258 100.926 -32.520 111.857 -78.109 91.942 -48.394 110.705 -52.518 88.782 -58.083 111.431 -72.365 90.407 -45.850 128.444 -76.418 91.641 -37.402 101.105 -82.314 90.477 -60.220 119.918 -20.659 95.071-135.883 154.321 -8.510 90.439 47.852 128.425 -76.779 91.580 51.962 124.949 -89.364 90.622 45.619 131.076 -76.556 90.558 44.211 140.018 -61.577 90.876 46.887 128.213 -41.063 90.390 52.866 136.179-104.032 90.283 43.096 130.976-136.318 95.519 72.775 104.073 -80.393 92.522 0.000 129.004 -76.682 # 644 total E -1.52205E+02 rmsd from N 0.000 %NC 0.00 93.198 161.698 141.570-101.061 93.603 52.545 141.216 24.873 91.878 47.022 106.316 -82.222 91.767 45.898 130.307 -77.164 95.881 45.812 140.445-112.997 92.486 41.107 56.849 -76.526 91.114 44.199 126.620 -39.047 91.745 51.781 121.815-102.168 87.654 41.005 136.909-117.581 97.950 111.177 82.472-101.982 107.001-114.424 163.549-117.805 92.934 59.778 98.223-105.874 91.853 44.965 106.110 -84.113 91.341 54.977 133.332 -91.969 89.020 42.486 127.730-125.443 93.210 56.529 126.013-113.576 96.044 -64.593 121.200 -72.969 125.135-165.168 148.880 -63.775 105.166 39.593 163.234 94.831 94.686 49.934 143.211-162.937 94.921 37.046 0.000 0.000 92.182 50.304 115.785 -80.202 89.594 46.698 140.801 -85.337 90.331 44.155 119.595-125.906 89.402 48.297 113.981 -77.262 90.876 48.091 137.474-104.588 91.986 48.026 132.543-152.724 93.407-102.250 141.501-122.210 114.918-172.912 158.288-147.926 123.682 -44.123 109.109-108.596 96.649 -36.949 110.221 -78.351 92.587 -45.243 110.073 -49.460 90.450 -48.270 109.492 -69.397 90.875 -43.575 128.691 -76.973 91.022 -41.790 99.696 -80.489 88.601 -52.210 118.088 -28.178 91.104 -43.087 156.490 -8.896 93.199 -56.489 129.605 -77.131 108.442-124.388 139.334 16.869 91.142 56.073 129.947 -75.306 91.049 45.549 141.825-106.076 90.723 44.423 126.721 -36.288 91.259 54.753 139.257 -88.006 89.542 43.915 134.060-144.421 94.677 86.808 103.500 -80.206 92.544 0.000 128.805 -76.701 # 645 total E -1.48175E+02 rmsd from N 0.000 %NC 0.00 93.150 -66.724 128.011 -79.970 94.295 -48.201 116.853 -79.539 91.105 -46.888 103.506 -78.748 90.238 -46.873 130.129 -76.396 94.536 -36.643 139.620-127.622 93.546 -45.164 61.992 -58.736 89.416 -40.964 128.890 49.386 101.515 -46.107 170.314-174.892 89.022 -47.139 120.667-114.492 91.533 131.472 80.856 -71.726 91.259 79.196 149.224 -38.122 92.754 37.963 96.535-110.244 97.256 55.889 105.754 -84.206 96.606 -19.455 148.045 -99.185 129.141-161.774 115.168 -91.745 111.294 50.346 146.038 149.773 93.612 47.256 135.461 -84.337 90.947 47.329 119.687 -54.447 92.678 54.411 114.158 -33.279 91.593 44.043 150.636 -13.056 89.407 47.280 0.000 0.000 90.359 59.213 105.719 -86.996 86.645 48.594 144.008 -75.540 88.343 47.732 119.154-127.152 88.959 50.012 105.464 -78.791 90.004 53.107 141.061 -85.492 90.460 48.386 133.356-144.870 93.566-108.215 106.139 -84.677 104.293 157.826 152.147-132.645 106.407 -55.616 90.243-102.962 112.650 -65.856 114.659 -79.945 124.009 -97.293 122.845 42.699 96.810 59.916 110.660 -69.267 91.343 41.025 130.662 -77.346 92.383 49.389 107.764 -89.034 94.344 110.523 131.604 -94.383 150.387 -97.334 176.470-176.373 94.506 -36.469 130.420 -78.154 103.706-152.695 120.494-119.548 93.113 50.309 131.264 -76.870 92.693 44.787 140.243-105.466 90.122 50.590 126.304 -13.511 91.236 60.369 130.722-113.681 87.375 38.913 131.294-161.885 95.806 81.880 103.596 -80.026 92.483 0.000 128.782 -76.523 # 646 total E -1.48472E+02 rmsd from N 0.000 %NC 0.00 93.172 -67.569 129.053 -83.059 94.329 -46.465 114.793 -79.463 90.515 -47.155 103.359 -74.852 90.429 -46.642 129.643 -76.507 93.374 -38.321 140.727-121.868 93.589 -42.802 64.268 -70.413 92.713 -37.902 132.810 -91.475 103.826 -32.795 170.385 129.258 96.041 -44.674 131.971-113.703 95.867 140.461 84.915 -83.880 107.257-138.256 140.043-100.612 100.689 71.342 121.649-140.849 121.923 154.786 104.226 -85.454 128.679 139.954 168.163 -2.047 112.766 -99.763 144.473-167.056 96.187 43.917 141.062 149.440 91.944 45.547 136.260 -86.231 90.016 55.243 120.954 -72.771 90.303 51.992 129.886 -36.060 90.855 39.808 142.827-163.233 90.655 46.407 0.000 0.000 90.852 55.729 106.325 -84.175 87.760 44.823 146.244 -78.852 91.562 40.848 117.462-126.869 90.630 51.939 107.867 -75.437 89.026 65.936 136.592 -83.645 89.482 37.693 136.930-150.751 94.882 45.886 113.937 -89.257 98.465 -27.194 139.520 -90.535 127.970 143.750 104.037 -97.521 99.008 65.500 124.862 -75.657 90.105 64.725 126.611 127.753 95.713 47.902 108.428 -74.765 97.980 -89.967 128.012 -75.171 95.364 -29.223 97.901 -83.211 89.973 -67.431 110.547 -44.906 84.089 -57.940 152.640 -39.906 89.631 -53.846 127.711 -75.339 91.121-128.734 124.988-134.047 89.733 55.069 132.919 -77.266 90.661 45.863 139.947-101.209 89.751 46.761 130.461 -28.123 90.314 61.550 143.496 -33.166 87.560 44.962 136.419-139.209 94.187 90.162 102.809 -80.284 92.496 0.000 128.822 -76.318 # 647 total E -1.50432E+02 rmsd from N 0.000 %NC 0.00 93.105 151.727 142.590-102.852 93.654 53.454 128.706 40.054 90.915 44.950 106.166 -81.469 91.391 51.497 130.663 -76.749 89.516 45.884 151.507-149.056 91.038 45.392 62.139 -65.556 89.811 45.873 123.862 -31.926 88.276 50.902 132.946-108.878 87.743 52.992 119.636-115.108 88.635 71.332 88.435 -96.303 87.507-166.364 142.034 -97.112 94.645 66.876 98.445-129.122 92.828 41.183 99.576 -81.973 94.167 102.278 147.402 -39.224 95.929 41.454 136.186-164.341 93.427 38.925 131.362-101.876 92.403 50.310 139.800 -39.463 93.199 43.957 105.552 -39.039 95.543 29.223 156.270-175.600 106.874 20.556 106.655 -83.227 100.966 40.254 0.000 0.000 92.896 43.686 138.496-121.746 93.612 42.074 112.174-111.551 90.934 41.404 117.961-114.109 91.728 46.635 112.819 -82.622 90.791 48.201 139.303-109.179 92.166 51.373 127.467-145.096 93.821 -98.587 103.517 -82.897 109.353 172.849 150.394 -17.481 132.449-167.165 111.821-108.594 97.512 51.514 115.664 -77.260 95.701 38.113 111.769 -28.608 92.827 47.886 121.477 -69.285 90.743 46.685 130.340 -78.174 89.534 48.366 132.825-130.367 91.205 111.593 117.131 -65.359 121.577 4.411 165.065 -18.288 110.802 107.958 158.394 -89.370 95.326-141.498 110.276-143.566 93.006 53.342 131.702 -77.229 91.585 41.929 142.005-114.950 90.011 52.414 140.657 -66.048 89.879 62.288 136.724-143.982 86.528 41.126 122.585-173.125 94.789 85.041 99.618 -78.260 92.506 0.000 128.934 -76.530 # 648 total E -1.53601E+02 rmsd from N 0.000 %NC 0.00 93.165 -69.713 128.893 -82.203 94.243 -47.559 118.917 -80.928 90.514 -47.935 103.265 -77.626 90.060 -50.057 128.084 -75.682 90.478 -39.011 139.500-129.792 93.168 -44.809 64.059 -65.767 90.880 -34.897 125.151 -21.945 105.167 -36.274 169.359 135.947 93.178 -44.425 127.814-120.923 94.792 136.340 83.745 -84.812 111.280-164.427 147.579-100.146 95.234 70.730 96.337-125.118 122.863 122.074 111.347 -91.049 135.372-115.196 172.162-152.778 107.099-120.456 140.556-156.846 95.862 43.876 149.757 150.840 92.680 46.602 135.974 -84.721 91.185 47.124 125.471 -65.741 92.463 49.269 120.602 -38.398 92.604 41.095 150.537 -16.709 91.019 46.421 0.000 0.000 89.952 61.843 110.063 -84.359 87.505 45.608 137.766 -79.224 89.117 45.036 118.589-121.471 89.818 53.478 106.803 -77.561 89.258 53.884 139.871 -91.026 90.492 39.715 130.916-147.575 96.938-120.198 106.160 -82.883 108.615 155.607 150.371 -11.750 134.573 -78.419 109.241-102.219 90.240 60.827 113.211 -75.852 89.904 53.058 101.636 -33.799 88.448 51.156 110.454 -74.287 90.061 42.586 128.231 -75.922 91.100 43.339 100.419 -81.072 89.958 49.296 144.087 -50.735 88.827 49.804 140.855-109.188 89.262 42.380 128.264 -76.821 88.777 50.705 113.093 -44.479 90.020 48.922 128.692 -76.373 89.597 44.308 136.066-130.960 90.175 48.717 130.151 -42.523 89.802 54.947 138.741 -53.198 89.517 43.869 136.553-123.656 94.690 80.484 103.863 -80.189 92.553 0.000 128.875 -76.689 # 649 total E -1.51774E+02 rmsd from N 0.000 %NC 0.00 93.076 -59.175 129.039 -83.825 94.574 -47.627 115.569 -79.563 91.301 -45.885 103.311 -77.493 90.632 -46.817 129.148 -76.028 91.541 -41.055 140.960-127.369 93.574 -41.582 60.134 -62.121 91.987 -41.355 130.765 31.638 100.131 -40.979 167.749 171.787 90.449 -58.489 124.892-123.186 89.509 -76.671 83.271 -86.502 106.515 168.049 141.921 168.279 105.913 -26.340 91.324-102.673 101.632 130.041 105.818 -81.019 104.529-127.131 160.559-136.163 103.693-115.260 140.067-154.408 93.193 45.979 141.088 157.270 92.306 46.308 134.164 -85.543 90.499 48.105 119.651 -51.293 90.942 51.540 114.506 -38.289 90.007 44.368 109.761 -81.852 90.203 44.844 0.000 0.000 89.368 62.570 117.579 -78.920 86.177 46.591 142.091 -86.490 88.798 45.110 117.619-127.120 88.365 56.242 107.177 -73.470 89.331 47.282 144.236 -88.040 92.792 37.949 129.311-134.618 97.499 22.868 145.104-133.675 118.176 168.697 107.667 -79.981 96.383 54.880 133.968-158.631 97.337 37.178 115.097 -77.981 108.439 21.083 131.398 17.922 94.433 51.618 121.059 -72.041 91.431 42.899 127.477 -75.808 89.655 44.203 101.907 -85.948 93.153 42.674 130.403 -39.537 96.681 35.293 128.368 -76.982 96.233 32.469 130.918 -78.621 103.319 111.224 94.761 -76.530 91.592 -61.635 129.715 -77.521 92.003 -45.172 145.145-140.039 89.682 -46.658 119.060 2.875 112.586 138.780 150.275 -3.486 95.264 42.117 138.731-157.131 117.639 21.100 104.740 -77.951 92.301 0.000 129.187 -75.769 # 650 total E -1.47667E+02 rmsd from N 0.000 %NC 0.00 93.146 -73.976 125.428 -67.547 121.290-101.850 129.709 -35.385 93.235 42.336 109.095 -79.348 93.706 48.908 131.510 -77.931 94.458 40.920 150.576-140.442 92.440 44.551 62.929 -89.862 90.007 44.762 118.569 -54.511 90.194 50.058 131.452-104.252 88.705 56.006 131.469-125.739 86.507-174.927 85.247 -93.324 94.940 88.582 149.141 162.388 91.500 47.734 91.796-124.464 93.600 45.065 106.611 -87.162 101.482-100.450 164.599-164.464 112.600-106.984 143.947-165.924 96.864 44.362 147.122 178.741 94.137 43.996 132.363 -85.736 91.141 47.816 131.113 -71.818 93.396 51.601 83.570-124.426 92.377 39.491 137.496-174.291 91.659 43.439 0.000 0.000 92.063 50.939 103.523 -86.059 89.598 51.297 145.975 -73.142 90.691 37.738 119.519-130.968 91.901 48.759 115.072 -76.955 92.209 42.777 133.386-101.715 93.316 68.197 137.278-166.402 91.659 -59.301 103.641 -85.416 121.923 126.736 150.792 -16.506 134.433 164.076 113.217-106.824 91.929 51.157 115.470 -77.031 91.093 52.183 108.182 -21.533 90.045 47.139 125.544 -18.792 91.073 44.026 129.707 -75.907 89.302 45.738 103.040 -85.173 89.984 52.540 119.180 -33.550 90.226 44.055 132.883 -54.431 92.053 39.450 129.876 -77.326 93.563 96.273 109.424 -96.014 93.751-162.556 128.790 -76.987 89.820 52.589 141.569-106.910 91.401 45.533 128.921 -39.465 92.112 49.344 171.936-147.816 90.777 38.164 129.028-174.695 95.464 108.862 102.726 -79.685 92.614 0.000 128.588 -76.813 # 651 total E -1.47338E+02 rmsd from N 0.000 %NC 0.00 93.139 -69.351 129.085 -83.800 94.259 -47.746 117.433 -76.093 90.940 -47.755 103.312 -78.717 90.368 -46.087 130.097 -76.156 94.300 -39.301 144.455-143.140 93.068 -46.283 77.871 -92.931 89.886 -50.593 128.912 49.570 105.122 -21.930 170.888 163.281 98.566 -54.154 123.212-112.759 92.325-108.705 87.192 -91.498 115.510 76.369 140.996 160.580 93.661 47.104 93.333-124.343 94.149 40.888 102.532 -84.067 92.967 58.970 144.082 -18.638 88.312 51.752 133.746-128.316 91.177 40.348 126.635-118.963 97.306-115.558 133.857 -84.907 93.815 126.186 102.748 -0.984 93.764 72.261 148.081-166.853 92.430 57.794 154.119 -8.097 86.190 67.883 0.000 0.000 89.209 110.435 99.396 -78.710 89.200 49.530 139.544 -84.996 89.674 50.584 120.222-128.527 88.153 69.172 109.286 -72.093 88.087 56.706 133.203 -64.377 91.060 29.864 135.550-120.179 103.374-121.227 107.391 -83.072 115.442-174.166 167.258-162.354 107.879-101.958 93.157 -91.910 94.173 51.274 127.899 9.816 91.284 46.034 97.005 -15.984 88.293 56.983 134.739 -22.617 89.159 46.811 128.149 -76.492 88.652 45.998 136.772-139.424 89.597 49.978 134.316 -39.749 89.501 50.800 141.324 -84.203 90.541 39.144 128.504 -77.031 89.442 52.002 108.646 -49.429 90.276 59.397 128.360 -76.542 87.763 46.520 142.155-154.111 89.775 45.754 130.863 -44.941 91.253 54.300 140.034 -38.800 89.374 44.443 143.263-138.786 94.391 82.527 103.601 -80.534 92.551 0.000 128.863 -76.752 # 652 total E -1.48710E+02 rmsd from N 0.000 %NC 0.00 92.928 154.662 136.181 -81.573 93.404 57.496 136.726 60.741 92.460 45.032 106.483 -81.835 92.128 45.448 130.535 -77.577 94.823 50.024 158.186-164.978 94.846 39.919 61.718 -77.560 94.104 37.760 136.723 -52.663 120.342 8.549 111.884-108.174 91.882 50.689 146.860-152.060 94.228 75.962 87.011-109.425 91.937 -70.447 137.301-110.838 103.301 -59.858 88.569 -86.725 89.022 -61.877 153.542 -19.164 131.203-126.386 156.625 176.654 99.047-118.346 131.495-160.099 94.733 46.562 134.453 140.601 91.754 47.729 135.531 -85.353 90.374 49.335 124.219 -67.125 93.088 50.972 127.351 -31.333 93.401 38.825 147.160-166.827 90.284 47.663 0.000 0.000 91.357 57.941 101.019 -85.008 88.260 47.378 145.896 -71.010 90.840 39.724 116.794-125.280 91.229 51.130 110.841 -76.611 90.568 50.994 138.243 -96.421 91.360 45.177 137.241-118.165 93.334 29.585 142.351-126.254 110.596 3.522 154.417 -21.839 137.006-167.302 107.059 -94.003 93.776 62.650 117.472 -76.497 92.006 129.960 99.919 2.740 91.925 -41.058 114.206 -72.026 93.070 -45.821 126.233 -75.293 95.141 -33.399 99.283 -81.966 94.106 -39.471 128.609 5.080 93.674 -48.069 145.634 -39.278 90.084 -46.486 131.698 -78.148 92.330-135.002 118.563 -51.434 90.407 49.082 132.235 -77.764 91.483 47.782 141.568-106.235 91.036 43.165 125.117 -19.485 91.039 58.207 147.854 -31.586 88.820 43.291 132.954-131.408 94.881 85.376 104.010 -79.727 92.542 0.000 128.875 -76.695 # 653 total E -1.49387E+02 rmsd from N 0.000 %NC 0.00 93.051 142.815 143.880-107.038 93.925 52.998 136.930 28.359 91.829 45.344 106.377 -82.201 91.463 49.725 131.308 -77.786 92.554 47.179 144.743-124.221 90.700 43.758 61.527 -73.890 90.057 46.365 127.970 -44.937 89.851 49.649 122.407-114.574 87.052 49.134 137.016-144.007 89.817 74.212 81.082-101.918 90.661 -67.248 142.299 -93.912 108.823 -69.230 95.109 -84.060 106.773-130.791 151.208 -2.792 138.968-114.958 154.893-150.554 102.678-118.473 136.288-155.177 94.594 45.824 143.892 146.040 92.101 47.228 135.286 -84.838 90.688 48.712 122.355 -59.762 91.297 50.583 126.527 -37.737 91.014 43.455 145.526-152.789 91.164 44.158 0.000 0.000 90.367 57.079 111.230 -83.025 87.741 47.444 140.340 -79.243 90.099 42.327 120.243-126.397 90.750 49.652 110.313 -74.419 91.229 43.000 137.706 -91.809 93.654 48.631 132.840-144.947 91.268 35.050 142.227-126.780 104.998-121.583 102.230 -80.839 121.283 -89.843 109.806-111.657 92.783 56.525 132.830 151.742 92.988 117.314 116.929 -91.719 97.516 -33.446 113.809 -78.146 94.574 -50.741 126.957 -75.247 97.264 -25.719 103.372 -83.465 95.248 -49.635 129.759 -81.272 89.554 -44.901 135.185-106.335 91.875 -43.133 128.599 -76.577 89.870 -46.448 113.630 -49.958 90.156 -53.666 129.509 -77.557 88.744 -45.647 145.981-142.602 88.178 -49.392 126.482 -18.965 90.410 -52.670 148.413 -22.290 90.827 -45.051 145.849-147.324 96.039 92.954 104.663 -79.700 92.486 0.000 129.013 -76.328 # 654 total E -1.47947E+02 rmsd from N 0.000 %NC 0.00 93.187 -66.201 127.058 -77.002 94.247 -48.646 116.085 -78.757 91.405 -45.438 103.335 -77.655 90.835 -46.702 128.621 -75.704 91.188 -40.687 140.737-126.315 93.718 -41.018 57.927 -58.494 93.270 -40.764 130.129 40.158 96.926 -40.761 169.093 178.494 92.102 -63.491 120.675-115.670 87.709 -81.488 82.730 -82.962 110.876 162.246 145.762 160.104 102.566 -26.322 90.939-100.318 98.439 111.641 110.863 -82.188 92.548-139.579 156.932-157.454 121.175-100.712 144.526-167.561 94.818 43.229 145.003 169.029 91.903 45.458 134.750 -86.037 89.864 54.220 122.915 -67.527 89.122 52.161 115.134 -42.877 89.000 43.028 109.666 -81.749 90.001 47.053 0.000 0.000 88.705 55.570 142.728-128.862 87.830 46.524 135.951 -99.813 89.793 41.706 120.226-128.930 89.343 53.685 114.107 -75.157 89.619 45.121 140.717-108.755 92.862 54.903 128.723-135.474 95.860 -10.052 112.809 -91.830 121.286-166.170 115.596 -74.654 99.706 52.499 134.454-158.524 98.942 31.261 115.195 -78.316 93.327 47.076 111.200 -5.404 91.869 53.118 111.849 -77.165 88.374 47.821 131.859 -78.491 86.466 48.086 103.419 -83.518 87.743 55.132 110.559 -43.441 87.733 49.912 139.417 -42.162 88.078 43.428 128.449 -76.661 87.357 59.161 111.308 -49.159 88.784 46.278 126.304 -75.483 91.255 45.631 134.902-112.103 92.068 54.306 128.853 -41.753 93.187-143.989 129.413 -71.921 95.550 45.714 138.972-145.389 116.800 152.647 108.960 -78.418 92.698 0.000 129.387 -76.476 # 655 total E -1.49605E+02 rmsd from N 0.000 %NC 0.00 92.676 154.144 122.864 -50.499 114.445 107.862 123.270 54.297 91.872 -43.527 102.668 -78.041 90.924 -50.299 128.490 -75.628 92.042 -37.812 139.528-130.129 92.322 -45.905 63.952 -63.415 90.924 -36.274 148.857-147.894 102.665 -44.775 171.949 155.861 93.474 -20.641 129.756-112.020 111.131 162.015 77.632 -80.531 92.544 77.527 152.071-107.163 92.086 42.087 94.483-121.665 95.269 61.121 105.343 -84.521 95.616 -66.100 150.163 -99.908 127.371-124.550 144.879-159.327 93.511 52.471 145.661 147.483 91.231 47.913 133.524 -85.364 89.879 51.965 107.991 -48.333 89.621 52.048 102.923 -32.668 90.221 44.124 108.022 -80.505 95.175 37.806 0.000 0.000 93.491 44.340 137.737 -91.153 94.453 40.696 161.368-137.770 92.823 42.986 111.564-138.617 92.232 45.451 110.960 -77.242 92.780 43.779 137.927 -93.164 93.957 58.421 137.357-150.096 94.481 1.108 107.800 -86.774 123.945 72.385 151.673 -16.728 138.000-121.369 111.862-102.292 122.606 11.720 118.038 -81.123 92.267 -58.758 116.274 -31.194 91.779 -45.926 113.649 -75.162 91.077 -46.832 126.561 -75.588 87.417 -43.606 100.317 -80.216 89.050 -56.032 111.885 -37.758 88.083 -49.107 148.940 -23.663 89.735 -50.470 127.987 -75.774 90.445 -56.183 126.127 -27.326 91.874 118.317 130.060 -75.418 94.082 39.536 140.340-106.647 90.845 51.806 129.794 6.973 91.438 58.725 146.855 -32.273 88.604 40.852 140.521-146.247 94.603 85.756 104.685 -80.970 92.527 0.000 128.866 -76.621 # 656 total E -1.47313E+02 rmsd from N 0.000 %NC 0.00 92.855 151.038 135.144 -76.503 93.760 51.179 116.927 -36.260 97.783 46.546 115.381 -80.269 94.570 109.235 130.584 -77.291 95.152 -34.285 125.855-116.409 93.114 -56.486 75.243 -69.515 91.394 -17.334 135.750 23.693 112.947 -42.010 167.656 128.411 91.864 -42.144 129.890-111.148 94.583 127.275 95.479 -88.448 106.244 38.303 146.772-121.634 94.486 57.378 96.170-112.262 91.449 80.360 107.380 -88.435 111.156 -91.679 122.816 -97.101 113.717-103.350 141.202-152.242 94.608 46.676 148.402 159.201 91.794 46.384 134.263 -84.735 89.245 56.761 142.749 1.481 89.836 49.921 133.855 -44.908 91.608 39.397 144.499-146.712 92.422 45.124 0.000 0.000 89.539 59.715 140.093 -26.086 87.884 52.592 137.842 -93.277 90.059 42.175 120.806-130.207 89.248 57.064 113.026 -74.183 87.993 60.598 130.141 -48.672 90.065 39.637 137.419-139.320 93.670 54.944 152.129 -22.129 98.104 10.366 118.007 -89.417 134.726-160.207 106.372 -93.978 96.485 48.467 115.150 -77.057 93.988 43.143 138.321 19.907 90.897 45.181 136.273 -6.998 92.373 47.189 129.005 -76.935 89.565 42.910 104.478 -86.053 91.195 46.102 128.536 -33.349 91.845 43.982 133.643 -64.065 91.732 40.963 128.541 -76.847 92.345 80.318 109.723 -89.788 89.936 -88.898 129.022 -77.214 93.483 -47.714 145.316-136.701 91.385 -50.217 119.566 21.586 95.021 117.788 145.273 -31.376 100.729 23.579 141.906-161.872 100.222 37.492 105.071 -78.390 92.355 0.000 129.698 -75.840 # 657 total E -1.46418E+02 rmsd from N 0.000 %NC 0.00 93.206 -66.621 126.645 -75.323 94.109 -50.599 116.865 -77.022 91.340 -45.403 103.757 -77.701 90.854 -46.945 128.348 -75.732 91.356 -39.407 138.906-126.578 94.392 -43.267 65.684 -65.440 91.628 -33.901 126.948 -18.886 102.975 -37.996 170.093 143.548 97.203 -44.826 130.079-109.271 95.170 143.535 88.546 -77.973 92.305 69.281 142.494-117.800 94.328 45.344 92.072-112.600 98.537 105.468 105.653 -83.577 133.964-133.060 151.981 -84.431 109.802-105.260 140.455-150.025 93.259 51.445 135.973 124.633 91.095 45.916 134.053 -85.440 89.638 53.703 137.144 6.549 89.620 48.563 134.296 -14.471 89.687 44.785 146.684-167.377 88.982 49.826 0.000 0.000 89.326 49.775 126.987 -42.667 89.358 47.980 150.509 -79.533 90.343 42.817 120.259-132.711 89.304 51.834 105.265 -74.135 91.024 65.864 136.383 -45.998 90.222 55.097 139.396-141.612 92.487 0.872 153.825 -21.396 121.112-156.447 105.890 -75.529 122.526 -95.318 118.802-120.986 96.619 -18.700 136.235-146.135 97.178-124.800 122.148 -17.017 94.966 39.552 114.963 -75.665 93.907 53.485 129.683 -76.039 95.369 30.337 103.028 -70.438 95.102 47.978 143.218 -27.260 93.700 36.704 135.279 -99.951 94.029 44.300 128.316 -77.130 93.962 60.290 115.052 -76.953 92.859-112.517 130.133 -77.050 96.010 -27.673 140.902-122.798 94.908 -69.217 118.664 27.035 95.986 120.558 156.901 -24.647 99.269 36.523 140.094-164.324 98.302 2.660 104.105 -69.591 92.508 0.000 129.704 -76.208 # 658 total E -1.47169E+02 rmsd from N 0.000 %NC 0.00 93.325 172.448 138.899 -96.113 93.515 56.221 133.620 23.517 92.784 44.836 107.237 -83.151 90.826 48.679 131.653 -77.298 91.413 48.817 142.339-124.357 92.125 39.480 59.047 -70.258 91.383 45.819 161.903 110.536 93.164 41.977 133.092 -99.624 90.736 44.941 143.520-141.263 89.862 53.760 80.422-111.090 89.707 143.464 132.712 -95.770 94.345 85.163 125.289-149.095 90.436 103.724 100.444 -86.086 93.124 -68.393 121.681 -95.893 99.544-121.984 136.929-144.713 91.637 50.157 139.462 120.199 91.465 47.632 134.788 -85.387 90.440 47.955 130.009 -43.835 90.624 48.368 131.402 -18.820 89.455 46.801 144.301-153.665 89.414 48.392 0.000 0.000 88.985 55.299 117.773 -76.592 87.971 43.166 140.987 -86.612 89.030 48.843 119.138-127.798 87.538 63.686 108.340 -77.735 88.052 56.413 147.551-103.146 88.174 35.040 124.034-156.692 98.590 -99.645 106.308 -83.329 121.758 179.582 153.451 -14.682 97.493 -61.943 95.951 -92.217 88.864 -55.052 111.574 -75.172 90.554 -48.179 112.743 -23.218 89.530 -48.026 112.926 -71.586 90.212 -46.139 126.998 -75.757 89.589 -45.638 101.383 -71.878 89.231 -51.144 147.617 -32.796 91.697 -73.110 158.184-160.094 89.880 98.332 128.443 -76.547 95.699 48.955 108.632-111.025 97.961-155.662 130.266 -76.135 94.943 7.670 139.884-109.163 107.231-113.674 123.875 18.586 113.816 84.818 157.906 -15.641 93.884 55.665 143.973-153.594 96.578 66.820 98.424 -78.554 92.375 0.000 129.336 -76.168 # 659 total E -1.47684E+02 rmsd from N 0.000 %NC 0.00 93.097 155.294 141.940-101.073 93.212 53.080 157.278 128.170 91.908 46.595 106.812 -80.461 90.777 48.227 129.880 -76.062 91.363 44.568 148.484-137.328 91.215 42.620 128.701 171.085 92.227 40.679 111.598 -74.314 96.688 38.380 131.822 -88.790 94.149 40.137 150.431-128.115 91.109 51.737 123.120-159.112 92.584 62.180 107.754-125.559 96.072-101.781 99.406 -93.728 111.227-148.364 105.018 -81.488 123.503-145.205 167.048-170.717 113.756 -99.707 140.546-152.740 93.793 45.879 152.143 166.868 92.636 44.432 134.960 -83.344 91.037 49.047 140.746 -78.846 90.951 45.445 133.932 -53.826 94.043 35.319 107.820 -82.358 100.066 31.309 0.000 0.000 97.728 39.168 144.177-119.471 94.332 41.298 133.781-120.748 91.822 43.478 112.214-126.649 87.748 58.170 114.611 -79.261 89.789 55.519 140.575-116.892 89.935 52.824 122.343-155.940 95.840 -56.699 152.513 -31.154 119.341-118.226 166.789-152.590 107.007-105.706 103.922 -90.716 97.247 -39.407 113.501 -80.473 97.136-117.599 127.228 -29.282 91.791 51.611 113.727 -73.096 91.351 49.559 129.362 -76.107 88.543 45.048 105.751 -81.924 90.316 49.930 139.600 -29.292 88.343 46.736 148.984-102.112 90.110 41.547 128.222 -76.831 90.029 48.942 114.052 -36.786 90.356 45.501 129.182 -76.647 91.608 45.188 138.203-146.809 94.203 78.715 129.724 -47.857 89.027 -82.013 141.261 -81.565 94.913 -40.168 134.286-136.498 99.751 -87.588 105.083 -72.840 92.924 0.000 129.405 -76.783 # 660 total E -1.46602E+02 rmsd from N 0.000 %NC 0.00 92.550 139.486 124.848 -49.159 93.613 60.662 132.020 49.766 93.091 36.352 108.188 -75.962 95.709-116.558 149.603 -87.344 102.242 -30.479 133.146-129.233 95.407 -45.489 64.088 -61.443 90.981 -38.011 132.974 0.679 101.867 -43.618 165.480 143.151 94.714 -53.709 131.200-119.053 97.837-146.159 74.828 -80.330 112.860 72.146 157.786-148.075 96.553 38.359 91.624-116.190 96.892 71.246 106.263 -80.149 103.875 -64.283 148.016 -47.485 109.350-145.271 149.285-144.354 95.215 50.342 140.859 146.226 93.732 43.566 134.956 -85.258 91.988 44.968 134.677 5.365 91.960 48.082 136.377 146.015 92.136 43.342 140.143-149.380 93.444 40.708 0.000 0.000 90.629 51.814 145.436 -20.744 89.003 57.325 129.001 -99.832 88.563 49.476 125.068-134.387 88.643 50.401 110.354 -70.814 90.727 44.734 134.188 -83.123 93.619 53.077 134.647-139.571 96.152 -78.824 143.189-125.484 117.357-165.003 153.011 -19.696 137.198 161.262 113.572-106.501 98.596 40.544 115.791 -78.017 93.144 46.858 110.746 -31.781 89.228 62.086 121.960 -72.704 90.269 39.879 127.510 -76.441 92.171 47.092 101.955 -82.989 91.548 51.718 128.102 -66.503 92.358 58.956 123.575 -84.252 91.585 62.779 129.997 -77.577 95.521-171.242 83.836-101.598 92.711 55.319 131.169 -76.805 91.435 43.458 141.052-110.303 88.935 59.025 135.140 -28.199 89.822 66.335 142.268 -52.539 86.402 38.775 142.308-151.224 95.851 86.643 102.665 -79.541 92.551 0.000 128.909 -76.284 # 661 total E -1.51301E+02 rmsd from N 0.000 %NC 0.00 92.968 150.975 138.926 -89.709 93.159 54.580 137.043 51.071 91.432 45.831 106.547 -82.435 91.670 49.516 130.741 -76.685 93.445 44.407 157.836-157.123 92.747 39.119 60.598 -75.075 93.725 43.965 124.053 -37.673 94.271 39.097 137.180-102.161 92.853 48.606 142.185 156.441 92.467 89.050 87.292-103.113 92.880 -70.460 134.473-105.030 98.396 -45.249 93.279 -90.624 92.706 -43.184 139.432 -14.185 95.597 -44.047 154.224 -38.803 92.569 -46.685 143.243-162.356 93.570 -40.872 128.556-142.399 105.664-164.894 149.795-168.540 94.897 -15.857 148.440 -62.319 112.105-133.260 131.181 -1.084 92.100 57.215 147.839-154.926 89.677 50.303 0.000 0.000 89.868 49.554 106.839 -80.400 88.920 47.412 143.550 -69.900 90.142 43.692 122.409-128.331 89.119 50.656 114.700 -76.415 90.087 45.446 136.353-107.257 93.063 53.242 135.894-135.124 92.799 -91.119 140.562-120.486 115.804 171.614 152.140 -12.953 131.416-173.407 110.548-106.945 97.857 49.186 116.206 -77.514 96.098 37.506 119.537 -54.534 94.809 43.961 121.400 -71.238 92.472 43.476 129.623 -75.523 91.390 42.612 108.628 -91.085 92.648 39.632 120.462 -90.706 92.721 48.920 126.321 -86.763 90.617 43.762 130.698 -78.552 92.469 110.102 96.607 -99.782 94.328-133.789 129.286 -77.646 91.870 52.391 141.167-108.934 90.993 48.803 131.810 -47.116 90.928 55.578 147.203 -30.432 88.995 44.298 141.992-151.073 94.383 88.170 102.858 -79.825 92.509 0.000 128.898 -76.515 # 662 total E -1.46633E+02 rmsd from N 0.000 %NC 0.00 93.150 -65.853 128.878 -82.967 94.563 -49.453 116.400 -79.067 91.704 -44.503 103.356 -78.248 90.663 -48.240 129.085 -75.922 91.402 -38.013 137.975-132.771 93.920 -45.264 61.549 -63.220 90.824 -31.231 131.538 48.288 104.514 -40.702 163.924-151.798 91.514 -50.317 132.389-115.646 91.492 96.952 91.191 -94.046 123.382 167.875 137.650 -88.390 96.372 79.737 127.930-152.528 98.199 128.368 101.090 -83.649 95.269 -54.910 134.299 -92.413 96.911-121.983 136.370-146.207 92.042 47.974 142.974 144.736 92.227 47.650 135.157 -85.302 90.676 47.209 134.034 -52.625 90.752 48.409 127.108 -37.304 90.905 45.659 146.116-151.579 91.850 40.712 0.000 0.000 90.803 53.804 115.749 -80.415 87.228 48.434 144.751 -86.502 89.094 44.407 119.265-130.741 89.178 49.211 111.427 -75.896 89.738 46.963 139.744-101.044 92.449 49.004 133.711-132.944 92.974 -95.167 141.417-121.134 119.385 173.222 151.973 -16.580 128.756-169.025 111.205-107.860 96.188 41.173 115.178 -77.454 93.044 47.395 108.510 -13.114 94.304 38.117 128.319 4.488 93.420 48.438 130.764 -77.116 94.228 28.430 102.893 -84.272 95.320-169.873 110.970 -24.754 110.930 -0.123 164.726 -2.995 93.609 -69.590 127.813 -76.316 97.157 -65.902 131.282 -36.915 91.345 83.898 129.626 -76.431 92.254 46.188 140.220 -97.698 91.132 48.337 124.767 -37.479 90.349 50.244 136.819-114.297 90.735 50.367 130.602-144.964 95.502 50.507 102.870 -77.818 120.144 0.000 146.140 -85.744 # 663 total E -1.56279E+02 rmsd from N 0.000 %NC 0.00 93.148 161.803 140.445 -98.053 93.597 53.217 137.967 44.715 91.373 47.854 106.249 -78.594 91.774 45.083 131.069 -77.616 95.974 44.231 149.967-135.410 93.646 37.556 51.225 -74.209 91.705 48.682 162.369 123.642 92.178 42.561 139.148 -95.400 90.646 45.250 146.771-148.651 89.065 50.960 75.880-111.555 91.308 141.169 136.227 -92.644 89.825 85.346 103.984-135.848 92.465 105.596 98.568 -86.103 92.672 -61.732 132.894 -93.113 96.454-123.291 135.512-142.072 90.662 50.398 136.409 123.455 91.710 47.382 134.845 -85.501 90.925 45.940 133.365 -38.153 90.635 47.927 133.022 -21.027 89.033 48.407 144.105-155.022 90.021 46.070 0.000 0.000 89.778 47.847 116.772 -77.095 90.074 45.439 137.431 -81.268 89.076 46.228 121.867-124.966 89.008 49.932 109.648 -80.509 89.799 49.051 136.401 -98.495 91.528 47.313 131.951-133.951 94.548-100.483 103.384 -82.910 110.590-177.348 150.931 -16.990 134.713-164.589 109.547-102.372 96.625 43.622 115.193 -77.277 93.584 44.350 103.284 -6.978 91.815 46.272 129.517 -4.602 90.109 47.355 129.791 -77.106 89.521 45.509 103.763 -85.050 89.858 45.425 120.205 -25.424 91.123 46.720 134.344 -62.492 91.552 39.072 128.717 -76.958 93.417 103.066 109.304 -92.073 90.612 -63.497 129.574 -77.846 92.617 -53.432 144.944-139.472 91.224 -44.068 124.090 -7.545 95.119 116.744 145.928 -36.576 103.916 21.003 145.855-173.750 99.276 63.537 106.322 -69.695 92.381 0.000 129.428 -76.132 # 664 total E -1.46531E+02 rmsd from N 0.000 %NC 0.00 93.437 -82.770 131.203 -88.297 98.276 -35.750 128.856 -51.436 94.982 -69.652 142.649-142.069 98.519-118.053 127.326 -74.212 87.689 57.846 144.278-149.652 90.450 46.075 113.628-147.387 90.491 42.916 113.398 -59.264 91.985 45.763 140.612 -70.195 89.997 39.789 137.799-115.227 92.657 47.143 86.914-104.666 92.034 60.332 133.667 -93.895 97.780-104.982 95.398-101.346 111.436 165.554 104.985 -84.142 121.230-100.664 162.114-147.587 104.766-111.820 138.176-148.632 92.656 47.246 146.161 134.234 91.730 46.091 133.955 -85.516 90.681 50.033 139.885 -59.052 89.302 48.240 143.827 -39.069 89.061 46.905 109.338 -82.378 90.735 44.115 0.000 0.000 88.778 51.131 146.077-117.207 89.858 41.270 115.729-116.205 90.698 46.109 119.535-123.930 88.328 53.713 112.804 -76.602 90.766 43.396 133.301-100.395 93.061 43.120 133.313-151.393 98.654 -47.895 144.659-128.862 133.801 78.615 153.340 -15.161 131.213 121.871 106.785 -99.377 146.968 144.844 132.517 -88.218 94.937-121.293 123.095 -22.273 93.258 49.070 130.203 -11.246 91.467 50.264 129.415 -75.964 88.963 43.952 105.508 -79.173 90.590 48.872 142.336 -84.380 88.899 46.537 152.110-173.047 90.137 42.143 128.066 -76.436 89.453 49.839 109.379 -53.770 90.145 47.151 127.952 -76.332 90.295 44.188 136.988-136.809 90.820 46.817 127.820 -42.603 90.427 52.131 136.448 -93.330 90.532 43.806 134.228-139.981 95.387 73.491 104.215 -80.449 92.496 0.000 128.964 -76.596 # 665 total E -1.48719E+02 rmsd from N 0.000 %NC 0.00 93.260 168.598 138.887 -94.419 93.102 57.177 137.826 22.167 92.504 44.534 107.621 -79.218 91.317 52.349 132.019 -77.385 90.713 43.447 144.798-127.429 89.902 45.317 71.333 -69.786 90.383 46.162 116.414 -57.121 92.365 44.201 126.524-101.589 88.761 43.074 142.323-150.461 90.720 53.333 80.580-104.862 90.452 141.479 135.500 -91.373 94.326 79.126 123.797-146.617 94.199 102.257 98.231 -84.700 93.323 -65.352 133.222 -87.521 100.725-122.342 136.349-143.246 91.097 51.157 137.533 126.838 91.137 48.144 134.741 -85.355 89.937 48.899 139.778 -44.898 90.591 47.439 132.263 -23.268 90.239 45.246 143.553-157.170 89.035 49.617 0.000 0.000 88.942 55.980 108.470 -80.479 87.482 43.662 139.479 -78.969 89.959 46.236 120.221-123.974 89.333 52.515 110.483 -77.137 88.883 51.232 141.217-102.438 91.268 42.420 130.534-131.969 96.282 -95.526 143.151-125.408 118.882-178.317 152.045 -16.434 137.389-170.368 108.404 -97.847 96.027 46.348 115.312 -77.151 92.387 47.560 102.001 -10.530 90.375 50.482 125.081 -8.634 89.478 47.603 128.968 -77.091 89.339 50.073 103.257 -84.159 90.032 46.892 132.345 -32.825 90.364 48.128 131.854 -79.735 90.713 39.388 128.694 -76.985 92.026 69.649 113.538 -87.390 91.834 -36.213 128.298 -76.658 125.013-121.559 142.552 -74.439 94.629-142.529 136.903 -55.923 126.012-124.031 161.313 -12.500 96.884 32.085 139.411-133.915 99.249 16.858 104.638 -78.312 92.489 0.000 129.506 -76.821 # 666 total E -1.46657E+02 rmsd from N 0.000 %NC 0.00 92.597 130.886 127.947 -58.178 94.431 48.780 141.813 0.770 93.239 43.883 107.905 -80.787 92.018 49.748 127.576 -74.556 91.141 41.871 127.494 -37.317 91.780 47.008 85.035 -71.196 88.493 49.707 114.960 -64.293 87.917 49.325 118.153 -92.351 92.625 120.741 113.187 -72.349 86.032-134.717 127.974-140.484 93.387 49.366 139.447-155.296 95.692 43.628 89.738-114.113 91.501 48.332 133.585-107.917 92.439 46.794 126.756-123.490 90.259 44.249 125.359-137.554 92.848 49.480 124.552-117.364 95.386-118.325 119.904 -75.009 100.334 143.265 141.397-107.479 96.897 156.611 156.926-107.463 94.516 59.970 145.641-169.804 91.875 44.568 0.000 0.000 90.820 45.621 139.073 -16.147 90.497 51.754 146.126 -87.920 88.955 46.462 121.354-134.883 88.344 47.929 107.672 -73.509 91.170 47.258 141.573 -50.086 91.739 47.744 137.971-147.278 93.042 -89.835 141.198-121.751 122.585 178.274 153.710 -10.361 118.639-130.228 115.467-120.797 111.038 29.721 116.658 -78.886 94.830 46.665 124.234 -55.659 93.785 40.824 118.597 -72.890 91.514 49.288 130.557 -77.950 88.633 46.459 104.704 -86.080 89.606 45.085 119.659 -79.966 90.151 57.817 137.297 -50.996 88.924 57.065 128.534 -76.777 88.524 172.472 81.859 -88.379 91.828 63.902 132.120 -77.631 90.537 43.580 140.610-100.483 91.144 45.088 115.836 -20.091 91.836 52.079 146.213 -50.660 90.404 46.026 138.950-138.860 94.482 83.563 103.473 -79.886 92.532 0.000 128.894 -76.620 # 667 total E -1.51489E+02 rmsd from N 0.000 %NC 0.00 93.245-101.134 124.528 -66.712 93.126 -55.916 113.197 -65.921 94.472 -36.222 106.493 -73.690 93.744 -46.847 130.405 -77.519 99.745 -13.724 151.085-173.235 104.664 -56.149 43.434 -84.429 94.681 -54.717 118.236 -38.811 94.221 112.652 142.061 -78.026 93.288 41.849 150.187-178.739 91.367 56.174 147.123-104.912 90.905 106.178 138.412-153.466 89.445 57.277 95.815-134.137 92.849 61.503 103.824 -85.083 93.221 -67.236 152.594-104.740 124.465-123.237 144.328-159.940 92.367 47.587 160.740 107.986 91.530 49.067 132.994 -84.047 90.131 48.657 129.194 -51.030 91.832 46.778 118.554-122.951 89.397 44.511 109.874 -87.487 88.441 53.728 0.000 0.000 89.864 49.033 107.158 -82.075 89.913 42.333 150.471 -77.827 90.432 44.917 116.548-128.392 90.205 52.396 110.807 -79.392 89.459 50.486 138.664-102.042 91.594 42.194 132.027-146.112 96.501 -97.104 143.560-125.566 115.755-172.464 151.704 -16.945 138.378-167.783 107.862 -96.462 96.143 44.446 115.019 -77.444 92.540 47.284 102.567 -10.572 89.957 50.447 132.994 -3.475 89.383 50.193 130.176 -77.431 87.353 46.497 103.072 -82.456 88.270 53.140 140.441 -38.242 87.836 52.166 161.527-130.583 89.481 39.958 128.268 -76.696 88.565 51.269 109.405 -34.869 89.427 55.832 127.473 -76.064 88.659 44.218 134.831-110.914 89.762 45.656 129.238 -38.671 90.795 53.716 136.911 -53.465 89.645 44.122 139.903-127.757 94.728 80.456 104.118 -81.390 92.591 0.000 128.936 -76.814 # 668 total E -1.49902E+02 rmsd from N 0.000 %NC 0.00 93.147 -79.012 122.590 -60.085 123.948-102.261 128.227 -41.497 93.638 43.297 108.177 -79.703 93.842 43.846 130.783 -78.035 96.664 43.024 153.173-139.261 92.901 43.648 56.408 -82.804 90.803 43.729 123.530 -41.149 92.263 44.617 130.316-104.172 88.772 49.481 144.286-156.922 88.745 45.306 78.189-105.363 92.240 177.094 130.323 -80.787 95.636 64.506 133.733-160.367 90.872-136.502 99.411 -83.831 99.675-134.802 147.670-167.361 95.683-134.709 135.387-151.182 91.628 48.212 133.738 127.135 91.754 46.413 133.582 -85.265 91.658 43.833 119.833 -48.074 91.284 47.911 148.835 -23.369 90.175 47.710 109.908 -82.387 90.484 42.829 0.000 0.000 90.017 51.023 114.217 -80.044 88.418 45.020 141.050 -82.374 89.955 45.328 120.966-126.908 89.537 47.234 108.258 -76.140 89.662 50.016 137.694 -85.495 90.908 41.654 135.221-135.121 92.343 53.388 142.984-127.876 94.395 -71.104 110.895 -87.894 124.807-115.156 109.895-108.488 92.129 64.901 114.955 64.704 91.791 90.006 118.357 -91.577 95.630 -0.564 112.484 -75.835 97.708 -92.567 128.631 -76.025 89.144 -43.597 99.909 -82.381 88.507 -53.993 121.874 -21.175 89.062 -57.121 144.957 -35.682 88.993 -49.539 128.716 -75.961 92.425-122.782 135.705 11.930 91.210 49.263 131.309 -76.949 92.922 51.242 140.218-101.258 91.895 41.005 125.472 -25.869 93.356 85.117 146.208 -19.631 88.188 57.491 135.603-152.807 95.291 135.718 97.937 -78.902 92.531 0.000 128.864 -75.949 # 669 total E -1.52407E+02 rmsd from N 0.000 %NC 0.00 93.126 163.600 138.711 -92.078 93.032 55.812 141.739 34.379 92.397 45.434 106.333 -82.766 92.167 46.188 130.649 -77.236 94.181 45.550 145.790-122.322 91.546 43.478 58.678 -73.917 90.803 46.167 127.129 -34.630 92.219 44.392 119.955-106.068 88.508 47.340 144.242-151.700 92.916 89.207 80.747-103.717 89.494 -69.803 141.555-100.410 97.470 -56.517 92.072 -87.726 88.670 -42.366 152.897 -8.383 111.927-142.138 156.982-179.072 113.769-105.317 106.250 -93.262 105.661 31.925 153.917 136.054 92.199 49.393 137.517 -87.595 90.535 52.642 150.549-109.618 92.454 48.289 126.231 -42.753 93.238 35.550 145.848-168.300 92.941 43.767 0.000 0.000 93.022 48.512 102.432 -86.430 88.850 45.837 149.813 -81.315 90.384 42.672 115.714-128.910 90.539 47.932 110.655 -77.144 89.843 50.231 144.139-101.518 92.114 39.287 139.036-137.919 93.643 46.115 143.227-130.276 95.457 27.928 138.106-103.180 127.537-128.560 111.777-109.779 94.159 -3.980 113.648 -77.460 106.989-138.464 129.539 1.764 98.727 -42.870 115.018 -76.345 94.915 -34.548 126.914 -75.595 97.658 -37.946 98.527 -78.927 97.586 -18.705 137.089 -18.721 109.255 -38.213 156.876 -25.896 94.259 -36.199 130.504 -77.350 99.506-140.988 104.080 -55.961 91.576 47.533 130.864 -77.229 91.489 51.723 142.087-112.715 90.637 50.334 123.853 -11.629 92.131-132.542 130.162 -86.821 96.291 32.218 138.175-140.843 126.251 91.227 100.158 -76.542 92.559 0.000 129.933 -76.757 # 670 total E -1.46656E+02 rmsd from N 0.000 %NC 0.00 123.014-102.183 149.581 -57.239 122.604-106.532 133.855 -31.842 92.454 45.883 108.604 -80.248 93.907 51.477 131.485 -77.626 92.281 41.344 149.601-131.446 91.723 43.153 70.545 -96.902 91.707 64.004 109.983 -58.241 87.424-108.795 140.045 -95.452 130.980 -46.024 138.678-142.122 91.605-110.739 134.718 -30.027 104.268 51.511 125.475 167.697 90.929 59.023 96.093-129.970 92.889 81.470 97.235 -83.504 91.408 -83.030 140.367 -54.549 102.395-112.729 140.559-149.641 92.749 44.232 148.825 178.969 92.311 46.777 134.930 -86.649 90.381 50.408 146.231 -82.678 90.133 47.247 117.699 -51.292 92.170 39.173 107.626 -83.346 97.051 35.909 0.000 0.000 93.220 46.283 141.707-105.833 91.863 43.739 126.310-120.554 91.269 41.263 113.752-124.813 89.486 50.239 112.524 -77.015 91.086 50.973 137.115-102.565 91.302 42.923 129.944-137.751 93.117 26.191 143.303-130.246 118.585 164.608 103.333 -82.815 93.092 56.664 139.550-168.764 92.321 41.174 113.715 -77.333 91.674 100.243 143.271 -77.011 91.488 53.823 109.888 -75.281 90.342 43.291 129.068 -76.119 91.175 44.639 105.910 -84.748 91.440 43.811 130.785 -82.421 90.945 47.231 134.312-102.885 90.587 48.318 128.294 -77.169 92.420 84.167 106.679 -79.533 87.799 -82.662 128.893 -76.640 92.354 -44.183 144.423-122.217 88.411 -50.958 116.374 12.784 91.562 -52.723 148.694 -32.541 90.456 -48.277 138.048-127.617 95.536 86.281 104.136 -79.142 92.520 0.000 129.123 -76.237 # 671 total E -1.47028E+02 rmsd from N 0.000 %NC 0.00 93.273 160.572 143.247-108.726 94.326 48.840 127.756 35.673 89.968 47.603 105.949 -81.538 91.063 52.336 129.264 -76.716 90.302 45.779 150.473-139.856 91.449 42.977 61.333 -67.560 90.610 45.597 122.625 -29.689 89.028 48.723 130.518-105.680 89.175 53.544 121.249-109.884 88.421 65.805 89.976 -96.905 91.148-165.098 132.731 -91.136 94.287 69.970 98.760-123.284 93.926 39.717 102.179 -80.687 93.107 102.606 147.833 -34.277 94.566 44.801 134.956-164.391 92.434 39.436 129.306-100.563 91.945 49.834 138.696 -22.671 93.516 42.668 100.098 -46.982 95.516 29.289 153.013-179.719 104.192 24.868 107.035 -83.137 100.499 39.532 0.000 0.000 92.618 43.349 138.674-119.805 93.190 40.874 114.235-112.565 91.170 43.815 117.159-115.077 90.760 45.980 112.203 -82.453 91.293 50.254 130.569-101.012 92.386 50.978 131.636-142.231 93.942-102.801 106.145 -84.382 105.105 173.271 149.940 -18.218 134.644 -67.988 115.259-111.939 131.243 -32.311 116.975 -82.608 117.179-115.006 134.835 -28.356 92.289 54.393 115.987 -72.257 92.665 44.135 128.708 -75.796 90.972 44.218 108.155 -84.573 95.024 84.215 122.432 -84.785 90.897 -76.013 150.446-119.782 93.603 -47.808 131.253-108.723 95.549-124.280 124.106-110.853 90.337 55.225 131.820 -77.602 90.677 45.710 140.425-100.090 89.275 48.078 116.555 -17.258 90.726 59.237 140.436 -45.500 87.870 42.616 139.699-136.457 94.579 86.243 103.468 -79.743 92.488 0.000 129.003 -76.554 # 672 total E -1.51439E+02 rmsd from N 0.000 %NC 0.00 93.141 -64.981 129.031 -83.227 94.635 -47.130 115.923 -79.728 91.058 -46.621 103.222 -77.235 90.526 -46.663 129.529 -76.247 91.852 -41.009 140.501-130.145 94.151 -41.256 60.753 -64.768 91.918 -40.566 130.517 21.955 102.032 -39.068 169.484 150.505 94.302 -56.508 121.782-118.394 95.551-121.172 75.311 -78.510 132.947 129.026 165.276-177.435 96.847 12.514 90.992-113.119 127.336 122.121 110.967 -80.003 90.545 -83.618 157.189-133.521 94.848-125.828 132.809-159.577 92.210 43.947 135.520 136.172 91.045 48.307 133.823 -86.794 89.647 51.199 135.473 -65.133 90.950 49.239 111.193 -27.704 91.280 39.490 107.614 -81.513 89.582 51.325 0.000 0.000 89.178 58.711 104.981 -85.303 87.327 44.425 140.408 -74.357 89.220 45.177 119.090-122.777 89.863 53.190 108.202 -77.870 88.626 50.841 139.730 -93.893 91.800 41.818 129.880-134.368 97.374 -95.484 143.902-126.444 114.611-167.388 151.896 -17.395 138.678-168.776 109.176 -98.464 96.902 43.526 115.172 -77.459 92.508 47.273 100.494 -8.461 89.855 51.808 129.656 -7.520 88.884 52.014 129.949 -77.039 87.659 45.720 103.728 -82.305 88.776 49.245 142.613 -37.031 88.405 51.414 154.133-125.464 88.705 43.692 128.173 -76.867 87.919 51.197 110.966 -36.613 89.459 51.376 127.513 -75.706 89.582 43.494 137.125-127.013 92.676 80.272 131.990 -48.148 88.171 -80.638 136.631 -60.702 95.896 -45.566 136.480-134.020 95.921 -43.731 105.639 -73.790 92.610 0.000 130.194 -76.623 # 673 total E -1.48463E+02 rmsd from N 0.000 %NC 0.00 93.385 178.718 138.408 -95.899 93.308 56.682 141.719 40.381 93.163 41.833 105.244 -81.373 92.000 50.622 132.309 -77.556 92.344 43.329 148.353-133.120 90.643 44.073 61.587 -74.343 90.650 46.089 120.020 -43.076 89.814 45.772 132.508-102.062 89.082 50.068 128.016-119.481 91.996 94.693 84.777 -97.439 89.941-171.629 144.653-101.789 94.255 62.828 96.522-125.290 95.055 34.402 98.131 -80.139 95.266 123.198 147.528 -40.584 96.024 44.957 137.791-175.146 93.063 38.517 127.563-102.035 92.715 47.810 146.126 -13.258 93.296 40.352 111.367 -47.630 97.305 32.575 153.177-128.952 102.770 22.446 107.538 -82.272 103.037 32.387 0.000 0.000 98.905 34.859 131.870-111.411 96.144 37.375 131.422-115.071 94.057 43.502 116.257-126.121 89.513 52.800 116.928 -77.596 89.907 47.673 125.910-102.604 91.029 47.935 132.963-146.879 95.395 -77.361 104.569 -83.779 130.224 153.339 153.781 -14.917 121.828 -72.772 115.578-118.338 97.802-145.795 112.160 -76.244 113.331 22.990 133.623 96.259 94.424 47.653 116.219 -73.449 94.082 39.353 128.253 -75.552 93.398 41.709 142.522 -49.322 94.003 44.594 146.395 118.036 91.603 41.146 127.349-177.173 92.394 40.399 127.293 -75.914 92.278 50.327 147.388-129.636 90.687 45.811 131.541 -77.675 92.255 37.269 136.389-131.912 91.341 54.162 133.073 -52.195 89.573 68.389 133.646-128.330 86.578 42.237 124.121-163.919 93.615 98.585 101.754 -79.684 92.544 0.000 128.769 -76.706 # 674 total E -1.52547E+02 rmsd from N 0.000 %NC 0.00 93.068 159.206 139.045 -90.591 93.366 55.899 143.004 50.249 92.834 45.402 106.024 -78.444 92.223 44.178 132.745 -78.443 96.561 44.235 151.060-130.203 93.311 38.565 53.037 -76.800 91.767 47.126 156.061 124.690 93.848 39.647 135.256 -94.482 91.305 44.635 147.908-145.739 90.320 52.266 75.946-111.326 90.818 148.983 132.230 -87.385 92.378 90.352 126.522-151.568 92.575 106.281 99.839 -86.283 92.097 -65.673 133.750 -99.550 97.917-121.751 136.077-143.208 92.082 46.274 135.499 113.831 91.210 47.554 134.323 -85.445 90.266 49.343 124.827 -21.573 90.365 47.819 131.126 -13.522 89.886 43.606 153.846 -16.148 89.435 49.783 0.000 0.000 88.489 50.437 129.707 -41.908 88.970 48.314 140.772 -75.609 89.078 45.021 125.313-129.216 88.754 49.017 105.121 -70.588 91.735 46.064 134.854 -58.680 93.529 37.355 134.863-121.084 94.373 41.128 114.995 -89.559 98.869 108.753 111.669 -83.879 93.626 71.312 107.483-125.677 95.501 -42.498 114.242 -79.080 112.136 150.241 126.095 26.769 97.108 -41.514 110.456 -74.746 93.434 -45.906 126.761 -75.040 94.286 -34.442 102.681 -81.514 93.568 -48.184 131.184 -77.813 88.887 -44.156 138.486-104.497 90.449 -46.366 128.108 -76.354 89.228 -47.130 134.179 -32.750 90.131 -47.125 131.303 -77.644 91.700 -40.763 143.803-159.147 88.617 -53.193 125.921 -18.400 88.397 -67.357 154.400 -13.780 90.681 -46.919 135.915-171.781 95.542 76.031 97.844 -82.249 92.492 0.000 129.047 -76.505 # 675 total E -1.46696E+02 rmsd from N 0.000 %NC 0.00 93.304 -74.153 128.511 -80.859 94.220 -48.017 119.257 -80.068 90.996 -48.166 103.318 -77.406 90.656 -45.020 129.656 -76.207 91.782 -43.240 144.516-142.575 93.382 -42.217 63.268 -57.191 89.414 -49.589 126.981 -11.540 95.686 -50.860 165.345 172.241 88.897 -65.718 115.670-110.788 89.812-106.924 78.999 -69.018 113.664 61.872 165.786-151.668 100.974 65.700 125.244-145.306 103.431 154.759 103.582 -77.848 122.980-158.297 164.037 -13.384 115.236-113.454 142.169-157.853 93.837 45.050 142.243-120.677 92.142 46.814 136.101 -76.690 91.065 47.009 129.254 -64.966 91.981 46.190 129.034 -27.143 92.381 42.622 146.139-162.352 90.780 44.712 0.000 0.000 91.146 51.319 105.876 -83.464 88.944 44.407 146.308 -78.772 91.474 41.145 117.780-126.966 90.503 48.648 109.273 -74.634 91.630 47.538 133.770 -87.780 92.366 45.868 138.049-131.449 94.271 19.716 116.752 -93.506 113.508 3.181 125.647 -93.605 132.511-175.017 112.951-106.171 95.765 59.077 129.656 134.045 91.909 115.623 125.650 -89.048 98.880 -23.848 114.253 -76.401 93.107 -66.484 127.516 -75.698 90.677 -40.447 100.695 -79.472 93.081 -42.869 138.129 -43.090 90.726 -52.004 132.843 -65.739 90.510 -46.822 130.943 -78.041 96.647-116.714 135.410 17.185 91.797 42.409 129.048 -76.035 93.952 57.078 139.986-102.467 93.173 38.783 125.252 -24.803 92.540 57.123 151.367 -13.966 89.327 44.346 138.622-153.434 95.232 84.037 102.965 -80.023 92.534 0.000 128.899 -76.527 # 676 total E -1.50111E+02 rmsd from N 0.000 %NC 0.00 123.002-104.722 150.697 -76.090 97.761 -45.261 132.598-126.982 91.587 -60.968 98.974 -80.640 91.338 -87.811 127.416 -74.583 84.139 88.800 138.461-134.533 96.514 43.251 128.594-175.822 92.858 39.529 117.682 7.194 94.754 41.923 141.774 -87.493 92.852 68.448 149.487-160.967 88.236 125.623 109.059-147.093 116.286 -94.669 129.531-152.652 106.083 30.189 90.412-109.497 94.545 53.474 115.116 -86.539 91.387 50.487 144.855-125.782 90.286 47.381 125.398-156.749 92.387 57.774 127.276-112.813 95.689 -71.235 125.031 -71.175 118.202-166.311 146.065 -68.422 97.539 49.947 149.258 -25.423 93.446 44.306 141.932-168.553 92.019 43.584 0.000 0.000 91.441 48.725 110.618 -85.484 89.809 46.715 144.724 -80.602 89.813 43.456 119.340-128.950 88.948 51.744 111.149 -76.804 91.229 47.297 137.695 -97.976 92.649 41.785 132.971-152.009 96.407 49.192 115.712 -88.935 127.922-174.043 107.129 -78.282 96.759 51.547 128.331-150.658 92.836 43.999 114.064 -77.305 89.698 57.782 118.749 -12.557 89.251 49.571 107.118 -73.101 90.880 43.182 128.925 -76.050 93.075 38.231 103.908 -81.536 91.807 49.092 151.895 -25.624 88.279 49.337 151.617-144.858 89.545 42.394 128.127 -76.706 89.650 47.607 115.965 -32.732 89.882 46.652 129.996 -76.834 90.661 46.166 136.516-130.796 89.342 48.138 129.743 -42.514 89.322 56.421 135.839 -62.494 89.207 43.443 131.106-114.503 94.999 80.944 103.886 -80.404 92.620 0.000 128.836 -76.746 # 677 total E -1.46558E+02 rmsd from N 0.000 %NC 0.00 92.631 72.649 134.458 -84.181 95.808 49.577 153.557-174.322 91.900 45.625 107.013 -81.445 91.578 46.959 129.219 -76.118 92.166 46.566 142.959-116.805 91.635 39.559 129.225-162.624 92.347 47.727 67.438-129.341 91.262 48.645 128.000 -89.400 92.276-132.645 132.695-106.021 98.491-135.342 130.898 -6.063 111.082 37.290 149.039-147.614 96.797 51.700 95.832-117.880 95.690 91.977 108.402 -82.155 93.759 -64.433 127.830-101.027 98.414-120.250 134.265-145.955 92.721 45.746 143.431 150.543 92.744 47.722 133.407 -85.665 91.550 45.423 124.289 -41.391 90.214 51.548 104.699 -35.366 87.117 50.870 108.609 -81.678 90.380 45.512 0.000 0.000 91.468 42.672 117.971 -81.437 90.866 45.259 141.692 -91.144 89.825 54.229 118.888-128.263 87.499 50.201 110.105 -76.422 90.462 51.178 128.429 -89.822 91.252 42.795 136.011-143.397 94.628-107.132 149.399 -30.600 102.543-141.096 153.390-129.737 97.433 -53.319 96.334-109.266 90.805 -47.440 110.736 -76.689 92.132 -62.492 106.386 -64.544 88.856 113.526 117.791 -74.893 93.956 41.995 128.000 -76.156 90.125 51.475 109.756 -82.251 90.063 50.940 136.454 -32.510 89.525 44.453 131.266 -82.100 91.854 40.914 128.537 -76.815 91.518 47.521 112.986 -40.736 90.378 49.594 130.255 -77.192 89.531 43.781 137.453-147.407 89.916 48.730 130.666 -45.709 89.828 53.971 137.278 -58.672 89.740 44.349 140.580-127.256 94.597 80.679 103.689 -80.246 92.535 0.000 128.826 -76.597 # 678 total E -1.47619E+02 rmsd from N 0.000 %NC 0.00 92.706 102.540 141.879-109.133 95.111 51.176 137.073 16.283 93.342 43.688 106.238 -81.239 91.754 47.929 130.553 -77.262 93.088 50.090 136.091-104.221 91.137 39.186 60.990 -74.197 91.791 44.896 127.508 -36.838 91.766 43.468 126.735-108.319 90.634 50.494 144.533-153.501 89.382 70.531 84.503-105.154 93.113 -63.929 133.171 -95.459 111.054 -73.865 91.724 -76.023 107.477-141.266 148.195 -17.035 125.455 -91.765 149.629-131.603 98.356-120.711 136.545-147.902 92.974 47.605 140.795 143.511 92.110 46.775 135.063 -84.774 90.634 47.781 128.307 -47.484 90.793 49.505 125.195 -34.211 90.132 45.401 146.221-154.830 91.033 43.616 0.000 0.000 90.344 51.380 112.018 -78.697 89.725 47.515 140.566 -79.227 90.157 41.604 121.037-126.658 90.073 49.516 108.391 -75.354 91.469 47.158 136.195 -83.382 91.960 49.455 136.610-154.269 90.493 32.948 142.261-127.622 104.765-108.963 105.440 -85.622 120.138 -69.490 113.501-117.471 93.070 67.571 137.121-166.580 92.279 133.384 119.545 -99.084 99.675 -35.443 111.888 -80.585 91.971 -57.779 126.667 -75.183 92.077 -35.898 100.971 -82.029 92.550 -49.096 122.605 -67.434 91.853 -36.570 154.382 177.819 93.416 -62.964 127.288 -76.331 91.806 -95.567 140.858 -73.426 88.555 79.989 129.835 -75.978 91.690 46.729 137.907-129.598 90.272 45.104 127.285 -21.941 91.093 53.423 136.668 -95.902 90.278 42.608 132.436-136.105 95.592 74.213 104.225 -80.549 92.441 0.000 128.760 -76.606 # 679 total E -1.47672E+02 rmsd from N 0.000 %NC 0.00 93.199 159.137 139.114 -92.312 93.308 56.475 136.848 50.197 91.975 44.034 106.870 -82.739 91.753 49.385 130.543 -76.924 92.454 44.318 154.504-155.525 92.684 42.782 61.053 -72.551 90.127 46.806 126.255 -40.187 88.659 57.824 136.980-112.637 87.047 58.569 139.911-145.974 83.941 167.112 88.394 -83.525 93.624 82.267 138.920-151.589 94.240 43.004 93.392-123.361 95.071 55.031 108.898 -88.165 107.953 -11.656 142.219-100.308 122.240-147.999 148.816-152.007 118.394 23.847 150.035 156.870 95.631 45.074 135.538 -82.078 91.372 47.949 115.227 -44.959 91.264 65.127 123.612 -82.811 88.473 43.956 140.010-125.868 91.778 43.348 0.000 0.000 89.354 59.295 131.219-101.684 89.089 48.607 125.052-102.614 89.195 41.305 119.886-122.504 91.282 47.811 112.555 -80.055 90.652 52.576 142.580-110.506 90.694 48.624 127.827-153.924 92.462-111.655 103.711 -82.358 98.637 174.505 149.648 -16.160 107.841-158.211 89.205 -89.869 91.194 53.740 115.026 -76.215 92.045 47.287 101.969 -14.577 90.584 46.796 126.985 -4.389 90.135 44.273 130.125 -77.737 89.391 51.794 103.293 -85.320 88.115 54.075 120.082 -27.520 89.154 44.568 128.929 -64.445 92.616 40.842 127.189 -75.574 94.865 89.555 111.867-101.677 90.746 -84.284 128.445 -76.293 90.677 -46.210 145.375-116.859 90.985 -55.545 106.879 69.971 94.149 117.440 146.269 -24.240 96.813 24.898 137.628-170.046 108.503 56.531 104.287 -77.597 92.396 0.000 129.358 -76.230 # 680 total E -1.47617E+02 rmsd from N 0.000 %NC 0.00 93.424-179.633 139.242 -98.936 94.223 55.036 130.513 45.308 92.667 42.809 105.538 -80.872 91.412 47.298 131.541 -77.722 91.797 46.755 148.322-144.760 93.849 39.207 55.784 -64.509 91.782 45.158 142.594 -15.018 88.932 53.373 131.963-108.179 89.546 47.461 115.688-102.915 93.179 106.879 90.104 -91.406 95.500 -30.523 151.831-108.795 102.907 -65.741 98.192 -96.874 99.095-135.052 145.983 -17.266 129.287-145.350 159.162-143.850 102.102-114.732 139.598-150.147 92.049 49.979 136.509 130.929 91.495 46.309 135.132 -85.440 90.286 48.600 123.252 -49.972 90.449 49.317 129.158 -23.002 89.448 46.275 144.811-161.186 90.010 45.723 0.000 0.000 89.861 50.320 108.567 -77.941 89.231 47.373 142.452 -72.206 90.296 41.848 122.552-128.607 90.330 46.483 110.812 -76.835 90.352 51.598 136.145 -94.285 91.493 40.196 137.416-166.914 93.649 43.950 143.286-131.178 97.693 -5.512 116.846 -95.374 129.701-176.257 109.905-104.341 147.084 82.528 176.431 -67.253 102.057-108.648 127.673 -45.483 91.173 50.567 127.445 -28.185 90.939 53.380 129.361 -75.748 87.825 49.673 109.240 -79.288 90.306 38.689 134.215 -94.156 92.089 53.339 141.932-124.709 90.263 60.659 128.017 -76.756 88.299 158.059 108.052-104.137 91.009 57.490 131.172 -77.061 89.894 44.114 141.000-101.385 90.622 45.870 124.151 -23.430 90.843 52.996 144.841-100.300 89.818 42.919 134.122-161.897 93.452 83.046 101.781 -79.758 92.583 0.000 128.687 -76.958 # 681 total E -1.47206E+02 rmsd from N 0.000 %NC 0.00 92.791 143.284 136.692 -83.063 94.044 52.940 128.084 69.478 90.887 48.334 107.205 -79.061 91.366 50.200 130.623 -77.725 93.555 125.168 149.990 150.125 95.292 -35.948 59.157 -81.278 93.730 -50.088 135.575 3.207 114.158 -74.186 167.920-175.382 116.793 -11.774 131.832-118.698 94.859-144.261 85.945 -86.576 106.356 74.343 142.167 175.303 96.559 37.064 91.003-119.255 93.448 47.072 114.224 -88.637 89.552 57.830 148.083-136.151 89.205 47.924 125.116-119.726 92.122 53.734 128.747-105.812 95.694 -64.263 131.068 -70.412 122.228-169.458 153.411 -58.378 105.451 39.453 163.259 101.069 93.434 48.378 142.373-163.842 94.272 38.397 0.000 0.000 92.321 48.493 120.711 -83.561 90.707 43.960 140.334 -90.786 90.699 45.344 117.902-124.190 88.636 52.151 112.664 -77.559 91.062 51.745 136.591-102.365 91.413 36.379 130.521-150.836 97.012 44.791 116.135 -89.185 137.676-173.142 109.791 -76.324 94.511 59.851 131.491-156.322 91.215 48.544 113.695 -76.827 89.540 55.700 124.253 -11.374 88.836 48.542 107.956 -73.891 89.370 45.105 128.408 -76.087 87.966 51.185 103.507 -82.909 89.401 47.482 132.260 -40.055 90.387 41.717 139.991 -87.794 92.474 40.505 128.362 -76.983 90.214 51.618 108.533 -52.105 89.754 50.569 128.095 -76.637 88.989 42.923 134.881-144.856 91.085 46.757 127.723 -41.622 90.282 52.743 138.141 -81.888 90.317 43.783 134.357-136.051 95.233 75.529 104.194 -80.453 92.494 0.000 128.864 -76.606 # 682 total E -1.48500E+02 rmsd from N 0.000 %NC 0.00 93.331 -78.510 132.724 -94.678 94.638 -44.311 125.459 -80.985 90.311 -49.697 103.475 -72.868 90.182 -52.641 128.224 -76.298 94.130 -26.097 147.082-153.305 100.696 -41.722 50.515 -67.453 95.698 -17.037 156.684-140.033 110.847 -40.042 171.538-156.162 94.028 -40.782 135.860-121.920 93.388 116.574 115.999-146.783 130.309 157.386 148.951-128.030 90.213 80.082 99.038-138.654 96.222 108.084 101.478 -83.515 91.145 -58.463 146.076 -85.531 97.043-125.259 108.170 -86.154 92.828 46.074 139.660 135.971 92.688 46.176 135.866 -86.342 91.131 45.810 149.640 -53.410 91.780 48.086 129.314 -29.639 91.048 42.980 107.857 -82.565 90.676 45.264 0.000 0.000 91.056 49.823 105.493 -84.434 88.415 45.054 148.412 -78.389 90.503 43.495 118.270-129.797 90.428 50.303 110.359 -76.789 90.413 39.988 134.614 -92.781 94.839 57.931 131.781-128.130 95.708 -27.208 107.034 -86.186 130.596 118.025 152.286 -14.789 131.182 167.910 112.188-107.291 95.609 41.310 115.385 -77.354 92.126 47.806 108.335 -17.877 90.623 48.848 130.453 -10.932 91.755 41.951 129.588 -77.495 91.412 43.995 102.855 -83.725 89.455 65.339 118.079 -31.007 89.350 56.502 129.828 -56.544 89.800 33.049 129.353 -76.432 95.627 178.084 110.160-104.834 133.331 126.902 168.046 -85.459 93.615 47.448 141.139-117.585 93.724 40.943 127.817 -54.529 92.774 53.055 165.086-162.200 89.668 46.263 125.039-178.044 93.306 104.196 100.388 -79.908 92.603 0.000 128.576 -76.691 # 683 total E -1.47901E+02 rmsd from N 0.000 %NC 0.00 93.173 -65.387 129.318 -84.341 94.628 -45.875 116.663 -81.277 90.298 -48.684 103.112 -77.161 90.054 -47.224 129.959 -76.590 93.093 -39.224 139.528-126.901 94.553 -42.612 66.321 -67.233 91.276 -37.331 131.956 -56.063 104.358 -35.819 167.322 144.284 94.191 -48.529 129.918-115.015 95.011 165.639 88.206 -78.251 92.311 93.544 148.604-146.923 92.607 53.202 92.702-125.027 95.672 88.834 99.803 -82.976 94.511 -70.118 127.160 -64.117 100.406-118.286 142.489-139.679 92.856 50.288 143.639 166.376 93.496 46.289 134.734 -84.780 91.021 45.449 146.885 -15.181 90.786 53.323 110.954 -42.720 88.883 49.529 150.919-139.338 91.623 39.879 0.000 0.000 92.222 46.482 113.062 -78.754 90.168 47.637 144.126 -83.314 90.133 45.140 119.731-128.775 89.700 46.883 110.136 -76.970 91.966 49.787 137.434 -91.549 94.450 95.308 135.428-161.747 117.564 -78.120 153.511-146.266 125.352 118.237 151.009 -17.102 96.235 -44.398 94.816 -97.203 91.216 -45.704 112.381 -75.836 90.430 -48.291 116.309 -57.196 90.162 -47.770 113.136 -74.448 92.242 -38.343 127.513 -75.974 92.607 -40.817 101.323 -79.350 90.076 -52.847 142.270 -42.181 89.366 -46.655 137.487 -75.094 90.318 -44.043 128.211 -76.267 91.566 -54.343 116.546 -59.483 91.951 126.286 131.283 -76.941 94.172 44.103 140.442 -95.489 92.125 51.091 122.980 3.664 93.462 109.491 141.675 -37.589 91.202 64.106 133.670-153.996 97.517 80.887 97.807 -79.365 92.372 0.000 129.399 -75.767 # 684 total E -1.47160E+02 rmsd from N 0.000 %NC 0.00 93.024 -59.619 126.527 -70.720 121.103-100.361 138.156 -37.670 95.223 38.359 105.869 -80.367 93.679 51.443 130.448 -77.386 92.734 43.901 150.695-140.145 91.600 44.299 71.390 -99.856 90.529 43.869 115.664 -68.039 90.422 46.024 128.713-100.931 90.089 56.944 141.302-130.386 90.001 86.068 101.685-125.397 92.951 -64.016 128.145-119.142 101.529 -58.495 90.769 -92.831 92.013 -62.034 138.719 2.252 128.536-140.990 173.862 -1.038 117.326-106.550 137.695-150.831 92.524 48.018 148.504 158.862 90.369 50.864 131.933 -84.311 89.522 54.608 148.189 18.723 89.882 43.404 146.985 -71.053 90.592 46.695 107.384 -82.304 87.681 70.521 0.000 0.000 89.593 48.069 100.784 -83.129 90.316 42.913 150.593 -71.514 92.251 41.845 117.109-126.739 89.887 53.057 113.891 -77.307 90.031 51.303 136.488-107.134 92.027 42.769 134.386-113.939 95.197 24.976 143.597-132.711 116.368 19.863 154.347-125.383 131.922 -86.444 118.033-115.563 137.395 1.109 121.727 -84.078 98.510-150.340 120.059 -48.100 95.421 52.662 113.227 -73.395 91.181 45.348 129.381 -76.194 91.134 43.436 146.508 -18.797 92.771 40.994 121.838-103.650 91.653 47.830 130.516 -95.273 91.224 59.480 128.092 -77.121 93.063 68.221 90.365 -80.292 90.557 -92.555 128.576 -75.588 92.592 -38.967 141.483-110.549 89.004 -53.575 122.645 43.102 90.401 -53.868 153.328 -99.523 90.540 -52.074 101.682 -90.740 93.219 85.944 105.052 -78.885 92.487 0.000 128.916 -76.395 # 685 total E -1.49214E+02 rmsd from N 0.000 %NC 0.00 93.035 150.461 139.295 -90.232 92.942 55.612 140.149 52.061 91.499 46.655 106.771 -82.784 92.453 45.097 130.066 -76.853 94.513 42.553 152.603-137.020 92.695 43.417 55.013 -70.641 90.985 45.766 122.714 -24.011 89.722 47.245 127.453 -99.351 90.974 47.355 125.160-106.486 94.560 114.770 92.060 -97.730 102.764 -45.452 136.680-113.994 97.006 -50.109 94.030 -91.169 92.206 -50.733 142.198 -17.433 127.324-124.472 170.777 -2.130 107.190-124.817 141.393-160.216 95.610 46.870 139.792 142.837 91.755 46.521 134.814 -84.443 90.456 51.268 126.182 -66.051 90.602 50.611 131.135 -32.096 91.391 42.451 144.618-150.905 90.654 45.435 0.000 0.000 90.041 59.263 105.722 -84.159 86.819 48.067 142.405 -81.749 89.660 43.039 118.697-127.500 89.676 52.983 110.871 -74.365 89.280 46.857 138.432 -96.712 92.260 52.864 131.965-145.019 95.886 -83.676 104.758 -85.187 117.562 166.535 161.187-150.673 106.491 -24.769 93.845-102.586 95.915 -55.250 113.755 -78.912 92.981-125.053 133.210 -54.903 89.598 62.589 120.818 -75.741 90.890 47.097 129.133 -75.877 90.491 41.299 102.544 -78.101 90.880 48.641 139.493 -38.119 90.063 47.195 144.502-100.917 90.287 44.497 128.447 -77.082 90.585 53.967 112.248 -48.294 91.626-120.669 128.795 -77.177 94.877 -29.942 140.495-115.181 97.410-119.570 121.947 11.276 95.078 -82.549 144.103 -42.953 91.912 -6.365 138.239-145.268 112.884 49.135 101.333 -80.599 92.414 0.000 129.532 -76.096 # 686 total E -1.50668E+02 rmsd from N 0.000 %NC 0.00 92.651 105.725 132.817 -76.492 92.844 56.287 128.856 -49.361 93.602 45.963 104.975 -80.527 92.316 42.936 128.450 -74.687 92.006 47.986 106.467 -77.078 88.249 43.729 98.087 -71.626 88.754 47.528 110.349 -89.459 89.976 45.629 124.468 -96.478 89.374 54.512 146.894-152.354 89.256 175.192 86.216-100.517 122.761 69.836 150.524-151.145 96.043 45.873 94.642-120.155 91.982 47.656 105.912 -84.508 91.517 66.799 139.236 -93.810 88.366 46.037 129.607-138.045 92.940 48.456 132.496-103.769 98.860 -80.134 119.349 -60.203 117.196 177.869 135.989 -48.566 96.743 62.580 145.490 -48.760 92.343 45.491 142.129-165.569 92.294 41.778 0.000 0.000 91.720 50.351 113.490 -82.173 88.653 45.593 144.062 -84.013 90.152 45.372 119.029-128.094 89.734 48.293 107.999 -75.820 90.083 47.261 133.780 -81.781 93.769 41.538 135.017-138.418 95.386 40.144 152.942 -21.258 98.772 50.386 115.058 -87.075 138.123-178.401 108.154 -96.398 95.978 43.117 115.231 -77.507 91.581 49.631 99.001 -9.731 88.886 55.070 119.381 -3.316 89.422 50.113 129.602 -76.732 87.969 43.499 103.575 -81.942 90.431 48.394 143.919 -37.939 88.417 50.492 163.862-149.615 89.453 42.782 128.225 -76.772 88.208 51.078 112.236 -40.301 89.277 50.976 127.414 -75.955 89.966 45.255 140.772-145.490 91.577 50.337 128.918 -41.111 93.552 -96.161 131.444 -67.929 112.838 78.260 110.020 -84.609 136.521 -1.391 106.745 -82.863 92.442 0.000 128.991 -76.308 # 687 total E -1.49228E+02 rmsd from N 0.000 %NC 0.00 93.229 163.699 141.270-101.584 93.731 52.650 130.758 39.880 91.017 45.358 104.895 -80.315 91.557 50.409 131.158 -77.420 91.115 46.175 151.240-141.447 91.734 44.177 59.701 -67.998 89.682 46.558 129.182 -31.615 88.891 52.489 123.021-115.510 87.440 47.232 126.245-119.979 91.419 80.084 84.904 -98.393 91.719 -57.993 144.558 -95.965 106.553 -70.187 93.803 -87.385 87.959-111.354 107.909 -80.168 96.041 -73.137 134.790-132.828 91.918-114.579 151.457 -37.889 89.558 55.080 135.897 107.652 91.122 49.322 136.794 -82.507 90.479 47.171 130.305 -53.732 90.821 45.698 136.005 -16.986 90.514 46.771 109.117 -82.185 89.677 47.823 0.000 0.000 89.349 48.164 108.347 -84.117 90.239 45.025 135.616 -77.798 90.641 45.237 123.369-122.730 88.898 50.651 114.469 -78.063 90.295 51.702 134.762-105.015 91.167 44.164 131.718-148.940 94.901-104.659 142.624-123.374 109.082-165.527 152.147 -18.984 103.673 -54.104 97.723 -98.163 102.528 -28.396 112.899 -77.813 92.644 -48.288 110.098 -50.951 91.427 -45.154 114.329 -73.144 92.117 -51.698 128.425 -76.013 90.738 -29.724 132.164-132.990 96.802-117.254 125.110 -1.533 97.235 53.548 145.853 -33.246 91.022 49.626 132.242 -79.353 91.997 117.424 126.412-109.986 90.868 -53.043 130.551 -78.455 91.506 -47.356 145.850-130.923 88.140 -51.198 118.829 1.776 91.091 -58.566 144.880 -33.624 89.476 -39.992 141.726-136.010 98.892 54.921 104.388 -78.936 92.288 0.000 129.802 -75.487 # 688 total E -1.47203E+02 rmsd from N 0.000 %NC 0.00 93.310 -86.688 126.254 -74.050 93.074 -52.359 117.906 -70.777 92.659 -40.857 103.269 -76.914 93.129 -45.769 126.424 -74.551 99.366 -14.258 156.346-160.101 106.127 -37.457 59.403 -72.341 96.999 -21.812 138.538 -32.327 106.612 -34.499 138.571 -88.647 100.161 -37.147 147.240-163.828 91.367 -52.433 86.889-103.244 105.397 114.050 149.535 -11.857 104.907-143.658 97.302 -91.476 104.022-163.295 107.982 -86.007 119.794 -64.807 140.474-107.233 92.742-119.820 107.696 -86.704 91.830 50.282 138.418 146.069 92.603 47.246 137.405 -85.581 90.689 46.720 134.996 -30.071 90.508 50.236 118.766 -35.699 88.865 49.386 148.192-144.934 90.958 42.770 0.000 0.000 90.782 47.884 123.488 -77.600 90.212 45.191 138.939 -89.388 89.319 47.310 119.877-126.550 88.252 51.185 110.605 -80.488 90.065 50.845 136.536-101.675 90.545 45.243 128.926-156.157 93.842-104.966 103.795 -82.626 107.809 173.614 150.612 -15.766 106.070-157.698 90.165 -88.049 93.187 51.317 115.108 -76.539 93.179 45.024 102.998 -15.122 92.204 43.754 126.527 -3.656 89.820 49.679 129.554 -76.698 88.240 49.875 102.245 -85.632 90.796 42.836 129.302 -38.226 93.226 37.984 134.995 -72.659 94.687 42.626 128.726 -77.090 92.923 52.503 104.731 -75.388 92.973-173.565 129.132 -77.279 93.838 35.205 141.349-116.153 98.882-139.280 133.148 -17.090 122.333 120.716 158.695 -12.717 95.913 76.869 140.402 166.057 94.065 91.444 99.804 -79.682 92.467 0.000 128.934 -76.398 # 689 total E -1.46901E+02 rmsd from N 0.000 %NC 0.00 93.397 -65.615 126.691 -75.704 94.252 -49.343 116.414 -78.060 91.064 -45.876 103.682 -77.745 90.752 -47.029 128.163 -75.584 91.660 -39.403 139.303-121.741 95.746 -40.481 62.525 -67.312 92.670 -38.216 127.417 -34.323 101.392 -37.710 166.785-166.263 90.542 -67.863 136.848-104.939 89.805 66.480 104.664 -91.290 137.167 177.814 134.666 -88.448 96.263 73.043 125.260-146.451 98.924 105.946 104.000 -80.307 93.105 -63.682 142.530 -44.117 94.836-124.664 143.428-137.098 91.564 47.864 137.352 127.779 92.235 46.840 134.698 -85.536 91.091 44.825 144.759 -24.388 91.279 49.007 134.266 -27.746 89.023 46.822 141.785-148.618 90.266 47.417 0.000 0.000 88.856 51.661 114.907 -75.959 90.080 45.067 128.666 -80.970 88.687 46.063 123.262-118.623 89.204 52.161 106.608 -81.635 89.323 55.228 134.205 -93.118 90.145 40.224 130.345-137.431 95.247-118.042 104.120 -81.792 96.997 179.953 149.706 -13.742 109.349-140.154 87.674 -84.924 92.125 53.836 115.231 -75.839 92.812 44.791 100.405 -10.787 90.666 46.105 125.323 1.100 89.940 46.758 129.820 -77.267 89.409 45.754 103.635 -85.159 88.939 47.766 120.914 -24.004 89.263 46.825 141.083 -53.879 90.519 44.189 128.071 -76.841 89.291 58.740 119.093 -94.637 89.921 114.048 128.146 -76.240 89.613 57.546 144.696-172.538 92.136 69.538 131.919 -50.493 88.308 -90.982 137.161 -53.532 93.293 -36.750 112.998 -82.037 107.153 -89.998 143.375 -10.617 92.752 0.000 129.323 -76.739 # 690 total E -1.49172E+02 rmsd from N 0.000 %NC 0.00 93.121 160.038 139.992 -95.479 93.044 55.797 139.396 36.742 91.863 45.662 106.596 -82.524 91.789 48.379 130.774 -76.840 93.808 42.297 148.094-133.034 91.932 44.639 57.368 -72.129 90.297 45.684 123.834 -34.911 90.323 51.514 127.244-101.807 87.270 41.372 133.413-124.547 95.629 103.520 80.310 -98.722 93.733 -42.992 155.607-103.314 103.930 -58.919 93.901 -92.923 92.978-161.166 106.898 -80.290 92.380 62.506 140.843 -93.342 97.320 33.478 108.435 -89.667 96.991 44.184 153.166 -92.151 96.985 43.574 138.206 -62.106 117.693 -90.035 158.015-100.636 121.553-109.890 113.576 -74.522 94.151 53.210 145.431-160.837 94.218 42.292 0.000 0.000 90.446 47.352 143.149 -15.874 90.024 57.116 136.720 -99.183 88.129 51.790 124.054-138.827 87.614 49.758 109.526 -72.799 90.800 46.144 137.009 -83.888 92.369 52.944 135.936-152.986 94.127 -91.888 101.977 -83.151 111.550 162.398 149.476 -23.171 107.192-174.525 90.827 -95.226 94.362 48.145 117.505 -78.064 92.010 46.740 104.001 -13.123 89.842 48.898 119.800 -15.652 91.401 44.514 127.967 -76.248 90.196 45.050 103.284 -86.362 90.488 47.694 115.438 -31.532 93.081 46.186 134.708 -48.139 91.125 37.819 131.352 -78.110 94.422 114.191 102.027 -97.388 90.659 -61.716 133.492 -99.388 91.221 -49.197 145.974-138.518 90.723 -47.472 124.521 -10.234 95.379 117.678 146.221 -31.848 103.512 26.790 143.472-164.263 100.123 37.038 105.609 -77.591 92.428 0.000 129.470 -76.235 # 691 total E -1.48059E+02 rmsd from N 0.000 %NC 0.00 124.325-104.265 146.528 -36.822 124.199-106.306 130.945 -42.521 92.600 45.287 105.849 -76.676 93.485 45.287 131.522 -78.097 98.458 37.840 156.559-146.046 93.439 40.270 52.006 -84.272 91.279 48.856 140.911 -48.630 91.715 46.737 137.261 -85.180 87.352 44.154 147.496-162.081 90.184 48.067 77.922-105.330 91.839 171.167 138.509 -90.678 89.227 74.171 108.182-153.243 92.368 47.410 102.801 -83.988 92.034 48.716 140.541 -28.845 91.561 40.700 112.800 -93.761 92.555 48.775 130.425-110.340 92.402 47.171 125.863 -72.361 92.365-126.493 117.816 -67.274 93.917 -57.450 137.565-106.659 94.070 113.391 142.164-142.838 98.209 40.712 0.000 0.000 90.455 46.928 141.678 -18.429 92.336 45.174 127.415 -95.606 91.453 52.039 121.071-117.189 90.973 40.426 113.782 -78.179 92.177 53.699 159.312 174.018 90.907 41.404 137.790 -87.482 94.276-119.385 148.155 -31.269 100.662-162.501 153.977-138.943 104.150-124.112 94.251 -98.047 92.392 62.743 112.928 -76.842 93.993 141.156 115.497-107.902 93.044 50.462 113.952 -74.058 90.967 46.421 128.600 -75.805 89.641 46.732 108.876 -86.559 90.498 45.445 127.220 -92.639 89.538 48.798 137.224-107.287 89.395 56.405 128.622 -77.296 88.558 66.086 96.585 -69.054 90.483-175.870 129.432 -76.656 92.303 54.232 140.305-106.201 89.899 52.830 126.488 -26.618 91.045 56.245 147.126 -27.692 88.762 39.502 140.836-149.309 95.814 74.291 103.253 -79.925 92.506 0.000 128.955 -76.657 # 692 total E -1.48566E+02 rmsd from N 0.000 %NC 0.00 93.076 160.257 138.571 -90.316 93.408 56.483 133.991 49.236 91.689 45.106 106.074 -81.636 92.025 48.003 129.542 -76.503 91.767 46.803 153.886-157.571 93.109 39.717 60.042 -70.273 93.633 42.656 125.658 -27.964 93.113 40.584 136.597-106.540 92.021 53.559 142.412 171.418 90.986 83.131 85.605-101.619 89.730 -78.318 131.933 -98.671 95.445 -45.999 94.176 -87.152 90.927 -51.194 145.707 -42.117 90.729 -50.734 142.663-111.730 91.650 -51.233 124.316-155.727 93.855 101.794 135.245-123.136 102.878-160.281 142.292 -86.516 145.862 -25.106 112.011 21.761 92.643 61.453 165.733-168.078 96.972 57.684 106.735 -82.228 116.264 -8.890 0.000 0.000 92.443 62.435 151.843-154.687 92.377 43.209 108.120-123.693 90.963 44.927 109.643-110.819 89.903 46.474 114.716 -77.961 90.957 51.148 132.795-100.740 91.287 44.734 131.539-143.162 93.729-117.675 106.569 -83.932 109.825 171.937 150.901 -15.495 123.841-137.569 118.997-123.752 93.664 59.222 114.538 -76.263 92.575 43.619 103.557 -50.678 91.134 50.339 115.997 -70.208 90.944 41.796 128.376 -76.534 90.351 47.103 105.569 -85.894 90.538 48.997 127.615 -85.472 89.208 53.077 134.869 -99.105 90.133 53.928 128.438 -77.034 93.376-177.549 88.558 -72.405 92.250 65.865 131.561 -76.938 91.528 42.958 140.418-103.065 89.422 54.612 130.209 -15.698 90.101 72.261 143.269 -43.578 86.198 46.248 140.569-152.552 94.553 119.466 101.730 -79.036 92.551 0.000 128.821 -76.298 # 693 total E -1.48265E+02 rmsd from N 0.000 %NC 0.00 93.346 -79.484 130.717 -88.236 94.553 -47.175 136.073-101.942 91.479 -50.953 139.235 -35.171 90.918 -44.498 127.184 -74.572 92.033 -45.776 148.406 170.965 94.126 -47.489 116.541-152.223 91.807 120.533 96.275 -84.201 97.891 43.609 119.123-108.954 87.975 51.472 146.196-170.713 91.301 86.568 81.856-102.926 88.632 -77.824 136.821 -97.395 98.150 -55.432 92.737 -84.557 91.265 -45.557 158.457 -19.541 125.192-135.289 156.175-168.631 107.305-117.439 134.703-142.916 96.821 38.615 142.799-104.093 92.848 47.432 138.429 -75.522 90.378 54.211 141.906 -89.897 92.052 49.892 124.079 -41.123 92.650 36.541 147.090-167.197 91.438 46.519 0.000 0.000 91.823 51.514 103.018 -86.891 89.252 45.405 147.143 -82.459 91.527 41.298 116.647-127.659 90.459 53.947 111.322 -76.996 90.286 65.952 139.995-100.996 89.405 37.316 133.330-162.325 95.454 49.395 143.824-128.691 119.905 29.485 156.342 -26.473 128.340 -73.491 113.025-108.791 95.988 -38.145 110.907 -77.941 89.442 -77.087 113.114 -43.258 89.293 -57.117 107.981 -76.151 93.303 -30.259 126.688 -74.605 97.488 -35.704 99.714 -79.278 103.153 -19.407 142.040 -14.988 105.746 -39.431 159.024 -19.939 94.717 -35.865 129.984 -77.407 98.239-138.147 99.595 -59.972 92.004 47.572 130.969 -77.392 91.784 51.578 141.903-112.069 90.901 49.366 123.011 -7.760 92.959-131.150 128.052 -75.602 97.339 35.138 106.259 -85.579 128.357 94.655 103.954 -74.454 92.569 0.000 129.925 -76.777 # 694 total E -1.51155E+02 rmsd from N 0.000 %NC 0.00 93.160 -71.230 126.336 -74.311 93.626 -51.342 112.029 -75.065 92.040 -41.576 103.276 -76.338 92.584 -43.875 129.440 -76.646 98.762 -21.481 139.563-122.970 103.576 -44.609 62.479 -70.054 91.093 -25.639 121.959 -48.912 110.091 0.896 166.039-158.206 147.600 164.299 163.829-147.476 112.835 122.311 133.737-108.341 145.075 -98.100 142.359-157.782 101.213 29.996 93.145-101.869 93.957 45.922 137.253-109.686 91.015 52.669 132.330-144.233 89.748 52.029 122.442-152.349 90.473 52.495 123.336-123.147 94.134 -75.724 131.487 -88.495 119.672-154.677 146.262 -88.703 96.555 43.165 155.984 -4.729 93.154 44.145 140.833-173.790 91.767 44.209 0.000 0.000 91.102 45.813 110.605 -85.120 91.888 44.348 147.395 -82.426 91.908 40.413 117.406-126.343 89.911 51.059 112.990 -78.248 90.644 52.602 135.763-101.452 90.512 47.881 137.243-134.427 90.884 43.461 114.732 -89.060 100.639 174.771 105.871 -79.853 94.148 56.655 132.713-158.773 90.440 50.384 113.785 -76.805 89.376 61.162 121.713 -18.760 88.312 50.739 111.552 -70.848 90.612 42.610 129.085 -76.408 90.293 44.017 103.359 -81.763 89.258 57.135 146.917 -34.178 86.819 51.390 151.745-131.310 89.202 40.365 128.071 -76.464 89.763 49.327 117.660 -35.305 89.552 47.581 129.051 -77.202 89.818 48.639 135.679-126.732 89.121 49.045 127.273 -39.735 89.231 56.400 139.793 -87.890 89.261 42.557 129.712-111.782 95.301 78.061 104.029 -80.406 92.534 0.000 128.908 -76.710 # 695 total E -1.53432E+02 rmsd from N 0.000 %NC 0.00 93.058 158.829 138.676 -90.520 93.004 55.297 124.187 -35.858 94.060 45.175 105.246 -80.524 92.641 43.800 128.539 -74.449 92.803 42.745 106.622 -83.872 90.859 44.768 87.061 -64.744 89.195 45.349 113.373 -62.394 88.392 47.489 130.802 -93.659 88.240 47.301 116.833-104.403 89.052 43.327 97.613 -96.844 92.582 57.041 131.983-100.023 99.765 -50.280 100.105-102.972 117.088 160.306 109.945 -86.686 148.561-161.926 169.968-165.428 105.274-117.444 142.580-160.349 94.483 47.404 140.366 132.414 91.104 48.131 134.464 -86.475 90.284 50.853 122.716 -70.061 91.602 48.672 124.030 -26.834 92.067 40.665 107.909 -82.595 90.806 48.129 0.000 0.000 90.450 55.263 105.751 -85.036 88.095 44.985 147.200 -76.334 90.560 42.549 117.874-127.685 90.156 52.030 108.585 -76.059 89.664 51.271 139.062 -87.912 90.418 47.167 133.676-142.693 90.462 49.023 142.059-128.767 96.215 179.290 106.049 -81.536 92.950 65.070 131.469-157.411 90.175 51.454 113.638 -76.465 89.990 50.888 148.701 -19.307 89.150 48.135 112.623 -75.468 89.472 47.960 128.558 -76.075 87.083 51.178 105.466 -84.610 88.710 48.605 135.055 -88.968 88.828 47.387 153.530-174.779 89.367 47.374 127.992 -76.345 86.953 77.401 100.345 -57.121 89.301 55.502 127.084 -75.231 88.283 44.528 142.163-115.438 91.947 53.284 126.728 -38.177 91.578-119.039 141.755 -84.795 98.822 72.799 137.221-140.503 135.738 18.129 105.845 -78.864 92.399 0.000 128.367 -76.018 # 696 total E -1.50408E+02 rmsd from N 0.000 %NC 0.00 92.795 136.856 137.542 -85.845 94.686 46.249 136.440-129.095 91.364 53.242 105.763 -81.029 91.192 50.135 127.848 -74.864 95.330 35.266 112.729 -85.483 97.001 40.586 150.079 147.984 95.348 38.401 106.275 -70.084 92.195 56.085 142.225 -86.174 90.334 67.373 143.735-141.353 87.231 124.074 119.099-172.046 94.536-116.960 125.308-123.929 93.719 53.731 95.462-119.079 95.290 40.649 103.147 -84.141 92.264 52.324 167.357-145.711 92.185 40.933 119.325-152.023 93.131 44.226 123.125-119.556 94.152 42.007 137.439 -79.956 97.148-119.474 146.560-113.121 113.744-105.348 116.010 -72.038 92.339 49.686 147.858-155.335 90.528 49.965 0.000 0.000 88.257 53.628 137.287 -20.537 89.134 47.997 140.323 -87.634 90.351 45.792 131.591-154.386 86.978 64.637 111.469 -74.554 87.779 61.003 130.451 -51.374 88.891 51.044 135.871 -44.775 91.361 42.863 141.814-125.788 96.390-110.675 107.369 -81.612 96.652 -49.357 96.288 -86.934 93.184 -54.906 110.450 -73.847 89.725 -43.320 130.031-154.186 91.620 -60.351 112.617 -73.782 91.681 112.164 130.331 -75.883 95.493 37.386 102.172 -82.310 90.463 54.888 138.953 -35.926 89.450 54.144 146.471 -29.106 88.500 44.251 128.668 -77.194 88.844 51.380 112.701 -38.817 90.040 48.426 129.288 -76.238 89.562 46.864 153.611-124.756 89.198 47.925 130.428 -44.937 90.091 54.101 134.469 -57.851 89.720 44.245 138.475-122.800 94.818 79.604 103.869 -80.646 92.542 0.000 128.735 -76.586 # 697 total E -1.51727E+02 rmsd from N 0.000 %NC 0.00 93.189 164.615 139.919 -96.790 93.532 54.372 136.738 33.700 91.906 47.349 107.118 -78.360 91.490 45.837 131.328 -77.574 94.842 46.483 146.492-126.196 93.263 37.466 54.888 -72.038 91.562 48.601 159.181 118.897 92.533 42.407 135.231 -98.842 90.601 43.824 145.123-144.403 89.700 52.340 77.954-112.800 90.262 140.821 137.189 -99.229 89.392 84.371 103.725-139.334 90.484 103.126 98.651 -86.146 92.031 -63.569 126.957 -92.161 98.495-123.906 136.808-144.470 91.292 49.919 138.102 121.214 91.410 47.565 133.439 -85.968 90.673 47.503 131.842 -44.826 90.539 47.873 132.177 -20.759 89.220 47.997 110.144 -82.571 89.291 47.467 0.000 0.000 89.188 51.717 117.254 -79.798 88.264 45.878 140.276 -88.388 89.504 46.082 120.822-129.551 88.070 52.539 112.425 -79.141 89.291 50.379 138.603-108.566 90.191 48.558 128.762-144.361 94.036 -97.944 104.141 -83.598 118.286 114.275 160.643-150.125 106.188 163.714 90.791 -87.739 102.185 34.911 151.954-119.120 94.772 48.537 129.448 79.260 96.750 107.321 111.877 -74.529 91.343 -67.358 130.133 -77.263 92.128 -37.463 106.882 -81.571 91.939 -93.313 103.350 -56.787 91.796 -56.728 145.356 -36.712 91.668 -35.085 129.039 -76.848 98.419-152.522 113.951-128.214 91.954 58.139 131.529 -76.705 91.153 42.548 140.240-105.866 90.749 45.951 129.746 -34.704 91.593 57.305 147.513-118.165 88.776 46.147 129.246-155.469 93.785 89.781 103.893 -80.413 92.529 0.000 128.827 -76.596 # 698 total E -1.48243E+02 rmsd from N 0.000 %NC 0.00 93.197 161.674 141.198-100.938 93.637 52.752 152.624 107.943 92.120 45.131 107.437 -80.898 92.600 50.936 130.809 -77.169 92.786 42.168 154.180-151.852 92.114 43.543 73.252-102.606 90.407 45.944 111.864 -77.226 90.160 52.535 136.734-103.361 86.939 55.763 143.761-176.219 86.512-159.677 78.681 -96.231 93.004 92.440 146.436 173.302 92.470 48.406 93.219-125.203 93.466 43.694 94.999 -74.783 93.643 43.743 147.962 -38.734 92.718 46.108 130.956-123.203 92.588 45.421 129.155-124.550 95.903-126.723 111.851 -98.575 95.299 -53.943 137.478 -96.469 97.247 143.220 142.951-147.838 136.804 -17.026 107.666 -81.805 95.854 49.577 0.000 0.000 92.105 45.980 113.064 -79.221 90.595 46.329 139.490 -76.033 90.431 42.537 121.082-124.255 90.395 47.247 109.787 -76.166 91.121 45.494 131.659 -86.955 94.700 38.482 137.499-137.476 96.884 37.108 144.491-134.283 99.088 21.727 144.531-115.683 126.686-172.538 120.925-126.118 95.357 57.330 115.297 -76.950 90.705 56.355 101.521 -23.493 88.740 58.059 106.091 -68.047 89.362 44.908 129.477 -76.851 87.675 46.115 102.367 -82.535 89.636 52.254 114.608 -45.497 88.546 45.067 138.682 -52.614 90.096 42.736 128.424 -76.648 89.738 53.074 110.306 -52.580 90.290 41.980 128.489 -76.645 92.180 49.318 137.733-138.506 92.266 66.479 127.821 -43.093 90.404-113.515 136.902-100.756 96.448 -9.860 106.417 -84.907 114.032-134.229 148.495 -14.804 93.084 0.000 129.134 -77.004 # 699 total E -1.54956E+02 rmsd from N 0.000 %NC 0.00 93.164 164.989 140.404-100.186 93.897 52.815 131.629 41.854 91.055 46.853 105.984 -80.488 91.601 46.793 129.816 -77.370 92.476 48.714 148.930-142.295 92.708 42.418 57.099 -68.315 90.435 45.932 131.844 -27.043 90.992 48.398 125.010-120.524 87.730 51.618 137.226-161.376 87.454 54.362 75.455-102.387 89.175 102.373 133.019 -74.772 93.733 43.750 96.193-107.138 94.962 55.933 103.065 -79.774 95.294 -2.760 145.348 -49.619 122.660-179.520 109.430 -83.614 98.480 40.260 146.551 125.182 93.896 44.344 135.569 -85.786 91.081 50.827 144.447 -59.960 90.358 50.629 129.642 -25.778 88.781 45.050 145.406-162.346 90.085 46.195 0.000 0.000 90.648 47.048 113.132 -85.281 90.156 46.695 142.289 -78.770 89.986 45.364 120.788-127.611 89.327 50.782 109.779 -77.384 90.766 44.039 136.075 -89.772 93.116 49.532 132.270-134.113 95.763 5.536 143.264-128.155 128.979-163.151 153.326 -9.286 94.465 66.728 133.901-160.537 90.693 46.321 113.675 -76.994 89.796 83.076 129.188 -73.025 89.556 57.596 110.062 -73.536 90.591 40.969 128.915 -76.232 89.321 47.338 109.489 -86.627 89.183 56.171 136.553-103.598 86.864 50.486 144.755-171.415 88.388 43.796 127.904 -76.155 88.878 51.674 106.707 -51.785 89.030 48.138 129.306 -76.658 89.745 45.808 136.815-129.225 89.396 51.993 127.390 -40.709 88.529 61.191 140.663 -94.157 88.523 47.853 132.625-128.287 92.688 93.776 102.296 -80.198 92.547 0.000 128.560 -76.829 # 700 total E -1.48432E+02 rmsd from N 0.000 %NC 0.00 93.138 -70.149 129.055 -82.812 94.817 -47.110 118.583 -74.659 90.890 -49.596 103.517 -77.780 91.123 -41.360 127.849 -75.399 91.589 -59.245 152.121-156.997 96.150 -35.909 90.883-106.926 97.825 105.313 91.397 -73.008 96.172 39.653 154.220 -92.632 90.391 56.189 152.615 169.889 87.578 49.472 75.523-105.570 93.799 146.487 130.267 -75.383 90.440 79.670 103.104-122.653 93.316 107.751 97.068 -83.273 92.623 -64.187 139.376 -53.981 95.241-124.611 141.209-137.453 90.794 49.552 139.425 126.368 92.125 46.906 133.105 -85.863 91.321 45.029 143.902 -13.094 90.013 50.586 137.922 -31.445 88.754 51.105 111.180 -83.063 90.611 41.627 0.000 0.000 88.989 51.349 122.868 -78.372 89.113 47.773 128.833 -87.899 89.113 45.418 124.505-123.232 88.700 47.542 111.073 -79.349 90.923 51.116 132.044 -97.863 92.269 52.662 132.366-127.623 92.380-108.817 109.824 -87.263 95.948 172.930 147.213-122.508 103.921 -35.064 90.995-108.867 106.056 -52.830 113.931 -81.200 110.588-110.921 132.145 -24.749 92.219 49.113 111.249 -72.970 91.703 48.376 128.837 -76.095 91.447 43.243 106.277 -85.956 91.103 46.304 142.494 -24.499 90.658 45.099 133.571-104.755 91.055 41.296 128.234 -77.094 93.111 91.455 117.030 -97.432 86.664 -78.489 130.147 -77.686 93.744 -43.449 146.779-141.876 90.513 -43.776 123.182 -10.201 91.618 -59.606 148.827 -43.699 90.472 -52.085 136.555-169.976 94.604 67.622 100.995 -79.794 92.425 0.000 129.082 -76.502 # 701 total E -1.46995E+02 rmsd from N 0.000 %NC 0.00 93.311 167.798 141.027-102.197 93.655 53.165 140.426 19.912 92.091 45.380 106.030 -82.815 91.822 49.210 130.777 -77.226 93.352 45.229 139.306-115.524 90.327 44.492 61.529 -75.512 89.845 47.115 124.954 -42.113 91.076 46.990 117.372-102.624 87.903 44.567 141.128-127.103 93.623 89.296 82.064-102.908 91.497 -61.965 146.514-104.729 103.124 -66.881 91.986 -89.754 90.257 -74.485 111.077 -78.394 116.929-157.183 145.745 172.534 114.934-101.249 143.832-159.721 94.456 44.599 142.096-107.091 92.372 46.093 136.445 -74.102 90.815 49.206 128.781 -71.429 91.389 47.532 147.639 -23.467 93.024 41.009 151.830 -10.683 90.463 45.749 0.000 0.000 89.931 60.235 101.311 -85.931 84.713 54.580 146.737 -79.023 88.628 38.484 121.609-138.061 93.654 65.816 109.728 -76.001 90.702 -53.533 152.187-107.556 118.312 -70.057 142.642 -98.991 94.749 -25.240 144.150-128.673 100.573-169.898 151.362 -9.845 100.331-167.498 94.669 -95.886 92.294 46.477 114.904 -77.347 92.049 46.904 104.028 -9.302 92.356 43.500 125.576 7.136 91.414 43.175 129.967 -76.862 89.626 46.398 103.628 -85.722 89.278 54.398 120.028 -12.450 88.246 43.796 135.147 -57.873 91.442 45.776 129.193 -77.003 92.586 126.349 119.429-115.980 91.510 -44.076 130.384 -78.195 92.282 -45.190 144.041-129.300 88.121 -50.061 123.376 -3.654 91.434 -53.540 162.427 -17.348 89.929 -45.297 136.596-134.144 95.232 102.841 104.809 -79.797 92.528 0.000 128.887 -76.477 # 702 total E -1.50209E+02 rmsd from N 0.000 %NC 0.00 93.105 -63.700 128.614 -81.343 94.402 -48.108 115.805 -79.976 91.166 -45.601 103.400 -78.048 90.342 -48.493 128.758 -75.782 92.389 -36.780 136.690-124.850 94.163 -42.608 60.606 -60.128 91.658 -37.394 129.257 41.107 100.725 -41.890 141.191 -99.751 92.552 -48.506 134.020-107.618 91.757 109.294 115.355-124.660 115.688 144.010 148.673-162.315 90.415 68.540 97.059-147.418 93.866 122.033 96.977 -84.535 93.459 -59.888 134.242 -92.993 97.546-118.522 109.682 -86.099 91.722 49.865 144.626 148.423 92.482 47.039 136.385 -86.026 90.811 47.276 142.300 -51.804 89.829 50.041 126.518 -39.045 89.271 48.198 109.280 -82.857 90.813 43.189 0.000 0.000 89.673 49.460 126.991 -98.263 88.871 49.081 136.283-104.187 89.352 45.384 120.629-132.118 88.692 48.268 112.297 -75.616 90.228 49.334 135.805 -98.652 91.776 48.592 131.472-136.874 93.073-102.379 141.285-121.530 114.802-171.370 157.944-147.076 124.377 -52.601 110.564-109.895 98.657 -33.687 110.311 -78.669 92.657 -46.280 109.343 -50.793 90.163 -47.856 113.517 -71.356 91.903 -42.602 129.510 -76.864 92.860 -37.807 103.537 -81.381 90.916 -66.296 108.246 -35.369 94.403 152.670 149.057 5.484 90.036 78.120 128.959 -76.969 90.766 54.848 137.032 -95.410 90.874 43.781 130.014 -75.427 91.682 42.884 146.304-159.020 91.075 47.731 129.537 -49.265 90.294 51.571 131.593-105.911 90.731 43.773 133.254-140.516 95.442 72.012 103.968 -80.707 92.523 0.000 129.008 -76.788 # 703 total E -1.51377E+02 rmsd from N 0.000 %NC 0.00 93.008 -64.582 124.200 -69.419 94.020 -52.519 115.668 -74.716 92.245 -43.064 103.700 -77.887 91.116 -47.516 127.806 -75.633 89.793 -41.761 138.686-122.128 92.451 -42.580 63.259 -68.708 93.347 -38.722 130.204 38.586 103.152 -31.989 171.592-179.067 93.119 -53.290 123.542-119.747 89.933 -79.288 83.858 -81.943 106.894-176.393 156.455 157.173 95.861 -56.671 96.515-112.385 101.768 169.322 102.462 -81.506 106.174-112.947 168.372-153.496 105.032-117.044 137.977-160.967 93.521 45.028 143.984 145.450 91.857 46.536 134.287 -85.906 90.622 48.377 124.924 -69.352 90.349 51.190 131.517 -37.568 89.171 44.896 108.822 -82.438 89.622 47.401 0.000 0.000 89.103 51.051 124.400-109.043 87.950 48.030 135.208-104.633 88.762 50.273 120.448-133.134 87.577 51.761 108.399 -73.880 89.666 50.295 133.939 -87.149 90.472 45.648 135.346-142.600 93.916 -96.718 105.762 -86.780 119.808-154.087 114.731 -78.546 105.614 -61.228 117.983-129.738 92.367 -43.779 112.772 -72.768 93.641 -72.309 111.594 -62.639 89.965 100.019 130.637 -15.788 93.860 47.226 128.639 -75.891 89.965 48.279 102.551 -69.108 89.917 49.899 117.422 -6.738 88.060 46.179 135.121 -59.066 90.290 49.855 128.092 -76.341 90.445 47.169 130.786 -51.157 89.926 44.725 131.123 -76.449 90.772 45.241 138.431-132.594 90.280 49.908 127.824 -43.007 88.687 53.725 137.691 -95.112 90.482 43.298 128.923-138.353 95.173 74.987 104.150 -80.552 92.513 0.000 128.971 -76.655 # 704 total E -1.53598E+02 rmsd from N 0.000 %NC 0.00 93.405 173.261 139.751 -99.073 93.211 55.269 142.201 10.682 92.669 45.333 105.404 -80.598 93.030 44.913 129.909 -76.807 94.477 42.592 130.929-106.688 95.301 39.377 55.354 -72.903 94.435 40.396 125.859 -29.572 94.382 42.558 137.203-102.261 90.089 48.718 136.520-136.372 91.660 67.995 80.262-100.010 91.388-169.808 132.959 -82.445 96.541 68.523 127.735-151.540 94.833 37.411 102.781 -83.583 90.487 53.734 147.179 -41.632 90.950 50.516 122.671-127.786 91.603 59.684 123.329-129.640 93.236 -9.575 131.920 -85.714 116.181 172.678 155.440 -88.264 107.027 31.147 144.078 19.787 91.167 55.883 144.169-173.120 92.053 43.075 0.000 0.000 92.831 43.365 112.897 -77.362 91.753 43.262 147.652 -80.112 91.458 43.697 116.894-125.029 89.860 49.086 113.357 -79.282 91.410 42.473 136.326-104.465 94.076 49.010 133.814-131.313 96.794 13.756 114.921 -91.228 138.136-156.024 118.291 -72.633 93.511 62.989 131.723-157.383 90.214 48.093 113.638 -76.797 89.656 54.612 111.393 -26.948 88.305 51.610 112.188 -69.793 90.275 43.088 129.060 -76.357 89.770 43.479 101.909 -81.412 89.110 53.439 141.202 -53.571 88.162 52.164 154.541-126.174 88.856 39.158 128.078 -76.526 89.848 50.122 114.041 -48.429 90.084 45.864 128.394 -77.243 90.393 48.778 138.687-126.992 89.448 49.492 127.589 -41.577 89.849 53.261 134.652 -84.451 90.330 43.919 135.906-128.777 95.329 74.569 104.216 -80.400 92.567 0.000 129.003 -76.651 # 705 total E -1.48175E+02 rmsd from N 0.000 %NC 0.00 93.119 -58.120 130.936 -90.950 94.820 -47.454 117.841 -79.874 91.108 -46.728 102.991 -77.370 90.512 -47.380 129.399 -76.176 91.469 -41.824 143.450-137.012 93.317 -43.889 61.536 -71.029 91.327 -44.762 132.267 17.228 109.116 -77.539 167.726 149.446 108.419 -13.558 118.817-104.095 101.046-144.234 89.749 -80.645 109.434 75.426 143.163-174.261 96.552 38.798 92.070-120.762 92.605 47.519 113.894 -88.270 90.260 62.315 143.767-128.075 88.934 50.777 127.223-135.713 91.741 51.230 130.705-107.100 96.836 -77.411 124.636 -67.813 116.285-169.929 146.062 -64.298 97.883 51.504 154.872 -31.341 92.734 43.917 141.350-171.329 91.613 43.325 0.000 0.000 91.815 49.261 110.871 -85.346 88.780 45.517 148.325 -83.084 89.753 44.897 117.579-129.423 88.723 52.378 110.440 -77.526 90.010 43.831 142.291-100.227 93.357 45.017 130.251-135.235 96.739 -10.626 114.286 -91.604 131.056-133.904 112.673 -72.739 95.960 97.858 136.692-163.589 90.823 49.866 113.620 -76.377 89.343 65.098 132.979 -46.801 87.770 51.619 106.389 -70.899 89.876 42.330 127.844 -75.673 90.406 47.647 102.977 -83.404 90.697 45.198 123.040 -73.658 90.713 45.672 131.477 -85.156 90.992 47.268 128.383 -77.033 93.028 77.870 96.694 -66.742 89.591 -83.693 129.698 -76.590 94.842 -45.184 144.025-118.634 93.623 -39.263 115.374 25.632 93.546 -52.593 143.935 -46.788 92.077 -42.389 139.939-166.527 97.778 61.333 104.880 -79.759 92.434 0.000 129.127 -76.305 # 706 total E -1.46467E+02 rmsd from N 0.000 %NC 0.00 93.308 173.572 138.849 -95.628 92.744 57.782 146.401 19.167 92.796 43.605 105.578 -82.888 92.332 50.307 131.053 -76.691 92.460 44.015 140.312-119.410 89.636 43.431 65.532 -79.065 91.783 44.554 120.422 -50.771 91.661 41.301 135.342 -94.555 90.500 46.071 141.979-145.438 92.485 85.319 85.000-104.840 89.763 -60.022 144.713-113.334 103.659 -73.443 93.472 -93.715 91.341-120.908 147.427 4.781 106.649 -73.834 145.607-130.732 99.505-111.748 138.090-157.565 93.757 44.329 156.390-164.460 92.178 47.390 135.660 -82.596 90.513 49.850 128.707 -61.902 90.346 50.127 118.291 -56.095 90.030 43.766 146.220-152.524 92.995 39.418 0.000 0.000 91.660 50.987 132.482 -99.457 87.535 45.022 130.104-121.044 90.629 44.192 115.586-130.224 88.898 49.997 114.629 -74.468 90.256 44.014 140.987-110.647 93.093 55.247 132.168-125.961 93.914 -62.282 141.437-122.164 125.304 104.618 153.159 -16.769 125.445 122.560 118.414-120.670 94.831 39.477 136.581 160.022 93.350 115.226 134.842-104.452 95.950 -29.462 114.481 -77.714 94.933 -56.954 127.465 -75.715 98.785 -13.491 101.541 -79.457 103.010 -47.210 142.638 -49.166 90.368 -45.642 157.406-128.154 93.726 -49.394 129.998 -77.018 98.108-111.913 124.209 -21.206 93.197 43.722 128.655 -75.871 93.901 53.762 147.039-101.865 90.311 48.321 132.574 -42.786 96.248-178.367 107.918 -56.773 92.446 34.233 144.039-148.272 117.255-153.541 103.069 -77.058 92.935 0.000 129.598 -76.199 # 707 total E -1.50138E+02 rmsd from N 0.000 %NC 0.00 92.820 144.533 136.843 -82.344 93.597 50.480 114.542 -21.752 93.161 45.750 105.974 -81.387 92.809 43.859 127.916 -75.483 91.034 49.499 108.848 -70.782 92.001 39.951 64.704 -60.608 90.405 44.978 119.608 -20.776 94.461 35.359 106.786 -88.153 96.486 36.971 126.241 -63.090 101.869 20.066 108.275 -90.918 105.877 34.527 151.091-138.545 101.516 24.792 89.574-108.773 97.257 47.263 117.331 -88.592 93.706 38.121 121.960-105.177 94.349 47.756 137.543-138.792 93.803 47.628 118.142-124.501 98.987 -79.807 150.977-118.043 125.376-108.736 152.056 -67.150 124.771 16.993 149.620 69.481 95.236 50.529 142.037-174.853 92.026 42.114 0.000 0.000 92.452 50.162 106.236 -84.836 87.982 44.096 147.859 -79.904 90.791 46.221 117.101-127.804 89.888 48.510 107.725 -76.127 89.154 48.169 136.190 -81.858 93.236 44.111 133.408-136.008 94.151 39.485 143.435-131.172 97.718 44.915 114.959 -87.915 137.457-178.742 106.948 -96.051 97.135 43.083 115.438 -77.606 92.460 48.001 102.667 -14.034 90.132 52.121 129.864 -22.333 90.350 49.509 129.198 -76.695 88.094 44.794 101.971 -83.049 91.247 47.144 133.815 -47.157 89.702 48.870 142.788 -92.597 89.775 44.989 128.367 -77.061 92.279 82.867 113.716-100.199 86.823 -82.712 129.863 -77.546 92.437 -47.608 145.035-134.293 86.593 -55.738 109.932 16.553 90.958 -60.652 140.441 -31.412 88.459 -29.634 142.172-130.108 108.675 104.730 103.461 -78.293 92.411 0.000 129.807 -75.807 # 708 total E -1.46513E+02 rmsd from N 0.000 %NC 0.00 93.102 -69.367 125.215 -70.867 93.663 -51.358 111.177 -74.295 92.323 -40.102 103.848 -76.503 93.256 -43.802 128.193 -75.790 97.337 -20.810 139.321-115.403 106.900 -37.294 59.286 -73.473 93.140 -25.936 120.711 -45.733 111.257 -23.621 164.693 -88.373 103.877 -95.668 131.016 -96.859 90.085 51.781 94.902-100.161 103.756-178.110 137.778 -98.001 95.028 80.041 127.178-151.531 94.767 106.699 100.266 -83.227 92.272 -69.266 136.177 -81.122 104.077-114.957 137.661-144.310 91.246 48.560 154.669-107.407 91.212 48.987 134.995 -79.469 89.552 50.033 155.385 -30.076 89.834 47.780 116.394 -77.896 87.869 50.631 144.447-159.189 88.420 51.179 0.000 0.000 89.804 45.589 155.188-132.150 91.857 39.883 136.732 -93.315 90.710 45.003 118.370-122.808 90.222 50.955 110.763 -78.570 89.860 50.234 131.745 -96.589 91.976 35.652 130.079-140.939 102.953-120.943 105.264 -81.175 103.580-178.093 151.823 -17.339 109.824-116.170 90.865 -87.774 94.586 49.265 115.338 -76.336 92.339 43.413 97.992 -14.172 89.740 50.874 133.506 -3.385 90.233 46.747 128.278 -76.386 89.964 41.651 102.602 -84.301 89.874 48.975 125.090 -31.870 91.435 44.389 137.315 -53.052 91.270 43.400 128.276 -76.509 91.181 53.590 112.440 -94.880 93.378-123.456 128.228 -76.418 97.095 -19.242 141.160-120.377 97.535 -66.366 120.136 8.656 107.980 137.298 159.020 -14.978 96.270 35.938 135.152-141.494 119.125 102.068 98.489 -73.764 92.474 0.000 129.623 -76.578 # 709 total E -1.46842E+02 rmsd from N 0.000 %NC 0.00 92.822 144.370 135.787 -80.679 93.521 50.964 117.016 -20.271 93.393 44.793 105.834 -83.277 93.282 45.023 128.070 -76.038 90.668 51.239 107.561 -68.905 91.953 41.371 74.607 -68.082 91.224 42.860 132.601 -58.412 96.122 37.937 100.872 -97.693 90.931 46.101 138.616 -77.569 90.301 42.547 93.845-102.803 93.016 46.262 134.601-108.699 98.420 24.154 92.450-101.495 99.919 115.488 132.762-103.872 144.981-138.398 160.935-162.661 97.595-119.539 151.206 -35.584 93.783 47.132 140.542 145.208 92.976 46.313 135.778 -84.240 91.272 44.727 116.127 -45.087 91.934 53.250 102.771 -30.169 88.554 47.237 107.877 -80.996 91.612 43.725 0.000 0.000 93.393 43.921 115.486 -79.510 90.830 43.931 155.346 -89.353 90.852 45.627 114.040-130.958 88.304 54.039 114.560 -78.934 89.669 53.287 141.729-115.112 89.962 41.761 125.236-159.126 96.117-101.797 143.419-124.866 113.701-173.015 152.745 -17.445 106.026 -47.211 96.693 -96.897 109.597 -25.673 115.138 -78.097 94.095 -46.560 112.573 -54.952 94.612 -39.986 109.170 -72.560 91.739 -51.962 128.524 -76.689 89.723 -35.409 129.132-128.839 96.079-111.333 125.682 -2.466 93.880 53.923 143.766 -30.512 91.418 46.968 130.724 -78.066 92.295 123.247 123.487-123.233 90.612 -54.197 130.779 -78.447 90.937 -44.645 145.351-116.696 90.198 -43.996 122.397 -1.089 92.577 -50.825 151.246 -29.307 91.449 -42.662 142.732-151.357 96.383 91.422 104.435 -79.272 92.410 0.000 128.977 -76.367 # 710 total E -1.47753E+02 rmsd from N 0.000 %NC 0.00 93.524-170.283 139.892-101.658 93.949 51.249 139.776 0.305 98.040 38.072 107.317 -82.663 94.792 40.634 128.623 -75.696 91.943 50.684 109.715 -77.292 91.048 43.805 65.064 -66.016 89.980 43.753 151.329 -27.205 90.711 43.585 104.742-103.040 88.853 52.451 118.387 -74.703 87.016 52.339 104.225 -96.759 88.790 28.369 133.281-113.775 117.948 -4.583 105.040-106.099 126.696 105.450 106.293 -83.624 94.401 -57.077 157.323-131.255 101.874-119.167 137.094-157.110 94.033 42.626 146.617 141.582 92.492 47.257 135.348 -84.542 90.138 48.443 127.821 -55.672 92.231 52.537 135.697 -42.130 90.116 40.864 142.595-165.980 90.284 48.334 0.000 0.000 90.235 58.024 107.556 -80.788 88.330 45.704 141.870 -77.978 88.763 44.159 118.137-124.381 90.316 51.679 107.701 -80.810 89.488 53.763 144.684-102.802 90.271 42.601 132.104-149.202 94.834-109.055 103.853 -82.159 103.463 176.120 150.199 -15.148 110.458-154.514 87.475 -85.047 92.650 52.017 115.131 -76.174 92.591 46.563 100.821 -5.981 90.923 45.479 122.302 1.605 89.089 50.850 130.942 -77.460 87.971 48.423 104.872 -86.406 88.794 45.019 116.737 -19.397 89.813 47.521 139.258 -48.228 90.886 43.964 128.566 -77.181 91.721 125.820 114.589-101.726 91.689 -47.773 131.086 -78.691 94.066 -43.780 143.403-155.487 94.480 -99.115 122.768 10.563 94.731 68.361 159.519 -23.634 91.792 50.552 141.673-174.753 94.060 57.739 100.813 -80.670 92.480 0.000 129.255 -76.390 # 711 total E -1.47481E+02 rmsd from N 0.000 %NC 0.00 93.134 164.828 138.441 -91.542 93.291 58.007 136.932 44.777 92.477 42.363 106.591 -82.703 91.820 51.729 131.007 -76.704 90.296 43.663 153.424-151.515 90.789 45.026 64.990 -70.768 90.696 45.471 118.864 -39.627 88.800 47.155 144.147 -99.258 88.847 51.295 133.103-131.656 86.847 52.218 86.853-104.540 89.572 52.986 140.430-108.605 96.967 60.868 119.686-135.953 87.459 87.546 106.747 -89.685 92.301 -55.004 123.851-105.444 121.080-120.723 144.334-158.752 92.895 52.076 138.929 118.462 89.513 52.399 135.810 -86.690 88.596 72.331 137.070 -77.881 89.318 49.235 127.731 -28.006 91.170 40.331 146.176-166.056 89.948 51.150 0.000 0.000 88.828 58.554 103.347 -81.809 87.101 45.240 141.331 -74.157 90.181 43.171 120.613-125.790 90.771 48.909 107.869 -75.404 89.419 48.158 135.985 -82.202 93.283 41.211 136.020-135.908 94.565 42.653 143.490-132.039 97.413 37.946 139.760-103.945 135.844-176.164 110.357-102.501 95.522 42.589 115.203 -77.245 92.358 48.412 103.231 -7.705 88.892 51.192 135.269 -6.912 92.354 44.787 128.947 -77.157 90.642 38.978 103.767 -83.382 90.500 63.964 114.741 -25.134 88.057 61.240 137.386 -49.672 88.441 35.874 128.731 -76.804 92.883 116.434 109.854 -38.960 91.933 -43.711 130.942 -78.285 93.504 -57.321 132.989-175.743 91.384 -54.963 132.979 -38.301 91.385 118.530 115.294 21.906 92.784 33.667 112.288 -82.204 115.048 -90.481 107.610 -70.588 92.887 0.000 129.352 -76.510 # 712 total E -1.51132E+02 rmsd from N 0.000 %NC 0.00 92.973 146.625 140.936 -95.421 93.061 56.265 134.892 50.913 91.704 44.421 106.047 -81.802 91.794 49.136 130.083 -76.421 92.131 44.535 152.783-159.020 90.582 43.560 60.677 -70.562 92.006 44.861 124.450 -33.597 89.428 45.063 147.197 -90.194 90.390 47.347 132.826-119.313 90.099 44.156 80.885 -98.261 91.590 159.227 133.346 -77.014 95.249 70.968 134.573-161.816 88.717-136.904 97.985 -84.560 103.378-140.620 151.254 171.082 109.522-110.218 132.874-146.442 92.960 42.333 141.023-109.102 91.464 48.350 133.011 -72.452 90.692 49.435 108.932 -12.613 90.920 42.204 143.825 -54.054 95.785 32.139 108.537 -81.878 101.941 28.445 0.000 0.000 99.735 36.770 160.468-164.541 94.378 40.184 131.241-121.346 91.763 44.502 115.125-129.180 89.894 47.364 109.402 -76.596 89.863 48.369 133.471 -85.232 93.962 37.578 131.675-137.644 96.648 43.277 113.784 -89.823 98.348 52.652 143.300 -96.569 131.170-134.033 118.166-117.910 118.640 39.859 118.307 -80.556 90.929 -74.630 108.705 -49.784 87.110 -58.186 109.924 -70.866 91.619 -41.136 127.161 -76.057 88.647 -50.283 101.556 -84.050 88.028 -78.103 108.299 -63.473 86.898 -49.861 154.575-100.261 90.575 -46.995 127.969 -76.233 95.217-132.270 118.741-113.535 89.783 53.048 132.347 -76.623 90.093 46.690 140.578-106.220 89.929 54.932 110.577 -9.046 90.772-110.559 140.151 -57.625 112.991 -17.896 107.763 -90.002 108.867 122.436 102.182 -72.603 92.648 0.000 129.394 -76.794 # 713 total E -1.46864E+02 rmsd from N 0.000 %NC 0.00 93.211 -67.498 129.677 -84.441 94.465 -47.536 118.473 -80.032 90.997 -47.448 103.184 -77.294 90.488 -46.756 129.732 -76.288 92.312 -40.713 142.713-139.316 93.406 -45.406 62.277 -63.364 89.156 -46.777 133.785 19.184 108.677 -95.880 167.191 170.437 104.018 -36.845 114.900 -94.418 92.064 95.918 92.487 -69.937 88.185 71.789 152.220 -82.519 92.856 34.138 96.239-116.251 95.992 55.753 105.609 -84.212 94.717 3.512 140.228 -91.845 121.103-178.945 108.044 -87.707 97.391 43.375 145.836 144.578 93.955 44.619 135.670 -85.381 90.494 50.798 138.460 -56.774 92.196 51.507 112.960 -29.664 90.794 41.109 149.747 -9.178 89.513 49.836 0.000 0.000 89.999 59.040 106.894 -83.178 87.797 44.526 142.792 -75.298 89.027 45.087 117.694-122.792 89.756 56.772 106.860 -77.884 88.312 57.400 143.109 -95.500 89.783 34.119 127.369-141.315 98.659-116.623 144.841-126.471 108.605-176.097 152.183 -14.576 103.476 -59.423 93.970 -92.052 93.626 -40.887 112.914 -75.536 91.372 -52.057 103.793 -67.108 90.021 -50.373 119.830 -72.782 91.903 -55.028 127.213 -75.834 89.425 117.227 105.583 -79.933 92.485 47.828 161.418-131.786 89.474 47.451 139.610-179.248 90.848 44.437 127.693 -76.077 88.590 53.253 110.074 -37.845 89.704 52.299 127.685 -75.332 88.523 42.649 135.504-148.885 90.339 48.884 130.442 -44.499 89.629 54.755 138.298 -55.357 89.587 43.948 135.185-121.201 94.758 80.118 103.930 -80.345 92.508 0.000 128.884 -76.743 # 714 total E -1.49027E+02 rmsd from N 0.000 %NC 0.00 93.096 -64.688 126.834 -76.057 94.236 -49.074 115.773 -77.712 91.046 -45.681 103.761 -77.633 90.525 -47.898 128.374 -75.985 91.322 -39.189 135.918-119.535 94.553 -41.733 66.879 -69.053 92.769 -32.211 132.826 -26.457 106.241 -34.144 171.415 155.547 97.408 -42.792 123.791 -95.465 96.830 150.850 87.992 -74.700 92.228 68.307 145.941-122.779 95.128 42.927 94.449-116.824 100.293 104.213 104.807 -82.570 103.557 -57.617 147.085 -91.842 100.287-120.762 110.410 -86.336 94.439 46.641 149.156 161.975 94.419 44.224 137.477 -84.265 91.389 44.701 128.977 -39.252 91.843 54.727 122.836 -45.059 89.268 45.926 146.437-147.685 91.380 40.392 0.000 0.000 91.289 53.097 119.761 -79.537 88.757 46.324 142.496 -83.786 89.604 42.750 119.344-127.402 89.326 50.996 107.169 -74.932 90.558 49.047 138.707 -79.971 91.183 42.242 135.560-150.524 92.730 42.998 142.891-129.669 96.491 132.208 110.436 -85.311 93.139 65.545 135.942-163.897 97.460 72.975 115.116 -78.250 90.929 -75.773 109.247 -48.316 89.487 -46.080 110.646 -70.608 90.916 -50.510 127.091 -74.212 92.464 -32.735 107.078 -84.811 91.638 -50.261 98.124 -61.974 89.522 -49.739 154.638 -20.610 91.048 -61.608 128.522 -76.945 86.471-166.974 116.671-141.010 93.319 49.096 132.267 -78.185 92.630 41.483 138.972-115.135 91.944 46.683 135.860 -47.249 91.682 57.813 143.292-139.640 87.896 40.078 125.742-161.288 95.410 80.138 102.734 -79.781 92.512 0.000 128.965 -76.582 # 715 total E -1.55414E+02 rmsd from N 0.000 %NC 0.00 118.442 151.961 153.292-107.435 93.712 54.998 139.590 36.835 92.608 44.198 106.085 -81.837 91.881 48.027 131.329 -77.637 93.207 45.605 147.249-127.509 91.067 43.198 58.983 -73.009 90.547 46.162 126.337 -36.912 91.365 45.732 127.063-107.441 87.897 47.600 140.343-153.446 88.919 54.950 77.596-103.302 89.717 139.076 135.563 -82.965 93.976 83.509 124.195-146.473 92.792 104.601 98.499 -85.263 92.319 -69.435 135.867 -89.908 97.865-116.389 133.683-142.376 90.260 50.593 132.060 106.285 90.800 47.071 134.046 -85.568 89.733 49.408 136.931 5.193 89.874 47.564 139.884 -2.413 89.231 45.004 153.263 -20.026 88.904 50.386 0.000 0.000 88.225 49.704 130.978 -40.022 88.876 47.006 140.115 -80.267 89.344 46.616 125.079-129.474 88.152 50.041 105.264 -71.342 90.902 46.532 135.628 -54.407 92.439 40.827 134.115-126.288 93.673 38.377 115.389 -89.517 106.613 160.350 105.482 -79.993 93.576 54.874 133.868-160.764 92.025 45.330 113.347 -77.269 92.122 108.841 145.695 -96.833 90.733 54.128 115.270 -74.544 90.783 44.059 129.058 -76.191 89.335 46.516 112.036 -88.095 89.182 48.755 132.075-105.250 88.216 53.825 142.959-142.344 87.583 47.819 127.881 -76.411 88.764 47.783 101.314 -60.386 90.569 44.633 128.149 -75.085 91.056 45.214 135.246-151.865 90.348 48.410 128.306 -44.392 89.699 52.229 135.685 -99.117 90.639 43.764 133.901-142.130 95.362 72.879 104.139 -80.571 92.518 0.000 128.994 -76.658 # 716 total E -1.51911E+02 rmsd from N 0.000 %NC 0.00 93.184 -67.062 129.457 -84.304 94.184 -46.818 116.254 -80.599 90.482 -48.058 103.019 -77.103 90.348 -46.999 129.209 -76.055 91.723 -40.527 141.166-125.841 94.112 -41.354 60.752 -65.337 92.479 -40.455 130.722 31.273 101.618 -38.871 168.603 162.883 92.828 -54.853 125.069-116.942 94.987-107.841 81.261 -84.391 116.920 74.063 156.674 179.677 92.498 49.597 97.067-126.361 94.425 40.555 101.684 -79.914 95.370 40.759 141.695 -23.451 96.674 41.782 112.749 -93.463 96.285 18.118 127.877-112.404 115.938 14.788 157.849 -92.982 134.003 -1.632 140.535 -96.583 123.799 168.353 130.070-141.804 95.306 58.033 137.845 173.979 89.442 53.545 0.000 0.000 89.978 47.565 130.088 -38.253 89.587 52.799 142.720 -77.289 88.286 51.443 124.141-134.308 88.514 47.460 108.644 -76.852 90.916 53.280 148.505 -99.846 90.252 46.253 130.596-156.419 93.710-109.358 103.361 -82.114 104.690 172.761 150.741 -16.014 108.133-157.588 89.843 -93.382 92.609 52.580 115.011 -76.658 91.952 47.519 103.042 -19.781 89.761 50.827 127.318 -10.648 90.557 41.269 128.855 -77.361 91.648 53.600 102.247 -84.548 89.620 56.780 124.420 -34.146 92.242 43.073 119.985 -76.875 92.013 41.234 130.107 -77.045 94.007 91.522 108.170-100.361 90.681 -82.253 129.200 -77.122 92.414 -43.955 144.923-129.596 91.228 -57.049 133.393 -51.942 95.379 115.826 147.167 -25.973 99.965 30.658 141.386-174.395 100.303 30.648 104.789 -77.773 92.446 0.000 129.475 -76.316 # 717 total E -1.48709E+02 rmsd from N 0.000 %NC 0.00 93.307 -73.735 129.911 -85.551 93.829 -48.039 121.362 -78.535 91.039 -46.779 103.015 -76.344 91.162 -48.169 128.702 -76.353 96.058 -24.534 149.052-146.370 101.404 -42.562 59.308 -72.922 93.990 -20.549 125.573 -38.267 108.716 -41.274 172.070-153.745 92.491 -47.855 129.975-119.095 91.808 125.890 89.373 -86.399 95.356 163.663 151.803-115.971 92.014 78.791 96.753-135.273 97.219 102.501 99.837 -85.512 110.686-108.747 141.369 -85.556 108.527-112.745 109.569 -85.772 93.720 48.583 145.593 -97.179 93.333 45.117 137.100 -74.771 91.602 45.714 133.045 -45.494 91.616 47.904 108.214 -34.403 90.233 46.672 108.632 -81.567 90.675 45.264 0.000 0.000 91.188 47.170 111.074 -78.595 90.698 42.922 143.693 -76.924 91.712 42.689 119.511-125.143 91.049 46.788 109.926 -76.697 91.600 46.206 131.506 -87.832 94.679 36.588 137.396-150.033 97.464 38.159 144.854-134.897 99.513 23.666 144.056-113.458 126.897-124.657 120.609-124.660 140.225 50.893 124.789 -84.499 114.292-127.228 132.425 -35.081 96.212 41.953 115.693 -70.058 93.336 44.209 130.144 -76.663 89.388 44.113 153.184 -18.118 89.525 51.752 116.236-121.715 87.734 53.371 137.711-170.965 87.623 47.910 127.755 -76.541 86.591 65.840 113.551 -75.562 88.519 52.323 126.837 -74.596 88.874 43.458 140.397 -52.187 91.074 45.501 125.710 -35.585 90.621 51.719 136.599 -86.002 90.795 43.718 132.910-127.358 95.180 79.504 142.045-132.107 92.552 0.000 128.967 -76.553 # 718 total E -1.49529E+02 rmsd from N 0.000 %NC 0.00 93.183 -78.556 129.003 -83.415 93.289 -60.545 113.827 -67.913 96.135 -31.896 101.603 -75.957 94.664 -48.039 129.648 -76.573 100.116 -3.966 151.096-172.790 107.863 -55.544 64.696 -84.388 92.742 -74.303 124.458 -28.274 89.292 102.102 144.279 -79.933 92.129 44.623 148.290-148.594 92.148 49.868 127.729 8.827 90.336 71.077 150.414-122.278 93.480 59.468 88.896-114.138 91.396 80.880 109.064 -85.418 94.222 -69.507 143.334-120.138 109.961-116.953 153.274 -27.881 93.623 46.479 148.857 163.689 92.679 45.969 137.968 -82.884 90.163 48.788 122.083 -57.758 90.886 54.674 117.389 -41.902 89.295 44.256 149.362-154.899 90.384 43.204 0.000 0.000 90.999 52.997 109.664 -85.129 87.412 47.973 147.649 -83.144 88.996 44.818 118.542-132.435 88.405 53.331 108.933 -74.065 90.129 43.010 143.896 -95.774 93.906 47.939 130.808-144.867 97.087 7.278 144.448-133.670 114.165 175.529 111.639 -83.281 102.041 51.217 131.184-153.451 99.525 30.963 115.179 -77.971 98.149 38.403 131.373 -41.961 95.869 46.154 114.514 -68.309 92.594 41.522 130.074 -77.148 92.163 38.852 103.295 -85.574 92.252 46.418 112.019 -65.635 90.952 52.589 133.755 -55.356 90.216 36.110 130.364 -77.774 93.451 111.614 95.116 -95.664 93.559 -41.229 129.756 -78.172 95.698 -49.178 141.254-115.983 95.176 -20.578 124.082 -15.028 103.948 -58.953 152.105 -21.131 90.229 -38.073 145.921-142.482 98.067 66.535 99.931 -80.253 92.446 0.000 129.160 -76.552 # 719 total E -1.52305E+02 rmsd from N 0.000 %NC 0.00 93.191 164.884 140.714-100.042 92.776 55.203 145.723 39.085 91.672 44.678 105.773 -83.142 91.924 54.022 130.583 -76.354 91.342 42.479 149.872-137.289 90.290 44.400 69.298 -83.076 91.042 44.878 116.414 -59.604 90.186 43.281 135.150 -95.211 91.451 46.518 138.530-128.228 91.313 68.417 105.482-122.420 93.665 -62.441 131.064-128.386 109.741 -69.846 85.738 -86.764 93.249 -36.392 113.480 -81.833 113.311 70.646 147.842-164.150 127.787 118.040 117.055 -88.138 118.960-105.750 137.198 -87.383 93.459 41.717 140.296 -81.802 90.785 49.943 120.883 -46.612 89.609 55.166 122.457 -40.425 88.254 47.584 143.689-142.997 89.952 42.228 0.000 0.000 90.217 52.441 110.563 -80.836 87.716 46.803 139.608 -81.624 89.998 44.749 121.610-127.525 89.760 47.675 108.243 -76.017 89.400 48.398 131.649 -81.977 93.073 46.534 134.362-131.971 94.840 34.698 108.057 -86.356 99.600 39.020 152.746 -20.763 131.376-175.212 114.837-113.241 97.185 53.097 115.651 -76.997 93.078 44.677 115.159 -47.229 88.732 58.282 120.419 -70.464 90.788 44.483 127.816 -76.497 89.609 44.635 131.690-122.416 91.971 47.122 119.916-108.945 89.883 53.581 131.848 -93.743 90.782 61.779 127.007-108.449 93.736-176.527 107.301-118.529 92.409 60.175 131.265 -76.995 91.741 45.115 140.751-106.081 89.298 54.063 131.706 -36.523 90.545 66.306 135.208-128.884 86.398 40.193 126.025-169.746 94.986 90.279 101.617 -79.459 92.498 0.000 128.831 -76.392 # 720 total E -1.48204E+02 rmsd from N 0.000 %NC 0.00 94.008-138.803 143.073-130.030 130.018 54.612 158.079 139.722 100.626 29.699 102.219 -80.321 92.695 56.309 132.033 -77.306 92.157 33.078 131.574-111.218 99.084 44.723 68.475 -85.832 95.875 20.996 124.717 -62.999 108.443-173.772 139.457-100.684 93.533 81.878 124.808 145.181 88.524 77.666 95.491 -70.347 92.307 54.729 141.712 -79.767 94.833 34.679 100.854-106.403 100.269 117.471 105.178 -83.175 110.284 -52.087 152.534-108.647 99.028-121.664 136.582-151.637 93.482 46.182 143.564 138.778 92.788 45.647 135.393 -84.942 90.702 46.937 127.335 -60.265 91.101 53.975 138.738 -37.293 89.772 44.478 139.779 178.664 90.449 42.248 0.000 0.000 90.723 52.491 111.349 -92.011 88.413 53.269 167.436-150.082 86.967 53.838 108.433-145.672 87.832 50.950 105.303 -73.413 90.311 48.388 147.102 -34.322 90.978 48.154 133.736 -41.821 93.434-104.592 103.837 -83.414 105.207-156.134 153.726-135.157 95.722 -50.745 96.160-110.063 90.713 -47.287 110.455 -76.339 91.619 -64.123 105.628 -56.604 87.938 113.824 122.978 -76.893 93.528 43.736 127.804 -76.050 89.638 51.523 109.252 -81.405 90.052 52.009 138.616 -30.680 88.483 45.097 134.122 -95.045 90.340 44.169 128.160 -76.736 90.720 49.608 124.558 -54.802 90.298 43.753 129.527 -76.468 91.041 45.001 134.005-139.336 91.064 52.303 127.628 -43.556 89.791 50.105 137.935 -95.608 91.319 45.410 136.866-159.048 94.991 73.120 104.128 -80.668 92.464 0.000 129.005 -76.674 # 721 total E -1.48491E+02 rmsd from N 0.000 %NC 0.00 93.224 168.428 139.683 -97.227 92.992 55.571 154.149 40.651 91.975 45.443 106.222 -82.076 91.951 54.708 130.684 -76.587 91.824 41.923 147.089-139.281 91.657 45.112 72.070 -94.173 90.401 43.977 112.716 -71.965 89.269 54.627 136.150 -99.970 87.084 50.989 120.333-115.559 90.490-157.061 83.468 -93.331 94.203 96.479 145.687 155.625 90.811 52.962 95.298-126.380 91.792 46.991 96.932 -80.393 92.556 46.848 171.193-130.651 92.831 41.616 123.973-138.072 95.095 36.335 129.594-116.748 101.576-151.911 121.685 -83.150 110.376 -23.715 132.511 90.097 112.868 120.993 135.406 147.454 146.618 -30.249 106.999 -84.248 96.082 49.926 0.000 0.000 91.192 45.317 113.730 -80.146 92.917 45.987 134.268 -77.450 92.070 41.054 122.057-119.663 90.665 48.335 112.125 -77.176 91.572 51.204 126.532 -90.677 91.485 46.502 138.205-149.350 92.741 29.107 142.749-130.400 112.970 45.781 115.255 -87.155 137.579-172.900 106.577 -92.023 93.937 50.495 114.611 -76.802 91.765 46.524 96.914 -17.919 91.007 47.268 118.250 5.741 90.297 47.169 129.454 -76.885 89.408 45.465 101.837 -83.673 91.052 45.259 127.347 -34.980 91.628 41.923 135.720 -64.840 92.902 40.814 128.395 -76.690 92.100 46.126 108.951 -61.904 91.695 45.917 128.554 -76.356 91.220 42.865 123.454-167.643 91.417 45.854 130.849 -50.177 91.347 50.998 133.099-109.589 90.679 43.532 133.329-143.963 95.765 69.667 104.215 -80.552 92.458 0.000 128.917 -76.764 # 722 total E -1.50976E+02 rmsd from N 0.000 %NC 0.00 93.093 167.296 135.899 -83.811 93.414 61.278 133.654 49.141 93.420 40.993 106.752 -81.745 92.105 47.738 131.392 -77.155 90.479 46.270 150.672-154.866 92.116 44.323 59.148 -65.552 91.109 42.926 127.891 -24.824 88.953 47.779 133.008-112.815 89.780 55.262 125.536-114.473 87.915 74.502 88.662 -99.091 87.177 -64.292 139.239-102.387 119.218 -60.188 116.590-120.757 97.949-129.736 103.934 -82.069 116.401 -98.788 153.430-158.830 107.673-114.932 137.034-155.220 92.024 49.065 143.652 132.821 91.077 47.586 135.164 -84.347 90.491 48.734 130.440 -60.552 89.873 47.859 153.394 -50.259 91.288 43.796 141.813-147.789 89.939 47.283 0.000 0.000 88.689 55.896 104.668 -84.074 88.363 49.243 134.145 -74.876 90.234 41.206 124.155-123.090 89.636 51.286 116.562 -77.004 89.761 50.274 139.860-113.850 90.529 50.072 136.410-137.408 92.223-104.619 104.209 -83.847 113.074-176.755 157.971-143.636 95.291 -66.972 97.689-105.119 91.225 -52.511 111.170 -72.926 92.859 -62.009 112.432 -38.163 90.623 104.810 115.498 -71.456 92.727 43.031 128.511 -76.372 89.821 49.670 106.983 -75.715 90.928 46.038 132.189 -38.955 95.590 30.214 133.779 -77.628 97.321 43.926 128.943 -77.012 96.862 73.379 100.784 -66.829 90.450 -92.919 129.418 -76.933 94.271 -34.762 142.935-115.309 90.653 -49.989 116.429 19.702 92.478 -51.132 158.196 -25.412 91.038 -43.596 139.475-153.398 94.370 109.542 103.780 -78.786 92.479 0.000 128.919 -76.120 # 723 total E -1.51475E+02 rmsd from N 0.000 %NC 0.00 93.098 -62.545 128.096 -80.356 94.410 -48.177 115.161 -78.892 91.389 -44.967 103.325 -77.824 90.515 -48.050 128.954 -75.834 91.678 -38.320 137.479-123.385 93.517 -43.530 60.266 -61.504 91.890 -35.853 134.531 42.362 100.487 -42.321 159.932-157.253 90.292 -42.646 151.285 -98.160 91.534 -53.144 77.630 -77.377 96.985-150.800 153.512 153.074 93.312 -59.109 99.747-118.932 101.714 167.583 101.978 -83.288 135.544-137.634 176.443-166.892 104.198-111.486 137.487-147.243 92.792 49.315 139.548 145.689 91.748 46.267 133.840 -86.863 90.382 51.346 144.493 -56.880 88.942 49.079 130.027 -34.829 89.216 47.617 109.749 -82.568 90.250 44.678 0.000 0.000 89.102 51.893 142.864-117.562 88.139 47.267 134.952-103.940 90.622 41.549 120.945-130.368 89.852 48.397 116.882 -74.815 90.275 46.472 131.890-105.495 93.013 60.255 131.200-129.891 92.211 -92.865 104.607 -87.297 106.705-174.783 113.276 -78.999 129.016 -64.827 118.195-119.418 107.228 -34.658 111.350 -82.125 93.605-117.490 107.915 -8.810 94.128 47.641 108.319 54.216 90.942 52.224 130.580 -77.051 91.177 45.614 104.689 -84.065 90.264 48.826 119.917 -8.069 90.530 43.095 129.847 -64.590 92.727 45.115 129.439 -77.028 94.706 115.357 117.703-104.388 90.838 -50.631 129.088 -77.232 91.219 -46.278 142.815-119.586 88.048 -51.188 122.375 1.701 91.635 -48.349 155.711 -17.276 91.682 -42.813 105.928 -86.221 95.819 113.701 106.013 -78.896 92.569 0.000 128.608 -76.526 # 724 total E -1.47522E+02 rmsd from N 0.000 %NC 0.00 93.124 159.197 140.317 -96.558 93.532 55.275 128.517 48.199 91.359 43.957 106.197 -80.578 91.751 48.959 129.781 -76.456 90.223 45.794 153.057-160.406 92.957 42.939 58.597 -64.558 90.025 47.256 152.327 -12.956 87.325 63.551 139.769 -97.643 87.400 68.597 123.380-120.788 82.807 171.555 85.178 -89.121 94.358 77.991 139.644-153.244 93.734 41.450 92.044-121.357 94.223 43.149 106.977 -84.752 94.014 45.239 140.947 -95.650 90.818 49.326 132.275-144.127 91.468 50.742 124.247-125.220 94.474-124.137 121.397 -93.926 101.139 -26.767 141.425-108.811 115.466-166.879 119.369 114.502 145.459 -71.531 110.127 -84.593 97.543 46.640 0.000 0.000 93.622 46.157 117.255 -75.082 89.838 44.870 154.350 -85.249 90.575 44.771 113.629-129.379 89.303 50.480 107.954 -75.826 89.138 51.188 141.667 -86.429 92.514 41.272 132.862-133.845 93.483 32.933 143.707-131.830 108.875 -20.914 115.984 -94.872 135.792 53.796 110.921-101.621 152.010 -96.749 131.370 -84.791 94.108 -40.843 107.906 -61.822 91.216 -45.709 109.823 -69.602 91.499 -46.879 125.930 -74.847 91.719 -35.116 106.674 -89.919 91.242 -48.158 97.307 -61.627 87.661 -51.428 153.337 -17.894 90.647 -60.870 129.510 -78.042 86.423-173.279 122.338-139.393 93.118 48.796 132.056 -77.989 92.896 40.295 138.047-114.610 93.225 44.144 132.046 -39.026 92.374 50.760 134.991-110.928 90.788 43.486 132.556-154.665 95.524 72.088 104.016 -80.418 92.519 0.000 129.002 -76.662 # 725 total E -1.46702E+02 rmsd from N 0.000 %NC 0.00 93.090 158.790 139.437 -93.226 93.444 55.637 133.308 48.870 91.790 44.598 107.003 -81.536 91.568 47.205 130.649 -77.148 93.087 44.158 154.090-151.517 92.884 42.419 55.849 -67.072 90.398 45.714 125.810 -27.240 89.124 54.923 132.584-108.361 88.221 46.269 128.209-112.645 96.802 107.966 89.554-100.752 115.131-113.328 166.109-129.283 97.290 40.314 94.356 -96.300 93.683 48.232 99.369 -69.333 92.361 47.711 149.913 -47.892 90.965 51.685 135.546-140.976 92.223 29.925 122.099-123.336 100.679-156.247 137.049 -93.975 141.824 -36.355 119.834 48.409 95.874 50.509 149.358-138.562 100.400 38.615 108.898 -82.482 114.105 10.586 0.000 0.000 94.293 54.582 154.986 175.596 90.773 49.642 138.212 -97.485 90.758 41.118 114.674-123.185 89.725 50.486 118.444 -74.945 89.994 43.332 135.092-105.429 93.160 56.839 130.326-115.075 93.414 -78.386 102.838 -83.421 119.958 148.594 151.666 -16.757 119.928 174.244 117.958-124.365 95.202 52.578 115.455 -76.800 92.916 43.792 118.600 -51.930 92.349 44.961 117.830 -72.866 92.192 43.408 129.574 -75.798 92.366 41.591 134.768-132.822 92.400 42.776 126.463 -83.895 92.380 49.175 126.785 -92.596 92.628 75.496 138.461-114.389 92.621-173.777 100.892-124.326 92.096 55.380 151.485 -85.848 91.297 45.732 140.751-105.311 90.774 46.388 129.946 -32.639 91.220 53.847 138.660-110.312 89.827 41.097 131.224-148.814 95.756 72.522 104.360 -79.795 92.509 0.000 129.012 -76.738 # 726 total E -1.47679E+02 rmsd from N 0.000 %NC 0.00 93.279 167.540 140.830-102.244 93.729 53.584 136.936 24.164 92.217 44.794 105.932 -81.771 91.654 48.906 131.443 -77.329 92.893 44.492 141.255-118.639 90.638 43.990 58.628 -70.721 90.383 45.360 124.136 -35.953 90.945 47.510 124.360-103.072 88.588 44.502 125.369-110.770 92.606 87.947 85.833 -94.359 93.401-128.694 144.851 -96.984 95.445 74.420 96.225-116.216 108.612 131.144 113.010 -88.581 140.261 155.618 169.997-167.237 118.160 -92.610 144.934-164.273 95.138 44.927 150.164 161.220 91.632 46.348 135.500 -85.085 89.799 57.020 129.722 -64.395 89.163 49.217 140.093 -54.076 88.693 44.243 142.564-158.483 89.916 50.169 0.000 0.000 89.165 49.927 154.353-141.705 91.215 40.891 135.750 -90.246 90.324 43.795 119.385-121.460 90.444 53.631 110.174 -81.889 89.021 52.530 139.418 -98.224 91.066 39.493 129.383-144.796 96.259-101.087 143.317-124.984 111.347-155.941 152.548 -15.105 132.293-134.951 109.733-103.784 97.561 44.162 114.633 -77.448 96.305 36.733 103.352 -17.211 98.034 37.767 141.051 -41.104 92.704 46.042 129.246 -76.652 91.534 42.491 101.926 -84.468 91.938 43.625 138.712 -32.612 94.717 36.819 135.819 -85.614 94.386 42.711 128.596 -77.169 93.379 65.863 106.827 -72.860 92.163-111.443 129.658 -77.271 95.385 -28.237 141.709-110.191 94.951 -76.652 117.970 27.356 95.650 107.281 153.745 -29.541 98.251 40.660 140.446-160.816 99.195 40.601 102.223 -79.133 92.403 0.000 129.471 -76.478 # 727 total E -1.48081E+02 rmsd from N 0.000 %NC 0.00 121.819 -71.490 150.818 -63.599 114.894-121.027 134.060 -44.804 94.289 40.454 108.845 -80.875 94.013 49.560 127.474 -74.105 95.023 34.808 148.075 -23.726 92.604 48.002 67.647 -88.059 88.659 52.755 109.315 -54.777 89.053 47.227 130.584 -82.422 89.473 43.810 140.281-102.367 91.182 41.554 84.136-101.965 93.726 69.196 133.153 -86.778 136.299-162.850 110.284-100.586 102.628 177.181 103.448 -83.671 102.890 -44.526 146.274-131.274 96.201-117.777 151.534 -35.183 91.343 49.326 142.433 122.022 91.590 48.019 137.945 -83.141 90.662 46.583 129.048 -57.567 90.449 48.844 144.031 -31.211 89.715 45.549 143.813-153.367 90.268 44.832 0.000 0.000 90.097 49.268 110.181 -84.041 88.845 46.552 139.558 -81.591 89.641 45.521 122.016-127.616 88.661 51.120 111.712 -75.933 90.841 41.856 139.725-103.027 94.108 50.770 129.938-141.688 96.391 -3.309 143.991-132.202 121.444-176.712 113.236 -80.036 98.261 52.904 133.859-158.173 98.329 28.737 114.868 -78.079 103.742 32.643 149.485 -22.604 93.887 51.097 111.619 -69.171 91.775 44.372 128.812 -77.028 90.478 42.497 106.936 -87.587 91.116 46.775 121.637 -84.918 90.030 58.428 137.934 -91.779 88.647 40.055 128.967 -77.418 92.042 105.159 96.339 -97.721 91.282 -62.537 128.992 -77.242 94.407 -46.088 143.181-119.433 92.850 -38.825 120.222 -6.415 94.977 -54.904 147.724 -42.971 91.735 -36.701 139.351-143.782 98.957 65.905 98.032 -79.893 92.425 0.000 129.333 -76.216 # 728 total E -1.48896E+02 rmsd from N 0.000 %NC 0.00 92.955 -55.210 128.837 -84.859 94.117 -48.139 116.231 -79.048 91.123 -46.004 103.331 -77.609 90.636 -47.546 128.512 -75.650 91.076 -39.707 140.344-127.870 93.540 -42.261 58.955 -62.706 92.874 -37.973 130.503 39.604 100.505 -40.222 169.170-171.151 91.604 -48.646 126.308-120.421 89.661 -71.661 75.353 -77.739 104.308-159.422 154.474 167.595 93.393 -65.693 98.716-104.161 98.675 169.769 104.034 -81.472 113.534-115.029 154.942 -84.157 104.119-111.218 138.377-148.325 92.020 49.042 138.089 139.029 91.345 46.308 133.825 -87.119 90.129 51.297 143.258 -57.237 89.082 48.481 130.131 -28.917 88.683 47.416 109.898 -82.257 89.560 47.085 0.000 0.000 89.220 49.261 151.641-132.553 89.540 43.690 136.588-102.019 91.092 43.381 119.511-127.899 89.166 51.416 114.554 -76.033 90.216 49.250 131.181-101.146 91.664 43.525 130.798-134.829 95.205 62.683 114.417 -88.160 122.729-112.778 112.942 -82.507 127.056 -81.606 115.011-115.041 98.506 47.043 115.718 -77.476 93.096 40.838 111.961 -30.914 89.119 56.811 115.659 -70.174 91.943 42.854 125.556 -75.688 89.883 42.266 105.212 -88.603 93.397 45.762 122.488 -66.770 94.614 36.207 129.472 -67.879 94.744 36.752 130.662 -76.831 96.578 35.763 111.926-117.661 99.845 32.042 128.670 -76.972 96.582 37.407 141.138 -94.410 93.219 45.894 132.110 -72.719 91.036 51.276 117.591-128.829 89.794 41.798 129.932-140.249 95.253 44.553 101.929 -79.842 92.522 0.000 129.131 -77.035 # 729 total E -1.50598E+02 rmsd from N 0.000 %NC 0.00 93.269 -95.449 124.954 -69.094 94.782 -51.617 129.976 -94.634 93.003 -47.983 102.576 -77.756 91.889 -40.437 129.045 -75.564 94.957 -42.153 147.680 178.635 97.312 -59.252 111.529-138.593 88.769 112.195 102.716 -49.161 93.819 50.084 139.683 -91.655 92.057 68.401 148.591 178.204 89.728 125.313 117.381-134.503 121.649 -98.802 131.797-153.125 100.698 36.492 90.733-110.103 94.139 47.793 138.212-114.620 91.801 51.873 132.616-147.494 89.980 47.238 122.099-150.398 92.354 53.040 125.243-116.969 96.263 -75.948 130.735 -74.480 119.104-161.020 144.532 -69.498 97.719 48.817 154.802 -24.909 93.371 44.300 141.796-170.723 92.024 43.196 0.000 0.000 91.682 48.657 111.766 -85.580 89.778 44.790 146.014 -83.596 90.406 44.222 117.912-127.903 88.684 53.600 111.566 -77.360 90.561 48.396 138.110-101.002 92.366 43.276 130.864-150.356 95.457 49.599 115.407 -88.610 123.895-175.967 104.512 -77.799 95.091 50.754 97.857-109.639 93.018 45.202 114.503 -77.217 89.433 57.834 121.270 -13.147 89.250 48.968 107.099 -73.011 90.994 43.002 128.921 -76.094 92.896 38.611 103.796 -81.610 91.607 49.806 151.484 -26.434 88.212 49.116 152.740-143.741 89.691 41.848 128.158 -76.667 89.946 47.229 115.404 -32.078 89.960 47.208 130.220 -77.027 90.407 45.650 137.622-128.316 89.398 48.359 129.854 -42.414 89.271 56.418 136.233 -60.298 89.194 43.497 131.600-115.429 94.842 80.974 103.866 -80.470 92.540 0.000 128.851 -76.721 # 730 total E -1.48777E+02 rmsd from N 0.000 %NC 0.00 93.188 -72.623 126.887 -76.206 94.063 -50.959 117.825 -76.742 91.704 -45.511 103.801 -77.481 91.089 -45.530 128.983 -75.772 91.664 -41.193 142.213-139.701 92.839 -44.700 61.231 -51.824 89.616 -44.048 138.070 36.569 96.680 -44.625 167.118 161.014 91.046 -49.343 135.592-132.496 96.608-108.580 137.421 0.331 103.691 72.304 151.612-156.931 92.278 57.016 96.367-127.741 94.116 62.954 105.009 -87.063 95.922 -77.461 155.043-112.971 112.726-116.444 135.267-155.606 94.848 43.080 146.748-127.072 92.694 47.244 135.260 -78.640 90.355 50.384 131.749 -62.340 91.792 49.638 108.770-101.502 91.570 40.410 132.307-175.451 89.405 49.626 0.000 0.000 90.057 56.643 100.774 -85.140 87.094 47.108 145.239 -74.133 89.863 43.360 119.280-128.591 89.493 51.537 112.923 -76.267 89.907 47.060 138.435-103.610 91.475 47.721 133.525-148.314 94.195 -88.663 105.107 -83.770 124.564 132.894 150.411 -14.201 104.170 159.441 95.269 -82.792 94.018 48.664 132.555 49.567 91.068 50.088 108.057 -14.564 89.546 48.837 123.168 -18.274 91.838 43.135 126.820 -74.943 89.918 44.698 105.679 -88.461 90.896 51.006 118.512 -28.187 91.968 40.641 131.321 -53.717 93.311 40.130 130.411 -77.756 95.439 110.660 103.925-112.709 91.283 -59.998 129.023 -77.380 90.977 -50.089 145.940-143.543 89.527 -45.686 116.990 29.843 96.939 122.296 147.397 -24.971 102.013 20.465 141.610-163.714 101.168 31.059 106.358 -78.102 92.465 0.000 129.383 -76.413 # 731 total E -1.50739E+02 rmsd from N 0.000 %NC 0.00 93.115 170.186 135.645 -84.239 93.067 61.306 143.392 55.997 94.889 41.709 106.515 -81.617 92.829 43.038 131.577 -77.683 95.406 44.056 147.135-134.485 93.595 45.751 55.984 -71.157 89.716 46.893 129.302 -29.399 90.739 49.809 115.428-109.291 88.185 45.184 134.765-118.402 94.002 99.846 83.841-100.576 93.779 -50.024 145.692-105.730 101.737 -67.554 91.734 -88.332 88.228 -72.318 147.276 -17.474 111.181-156.763 150.550 170.853 108.292-107.960 114.760 -88.808 95.791 46.304 148.459 150.266 93.010 44.899 137.751 -83.321 90.877 48.886 134.658 -63.939 92.704 49.550 133.806 -42.243 91.782 40.881 143.437-171.635 89.780 47.541 0.000 0.000 91.490 52.271 102.109 -85.435 88.251 43.968 146.677 -75.036 90.767 43.475 117.644-126.804 90.739 50.438 109.294 -76.220 90.737 43.030 132.177 -87.930 94.480 43.460 134.111-135.038 96.912 25.216 108.347 -86.749 114.173 57.263 156.494 -15.021 125.888 -42.874 121.596-124.442 143.832 -26.901 126.161 -86.008 109.547-122.227 133.493 -16.552 95.041 44.227 115.188 -74.670 93.774 45.358 128.919 -76.270 91.114 41.394 103.288 -77.299 91.107 62.474 150.745 -29.979 87.737 48.125 149.650-136.481 89.715 40.577 128.700 -76.733 90.468 50.279 113.631-128.561 88.731 55.248 131.366 -77.505 87.270 47.648 137.772-129.139 87.454 51.362 102.536 -30.012 89.363 59.109 136.703 -43.583 87.673 40.155 138.578-130.065 95.327 88.265 102.162 -79.751 92.503 0.000 128.892 -76.550 # 732 total E -1.47089E+02 rmsd from N 0.000 %NC 0.00 93.103 -60.580 129.269 -84.822 94.846 -45.314 115.491 -81.492 90.505 -48.240 102.982 -77.287 90.237 -45.701 130.840 -76.757 93.805 -40.342 141.328-123.641 95.119 -42.935 62.805 -60.780 88.053 -43.608 135.344 26.381 101.424 -70.013 160.012 179.396 91.103 -47.201 121.382 -86.658 92.146 120.310 90.275 -68.632 88.213 78.480 153.720 -78.786 92.022 35.873 95.267-118.884 97.033 55.386 103.958 -83.941 95.384 -4.917 144.173 -89.822 126.133-173.612 110.266 -89.000 105.116 41.565 147.094 146.317 93.847 45.959 135.299 -84.743 90.743 49.051 127.438 -45.023 91.317 53.247 112.577 -32.613 89.956 44.347 149.423 -18.615 89.828 47.438 0.000 0.000 89.653 62.535 112.574 -76.454 87.432 47.263 141.438 -74.684 89.866 41.669 118.942-123.730 89.840 53.603 105.475 -73.890 90.106 51.496 136.837 -62.189 91.161 40.883 134.688-134.413 94.227 33.641 144.094-130.548 115.402 162.478 105.535 -82.568 94.559 60.557 136.504-163.495 93.564 38.552 113.687 -77.410 92.669 111.856 139.780 -89.306 94.583 54.313 112.421 -75.987 91.912 40.247 129.591 -76.489 93.512 45.260 104.547 -84.557 94.319 79.737 124.857 -76.147 94.446 -78.260 142.428-109.328 96.145 -48.514 129.386 -78.067 99.273-153.221 112.048-111.615 92.265 54.102 130.105 -76.495 91.987 45.458 140.141-105.761 90.551 47.202 126.950 -12.841 91.011 57.177 136.324-104.296 88.799 41.892 132.581-148.625 95.060 80.700 104.629 -80.468 92.587 0.000 128.848 -76.637 # 733 total E -1.51184E+02 rmsd from N 0.000 %NC 0.00 93.165 164.276 139.284 -94.958 92.391 57.458 149.829 28.410 92.252 45.246 106.326 -83.497 92.244 49.913 130.929 -76.657 93.794 41.494 142.529-123.161 90.731 44.279 63.522 -81.386 90.670 45.603 117.445 -50.677 91.009 43.946 130.894 -93.578 92.312 43.108 136.713-117.032 95.724 98.389 91.856-104.043 104.560 -44.238 143.979-117.299 98.590 -58.794 91.982 -90.890 88.936-104.096 136.161-150.115 101.328 -53.893 154.911 -37.561 95.460-113.194 144.206-146.482 92.818 47.279 148.804 119.398 91.786 47.269 136.080 -88.145 90.431 51.433 150.228 -98.668 88.849 50.432 153.468 -54.294 88.875 43.394 142.537-136.662 92.757 42.004 0.000 0.000 90.111 48.205 148.600-127.653 91.253 42.837 116.190-114.946 90.466 44.958 119.076-121.403 88.980 53.160 114.243 -77.978 89.525 46.813 132.665-103.674 91.607 48.232 132.969-145.811 94.698 -77.444 106.955 -85.787 124.683-106.254 166.698-160.861 111.653 95.557 132.221-148.419 93.370 43.807 114.693 -77.244 92.343 46.122 107.297 -23.994 91.439 46.074 113.210 -74.092 90.553 45.943 129.935 -77.432 88.427 45.884 101.713 -84.367 89.206 49.597 112.796 -45.421 91.750 41.041 138.122 -47.281 92.549 42.821 128.554 -76.482 93.054 63.482 106.256 -82.607 91.925-109.537 128.784 -76.978 96.222 -29.064 141.872-118.396 91.651 -57.827 121.912 -1.210 91.322 -52.978 156.416 -28.635 91.165 -40.873 139.934-149.475 96.662 116.430 103.500 -78.231 92.463 0.000 128.898 -75.947 # 734 total E -1.47366E+02 rmsd from N 0.000 %NC 0.00 92.977 -68.818 125.700 -67.792 122.188-102.059 131.457 -37.781 93.954 40.929 110.345 -80.697 93.526 49.123 130.575 -76.679 94.654 38.031 153.260-146.537 92.315 44.132 64.980 -93.325 90.566 43.364 110.381 -54.478 90.378 48.621 139.097 -81.302 89.694 39.890 129.645-113.015 92.687 43.405 86.685 -99.436 93.148 57.979 134.046 -87.877 102.274-104.741 99.405 -99.898 116.255-170.057 101.011 -85.965 145.341-153.379 170.863-171.868 102.409-115.874 138.169-147.730 93.022 49.827 140.789 139.088 91.956 47.104 133.802 -85.202 90.881 47.272 128.499 -52.574 91.872 47.419 110.195 -27.630 91.085 44.527 107.494 -81.607 89.945 48.457 0.000 0.000 91.342 49.687 104.421 -81.272 88.461 44.319 153.413 -80.365 90.136 44.960 115.974-131.672 88.656 51.711 112.916 -80.864 90.149 49.857 144.731-119.191 89.471 48.702 123.226-167.237 94.150 -98.548 103.956 -83.519 117.644 127.774 160.371-149.507 104.688 -67.416 95.148 -94.327 131.668 -57.534 118.439 -81.522 119.084-106.011 134.080 0.889 94.633 47.639 111.995 -67.843 91.887 42.427 130.015 -77.871 91.050 45.184 101.223 -85.732 90.899 47.788 133.886 -51.801 89.872 45.652 138.189 -82.676 90.853 40.439 128.415 -77.024 90.668 49.002 112.391 -63.318 90.736 45.704 128.371 -76.646 91.423 43.199 138.154-116.867 91.276 46.197 130.807 -46.808 91.068 51.552 133.887-110.515 90.686 43.355 132.243-142.920 95.624 70.089 104.224 -80.323 92.553 0.000 129.075 -76.598 # 735 total E -1.51007E+02 rmsd from N 0.000 %NC 0.00 93.150 148.388 141.459 -95.712 93.018 52.718 162.272 15.993 91.213 48.640 106.985 -80.558 90.251 50.869 128.872 -75.333 90.108 45.327 142.449-116.777 93.343 40.237 135.158 168.992 92.733 41.143 111.552 -68.593 93.827 45.085 133.864 -91.213 91.096 58.214 151.425-154.715 88.955 129.559 113.352-158.469 93.802-115.417 122.819-127.558 91.819 54.596 95.740-120.449 96.417 40.953 103.560 -87.000 93.541 42.675 171.405-137.917 95.275 36.447 124.861-154.369 94.886 45.460 123.964-115.236 92.406 46.201 127.640 -72.435 93.232-133.944 102.146 -79.729 95.316 -70.558 133.851 -83.595 90.297 99.071 153.069-157.249 92.605 48.894 0.000 0.000 90.426 44.120 139.840 -13.034 91.529 47.848 149.636 -94.614 90.563 44.806 119.389-133.214 87.088 54.156 107.230 -74.055 90.938 58.098 137.462 -38.099 89.400 47.757 137.391-144.156 93.254 11.190 143.375-130.802 126.762-163.473 107.913 -78.055 92.249 74.251 109.060-125.349 92.723 48.292 113.955 -78.256 90.494 50.653 99.427 -25.294 88.796 59.082 112.019 25.725 89.339 46.375 129.556 -77.200 90.964 40.870 102.203 -82.878 89.505 81.394 115.456 -2.892 86.836 71.180 139.487 -45.759 88.572 42.178 127.356 -76.040 89.685 50.815 134.598 -37.435 90.301 47.803 129.669 -76.366 90.007 47.802 158.586-171.447 89.698 45.526 127.835 -43.976 90.755 53.055 132.931 -89.897 90.125 43.396 135.174-131.217 95.405 74.494 104.234 -80.920 92.595 0.000 129.052 -76.751 # 736 total E -1.46530E+02 rmsd from N 0.000 %NC 0.00 122.528 -91.976 151.425 -82.340 94.238 -49.505 119.824 -77.066 90.990 -47.174 102.980 -77.120 90.522 -48.515 127.495 -75.420 90.223 -41.683 144.437-139.730 90.918 -46.015 59.372 -73.757 90.771 -83.110 127.517 -16.134 82.243 98.140 141.195-114.441 93.933 68.579 137.897 153.140 90.076 76.005 122.472 -20.457 92.786 -82.777 126.473-104.982 97.716 -41.007 92.831 -90.226 91.746 -53.089 139.843 -54.042 89.811 -55.989 138.653-105.112 91.467 -47.036 123.250-152.450 94.824 103.624 136.515-110.225 103.606-130.394 155.209 -79.343 149.580 -73.975 100.088 24.708 94.165 66.249 152.265 -87.017 96.014 45.427 106.677 -82.606 112.434 7.703 0.000 0.000 94.034 55.594 153.122-155.994 92.407 42.744 107.978-124.620 90.799 46.285 111.926-112.982 89.640 47.598 113.540 -77.359 90.757 51.341 134.535 -98.849 91.127 43.869 133.247-146.876 94.166-118.944 106.575 -83.700 110.251 172.843 151.128 -15.010 123.291-136.852 119.546-124.965 94.201 58.040 114.490 -76.534 92.441 43.981 104.186 -48.124 90.943 51.499 116.945 -70.314 91.422 39.698 128.100 -76.520 92.430 45.497 103.628 -84.677 91.445 48.557 124.861 -75.305 90.336 54.088 127.124 -86.884 90.079 58.767 129.313 -77.564 92.131-173.079 77.944 -78.281 92.000 65.014 131.597 -76.863 91.063 43.413 140.568-104.248 89.295 52.821 135.096 -9.382 89.844 66.884 144.932 -40.111 86.209 43.720 141.121-160.422 95.129 106.135 102.991 -79.571 92.524 0.000 128.975 -76.237 # 737 total E -1.54107E+02 rmsd from N 0.000 %NC 0.00 93.044 148.265 141.505 -98.668 93.981 49.161 146.806 53.411 90.668 50.277 106.894 -80.252 90.486 49.712 129.022 -76.109 92.642 43.449 154.508-142.148 94.781 40.537 129.241 154.256 91.732 43.054 110.499 -73.637 92.900 55.827 128.770 -94.542 90.565 68.438 151.477 176.248 86.954 104.716 103.056-157.758 126.246 -96.630 131.371-122.520 119.908 21.185 112.363-116.866 93.155 55.938 111.958 -86.624 91.082 47.986 144.087-115.649 91.032 48.395 130.909-152.053 91.622 57.938 126.983-116.018 94.536 -69.828 124.159 -77.802 123.335-164.911 146.036 -87.435 96.872 45.311 129.933 -37.646 94.197 44.990 147.371-163.867 93.605 41.024 0.000 0.000 92.036 45.761 117.092 -83.229 92.886 43.384 140.338 -82.617 92.223 40.928 119.119-121.963 89.606 50.994 110.035 -76.925 91.600 55.903 133.417 -89.216 89.471 46.191 135.353-156.317 91.510 42.154 142.447-127.964 108.288-173.115 106.240 -79.898 93.468 64.949 131.985-157.751 89.342 56.536 113.546 -76.367 89.230 59.290 136.862 21.685 87.396 49.754 113.410 -71.453 89.769 43.076 128.216 -75.843 90.117 47.330 139.874-144.882 89.965 47.790 138.222 -32.375 89.826 41.965 136.219 -96.243 93.037 41.831 128.379 -77.032 91.560 46.388 110.923 -40.186 90.240 51.231 130.810 -77.896 88.851 45.142 134.262-149.674 89.291 50.401 132.008 -50.672 89.428 55.445 136.020 -52.862 89.412 44.167 138.420-123.134 94.606 81.800 103.930 -80.467 92.502 0.000 128.834 -76.723 # 738 total E -1.51000E+02 rmsd from N 0.000 %NC 0.00 93.099 159.535 138.712 -91.140 93.921 55.129 131.750 57.337 91.839 44.169 105.828 -80.678 92.063 48.013 129.594 -76.763 91.717 48.193 155.917-172.884 93.336 37.807 60.725 -70.868 94.467 41.443 126.431 -29.359 94.187 39.621 137.639-107.277 91.377 54.876 136.945 148.449 86.499 53.020 81.749-102.796 91.319 160.069 124.615 -81.122 91.193 67.271 102.428-121.373 94.956 38.906 97.262 -81.648 94.165 47.836 149.072 -27.834 90.983 42.883 143.428-144.147 91.827 49.828 115.267-140.772 91.837 48.323 131.435 -78.803 91.752-118.525 127.573 -77.585 97.288 -66.666 138.691-112.758 93.002 120.359 116.564 -84.774 93.674 47.505 0.000 0.000 89.668 47.622 138.297 -32.315 90.285 55.314 139.139 -89.435 88.934 50.913 132.592-118.609 87.729 47.749 111.695 -73.784 91.014 49.175 136.590 -97.067 92.346 57.431 131.593-136.659 92.884 -97.061 103.987 -84.761 99.504-163.193 149.342-124.384 102.546 -66.734 94.303-118.594 96.231 -30.388 113.877 -80.123 102.081-117.139 131.652 -58.161 91.054 63.892 112.524 -71.999 90.864 50.334 129.266 -76.181 90.225 43.136 103.959 -83.045 92.106 45.739 138.614 -22.081 91.376 43.177 136.443 -96.224 92.029 40.799 128.513 -77.262 94.138 95.606 116.368 -87.351 87.421 -77.067 129.910 -77.592 93.027 -43.058 147.177-140.287 90.702 -43.189 122.832 -10.528 92.039 -58.510 148.654 -40.681 90.877 -44.207 139.628-176.536 96.948 60.027 99.313 -80.528 92.454 0.000 129.273 -76.334 # 739 total E -1.47861E+02 rmsd from N 0.000 %NC 0.00 93.125 -73.947 124.271 -63.861 124.807 -97.326 135.131 -34.955 96.367 36.549 110.181 -80.640 93.462 51.422 132.078 -77.485 92.788 40.217 148.583-144.470 89.735 48.794 65.742 -87.945 89.046 45.151 107.008 -48.235 89.836 46.868 139.742 -74.363 89.311 42.000 131.941-116.217 92.037 44.714 81.951 -98.138 92.816 148.406 132.026 -77.281 93.143 72.763 132.727-160.186 96.485-157.654 98.270 -85.017 120.861-161.449 157.207-163.850 115.448-105.460 154.520 -25.509 94.549 43.744 145.083-104.871 92.564 46.052 137.580 -73.392 90.932 47.740 121.005 -64.735 91.248 49.337 139.235 -36.086 91.502 42.715 142.776-163.103 91.055 42.916 0.000 0.000 90.781 55.644 106.357 -83.269 87.315 50.361 149.863 -80.359 89.496 40.929 117.865-131.304 89.434 50.975 112.001 -74.638 89.094 58.455 147.579-111.187 90.291 34.749 140.582-128.166 94.564 48.732 114.416 -89.115 97.519 -11.047 135.007 -92.495 129.099 -99.033 111.875-108.906 96.683 -30.463 113.180 -77.803 99.059-129.178 126.205 41.557 99.809 -36.295 113.710 -77.049 93.614 -50.860 127.279 -75.743 91.933 -29.216 99.341 -80.527 97.542-121.553 138.727 -25.619 94.077 57.797 143.618 -28.689 91.305 44.657 131.790 -78.935 91.305 112.007 128.552-149.536 93.746 -35.890 137.394-105.343 94.419 -57.597 144.170-150.293 91.045 -44.500 122.286 2.348 96.552 128.415 155.848 -22.520 97.581 59.138 139.665-165.186 98.425 13.307 106.032 -81.215 92.443 0.000 129.735 -76.254 # 740 total E -1.47317E+02 rmsd from N 0.000 %NC 0.00 93.125 -79.470 121.404 -57.513 119.480-103.954 130.513 -37.597 93.429 42.658 109.434 -81.631 93.078 48.865 130.928 -77.015 93.638 40.894 153.242-151.404 92.142 45.103 58.580 -75.724 89.137 46.837 120.885 -36.582 88.533 53.396 136.680-103.211 86.810 45.422 124.602-120.245 89.630 46.885 82.629 -97.056 90.457 81.395 142.667 -86.971 91.757 75.806 104.238-116.473 88.896 117.230 105.393 -88.116 122.296 -34.048 137.620-107.079 111.716-111.225 140.432-154.755 94.298 45.364 145.872 139.275 91.907 45.167 132.869 -83.190 89.306 53.728 145.912 -4.634 90.881 51.070 160.397 -72.416 90.383 38.417 142.811-159.146 94.044 41.614 0.000 0.000 91.301 49.103 145.826 -19.399 90.324 46.917 134.504-106.320 88.915 45.760 118.248-129.619 87.703 61.719 110.900 -77.873 88.388 52.309 134.871 -56.665 90.526 40.733 140.537-143.395 96.058 -88.172 142.876-128.012 122.366-175.035 114.273 -77.467 132.189 135.394 114.092-109.900 93.827 55.193 133.715 143.889 92.244 45.346 117.787 -43.066 91.215 44.178 109.892 -70.996 92.151 48.469 128.027 -75.602 89.592 44.829 105.599 -88.776 91.624 40.873 113.668 -78.968 91.805 49.027 129.372 -66.320 89.366 47.248 129.950 -78.055 91.373 82.045 101.778 -99.454 87.184 -83.631 128.005 -76.197 91.584 -48.126 144.925-124.680 89.552 -47.358 117.775 24.257 91.957 -48.748 146.074 -37.080 92.652 -37.253 144.978-136.640 100.180 129.091 104.913 -79.060 92.445 0.000 129.135 -75.834 # 741 total E -1.51752E+02 rmsd from N 0.000 %NC 0.00 93.056 156.561 139.527 -92.926 93.107 55.566 137.088 49.544 91.827 45.621 106.774 -81.970 91.690 46.106 130.811 -77.290 94.721 43.350 151.606-145.331 93.065 42.679 54.218 -70.716 89.552 47.245 124.497 -28.962 90.184 53.179 132.180-107.362 86.937 42.796 132.363-124.720 89.989 46.615 72.240 -94.437 92.464 110.213 141.208 -54.141 87.562 86.801 138.042-166.702 90.212-151.420 99.628 -86.447 148.931-154.012 164.486-169.882 100.450-115.381 151.433 -34.075 93.487 49.727 139.957 120.156 91.527 47.632 137.006 -83.393 90.862 48.053 123.537 -58.851 90.752 48.856 113.631 -16.422 89.527 45.304 139.104-113.624 91.633 47.843 0.000 0.000 94.028 36.718 108.965 -81.080 96.054 41.382 174.807 173.035 93.947 39.130 103.243-132.839 91.250 50.029 114.844 -79.952 90.543 55.368 146.510-121.708 90.673 39.715 146.442-123.932 93.986 43.387 114.288 -90.264 99.018 4.388 142.038 -99.077 131.584-167.639 114.926-112.205 114.387 24.620 118.116 -79.871 91.997 53.531 107.260 -12.309 90.126 47.430 110.948 -82.432 89.981 64.592 129.363 -75.375 82.968 53.626 105.921 -86.082 89.038 44.736 100.917 -71.817 89.956 49.198 136.180 -43.726 90.280 48.980 129.346 -76.913 90.418 118.840 101.926-101.859 90.636 -47.593 129.537 -77.968 92.386 -45.988 144.218-125.566 88.608 -48.967 124.761 -5.219 90.577 -56.956 159.016 -22.517 89.454 -46.826 131.256-125.236 94.768 89.645 103.164 -79.591 92.501 0.000 128.972 -76.447 # 742 total E -1.49150E+02 rmsd from N 0.000 %NC 0.00 93.508-175.964 139.594-100.176 94.518 53.089 143.492 40.109 93.908 43.825 105.589 -76.638 92.033 44.763 133.601 -78.885 95.929 45.258 142.602-117.005 92.989 38.789 53.592 -76.300 90.673 47.512 158.689 129.164 92.355 42.805 133.912 -96.555 89.834 44.837 143.784-139.668 89.919 54.809 76.846-111.854 88.891 143.596 134.208 -92.604 94.584 85.596 124.359-147.690 91.129 103.277 100.445 -85.885 93.006 -67.434 125.045 -96.555 99.660-121.850 137.240-144.630 91.680 49.911 137.798 120.301 91.404 47.676 134.628 -85.566 90.447 48.248 130.842 -42.660 90.532 48.070 132.328 -18.378 89.192 47.225 143.753-153.909 89.404 48.516 0.000 0.000 88.968 54.517 116.602 -76.136 87.931 41.968 139.882 -86.392 89.622 49.404 119.768-127.269 87.703 61.167 108.361 -75.257 88.198 52.700 138.548 -94.653 90.397 36.699 132.649-151.374 98.753 -85.871 145.001-129.665 123.798-165.919 153.588 -13.845 137.376-150.240 108.602 -96.767 122.981 -4.649 120.705 -80.648 123.276 100.924 143.746 127.653 134.987 38.614 121.122 -81.918 109.893-113.844 140.722 -72.519 91.121 44.269 96.995 -82.920 91.366 58.050 114.101 -22.439 89.111 49.065 143.945 -36.524 90.760 42.365 129.609 -77.301 91.908 119.179 114.182-111.576 92.188 -43.699 131.678 -78.909 93.487 -51.000 150.791 169.275 91.783 -70.545 128.121 -6.915 93.331 95.091 154.127 -26.115 95.252 45.640 142.125-159.448 97.458 33.814 101.027 -77.397 92.316 0.000 129.667 -75.738 # 743 total E -1.53228E+02 rmsd from N 0.000 %NC 0.00 92.502 125.481 124.697 -51.301 94.644 46.723 152.957 -0.855 92.840 46.247 108.450 -80.759 91.326 47.951 127.827 -75.133 90.601 44.804 122.085 -31.329 93.489 41.373 105.113 -78.583 92.675 39.377 109.690 -83.284 107.925 15.605 105.886 -77.844 95.212 43.852 146.907 -32.865 100.230 26.026 75.294-100.136 96.478 42.747 152.700-134.079 100.811 22.417 84.011-101.426 95.854 53.368 146.151 -41.319 91.816 42.949 113.820-107.875 91.436 48.871 137.852-132.268 91.723 42.080 118.904-123.088 97.571-113.178 126.964 -81.644 117.563 144.578 151.443 -61.557 113.833 171.444 130.646-134.109 98.037 48.005 147.069-162.297 92.371 45.558 0.000 0.000 90.076 50.586 140.321 -27.074 89.241 59.795 140.566 -86.470 88.205 48.955 125.716-139.510 88.872 47.449 111.106 -73.473 90.967 48.057 143.654 -98.415 92.161 56.366 134.552-146.552 92.118 -97.211 103.360 -84.212 109.204 176.809 156.637-141.536 132.577-176.005 111.258-106.673 95.303 44.588 115.796 -77.347 93.147 44.276 106.053 -17.719 91.874 47.737 125.756 -13.145 91.082 42.154 129.827 -77.823 90.411 53.014 102.695 -86.627 89.299 56.407 122.085 -33.665 92.203 39.572 124.287 -73.550 93.350 42.001 130.078 -76.930 95.245 99.522 104.871-102.665 90.491 -72.084 129.175 -77.175 91.177 -46.232 145.958-132.027 90.245 -52.760 128.489 -9.546 95.247 117.738 150.872 -24.629 102.033 27.477 141.826-162.830 100.029 33.202 104.653 -77.782 92.463 0.000 129.413 -76.437 # 744 total E -1.48874E+02 rmsd from N 0.000 %NC 0.00 93.284 -71.909 130.133 -86.269 94.537 -46.448 118.031 -81.598 90.866 -48.012 103.138 -77.483 90.306 -46.327 129.946 -76.220 93.110 -39.484 142.008-139.768 93.750 -43.014 59.508 -58.137 90.898 -42.064 129.282 39.979 99.263 -45.608 169.748 175.296 90.057 -49.299 125.450-122.770 95.361-105.724 80.644 -86.085 115.379 70.705 156.264-147.133 95.151 53.250 97.868-121.347 97.052 33.028 102.080 -78.595 94.808 50.387 146.214 -27.367 94.552 36.670 109.825 -90.901 95.043 46.699 131.693-108.816 98.099 1.845 122.572 -83.890 135.150 -17.068 143.113 -75.699 133.715-163.263 89.397 -99.717 96.313 62.274 145.133 179.855 94.813 43.990 0.000 0.000 91.843 44.881 140.160 -8.831 90.825 50.913 146.563 -91.176 89.972 47.026 120.318-133.677 88.584 48.133 108.754 -72.391 90.926 50.321 145.554 -45.505 90.689 48.759 135.091-144.219 94.242 -97.237 103.270 -82.776 115.750-176.270 152.462 -15.941 131.134 -57.870 114.026-111.087 113.223 -16.406 114.178 -80.268 92.849 -50.930 109.992 -55.044 91.756 -41.119 114.304 -68.720 94.081 -44.615 127.243 -76.391 93.154 -35.393 99.994 -82.527 90.002 -51.335 114.049 -38.444 90.575 -59.215 148.362 -28.952 87.836 -52.719 129.218 -77.263 91.266-124.373 154.760 173.497 90.919 49.118 132.338 -77.302 91.466 54.442 141.605-114.731 92.096 66.205 129.293 -36.224 90.598-103.112 144.746 -38.342 99.084 -14.548 138.312-138.699 114.666 83.233 100.187 -71.625 92.458 0.000 129.526 -76.442 # 745 total E -1.48970E+02 rmsd from N 0.000 %NC 0.00 93.184 -81.281 119.341 -54.075 116.846-108.371 131.616 -56.730 90.228 50.259 106.175 -76.974 93.012 43.598 129.830 -77.867 96.210 48.356 160.129-167.098 95.488 35.491 54.288 -76.649 94.628 42.822 131.943 -33.322 95.419 41.115 126.166-108.621 90.110 49.834 133.849 145.206 89.766 67.038 81.201-105.161 93.273 -68.844 138.404 -94.717 108.776 -74.378 93.307 -84.354 93.362-117.791 106.959 -80.619 93.296 -54.878 156.536-141.964 106.205-105.521 135.073-156.522 90.855 53.646 144.281 92.676 89.852 51.231 134.754 -85.189 88.742 56.618 159.757 -63.730 88.951 44.714 129.616 -16.759 90.958 43.239 146.424-155.335 89.652 50.594 0.000 0.000 88.870 48.013 105.103 -85.230 90.727 46.495 134.856 -74.379 91.863 41.879 124.929-122.333 90.196 48.771 119.433 -77.914 91.032 51.871 133.413-112.232 91.163 50.314 136.251-153.898 92.404-117.788 103.748 -82.370 98.186-166.085 150.493 -19.335 101.673 -59.261 98.016-101.569 103.871 -25.740 112.541 -78.575 91.978 -49.742 109.813 -47.282 89.102 -53.114 116.182 -73.345 91.406 -45.694 128.221 -76.094 92.255 -35.188 97.412 -79.638 91.236 -49.469 126.144 -13.435 103.955 -15.395 158.266 9.622 101.520 -51.395 129.827 -77.056 103.113-108.481 119.219-104.496 90.992 67.902 129.574 -75.824 91.745 45.374 141.518-107.167 90.171 46.475 127.975 -28.539 91.117 59.318 139.689-107.121 88.225 47.704 131.905-157.228 93.495 104.979 101.612 -79.608 92.491 0.000 128.687 -76.327 # 746 total E -1.47527E+02 rmsd from N 0.000 %NC 0.00 93.206 -83.766 118.843 -53.362 115.297-108.083 132.531 -56.046 89.737 51.733 105.721 -75.146 92.984 43.445 129.903 -77.704 95.584 47.480 156.743-165.233 95.147 35.103 51.247 -71.424 94.439 45.319 146.266 -14.813 92.662 44.712 132.777-111.090 88.918 49.580 134.992 150.242 89.491 69.962 79.958-104.650 91.002 -70.660 141.746 -95.486 107.740 -74.876 93.563 -85.493 94.051-121.706 108.664 -80.215 99.255 -61.446 153.573-137.994 105.332-108.415 136.548-152.526 90.849 52.568 144.836 115.449 90.233 49.432 134.546 -85.438 89.103 53.652 155.714 -40.086 89.014 46.365 128.866 -21.291 89.856 45.561 145.518-148.152 89.470 49.095 0.000 0.000 88.811 50.922 107.945 -82.150 88.712 44.659 134.629 -75.705 89.803 46.364 124.132-122.723 88.988 49.428 112.857 -76.126 90.265 48.972 136.705-102.936 91.203 44.053 131.391-146.345 94.684-100.674 104.779 -83.232 111.484-154.281 153.407 -20.358 95.893 -56.225 101.723-105.768 93.317 -41.603 134.800-179.062 97.050 -84.878 120.530 -66.928 88.593 88.017 130.556 -22.382 91.969 51.233 129.182 -75.966 90.018 44.382 98.839 -79.427 90.041 48.993 119.484 -17.948 89.597 47.733 138.054 -54.434 90.918 46.235 129.068 -76.996 92.290 113.939 119.827-100.535 92.253 -38.962 130.661 -77.954 92.959 -54.998 133.561-120.047 84.974 -59.241 119.084 4.517 90.484 -50.677 158.061 -19.059 90.739 -47.829 105.272 -82.715 93.955 107.236 106.352 -78.794 92.533 0.000 128.727 -76.583 # 747 total E -1.46720E+02 rmsd from N 0.000 %NC 0.00 92.688 134.044 131.102 -66.677 93.357 58.634 131.157 63.860 91.728 47.388 106.680 -82.254 92.116 42.750 131.050 -77.212 94.796 63.386 154.134 170.069 92.961 30.212 67.818 -81.593 95.738-111.888 97.422 -41.387 88.100 -49.741 175.406 171.727 104.187 -61.108 134.169-140.942 92.283-146.620 78.476 -94.320 97.297 79.372 150.182-177.854 96.915 35.450 91.908-119.705 92.672 49.489 116.758 -85.414 89.744 56.611 146.657-135.019 88.342 52.104 123.214-118.098 90.706 49.719 129.968-105.371 94.525-117.431 128.820 -74.687 94.719 119.988 136.312 -90.223 95.327 107.920 151.706 -83.739 94.616 45.904 143.748-162.331 90.826 46.161 0.000 0.000 89.600 52.188 135.246 -15.128 90.947 46.903 137.199 -92.907 90.822 42.253 131.458-158.684 88.050 60.673 109.282 -74.588 89.682 57.947 97.809 -42.238 88.586 46.719 143.966 -28.999 91.349 41.180 112.416 -89.756 102.578-177.754 106.829 -76.361 94.438 75.506 136.418-164.178 92.059 46.305 113.344 -77.298 89.616 80.185 113.778 -29.527 89.161 60.308 106.566 -74.443 90.361 41.388 128.969 -76.278 90.679 44.851 102.847 -80.814 90.213 54.520 141.881 -37.300 88.111 49.005 145.045-107.402 90.286 39.743 128.244 -76.688 90.539 49.087 115.190 -43.468 90.255 49.510 128.820 -76.538 89.867 44.955 138.581-130.487 90.628 44.766 127.511 -39.940 90.990 52.777 138.149 -83.438 90.186 43.623 135.523-139.197 95.305 75.786 104.185 -80.420 92.443 0.000 128.937 -76.673 # 748 total E -1.46865E+02 rmsd from N 0.000 %NC 0.00 93.427-163.913 133.645 -79.960 94.503 60.279 149.025 116.707 97.156 41.083 105.180 -76.282 95.139 34.534 131.820 -77.970 102.288 37.152 138.868-116.348 102.443 35.649 51.823 -81.388 94.677 44.245 141.468 -29.717 92.750 46.067 125.128-128.308 88.320 52.779 132.870-151.149 88.988 68.654 81.525-103.905 91.852-160.727 137.724 -90.929 92.969 73.882 98.961-123.273 89.460 57.116 107.555 -81.756 90.152 61.188 137.638 -32.478 89.878 38.794 130.525-121.170 96.398 62.878 133.832-102.340 100.745 -97.588 127.211 -61.027 92.009 115.053 103.085 -19.237 88.179 65.326 150.682 159.842 90.468 46.506 148.123-135.061 91.588 39.727 0.000 0.000 91.750 44.710 140.415 -25.390 91.119 48.409 136.296-100.675 88.662 56.035 128.602-165.391 85.346 58.426 109.425 -76.643 89.602 48.888 136.345 -93.995 90.736 50.621 135.622 -42.111 94.202 -99.814 104.567 -86.328 112.975-178.678 113.301 -78.238 130.247 -45.255 111.880-108.955 106.944 -24.902 112.635 -79.606 93.150 -47.882 114.574 -56.475 91.388 -45.741 112.256 -70.102 92.519 -43.749 126.757 -75.224 91.973 -37.436 101.070 -81.381 93.499 -42.541 144.594 -46.261 91.251 -55.911 153.219-109.286 89.917 -37.476 130.564 -78.021 96.292-115.083 135.526 27.265 91.937 51.180 129.599 -75.921 94.358 49.920 141.870-117.257 95.937 29.604 132.721 -57.536 95.352 56.968 156.014 -17.438 89.729 49.795 139.475-163.712 93.074 111.424 100.411 -79.126 92.515 0.000 128.701 -76.482 # 749 total E -1.48572E+02 rmsd from N 0.000 %NC 0.00 92.628 93.262 137.354 -91.250 94.150 50.194 115.002 -17.816 93.301 44.920 105.476 -81.600 92.335 45.566 128.317 -75.489 92.293 49.780 114.954 -81.910 90.043 40.858 62.122 -66.974 89.742 50.091 121.881 -29.026 89.272 44.733 124.789-101.343 92.108 55.389 134.086-118.890 89.531 83.304 92.345-105.037 102.702-140.414 129.160-103.088 95.181 66.663 96.324-111.459 93.375 44.463 104.235 -75.740 91.461 54.222 144.931 -34.902 89.804 45.426 130.877-128.901 93.822 55.415 124.854-115.823 96.941-108.702 127.235 -67.768 91.656 119.325 102.299 -17.932 90.029 64.701 167.677-174.341 93.930 41.572 103.264 -85.040 92.076 39.786 0.000 0.000 91.840 51.467 144.384 -20.536 88.492 49.459 136.123-105.821 91.020 56.200 119.606-133.063 85.593 67.244 111.403 -73.862 88.907 54.686 124.720 -84.329 91.098 62.058 135.289 -73.686 93.544 -54.104 141.186-123.219 130.997 124.184 152.181 -15.653 135.232-175.401 110.360-102.104 96.584 42.583 115.051 -77.486 91.979 50.670 129.743 -96.824 88.909 64.248 148.851 -10.686 87.951 59.687 130.429 -76.907 83.369 59.830 102.276 -82.608 87.191 66.285 107.960 -22.037 85.000 53.977 143.550 -24.911 87.723 49.221 127.961 -76.247 87.226 53.853 114.746 -25.042 87.794 49.387 129.768 -75.606 89.069 45.308 144.699-128.616 89.156 48.148 131.954 -44.867 87.805 59.633 136.644 -49.654 88.945 42.860 117.440-120.152 94.498 85.258 103.626 -80.308 92.521 0.000 128.731 -76.775 # 750 total E -1.47029E+02 rmsd from N 0.000 %NC 0.00 92.657 154.225 124.042 -53.002 116.297 108.310 120.681 57.584 89.932 -47.286 103.059 -78.443 91.095 -45.811 130.065 -76.177 93.333 -40.783 143.159-127.744 93.525 -44.463 63.467 -56.552 87.431 -43.847 131.399 42.989 99.687 -65.348 159.846 177.436 90.179 -41.390 125.165-101.316 93.281 120.702 80.511 -70.961 89.889 74.980 152.388 -35.245 92.461 37.836 95.764-112.540 96.889 57.112 104.773 -83.712 95.639 -16.852 147.562 -95.183 128.816-163.478 113.695 -90.649 108.783 48.151 146.516 154.151 93.720 46.204 135.486 -84.817 90.727 49.405 123.152 -50.883 91.015 54.977 113.898 -35.535 90.172 45.179 149.755 -20.566 89.910 46.000 0.000 0.000 89.695 60.330 110.283 -83.775 87.050 48.896 141.292 -75.792 89.265 43.995 120.190-126.584 89.129 52.935 111.716 -76.076 89.548 51.573 140.631-102.621 90.605 46.095 131.241-152.251 94.601-102.269 104.267 -83.126 109.164-167.936 151.979 -17.932 101.841 -48.066 98.103 -98.219 98.718 -36.735 112.074 -77.254 93.470 -42.202 112.480 -48.344 92.482 -47.073 109.436 -73.441 91.163 -46.602 128.858 -76.835 89.353 -37.638 134.697-149.050 95.655-101.623 134.821 -20.116 88.958 73.344 154.551 -32.619 91.565 45.515 129.901 -76.791 92.237 112.034 108.331-119.970 93.430 -40.778 129.747 -76.887 96.025 -48.469 142.135-120.951 95.794 -28.233 124.432 -15.860 98.508 -55.077 155.782 -26.550 91.394 -39.119 143.348-149.347 97.470 86.495 102.793 -79.226 92.363 0.000 128.914 -76.443 # 751 total E -1.47607E+02 rmsd from N 0.000 %NC 0.00 124.688-113.004 146.159 -39.909 120.597-101.916 131.185 -36.121 93.324 44.343 108.991 -80.308 92.911 45.473 131.067 -77.860 94.460 44.816 147.575-139.403 91.851 44.912 55.498 -73.310 89.689 45.811 130.936 -31.340 90.042 48.692 126.714-115.396 87.095 49.160 134.334-143.830 87.966 56.100 78.618-102.638 88.186 125.089 139.078 -86.301 90.407 79.808 101.095-126.252 88.121 96.352 98.166 -85.319 91.769 -77.380 101.913 -79.822 99.709-109.367 150.109 -39.115 89.809 59.721 146.969 116.850 92.259 46.675 137.567 -80.446 90.339 46.323 151.131 -14.158 90.028 50.392 139.681 -19.240 89.210 49.571 141.492-152.103 90.051 43.624 0.000 0.000 90.000 49.796 110.925 -81.940 88.894 49.391 140.180 -80.747 90.300 44.012 122.480-128.755 89.555 47.923 115.360 -75.889 90.787 46.149 137.265-106.972 93.158 57.499 134.985-115.387 92.614 -92.840 148.258 -30.029 111.662 154.591 150.828 -17.259 99.921 -61.506 96.510-110.888 112.760-170.541 115.511 -78.356 93.871 55.568 121.043 105.580 95.346 88.345 112.030 -75.033 90.878 -82.325 126.918 -74.855 92.379 -39.953 103.353 -80.192 89.564 -50.288 129.034 -74.125 90.058 -44.668 137.577-107.452 90.995 -45.060 127.669 -76.090 88.306 -47.490 123.591 -29.961 90.857 -50.497 128.135 -76.202 89.981 -41.052 144.759-153.700 89.977 -47.763 125.341 -15.268 91.016 -53.102 151.742 -24.112 90.853 -45.029 142.789-162.983 95.835 92.403 104.687 -79.699 92.503 0.000 129.075 -76.468 # 752 total E -1.48891E+02 rmsd from N 0.000 %NC 0.00 124.628-112.885 146.370 -41.772 119.269-104.929 132.632 -36.436 92.213 46.476 107.718 -80.440 93.035 45.686 130.667 -78.041 95.019 45.239 149.294-133.020 91.760 44.648 56.379 -75.824 89.743 46.636 127.868 -36.307 90.936 48.412 124.675-111.110 86.833 47.161 138.997-157.965 88.681 52.543 76.289-103.374 89.766 129.981 137.324 -81.469 89.977 78.488 102.804-127.586 90.997 101.116 97.213 -84.440 92.015 -68.865 128.847 -67.040 98.837-117.478 149.474 -45.154 90.504 52.406 135.610 118.902 91.240 47.144 137.687 -83.475 90.253 48.190 144.001 23.883 88.651 52.946 140.764 -17.490 87.581 51.624 142.244-145.226 90.160 43.895 0.000 0.000 89.007 49.573 124.982 -77.935 89.848 49.492 138.532 -86.318 90.405 43.397 122.849-128.602 88.653 50.183 114.680 -76.387 91.288 58.175 136.096-106.787 90.784 62.431 135.465-131.489 91.902 -16.000 141.355-129.181 123.762-161.565 110.617 -79.524 97.455 47.955 137.016-161.623 97.886 35.366 114.925 -78.043 93.029 49.517 144.851-140.337 91.129 84.175 110.034 -75.752 86.927 58.613 131.279 -77.182 85.799 49.109 101.892 -82.350 88.786 47.847 112.284 -39.071 89.285 49.047 140.651 -35.638 88.778 44.538 128.267 -76.493 88.164 53.708 108.649 -49.743 90.626 40.510 127.475 -76.202 92.269 48.929 144.964-143.846 91.535 55.160 129.314 -44.537 91.344-136.574 127.581 -76.200 94.222 31.194 106.697 -84.555 119.471-140.567 148.012 -15.670 126.876 0.000 146.353 -89.963 # 753 total E -1.49540E+02 rmsd from N 0.000 %NC 0.00 93.129 167.148 137.394 -88.877 92.686 58.362 145.736 41.836 92.807 43.419 106.366 -83.050 92.128 50.199 131.420 -76.815 93.085 41.369 148.802-136.526 90.721 44.269 62.458 -77.310 90.850 44.977 118.240 -45.252 91.858 44.490 134.123 -94.584 88.691 43.490 142.230-146.514 91.461 52.876 76.375-101.742 91.037 130.468 135.292 -77.331 92.600 82.203 136.384-164.624 90.928-176.787 100.690 -86.164 138.817-142.017 164.601-156.537 104.315-114.173 139.437-150.319 93.288 47.261 142.129-112.614 92.748 47.692 136.215 -75.328 91.664 44.147 126.210 -57.007 92.632 46.776 125.674 -21.883 91.471 45.066 145.253-152.086 91.455 45.104 0.000 0.000 93.624 41.754 104.324 -84.403 90.463 47.758 157.142 -82.314 90.473 45.757 113.597-132.707 89.632 46.399 108.749 -76.316 90.278 50.702 140.860 -88.155 92.030 43.167 140.460-145.983 93.148 41.483 115.372 -90.032 97.984 15.116 119.333 -87.609 135.856-170.916 106.970 -96.409 112.444 34.330 118.073 -79.472 93.180 50.574 109.969 -16.023 91.310 44.096 112.631 -78.244 90.658 60.675 130.095 -75.913 84.412 49.609 104.857 -86.354 89.837 43.300 102.676 -70.414 90.362 49.281 138.123 -39.035 90.236 45.934 129.639 -77.503 90.423 115.598 100.641 -99.212 92.555 -36.568 129.592 -78.166 94.345 -54.322 144.497-161.776 89.898 -43.476 125.404 -9.402 96.236 135.837 150.335 -4.423 91.245 44.408 138.921-160.415 107.387 -86.704 104.738 -67.841 92.855 0.000 129.305 -76.581 # 754 total E -1.47814E+02 rmsd from N 0.000 %NC 0.00 93.141 -66.026 128.256 -80.531 94.409 -47.519 116.532 -79.666 90.678 -47.333 103.259 -77.348 90.336 -47.629 129.221 -76.256 91.559 -40.249 139.891-124.416 94.530 -41.608 62.972 -66.474 91.989 -37.505 131.973 -2.356 104.412 -32.579 168.832 145.438 95.749 -52.004 126.514-119.943 95.063-152.235 77.151 -82.216 93.978 59.498 159.164 177.238 95.683 38.978 94.112-123.437 93.420 45.704 139.923-137.305 91.992 82.377 140.643 -30.335 90.954 38.632 128.837-128.348 95.536 48.138 128.151-121.994 97.389 10.362 137.594 -68.063 114.221 154.601 148.375 -45.160 97.443 49.252 109.792-177.937 99.491 52.447 108.774 -81.977 120.300 -5.977 0.000 0.000 93.281 59.585 116.805 -84.437 90.630 44.364 134.859 -96.261 90.583 47.080 115.485-120.914 89.480 46.503 113.539 -75.902 91.048 49.440 139.293-103.073 91.155 47.064 129.409-147.448 93.740-106.661 103.502 -82.453 109.632-164.046 152.879 -20.282 95.142 -57.658 97.402-106.627 90.501 -51.531 110.406 -75.030 91.790 -65.351 106.505 -55.614 88.702 110.318 115.969 -76.812 94.591 45.326 128.222 -76.536 90.865 53.538 101.443 -77.629 91.352 93.568 136.204 -61.015 90.064 50.760 154.277-143.503 90.700 42.366 128.246 -76.288 90.169 56.803 123.909 -35.497 89.764 59.917 128.230 -75.755 90.327 35.522 139.067-136.572 95.604-124.160 135.040 -60.048 95.318 -56.503 146.817 -29.598 92.567 -45.729 142.428-122.140 96.914 83.999 104.771 -79.396 92.464 0.000 129.103 -76.343 # 755 total E -1.46820E+02 rmsd from N 0.000 %NC 0.00 93.579-174.542 139.990-103.097 94.038 54.983 139.469 50.668 94.004 40.755 106.163 -81.605 92.112 48.125 131.337 -77.310 92.250 46.666 146.179-138.978 91.481 41.420 61.093 -72.822 92.151 43.358 124.412 -36.266 92.181 42.390 135.494-106.752 89.833 52.099 141.803-163.544 87.690 54.860 79.758-104.395 89.652 159.567 129.234 -83.203 93.107 67.834 130.090-155.679 93.186 38.359 97.740 -81.706 93.133 50.305 149.422 -33.448 90.859 41.104 135.647-113.723 92.707 53.910 124.019-127.151 92.107 40.762 132.921 -84.778 93.798-120.794 152.131-127.277 99.224 -56.341 138.834-116.473 93.488 123.821 145.786-145.436 94.795 45.924 0.000 0.000 90.909 50.957 114.012 -76.856 89.080 44.812 143.910 -85.783 90.317 45.816 117.722-126.132 89.195 48.491 108.632 -74.457 91.199 46.171 139.348 -89.190 92.523 44.993 130.885-118.505 92.552 36.767 142.835-128.649 104.471-121.341 104.326 -82.981 115.273 -67.555 116.548-124.572 92.430 76.214 131.039 49.581 90.935 122.907 120.801-101.946 95.531 -35.472 110.935 -78.207 94.043 -51.490 126.460 -75.327 97.171 -25.016 101.129 -82.114 94.311 -50.390 112.721 -54.215 90.016 -46.794 156.561 -23.583 92.757 -56.921 129.553 -76.968 95.774-115.539 102.765 -54.147 92.073 46.992 128.929 -75.630 93.370 50.939 142.353 -86.752 90.492 52.571 128.972 -25.911 95.709 177.764 106.613 -56.003 91.572 36.903 144.204-144.550 115.480-159.855 103.065 -77.778 92.845 0.000 129.683 -76.184 # 756 total E -1.49755E+02 rmsd from N 0.000 %NC 0.00 92.888 147.606 137.519 -84.397 92.539 57.347 145.524 45.143 91.954 47.221 105.525 -80.795 92.371 46.425 131.701 -77.797 96.214 41.876 152.906-133.339 92.144 41.947 57.060 -80.013 91.360 46.066 121.205 -45.258 92.826 44.469 131.112 -96.753 88.331 45.817 145.844-149.993 90.158 52.818 80.015-105.197 91.717 176.733 137.168 -91.589 90.536 73.897 107.399-150.081 93.404 41.764 101.184 -80.939 90.831 50.584 143.694 -42.561 91.753 46.531 123.076-117.317 91.463 48.100 123.657-124.395 91.858 41.727 125.277 -76.896 98.093-105.589 109.438 -79.648 115.319-112.605 110.090 -80.291 91.653 62.986 152.320 -15.389 90.828 52.492 0.000 0.000 89.453 47.449 135.367 -22.476 89.846 51.462 140.257 -84.217 88.158 55.585 132.755 163.699 86.598 55.591 110.321 -72.782 89.656 41.969 149.657 -98.359 92.651 60.091 130.023 -14.725 93.659 -70.530 103.732 -85.593 118.723 111.215 160.961-148.759 123.305 171.541 114.823-117.770 95.825 54.946 121.232 73.116 92.347 100.422 130.911 -97.281 96.946 -11.438 113.819 -75.401 96.185 -79.206 127.417 -75.592 91.219 -38.594 98.300 -81.275 90.232 -54.727 110.492 -42.955 91.275 -32.896 150.304 -24.332 98.021 -65.198 129.053 -76.742 117.593-103.357 142.602 9.360 91.444 54.134 130.852 -76.963 91.922 45.052 140.437-101.279 89.664 50.925 124.519 -18.684 89.875 61.503 139.161 -99.413 87.519 40.530 131.692-145.964 95.333 85.705 103.580 -79.678 92.501 0.000 128.970 -76.462 # 757 total E -1.50897E+02 rmsd from N 0.000 %NC 0.00 93.193 -75.612 126.421 -70.810 121.278-101.013 133.295 -25.318 94.644 40.239 110.556 -80.086 93.736 49.773 131.131 -76.432 94.076 38.316 144.813-123.229 92.512 43.889 63.211 -86.278 91.332 43.124 117.147 -50.477 91.086 45.715 141.884 -98.112 89.134 44.567 134.984-129.970 89.854 48.043 82.793-103.826 91.055 113.989 139.361 -97.647 90.660 81.649 109.130-140.292 90.397 112.273 102.116 -87.584 112.521 -29.444 132.622-101.552 103.979-122.042 140.809-145.829 93.944 46.225 152.210-178.805 93.256 45.533 135.516 -83.029 90.575 47.278 132.966 -44.215 91.258 53.762 128.314 -60.311 87.714 45.214 139.620-177.731 90.374 45.452 0.000 0.000 92.632 40.219 108.760 -81.424 93.406 47.020 147.641 -81.204 93.405 39.660 117.147-126.721 90.626 48.525 121.549 -78.311 92.044 45.770 126.706-109.493 92.919 67.161 133.698-166.909 91.495 -76.651 102.634 -84.959 114.603 151.474 149.657 -15.543 137.518 152.237 108.457 -97.703 94.709 43.806 118.425 -78.569 92.416 47.591 119.663 -45.015 90.157 47.214 126.950 -46.088 91.174 48.112 128.495 -74.614 89.792 42.698 106.415 -89.739 91.864 42.402 123.327 -85.294 91.119 50.261 130.494 -83.607 90.383 43.719 129.815 -77.770 91.913 112.114 98.884-100.876 94.203-124.302 129.606 -77.768 92.345 57.573 140.602-106.337 92.302 46.088 124.200 -9.975 91.464 51.025 152.297 -98.833 90.996 42.419 132.553-165.247 95.493 72.920 103.599 -79.845 92.625 0.000 129.004 -76.685 # 758 total E -1.47588E+02 rmsd from N 0.000 %NC 0.00 93.166 161.470 140.511 -98.662 93.530 53.782 138.383 31.333 91.776 46.122 106.509 -82.528 91.821 47.317 130.494 -77.284 93.691 45.644 145.527-122.457 92.015 41.778 58.184 -72.677 90.730 46.192 124.307 -32.281 90.791 46.905 126.650-102.407 88.400 49.998 140.157-131.163 90.624 70.091 83.637-103.065 88.750 -89.234 135.186 -93.249 96.824 -44.985 95.153 -88.289 92.360 -49.745 150.012 -5.470 91.450 -49.711 145.725-100.683 93.568-119.269 134.318-167.528 92.683 42.541 137.369-114.211 92.053 52.650 136.092 -75.974 90.952 47.004 128.197 -66.182 92.179 44.524 133.363 -25.989 93.013 41.058 144.094-147.079 92.644 45.336 0.000 0.000 90.238 56.228 117.612 -78.856 89.147 44.938 131.355 -83.901 91.602 39.831 121.998-120.647 97.976 152.507 109.345 -76.773 94.822 46.305 159.108-167.807 95.819 43.372 139.176-136.955 99.100 86.875 152.514 -22.191 137.403 -50.038 116.109 -98.299 117.632-131.285 114.297-117.946 101.925 33.933 115.660 -77.897 94.954 43.259 109.384 -17.253 96.048 37.842 132.316 -3.494 93.936 46.760 129.338 -76.824 90.360 39.721 101.834 -85.341 90.866 49.676 116.250 -34.201 92.406 42.841 135.283 -47.812 91.762 42.035 129.508 -77.275 93.771 68.344 104.480-100.237 91.932-102.931 128.638 -76.556 95.177 -33.871 140.569-119.006 91.396 -55.463 137.867 103.263 92.201 -49.895 153.298 -25.337 91.417 -41.364 139.660-135.245 97.176 122.082 104.708 -79.406 92.513 0.000 128.783 -76.147 # 759 total E -1.46454E+02 rmsd from N 0.000 %NC 0.00 93.168 168.645 137.681 -90.460 93.100 59.952 140.246 40.072 93.132 42.473 106.870 -82.449 92.109 48.934 131.241 -76.626 92.159 42.926 148.977-138.229 91.660 44.647 59.703 -70.422 90.946 45.281 122.015 -33.030 89.946 45.489 132.060 -99.822 90.569 48.450 128.779-116.952 92.683 94.665 87.306 -98.469 90.874-145.144 147.609-111.879 92.383 60.820 96.470-122.825 92.613 45.618 99.912 -79.473 92.444 49.617 146.764 -37.150 91.776 43.518 132.457-128.564 95.116 57.775 126.113-115.479 98.932-102.143 125.810 -73.137 91.933 125.243 98.130 -16.987 88.920 74.784 152.430 174.942 92.154 40.600 134.398-130.093 91.300 45.185 0.000 0.000 88.408 56.729 137.121 -28.407 89.930 47.565 124.392 -96.395 90.095 44.185 134.743-162.488 88.492 55.712 109.062 -74.612 89.154 54.421 110.665 -49.880 89.282 47.849 130.716 -32.045 90.747 39.621 113.856 -89.218 100.486-117.392 107.150 -77.884 120.976 107.809 118.983-125.062 117.934-171.529 118.284 -81.869 150.728 -25.166 117.520 39.676 99.377 47.360 122.462 -73.546 93.569 39.918 129.110 -76.259 92.855 41.022 100.018 -79.059 91.834 50.814 148.247 -38.879 88.252 48.392 157.314-153.678 90.013 41.045 128.135 -76.550 90.222 48.399 119.595 -48.902 90.422 46.404 128.959 -76.897 90.573 46.026 138.740-126.747 90.331 47.409 128.375 -41.605 90.292 52.571 136.979 -95.806 90.414 43.578 133.492-136.290 95.524 72.475 104.363 -80.283 92.513 0.000 129.054 -76.639 # 760 total E -1.52165E+02 rmsd from N 0.000 %NC 0.00 93.174 164.897 139.120 -93.644 92.769 56.645 139.393 41.204 91.892 44.989 106.193 -82.867 92.192 49.126 130.398 -76.493 92.386 43.312 149.559-140.589 91.433 44.320 60.856 -73.170 91.231 45.394 121.815 -38.009 91.271 43.180 132.844-102.536 90.343 50.219 136.302-129.893 90.809 86.554 85.485-101.993 90.050-155.348 144.451-108.905 92.132 63.465 96.858-126.896 91.858 46.970 101.012 -84.776 90.598 54.098 144.630 -31.623 90.882 39.416 126.994-123.406 96.402 64.013 129.527-109.291 98.754 -99.296 128.740 -71.265 91.308 114.666 101.879 -15.036 87.976 68.171 152.375 176.769 91.992 43.158 141.005-128.149 90.611 42.564 0.000 0.000 89.332 52.675 135.013 -29.857 90.754 46.965 128.135 -93.575 90.189 43.638 134.574 177.142 88.691 53.091 106.524 -74.400 90.276 77.503 111.389 -46.630 87.589 54.181 132.994 -15.628 90.368 36.538 112.347 -88.855 100.202-165.941 111.786 -74.929 94.894 77.291 133.880-160.617 89.780 58.284 112.308 -76.197 89.478 59.622 152.851 17.454 89.616 46.839 126.862 -2.404 91.691 40.149 129.307 -76.575 89.988 47.624 106.804 -85.316 88.194 59.198 133.999 -39.024 87.021 49.631 141.873 -53.749 87.901 42.442 132.657 -95.488 88.765 54.726 121.786 -43.051 89.197 44.774 128.022 -76.613 90.124 46.960 140.815-145.267 89.887 52.416 129.402 -44.267 88.861 53.492 136.422 -79.176 90.478 44.005 134.964-128.970 95.108 75.566 104.241 -80.390 92.547 0.000 128.939 -76.740 # 761 total E -1.46928E+02 rmsd from N 0.000 %NC 0.00 93.197 -71.243 128.994 -81.823 94.738 -47.480 115.969 -78.795 91.395 -45.715 103.237 -76.895 90.495 -47.100 129.076 -76.120 91.758 -41.445 143.188-129.470 92.082 -42.672 58.367 -71.596 91.827 -79.839 123.743 -17.406 89.746 96.286 148.497-105.289 92.081 59.698 141.708 177.519 92.341-176.759 119.970 -23.255 148.069-151.035 156.947-156.768 97.298 -59.966 95.647 -94.330 103.477 170.274 105.051 -80.307 101.637-104.282 171.812-157.641 106.966-119.680 142.155-148.039 93.643 43.340 147.011 153.288 92.939 44.967 134.048 -84.492 90.903 46.525 132.095 -60.836 91.859 51.074 125.615 -41.019 90.955 41.640 108.688 -82.840 90.374 44.781 0.000 0.000 89.865 57.186 107.745 -85.233 87.539 45.877 137.298 -79.617 89.182 43.806 120.307-123.552 90.077 50.597 110.796 -77.529 89.952 47.344 137.819 -98.685 92.466 52.071 131.981-139.783 95.149 -96.072 103.637 -84.238 104.162-163.351 152.196-130.834 135.077 -55.322 113.113-108.283 95.191 -44.847 110.727 -80.951 96.501-119.610 131.609 -45.696 90.689 56.364 123.793 -4.725 91.782 51.297 130.323 -75.948 91.277 39.566 106.082 -81.186 91.885 43.248 123.154 -37.364 90.134 53.274 151.564 -38.798 87.925 50.145 128.637 -77.362 86.794 50.468 107.094 -52.180 89.980 45.607 127.232 -75.275 90.366 46.704 144.431-131.848 90.136 48.639 128.274 -42.588 89.515 53.452 134.753 -82.586 90.353 43.785 132.092-126.136 95.365 74.244 104.351 -80.859 92.457 0.000 128.908 -76.617 # 762 total E -1.54450E+02 rmsd from N 0.000 %NC 0.00 93.182 164.537 139.800 -96.344 93.295 55.000 140.650 36.019 91.898 45.751 106.055 -82.008 91.776 48.453 131.352 -77.671 93.927 44.868 149.168-129.083 91.213 42.842 59.483 -75.608 90.529 46.485 123.625 -42.653 91.385 46.618 128.529-107.223 87.874 47.190 141.709-159.585 88.413 50.926 78.412-104.897 91.364 133.014 137.985 -89.352 91.200 77.750 101.549-128.287 93.452 105.906 95.999 -83.241 93.060 -64.093 128.643 -82.005 95.690-118.789 135.611-138.815 89.600 54.207 135.506 117.924 91.805 47.059 134.518 -85.551 90.713 45.042 145.967 -8.550 90.246 49.738 138.985 -16.302 88.601 50.188 143.250-149.853 89.942 44.388 0.000 0.000 89.610 48.894 120.839 -76.884 89.701 46.507 138.171 -79.331 88.832 45.792 122.226-125.246 88.833 48.940 110.686 -80.820 90.019 50.800 140.478-106.607 91.109 47.089 134.162-127.637 92.988-107.290 103.172 -82.449 102.445 175.785 149.724 -16.845 105.996-159.260 89.359 -87.453 91.778 53.353 114.938 -76.262 93.598 43.826 104.632 -22.302 93.078 41.595 130.936 -8.248 91.388 45.775 130.097 -76.915 89.622 46.565 102.045 -85.428 90.015 45.336 120.479 -37.553 91.991 43.310 135.174 -57.243 93.089 38.140 128.764 -76.821 95.211 105.450 103.450 -82.078 124.687 171.673 142.037 -93.720 92.545 46.390 140.842-108.866 93.358 42.608 123.398 -26.882 92.751 48.282 151.416 -30.145 91.597 43.096 141.449-155.665 94.296 108.773 102.199 -79.794 92.558 0.000 128.782 -76.532 # 763 total E -1.49206E+02 rmsd from N 0.000 %NC 0.00 93.099 -64.947 126.606 -70.365 122.341-102.327 131.656 -43.096 93.411 42.132 110.145 -80.966 93.702 48.327 129.904 -76.757 94.225 40.697 156.013-148.065 93.768 43.672 67.659 -98.047 90.087 44.064 114.266 -58.567 89.144 56.779 130.217 -95.010 87.717 63.378 129.996-109.048 81.962 171.054 86.731 -98.372 94.088 67.707 136.073-154.199 94.009 47.183 91.896-123.836 94.518 67.723 109.192 -86.819 94.394 -81.592 148.818-118.353 116.714-113.647 143.314-161.066 94.990 44.242 140.683-132.356 92.646 45.775 136.628 -79.440 90.138 51.212 125.622 -66.722 91.659 52.716 117.246 -95.933 91.325 39.991 137.464-168.860 90.207 46.957 0.000 0.000 90.460 59.523 102.300 -84.574 86.344 47.131 144.720 -74.957 89.884 42.846 118.390-127.706 90.784 48.723 107.189 -75.042 89.737 46.708 136.459 -79.123 93.607 48.061 136.364-136.841 95.556 17.767 143.099-133.603 124.437 82.087 163.938-152.447 136.138 -65.717 111.183-102.116 109.879 -22.277 112.822 -80.726 92.075 -50.597 109.044 -55.468 90.278 -48.820 109.155 -69.789 89.654 -45.987 127.829 -76.321 88.123 -46.459 102.461 -87.735 87.680 -61.260 106.142 -64.350 84.471 -56.569 162.053-122.574 89.151 -46.805 128.287 -76.381 92.895-128.233 124.445-121.488 90.580 50.793 132.607 -77.116 90.491 49.203 140.847-107.969 90.267 61.835 124.000 -12.063 89.897-114.123 137.917 -56.936 100.135 -5.852 109.817 -86.666 125.404 91.803 102.583 -74.358 92.544 0.000 129.633 -76.843 # 764 total E -1.47929E+02 rmsd from N 0.000 %NC 0.00 123.055-100.750 150.595 -73.917 97.872 -45.015 129.553-124.985 91.314 -62.232 99.534 -80.209 91.489 -88.793 127.697 -74.868 85.793 88.665 139.294-128.106 95.883 42.163 128.517-166.879 93.503 40.545 116.655 7.313 95.085 40.234 142.144 -85.160 93.333 68.799 150.862-170.526 88.399 127.563 109.008-155.097 130.286 -92.391 135.513-146.312 107.002 29.090 92.661-103.354 95.117 64.427 120.901 -83.338 91.050-150.793 150.367-141.701 126.560 -99.604 157.649 -13.664 95.499 40.982 155.929 172.643 93.052 44.295 136.183 -84.087 90.436 50.395 121.670 -71.714 91.501 53.942 133.015 -97.378 90.719 38.885 108.392 -83.262 91.046 45.445 0.000 0.000 89.977 57.968 107.950 -86.982 87.945 46.980 139.930 -82.322 89.574 42.316 119.303-126.453 89.552 53.733 109.845 -76.276 90.412 50.358 138.869 -95.838 91.550 40.857 131.791-148.592 96.208 51.247 115.412 -88.760 125.335-176.128 107.502 -78.534 97.331 53.032 128.350-150.460 93.009 43.789 114.134 -77.338 89.627 59.484 119.368 -13.464 89.360 49.773 106.425 -73.190 91.334 43.036 128.998 -76.139 93.361 37.778 103.898 -81.363 91.632 51.702 151.534 -24.424 87.821 50.933 152.763-147.022 89.628 40.963 128.099 -76.592 90.270 47.014 117.609 -35.403 90.107 46.960 130.113 -77.247 90.614 49.371 138.026-128.262 89.026 47.403 127.578 -41.071 89.859 54.909 133.186 -85.974 89.686 43.214 132.023-122.517 95.319 77.039 104.018 -80.532 92.530 0.000 129.000 -76.622 # 765 total E -1.46846E+02 rmsd from N 0.000 %NC 0.00 93.138 -81.008 122.070 -59.845 118.475-102.862 131.803 -32.904 93.875 42.256 109.412 -80.950 93.045 48.880 131.442 -76.941 93.271 41.183 149.728-140.655 91.581 44.950 57.432 -73.007 90.314 46.058 119.158 -29.000 89.527 45.251 133.126 -99.270 91.300 49.968 126.278-113.547 90.728 177.220 93.016 -96.764 132.143 105.015 151.593-164.780 92.990 57.720 95.638-126.983 96.796 62.621 105.253 -87.612 95.039 -79.883 164.083-144.266 109.353-114.726 137.274-160.054 94.723 42.703 153.784-140.400 92.943 46.991 134.116 -80.826 90.799 47.732 130.685 -60.216 92.650 48.736 98.352-111.936 91.333 41.142 129.619-177.932 89.217 49.873 0.000 0.000 90.091 55.998 102.565 -84.970 87.152 45.197 148.140 -77.134 90.056 43.643 117.586-129.707 89.573 52.273 112.033 -75.986 89.985 44.870 137.173-100.211 91.713 46.609 130.887-151.484 96.009 -67.541 105.106 -84.081 132.244 112.834 152.718 -13.911 127.176 156.825 109.716-105.535 94.870 50.573 117.972 -77.614 92.297 45.539 112.396 -21.110 92.244 43.322 122.865 -21.510 92.349 44.686 128.068 -75.634 89.720 46.397 108.950 -94.300 90.075 48.883 121.149 -37.994 91.590 44.078 129.504 -59.703 91.829 37.886 130.719 -77.668 96.378 113.876 101.647-103.054 89.863 -63.762 129.814 -77.906 90.796 -45.676 145.381-124.079 89.666 -46.034 119.670 9.300 92.359 -50.045 150.956 -32.125 91.784 -45.052 143.467-144.664 96.688 110.645 104.833 -79.437 92.466 0.000 128.988 -76.035 # 766 total E -1.46788E+02 rmsd from N 0.000 %NC 0.00 122.987-108.433 150.328 -77.033 96.056 -47.900 127.240-103.150 91.962 -52.344 107.044 -81.519 91.278 -52.403 129.310 -76.255 93.548 137.014 143.930-157.947 105.977 39.678 135.784 162.289 90.282 46.994 122.003 -45.202 94.383 45.843 136.004 -95.330 88.952 45.891 153.125-124.309 90.345 49.207 79.076-108.126 92.808 50.947 135.275 -85.943 134.756-132.641 107.357 -96.334 110.822 177.890 103.355 -83.109 95.660 -49.000 149.223-133.921 96.964-118.056 136.747-159.469 93.227 43.806 147.973 133.018 91.727 48.902 135.130 -84.332 90.446 48.139 127.496 -62.389 91.729 48.397 132.331 -37.493 90.851 41.287 144.935-156.451 90.685 46.442 0.000 0.000 90.300 55.808 109.792 -80.522 87.751 43.136 141.690 -83.897 89.235 45.782 117.784-124.669 89.346 54.128 108.998 -78.613 88.507 52.262 147.325-108.459 90.148 38.680 128.322-142.334 97.604-119.361 105.450 -82.361 110.839 173.849 157.614-146.118 97.244 -55.852 92.110 -99.808 87.712 -55.468 110.784 -75.225 89.322 -54.016 127.978 -39.700 89.719 -45.846 115.568 -74.105 90.696 -43.089 127.023 -75.435 89.544 -47.729 103.652 -79.243 91.660 -44.438 149.776 -24.103 91.697 -43.405 142.309 -93.916 91.961 -49.597 128.266 -76.658 92.141-117.794 129.630 27.513 91.567 -54.689 129.373 -77.341 91.970 -38.744 143.142-124.882 89.879 -56.939 123.422 -15.115 90.173 -69.331 150.785 -26.494 89.150 -56.308 133.015-117.581 94.846 74.711 102.999 -78.902 92.435 0.000 129.206 -76.124 # 767 total E -1.52622E+02 rmsd from N 0.000 %NC 0.00 93.180 169.212 135.930 -84.817 94.301 58.810 127.158 55.622 93.922 38.853 105.377 -79.795 91.857 48.373 132.191 -78.037 89.117 48.551 154.680-169.557 93.258 40.604 60.153 -62.142 91.955 41.991 126.915 -24.065 87.989 51.889 134.843-113.639 90.809 50.173 117.446 -94.051 89.594 61.405 97.080 -93.795 96.932 -35.787 136.257 -99.492 116.066 -91.684 89.704 -73.305 107.697-106.242 150.815 5.866 139.616 171.113 165.295-168.003 104.130-107.995 141.284-155.399 93.158 49.262 140.340 139.309 91.495 46.598 135.413 -85.463 90.030 50.463 121.760 -59.920 90.920 49.851 129.108 -30.156 90.931 42.403 143.864-157.760 90.002 47.718 0.000 0.000 90.097 57.206 105.736 -81.865 88.154 42.498 140.064 -78.443 91.719 43.207 118.612-122.812 90.699 52.853 108.015 -75.775 89.676 52.733 127.305 -80.691 92.339 40.114 135.041-137.585 95.740 40.176 113.330 -89.984 100.525 40.619 141.974 -91.212 137.999-175.438 109.879 -99.371 96.173 45.820 115.305 -77.466 93.107 45.255 105.092 -8.987 89.484 50.393 132.025 -14.864 90.046 52.298 129.599 -76.953 88.104 44.814 102.979 -83.471 90.705 43.034 133.485 -46.773 90.839 52.248 141.937 -90.800 89.149 48.253 128.440 -77.055 90.427 75.752 111.472-100.295 88.358 -89.872 129.270 -77.521 92.931 -46.823 144.938-126.195 87.646 -57.697 111.090 4.166 90.185 -52.787 145.492 -27.599 90.798 -39.031 142.375-124.347 100.130 116.709 104.495 -79.027 92.402 0.000 129.384 -75.789 # 768 total E -1.50991E+02 rmsd from N 0.000 %NC 0.00 93.128 160.997 139.785 -94.899 93.370 55.309 139.478 36.295 92.191 44.902 106.335 -82.046 91.757 48.405 131.664 -77.733 93.372 44.352 149.400-128.941 91.098 43.667 58.616 -72.815 89.942 47.815 125.677 -38.328 90.539 47.882 127.192-106.994 86.842 46.502 140.444-161.668 88.951 52.865 76.436-103.006 89.168 129.774 138.571 -83.977 90.428 83.290 101.537-128.121 90.600 98.428 97.428 -85.205 92.478 -69.695 131.205 -81.418 99.964-116.499 135.729-140.463 90.428 51.669 135.775 116.616 90.938 47.601 134.279 -84.489 89.971 49.482 140.946 21.722 88.641 52.694 141.040 -16.316 87.079 51.761 142.052-144.142 89.459 46.496 0.000 0.000 88.558 50.465 130.612 -76.916 89.017 46.488 136.989 -93.471 89.180 47.322 121.829-129.476 87.879 52.108 111.566 -78.008 89.464 53.348 142.973-109.112 89.264 44.025 125.086-146.466 94.875-115.914 104.572 -82.735 108.439 175.598 154.924-137.903 97.550 -60.293 93.338-106.855 90.586 -52.838 109.808 -76.535 89.425 -51.996 139.048 -12.298 89.808 -52.405 140.886 -8.885 91.249 -42.871 127.881 -75.824 92.606-117.940 110.375 -81.882 108.725 44.121 159.908 -12.924 90.775 52.090 164.301 171.766 91.737 39.436 128.498 -75.903 92.154 47.682 115.750 -48.534 90.251 44.336 131.416 -77.983 90.941 46.912 141.605-108.464 89.691 48.607 127.645 -39.394 89.299 54.409 135.723 -96.769 90.110 41.896 131.254-131.302 95.973 109.886 146.820 -24.460 124.033 0.000 144.607 -92.554 # 769 total E -1.46503E+02 rmsd from N 0.000 %NC 0.00 92.670 87.004 139.263 -98.732 93.534 54.975 141.671 21.190 93.158 43.187 106.318 -82.926 92.155 48.556 130.464 -76.612 92.643 45.073 138.716-114.571 90.778 42.311 61.978 -73.179 91.619 44.097 124.614 -36.649 91.658 43.435 134.534-103.004 89.001 47.688 138.785-140.996 88.110 53.401 76.729 -98.581 89.871 55.282 139.351 -76.834 97.844 25.678 94.026 -94.248 93.926 54.741 117.710 -86.994 91.888 44.015 116.032-100.665 99.643-143.184 108.262 -89.245 96.242 66.973 137.155-104.216 110.203-159.929 149.472 -22.197 93.810 55.294 154.278-107.708 92.824 45.926 126.053 107.725 94.716 37.879 147.460 -22.584 93.878 45.892 0.000 0.000 88.384 56.497 147.021-175.030 88.449 49.658 121.552 -96.274 90.902 39.174 123.385-114.581 90.799 47.559 121.713 -77.070 91.453 43.541 133.194-105.778 93.541 58.238 132.344-139.456 91.362 -87.469 139.134-120.478 117.213 149.836 112.546 -80.642 128.538 179.801 116.569-115.802 90.957 55.712 114.012 -76.086 91.484 49.009 89.529 -50.947 89.545 47.751 123.604 -39.630 90.479 44.979 128.722 -77.125 90.295 49.036 103.086 -84.523 89.949 46.615 123.542 -77.877 89.370 54.540 129.188 -74.832 89.323 50.705 128.371 -76.731 91.603-179.855 103.465 -96.488 92.041 80.682 161.847 -89.482 90.478 47.829 141.195-104.675 90.773 46.170 131.407 -43.725 91.203 56.054 156.159-116.882 88.844 43.624 129.430-152.878 94.812 84.423 101.716 -78.745 92.491 0.000 129.067 -76.173 # 770 total E -1.48793E+02 rmsd from N 0.000 %NC 0.00 92.837 142.633 135.886 -79.703 93.863 54.080 143.939-108.239 91.284 48.899 106.953 -81.050 93.603 79.672 128.269 -75.612 86.423 -80.026 139.576-109.210 99.056 -46.177 77.734 -76.819 92.059 -30.533 110.073 -53.671 106.665 -4.301 166.677-125.053 131.277 139.011 157.343-157.193 97.685 135.167 138.973 -18.934 129.043 -95.164 141.532-163.094 101.175 33.965 92.689-109.160 92.565 49.615 138.258-117.468 90.193 58.495 129.087-146.637 89.009 47.586 117.127-139.388 91.937 51.304 129.964-111.199 96.295 -68.815 131.621 -76.063 123.414-158.058 149.597 -64.241 109.123 32.911 156.942 52.436 92.547 52.118 142.494-168.122 92.312 41.902 0.000 0.000 91.415 49.125 119.283 -82.899 90.337 43.011 146.621 -86.645 90.986 44.812 117.237-127.134 89.050 52.952 110.522 -77.046 90.588 49.962 137.417 -96.648 91.539 42.504 131.539-148.030 95.390 50.165 115.303 -88.733 116.396-178.907 106.418 -79.408 97.360 52.993 128.161-150.360 93.247 43.363 114.168 -77.437 89.449 61.252 114.928 -15.724 89.568 50.774 104.896 -74.892 91.260 43.457 129.180 -76.319 92.905 38.654 103.470 -81.313 91.231 52.777 152.389 -29.741 87.775 52.673 150.065-135.130 89.151 42.073 128.113 -76.601 89.750 48.134 117.293 -36.225 89.788 48.484 129.222 -76.525 90.033 47.383 134.409-127.362 89.566 47.441 127.550 -40.054 89.829 55.041 136.254 -78.464 89.601 43.313 132.782-121.312 95.199 78.072 103.845 -80.421 92.551 0.000 128.891 -76.725 # 771 total E -1.49397E+02 rmsd from N 0.000 %NC 0.00 114.059 128.566 153.015-119.073 93.936 51.279 136.991 41.256 91.361 47.090 106.469 -82.096 91.430 46.604 129.941 -77.367 94.346 48.360 147.649-129.102 91.740 41.221 58.123 -72.977 90.741 46.318 128.275 -30.497 91.121 48.959 122.797-108.566 87.890 46.937 144.681-146.236 92.715 85.900 81.383-104.306 92.698 -64.118 137.097 -94.812 100.219 -56.463 92.864 -81.068 92.695 -41.796 141.837 6.744 133.065-124.027 173.563 2.209 100.946-122.171 140.156-161.571 94.944 49.832 127.584 148.784 92.387 46.475 135.051 -84.876 91.088 46.712 130.074 -64.408 92.777 49.170 123.745 -32.490 92.721 42.585 148.811-163.230 90.706 44.724 0.000 0.000 92.066 49.749 103.493 -84.282 90.493 47.341 147.525 -75.049 92.050 38.613 117.639-127.448 91.146 50.298 113.423 -77.888 91.058 56.281 132.567 -98.322 90.195 52.545 143.945-152.095 91.765 18.634 112.097 -92.532 113.867 13.835 160.251-129.633 132.829-170.866 116.039-113.286 96.447 63.705 115.651 -76.872 91.827 51.772 106.195 -15.776 89.804 50.658 115.089 -76.820 89.105 51.047 130.226 -76.080 86.907 48.048 102.788 -84.744 89.441 47.683 113.751 -47.982 89.098 46.942 136.098 -50.555 91.377 45.990 128.616 -76.567 91.072 114.298 107.503-100.021 91.748 -42.118 130.291 -78.281 96.175 -56.704 146.499-155.666 95.032-134.141 135.738 -62.180 120.894-111.958 159.869 -17.247 97.659 -12.195 140.521-139.182 117.460 88.492 102.441 -72.592 92.484 0.000 129.565 -76.448 # 772 total E -1.48567E+02 rmsd from N 0.000 %NC 0.00 93.052 -64.996 127.325 -77.876 94.161 -49.488 117.786 -79.354 91.185 -46.281 103.469 -78.942 90.375 -48.103 128.164 -75.403 92.111 -37.782 138.862-126.657 94.106 -44.280 62.019 -56.213 89.527 -39.196 132.114 49.556 98.566 -48.328 161.839-146.689 87.988 -49.232 132.799-116.661 91.806 112.512 93.379 -96.372 114.523 118.529 149.174-113.971 93.431 71.149 98.986-135.087 98.407 112.381 97.569 -83.705 124.196 -69.056 139.171 -78.992 98.064-116.921 139.769-138.463 91.629 55.579 135.098 125.750 92.218 45.878 134.577 -85.233 90.662 46.113 155.390 -16.098 90.754 49.367 145.420 -24.998 90.177 47.337 143.393-148.113 90.154 44.110 0.000 0.000 89.853 52.219 110.864 -81.262 88.969 47.642 139.485 -79.901 90.014 42.650 121.944-127.320 88.833 53.279 113.948 -76.298 90.521 46.810 142.802-113.019 92.047 53.215 127.256-154.126 94.830 -5.630 143.144-130.870 121.180-172.017 112.456 -79.612 98.831 48.734 132.748-155.917 97.674 34.255 114.741 -77.444 99.359 35.902 157.186-127.275 94.989 45.708 114.695 -72.895 91.573 42.850 130.088 -77.357 89.970 46.658 133.671-135.707 90.276 46.518 110.815-115.423 88.838 50.919 135.490 -93.357 89.144 47.801 128.229 -77.209 90.015 84.386 111.126-108.262 90.731-169.398 128.042 -76.526 93.567 50.723 140.692-109.641 92.460 43.353 124.847 -27.715 92.247 49.957 155.612 -27.468 91.476 48.452 142.993-162.457 92.078 114.158 101.734 -80.145 92.607 0.000 128.465 -76.745 # 773 total E -1.48877E+02 rmsd from N 0.000 %NC 0.00 92.460 122.134 122.714 -47.418 95.492 45.561 142.024 13.656 91.800 47.805 108.827 -80.206 91.417 47.905 128.120 -75.310 91.494 42.299 120.334 -27.965 92.760 41.541 94.832 -65.097 93.049 42.233 110.423 -68.127 100.839 17.437 107.730 -75.877 102.227 39.676 146.535 -31.297 94.783 30.243 118.367-114.453 99.416 63.914 118.429-124.782 97.264 -12.067 92.277 -98.695 113.803 127.498 151.027 -28.812 122.580-106.642 147.015-155.963 107.013-111.556 140.266-158.724 94.663 42.878 150.159 162.216 93.053 45.710 135.861 -83.890 91.026 45.870 124.011 -61.959 93.013 49.904 125.747 -47.295 91.201 41.936 145.398-168.391 92.911 39.430 0.000 0.000 93.267 49.723 113.021 -83.865 88.561 45.763 150.609 -90.119 89.526 44.181 115.211-130.644 88.673 53.294 110.155 -75.267 90.438 41.832 145.228-101.780 94.300 44.673 129.246-150.277 98.068 10.586 145.111-134.416 113.596 173.731 111.356 -82.013 100.809 51.519 130.351-153.043 97.512 32.574 115.205 -78.280 101.834 35.661 137.493 10.949 94.547 48.868 115.837 -71.683 90.656 44.648 130.649 -76.947 88.856 44.145 137.163-147.791 90.678 46.845 114.207 -47.476 90.426 45.884 135.689 -50.207 90.207 43.595 129.954 -77.848 92.380 96.697 106.321-100.772 91.216-163.720 129.367 -77.711 94.223 47.217 140.333-109.029 92.644 41.963 124.832 -28.463 92.372 54.301 158.263 -21.997 89.688 47.691 135.698-147.060 91.945 111.546 101.191 -79.738 92.637 0.000 128.568 -76.719 # 774 total E -1.47584E+02 rmsd from N 0.000 %NC 0.00 93.346 -77.892 130.657 -87.607 95.126 -45.749 135.348-100.051 91.196 -52.375 101.279 -79.401 90.317 -45.244 126.957 -74.591 89.896 -51.568 150.277 174.692 95.211 -42.336 118.162-148.581 91.375 115.682 94.578 -77.885 93.685 45.924 129.955-109.389 89.921 54.400 146.173 164.662 89.281 75.117 83.392-108.447 91.134 -77.675 129.511 -95.564 100.780 -62.283 94.646 -85.374 93.206 -65.179 110.979 -74.857 117.596-149.665 150.384-135.049 102.680-113.606 146.894-156.180 93.654 46.159 135.596 140.325 91.141 46.911 135.440 -85.438 89.802 52.250 119.885 -66.355 90.419 51.073 128.026 -28.104 90.998 41.241 145.127-163.594 89.965 46.411 0.000 0.000 90.214 58.561 102.190 -82.532 86.529 49.005 151.326 -74.720 89.971 40.299 117.212-131.300 90.120 50.107 109.663 -76.062 88.528 59.236 143.458 -97.557 89.591 42.546 144.091-137.096 92.283 42.622 142.843-128.710 97.825 -9.152 117.016 -89.959 134.579-157.719 105.998 -94.253 92.514 51.344 114.044 -76.708 91.375 57.689 100.540 -35.862 91.094 48.115 122.236 8.802 91.885 42.435 129.760 -76.468 89.156 44.906 101.804 -82.922 90.784 58.162 139.441 -40.780 89.018 46.287 136.349 -49.916 92.717 33.259 129.835 -77.077 97.653 115.743 110.108 -98.988 94.031 -36.274 130.852 -78.285 95.993 -48.941 141.026-120.799 95.005 -15.094 125.268 -19.394 106.004 -66.139 156.772 -15.321 91.001 -52.820 141.484-139.425 93.257 75.741 101.006 -83.711 92.575 0.000 128.720 -76.946 # 775 total E -1.50456E+02 rmsd from N 0.000 %NC 0.00 93.215 178.083 135.501 -83.971 93.454 61.427 147.469 54.849 94.809 40.185 107.076 -81.892 92.202 48.330 132.318 -77.191 94.732 39.936 148.483-138.438 92.976 42.646 57.695 -76.449 90.682 44.503 117.223 -40.649 90.920 48.387 137.943 -91.024 89.189 43.996 128.838-114.262 90.733 39.889 85.441 -98.441 95.050 117.931 137.654 -87.869 90.564 70.323 136.994-165.846 90.035-162.614 100.222 -85.101 139.369-139.600 164.923-162.251 99.272-118.089 137.420-148.742 93.267 48.054 140.762 137.325 92.398 46.857 135.168 -84.868 91.388 44.986 123.522 -53.179 92.333 47.584 113.069 -26.772 91.658 44.842 153.830 -17.582 90.329 46.575 0.000 0.000 90.143 50.416 106.011 -81.002 90.903 48.456 144.945 -72.171 91.755 38.469 122.187-125.298 90.547 50.393 112.846 -77.553 91.208 65.415 137.670-101.014 89.710 41.388 146.813-136.875 92.747 41.290 142.933-129.645 100.393 -9.877 139.148-102.008 137.204-157.911 108.428 -96.659 91.543 56.862 113.938 -76.505 90.764 58.893 98.787 -15.302 90.302 48.652 114.248 0.350 88.891 49.936 131.263 -77.100 87.505 50.507 104.063 -84.019 88.686 48.712 119.155 -26.791 89.610 43.770 139.950 -48.710 90.630 45.835 128.532 -76.739 88.823 54.709 120.558 -66.716 89.479 46.104 127.958 -75.916 91.477 43.552 138.383-135.744 91.093 46.161 130.166 -47.008 91.121 51.628 133.812-107.278 90.565 43.407 132.474-140.860 95.641 70.765 104.229 -80.441 92.535 0.000 129.037 -76.656 # 776 total E -1.49671E+02 rmsd from N 0.000 %NC 0.00 93.075 -65.677 128.466 -81.763 94.428 -48.482 117.174 -78.825 91.257 -45.954 103.499 -77.940 90.497 -47.726 128.843 -75.819 91.837 -38.980 139.952-132.276 93.526 -42.930 59.144 -64.981 92.950 -38.363 130.429 42.459 102.278 -38.453 170.197-166.239 91.010 -48.685 129.259-127.105 91.097 -68.105 77.185 -81.469 102.849-159.839 152.369 158.009 98.294 -51.339 96.822-112.697 102.762 165.355 103.395 -83.844 130.020-126.648 176.415-162.339 101.363-123.246 138.035-148.565 93.452 48.130 136.913 143.718 92.007 46.290 133.826 -85.933 90.636 48.640 127.136 -53.157 90.305 50.869 125.091 -31.884 90.131 46.092 109.069 -82.518 89.977 44.220 0.000 0.000 89.652 57.324 109.402 -84.675 86.006 48.741 142.293 -83.801 88.786 46.781 120.170-129.214 88.568 49.721 109.000 -75.092 89.588 48.053 136.990 -90.335 92.088 46.808 131.328-130.029 95.135-101.658 148.043 -29.125 120.987 117.025 150.693 -13.713 96.187 116.966 97.255-103.043 162.263 159.521 143.541 -89.393 88.626-124.577 94.958 6.974 92.896 45.108 125.055 45.602 91.863 50.456 129.433 -76.072 91.385 39.124 101.453 -80.563 91.812 47.971 138.651 -33.677 89.967 46.406 138.505 -58.727 90.337 42.529 128.542 -76.890 89.599 50.086 120.284 -64.190 90.639 45.367 127.895 -76.153 91.317 43.505 141.662-124.246 91.210 46.132 130.093 -47.133 91.036 51.683 133.607-107.860 90.575 43.475 131.920-142.205 95.640 70.292 104.243 -80.448 92.493 0.000 129.050 -76.632 # 777 total E -1.47183E+02 rmsd from N 0.000 %NC 0.00 93.183 -72.736 127.819 -78.699 94.068 -48.650 119.395 -80.296 90.959 -47.676 103.126 -79.730 90.026 -48.575 129.031 -75.675 91.855 -38.607 140.864-132.935 93.062 -44.792 59.900 -57.992 90.991 -38.512 138.528 70.075 100.045 -41.261 169.910 157.760 92.290 -48.614 129.296-124.400 91.752 131.531 85.421 -73.171 92.800 96.835 146.160 -96.952 94.190 30.027 94.196-116.115 97.034 59.026 108.952 -85.469 95.509 -18.379 141.967-102.841 127.121-168.303 111.627 -88.798 96.978 55.422 147.296 164.212 94.231 45.105 135.405 -83.974 90.789 48.754 109.681 -26.160 91.306 57.785 127.911 -46.735 88.933 47.183 151.797 -25.438 90.279 45.058 0.000 0.000 90.131 54.467 150.897-160.314 88.376 48.767 138.184 -99.288 90.174 43.029 120.773-128.599 89.450 51.029 114.830 -75.935 89.635 49.557 138.785-104.075 90.894 50.546 130.398-143.295 93.220 -99.416 104.226 -83.944 114.790 154.713 158.572-145.036 102.187 -86.402 92.714-100.451 92.253-142.124 113.359 -75.508 105.958 26.121 115.990-117.447 96.107 52.216 117.531 -76.048 94.312 36.979 129.272 -76.161 90.938 48.084 119.888 -85.042 90.270 42.547 126.514-112.201 90.875 52.772 142.243-152.827 89.415 46.037 127.736 -76.429 90.869 143.344 107.972-104.609 92.520 49.620 131.481 -78.157 90.562 47.878 141.881-111.584 91.506 57.805 130.037 -51.156 92.197-134.563 140.676 -98.056 97.521 27.460 126.128-110.868 120.326 97.771 99.588 -78.373 92.599 0.000 129.320 -77.044 # 778 total E -1.48966E+02 rmsd from N 0.000 %NC 0.00 93.296 172.691 139.221 -96.986 93.093 57.083 142.318 42.625 92.846 42.432 105.536 -80.928 92.042 51.098 132.696 -77.808 92.004 42.616 149.161-139.768 91.117 42.849 63.101 -75.364 91.105 45.614 117.903 -44.607 91.038 43.527 138.314 -94.564 89.869 47.739 139.857-136.442 89.232 46.717 81.868-103.086 91.717 176.846 130.797 -84.270 93.833 73.833 131.795-158.917 92.914 48.605 99.890 -79.612 93.313 38.351 146.053 -38.764 97.360 64.727 109.544 -90.377 97.901 -56.793 131.926-117.222 115.516 100.247 152.721 -82.298 94.759 3.811 123.666 -94.165 109.157 167.325 137.468-151.199 92.795 53.558 143.801 178.743 90.116 49.590 0.000 0.000 90.671 44.955 136.716 -30.814 89.358 53.013 147.769 -85.059 88.367 51.267 121.855-137.237 87.756 48.494 109.181 -74.572 90.509 49.162 141.211 -92.243 91.398 48.936 131.242-142.760 94.359 -95.872 103.628 -83.271 113.018 163.808 150.446 -20.165 107.288-168.319 90.791 -92.845 93.621 51.026 115.404 -77.023 91.987 48.737 103.460 -15.544 90.665 46.486 122.448 -14.953 90.526 47.752 129.698 -76.085 88.839 45.552 102.833 -84.971 90.591 45.585 117.508 -36.157 92.033 44.068 137.774 -46.781 92.514 40.594 129.787 -77.694 94.299 94.945 105.302 -83.268 122.655 172.616 138.304 -95.581 93.142 46.273 141.014-110.700 92.084 45.558 128.222 -38.151 91.291 56.026 150.594 -26.147 88.910 46.604 140.292-154.779 92.355 110.519 101.734 -80.243 92.642 0.000 128.505 -76.938 # 779 total E -1.46377E+02 rmsd from N 0.000 %NC 0.00 92.929 170.044 130.821 -68.617 94.809 63.647 132.281 66.753 95.076 39.861 105.634 -73.622 93.477 42.261 130.272 -77.293 93.936 48.462 151.201-166.522 97.030 37.004 55.750 -66.789 91.937 45.538 136.662 -23.334 89.890 50.757 123.313-123.817 88.798 51.236 113.364 -96.216 88.091 43.372 91.893 -88.857 93.714-162.019 129.191 -77.684 97.041 57.648 128.912-152.744 125.091 151.462 104.066 -83.975 119.139 -96.028 150.399 -85.986 101.529-117.801 150.970 -39.307 92.047 50.843 142.681-110.457 92.658 48.010 138.059 -74.192 91.776 44.513 138.057 -31.215 91.381 45.361 135.210 -14.671 90.483 50.631 143.802-166.320 90.408 45.203 0.000 0.000 90.693 45.527 115.975 -77.658 90.465 47.728 146.580 -85.214 89.483 45.447 118.762-129.401 88.913 49.219 114.194 -80.108 90.362 49.909 143.359-117.984 91.443 49.828 136.869-116.554 93.613-106.451 103.391 -82.406 106.117-172.903 150.625 -18.344 132.307 -62.615 112.208-107.989 109.879 -21.757 113.924 -79.602 95.915 -44.320 120.194 -65.527 96.931 -37.012 112.855 -74.088 92.825 -47.918 127.483 -75.837 90.839 -38.938 99.783 -81.816 93.848 -39.545 139.742 -41.617 94.273 -42.059 169.176-153.205 92.113 -51.789 130.392 -78.552 94.339-120.728 132.973 18.964 89.235 56.462 131.396 -77.049 90.575 44.211 143.320-117.540 91.785 76.558 134.784 -55.543 88.934 -80.600 144.535 -52.544 101.463 -43.881 137.744-134.436 109.603 169.710 100.337 -78.589 128.250 0.000 146.470 -94.413 # 780 total E -1.50783E+02 rmsd from N 0.000 %NC 0.00 93.162 -71.244 127.401 -72.838 122.627 -99.452 131.560 -32.902 94.129 40.318 110.749 -80.072 93.608 50.194 131.296 -77.299 93.365 39.676 148.855-136.580 91.463 47.517 67.336 -94.743 88.473 47.060 112.671 -62.909 89.506 53.979 125.910 -96.546 86.630 44.698 133.755-120.486 93.973 148.961 75.291 -94.815 92.063 64.389 158.346-120.831 93.409 46.904 93.417-118.501 93.488 54.039 106.893 -86.470 94.589 -91.967 141.859-103.102 114.788-111.852 143.071-160.483 93.363 48.462 156.196 176.441 92.919 45.778 130.693 -86.707 90.631 48.711 133.496 -54.459 90.968 48.516 79.829-120.494 89.369 45.598 132.409-174.946 89.074 48.347 0.000 0.000 90.167 48.927 105.324 -83.145 88.273 47.432 142.612 -72.005 90.804 41.385 124.000-132.925 95.376 101.381 110.001 -77.574 94.407 -15.979 158.275-128.188 98.303 -74.084 133.378-144.794 92.330 0.425 110.997 -85.756 109.798-136.683 154.096 -22.188 126.585 172.907 113.993-112.342 95.045 44.235 114.870 -77.048 94.111 41.947 113.385 -40.961 95.370 39.951 128.628 -31.210 91.868 46.568 130.472 -77.794 89.322 47.257 101.806 -85.066 89.508 48.099 126.800 -70.709 89.356 47.158 142.483 -91.198 89.891 45.615 128.388 -77.063 90.548 80.426 111.710 -92.046 90.279-166.119 129.610 -77.764 93.410 56.175 140.875-111.403 91.077 47.092 130.916 -44.904 92.051 50.662 155.982-135.191 91.052 44.171 127.501-163.747 94.764 79.559 103.276 -79.986 92.545 0.000 128.867 -76.757 # 781 total E -1.47369E+02 rmsd from N 0.000 %NC 0.00 93.195 156.080 143.286-106.441 93.821 50.489 157.424 120.521 91.941 46.692 107.201 -80.672 90.847 49.365 129.103 -75.535 90.478 45.417 150.756-140.458 92.928 41.028 127.192 172.708 92.511 42.276 111.073 -68.429 91.984 46.594 133.495 -90.225 91.165 71.814 152.009-142.797 84.139 124.211 108.665-158.707 90.443-120.844 127.982-132.938 94.724 55.953 94.844-120.668 95.341 43.517 107.415 -89.484 93.307 53.507 153.593-149.288 89.770 47.092 123.102-161.796 93.056 57.527 123.160-114.925 98.192 -62.680 127.038 -55.761 124.386-157.125 146.077 -38.069 117.244 39.221 144.490 -9.309 94.671 48.942 152.192 -17.316 90.991 46.156 0.000 0.000 90.137 56.189 109.076 -83.482 88.074 45.473 140.582 -75.538 90.388 44.392 120.924-123.587 89.255 52.491 109.635 -75.031 90.456 48.604 134.741 -92.579 92.272 44.315 131.410-132.981 94.531 33.297 115.508 -89.971 113.559 167.580 106.763 -78.424 97.687 49.663 134.029-158.042 96.352 36.455 114.579 -78.116 90.131 69.944 122.202 -24.124 90.264 66.017 97.582 -74.908 89.201 39.061 131.259 -77.744 91.705 49.160 102.082 -82.209 91.346 56.133 126.386 -53.974 93.995-115.275 130.623 -82.975 97.880 -17.612 128.382 -77.426 126.140 177.088 144.434-129.156 135.997 167.926 146.735 -77.714 92.593 49.435 142.252-119.787 92.165 48.675 131.702 -80.972 90.700 59.894 148.758 -23.223 88.128 41.496 137.204-149.143 95.750 80.333 102.411 -79.959 92.473 0.000 129.078 -76.504 # 782 total E -1.47588E+02 rmsd from N 0.000 %NC 0.00 92.628 154.646 123.492 -51.814 114.226 109.554 120.561 55.444 89.645 -47.315 102.379 -77.142 91.130 -46.774 130.077 -76.384 92.010 -40.640 144.079-126.388 93.544 -41.198 60.678 -65.222 92.241 -42.313 149.812-125.791 100.063 -36.719 170.707 141.921 92.941 -51.732 129.563-119.809 96.179-109.423 84.262 -94.237 108.709 82.208 158.419 175.933 91.277 53.575 98.154-127.211 94.452 53.364 106.546 -87.595 95.096 -91.121 159.533-134.869 111.835-113.309 141.205-163.364 96.024 41.898 161.727 163.730 93.020 45.795 133.797 -85.530 91.354 46.972 132.858 -77.102 92.998 48.003 89.872-119.169 91.890 39.220 134.841-179.251 90.617 46.334 0.000 0.000 91.722 46.822 104.041 -87.316 90.694 46.301 147.835 -77.873 91.931 39.749 117.331-128.247 91.013 49.931 113.825 -78.243 91.284 48.637 129.618 -97.641 91.847 64.638 139.460-146.143 91.690 -17.569 106.553 -86.701 124.538 55.213 153.059 -15.706 138.790 174.267 110.355 -99.014 94.118 53.379 127.068 62.473 90.400 60.968 101.280 -10.448 87.577 57.636 123.176 -24.299 91.483 44.797 126.134 -73.176 89.618 42.089 107.570 -88.726 91.382 47.742 119.144 -27.772 91.510 46.489 132.293 -55.241 91.310 37.452 130.531 -78.315 94.593 106.195 102.386-106.953 91.469 -63.745 129.142 -77.460 91.182 -53.379 146.132-142.498 90.973 -45.308 126.378 70.580 95.310 119.681 144.127 -32.820 101.283 19.900 141.570-162.461 100.020 34.721 105.508 -78.047 92.512 0.000 129.381 -76.518 # 783 total E -1.46475E+02 rmsd from N 0.000 %NC 0.00 92.937 160.979 134.645 -78.520 92.775 61.859 135.976 50.706 93.046 40.743 106.468 -81.973 91.940 51.094 131.511 -76.196 90.418 41.046 157.294-167.571 91.203 44.860 63.971 -67.167 90.683 45.603 116.721 -38.633 88.011 49.238 149.915 -87.034 89.428 42.219 112.576-105.680 90.474 44.944 87.489 -86.735 92.849 121.611 140.376 -72.563 89.603 61.107 133.814-162.320 87.712-110.164 101.163 -84.339 138.886-179.550 151.228 162.808 104.762-140.067 139.813-147.171 134.842 37.779 137.355 118.173 95.486 40.513 136.338 -84.627 93.529 44.307 122.878 -55.608 93.281 47.859 124.100 -22.195 91.105 46.454 155.462 -18.266 89.987 45.761 0.000 0.000 90.083 50.349 108.379 -82.026 90.079 45.999 139.814 -75.706 91.289 43.210 124.899-127.978 90.780 52.022 111.779 -77.799 92.933 104.419 127.198 -90.982 92.962 56.404 140.886 172.051 93.194 24.132 150.795 -23.901 108.999 125.534 143.128 -21.641 133.569 155.572 114.492-110.202 101.910 30.005 110.687 -78.869 93.354 53.963 110.844 -20.501 87.923 56.686 115.044 -70.057 88.645 48.097 129.283 -76.828 89.177 43.247 101.921 -82.939 90.092 44.108 122.531 -66.514 90.635 65.804 139.113 -46.463 87.829 56.920 128.622 -76.916 86.718 164.395 83.764 -91.732 91.197 58.700 162.019 -96.213 89.628 44.111 141.155-102.974 92.097 43.769 126.375 -28.304 92.421 45.765 146.009 -45.394 93.375 40.960 139.618-132.112 96.584 77.671 104.112 -79.785 92.502 0.000 129.015 -76.586 # 784 total E -1.46849E+02 rmsd from N 0.000 %NC 0.00 93.410-179.937 139.068 -97.736 92.777 57.483 141.966 38.546 92.650 42.408 105.442 -81.368 91.817 52.591 133.354 -77.646 91.496 40.773 147.823-140.842 90.391 44.450 63.613 -74.581 90.107 47.551 118.394 -46.437 88.683 46.744 140.044 -88.115 88.757 44.595 127.425-119.286 90.423 47.179 85.662 -98.305 90.631 169.136 137.241 -89.185 93.152 73.271 131.389-159.397 91.243 50.510 97.845 -81.849 93.617 38.119 142.104 -38.503 97.004 67.975 111.233 -88.594 96.714 -57.496 131.467-119.273 112.845 101.242 153.946 -79.549 94.768 -0.947 123.630 -99.288 113.166 168.095 137.248-147.703 92.494 54.783 144.669-177.364 90.060 50.579 0.000 0.000 90.192 46.631 137.261 -28.486 88.925 52.970 146.167 -86.733 88.572 52.007 122.328-137.276 87.537 49.840 108.913 -73.395 90.093 49.971 139.770 -87.390 91.050 48.481 130.888-142.108 94.872 -93.687 103.817 -83.345 115.604 162.138 151.044 -19.869 107.699-169.197 91.619 -96.217 94.727 49.460 115.572 -77.341 91.566 50.347 102.960 -13.272 89.784 49.360 119.614 -17.075 90.571 47.935 130.909 -77.043 90.206 42.582 103.187 -83.913 89.420 50.558 112.941 -36.605 90.352 65.495 139.704 -36.016 87.999 45.219 129.553 -77.501 89.525 130.303 105.465-103.022 93.037 49.589 131.359 -77.610 91.414 46.504 140.204-142.869 92.519 52.164 127.685 -40.703 93.065-123.881 133.899 -89.072 95.940 -2.541 138.076-141.409 121.203-157.013 144.375 -10.033 93.037 0.000 129.435 -76.682 # 785 total E -1.53646E+02 rmsd from N 0.000 %NC 0.00 92.488 139.621 123.028 -47.296 93.330 68.088 140.164 62.219 94.311 43.837 106.734 -78.920 93.043 41.527 131.291 -77.395 95.812 44.403 156.637-165.999 94.593 39.137 51.191 -71.746 93.274 45.013 141.065 -22.347 92.316 42.706 133.448-110.550 90.248 49.118 140.690 170.987 90.156 75.747 82.102-102.542 90.047 -67.132 140.375 -96.882 108.192 -71.651 90.852 -78.699 96.799-131.469 143.149 -37.159 100.820 -71.836 152.849-128.238 111.317-107.627 107.977 -90.453 91.212 51.005 143.709 112.991 89.972 49.564 138.282 -84.964 89.195 53.283 159.589 -42.164 89.062 44.776 130.584 -18.937 90.412 45.354 145.248-153.035 89.204 49.764 0.000 0.000 88.835 49.714 105.926 -84.190 88.854 44.912 136.313 -75.913 90.238 46.012 123.983-123.884 88.997 48.802 113.688 -76.107 90.496 48.320 135.098-103.046 91.322 45.865 132.615-144.654 94.129-103.454 104.218 -82.986 112.252-162.587 153.094 -19.839 94.506 -56.086 99.746-106.050 90.795 -47.999 110.445 -73.927 91.445 -69.344 108.749 -55.497 88.024 107.791 119.443 -74.988 93.046 46.841 128.466 -76.236 88.074 50.636 105.171 -74.449 89.928 51.446 139.349 -35.561 88.218 45.066 146.202-108.549 90.198 44.390 128.149 -76.626 89.763 51.472 120.294 -47.108 89.569 44.534 129.027 -76.676 90.728 46.242 135.180-131.573 90.693 52.678 127.975 -42.304 89.591 50.640 136.845 -83.823 91.299 45.336 138.683-151.388 95.022 73.918 104.265 -80.871 92.509 0.000 129.001 -76.636 # 786 total E -1.46820E+02 rmsd from N 0.000 %NC 0.00 92.639 132.138 132.372 -69.681 92.480 59.068 124.338 -13.610 92.049 51.613 105.395 -77.800 93.565 36.360 128.570 -75.485 96.103 51.890 118.845 -85.603 92.530 36.828 54.267 -68.135 90.890 49.926 141.261 -24.224 91.263 44.529 123.602-101.841 90.080 49.245 137.076-113.998 89.332 56.962 86.008-101.715 92.865-171.500 126.918 -85.402 92.741 73.567 101.397-122.213 94.976 40.675 105.707 -82.290 91.033 49.866 145.094 -35.069 92.154 44.433 126.770-125.664 92.175 48.872 123.149-122.065 92.227 40.223 126.014 -75.596 97.896-105.713 116.235 -75.899 111.361-113.792 106.887 -82.871 90.905 67.020 152.386 -4.663 90.553 51.977 0.000 0.000 90.353 44.527 138.228 -19.530 90.192 51.334 147.178 -82.910 88.100 55.540 130.032 157.122 86.260 56.003 110.341 -73.502 89.653 40.726 144.974 -97.030 93.122 61.817 128.610 -8.850 93.366 -69.866 103.735 -86.023 117.065 111.008 159.754-146.137 125.089 170.352 113.342-114.150 94.742 56.643 118.856 78.901 92.317 109.009 130.130 -95.823 96.019 -23.229 113.511 -77.420 93.204 -73.703 126.768 -75.764 87.667 -44.734 104.688 -80.329 88.708 -53.249 121.739 -68.270 87.485 -46.377 140.765 -97.855 90.115 -49.484 126.861 -75.823 84.715 -59.771 115.559 -39.316 87.901 -57.480 128.217 -75.724 87.351 -41.474 137.569 166.199 90.082 -49.959 130.723 -35.207 88.664 -56.263 152.469 -14.710 91.037 -42.886 137.106 166.651 96.256 93.707 104.756 -80.110 92.519 0.000 129.126 -76.459 # 787 total E -1.46459E+02 rmsd from N 0.000 %NC 0.00 92.489 124.859 124.632 -51.389 95.116 46.113 139.580 -5.454 92.318 47.556 109.249 -80.194 91.335 47.652 127.914 -75.196 91.345 42.365 119.024 -34.317 92.202 45.162 103.226 -66.624 91.454 43.024 115.829 -77.598 109.396 14.030 105.975 -83.804 95.501 38.572 142.112 -45.194 101.988 26.349 88.455-103.228 97.799 42.485 142.004-121.223 100.966 22.386 88.294-102.849 95.409 49.846 137.147-108.888 93.938 38.273 106.099-103.986 94.699 49.051 111.651 -89.689 94.437 8.492 123.067-109.823 113.742 47.778 150.202 -66.424 135.893 -62.810 138.539 -90.248 138.615-121.635 123.887 -74.667 93.849 59.868 147.573-159.753 91.504 47.218 0.000 0.000 89.408 49.288 137.787 -27.829 89.454 57.566 143.079 -86.987 88.572 50.145 125.001-139.904 88.110 47.725 110.628 -73.410 91.085 51.818 144.001 -96.538 91.495 48.992 133.939-152.370 92.471-105.131 141.060-120.417 107.718-167.287 153.591 -14.807 102.703 -59.069 97.980-103.030 109.022 -20.985 113.336 -79.020 92.848 -48.996 108.372 -49.594 91.381 -42.848 115.090 -72.948 92.156 -46.345 127.738 -76.329 91.800 -36.521 102.859 -83.134 89.453 -53.273 103.468 -49.807 88.556 -47.966 161.015 -17.544 89.330 -59.493 127.620 -76.496 88.562 -78.253 125.961 -37.738 87.729 94.423 131.520 -76.228 90.381 52.620 140.172 -85.484 88.724 46.953 115.420 -27.249 91.154 55.846 142.449 -30.829 88.885 40.952 138.473-132.961 95.316 80.318 103.325 -79.996 92.472 0.000 128.873 -76.611 # 788 total E -1.52579E+02 rmsd from N 0.000 %NC 0.00 93.156 -67.278 128.998 -82.832 94.422 -46.675 116.346 -80.630 90.491 -48.088 103.180 -77.228 90.227 -47.068 129.480 -76.019 92.177 -40.312 139.500-127.607 94.081 -42.218 61.547 -63.506 91.491 -40.758 130.556 36.993 101.040 -48.401 166.545 168.571 92.004 -46.439 124.704-110.721 96.707-109.184 134.937 -21.548 111.038 59.711 144.249-153.058 93.932 58.579 94.426-123.488 93.189 82.040 104.372 -81.093 91.777 -84.965 132.528 -78.825 102.501-112.104 134.919-160.497 93.029 45.318 143.285 176.175 91.918 48.595 135.656 -85.000 89.824 51.600 134.981 -76.220 91.045 47.373 111.771 -51.684 92.002 41.679 150.410-144.483 93.829 40.006 0.000 0.000 91.914 50.623 137.279-112.474 89.316 45.751 124.857-122.799 89.876 43.275 115.604-127.412 89.664 48.841 113.416 -80.653 90.340 50.340 142.367-114.827 90.283 50.762 123.176-152.341 92.859 -99.952 103.479 -82.378 113.714 127.711 149.620 -16.374 106.388-176.622 93.019 -93.428 90.312 78.140 123.256 57.916 89.605 62.970 106.549 -34.487 90.650 42.167 107.664 -78.928 90.625 54.985 131.140 -76.900 86.192 54.666 103.226 -87.836 87.795 49.728 102.575 -69.335 88.771 53.046 132.841 -48.167 88.678 47.787 128.063 -76.025 90.791 85.308 104.266-103.753 87.424 -83.288 127.919 -76.463 91.257 -51.391 145.310-128.742 88.643 -50.225 126.406 46.687 91.034 -50.275 142.947 -35.305 91.963 -39.670 145.435-130.078 100.565 114.403 104.775 -78.715 92.428 0.000 129.230 -75.995 # 789 total E -1.48144E+02 rmsd from N 0.000 %NC 0.00 93.330-170.719 133.579 -79.880 94.131 63.572 131.726 61.199 94.074 42.097 106.949 -75.430 92.837 41.911 132.405 -78.160 93.764 45.626 151.962-167.941 96.365 39.527 50.478 -63.335 90.395 45.925 157.913 13.793 88.113 56.098 131.804-112.173 90.002 41.546 125.616-108.678 91.253 62.185 91.348 -99.718 93.376 -44.246 142.436 -96.324 115.681 -92.834 89.363 -77.615 121.162-115.750 152.626 154.817 123.341 141.992 149.043-179.007 116.536 -92.301 142.886-161.607 95.625 44.262 151.365-149.718 92.107 44.884 134.340 -80.968 89.918 60.320 112.503 -6.460 87.581 52.390 136.933 -93.281 88.047 44.626 142.951-150.075 91.404 45.498 0.000 0.000 89.326 47.533 142.741 -22.640 89.362 48.104 133.560-103.653 88.783 52.725 121.448-132.723 86.321 57.021 111.075 -73.566 89.029 49.278 141.494 -87.214 90.471 41.629 140.220-136.202 94.544 -96.907 105.553 -83.558 125.770 177.341 153.885 -9.584 94.126-149.454 101.027-100.709 98.345 42.887 114.883 -77.429 93.444 44.346 114.498 -75.998 92.756 45.399 137.178 -7.354 93.335 43.483 128.885 -75.675 94.905 33.944 101.671 -83.790 94.774 41.614 114.168 -48.376 92.474 57.362 150.852 -23.151 88.233 47.392 128.932 -77.806 89.822 47.627 100.381 -95.583 93.851-107.411 128.876 -76.326 112.374 -41.826 151.393-135.083 121.275 -91.731 130.586 8.235 92.139 64.100 149.028 -19.097 90.838 30.250 139.658-148.826 96.358 56.278 145.618 -24.252 92.579 0.000 128.802 -77.002 # 790 total E -1.53243E+02 rmsd from N 0.000 %NC 0.00 93.012 163.084 135.302 -81.116 93.436 60.413 138.972 54.005 93.697 43.375 106.240 -81.253 92.383 43.960 131.018 -77.519 94.468 47.181 151.455-145.284 93.243 43.034 56.250 -71.458 90.763 46.050 130.204 -28.472 91.290 46.070 122.440-113.384 89.435 50.238 142.495-153.140 90.043 73.700 83.525-104.816 91.751 -70.915 133.909 -95.093 106.280 -67.796 89.820 -77.517 92.749 -67.525 151.954 -20.651 117.423-164.740 153.878-166.512 114.199-105.790 149.444-162.124 95.302 43.997 147.724 145.101 92.103 45.721 135.755 -84.102 90.550 49.951 119.887 -69.101 91.542 50.548 136.102 -40.898 91.990 40.342 142.731-166.881 90.793 44.994 0.000 0.000 90.867 57.754 102.190 -83.488 87.943 49.524 148.612 -76.743 90.781 38.571 116.862-127.995 91.491 50.739 110.497 -76.392 90.218 70.612 145.288 -99.533 90.096 40.817 142.488-130.290 93.010 45.026 143.051-129.973 99.500 -7.671 140.116-102.516 132.040-163.477 114.418-111.166 96.176 50.246 130.461 156.742 91.334 50.055 108.134 -8.612 89.030 51.254 123.423 -21.045 91.805 47.397 129.982 -76.591 91.111 38.647 139.084-148.672 91.051 47.495 116.442 -38.981 90.954 59.928 140.192 -48.742 88.561 45.416 129.991 -78.172 88.781 133.887 105.264 -78.824 93.096 53.269 132.132 -78.794 91.028 46.728 140.866 -86.685 91.886 51.574 128.028 -28.910 93.408-131.704 131.179 -58.166 96.263 14.343 107.705 -84.697 121.296-169.150 103.883 -67.571 92.878 0.000 129.589 -76.298 # 791 total E -1.48831E+02 rmsd from N 0.000 %NC 0.00 92.996 148.587 140.854 -95.884 92.595 54.168 153.967 56.929 91.740 47.415 107.067 -80.472 90.673 50.052 129.335 -75.511 91.224 39.560 149.441-135.833 93.721 49.049 120.351 150.139 90.502 52.690 109.271 -59.956 91.943-111.636 115.297 -80.396 91.507 -51.689 98.662 -12.888 95.287 -42.824 146.505 -1.545 96.225-118.493 149.298-127.470 92.523 73.658 99.365-135.653 94.347 124.746 104.474 -83.974 120.669-126.320 147.692-117.949 110.367-104.689 140.864-160.014 94.291 44.866 151.186 173.828 92.421 46.262 136.264 -83.430 90.657 48.567 125.714 -74.649 92.375 46.588 122.128 -49.339 94.375 39.486 147.538-161.306 95.804 35.938 0.000 0.000 93.189 52.182 113.407 -86.639 88.214 48.559 142.627 -89.667 89.973 43.212 117.688-128.219 89.559 49.163 114.541 -76.494 90.302 47.405 138.718-107.619 91.884 51.485 134.118-142.238 92.617 -98.039 103.536 -83.174 113.769 160.734 150.585 -16.300 103.058-174.330 92.847 -92.444 93.558 52.028 128.561 36.251 91.713 48.143 110.193 -29.581 90.823 47.275 131.710 -23.848 92.418 41.179 127.462 -75.577 91.225 46.585 102.062 -84.043 91.403 50.615 125.926 -41.537 93.624 39.803 129.236 -70.879 92.990 39.310 130.672 -77.909 94.962 88.454 102.538 -91.650 91.069 -77.900 128.473 -76.989 92.947 -51.484 144.769-155.124 92.132 -30.700 146.235-111.083 113.130 130.385 147.188 -18.062 95.644 27.692 139.322-156.624 113.230 23.705 105.671 -75.590 92.386 0.000 129.163 -76.095 # 792 total E -1.48081E+02 rmsd from N 0.000 %NC 0.00 93.250 -79.446 126.460 -75.827 93.107 -52.202 115.290 -73.201 92.095 -41.152 102.776 -76.796 92.749 -46.987 126.413 -74.305 99.481 -12.221 150.316-136.940 106.572 -39.578 58.683 -84.050 96.240 -19.488 139.305 -35.904 110.666 -36.879 132.356 -88.826 93.331 -46.283 147.396-127.089 92.747 -48.436 85.245 -84.912 113.285 122.393 156.104-167.948 98.029-128.498 101.005-105.908 112.727-165.881 106.478 -84.035 139.298-101.023 163.126-154.170 99.111-116.781 109.149 -88.450 93.318 51.515 139.072 135.551 93.426 44.266 136.804 -85.015 91.731 44.359 135.888 -51.317 92.194 49.087 134.283 -31.899 91.380 45.534 109.013 -82.735 91.347 42.001 0.000 0.000 90.824 51.436 111.192 -83.469 89.796 46.240 139.704 -81.169 91.265 41.855 120.357-124.664 90.534 51.272 109.305 -76.360 92.365 85.631 129.862 -84.981 91.308 58.065 140.413 177.422 92.111 14.217 142.527-131.014 110.496 168.654 109.453 -84.636 126.043 39.069 127.153-133.373 98.018 37.071 115.752 -78.917 93.593 45.288 131.080 -74.631 91.767 49.944 110.255 -72.981 92.448 41.326 128.109 -75.835 91.555 44.417 139.132-160.010 92.042 43.272 103.032-117.708 90.408 52.402 126.491 -82.062 90.412 42.017 129.042 -77.669 91.966 110.566 102.674-106.756 96.665-132.534 128.989 -77.653 91.007 56.080 141.118-106.543 90.795 48.565 128.804 -39.526 90.914 55.608 145.117 -28.907 88.817 41.827 146.619-159.423 95.156 98.037 102.854 -79.829 92.504 0.000 128.875 -76.384 # 793 total E -1.46478E+02 rmsd from N 0.000 %NC 0.00 93.211 -67.169 127.449 -77.647 94.231 -49.374 116.495 -76.238 91.123 -46.212 103.628 -77.408 90.743 -46.683 127.659 -75.410 90.986 -41.695 141.867-129.304 93.704 -41.539 55.508 -67.422 92.010 -48.479 128.507 -21.712 101.805 -74.109 169.555-155.269 88.637 92.553 127.391 -99.673 95.993 53.787 90.218 -91.818 88.847 78.886 156.283 -99.948 95.302 -2.935 88.245-105.108 107.167 153.116 107.408 -82.431 131.439-139.995 175.550-167.275 110.816-103.246 140.073-152.465 93.458 46.141 151.433 166.767 92.283 45.424 135.303 -86.289 90.880 49.804 142.045 -85.403 90.529 45.166 129.864 -49.827 93.306 39.366 107.952 -82.931 97.936 35.275 0.000 0.000 94.314 44.007 139.871-108.897 92.091 43.534 127.121-119.133 91.099 42.783 113.903-123.977 90.262 47.605 115.744 -78.366 91.073 46.760 132.370-105.001 93.110 56.121 130.997-142.577 93.815 -96.703 104.676 -86.798 102.230-167.199 112.656 -78.948 132.406 -53.733 115.284-113.845 96.986 -42.133 111.470 -80.865 95.660-119.830 124.347 -25.773 92.971 51.439 125.741 -9.981 90.896 55.876 130.309 -76.373 89.512 45.750 104.562 -81.902 90.780 42.921 135.132 -44.112 90.283 52.908 138.584 -91.960 89.015 48.716 128.349 -77.196 90.755 79.149 113.866 -98.664 87.130 -84.251 128.857 -76.891 92.542 -48.512 142.517-118.474 86.696 -55.551 110.429 22.864 90.087 -55.063 145.217 -35.664 90.540 -39.827 113.844 -83.945 99.893 80.236 105.357 -78.143 92.414 0.000 129.482 -75.891 # 794 total E -1.47954E+02 rmsd from N 0.000 %NC 0.00 92.601 134.633 131.179 -65.589 93.928 50.708 145.460 6.534 93.472 43.378 106.885 -81.610 93.370 44.008 126.969 -74.578 95.406 35.753 128.557 -43.972 100.045 32.150 56.531 -66.249 99.658 32.079 112.265 -19.481 99.211 27.521 121.193 -49.241 104.181 31.128 150.832 -37.483 96.578 31.086 102.014-103.164 110.124 21.054 140.291-117.601 98.153 43.535 96.337-101.597 91.527 63.532 137.438-133.508 90.410 61.327 112.509-136.238 95.724 65.988 130.493-141.694 119.031-133.258 159.126 172.389 95.187 52.929 137.862 -82.744 89.742 56.314 112.899 -31.127 88.532 67.106 109.313 -81.457 86.353 51.836 138.878-176.993 86.540 52.886 0.000 0.000 88.726 53.527 101.528 -84.002 87.277 54.946 144.645 -68.920 87.686 50.200 124.407-136.992 87.673 50.728 105.579 -71.961 90.234 49.325 137.213 -45.150 91.098 46.197 138.137-140.136 94.245 -93.721 141.990-123.227 122.638-166.700 154.626 -16.520 110.535 -59.265 115.030-123.574 91.809 -45.922 112.210 -74.247 93.293 -77.036 107.247 -40.246 90.312 101.612 137.621 -45.461 93.617 50.249 129.457 -76.697 88.985 46.297 97.917 -71.198 89.958 60.938 145.486 -35.386 87.397 51.579 160.797-139.249 89.629 40.596 128.312 -76.483 90.477 49.694 115.950 -29.519 89.755 50.198 130.189 -76.735 89.352 45.250 140.199-131.414 89.465 48.391 131.042 -44.369 89.896 54.122 138.427 -52.094 89.627 44.285 141.112-129.537 94.632 80.815 103.943 -80.546 92.481 0.000 128.889 -76.880 # 795 total E -1.52108E+02 rmsd from N 0.000 %NC 0.00 93.049 159.318 137.660 -86.318 93.086 58.606 139.551 51.733 92.343 44.161 106.105 -82.496 92.230 48.378 130.170 -76.726 92.627 45.841 154.058-154.813 92.276 41.378 62.434 -75.393 93.514 41.340 124.083 -43.064 95.599 37.643 132.686-103.449 93.425 48.651 147.413-175.255 90.836 74.495 85.335-105.441 92.786 -64.702 135.507-100.853 107.929 -74.576 91.565 -83.687 93.812-117.736 142.626 -26.221 111.883 167.617 152.094-127.637 109.844 102.386 139.319-157.445 112.275-108.162 146.990-138.113 93.121 48.442 136.567 -83.614 92.168 48.262 128.682 -38.129 91.574 45.262 134.042-137.283 89.412 49.628 138.893-178.833 88.370 50.357 0.000 0.000 90.384 46.934 110.696 -75.421 90.119 42.863 146.235 -73.996 89.966 45.346 117.802-125.326 89.459 51.625 111.033 -80.563 89.278 50.685 142.207-109.899 91.863 42.502 132.540-121.644 97.100 -99.630 143.908-125.758 110.627-163.763 151.554 -18.348 138.360 -65.939 108.534 -97.710 105.995 -18.309 114.253 -78.405 93.177 -54.240 110.953 -56.742 95.364 -34.442 114.737 -69.928 95.604 -44.952 128.069 -76.517 94.784 -31.958 104.153 -87.423 91.588 -53.740 101.778 -60.338 88.187 -57.283 152.057 -27.990 89.504 -50.393 129.131 -76.762 92.259-131.564 125.778-138.731 91.240 56.301 132.105 -76.948 91.806 44.105 140.474-108.237 90.815 45.495 134.393 -40.370 91.548 70.525 146.015 -31.163 87.364 52.373 140.097-153.892 93.214 120.841 146.136 -23.696 92.496 0.000 128.898 -76.251 # 796 total E -1.47173E+02 rmsd from N 0.000 %NC 0.00 93.073 158.302 141.946-101.619 93.581 51.522 148.849 -18.099 92.164 46.295 104.746 -80.509 91.524 52.537 129.734 -75.916 92.249 40.037 128.556-102.640 92.800 48.955 84.298 -87.338 87.493 65.652 117.096 -83.907 93.856 38.316 99.824-110.151 89.373 56.129 143.033 152.206 86.190 138.720 85.095 -97.736 93.114 65.250 150.231-136.011 92.748 43.109 94.169-120.048 94.476 54.868 106.778 -85.727 94.738 -90.482 143.218-101.422 115.047-111.523 143.067-159.976 93.948 48.800 156.452 170.534 93.634 44.637 130.803 -86.770 90.983 47.832 132.905 -50.279 91.420 48.948 79.269-119.286 88.721 47.370 135.844-177.988 89.978 44.647 0.000 0.000 91.622 46.648 110.703 -80.785 88.821 44.778 151.015 -81.089 90.215 46.108 116.950-130.669 89.526 47.211 107.682 -75.959 89.748 47.563 137.475 -82.229 94.096 38.029 134.050-140.971 95.952 42.272 153.003 -21.145 98.701 62.467 115.406 -86.319 136.097-113.915 111.017-101.561 119.558 7.640 117.188 -80.505 92.153 -59.993 110.850 -52.891 90.572 -47.740 108.995 -72.971 90.041 -47.311 127.582 -76.095 88.216 -43.538 104.993 -87.565 89.428 -55.930 105.353 -67.185 85.757 -52.996 163.356-146.631 89.603 -50.865 127.697 -75.882 92.246-123.510 126.301-117.756 89.206 55.808 133.099 -77.267 90.521 46.173 140.313-105.588 88.978 48.982 125.307 -21.202 89.876 62.488 145.224 -36.882 87.482 45.163 139.288-146.388 94.560 91.898 103.157 -79.912 92.531 0.000 128.857 -76.506 # 797 total E -1.49960E+02 rmsd from N 0.000 %NC 0.00 92.510 129.262 127.744 -57.226 94.617 47.824 116.899 -45.908 93.981 51.998 107.661 -74.478 92.573 118.247 129.534 -76.480 87.542 -47.281 124.920-116.356 93.040 -49.899 68.878 -62.484 95.236 -26.824 127.195 48.098 101.031 -39.054 174.635-169.994 99.334 -42.820 133.292-104.677 93.730 141.891 94.104 -75.770 95.436 81.183 148.479-134.691 91.943 37.279 95.126-123.392 97.764 48.059 103.154 -84.048 97.678 -11.597 142.666 -83.558 131.820-173.925 108.074 -88.697 96.576 42.028 147.826 125.469 93.163 45.286 135.938 -86.976 90.856 50.923 148.280 -76.960 90.285 48.918 129.997 -27.728 90.394 43.210 154.029 -18.658 90.149 47.053 0.000 0.000 89.554 50.729 108.271 -89.904 88.273 52.937 143.075 -83.648 88.051 48.845 124.350-133.756 87.795 51.283 106.716 -72.520 89.957 48.182 136.036 -54.837 91.336 47.506 136.704-134.775 94.507 -98.618 105.088 -84.124 114.270-166.064 159.376-146.307 97.030 -50.911 96.375-109.516 91.840 -46.850 110.861 -74.198 92.039 -73.587 112.007 -61.214 89.141 106.896 117.151 -72.504 93.150 45.008 128.601 -76.350 89.157 47.752 101.937 -74.052 90.923 53.827 145.673 -27.319 87.223 46.852 161.673-159.166 90.308 42.582 128.202 -76.552 89.957 49.321 115.070 -28.263 89.171 48.972 130.800 -77.642 90.115 43.938 135.051-112.640 89.484 51.856 129.836 -40.237 88.364 66.515 141.018 -52.463 88.095 52.585 133.549-125.484 91.255 101.666 101.346 -79.938 92.552 0.000 128.437 -77.027 # 798 total E -1.48741E+02 rmsd from N 0.000 %NC 0.00 123.201-110.849 150.303 -79.253 94.851 -49.210 124.680 -77.350 92.033 -47.194 140.688 -31.812 91.374 -44.173 128.440 -75.655 93.593 -43.930 147.587-173.787 91.019 -54.576 111.369-126.725 90.361 125.452 111.215-107.612 95.108 41.937 143.203 -86.147 91.193 48.987 150.810-149.177 89.859 46.179 83.277-100.713 94.037 173.041 129.808 -83.072 91.121 77.302 132.457-160.592 91.208 49.296 103.428 -82.687 91.146 50.114 142.465 -31.425 91.694 39.302 135.795-115.007 93.713 47.504 123.214-126.709 93.690 40.688 125.634 -87.928 95.596-106.787 150.096 177.785 117.162 -88.518 91.563 -96.841 88.499 86.061 151.199 -20.503 89.827 61.813 0.000 0.000 90.271 48.402 109.498 -76.425 89.340 45.265 147.545 -75.632 89.504 47.343 119.553-127.926 88.537 51.973 110.888 -79.932 89.113 49.957 140.674-106.480 90.956 46.604 132.731-119.579 94.591 -99.800 104.305 -83.892 114.146 176.144 158.847-146.949 132.866-164.769 109.333-103.274 96.621 45.842 115.167 -77.265 93.886 43.167 106.467 -18.806 92.432 46.215 133.724 -15.948 90.459 46.013 129.483 -77.396 90.580 49.083 101.886 -84.945 90.408 44.371 126.872 -42.163 91.723 47.925 124.915 -76.552 90.331 43.144 129.611 -77.376 92.751 110.298 106.138 -98.618 88.801 -61.302 129.727 -77.847 91.435 -47.382 145.083-130.819 89.180 -47.203 131.840 -24.564 90.328 -53.821 156.607-152.632 90.608 -45.589 130.182-145.466 94.034 103.464 103.540 -79.523 92.549 0.000 128.684 -76.693 # 799 total E -1.47758E+02 rmsd from N 0.000 %NC 0.00 93.091 171.021 135.278 -82.891 92.375 63.454 126.463 -28.986 94.392 42.487 104.753 -79.199 93.592 43.226 129.039 -75.408 93.056 46.038 113.810 -89.800 91.183 40.980 61.860 -68.042 90.792 46.136 121.960 -38.408 91.163 42.062 130.481 -98.808 91.596 48.747 129.078-110.872 88.501 49.102 88.639 -97.699 91.888 176.608 126.316 -84.803 91.007 76.625 133.566-162.742 91.431 44.320 101.773 -79.416 92.355 48.833 143.064 -33.053 91.926 39.436 140.032-120.804 93.414 48.181 122.283-127.774 93.114 39.278 124.870 -91.158 96.199-108.644 148.011-179.121 116.772 -88.124 86.795 -99.526 87.969 84.034 149.957 -15.683 89.245 65.771 0.000 0.000 89.003 51.808 114.210 -65.918 90.069 42.850 149.163 -75.288 91.394 41.752 118.516-127.790 88.766 58.394 105.444 -74.092 89.652 54.512 138.867 -57.910 90.960 44.499 130.132-113.138 94.101 39.579 143.837-130.362 111.243-107.597 106.231 -84.427 97.263 -45.421 94.484 -89.456 90.852 -63.518 117.801 -76.352 88.606 -50.818 130.586-152.984 89.564 -58.681 112.829 -74.242 90.901 109.151 129.515 -75.248 94.130 42.623 103.762 -83.099 89.758 50.256 121.950 -20.961 89.823 49.036 145.576 -32.575 89.150 44.548 128.414 -76.930 88.933 52.541 113.704 -35.879 90.433 45.784 127.888 -75.892 92.150 44.554 143.073-105.299 94.846 111.616 130.739 -48.541 92.416 -50.074 145.751 -85.692 95.473 -55.544 134.498-136.282 95.183 116.636 104.826 -79.191 92.412 0.000 128.789 -76.151 # 800 total E -1.47467E+02 rmsd from N 0.000 %NC 0.00 93.176-178.857 132.926 -77.729 94.313 64.597 139.361 58.302 96.820 35.686 105.523 -78.644 92.573 47.762 133.113 -78.508 91.987 44.797 147.924-144.884 91.722 46.350 57.786 -68.216 89.464 45.271 126.932 -32.948 88.936 51.277 124.909-111.979 87.295 47.297 127.736-122.880 91.738 84.410 84.847 -99.095 90.598 -55.811 148.819-104.902 104.082 -70.901 92.692 -88.008 89.169 -75.587 147.076 -0.217 102.560 141.763 147.768 159.111 117.566 64.963 136.885-150.094 127.236 -99.995 144.165-129.534 92.803 52.678 137.556 -81.981 91.199 48.890 125.203 -44.701 90.757 48.402 137.082-126.834 89.241 48.477 132.803 160.972 87.110 52.898 0.000 0.000 89.182 49.194 104.672 -83.771 90.558 43.087 176.443-151.564 91.483 42.620 108.361-139.333 90.414 50.764 112.457 -78.022 90.262 50.881 151.014-120.552 90.728 42.481 141.566-154.861 91.135 45.294 141.691-129.374 93.805 90.108 137.207-106.550 90.128 73.048 103.458-130.742 93.141 44.770 113.624 -78.838 102.725-173.103 133.423 26.649 97.069 53.209 135.774 -16.774 92.601 46.365 129.311 -76.293 87.554 50.753 103.856 -76.806 89.813 59.455 141.815 -42.930 87.761 46.450 159.272-138.396 90.078 41.113 128.207 -76.450 90.154 54.054 115.834 -29.963 89.415 49.092 130.129 -77.448 90.089 42.301 137.054-133.307 90.460 63.663 131.611 -44.558 89.590 93.740 134.214 -52.297 88.139 50.857 137.975-136.407 96.359 91.403 101.172 -79.213 92.385 0.000 129.317 -75.769 # 801 total E -1.48050E+02 rmsd from N 0.000 %NC 0.00 92.996 157.992 138.313 -88.413 93.431 57.665 134.597 51.725 92.239 42.421 106.429 -82.425 91.783 50.830 131.294 -76.886 90.787 46.256 156.227-164.787 93.586 39.520 65.010 -72.854 91.474 48.436 121.378 -37.615 89.114 96.264 140.662-105.633 80.013 65.971 123.258-141.825 88.884 45.925 80.946 -92.097 92.360 48.880 147.066 -78.758 95.549 46.323 102.145-110.865 95.728 165.986 108.660 -90.507 137.017 55.412 154.782-152.021 94.904 52.893 136.841-157.697 93.148 48.190 140.953-120.527 97.578-112.769 129.072-115.693 101.800-141.863 128.808 -93.180 96.149 45.435 136.966 -18.502 93.865 46.367 145.401-168.002 90.597 45.019 0.000 0.000 91.650 49.222 104.237 -84.979 88.811 45.459 145.535 -70.792 90.375 43.853 120.019-127.406 90.601 46.638 107.656 -75.627 91.172 44.142 133.418 -78.411 95.992 36.913 139.140-138.051 98.230 36.436 145.411-135.437 100.923 38.477 110.272 -84.167 113.414 179.771 92.043 -80.576 92.496 47.964 115.452 -76.518 91.282 52.838 96.666 -11.872 88.143 53.460 125.508 -8.187 89.846 47.842 129.118 -77.060 89.023 43.356 103.691 -84.470 90.537 49.167 119.744 -25.219 91.797 38.813 136.021 -56.309 93.699 46.458 128.492 -76.510 94.681 67.961 114.257 -82.282 90.947 -98.362 128.875 -76.544 93.689 -36.079 142.760-117.698 90.303 -55.759 119.565 2.919 91.293 -48.992 153.610 -24.624 92.044 -40.321 142.399-142.094 98.317 105.629 103.892 -78.477 92.363 0.000 129.231 -75.714 # 802 total E -1.47707E+02 rmsd from N 0.000 %NC 0.00 93.025 147.428 141.642 -98.993 93.063 50.497 125.717 -25.470 90.638 47.652 104.432 -81.829 91.045 55.574 130.273 -76.255 91.330 42.885 126.792-101.963 89.609 43.394 79.341 -85.064 89.861 49.045 123.507 -80.604 88.714 47.715 128.649 -94.360 90.836 41.151 118.966-103.920 97.012 148.759 90.651 -90.529 95.876 57.326 145.756-139.615 94.428 49.319 94.681-119.982 94.677 61.525 104.254 -84.086 96.307 -91.453 130.748 -85.581 112.106-113.733 140.420-150.693 92.903 55.499 135.793 133.099 91.945 44.311 133.911 -87.528 89.803 52.265 140.756 -47.021 89.677 53.409 88.941 -24.782 88.797 45.182 105.971 -75.646 90.817 47.206 0.000 0.000 93.656 44.306 106.808 -80.690 89.771 41.988 156.714 -81.171 92.424 44.084 112.754-128.627 90.131 51.077 110.084 -77.480 89.213 48.004 135.790 -93.044 92.779 59.005 132.418-139.243 93.899 -13.299 107.494 -86.624 125.757 120.409 150.124 -15.837 136.043 -65.819 107.221 -96.294 101.921 -28.101 112.722 -78.491 93.274 -49.570 108.105 -54.812 93.588 -38.478 116.363 -67.894 92.198 -51.836 127.870 -76.325 89.886 -64.525 103.028 -85.346 86.905 104.524 109.879 14.392 94.494 51.077 137.767 -43.252 90.661 50.972 132.315 -78.257 92.143 121.365 152.382 163.616 91.973 -46.773 128.059 -76.355 91.549 -44.642 144.843-130.024 89.009 -51.342 127.318 -26.893 91.582 -54.566 157.536 -19.148 89.931 -35.980 139.037-141.817 99.450 125.237 103.850 -78.570 92.473 0.000 129.086 -75.844 # 803 total E -1.46824E+02 rmsd from N 0.000 %NC 0.00 92.586 133.067 131.538 -68.283 94.485 47.476 135.744 -94.905 91.946 48.496 106.618 -81.661 91.100 49.743 127.990 -75.585 88.589 50.320 97.578 -66.009 92.081 40.618 93.767 -65.141 91.619 41.902 115.444 -71.082 98.384 30.792 106.638 -89.499 94.407 47.532 137.867 -73.691 108.221 7.844 79.786 -92.821 97.354 54.221 148.375 177.009 98.313 0.636 88.113-111.301 106.122 59.549 111.279 -85.637 107.165-174.525 121.156 -90.120 123.992 -64.069 145.827 168.563 95.844 50.292 141.618-122.970 93.876 41.640 133.815 -79.516 90.835 54.989 155.813 -18.097 89.554 46.292 108.290-104.323 89.389 47.970 153.799 -23.754 90.555 47.497 0.000 0.000 89.275 50.226 120.426 -75.414 89.310 43.290 140.343 -92.047 90.163 48.812 121.638-127.034 87.770 54.415 111.190 -79.507 89.493 51.138 139.700-104.571 89.972 46.134 129.918-150.556 95.568 -86.791 103.991 -82.766 124.229 138.084 151.421 -15.485 133.452 -28.694 112.634-107.053 139.945-118.829 123.098 -83.229 92.403 51.350 107.304 -8.235 92.264 45.351 126.452 -5.131 91.067 47.216 129.816 -75.920 91.137 42.725 104.562 -86.396 89.891 48.501 117.021 -24.536 91.398 46.881 135.596 -56.560 92.146 44.104 130.533 -77.261 90.968 111.758 104.322-112.918 92.803 -46.462 129.188 -78.177 94.786 -47.057 143.252-122.889 92.624 -37.426 120.202 16.670 95.080 -56.780 157.859 -25.475 90.795 -41.856 137.829-144.256 96.844 86.563 100.000 -79.631 92.470 0.000 129.042 -76.401 # 804 total E -1.47543E+02 rmsd from N 0.000 %NC 0.00 93.086 -65.374 127.193 -77.238 94.313 -48.946 116.353 -78.036 91.025 -46.310 103.656 -77.737 90.630 -47.100 128.298 -75.639 91.182 -40.985 138.904-124.322 94.260 -40.920 63.035 -64.904 92.939 -39.706 132.387 -4.137 100.128 -37.054 170.606 160.022 96.040 -60.224 129.386-111.197 94.728-154.214 79.491 -80.673 108.974 67.820 145.827-144.728 96.917 38.163 91.527-117.887 95.732 80.110 110.807 -81.261 93.196 -44.775 145.257 -53.624 115.263-143.550 116.575 -86.327 123.097 9.661 136.611 142.474 94.788 45.918 135.804 -83.656 91.705 45.892 125.932 -52.756 91.378 54.555 112.613 -37.541 88.103 43.954 153.716-153.176 88.708 47.830 0.000 0.000 90.155 48.267 105.358 -82.511 90.969 44.388 141.701 -70.440 92.337 39.606 121.439-123.881 91.071 48.966 111.727 -77.688 90.940 53.206 130.112 -92.193 90.902 48.206 140.939-157.977 91.591 30.233 142.267-129.271 110.794 43.263 113.375 -85.939 140.029-171.162 104.693 -87.512 109.654 103.818 117.783 -79.251 91.493 -58.110 100.838 -55.805 89.989 -39.568 120.390 -73.253 93.121 -62.781 126.166 -75.186 84.886 -54.819 102.131 -82.570 87.347 -57.201 118.700 23.073 89.669 -52.243 142.351 -27.589 89.481 -43.348 128.972 -75.571 95.567-151.367 106.889-108.257 90.407 53.988 132.004 -77.034 90.930 46.285 140.015-111.419 90.249 46.743 124.536 -6.653 90.095 55.314 139.484 -91.109 89.846 42.324 132.225-135.591 95.255 79.531 105.251 -80.501 92.545 0.000 128.906 -76.743 # 805 total E -1.47611E+02 rmsd from N 0.000 %NC 0.00 92.970 154.456 138.648 -89.477 93.404 56.073 129.854 51.346 91.753 44.198 107.255 -81.174 91.621 46.524 130.147 -76.618 92.182 45.339 156.298-160.794 93.276 42.756 55.651 -63.514 90.239 44.391 128.665 -18.755 89.543 54.485 131.394-115.229 88.504 43.040 124.811-105.409 90.902-146.865 85.234 -90.515 122.699 142.567 150.972 146.821 93.067 70.952 92.441-123.447 100.625 72.764 100.550 -85.108 126.330 -93.588 140.115 -71.099 112.474 -93.162 144.080-148.297 93.905 50.483 146.457 141.487 92.518 43.126 134.471 -90.884 90.123 52.270 161.310 124.927 89.173 49.357 154.991 -57.829 90.649 42.582 141.989-135.548 93.690 40.077 0.000 0.000 89.971 52.520 151.743-154.723 90.080 46.673 113.148-120.889 90.532 41.505 119.345-124.140 89.973 50.785 115.539 -74.883 91.228 46.082 136.344-103.620 92.789 50.716 131.257-146.454 94.789 -6.826 143.339-131.330 129.503-168.722 107.763 -78.960 95.840 49.182 137.391-163.651 95.220 38.061 114.676 -77.599 91.881 49.025 148.081-141.325 89.317 58.675 109.062 -70.792 87.598 44.532 130.492 -77.496 88.999 45.866 138.574-157.340 90.286 44.584 127.060 -55.938 89.486 48.666 136.352 -85.109 89.827 49.986 128.452 -77.307 89.724 79.742 110.002-106.438 90.543-169.737 128.759 -77.195 94.349 49.717 140.722-111.035 91.059 47.252 125.074 -31.204 91.196 55.674 154.907 -33.933 90.163 58.369 142.975-171.422 89.607 108.227 100.848 -80.196 92.604 0.000 128.495 -77.000 # 806 total E -1.49266E+02 rmsd from N 0.000 %NC 0.00 93.248-152.156 129.260 -67.605 94.364 63.394 149.552 36.644 96.443 36.763 107.680 -81.546 92.107 51.353 133.818 -77.902 92.197 40.606 139.279-128.306 90.466 48.479 62.072 -74.713 88.009 50.313 114.690 -46.104 89.769 47.580 122.200 -93.133 87.905 44.523 133.873-112.569 90.880 59.019 84.972 -98.789 91.595-175.342 133.792 -86.319 91.577 72.160 101.434-128.637 93.336 42.617 103.798 -79.600 91.277 50.870 149.440 -28.484 90.003 44.696 132.946-131.421 91.223 46.536 120.840-122.318 91.396 48.254 132.510 -71.532 91.971-118.716 116.011 -75.280 101.867 -97.315 106.779 -90.770 85.514 83.358 154.010 -21.106 90.639 56.349 0.000 0.000 91.529 43.330 159.167-154.952 91.997 40.585 143.144-108.947 92.502 48.484 126.828-149.739 86.783 62.798 118.196 -78.839 88.812 55.034 137.062-120.422 89.029 41.276 124.243-163.652 96.690 -96.047 143.061-128.034 127.536 165.884 112.784 -78.635 131.415 -23.790 110.738-105.082 99.637 -43.022 111.365 -78.592 91.983 -45.137 112.907 -56.293 89.105 -58.133 110.120 -76.551 88.722 -48.223 128.104 -76.272 87.659 -49.866 96.854 -80.740 87.327 -58.723 113.471 -25.462 90.701 -32.733 149.779 -13.091 97.084 -58.845 129.034 -76.643 122.164-108.175 140.735 28.131 91.569 51.691 130.669 -76.560 92.044 45.004 140.370-103.215 90.028 49.006 125.143 -21.864 90.491 56.989 134.372-104.332 88.527 42.026 132.182-148.819 95.292 84.591 103.145 -79.598 92.543 0.000 128.962 -76.467 # 807 total E -1.47166E+02 rmsd from N 0.000 %NC 0.00 92.919 152.464 139.133 -90.956 93.223 50.741 115.493 -26.706 92.771 45.309 104.778 -81.607 92.279 46.911 129.830 -75.753 91.890 46.251 110.976 -78.048 88.997 42.456 65.887 -65.455 88.661 53.159 130.204 -42.625 88.147 47.934 120.066 -98.323 88.745 43.748 130.449-109.506 93.567 92.711 86.728 -96.948 90.002 -68.143 143.994-104.613 101.688 -47.433 121.193-137.715 89.849 -53.477 105.332 -79.259 112.736-122.092 160.988-153.011 113.826 -88.902 141.813-153.922 94.206 53.119 136.574 -95.777 94.272 42.937 139.810 -2.249 93.936-172.996 152.733-121.182 123.389-106.226 131.377 -58.642 88.285 63.113 157.346 -16.236 88.838 55.473 0.000 0.000 89.328 49.135 107.910 -78.831 88.911 44.773 144.980 -76.230 90.139 48.225 121.301-129.342 87.805 53.037 112.645 -77.593 89.414 49.562 135.234-103.334 90.536 44.846 130.186-144.783 95.376 -90.172 104.567 -83.421 124.826 160.987 152.230 -14.846 131.700-167.556 109.662-103.637 96.301 47.011 115.304 -77.281 92.734 46.204 104.258 -10.359 91.529 47.489 129.197 -7.951 90.842 44.526 129.385 -77.245 89.962 49.490 103.352 -85.376 89.435 52.649 118.947 -25.970 91.602 42.256 128.481 -63.665 92.417 42.442 129.964 -76.821 95.044 115.361 109.781-101.869 89.825 -61.117 129.740 -77.887 90.881 -45.527 145.167-124.864 89.153 -47.440 131.343 -21.988 91.309 -53.584 159.513-154.487 90.464 -44.392 125.206-148.884 94.552 102.896 103.091 -79.455 92.620 0.000 128.827 -76.625 # 808 total E -1.49689E+02 rmsd from N 0.000 %NC 0.00 93.033 155.813 141.250 -98.129 92.936 54.894 147.974 57.955 91.557 46.043 106.231 -82.182 91.669 53.759 131.120 -76.703 93.269 41.425 151.183-154.688 91.244 42.998 67.545 -90.132 90.834 45.837 110.406 -60.063 88.491 55.670 143.498 -86.802 89.189 33.208 118.992-112.409 95.837 49.545 94.799 -94.790 106.620 8.717 135.858 -88.971 109.991-110.040 101.273 -83.147 110.768-163.500 104.889 -81.595 113.701-122.085 158.004-137.868 105.597-115.647 140.590-152.633 92.342 47.537 140.117 139.615 91.374 47.082 135.110 -85.137 90.349 48.457 125.557 -51.471 90.396 48.890 131.233 -31.583 89.475 45.121 143.758-144.130 89.556 48.535 0.000 0.000 89.069 53.398 112.620 -79.441 88.977 42.736 132.366 -78.694 89.505 46.714 122.238-118.974 89.238 53.066 108.710 -79.408 89.204 51.433 139.608 -97.026 90.477 40.593 129.742-146.146 97.056 -97.300 105.255 -83.224 116.320-171.024 152.081 -16.026 136.784-158.486 107.728 -97.292 96.640 43.509 115.043 -77.544 92.637 45.956 100.034 -8.264 91.065 49.293 120.024 11.560 88.487 53.084 128.996 -76.247 88.696 45.928 103.766 -84.231 92.249 41.217 133.594 -25.891 93.857 37.252 133.483 -77.528 95.226 45.689 129.258 -77.441 97.126 109.232 104.832 -66.478 90.668 -49.548 131.573 -78.145 91.730 -56.870 142.364-126.879 85.824 -65.797 129.570 0.351 88.450 -54.537 160.558-168.663 90.388 -41.892 131.358-106.030 95.951 116.769 105.437 -79.550 92.536 0.000 128.643 -76.452 # 809 total E -1.50406E+02 rmsd from N 0.000 %NC 0.00 93.133 158.283 140.967 -98.306 93.170 55.297 152.288 108.013 92.402 44.006 107.545 -80.785 92.682 51.493 130.844 -76.710 92.019 41.349 153.010-156.883 91.195 45.175 74.005-101.903 91.075 45.056 114.653 -80.061 88.444 50.349 140.923 -94.994 90.393 47.970 112.341-105.856 91.752 172.530 94.987 -91.073 114.089 44.652 139.116-151.356 91.885 59.401 100.103-131.780 91.387 65.549 103.917 -85.411 92.562-105.026 125.119 -84.434 104.043-117.363 140.171-151.790 91.601 50.560 142.023 143.293 91.423 46.648 135.051 -85.885 89.784 50.457 125.763 -53.133 89.599 51.127 124.508 -30.433 89.551 45.808 144.822-150.264 90.105 44.942 0.000 0.000 89.565 55.480 109.428 -80.330 87.258 47.563 142.405 -79.760 89.795 44.221 120.989-129.092 89.590 50.231 109.473 -76.323 89.312 49.072 134.560 -90.283 92.569 52.839 133.640-142.195 94.249 10.507 108.122 -86.867 125.724 89.100 151.801 -16.514 133.992 -78.047 114.494-108.521 121.227 -0.397 116.162 -81.391 92.168 -57.337 104.303 -55.834 91.006 -37.590 118.083 -73.323 94.606 -64.475 126.054 -75.403 86.639 -77.814 97.851 -82.916 87.748 97.936 106.579 42.476 97.477 63.189 138.507 -18.121 90.495 32.376 132.715 -77.750 99.500 111.636 133.958 153.131 137.184 -80.768 132.909 -77.182 90.966 54.721 141.795-111.237 92.487 41.115 124.531 -67.806 92.127 53.357 137.856-100.304 89.998 43.855 133.856-145.286 95.821 52.221 102.431 -79.494 92.443 0.000 129.350 -76.317 # 810 total E -1.53227E+02 rmsd from N 0.000 %NC 0.00 93.096 161.288 138.176 -88.658 93.367 55.592 150.341 120.059 92.860 43.127 107.723 -80.155 92.916 48.579 131.667 -77.775 94.160 40.362 158.051-148.412 93.197 44.125 69.664-101.642 90.276 44.706 112.249 -72.655 90.254 57.239 133.577-103.609 87.873 52.064 122.749-112.221 88.363 168.935 84.993 -96.893 94.576 57.994 141.292-147.281 94.757 47.981 93.164-117.702 92.877 53.750 107.510 -82.382 92.872-127.623 134.160 -76.138 107.554-107.610 140.180-155.051 91.181 50.773 141.996 172.325 91.198 48.857 134.708 -84.469 89.618 52.125 131.346 -14.893 89.306 47.426 123.811 -53.952 87.410 52.598 137.452 169.003 86.711 56.069 0.000 0.000 88.146 46.808 106.395 -75.414 89.839 45.294 145.381 -65.599 91.427 42.736 122.747-127.235 89.739 48.409 111.001 -77.684 88.864 57.993 138.967 -99.024 90.214 46.322 142.328-122.226 92.166 37.647 108.268 -86.074 99.896 5.767 150.091 -24.583 136.231-163.417 104.834 -92.966 95.433 49.043 114.941 -77.226 92.676 50.513 105.765 -14.263 91.032 45.544 124.024 -4.903 91.254 49.629 131.103 -76.511 89.339 39.825 103.101 -85.076 92.452 42.678 119.340 -34.501 92.550 45.934 138.499 -47.368 91.254 41.119 130.565 -78.469 92.086 117.883 103.176 -95.368 91.487 -45.592 130.585 -78.592 94.335 -45.471 144.614-133.128 91.838 -39.308 124.409 -12.217 92.239 -62.584 159.344 -27.317 90.197 -48.309 140.125-151.414 94.666 76.728 99.274 -80.696 92.482 0.000 128.988 -76.517 # 811 total E -1.46375E+02 rmsd from N 0.000 %NC 0.00 93.156 162.932 140.392 -97.984 93.428 54.917 139.809 35.355 92.134 45.140 106.586 -82.815 91.960 47.196 130.072 -76.782 93.536 44.901 146.733-124.268 92.824 41.707 58.163 -72.271 91.108 45.198 124.916 -32.144 90.067 47.760 130.601-103.607 88.750 51.436 137.370-130.090 86.921 46.381 82.177-105.051 92.301 174.269 135.296 -91.224 90.840 83.910 114.624-159.568 91.118-179.621 105.490 -85.408 139.824 -94.865 157.132-150.624 100.603-120.431 134.507-151.584 94.577 45.634 144.787 137.772 92.587 46.563 133.964 -84.425 91.114 46.438 127.429 -56.728 92.799 49.725 125.972 -32.769 91.712 41.451 108.152 -82.650 90.010 48.181 0.000 0.000 90.693 56.207 103.425 -81.031 88.320 42.711 146.300 -74.189 91.301 41.622 116.625-124.883 90.985 51.521 107.691 -75.242 90.267 48.919 134.667 -80.564 92.238 39.710 134.390-130.488 95.278 33.451 116.728 -91.509 108.245 -11.582 120.354 -89.696 134.286-163.246 107.054 -96.697 97.521 60.534 118.382 70.721 92.955 110.677 122.965 -89.913 99.610 -24.759 110.865 -75.990 92.449 -64.029 127.775 -76.435 88.368 -43.087 102.788 -83.379 90.215 -55.987 103.232 -54.389 87.173 -46.330 149.299 -31.871 94.643 -51.601 130.619 -77.279 125.364-121.864 143.630 -24.634 92.707 48.810 129.489 -75.029 92.432 43.810 142.597-109.485 91.334 45.342 130.822 -45.552 91.636 51.572 127.597-107.635 90.556 43.476 133.419-147.200 95.634 71.880 103.916 -80.291 92.510 0.000 129.003 -76.647 # 812 total E -1.46889E+02 rmsd from N 0.000 %NC 0.00 93.158 158.240 141.199-101.597 95.471 38.798 138.211-110.495 98.195 119.230 102.447 -76.153 92.461 -50.505 130.926 -77.355 96.844 -36.499 137.830-123.080 102.582 -26.322 71.353 -77.949 93.935 -56.074 112.234 -52.643 94.488 -39.504 144.544 -77.872 91.405 -46.363 131.993-106.929 93.894 103.781 118.966-123.645 149.970 125.654 159.716-165.051 93.649 77.387 134.119-161.202 93.758-170.765 100.935 -85.884 141.902-152.965 165.020-159.501 101.722-115.832 151.715 -33.300 92.833 49.210 139.504 134.840 91.285 48.194 137.328 -82.685 90.503 48.114 125.110 -53.901 91.481 46.613 117.167 -26.434 90.278 45.859 149.706-137.020 89.531 48.158 0.000 0.000 92.497 45.457 102.719 -81.544 89.559 41.725 152.849 -78.189 92.293 43.844 114.557-127.122 89.807 49.640 109.900 -75.725 89.525 51.930 134.936 -93.900 91.315 39.782 135.404-140.266 94.101 42.642 114.497 -88.986 97.665 12.921 116.765 -82.393 139.239-169.129 103.431 -87.702 93.847 48.756 114.702 -76.869 92.062 49.417 99.381 -13.640 89.723 49.352 127.945 -2.577 90.578 47.282 130.030 -77.744 90.361 42.146 103.406 -84.371 90.223 47.994 120.688 -29.814 89.819 51.749 135.801 -57.541 88.841 42.379 128.545 -77.090 90.686 83.903 112.717-103.959 88.377 -81.184 128.776 -77.202 95.289 -53.488 143.615-125.137 93.598 -37.678 115.189 30.569 93.990 -50.422 141.260 -53.248 93.079 -45.620 140.136-134.615 96.719 62.926 103.950 -79.347 92.409 0.000 128.993 -76.265 # 813 total E -1.47694E+02 rmsd from N 0.000 %NC 0.00 92.663 -19.550 125.148 -68.236 122.495-113.871 137.672 -41.898 92.845 49.494 145.670 -25.810 92.130 47.408 129.404 -75.947 92.591 41.564 156.835-149.759 92.339 43.563 126.550 156.412 91.871 44.036 119.262 -45.490 93.310 40.722 132.912 -94.359 90.200 48.594 148.510-152.298 89.048 57.127 78.345-109.166 91.149 37.052 130.005 -83.429 105.256-123.956 96.881 -82.575 115.005-177.051 106.457 -82.760 134.668-102.808 172.168-164.967 103.784-117.013 137.054-144.652 92.981 46.773 149.961 158.409 92.350 46.394 134.932 -84.814 91.073 48.228 142.794 -45.537 89.554 48.880 125.420 -43.525 88.723 49.127 145.322-151.181 91.007 43.422 0.000 0.000 90.144 46.788 131.603 -84.608 90.272 44.697 135.922-107.868 90.724 47.232 118.279-130.135 86.841 56.017 117.751 -78.759 89.449 53.283 139.062-121.245 88.545 45.146 120.425-165.646 94.506-109.673 104.719 -83.192 117.238 169.664 160.604-149.220 96.337 -64.731 95.488-105.992 90.591 -54.674 109.538 -76.377 88.206 -55.659 143.752 -14.233 89.379 -52.019 135.637 -5.689 90.961 -41.594 127.603 -75.480 92.252-115.244 111.751 -79.568 102.547 47.867 159.576 -17.796 92.189 51.757 163.469 168.941 92.184 37.330 128.319 -75.633 93.023 48.294 114.291 -46.258 89.913 44.905 131.921 -78.127 90.839 47.869 142.999-105.915 89.524 48.378 127.570 -39.460 89.439 54.633 135.821 -96.454 90.008 41.796 130.471-131.335 95.956 109.964 146.827 -24.496 124.058 0.000 144.597 -92.615 # 814 total E -1.49381E+02 rmsd from N 0.000 %NC 0.00 93.096 155.780 140.998 -97.764 93.032 54.582 148.506 49.719 91.855 45.921 107.171 -80.452 90.792 50.136 129.539 -75.695 91.502 39.426 150.255-138.364 92.964 50.132 115.548 142.325 89.789 49.719 107.418 -55.871 91.984-114.219 119.668 -73.909 91.982 -47.117 93.986 -34.383 96.357 -34.299 146.791 -4.304 97.914 -38.227 150.242-126.383 105.070 -53.116 91.040-100.158 99.334-149.799 107.163 -82.461 121.978 -49.738 140.330-118.040 100.675-111.125 152.021 -36.893 94.339 44.382 153.976-172.593 92.842 46.398 137.596 -81.732 90.662 47.695 133.121 -72.598 92.400 49.178 123.476 -59.112 91.865 39.483 143.946-159.903 94.965 38.155 0.000 0.000 93.066 48.547 135.457-110.761 90.450 44.940 130.606-113.121 89.894 42.747 115.479-124.398 90.877 46.555 112.527 -81.088 90.564 51.239 144.064-114.601 91.176 48.397 130.801-142.998 92.511-109.605 103.267 -82.337 100.213 172.710 149.400 -16.552 106.726-161.887 88.796 -87.051 91.248 55.194 128.952 32.301 92.224 47.075 102.254 -15.976 90.989 45.380 127.205 -8.471 90.391 45.163 129.758 -77.171 89.554 49.665 102.853 -82.762 88.982 49.433 118.889 -30.069 91.784 38.880 130.688 -62.795 94.082 43.420 129.295 -76.785 94.300 80.370 110.185 -79.166 93.896-170.184 128.819 -76.993 91.348 50.511 140.766-104.997 90.979 46.948 126.648 -31.886 90.394 54.763 151.439 -29.101 89.369 44.896 136.844-142.901 93.332 114.598 101.135 -79.610 92.625 0.000 128.587 -76.758 # 815 total E -1.47810E+02 rmsd from N 0.000 %NC 0.00 93.079 157.439 141.365 -99.586 93.494 52.586 155.624 121.771 92.256 46.640 107.251 -80.358 90.921 48.359 129.622 -75.684 91.364 43.565 151.820-140.727 91.594 42.931 123.865 168.946 91.851 43.556 111.214 -62.470 93.978 40.507 132.066 -83.975 95.421 41.941 158.256-134.699 95.795 111.694 121.739-161.043 115.211-118.615 123.716-162.177 94.604 47.423 94.991-124.906 94.341 40.773 102.720 -82.751 91.686 58.360 155.173 -92.283 90.502 41.317 116.717-134.315 92.847 43.831 128.281-111.620 93.846 50.649 127.516 -59.198 94.259-111.797 129.377 -86.200 111.671-103.543 89.905 -95.364 88.682 72.664 111.191 -82.646 93.016 47.672 0.000 0.000 89.997 44.639 141.345 -7.910 91.727 46.074 141.472 -98.668 89.400 50.029 120.465-133.233 86.620 59.455 110.429 -76.136 88.869 47.882 131.467 -60.181 91.075 43.942 140.741-135.114 95.697 -86.246 105.272 -83.940 120.937 163.436 151.087 -18.764 99.975 -76.624 94.456 -92.415 91.298-148.030 108.959 -73.866 93.287 40.965 141.643-122.229 101.177 42.998 115.403 -77.439 102.970 24.982 129.879 -76.470 93.042 49.664 119.747 -85.899 90.819 47.614 111.732-101.775 91.505 46.517 122.699 -76.559 91.297 40.192 127.808 -75.624 92.340 47.305 76.527 -87.848 92.236 43.542 130.619 -76.669 93.540 35.395 137.656-135.102 93.436 45.257 132.420 -55.380 92.354 48.963 124.963-111.841 91.061 44.821 135.469-149.272 95.305 72.807 103.729 -80.767 92.539 0.000 129.013 -76.678 # 816 total E -1.49224E+02 rmsd from N 0.000 %NC 0.00 93.151 160.585 139.753 -94.678 93.966 53.872 131.562 52.175 91.539 47.465 106.173 -75.863 92.336 42.422 131.231 -78.112 94.249 49.011 149.708-149.127 95.690 36.245 51.505 -68.273 93.632 45.800 133.181 -13.649 92.535 41.895 134.226-110.663 91.711 52.690 149.211-166.466 87.539 46.610 75.374-104.181 94.453 149.258 132.454 -75.696 89.405 77.912 105.590-129.574 94.067 111.349 97.592 -81.097 91.881 -60.242 142.796 -50.788 94.647-125.001 142.282-139.209 90.466 48.640 135.828 121.091 91.720 46.888 133.178 -86.215 91.244 45.380 147.277 -39.333 90.169 47.837 141.235 -24.485 89.420 48.000 110.532 -82.872 90.160 44.154 0.000 0.000 88.998 49.156 113.917 -81.203 90.287 47.401 131.833 -83.581 89.746 44.439 123.745-121.817 89.390 52.874 112.122 -75.392 92.421 97.555 136.116 -97.836 94.929 -63.838 136.916-173.916 96.857 88.433 145.853-135.436 97.197 43.741 142.683-111.016 108.728 171.195 93.594 -91.051 92.865 49.613 127.782 36.931 90.962 52.490 105.441 -8.622 89.187 48.391 126.542 -23.793 90.348 51.078 131.256 -77.627 90.312 50.891 136.636-137.380 90.388-108.491 111.682 -44.756 91.382 -61.577 145.110 -29.936 92.642 -31.247 133.725 -79.463 97.740-157.236 118.144-134.268 93.309 53.080 130.593 -76.649 92.770 40.053 140.095-110.225 92.627 43.992 131.872 -27.629 92.466 50.826 135.212-117.848 90.664 47.425 130.247-154.928 94.000 79.652 102.013 -79.506 92.492 0.000 129.110 -76.344 # 817 total E -1.48296E+02 rmsd from N 0.000 %NC 0.00 93.371 -96.594 127.186 -75.973 92.954 -52.910 118.053 -65.484 92.949 -40.065 105.711 -73.922 93.039 -47.085 126.476 -75.311 99.894 -16.190 150.259-178.514 102.877 -38.653 57.249 -64.906 98.701 -22.256 134.823 -3.837 102.887 -43.525 137.785 -85.333 92.239 -38.464 140.357-151.521 94.754 -58.096 75.185 -89.717 93.688 -0.225 175.368-150.381 137.273 123.895 112.344-102.335 86.964 142.532 114.836 -86.138 128.040-127.854 150.518-128.465 105.580-108.482 140.430-153.748 94.748 42.362 144.188 153.082 91.318 48.625 134.706 -84.823 89.986 54.259 126.381 -46.548 91.137 44.643 122.523 -41.551 94.232 35.220 148.410-152.775 95.917 40.594 0.000 0.000 92.748 47.333 137.009 -33.293 88.915 50.120 145.716 -92.451 89.232 46.539 119.069-132.672 89.342 47.180 106.279 -73.928 89.926 50.541 137.530 -54.926 92.025 43.037 135.847-137.579 93.146 48.136 152.271 -22.090 97.079 27.273 114.083 -87.309 138.393-169.466 104.335 -89.650 96.004 46.076 115.367 -77.229 92.653 47.078 103.373 -5.477 89.534 50.406 127.913 -4.419 90.526 48.403 129.064 -76.777 89.315 43.437 104.501 -84.748 90.744 47.001 122.641 -25.296 90.226 47.401 135.490 -61.810 90.244 43.099 128.431 -76.871 91.924 90.112 115.217 -99.010 87.643 -80.058 129.288 -77.293 93.920 -47.049 146.459-138.584 91.249 -40.644 117.553 21.673 92.737 -65.721 141.347 -52.022 90.583 -57.690 137.364-159.797 95.264 62.136 103.279 -79.733 92.444 0.000 129.420 -75.948 # 818 total E -1.48465E+02 rmsd from N 0.000 %NC 0.00 93.342 173.720 139.360 -98.014 93.548 55.036 142.660 22.379 93.163 44.197 106.145 -81.506 92.136 46.050 131.266 -77.174 95.181 42.364 137.635-111.680 94.338 40.344 54.272 -73.326 91.641 44.178 125.269 -31.693 90.226 49.945 137.362-106.254 88.555 46.967 127.484-120.461 89.433 43.510 83.250 -99.185 92.763 48.036 144.670 -93.069 119.657-138.740 111.203-111.508 101.781-143.588 104.574 -82.132 144.265 179.739 176.429-175.171 104.612 -96.821 139.737-149.368 91.877 60.649 137.843 122.158 92.403 44.513 134.600 -85.197 90.717 48.493 150.610 -20.951 89.535 48.766 142.816 -17.475 89.892 49.017 143.363-145.171 90.801 42.927 0.000 0.000 89.696 50.210 114.063 -78.642 89.471 50.001 137.799 -79.946 89.842 42.275 124.149-128.561 88.977 50.235 115.388 -76.435 91.095 46.387 145.370-118.300 92.647 59.754 134.392-147.993 93.264 -18.408 141.979-129.280 119.078-157.077 113.778 -81.831 116.552 34.933 130.217-144.406 95.399 41.377 114.917 -77.939 93.312 44.008 137.143 -46.757 93.150 46.538 112.435 -69.522 90.745 42.587 130.667 -76.148 91.574 39.285 104.032 -85.511 93.295 42.339 118.137 -71.381 90.494 45.379 132.622 -68.647 91.084 41.572 128.791 -78.034 90.529 47.095 104.535 -70.072 91.217 44.681 127.918 -76.100 92.062 42.184 132.726 -97.019 91.492 46.516 135.386 -68.620 91.039 50.711 128.547-120.748 90.792 42.954 130.488-141.658 95.846 67.013 104.268 -81.481 92.523 0.000 129.075 -76.692 # 819 total E -1.52833E+02 rmsd from N 0.000 %NC 0.00 92.907 146.236 138.208 -87.541 94.414 45.520 132.671 -88.050 92.122 48.884 105.271 -80.519 90.537 51.244 129.899 -75.786 90.253 46.556 101.373 -79.585 90.096 41.679 69.574 -59.727 89.367 50.838 122.988 -44.182 88.364 50.774 123.959 -98.864 88.211 42.137 126.438-113.096 92.080 45.507 85.694 -94.426 92.994 45.741 138.852 -84.607 102.853-128.470 97.668-100.079 108.654-161.369 104.394 -83.392 146.771-155.523 176.438-176.338 109.827 -97.359 140.054-149.090 94.055 48.457 149.303 159.800 92.221 45.477 133.983 -84.916 90.149 53.348 136.673 34.101 89.383 46.820 125.941 -40.624 89.725 44.520 146.263-152.106 91.897 44.753 0.000 0.000 90.490 44.437 142.542 -21.169 91.712 44.773 133.249 -98.293 89.091 49.931 120.143-125.993 88.132 52.531 105.474 -76.537 89.697 51.407 133.676 -63.977 90.895 39.367 137.901-140.762 97.698-116.389 104.503 -81.892 104.197-173.998 152.228 -15.291 109.512-118.739 90.295 -87.609 93.218 49.254 115.008 -76.110 92.000 44.480 97.235 -19.046 89.821 50.543 126.628 8.257 89.953 46.641 129.035 -76.618 89.130 42.272 101.855 -82.537 89.743 49.668 139.164 -41.245 88.644 50.864 144.010 -45.928 88.652 43.527 128.390 -76.815 87.867 52.933 110.544 -40.217 90.061 45.464 127.251 -76.409 90.744 48.728 141.821-111.431 90.722 54.718 129.211 -41.363 92.511-170.163 129.257 -68.450 96.123 35.832 107.925 -85.008 115.176-171.602 147.371 -19.972 92.901 0.000 129.499 -76.434 # 820 total E -1.50270E+02 rmsd from N 0.000 %NC 0.00 93.173 -68.926 128.162 -79.937 94.208 -48.468 118.433 -79.844 90.820 -46.936 103.368 -77.337 90.293 -49.315 128.295 -75.830 90.648 -38.654 140.241-128.497 93.817 -44.737 64.540 -65.492 90.942 -32.151 122.595 -19.193 105.940 -36.400 167.549 126.870 95.454 -46.882 127.801-120.535 92.290 121.526 81.807 -86.733 104.914-169.773 134.809 -87.250 96.471 70.638 124.846-147.688 114.054 114.883 103.769 -82.985 123.589 -93.330 171.534 -6.973 112.091-125.604 146.004-160.231 96.673 41.249 153.507-154.388 92.133 47.029 136.330 -81.737 90.545 50.919 128.686 -74.188 91.914 49.744 125.422 -70.554 92.764 38.099 140.957-165.946 90.774 48.640 0.000 0.000 90.051 67.119 103.797 -84.426 85.952 47.996 142.729 -81.008 88.981 44.708 115.158-124.944 89.734 53.077 109.121 -74.378 88.772 49.517 142.827 -95.729 91.662 45.654 130.383-149.859 96.208 -95.282 104.393 -83.232 112.178-158.297 153.274 -12.852 138.533 177.818 111.646-102.431 98.507 38.288 115.721 -78.031 92.615 48.905 102.802 -10.148 88.771 57.265 129.179 -17.223 91.123 46.374 126.226 -75.359 90.130 41.519 102.487 -82.493 94.665 79.403 128.858 -39.972 86.428 -92.010 138.173 -72.256 93.252 -75.090 128.693 -77.901 91.815-157.595 115.262 58.048 93.044 -63.822 129.661 -77.245 92.506 -44.557 148.402-179.213 92.787 -45.704 124.488 -17.595 101.881-152.806 156.318 -23.736 118.641 -18.317 139.919-133.650 98.493 47.894 99.603 -78.559 92.432 0.000 129.416 -76.272 # 821 total E -1.51495E+02 rmsd from N 0.000 %NC 0.00 93.217 -80.116 125.548 -70.003 113.423-103.049 140.654 -11.034 94.734 41.900 104.866 -84.236 92.068 54.512 132.190 -77.244 90.526 42.819 138.083-125.351 90.541 42.761 64.983 -78.590 90.684 45.356 119.507 -47.808 90.152 44.592 133.891-101.666 89.204 47.347 131.167-125.587 89.147 51.534 81.645 -99.542 90.655 150.316 132.534 -79.878 93.027 90.711 126.863-151.326 94.886 103.006 100.608 -86.055 92.683 -65.512 142.312-102.339 99.922-121.500 136.747-145.906 92.438 46.369 135.972 114.105 91.192 47.080 134.485 -85.403 90.175 50.101 126.691 -30.849 90.215 48.370 137.868 -14.064 90.802 41.727 152.358 -17.356 90.151 47.743 0.000 0.000 88.688 54.867 120.419 -48.525 87.887 50.171 138.375 -71.967 89.546 42.632 124.531-125.936 91.519 43.532 105.320 -73.045 91.105 50.203 150.138 -45.721 91.080 48.346 129.711 -70.848 90.493 38.944 113.478 -89.419 97.859 142.405 113.114 -80.529 104.842 149.331 132.026-151.460 128.767 -9.888 120.343 -82.552 116.946-110.875 129.756 -25.802 94.256 46.850 129.780 -16.793 92.393 46.774 128.695 -75.729 89.142 46.338 109.921 -83.848 90.820 48.131 138.033 -99.459 89.628 46.132 153.341-179.832 90.235 42.223 127.978 -76.300 91.940 46.821 110.313 -66.496 90.616 45.811 131.742 -77.483 93.609 37.311 140.622-132.922 96.612 91.194 126.554 -43.611 93.346 -60.352 149.986-126.782 97.676 -53.820 98.040 -88.232 91.140 161.435 99.186 -70.840 92.896 0.000 128.200 -77.009 # 822 total E -1.48563E+02 rmsd from N 0.000 %NC 0.00 93.071 168.119 140.490 -99.128 93.586 54.365 135.892 29.802 92.075 46.405 107.333 -81.786 91.731 45.614 130.520 -77.273 93.754 48.733 142.093-123.270 92.603 39.242 56.278 -71.087 92.187 45.989 127.030 -19.371 92.057 41.440 129.778-108.734 91.306 51.642 140.868-137.360 87.693 52.158 78.812-102.321 92.401 151.619 128.703 -76.464 90.957 75.651 129.031-154.087 94.319 109.701 98.111 -82.999 91.972 -63.744 134.142 -51.452 95.330-125.301 147.406 -52.640 90.995 48.790 133.198 122.193 91.427 47.872 137.828 -84.818 90.794 46.154 149.384 -27.765 90.353 47.596 139.700 -21.283 89.783 47.775 142.813-155.465 89.896 45.000 0.000 0.000 89.495 53.114 113.853 -77.272 87.150 47.748 143.400 -84.965 89.032 45.031 120.641-131.598 88.388 51.446 111.799 -75.181 89.794 43.350 142.694-106.786 92.626 52.761 131.457-124.280 94.653 -68.904 104.776 -85.255 124.839 99.377 165.501-157.411 128.657 153.015 110.516-107.281 95.774 47.945 139.479-161.579 93.999 40.024 125.018 -75.041 113.987 108.189 114.856 -76.738 105.304-123.998 157.687 -89.983 98.032 39.292 100.012 -81.058 92.043 53.123 119.144 -10.764 90.646 44.362 143.092 -48.077 91.212 49.843 128.455 -76.863 92.057 76.957 120.311-113.885 88.661 -93.114 128.420 -76.126 92.530 -42.868 144.109-124.393 89.083 -51.821 117.731 9.119 91.013 -52.240 147.495 -32.656 90.861 -45.729 143.196-136.992 96.787 88.892 104.838 -79.602 92.375 0.000 129.073 -76.096 # 823 total E -1.46887E+02 rmsd from N 0.000 %NC 0.00 93.260 169.769 138.366 -93.005 92.970 56.658 142.837 24.558 92.901 44.077 106.125 -83.110 92.321 47.634 130.943 -77.346 93.071 44.536 141.195-117.454 90.997 44.821 60.552 -73.700 90.115 48.178 124.439 -36.277 91.693 42.359 120.473-104.804 89.178 49.721 145.662-165.493 91.355 82.343 81.100-103.652 87.567 -79.728 138.006 -97.204 97.994 -50.847 93.579 -84.706 92.731 -48.726 153.500 -28.440 113.628-131.413 155.993-154.290 106.564-111.502 136.193-126.956 96.073 38.775 161.454 177.967 92.470 46.466 138.911 -89.397 90.097 53.668 141.071-112.851 91.878 49.177 118.992 -51.554 93.654 33.426 146.363-157.340 97.227 36.534 0.000 0.000 94.667 49.535 107.709 -86.354 88.122 46.029 146.823 -87.317 89.711 44.455 114.664-127.279 89.946 48.341 108.709 -76.371 89.254 48.199 138.767 -88.920 93.006 40.713 132.057-128.931 93.924 44.118 142.720-126.934 96.059 36.861 150.858 -26.506 125.571-129.698 111.252-109.922 94.157 -8.122 113.714 -77.487 108.192-155.862 126.339 20.995 97.752 -36.801 111.877 -74.793 91.605 -50.165 126.883 -76.118 89.423 -42.267 105.612 -81.980 88.936 -54.378 120.829 -73.017 86.321 -48.050 141.374-120.379 89.817 -47.048 127.032 -76.071 87.165 -49.596 116.760 -44.509 89.242 -49.451 130.187 -76.751 89.020 -44.995 136.125 150.534 88.642 -51.249 130.819 -32.622 88.866 -53.964 149.733 -22.108 91.253 -44.006 145.797-170.352 96.260 90.181 104.961 -79.808 92.742 0.000 129.079 -76.340 # 824 total E -1.51092E+02 rmsd from N 0.000 %NC 0.00 93.211 170.466 138.035 -91.810 93.272 57.436 152.965 125.402 92.942 43.148 107.906 -80.279 92.776 49.644 131.288 -76.908 92.925 39.992 151.390-150.072 91.787 46.011 73.270-103.300 90.389 45.246 110.625 -78.718 89.321 52.215 136.648 -97.617 88.760 47.456 123.088-117.082 93.188 176.369 86.809 -93.352 116.680 45.622 148.511-149.218 91.860 61.656 100.689-129.875 92.547 67.883 103.301 -85.492 93.494 -98.477 127.837 -88.195 99.713-120.105 139.386-150.338 93.511 46.777 142.893 133.355 92.638 45.764 135.194 -86.123 91.274 45.264 116.949 -47.077 91.905 50.812 105.906 -23.737 89.210 47.363 157.893 -13.615 88.648 49.074 0.000 0.000 89.359 54.721 109.381 -80.710 87.315 45.655 144.961 -69.403 90.329 43.937 121.391-127.709 89.554 51.221 108.795 -76.067 89.075 46.886 135.764 -88.435 92.982 53.857 131.573-126.645 93.351 6.584 108.144 -86.858 118.931 13.558 158.826 -12.047 135.942 47.784 110.567-101.626 142.095 -90.080 125.736 -82.006 92.354 -47.767 106.849 -58.036 92.436 -43.475 113.288 -74.209 91.637 -48.921 128.989 -77.067 90.513 -62.530 102.765 -80.237 85.182 108.625 111.719 3.553 93.229 64.611 135.536 -44.398 91.539 38.819 130.301 -77.819 93.431 115.697 140.305-158.335 93.641 -39.546 128.198 -76.428 95.709 -48.430 141.780-118.824 94.757 -21.544 125.806 -19.352 103.509 -71.750 160.717 -21.977 90.462 -60.958 138.400-120.889 91.242 84.479 102.404 -79.303 92.565 0.000 128.784 -76.828 # 825 total E -1.50556E+02 rmsd from N 0.000 %NC 0.00 117.267 144.523 153.466-109.064 93.733 53.051 135.365 40.469 91.620 47.137 106.277 -79.018 91.748 44.993 131.502 -77.761 94.738 45.320 148.786-130.793 92.912 38.909 51.356 -69.529 91.305 48.871 164.297 13.567 92.218 43.837 133.319 -98.583 89.972 44.907 144.612-151.636 89.474 52.930 77.121-106.638 91.384 148.086 131.402 -82.222 92.432 85.257 125.472-148.910 97.741 104.933 99.891 -85.456 91.806 -62.834 152.882-111.034 98.977-122.307 137.793-155.504 91.377 48.288 138.888 116.556 91.333 47.365 135.151 -85.604 90.692 46.670 126.596 -57.591 90.645 48.257 141.386 -22.669 90.592 44.695 151.960 -22.374 90.038 46.125 0.000 0.000 89.002 55.700 109.187 -82.691 87.436 47.199 140.032 -81.663 89.579 43.906 121.297-126.644 88.956 52.304 110.959 -76.865 89.341 47.578 140.013-101.037 92.614 52.016 131.962-110.539 95.300 -53.600 155.919 -24.155 127.368-148.269 114.364 -74.909 132.404 175.865 117.725-113.920 126.755 55.424 121.017 -82.123 94.076 -54.822 112.742 -58.804 94.339 -39.239 109.775 -72.938 92.380 -45.734 127.894 -75.702 89.812 -44.885 104.719 -91.854 88.109 -56.795 100.628 -64.442 86.834 -40.270 143.365 -17.241 93.529 -65.504 122.328 -72.666 80.827 119.767 113.032-131.950 93.615 41.179 129.510 -77.608 92.520 43.860 138.347-134.027 92.484 59.727 132.123 -51.567 90.743-121.271 131.057-123.509 97.905 -8.351 109.140 -86.360 112.434-173.849 107.150 -76.073 92.819 0.000 129.564 -76.288 # 826 total E -1.50421E+02 rmsd from N 0.000 %NC 0.00 122.628 -92.067 150.458 -69.222 95.027 -50.279 115.816 -77.565 91.539 -44.292 103.591 -77.124 90.749 -48.680 128.374 -76.055 89.258 -42.914 135.339-128.084 91.605 -46.390 62.430 -64.200 93.260 -30.771 130.026 -30.833 102.185 -38.231 169.865-122.525 94.043 -46.102 135.664-118.686 95.594 132.779 97.064 -95.228 139.743 162.159 156.394-113.948 94.929 65.834 125.726-149.140 93.904 42.199 99.462 -77.756 92.358 54.841 143.396 -25.230 90.811 40.798 138.665-133.117 92.985 47.908 124.450-122.316 93.909 38.691 130.349 -84.715 97.678-106.420 161.415-171.639 117.002 -89.295 86.009 -96.219 90.069 90.891 150.032 -22.798 90.859 62.164 0.000 0.000 90.467 50.647 112.082 -75.089 88.615 44.006 149.707 -80.927 89.621 49.467 117.930-127.947 88.620 53.461 107.877 -77.788 88.362 52.277 140.531 -93.044 90.767 43.234 127.231-133.387 96.240-101.778 104.373 -82.656 112.662-171.520 151.818 -15.998 136.360-154.757 109.051-100.222 95.909 42.642 114.676 -77.538 91.852 48.709 100.739 -7.490 89.371 52.252 126.854 13.115 89.861 45.740 129.303 -77.319 88.999 44.482 104.754 -83.692 88.397 60.910 116.652 -9.140 85.666 58.514 141.454 -47.934 87.170 48.150 128.009 -76.520 86.927 55.643 115.187 -21.313 88.339 50.237 127.616 -75.391 88.827 46.307 132.902 -94.681 89.349 55.508 130.387 -39.960 88.871 54.175 135.903 -52.959 90.126 44.568 140.464-123.784 94.556 80.121 104.056 -80.880 92.564 0.000 128.981 -76.810 # 827 total E -1.49223E+02 rmsd from N 0.000 %NC 0.00 92.976 147.693 139.810 -92.289 92.873 55.445 152.267 107.503 92.063 45.271 107.674 -81.442 92.727 50.607 130.688 -76.686 92.752 40.643 155.584-155.618 91.080 44.979 72.308-100.926 91.542 43.883 110.973 -73.713 90.873 47.394 140.806 -94.786 88.971 51.924 143.493-171.896 91.196 176.828 83.469 -94.744 110.062 55.520 143.770-146.066 93.228 57.283 94.998-121.166 92.318 60.341 104.863 -84.779 95.136-113.759 126.103 -85.970 103.898-113.428 140.776-154.234 93.073 50.505 140.411 150.782 91.786 46.485 135.485 -86.108 89.942 51.331 123.352 -60.569 90.238 52.312 119.123 -33.987 90.279 44.052 146.758-149.513 90.825 44.502 0.000 0.000 90.061 57.150 109.948 -83.873 87.923 48.808 140.946 -77.633 90.749 41.243 120.248-125.878 90.577 51.352 111.502 -77.102 90.222 67.865 132.073 -94.277 90.238 63.814 138.027-142.014 91.848 -4.423 107.277 -86.830 122.215 122.022 149.475 -16.584 135.291 -65.890 110.345-101.182 101.620 -29.629 112.326 -77.736 98.437-152.570 120.629-124.674 108.887 27.276 116.519 -75.649 92.553 49.376 129.689 -76.267 98.109 19.800 107.137 -86.100 105.483 34.727 143.095 -22.294 98.385 31.454 131.806 -80.007 97.149 41.886 129.827 -77.488 96.517 111.482 85.077 -93.169 92.835-131.612 136.107-103.638 90.993 49.897 143.283-125.845 91.244 50.426 133.960 -95.809 90.382 56.926 148.876 -31.922 88.074 45.702 139.785-151.458 93.760 77.408 99.197 -78.698 92.496 0.000 128.988 -76.489 # 828 total E -1.47094E+02 rmsd from N 0.000 %NC 0.00 93.150 -62.353 130.020 -87.067 94.620 -45.572 116.789 -81.786 90.218 -48.694 103.018 -76.942 90.165 -47.545 129.841 -76.230 91.827 -40.621 140.016-128.443 93.958 -41.657 61.293 -64.531 91.958 -40.036 131.748 7.130 102.392 -35.050 168.593 151.403 93.989 -57.576 128.037-121.295 95.140-151.775 77.601 -81.259 109.335 72.220 155.226-139.157 97.046 45.712 92.131-120.385 93.878 48.104 111.216 -82.891 104.419 167.798 131.240 -83.968 127.922 -23.063 147.335 164.132 98.915 45.038 150.691 164.547 93.453 42.112 132.157 -85.461 90.896 66.615 142.199 78.625 89.454 44.156 137.928-135.010 90.466 45.216 136.351 166.293 87.461 63.167 0.000 0.000 87.370 53.519 103.706 -82.563 89.089 43.074 144.365 -74.182 92.115 43.166 120.637-125.224 89.840 51.962 110.458 -75.589 90.003 62.924 130.449 -92.053 89.609 45.286 136.743-140.534 92.470 35.385 108.503 -86.353 113.883 17.964 150.420 -26.788 138.201 -89.637 107.113 -92.893 127.778 4.420 119.556 -81.298 93.924 -56.718 112.398 -53.722 96.487 -36.707 119.552 -74.715 91.748 -50.324 129.327 -76.798 90.813 -59.346 99.289 -83.215 87.458 111.858 113.654 9.386 93.733 70.270 144.671 -37.595 91.726 35.832 130.345 -77.301 96.469 113.898 143.549-155.139 137.192 -93.708 132.999 -85.039 91.324 54.428 141.086-108.144 92.079 42.933 123.572 -55.235 91.545 56.742 147.687 -96.473 88.431 39.666 131.977-149.326 96.001 88.140 102.986 -79.373 92.418 0.000 129.082 -76.130 # 829 total E -1.47460E+02 rmsd from N 0.000 %NC 0.00 117.526 141.964 152.037 -73.028 93.437 62.858 133.009 54.835 93.792 39.736 106.377 -82.059 92.039 48.085 130.801 -77.374 89.987 51.018 152.912-169.246 88.334 53.074 71.528 -68.086 91.150 36.827 109.424 -55.074 92.008 47.611 143.764 -82.466 95.623 34.888 114.055-100.523 98.597 122.359 107.365 -92.604 129.533-161.939 160.231-151.436 95.917 65.078 121.852-143.163 95.062 50.262 105.072 -85.390 96.359-108.777 148.330 -96.646 102.874-114.207 138.625-148.739 93.992 45.084 138.237 155.049 92.173 46.372 134.743 -85.772 89.731 53.703 119.543 -18.939 89.716 52.877 116.401 -38.323 89.500 42.228 153.104 -18.717 89.987 48.823 0.000 0.000 88.557 55.727 129.443 -37.026 88.273 49.857 138.916 -82.940 89.274 43.659 123.677-130.168 89.133 50.849 106.480 -72.964 90.342 51.145 134.508 -46.656 90.643 42.311 138.425-138.638 93.410 41.646 151.764 -21.651 98.238 134.918 111.631 -79.622 122.611 164.127 128.661-136.292 94.737 -14.159 113.953 -77.564 99.218-137.938 135.386 -9.531 93.250 48.948 138.126 -22.142 91.654 52.516 130.513 -77.039 89.769 44.879 108.315 -80.838 90.904 44.116 128.733 -86.968 90.435 57.331 138.324 -89.892 89.589 54.245 128.598 -77.416 89.238 174.712 89.823 -94.761 92.761 60.431 132.594 -78.015 90.800 51.044 141.176-105.839 91.846 50.670 120.799 -25.382 94.391-112.720 133.886 -81.673 97.847 -24.271 101.532 -86.348 116.693-147.657 108.391 -77.707 92.911 0.000 129.562 -76.011 # 830 total E -1.47207E+02 rmsd from N 0.000 %NC 0.00 92.784 -31.505 128.803 -87.172 94.692 -49.824 113.624 -76.350 91.839 -44.031 103.570 -77.866 90.760 -47.571 128.282 -75.755 91.104 -41.230 137.720-122.890 92.895 -41.009 60.279 -64.438 94.646 -38.837 129.649 43.788 98.726 -40.169 170.513-174.547 92.324 -52.027 130.471-113.942 90.619 -71.381 79.851 -80.282 104.104-168.745 142.697 161.482 102.307 -41.623 93.848-104.960 100.442 136.153 104.307 -81.368 105.387-118.381 156.259-110.198 101.545-115.099 140.544-152.158 93.282 44.852 146.943 131.404 92.773 46.441 135.210 -84.923 92.208 42.982 120.387 -48.273 92.545 47.130 106.018 -20.861 89.464 46.970 152.134 -29.673 89.477 50.507 0.000 0.000 91.539 43.054 107.825 -80.757 91.816 40.928 150.270 -77.598 93.368 42.837 123.206-130.693 89.932 49.874 112.876 -78.338 90.064 47.877 128.898 -95.903 93.299 52.110 135.165-139.289 96.788 -14.175 156.203 -20.725 130.971 110.287 115.556 -78.319 134.786 -61.214 110.786-103.391 103.400 -33.778 112.970 -78.632 94.620-143.370 130.169 -12.093 95.051 55.022 137.386 -30.119 90.968 52.433 129.821 -75.799 90.198 42.000 105.419 -79.632 92.480 42.632 129.802 -76.664 90.094 52.850 141.858 -88.487 90.137 54.054 128.141 -77.358 92.749-177.655 84.794 -72.741 91.215 76.364 131.547 -77.214 92.616 44.313 141.807-121.633 94.934 82.770 123.798 -21.924 93.308 -67.046 152.489 -98.604 99.605 -51.831 100.368 -87.588 94.159 127.204 98.157 -73.564 92.591 0.000 128.489 -76.232 # 831 total E -1.51463E+02 rmsd from N 0.000 %NC 0.00 93.195 168.731 137.128 -88.641 93.316 58.207 152.371 119.956 93.224 42.557 107.985 -80.785 93.016 49.693 131.565 -77.151 93.167 40.152 154.034-150.546 91.383 45.540 71.680-100.633 90.687 46.213 112.136 -74.779 90.699 46.956 136.053 -99.319 89.048 54.516 145.619-168.155 89.016 173.382 84.318 -97.645 109.432 53.210 141.563-144.966 91.813 56.241 97.633-126.625 92.462 59.266 103.375 -84.792 94.556-113.436 128.529 -82.928 104.026-114.875 140.259-152.643 92.636 50.690 140.382 151.087 91.866 46.143 135.299 -85.896 89.942 50.758 124.137 -55.023 89.990 52.395 120.159 -33.759 90.001 45.386 148.178-150.341 90.734 43.336 0.000 0.000 90.226 55.385 110.316 -81.423 87.936 48.924 142.903 -75.622 90.125 41.914 120.792-127.848 90.229 49.296 109.815 -76.423 90.214 49.791 135.950 -90.325 91.758 55.315 135.603-122.142 91.704 9.561 111.018 -92.047 117.365 11.055 163.714-141.148 135.836 69.019 114.015-107.768 157.509-178.878 136.783 -90.178 92.598 56.579 105.098 -13.361 92.022 45.797 124.114 -17.187 90.385 50.435 131.142 -77.354 87.829 47.416 100.780 -83.925 88.142 52.931 113.186 -35.014 90.930 45.611 131.079 -47.428 90.743 41.299 129.315 -76.628 93.102 67.053 108.424-100.546 92.233-111.598 128.214 -75.840 97.151 -27.205 142.304-130.441 93.811 -55.213 129.681 -51.646 91.733 -51.250 154.204 -33.197 91.922 -44.401 141.287-156.574 97.649 164.568 105.116 -79.066 92.639 0.000 129.137 -75.995 # 832 total E -1.48367E+02 rmsd from N 0.000 %NC 0.00 93.177 170.004 137.636 -90.260 93.126 58.400 146.756 19.481 93.601 43.097 106.286 -82.804 92.405 47.391 131.260 -77.087 93.829 45.496 140.574-110.605 90.601 42.202 61.757 -77.340 91.261 44.572 121.867 -44.675 93.355 40.354 127.420-100.722 91.264 47.072 142.275-131.434 88.892 50.548 81.529-103.043 92.835 154.017 128.993 -82.625 91.409 89.011 127.816-153.292 95.918 102.302 97.954 -82.987 93.737 -67.269 136.157 -89.888 98.351-121.823 135.209-144.875 91.418 50.066 134.995 125.987 91.545 47.180 134.772 -85.677 90.572 47.586 135.618 -40.962 90.788 47.533 134.512 -21.604 89.794 46.193 143.667-156.117 89.636 47.627 0.000 0.000 89.073 56.003 116.857 -74.964 87.417 44.611 142.516 -86.175 89.015 46.700 119.329-129.584 87.760 58.625 108.573 -75.543 89.102 44.614 147.410-100.776 93.355 41.886 131.731-135.902 98.842 -11.244 145.501-135.239 124.313-163.383 110.173 -79.118 127.364 57.926 121.466-124.042 98.276 50.095 115.819 -78.567 95.012 39.094 111.148 -9.722 95.033 44.315 119.168 -75.638 89.891 48.879 132.654 -78.801 86.416 53.815 102.488 -84.712 87.205 53.314 109.405 -46.526 88.316 52.280 135.029 -42.569 90.009 33.034 128.185 -76.152 96.541 121.322 103.697 -93.489 92.265 -43.962 131.976 -79.036 94.245 -56.353 136.057-106.574 90.565 156.486 135.736 -52.723 117.066 93.864 153.707 -30.101 93.780 62.264 146.731-171.626 94.036 115.376 99.301 -79.437 92.530 0.000 128.922 -76.296 # 833 total E -1.47278E+02 rmsd from N 0.000 %NC 0.00 93.110 -70.451 127.735 -72.995 126.016 -97.433 132.280 -35.872 95.315 38.868 110.561 -78.922 93.488 48.579 131.683 -77.306 94.952 37.199 149.944-133.988 93.149 44.094 65.164 -94.785 89.775 43.700 109.235 -57.548 90.605 50.250 134.243 -85.721 89.992 38.281 123.064-111.961 92.781 43.417 94.248-100.332 94.535 53.941 131.556 -97.822 100.049 -73.852 102.226-101.697 120.139-152.362 106.150 -88.455 135.663 129.509 154.759 171.627 112.121 -99.182 144.558-164.641 95.846 44.474 149.137 153.795 92.123 45.777 136.198 -85.196 90.248 53.010 118.822 -69.393 90.407 50.649 134.096 -43.202 90.153 42.168 143.136-166.283 90.987 44.403 0.000 0.000 91.008 51.668 107.569 -84.030 87.855 47.264 147.773 -80.925 90.263 42.629 119.138-131.744 89.430 49.856 114.561 -76.356 89.560 48.273 137.752-107.345 91.038 50.625 135.258-153.227 91.617-100.148 102.640 -82.755 117.466-169.963 154.970 -6.625 124.146-141.044 117.324-120.312 92.294 58.871 113.990 -76.296 92.051 46.870 96.390 -47.509 92.747 44.740 115.747 -47.175 91.848 44.814 130.229 -77.140 90.666 55.790 103.611 -85.128 90.325 35.581 121.852 -78.347 99.970-127.503 120.472 -71.335 91.701 -44.736 129.061 -76.153 120.843-165.208 125.285 58.323 93.304 -50.044 127.881 -75.105 92.175 -40.918 144.545-123.091 92.050 -46.492 129.845 -29.028 91.659 -48.220 156.093 -28.535 92.773 -42.414 140.799-153.254 95.448 107.041 104.224 -79.808 92.528 0.000 129.028 -76.490 # 834 total E -1.46698E+02 rmsd from N 0.000 %NC 0.00 93.294 -68.961 131.077 -89.761 94.734 -44.168 123.299 -72.098 90.402 -50.425 103.578 -78.494 90.657 -46.465 126.408 -74.178 91.000 -45.488 157.850-168.094 95.798 -33.868 96.506 -98.899 98.258 102.289 97.900 -68.872 131.052 66.016 137.284 -77.775 89.237 46.875 149.174-104.696 99.638 120.531 78.927-105.042 105.706-109.536 164.184-120.818 92.814 58.127 98.352-106.118 91.888 45.947 105.186 -84.365 91.219 54.367 131.744 -88.543 88.992 42.615 129.237-124.732 93.154 56.916 126.314-113.399 95.918 -65.565 120.974 -74.384 125.611-164.347 149.290 -66.779 104.312 39.889 164.792 95.271 94.722 49.522 143.309-162.473 94.682 37.489 0.000 0.000 92.082 50.439 114.650 -80.982 89.383 46.855 140.873 -84.986 90.207 44.490 119.492-125.737 89.349 48.268 114.025 -77.299 90.704 48.410 138.817-105.925 92.060 48.521 133.317-146.218 93.121-104.145 141.345-121.465 112.842-171.758 156.936-145.115 123.333 -44.566 109.043-108.753 96.837 -36.561 110.218 -78.457 92.843 -44.625 110.027 -49.967 90.705 -47.893 108.747 -69.970 90.804 -43.491 128.664 -76.930 90.735 -41.855 100.215 -80.770 88.693 -53.376 110.681 -37.587 90.070 -43.873 155.723 -9.769 93.305 -59.002 129.502 -77.013 109.994-122.264 141.510 1.947 91.117 55.227 129.885 -75.175 91.062 45.390 142.173-110.368 90.592 45.046 126.893 -36.786 91.031 54.460 138.330 -87.985 89.639 43.800 133.705-141.330 94.795 85.905 103.605 -80.181 92.575 0.000 128.853 -76.697 # 835 total E -1.47796E+02 rmsd from N 0.000 %NC 0.00 93.186 -71.137 130.600 -87.942 94.623 -46.837 130.159 -92.079 90.893 -50.635 101.554 -79.908 89.860 -45.654 127.323 -74.538 91.887 -46.216 150.013-166.699 92.802 -39.738 109.051-139.942 92.028 134.866 102.570 -74.369 115.942 55.420 164.418-154.421 86.771 47.494 136.204-155.259 92.176 46.796 63.490 -92.848 93.904 101.508 149.169 -32.639 88.290 90.188 137.566-165.904 89.975-149.075 100.248 -86.520 149.722-159.120 163.931-171.605 101.073-114.475 151.616 -33.034 93.711 49.273 140.525 122.535 91.367 48.127 136.936 -83.124 90.686 48.996 121.826 -60.477 90.638 48.574 113.283 -19.340 89.461 45.466 139.639-113.069 91.213 48.621 0.000 0.000 93.530 38.464 108.903 -81.747 95.435 40.093 174.597-176.455 94.195 40.426 104.565-133.762 90.480 53.080 114.950 -79.498 90.047 58.211 145.547-121.982 89.953 37.312 142.760-152.618 94.554 46.310 113.605 -89.275 98.227 -0.475 140.800 -93.063 130.606-165.326 115.825-114.177 115.298 22.281 118.199 -80.047 91.779 54.525 106.954 -13.267 89.567 50.115 111.019 -82.827 89.853 64.242 129.019 -75.419 82.948 53.906 105.237 -85.360 88.693 46.350 101.087 -69.198 89.913 49.774 135.310 -41.599 89.938 46.709 129.638 -76.945 90.634 119.552 101.205-101.455 91.081 -46.807 129.780 -78.143 92.537 -46.146 144.204-126.391 89.067 -47.399 125.126 -6.924 91.164 -56.467 157.907 -23.471 89.531 -45.672 132.482-126.920 95.357 88.226 102.844 -79.576 92.562 0.000 128.952 -76.517 # 836 total E -1.49139E+02 rmsd from N 0.000 %NC 0.00 93.013 147.834 141.601 -98.527 93.185 51.480 155.459 48.061 91.272 49.191 106.858 -80.330 90.440 51.041 129.307 -75.539 92.520 39.058 148.261-128.891 94.231 45.911 126.462 161.781 91.962 56.486 110.175 -65.734 94.097-106.392 120.565 -88.005 92.660 -55.780 86.860 -40.125 92.968 -40.160 156.339 -2.430 97.722 -43.924 162.518-145.526 99.860 -48.981 96.504-109.157 104.480-152.502 104.908 -85.548 105.410 -49.137 142.802-138.932 99.250-118.982 152.618 -28.222 94.437 43.784 150.917 141.242 92.518 46.955 137.710 -83.012 90.449 47.687 120.921 -65.617 92.207 53.968 130.432 -41.140 91.357 40.003 144.535-158.185 90.873 44.416 0.000 0.000 91.037 57.054 104.214 -85.453 87.266 48.242 144.191 -79.282 89.181 43.121 118.589-128.375 89.784 50.586 111.599 -77.476 89.872 48.727 140.345-103.321 91.345 48.224 134.396-147.114 93.564-100.007 103.983 -83.025 111.994 165.057 150.831 -16.414 105.014-168.225 90.283 -91.362 94.398 54.236 129.645 36.911 92.877 45.917 115.749 -49.495 91.023 46.129 133.330 -41.326 92.163 45.303 128.345 -75.853 91.757 45.325 107.103 -85.025 91.657 42.102 123.971 -85.024 91.329 51.626 127.620 -86.523 89.613 47.516 129.789 -77.628 88.764 88.964 99.098-102.637 93.077 -1.347 128.457 -77.005 100.165 -90.476 136.298-135.660 90.396 -52.284 124.646 -12.646 90.715 -54.387 150.301 -33.369 91.533 -45.301 144.921-137.813 96.327 83.581 104.508 -79.955 92.476 0.000 128.828 -76.355 # 837 total E -1.50222E+02 rmsd from N 0.000 %NC 0.00 93.216 -69.824 130.210 -86.729 94.403 -46.349 120.729 -83.170 90.242 -49.357 103.313 -77.015 89.548 -52.384 128.144 -75.585 91.414 -35.525 137.944-132.996 92.619 -49.393 64.791 -61.390 89.701 -29.698 131.337 -10.442 104.698 -56.652 166.920 161.590 91.858 -16.460 142.615-103.342 110.915 101.258 85.859 -92.478 121.431-169.097 145.814 -82.428 98.610 67.771 125.954-147.957 113.624 132.796 106.028 -80.757 127.503-115.253 166.876 -5.832 110.946-113.073 144.446-146.920 94.358 44.848 148.837 148.140 91.978 45.846 135.290 -85.663 90.347 51.186 153.959 -65.340 90.047 48.997 137.454 -42.176 89.367 43.826 143.958-146.145 90.080 48.244 0.000 0.000 89.673 50.720 151.513-151.382 90.137 41.221 131.905-101.958 91.030 43.950 118.502-123.832 89.706 54.466 114.839 -77.529 89.080 51.816 139.883-106.737 89.626 37.688 126.021-156.074 96.990 -97.750 106.260 -84.288 122.177-155.106 165.120-159.492 119.958 -67.976 112.507-114.096 95.588 -22.376 113.257 -77.564 101.976-143.355 79.806 -52.715 92.268 44.753 116.255 -74.520 93.290 46.045 151.862 -82.338 96.929 39.250 142.889-176.485 93.286 37.731 140.316 -40.597 94.619 55.799 115.739 -91.038 93.342 82.250 129.959 -78.226 89.963-169.962 112.400-130.273 92.377 49.677 131.826 -77.741 91.321 45.401 140.600-104.075 89.603 52.834 131.894 -25.284 89.849 59.597 135.775-118.097 87.556 38.268 128.868-167.394 95.523 82.756 103.420 -79.803 92.501 0.000 128.842 -76.607 # 838 total E -1.51781E+02 rmsd from N 0.000 %NC 0.00 93.028 161.585 139.867 -93.413 93.028 55.424 147.425 61.988 92.070 44.858 106.305 -81.915 92.174 51.264 130.658 -77.200 93.856 43.533 154.640-150.623 93.365 41.995 66.451 -89.547 90.862 45.780 118.243 -63.643 89.381 63.966 134.764-105.672 88.254 59.150 119.135-115.160 87.601 168.403 90.104 -96.136 127.059 57.099 160.677-156.187 94.075 43.814 97.728-120.795 93.125 44.590 100.266 -80.593 94.387 101.434 140.048 -46.558 94.622 40.602 143.347-148.719 92.898 40.320 131.486-101.765 92.818 48.871 138.869 -41.499 93.653 40.546 105.909 -41.992 96.976 28.625 155.065-167.340 104.347 24.519 108.284 -81.906 102.525 32.912 0.000 0.000 100.196 29.086 133.818-106.160 98.876 37.900 143.366-115.518 95.196 37.315 115.859-128.687 91.943 48.139 111.918 -75.990 89.381 58.158 134.184 -91.795 90.509 42.795 137.229-134.098 92.511 40.788 143.023-129.359 99.105 3.367 113.957 -88.488 138.600-162.922 101.956 -85.576 94.615 50.846 115.119 -76.809 92.859 48.234 105.580 -13.862 90.847 45.171 126.279 -2.008 91.378 49.517 130.182 -76.038 89.267 39.854 102.918 -85.146 93.178 41.713 121.855 -34.559 93.035 43.217 139.998 -47.615 92.080 42.264 130.772 -78.598 92.301 119.690 104.616 -88.103 91.726 -45.348 130.142 -78.393 93.816 -44.388 144.274-131.401 91.171 -41.307 127.010 -20.416 92.366 -61.077 157.683 -23.963 89.470 -43.211 137.087-152.042 96.449 70.656 101.333 -79.891 92.465 0.000 129.199 -76.468 # 839 total E -1.50973E+02 rmsd from N 0.000 %NC 0.00 93.144 -66.727 128.167 -80.027 94.383 -47.906 116.642 -78.218 90.758 -47.001 103.395 -76.984 90.400 -47.745 128.990 -76.207 91.011 -40.238 141.011-126.520 94.250 -42.471 61.855 -70.450 91.858 -36.803 127.277 -8.517 108.180 -23.704 168.537 145.742 97.705 -35.609 139.197-130.646 117.549-113.303 90.493 -98.531 104.416 68.373 153.051 -90.632 95.663 32.743 94.766-107.010 94.247 52.439 115.395 -80.130 97.499 16.478 132.595 -99.127 105.365 50.391 140.467-158.157 95.531 60.790 121.226-124.736 97.862 -74.664 139.309 -82.988 119.557-118.621 130.080 -51.848 94.842 42.279 157.718 -98.469 93.379 45.462 138.198-177.179 88.492 49.296 0.000 0.000 91.194 51.266 103.437 -85.146 88.027 42.793 147.555 -76.504 90.809 44.327 117.799-127.400 90.227 49.510 107.591 -75.410 89.454 47.752 134.670 -82.026 93.030 38.399 134.876-141.142 95.218 45.273 144.062-131.660 97.204 26.613 117.563 -89.838 134.825-172.382 109.019 -99.652 94.911 44.642 114.793 -77.274 91.651 49.750 100.705 -10.391 88.736 52.471 128.704 -5.429 91.570 45.370 129.280 -77.721 89.755 41.690 102.961 -83.180 90.290 75.540 121.619 -27.167 87.505 57.229 135.206 -48.516 88.537 41.941 128.050 -76.058 92.555 79.395 124.042-123.208 87.043 -89.979 129.934 -76.893 92.050 -52.615 145.257-136.420 89.671 -47.040 125.010 2.702 91.437 -55.084 140.453 -40.460 91.254 -21.837 144.350-132.641 108.520 108.018 101.116 -77.905 92.548 0.000 129.617 -76.463 # 840 total E -1.51733E+02 rmsd from N 0.000 %NC 0.00 93.093 155.939 140.461 -96.275 92.719 53.272 136.744 53.429 91.052 47.209 106.512 -82.323 91.746 45.875 130.345 -77.168 95.239 42.645 153.980-146.729 94.134 41.054 54.140 -72.662 89.883 48.235 123.123 -31.697 88.954 56.477 133.584-103.551 87.401 43.336 125.275-117.661 90.287 43.658 82.345 -95.107 92.087 58.388 140.075 -80.611 94.556 39.137 98.880-103.703 91.869 49.105 112.519 -88.298 94.858 29.003 123.661 -98.151 131.380-175.225 106.970 -87.605 95.339 46.321 148.456-129.965 91.615 50.748 134.809 -81.707 89.147 68.337 153.566 -51.874 89.851 50.698 134.480 -93.527 90.028 41.687 106.975 -83.111 89.866 55.986 0.000 0.000 91.975 44.612 99.886 -84.285 89.459 46.850 153.526 -71.513 90.158 45.695 116.586-132.445 90.669 46.809 107.898 -76.123 90.626 46.060 141.781 -85.397 93.459 42.821 138.369-147.784 93.891 41.724 143.377-130.740 97.349 36.796 114.847 -88.177 138.615-179.308 106.973 -93.795 94.874 42.282 115.289 -77.450 91.330 53.490 106.153 -11.282 87.838 56.926 126.011 1.220 90.772 43.870 128.643 -76.922 90.289 42.216 103.577 -82.655 90.164 63.034 135.138 -32.465 87.620 55.770 133.619 -51.989 88.212 40.402 128.237 -76.106 92.055 80.089 119.842-116.075 87.355 -88.078 129.297 -77.320 92.701 -53.038 142.974-127.637 89.034 -51.479 121.427 -0.083 90.569 -52.762 140.785 -36.912 91.975 -31.341 138.063-107.808 101.083 76.390 98.024 -77.844 92.386 0.000 129.416 -75.869 # 841 total E -1.49831E+02 rmsd from N 0.000 %NC 0.00 93.055 158.394 139.244 -92.225 93.325 56.110 137.225 52.783 91.954 43.886 106.854 -82.742 91.781 49.351 130.226 -76.687 92.942 43.865 155.717-155.782 93.530 41.658 60.729 -74.352 90.825 46.445 123.150 -41.071 88.229 64.841 135.475-103.509 88.047 66.720 127.961-121.773 83.282 169.064 88.410 -99.219 116.569 52.137 150.463-155.082 90.099 49.907 104.285-139.672 94.367 43.321 97.346 -82.012 93.680 108.286 136.218 -57.430 95.188 45.209 134.255-156.990 94.061 50.632 135.332-114.514 97.032 3.979 141.264 -97.127 119.783 162.518 149.557-130.056 118.510 16.726 151.927 12.691 92.602 57.084 143.222 165.912 87.730 53.816 0.000 0.000 92.230 42.435 100.957 -83.333 92.047 44.112 147.502 -71.376 93.198 41.940 116.878-124.575 90.906 48.727 115.295 -78.998 91.703 50.813 129.506-102.986 91.317 59.431 136.248-162.821 92.086 -6.076 140.613-126.589 131.314 85.666 126.109 -86.201 127.280-173.707 114.437-111.318 95.918 45.054 115.004 -77.370 90.936 48.815 95.036 -22.332 89.908 53.677 121.712 6.788 89.767 46.550 129.296 -76.932 90.484 42.535 103.080 -83.938 90.189 50.911 121.440 -18.622 89.412 48.216 134.553 -54.547 89.910 45.724 128.108 -76.330 92.076 74.709 118.716-110.095 88.194 -93.468 129.201 -76.798 93.415 -42.898 144.723-131.544 88.719 -52.964 117.041 0.255 90.868 -53.124 146.928 -27.946 91.161 -37.572 144.429-145.895 99.994 103.158 102.881 -78.571 92.414 0.000 129.258 -75.942 # 842 total E -1.49142E+02 rmsd from N 0.000 %NC 0.00 93.214 -69.672 126.358 -74.177 94.025 -48.869 116.664 -78.480 90.917 -46.484 103.610 -78.334 90.473 -48.709 127.402 -74.988 90.108 -40.578 138.176-119.443 93.222 -43.962 60.858 -54.239 89.875 -40.359 134.366 54.898 95.817 -46.380 160.122-163.100 89.704 -54.775 142.703-106.448 89.560 107.078 90.663 -90.801 110.600 154.180 137.311 -94.928 94.223 90.159 128.683-154.728 92.038 96.998 100.488 -86.514 93.122 -78.196 136.189-100.877 107.373-118.163 139.846-153.649 92.864 46.550 139.811-127.168 91.455 48.826 135.805 -78.172 89.895 50.925 129.882 -57.699 91.146 46.523 111.295 -79.379 91.797 43.365 137.746-173.998 89.245 50.880 0.000 0.000 89.220 59.886 103.009 -82.485 86.562 46.456 142.488 -75.977 89.138 46.407 118.906-126.116 88.883 53.663 108.957 -76.324 88.954 49.136 140.662 -96.145 91.206 46.987 127.927-144.911 95.589 -91.128 103.707 -82.932 119.632 165.854 152.060 -14.837 133.765-170.485 109.103-102.540 98.024 46.876 116.379 -78.198 93.630 44.292 106.555 -19.412 91.196 47.939 123.334 -26.331 91.064 50.043 129.916 -77.011 89.245 51.301 101.339 -83.820 91.010 52.622 124.613 -58.253 97.684-100.867 130.271 -75.069 99.463 -42.515 127.893 -76.723 106.581-127.625 126.472 39.082 92.849 -60.792 127.946 -75.927 91.814 -38.564 140.720-152.190 90.736 -49.111 126.546 -19.727 91.243 -53.271 151.659 -24.679 91.070 -44.396 141.836-164.254 96.278 92.685 104.633 -79.660 92.510 0.000 129.024 -76.305 # 843 total E -1.48601E+02 rmsd from N 0.000 %NC 0.00 92.553 141.579 122.872 -45.326 93.352 70.414 138.238 53.702 94.391 42.869 107.497 -77.766 92.610 42.077 132.677 -77.562 95.345 41.184 152.910-164.502 96.431 39.713 44.617 -64.867 89.979 47.607 166.966 16.601 88.460 56.526 141.087 -88.574 89.545 34.474 128.433-115.069 94.362 50.109 85.741 -97.721 96.066 -11.802 137.246 -80.696 120.634-118.702 84.652 -70.266 100.081-108.151 109.795 -79.392 113.962 129.085 162.836-146.257 113.834-107.818 142.324-163.221 93.738 49.106 136.590-107.563 92.824 45.577 135.511 -74.732 91.468 48.024 137.989 21.295 90.725 45.059 163.241 100.566 92.372 44.312 144.012-147.847 92.967 42.384 0.000 0.000 90.113 50.416 145.570 -12.496 89.886 47.392 130.760-105.316 91.018 50.001 120.806-130.079 87.209 64.739 111.749 -73.344 89.050 53.379 121.419 -70.220 90.214 55.320 142.136-128.655 94.968 -51.819 105.643 -85.252 134.860 128.402 153.985 -13.370 129.044-163.017 115.303-113.904 109.616 32.337 117.435 -79.251 91.375 51.874 100.393 -6.958 89.728 50.693 129.416 -43.979 92.572 45.655 127.668 -75.616 93.425 35.503 103.780 -81.559 93.036 50.770 152.780 -24.936 89.427 52.566 160.546-177.722 89.873 39.407 128.606 -77.071 90.234 49.706 113.959 -36.237 89.787 56.315 130.623 -77.842 88.355 46.783 143.712-136.499 91.316 77.039 132.186 -48.232 88.849 -82.224 135.854 -61.234 97.963 -45.764 109.411 -83.139 107.724-146.001 144.891 -11.189 93.053 0.000 129.105 -76.823 # 844 total E -1.54342E+02 rmsd from N 0.000 %NC 0.00 93.119 -78.181 118.436 -51.641 125.451-101.510 121.576 -50.287 94.581 40.681 107.972 -80.177 93.796 45.230 129.927 -76.970 94.750 44.967 157.868 173.232 93.776 38.237 58.779 -79.549 94.667 39.381 125.938 -38.721 95.809 34.791 134.042-102.567 94.356 57.438 138.547 140.539 88.627 77.841 99.100-139.767 90.901 -76.292 117.506-121.648 100.290 -53.529 91.315 -99.440 91.686 -61.660 106.764 -76.148 115.448-141.435 161.710 -15.959 105.209-108.901 147.367-135.824 92.992 46.224 139.245 155.704 91.790 46.579 135.520 -87.097 90.621 48.683 132.815 -88.338 91.860 44.389 112.624 -37.016 95.285 35.863 107.489 -82.307 100.852 29.417 0.000 0.000 96.696 48.076 115.855 -80.635 88.499 44.337 147.760 -89.537 90.355 44.888 113.149-126.436 89.830 47.702 107.802 -76.065 89.057 48.196 135.546 -81.685 92.844 43.307 133.743-137.126 93.627 41.256 143.201-130.814 96.666 39.278 115.385 -88.552 135.781-177.279 106.314 -95.945 96.619 43.752 115.394 -77.500 92.753 47.642 107.225 -18.183 89.540 51.962 137.128 -26.335 90.568 48.635 128.635 -76.566 88.566 44.762 102.027 -83.358 91.481 46.049 132.122 -52.459 90.374 47.900 137.558 -86.245 90.476 43.801 128.559 -77.291 92.748 93.739 110.294 -93.473 88.433 -76.052 128.923 -77.174 91.911 -47.082 142.300-117.634 88.756 -49.322 120.442 8.055 91.499 -54.295 145.865 -40.351 90.404 -47.117 111.379 -84.105 96.037 69.056 105.060 -78.985 92.424 0.000 129.270 -76.156 # 845 total E -1.46696E+02 rmsd from N 0.000 %NC 0.00 93.110 -66.772 126.258 -74.208 94.101 -50.731 114.701 -73.947 91.615 -44.567 103.988 -76.946 91.138 -45.297 128.919 -76.165 92.432 -38.786 141.616-125.943 94.023 -43.798 63.317 -75.621 91.799 -40.809 130.611 6.048 106.902 -22.069 171.018 167.479 99.260 -25.033 137.634-131.979 126.095-112.184 95.273 -87.926 114.263 61.715 166.448-130.779 96.411 34.066 92.528-111.487 95.596 46.858 114.156 -86.306 95.444 37.529 135.625-107.305 93.855 52.768 138.960 174.935 89.956 48.833 122.054-124.472 97.338-120.170 109.284 -82.297 128.671 -75.896 131.972 -13.940 95.334 44.649 152.963-114.475 91.615 49.147 141.539 168.600 86.454 63.954 0.000 0.000 88.139 46.129 107.229 -81.890 90.919 43.507 146.725 -76.821 92.504 42.199 119.886-127.192 89.405 53.640 115.535 -78.285 89.428 52.778 131.907-107.319 91.469 58.659 132.660-112.328 94.341 -17.049 106.307 -86.351 120.273 145.158 148.769 -17.970 137.523 -90.692 112.494-103.539 106.008 -11.187 115.367 -82.612 97.607-151.899 97.028 -48.232 99.505 42.138 118.857 -73.797 94.297 42.779 129.692 -76.484 91.023 42.495 145.789-167.749 90.250 56.238 144.557 -41.734 87.076 50.082 154.284-142.001 89.320 41.128 127.933 -76.439 90.150 49.581 117.160 -35.867 89.343 49.147 130.135 -76.688 89.482 44.979 138.202-139.296 89.457 48.105 131.263 -45.204 89.234 55.681 139.069 -48.921 89.296 44.083 136.264-128.581 94.316 83.345 103.441 -80.521 92.497 0.000 128.830 -76.752 # 846 total E -1.50255E+02 rmsd from N 0.000 %NC 0.00 93.232 -73.098 128.792 -81.778 94.161 -47.888 121.937 -81.338 90.946 -48.471 103.198 -78.329 89.439 -50.954 128.559 -75.895 90.768 -39.075 141.998-135.116 91.662 -45.670 59.834 -57.930 90.204 -43.496 144.380 77.038 100.917 -44.267 175.624-174.007 89.396 -33.383 131.557-133.130 104.610-136.524 82.169 -79.350 115.610 72.012 157.601 -98.507 95.063 40.226 92.988-108.839 94.928 47.920 111.552 -83.015 96.238 36.811 133.049 -92.943 94.205 47.383 142.737-165.703 94.038 68.654 120.196-123.604 96.468 -76.713 131.747 -97.805 124.629-115.181 131.101 -57.370 94.156 41.771 139.605 -14.605 94.430 44.755 144.962-167.491 89.432 46.601 0.000 0.000 90.436 52.808 103.275 -86.493 87.933 46.914 149.847 -79.167 90.880 41.787 118.133-130.173 89.892 50.115 110.216 -76.048 89.167 63.604 143.010-100.656 89.458 40.559 141.621-141.781 93.207 44.706 152.673 -21.905 98.400 -8.984 120.865 -93.072 130.245-155.399 114.317-110.230 97.262 47.252 114.598 -77.531 91.057 63.152 101.636 -23.373 89.627 59.617 111.622 -18.460 89.925 48.816 130.333 -75.891 89.592 43.723 102.037 -82.836 92.095 40.923 127.830 -55.789 92.744 59.137 141.724 -23.242 88.420 52.720 130.764 -78.550 89.943 179.651 96.539-102.933 91.758 70.444 165.682 -92.411 89.925 47.371 140.737-100.723 90.157 48.003 128.418 -27.378 91.050 58.423 146.374 -29.615 88.120 41.472 138.054-140.886 95.149 79.336 103.498 -79.928 92.475 0.000 129.086 -76.393 # 847 total E -1.48143E+02 rmsd from N 0.000 %NC 0.00 93.097 157.904 140.091 -95.237 93.205 55.488 136.841 45.585 91.838 45.156 106.748 -82.356 91.865 46.869 130.316 -77.004 93.302 43.924 150.904-138.386 92.244 43.932 56.749 -68.668 90.094 45.717 124.595 -28.489 89.451 52.121 126.642-103.339 88.394 42.987 128.585-110.046 95.460 98.756 84.622 -96.230 94.015 -61.068 144.207 -97.591 99.904 -48.411 92.035 -83.227 92.560 -58.002 146.355 -37.765 118.959-109.940 160.416-173.969 102.207-112.405 135.776-159.327 94.151 46.221 138.087-105.879 93.349 47.605 136.091 -72.527 91.851 43.785 127.326 -61.718 93.551 47.829 138.871 -25.814 92.745 43.215 141.761-171.397 91.021 43.965 0.000 0.000 91.851 50.722 104.388 -84.707 88.353 46.324 148.993 -76.391 89.938 43.984 117.676-129.851 89.971 47.695 107.937 -75.720 90.251 49.886 138.871 -84.455 90.688 42.274 138.418-152.300 92.021 50.361 142.774-127.692 95.395 -78.116 110.316 -86.578 125.539-111.321 108.449-106.305 92.114 66.674 111.529 59.394 91.336 86.402 120.407 -93.116 94.983 5.097 111.419 -75.360 99.144 -99.275 126.816 -73.991 89.432 -43.598 96.416 -81.263 91.832 -39.293 125.733 0.184 101.337 -34.261 153.541 -17.479 95.714 -46.853 129.567 -76.648 95.749-125.924 121.566 -66.697 91.586 49.904 130.733 -76.904 91.291 51.529 142.168-112.788 90.580 48.007 124.149 -19.358 93.324-133.375 138.203 -48.616 97.356 32.261 137.026-139.195 124.150 102.624 107.158 -77.839 92.523 0.000 129.724 -76.518 # 848 total E -1.47958E+02 rmsd from N 0.000 %NC 0.00 93.341 177.723 138.490 -95.461 93.347 58.027 147.339 42.303 94.177 41.401 106.338 -81.597 92.393 47.829 131.723 -77.423 94.074 43.258 142.975-127.591 92.719 41.004 59.974 -77.161 92.666 41.808 119.209 -41.118 94.555 39.759 135.407 -93.742 92.796 45.483 137.252-112.737 92.006 37.133 82.947-101.231 94.976 120.678 142.749 -97.739 91.610 69.610 131.400-159.068 89.584-163.569 101.914 -85.420 142.966-139.364 161.269-161.479 102.805-115.915 151.767 -32.781 93.720 47.284 141.322 123.027 91.569 48.259 137.162 -83.349 91.271 47.105 124.720 -56.340 91.691 45.293 125.732 -22.618 90.253 46.829 148.080-158.318 90.445 46.761 0.000 0.000 92.529 42.572 109.142 -79.476 91.863 41.584 153.175 -82.314 93.144 41.854 113.929-125.219 90.522 49.595 111.289 -77.841 89.952 51.683 133.038 -94.445 91.625 49.688 135.581-123.069 93.566 19.099 108.319 -86.769 121.898 66.348 150.592 -18.715 137.053 -83.582 111.409-100.412 118.628 -13.200 115.222 -80.977 92.694 -52.654 111.191 -54.910 95.035 -37.533 115.875 -68.809 92.338 -50.706 128.995 -76.743 91.342 -65.549 97.887 -76.311 87.015 102.565 111.758 15.288 92.814 57.710 139.317 -26.578 90.698 47.258 129.268 -76.758 90.574 126.818 138.407 173.718 122.656-101.107 130.520 -87.708 92.586 46.481 140.868-112.578 95.507 39.326 127.116 -31.465 95.450 40.320 152.364-101.474 96.312 42.636 133.411-157.945 96.076 74.546 103.260 -80.152 92.531 0.000 128.886 -76.822 # 849 total E -1.47900E+02 rmsd from N 0.000 %NC 0.00 93.114 154.596 142.961-104.323 93.760 48.771 113.214 8.925 89.964 50.988 107.001 -77.167 90.111 51.706 131.150 -78.097 92.076 47.161 139.051-118.245 92.135 38.946 54.886 -68.014 90.537 48.050 164.830 108.001 91.506 45.447 128.095 -93.512 94.010 39.401 126.332-105.916 97.332 133.903 103.533-102.241 149.728 165.758 167.807-158.631 94.795 64.223 97.212-109.998 97.778 44.302 110.262 -82.590 95.699-108.897 163.952-154.456 110.348-112.850 139.732-159.773 93.825 45.434 143.265 158.565 91.989 46.635 135.214 -85.048 89.881 50.749 128.413 -61.713 91.517 49.934 116.496 -38.116 90.984 41.756 152.199-154.159 90.112 46.495 0.000 0.000 90.918 54.119 105.205 -82.779 88.342 45.410 142.363 -77.348 89.799 43.268 118.887-125.694 90.372 50.598 111.560 -78.691 89.708 49.159 140.449-103.326 91.220 45.582 133.770-142.826 94.609-101.862 105.036 -83.909 113.162-164.307 157.956-144.371 132.254-157.706 112.698-108.026 112.676 94.564 117.876 -79.646 92.496 -53.999 108.769 -66.762 91.510 -44.436 108.605 -77.248 89.305 -60.104 127.167 -74.433 90.759 -47.241 103.308 -88.561 92.590 107.493 105.096 -44.519 93.998 52.305 145.942 -25.147 90.333 54.445 129.736 -77.619 89.179 91.777 140.832 -98.644 90.634-162.340 129.232 -77.620 94.793 48.986 140.320-112.056 90.567 50.467 134.001 -22.840 91.244 56.603 161.872-172.853 88.834 43.364 124.418-166.042 95.447 96.581 102.899 -79.765 92.450 0.000 128.909 -76.282 # 850 total E -1.48504E+02 rmsd from N 0.000 %NC 0.00 93.287-179.251 136.277 -88.618 93.192 60.329 144.158 41.896 93.552 40.975 105.546 -81.795 92.087 51.844 132.609 -77.592 91.261 42.447 150.280-139.885 90.599 45.770 64.888 -75.598 90.709 43.956 120.088 -49.806 90.344 46.094 134.090 -99.327 90.148 42.694 135.010-125.670 92.010 66.438 87.156-102.129 93.219 -48.915 141.917-103.338 114.621 -92.460 90.542 -82.439 104.965-100.073 154.558 -4.464 140.859 160.400 159.960-171.095 114.935-101.080 143.464-161.702 94.869 44.742 152.301-145.279 91.488 47.996 135.507 -80.983 90.054 53.603 120.424 -56.281 90.322 47.056 126.237 -74.127 89.289 46.320 135.591 171.983 88.623 51.754 0.000 0.000 90.455 46.902 104.609 -80.388 89.850 43.539 148.561 -72.531 91.145 44.034 118.606-127.843 89.931 49.489 110.937 -77.315 89.740 50.188 135.340 -95.442 92.447 37.602 135.800-133.080 94.748 45.650 143.887-131.387 95.758 29.600 139.747-105.994 123.825-131.269 114.641-116.649 94.883 -5.351 114.219 -77.262 107.991-158.226 129.262 20.415 108.362 -27.399 114.516 -76.151 94.061 -45.828 126.707 -75.522 94.571 -34.488 100.355 -80.582 91.403 -48.471 119.788 -35.849 90.185 -52.568 150.744 -31.237 89.690 -53.032 130.568 -78.191 91.869-127.282 124.408 -8.848 92.645 44.431 131.540 -77.003 92.363 51.853 142.946-122.047 91.417 65.956 135.024 -57.057 93.072-120.845 116.628 -64.475 95.036 10.285 126.492-116.610 118.725-121.554 102.204 -71.775 92.874 0.000 129.586 -76.506 # 851 total E -1.48475E+02 rmsd from N 0.000 %NC 0.00 93.239 -70.841 127.825 -78.455 94.003 -50.856 119.553 -75.961 91.523 -45.100 104.526 -78.570 90.667 -50.241 128.756 -76.337 90.111 -40.973 141.901-134.316 94.422 -69.321 83.443 -85.866 93.371 56.208 108.782 -83.490 121.721 70.362 170.507-135.289 89.394 64.832 137.969 152.967 94.018 175.370 75.243 -97.513 105.181 55.824 145.516-134.275 93.525 56.932 94.238-116.863 91.691 54.525 105.542 -84.337 100.789-114.993 121.889 -83.131 106.553-111.823 141.601-157.579 94.625 48.619 144.073 157.803 92.217 46.228 134.579 -86.732 90.346 50.946 121.962 -65.224 91.227 51.720 107.103 -37.144 91.796 41.668 109.015 -82.487 90.438 46.398 0.000 0.000 89.634 62.711 104.047 -83.813 86.571 47.501 138.561 -74.930 89.747 42.972 119.528-123.545 90.598 49.477 107.369 -75.266 89.509 48.256 134.267 -78.048 93.003 42.706 136.200-136.016 94.517 39.998 143.590-131.557 98.507 44.847 114.351 -87.594 137.712-178.764 106.346 -94.329 96.850 43.841 115.506 -77.611 92.716 47.104 103.133 -11.425 89.475 52.339 134.087 -22.902 89.921 50.361 128.671 -76.202 88.635 44.738 102.650 -83.337 91.721 42.420 134.530 -46.525 92.353 46.362 134.885 -86.457 91.606 43.605 128.665 -77.390 92.790 92.694 106.880 -85.558 90.221 -78.935 128.432 -76.789 94.171 -42.620 144.086-126.910 91.907 -43.860 125.163 -15.544 93.606 -68.813 143.920 -50.972 90.112 -60.150 136.069-140.683 94.606 64.887 102.924 -79.580 92.394 0.000 129.322 -76.182 # 852 total E -1.49354E+02 rmsd from N 0.000 %NC 0.00 93.187-179.983 133.357 -78.829 93.313 62.678 151.286 23.803 95.055 39.618 106.364 -82.424 92.390 50.305 132.311 -77.075 92.643 42.708 142.723-117.228 90.642 42.990 64.283 -78.677 91.731 42.838 119.154 -49.153 93.179 40.970 135.076 -94.743 91.104 44.285 139.665-130.191 90.713 48.101 81.406-102.209 91.846 156.033 133.978 -85.873 91.540 91.110 130.098-157.738 89.212 107.766 98.666 -82.050 91.563 -77.139 130.537 -98.126 98.164-116.781 135.619-149.378 90.806 49.134 139.349 132.720 91.059 48.237 134.823 -85.678 89.690 50.286 134.509 -53.387 90.048 48.336 128.472 -27.290 88.783 46.227 144.846-146.534 89.392 49.726 0.000 0.000 88.997 52.815 143.849-100.013 89.226 40.474 134.893-105.485 90.665 46.002 117.667-128.124 88.255 63.966 112.064 -77.132 89.202 46.258 142.969-111.349 92.933 40.128 131.567-149.562 99.114 8.833 145.803-134.995 120.788 176.039 108.992 -80.119 100.553 54.526 129.160-150.382 97.262 34.843 114.999 -78.030 103.766 31.872 134.149 12.417 97.071 43.753 116.167 -74.204 92.014 47.830 131.009 -77.180 88.655 44.316 102.258 -84.579 92.901-175.718 100.544 -48.398 91.427 -52.794 148.618 -33.540 90.960 -43.612 129.266 -76.451 94.972-145.412 101.849 -53.089 91.269 48.892 131.686 -77.939 91.028 52.468 141.929-111.469 90.437 56.723 124.856 -11.895 91.426-140.975 136.393 -89.413 96.483 44.880 139.383-141.359 116.349 79.689 102.601 -79.262 92.573 0.000 129.448 -76.822 # 853 total E -1.47955E+02 rmsd from N 0.000 %NC 0.00 93.274 -66.125 127.224 -77.156 94.263 -49.285 117.088 -78.276 91.063 -46.174 103.742 -77.794 90.549 -47.765 128.100 -75.776 90.969 -40.642 138.731-124.845 93.794 -41.728 65.326 -67.007 92.746 -37.759 134.243 -18.628 102.608 -34.083 171.198 162.779 98.069 -45.675 129.825-115.231 98.407 171.061 87.410 -80.701 115.139 48.366 155.834-142.808 94.235 58.138 129.008-154.640 94.474 174.428 103.710 -85.950 119.300-171.914 152.718-161.954 116.761-106.050 154.768 -23.615 96.006 39.398 142.048-105.915 92.486 47.136 138.070 -72.816 90.446 51.655 129.093 -73.065 91.927 49.750 134.120 -28.513 91.845 38.476 142.970-169.939 90.109 49.004 0.000 0.000 91.203 52.170 103.224 -85.348 90.240 44.194 144.247 -75.159 92.405 38.856 117.866-123.592 91.324 52.551 110.619 -76.125 91.043 58.444 134.331 -90.946 89.365 39.998 137.833-153.056 93.848 40.762 114.293 -88.900 102.803 -10.023 117.710 -80.865 142.003-156.601 102.550 -82.474 90.876 56.484 114.675 -76.065 91.060 53.401 93.235 -31.536 88.356 55.187 122.070 8.241 89.116 48.935 129.762 -76.911 88.456 47.057 102.955 -84.116 88.777 53.143 117.987 -15.893 89.049 50.363 133.044 -49.935 90.376 40.710 129.632 -77.108 92.842 112.269 114.877-111.143 93.381 -31.188 130.961 -77.926 97.384 -66.025 135.096-118.488 92.330-127.166 134.815 -48.564 131.725-130.820 170.372 -0.606 99.087 -2.455 137.207-137.390 119.487 80.166 103.019 -74.555 92.432 0.000 129.484 -76.519 # 854 total E -1.51301E+02 rmsd from N 0.000 %NC 0.00 92.952 147.680 139.331 -91.134 93.719 48.822 118.348 -23.348 92.840 45.295 105.042 -81.951 92.487 47.095 127.536 -74.675 91.056 46.542 110.828 -78.567 89.888 43.953 76.653 -65.499 88.666 47.011 120.351 -46.047 87.919 48.303 119.690 -99.113 88.098 52.552 117.957 -96.224 86.762 46.268 97.426 -97.041 91.951 56.394 126.773 -94.437 101.967 -47.235 100.751 -94.288 116.037 152.658 111.125 -86.917 150.440-156.854 170.065-163.724 103.302-118.822 141.586-159.375 95.389 46.005 142.266 135.183 91.451 48.252 134.410 -86.333 90.300 51.744 120.410 -65.474 92.041 49.817 114.156 -29.046 91.836 40.052 108.844 -81.908 91.077 50.018 0.000 0.000 90.105 64.786 112.587 -80.117 87.849 42.348 141.043 -81.587 89.305 47.454 115.701-122.110 90.158 64.245 105.029 -76.348 88.578 56.200 141.959 -88.073 90.828 31.004 134.315-161.056 101.715-121.932 146.339-128.068 115.763 172.322 152.825 -3.095 131.345 -86.266 112.243-108.602 97.025 42.397 113.937 -77.422 91.002 48.331 122.587 -15.179 88.845 56.141 140.689-159.568 88.332 43.625 127.878 -75.833 91.242 41.557 101.896 -82.522 92.021 44.193 138.427 -34.758 93.728 39.238 130.750 -89.522 93.299 43.116 128.543 -77.157 92.733 65.469 108.976 -69.272 91.526-109.808 130.207 -77.585 98.575 -26.382 141.681-120.178 91.936 -54.786 114.517 27.813 93.168 -69.041 156.173 -27.014 90.832 -48.857 138.654-148.825 96.066 67.949 98.717 -79.909 92.532 0.000 129.222 -76.370 # 855 total E -1.49867E+02 rmsd from N 0.000 %NC 0.00 92.954 162.653 133.678 -75.935 92.964 63.227 143.996 68.978 93.961 38.999 106.129 -81.942 92.526 52.865 130.785 -76.095 90.265 43.024 156.584-174.335 92.277 43.637 75.692 -82.089 91.387 43.813 113.963 -68.146 87.829 61.672 144.087-100.977 88.081 45.797 109.451-105.075 94.331 175.956 87.757 -87.436 107.983 51.277 146.901-139.202 94.318 55.214 94.457-117.461 92.720 67.721 107.832 -83.692 91.809-110.640 128.718 -81.842 101.417-117.284 139.077-149.268 91.228 49.935 143.790 150.842 92.123 46.051 134.985 -85.872 90.016 49.098 122.246 -43.381 89.461 53.027 114.447 -33.555 88.998 47.800 152.127 -23.217 89.754 44.661 0.000 0.000 89.037 58.783 109.196 -77.456 86.393 50.551 145.372 -77.165 89.077 44.290 121.038-130.062 89.040 50.501 107.418 -75.172 88.394 54.676 138.748 -82.746 91.137 49.812 135.707-131.945 91.725 24.707 108.685 -86.858 110.721 -13.082 160.643 -13.811 135.700 42.127 110.549-101.390 150.143 -98.034 130.851 -84.196 95.568 -39.227 109.852 -58.250 91.253 -47.654 113.151 -69.003 93.834-122.467 128.964 -76.294 88.736 45.133 95.939 -85.024 91.535 56.360 106.759 -44.539 88.859 49.619 144.204 -17.475 89.117 41.126 128.285 -76.736 90.011 51.311 111.314 -63.344 90.538 46.049 128.425 -76.215 90.923 43.878 141.050 -78.854 91.087 45.491 130.202 -43.590 91.167 51.905 133.990-108.961 90.502 43.201 131.918-140.920 95.716 70.376 104.217 -80.364 92.519 0.000 129.029 -76.646 # 856 total E -1.47172E+02 rmsd from N 0.000 %NC 0.00 93.274 162.517 142.513-105.677 93.044 54.359 140.378 42.503 91.758 43.098 105.808 -82.869 91.366 53.596 131.152 -76.726 90.980 43.331 148.402-143.060 88.977 46.368 67.302 -75.992 89.771 46.001 110.856 -49.578 89.102 47.470 142.404 -83.436 90.836 39.823 117.739-110.920 90.691 47.228 88.839 -90.617 91.372 71.967 140.035 -85.174 93.782 26.846 97.248-108.227 95.640 55.563 112.722 -86.992 96.641 -18.263 128.136-100.639 126.986-164.988 110.471 -87.715 98.255 58.145 148.144 168.995 95.424 43.835 136.095 -84.670 91.211 49.426 120.570 -29.784 91.064 60.908 117.965 -44.027 89.520 49.406 150.725 -25.061 91.853 39.080 0.000 0.000 90.694 61.647 110.840 -73.752 86.961 53.439 141.613 -73.710 89.806 40.608 120.249-124.703 91.400 44.882 106.890 -74.523 90.032 57.013 134.717 -70.687 90.290 47.059 141.784-104.655 89.853 42.500 141.500-127.436 96.801 42.994 111.146 -85.517 102.140-104.608 102.563 -88.788 120.825 -15.414 121.375 -80.746 130.067 -91.975 133.598 -51.072 89.614 62.578 114.206 -71.071 90.895 48.147 128.417 -75.500 91.034 42.980 99.292 -77.897 92.271 41.708 139.188 -37.256 91.898 45.215 132.285 -87.732 91.755 42.014 128.158 -76.920 91.256 45.173 105.833-102.623 91.188 44.832 130.521 -77.928 91.350 46.178 138.812-118.973 90.252 47.849 129.531 -45.449 90.059 53.482 138.185-110.511 90.123 42.539 131.018-133.963 95.507 72.896 103.699 -80.141 92.529 0.000 129.029 -76.659 # 857 total E -1.52101E+02 rmsd from N 0.000 %NC 0.00 93.221 -69.542 129.232 -83.355 94.306 -46.960 118.647 -81.473 90.330 -48.484 103.256 -77.242 89.908 -50.036 128.404 -75.731 91.311 -38.105 138.662-129.094 93.229 -44.902 63.638 -65.981 91.200 -35.120 124.744 -26.070 104.391 -38.655 170.350 146.247 93.235 -43.019 129.567-117.123 95.376 132.703 86.283 -87.337 110.259-130.581 146.992-102.564 125.196 -1.217 115.486-118.823 111.531-175.724 102.521 -82.595 126.306 -99.305 170.651 -4.347 107.097-120.931 142.429-154.146 94.528 44.369 146.973 146.988 92.270 46.478 135.914 -85.281 90.902 47.263 135.236 -76.077 92.102 48.920 134.980 -43.280 91.493 41.878 145.006-153.102 90.590 46.568 0.000 0.000 90.184 55.956 131.072-109.777 87.746 45.673 140.587-101.886 90.238 41.445 117.264-129.493 89.785 51.513 115.324 -79.687 89.633 48.794 142.612-119.733 90.774 50.352 126.144-149.849 92.692 -94.880 103.381 -82.869 118.821 116.583 149.558 -15.027 107.089 172.578 94.620 -81.054 87.289 82.569 118.554 33.655 90.415 58.386 113.743 -92.997 93.509 37.570 109.653 -73.148 94.676 42.264 130.721 -77.686 91.491 52.141 137.545 172.127 88.178 51.383 89.872-127.705 87.143 62.732 125.593 -70.678 89.006 45.231 127.164 -75.360 90.134 111.036 99.836-106.446 92.656 -45.167 128.929 -77.834 93.942 -52.078 144.987-132.414 91.265 -52.392 122.703 0.919 95.253 114.504 156.708 -27.309 105.808 43.547 142.465-167.023 98.727 101.471 105.479 -76.297 92.426 0.000 129.168 -75.934 # 858 total E -1.49819E+02 rmsd from N 0.000 %NC 0.00 93.136 -67.563 127.223 -77.118 93.449 -51.597 118.335 -75.521 91.494 -45.335 103.447 -77.172 91.031 -48.149 126.562 -75.178 88.760 -43.625 143.757-134.749 90.158 -43.748 51.577 -62.499 93.542 -84.546 130.269 -1.559 84.280 109.091 145.812-100.257 93.541 68.267 147.069 171.313 89.046 53.300 110.243 -61.755 92.501 167.776 136.913 -91.307 97.294 63.467 125.962-148.710 93.865 38.870 97.259 -81.866 92.651 56.856 143.644 -29.985 90.722 42.515 129.605-124.657 93.281 48.509 116.729-146.522 94.994 28.518 129.256 -88.185 102.050 150.186 157.209-129.174 100.139 41.364 93.633 138.017 95.756 40.475 142.279-125.514 99.636 28.415 0.000 0.000 106.765 29.171 165.288-174.197 96.743 41.751 156.831-175.157 91.629 48.913 112.817-149.172 90.528 45.407 110.830 -77.826 91.359 50.001 148.949-106.670 91.691 48.181 132.389-157.028 94.452-108.003 103.712 -82.233 108.003-173.501 151.192 -16.958 131.818-157.765 113.178-110.973 97.040 44.560 115.171 -77.373 92.771 45.369 104.818 -23.247 90.150 52.423 132.869 -23.797 90.365 44.661 128.265 -77.012 91.062 48.173 101.525 -82.740 90.578 47.715 130.970 -52.548 91.572 63.740 125.950 -78.190 90.939 60.484 129.384 -77.332 93.704-168.830 76.397 -94.453 92.223 55.766 131.444 -77.225 90.837 46.370 141.546-110.548 88.293 61.771 141.666 -38.671 89.455 61.818 141.127 -50.978 87.255 40.075 146.811-165.444 95.695 84.816 101.476 -79.123 92.484 0.000 129.012 -76.396 # 859 total E -1.47769E+02 rmsd from N 0.000 %NC 0.00 93.084 156.910 140.510 -95.935 93.600 53.599 155.137 123.609 92.363 46.323 107.278 -80.456 91.373 46.805 129.384 -75.779 91.752 43.365 153.489-140.555 93.822 41.157 126.599 169.081 93.089 42.289 111.493 -68.432 92.802 42.312 131.912 -91.487 93.319 70.088 150.484-146.931 87.457 125.743 113.286-159.202 92.757-116.028 118.625-153.163 95.651 52.171 94.306-122.616 94.811 44.806 108.805 -87.796 91.850 52.813 152.355-131.337 90.138 47.992 121.940-157.944 92.670 60.897 124.400-117.064 96.055 -65.381 130.505 -69.134 117.425-165.924 148.519 -54.746 97.978 49.994 152.575 -31.006 94.842 42.819 143.306-163.754 92.369 43.239 0.000 0.000 91.168 51.506 111.227 -87.849 89.843 45.966 141.250 -82.142 91.889 41.731 119.501-125.342 89.870 52.266 113.383 -77.327 90.854 59.940 127.446 -96.593 89.831 57.837 135.594-153.036 92.555 -60.937 141.357-128.253 135.101 139.747 112.712 -76.669 102.280 -79.796 97.218 -88.653 93.983 -48.245 112.077 -74.740 92.584 -65.716 104.858 -51.727 88.210 110.505 111.590 -71.982 92.440 46.501 128.734 -76.850 89.843 49.115 108.805 -80.031 90.302 44.435 134.082 -36.885 91.130 44.752 133.316 -84.079 91.694 41.072 128.315 -76.909 90.959 47.075 111.065 -61.555 91.048 46.111 128.707 -76.880 91.370 42.951 137.417-127.676 91.275 46.103 130.477 -47.369 91.072 51.454 133.680-108.928 90.613 43.328 132.115-141.316 95.673 70.259 104.220 -80.400 92.542 0.000 129.054 -76.622 # 860 total E -1.46437E+02 rmsd from N 0.000 %NC 0.00 92.519 124.320 124.322 -50.620 95.072 46.439 148.089 -7.397 92.101 47.190 108.010 -80.350 91.282 49.356 127.908 -75.312 90.910 43.143 122.085 -32.585 93.287 42.454 97.859 -75.099 92.158 40.119 111.444 -74.005 108.678 17.696 106.454 -78.239 94.265 40.768 142.310 -42.733 105.830 19.467 76.835 -98.303 97.770 42.386 149.840-147.867 100.426 24.547 86.370-109.732 95.649 50.124 137.813-127.996 91.849 43.908 120.247-121.243 91.408 52.440 138.535-129.817 90.187 45.749 120.574-125.659 96.817-114.280 121.975 -86.951 121.686 134.458 151.114 -68.953 126.660-179.756 110.051-118.867 97.084 50.622 146.177-165.985 93.620 43.754 0.000 0.000 90.628 48.702 142.264 -16.802 89.616 54.671 140.363 -97.371 88.705 50.221 122.077-135.817 88.420 47.157 108.598 -73.915 91.026 51.794 136.406 -75.124 91.243 48.625 135.907-141.524 93.427-113.093 107.642 -85.674 103.640 168.036 152.464-135.690 102.090 -47.132 92.646-114.812 100.610 -71.167 114.421 -77.975 127.426 -91.000 112.741 47.768 94.139 55.403 111.528 -67.101 91.601 42.316 130.733 -78.197 90.047 44.789 130.029-119.098 89.248 51.641 118.621-103.544 88.690 56.364 147.448-128.498 87.696 40.904 127.866 -76.703 91.088 56.149 97.611 -81.289 92.217 -95.826 128.555 -76.265 113.070 -51.362 152.982-174.222 112.084 -71.064 112.486 41.582 92.187 74.970 149.067 -26.304 92.374 36.073 141.084-147.905 96.380 71.711 99.645 -75.189 92.441 0.000 129.204 -76.333 # 861 total E -1.54050E+02 rmsd from N 0.000 %NC 0.00 92.893 146.265 138.177 -87.423 94.408 45.737 133.223 -88.198 92.085 48.675 105.212 -80.741 90.565 51.311 129.949 -75.811 90.352 46.956 102.827 -79.466 90.367 40.692 67.807 -61.037 89.384 51.358 123.151 -41.332 88.430 50.796 124.683 -96.939 87.973 42.057 129.119-115.489 92.111 45.862 82.278 -96.979 92.772 45.052 137.934 -80.919 103.415-129.350 97.542 -97.780 109.322-161.388 104.419 -83.428 147.120-154.566 176.443-176.446 109.426 -97.665 139.900-148.709 94.048 48.539 149.205 159.620 92.209 45.569 133.973 -84.944 90.128 53.402 136.725 34.354 89.398 46.800 125.510 -40.481 89.719 44.545 146.417-151.612 91.841 44.915 0.000 0.000 90.478 44.477 142.611 -21.321 91.674 44.747 133.064 -97.997 89.074 50.186 120.255-125.909 88.129 52.758 105.532 -76.423 89.677 51.312 133.294 -65.479 90.951 39.100 137.933-140.669 98.031-117.161 104.562 -81.829 104.246-174.731 152.187 -15.406 109.613-117.890 90.454 -87.445 93.300 49.555 115.044 -76.104 91.988 44.401 97.099 -19.511 89.769 50.802 126.698 5.696 89.945 46.780 129.056 -76.596 89.218 42.016 101.796 -82.507 89.766 49.319 138.188 -43.615 88.674 51.813 144.860 -44.895 88.488 43.883 128.359 -76.819 87.725 52.128 111.558 -47.388 89.746 47.360 127.523 -76.283 89.961 47.303 141.035-105.858 90.016 47.741 127.139 -40.009 90.267 52.904 136.359 -88.713 90.299 43.686 134.994-132.195 95.459 73.541 104.339 -80.325 92.520 0.000 129.001 -76.648 # 862 total E -1.46913E+02 rmsd from N 0.000 %NC 0.00 92.890 147.375 139.574 -91.498 93.626 52.742 135.208 58.128 91.132 47.044 106.962 -82.077 91.504 46.080 129.456 -76.998 95.634 46.703 158.413-160.844 94.780 36.565 56.238 -76.469 94.767 36.478 128.937 -41.791 113.760 9.574 129.427 -93.408 97.630 51.868 154.800-151.642 88.245 48.844 107.068-141.259 94.562-176.246 102.162-113.532 88.709 76.015 133.858-162.427 91.194 51.225 96.691 -83.029 90.498 52.072 138.320 -41.863 91.048 41.549 128.647-116.020 92.331 50.017 124.274-145.068 92.773 42.508 126.683 -89.864 95.048-113.342 153.419-152.425 111.921 -74.163 108.784 -61.273 91.586 103.779 145.289-161.971 91.894 52.287 0.000 0.000 88.458 56.761 108.532 -76.158 88.240 49.199 139.051 -73.994 89.663 44.355 122.734-126.776 89.172 49.609 108.811 -76.001 89.258 55.987 136.728 -89.577 90.734 41.503 137.268-137.981 92.507 45.027 152.441 -22.023 98.115 26.949 116.716 -89.144 137.014-162.361 109.200 -96.295 91.382 59.970 113.980 -76.280 90.077 57.366 117.947 -30.869 87.919 52.215 119.584 -15.624 90.551 42.997 128.476 -75.964 90.325 44.597 101.636 -82.850 89.798 51.435 132.187 -49.711 89.262 49.425 134.162 -56.323 89.207 43.632 128.215 -76.232 91.410 75.616 113.846-102.635 88.069 -96.198 129.031 -76.991 93.979 -44.177 144.465-129.208 89.892 -48.797 119.733 5.671 91.533 -51.997 144.732 -37.569 91.199 -43.705 143.303-146.296 97.563 79.364 105.365 -79.536 92.388 0.000 129.313 -76.033 # 863 total E -1.51242E+02 rmsd from N 0.000 %NC 0.00 93.151 -79.235 122.391 -60.949 118.111-105.430 130.579 -34.952 92.175 45.346 107.333 -80.874 93.465 48.725 130.142 -77.046 93.829 42.330 151.585-143.119 92.472 41.885 59.957 -79.339 92.640 43.566 122.453 -36.336 92.570 40.668 135.009-101.639 91.090 50.519 144.254-151.903 88.718 54.087 78.997-104.115 91.837 158.179 125.539 -77.875 95.610 56.169 133.631-158.462 111.162-156.906 146.455 -20.691 128.434-161.472 162.244-132.573 111.505-105.626 141.647-154.390 92.874 48.220 140.734-107.322 92.228 47.236 135.952 -74.525 91.132 47.147 129.391 -54.938 91.179 45.488 137.968 -16.476 90.956 45.742 143.516-163.686 90.066 46.688 0.000 0.000 90.367 48.220 109.354 -81.080 90.557 43.710 143.174 -77.532 92.319 41.102 119.443-123.593 90.476 50.037 111.408 -77.298 90.477 54.610 129.279 -91.820 91.300 50.890 137.514-130.764 92.977 20.571 141.901-125.919 122.397 43.102 154.618 -18.462 137.890 -82.233 112.702-101.507 128.673 -4.889 117.988 -82.277 92.604 -52.492 112.430 -53.735 91.938 -45.245 113.305 -68.857 92.520 -42.031 126.763 -74.782 91.841 -37.851 100.903 -84.974 92.741 -44.829 131.301 -26.397 91.082 -49.139 154.733 -29.947 90.568 -50.459 129.386 -77.122 90.769-128.959 114.158-118.844 90.940 51.158 132.298 -77.460 90.407 50.156 140.934-106.966 91.096 63.527 119.332 -5.553 90.736-106.351 150.581 -35.967 101.446 -17.448 106.334 -87.841 114.782 134.782 102.505 -75.305 92.689 0.000 129.289 -76.799 # 864 total E -1.48753E+02 rmsd from N 0.000 %NC 0.00 93.174 -67.416 128.926 -82.481 94.383 -46.933 117.757 -81.142 90.524 -47.937 103.191 -77.306 89.943 -49.166 129.468 -76.370 91.906 -38.003 138.951-127.946 93.631 -45.186 65.308 -68.814 90.859 -31.818 120.023 -30.657 108.051 -35.122 167.174 140.570 93.793 -46.156 130.513-117.191 93.194 124.419 86.904 -86.824 106.894-173.459 142.648 -98.578 93.744 71.456 98.609-128.292 117.503 102.430 104.673 -84.316 103.583 -86.410 147.162 -99.092 98.165-119.996 136.719-146.472 92.565 46.289 145.991 -81.013 92.629 47.835 134.998 -72.703 91.748 44.782 124.684 -40.162 92.162 44.654 92.877 -57.587 90.051 50.154 161.614 -13.083 88.926 51.085 0.000 0.000 89.685 44.235 110.227 -78.394 92.657 42.964 140.974 -74.066 93.060 43.023 123.049-120.320 90.397 48.224 113.316 -78.675 91.241 48.216 130.255 -96.792 92.732 48.784 135.313-130.127 93.425 21.349 142.487-131.647 112.151 26.834 153.274-127.284 131.722-125.546 118.336-117.928 147.052 55.518 127.118 -86.440 99.862-135.727 113.633 -19.819 109.466 32.805 138.344 -3.958 94.540 46.957 129.338 -75.998 96.204 31.434 145.133 -26.549 97.165 122.389 103.858 -80.815 93.470 -49.855 142.210 -79.890 92.201 -48.839 129.833 -77.975 97.481-137.146 115.589-114.459 90.245 61.361 131.758 -77.285 90.357 46.977 140.746-102.356 89.444 48.181 126.063 -22.392 90.025 61.765 146.255-105.948 87.864 45.321 132.016-151.147 92.949 101.457 102.005 -79.806 92.571 0.000 128.671 -76.696 # 865 total E -1.50650E+02 rmsd from N 0.000 %NC 0.00 93.293 171.731 139.644 -98.270 94.091 54.443 135.411 44.337 92.001 44.194 105.397 -80.135 92.003 49.331 130.651 -77.484 91.621 45.878 148.879-144.937 92.941 40.378 60.386 -70.823 92.689 42.970 124.971 -31.479 92.176 43.538 136.400-107.897 90.090 51.891 144.494-165.046 87.192 50.133 78.368-103.759 92.060 157.098 131.468 -80.373 89.948 94.456 107.579-137.937 93.830 69.828 104.795 -85.175 92.711 -84.080 148.506-106.161 107.131-116.996 139.284-150.858 92.189 45.970 156.936-133.582 91.132 49.258 135.156 -81.643 90.414 49.948 131.266 -38.329 90.576 43.923 122.047 -78.887 89.700 49.391 131.026 171.298 87.517 56.586 0.000 0.000 89.483 43.625 104.661 -79.775 91.898 44.084 144.674 -66.014 92.383 41.103 121.618-127.295 90.640 49.368 113.033 -78.689 90.104 49.503 134.165-100.144 92.600 47.278 134.800-163.923 92.643 29.268 142.288-131.074 107.928 15.922 149.564-120.254 131.260-118.060 117.456-116.860 139.942 48.042 124.600 -84.508 111.592-127.661 135.043 -24.048 96.561 42.840 117.159 -71.351 93.877 42.547 128.969 -76.519 89.434 48.705 155.689 -18.048 90.723 48.914 108.991-122.151 88.860 47.950 134.511-120.376 89.698 48.065 128.143 -76.991 92.515 93.881 97.012 -67.210 86.981 -77.874 129.197 -76.761 91.144 -45.749 145.984-133.272 88.814 -48.500 130.605 -19.186 91.317 -54.789 159.915-133.660 91.102 -36.470 127.650-162.387 98.991 84.472 99.834 -79.435 92.451 0.000 129.200 -76.215 # 866 total E -1.47697E+02 rmsd from N 0.000 %NC 0.00 92.929 147.907 138.737 -89.123 93.305 50.977 122.568 -30.871 93.245 45.875 105.489 -81.110 92.682 44.650 128.105 -75.028 91.404 45.270 107.240 -78.660 89.857 46.457 89.328 -66.036 87.994 48.031 118.047 -64.887 87.735 45.738 120.083-102.413 89.308 56.018 119.868-102.670 85.277 54.862 95.508-101.164 90.739 59.340 123.588 -92.234 98.429 -69.404 100.595 -90.168 114.785 173.831 108.530 -83.392 143.992-155.624 169.677-165.905 106.246-116.643 142.467-158.870 94.130 47.539 139.278 136.652 91.176 47.742 134.530 -86.307 90.400 50.545 124.192 -69.507 91.217 48.130 128.238 -29.898 92.502 41.333 108.560 -82.670 91.525 45.352 0.000 0.000 90.116 58.013 107.295 -84.160 88.556 48.345 142.509 -79.023 91.070 39.557 118.680-125.004 91.104 52.159 108.543 -74.546 91.665 68.353 139.212 -89.004 91.615 41.348 136.511-133.366 92.017 39.455 115.992 -89.985 97.767 83.884 112.775 -85.718 92.718 61.076 105.633-108.473 91.051 29.816 113.655 -78.587 101.981 119.820 137.119-117.946 130.845-104.173 125.009 -79.806 94.752 -37.561 127.800 -75.521 95.469-104.496 101.542 -75.458 88.440 63.459 121.635 -22.207 92.785 53.985 153.333 -26.582 90.077 43.998 128.091 -76.308 89.503 53.765 110.683 -40.864 89.491 52.092 129.005 -75.602 89.500 44.026 145.401-111.131 91.157 43.861 126.879 -38.535 91.536 52.841 137.873 -75.905 90.067 43.957 139.763-136.272 95.047 78.328 103.892 -80.752 92.451 0.000 128.851 -76.696 # 867 total E -1.46832E+02 rmsd from N 0.000 %NC 0.00 92.611 1.666 133.618 -90.742 112.824 -31.282 140.803 -34.707 94.675 -65.800 110.375 -88.204 110.093-100.020 144.916 -71.578 91.000 67.781 145.904-151.855 93.381 43.324 117.981-146.109 91.262 44.886 50.722-115.802 90.254 50.847 144.008 -77.953 88.579 48.037 126.464-114.552 89.292 42.091 89.542-101.850 93.977 59.057 133.729 -93.444 100.089 -55.294 100.975-101.346 115.923 170.794 107.012 -86.171 145.751 171.439 167.207-174.403 106.187-107.819 143.592-159.715 93.616 47.370 140.503 142.089 91.297 47.578 134.439 -86.395 90.196 51.074 120.860 -66.226 90.602 47.548 126.134 -32.409 91.362 42.718 109.392 -82.312 91.913 43.915 0.000 0.000 89.526 54.424 113.483 -82.000 89.163 46.542 133.793 -79.498 89.461 42.314 122.971-123.082 89.521 51.067 108.553 -75.673 91.644 47.516 137.387 -85.527 91.810 40.218 134.489-151.315 94.694 42.613 114.931 -88.556 117.114-169.627 106.891 -75.676 92.932 73.448 132.538-158.542 90.854 49.711 113.471 -76.512 89.816 51.659 153.275 -20.501 87.733 50.974 114.174 -72.123 89.248 46.593 128.721 -76.211 87.612 47.441 107.192 -85.652 88.166 50.185 137.187 -97.861 88.052 51.744 142.935-145.162 87.978 46.438 127.986 -76.412 87.200 54.395 101.400 -53.342 89.976 47.303 126.594 -75.206 89.652 47.958 140.165-116.754 91.767 64.322 127.372 -41.963 89.762-109.999 141.442-101.733 98.249 -17.695 138.267-142.070 113.324-145.816 106.058 -77.022 92.965 0.000 129.470 -76.410 # 868 total E -1.48199E+02 rmsd from N 0.000 %NC 0.00 93.019 156.837 138.083 -88.051 92.774 55.711 119.528 -28.472 93.128 44.904 105.189 -82.063 92.705 44.603 128.368 -74.927 93.477 43.089 111.635 -83.323 93.803 39.329 62.006 -64.823 91.898 44.077 120.796 -29.452 91.434 48.176 137.613 -93.883 88.776 42.145 139.933-134.465 92.549 40.915 68.859 -96.245 93.009 48.112 139.717 -52.383 106.364-148.286 97.224 -93.990 104.258-153.829 98.381 -87.392 147.400-139.260 176.443-176.407 105.220-104.190 136.658-143.991 93.475 48.713 146.234 149.276 92.149 46.221 133.988 -84.873 90.299 50.815 147.836 18.930 90.079 46.301 128.249 -36.805 91.009 42.848 146.303-155.207 92.465 44.416 0.000 0.000 90.600 43.904 142.069 -35.169 91.575 51.471 134.572 -90.304 88.258 49.482 123.688-128.918 88.645 47.736 107.765 -78.221 90.431 51.838 142.877 -93.329 90.338 46.659 130.080-147.815 94.072-105.821 104.622 -85.433 109.672-176.345 112.566 -78.127 134.685 -80.058 110.885-103.806 108.204 -22.260 113.169 -78.813 93.641 -43.410 113.777 -38.539 102.579 -22.637 114.836 -71.032 100.060 -39.474 128.291 -76.987 98.235 -27.808 103.695 -85.742 97.498 -40.375 125.927 -81.672 92.694 -46.329 146.390-111.753 91.075 -50.456 139.036-108.340 91.876-122.231 126.683 -21.625 91.106 53.087 131.592 -76.667 90.890 49.390 144.165-122.679 91.508 65.337 133.317 -50.141 90.680 -99.475 142.512 -49.021 100.420 -20.273 110.404 -85.600 118.970 92.841 147.558 -19.197 92.494 0.000 129.553 -76.675 # 869 total E -1.48716E+02 rmsd from N 0.000 %NC 0.00 93.503 175.805 141.007-104.971 94.183 53.376 133.101 45.185 91.913 44.726 105.787 -79.989 91.829 47.146 130.469 -77.549 92.206 47.835 146.899-143.664 92.369 42.621 56.876 -68.286 90.979 44.746 130.299 -26.266 90.603 48.079 131.638-118.262 87.987 52.222 137.503-156.909 86.811 55.585 78.073-104.145 89.417 125.230 135.711 -84.734 91.121 79.859 100.857-123.772 90.243 97.307 97.985 -84.828 92.544 -72.022 111.390 -80.268 99.405-112.878 138.555-140.055 90.243 56.538 142.199 116.590 91.842 47.088 134.114 -85.489 90.294 47.085 148.459 0.497 89.950 50.327 136.114 -18.138 88.531 50.287 142.638-155.955 89.656 45.260 0.000 0.000 89.590 49.678 114.708 -76.566 89.352 47.542 142.266 -80.657 90.130 44.088 121.880-129.124 88.681 49.581 104.549 -72.069 91.465 49.979 136.667 -51.320 91.108 50.808 135.534-127.510 91.491 38.351 114.808 -89.490 100.851-113.809 106.926 -79.046 93.009 -48.515 94.376 -87.549 89.502 -61.792 117.446 -72.724 89.978 -44.110 113.742-134.623 91.017 -49.613 113.172 -74.250 93.829 99.177 129.679 -76.249 108.051-107.431 110.835 -86.394 130.092 -81.069 155.954 2.449 115.863-122.652 151.658 -36.099 90.297 52.570 129.228 -75.870 91.357 48.687 135.703 -84.756 90.474 43.969 130.999 -76.538 91.317 43.165 139.941-111.263 90.523 49.566 129.962 -46.472 89.227 54.225 134.211-111.783 90.014 42.468 127.765-125.196 95.531 73.553 103.957 -80.316 92.549 0.000 128.991 -76.735 # 870 total E -1.48343E+02 rmsd from N 0.000 %NC 0.00 117.210 139.075 153.129 -97.478 93.534 56.138 133.926 53.359 92.023 43.825 106.884 -82.335 91.831 47.333 129.807 -76.557 92.694 45.380 156.672-155.783 94.248 40.629 59.134 -69.715 91.042 44.955 126.084 -33.954 88.886 61.174 132.926-106.918 87.380 63.405 119.801-104.862 81.361 163.368 92.071 -97.449 95.221 62.400 131.927-149.718 93.691 48.587 93.924-124.200 94.591 72.709 107.202 -87.299 94.049 -73.996 144.217-109.703 114.530-116.817 142.270-159.072 95.012 44.492 148.152 171.432 92.767 45.727 135.793 -84.638 89.995 51.288 123.918 -62.359 91.480 54.621 109.445 -43.049 91.057 40.446 149.950 -13.410 90.843 46.041 0.000 0.000 90.055 64.658 105.195 -82.303 86.207 47.744 142.635 -80.690 89.515 43.374 117.560-126.543 90.365 51.680 106.763 -74.499 90.237 42.104 137.736 -79.625 94.174 50.080 137.567-152.298 96.702 8.546 113.892 -91.252 111.691 128.329 112.743 -75.328 135.127 -67.434 115.530-111.274 101.437 -37.990 113.227 -81.971 95.432-123.910 129.017 -33.367 92.994 51.960 134.462 14.045 91.914 51.695 129.575 -76.063 88.797 43.954 102.309 -76.123 90.670 50.797 141.507 -35.662 90.236 47.813 165.891-144.372 92.155 36.550 128.316 -76.651 91.343 50.786 114.344 -64.031 90.274 66.309 130.554 -77.525 87.222 49.547 143.575-124.212 90.285 46.275 129.005 -39.527 93.629-109.288 134.148 -52.253 115.656 21.117 113.562 -84.595 132.917 96.898 112.007 -75.094 92.501 0.000 130.177 -76.231 # 871 total E -1.50189E+02 rmsd from N 0.000 %NC 0.00 93.190 163.200 140.621 -98.604 93.480 54.826 140.388 25.006 92.001 45.798 106.480 -83.153 92.290 49.285 130.540 -76.796 93.704 41.764 145.209-124.276 91.058 44.359 60.734 -76.067 90.292 46.644 118.778 -41.555 90.777 45.864 126.800 -91.981 90.112 43.399 138.622-115.132 95.925 103.268 85.790-101.598 94.321 -56.793 143.318-110.461 98.396 -49.498 92.758 -92.037 90.989 -51.296 141.065 -8.895 128.622-124.556 164.138 -2.117 102.242-110.741 140.218-157.441 93.713 52.373 136.120 129.440 91.564 46.926 138.346 -94.694 90.818 49.728 135.130-116.786 89.088 53.829 137.997 -25.209 88.446 51.848 142.273-141.343 90.342 43.084 0.000 0.000 89.751 55.114 115.501 -74.964 87.033 49.274 140.176 -84.017 89.212 46.385 122.000-130.080 89.017 48.368 112.158 -75.661 90.676 46.499 138.811 -99.515 92.034 55.362 132.760-146.231 92.857 -88.550 104.070 -84.513 116.512 158.116 159.480-146.875 123.208-175.639 119.041-124.687 94.656 56.949 115.121 -76.595 92.294 45.116 100.467 -47.200 90.640 50.633 112.410 -69.947 90.401 43.964 129.345 -77.386 90.396 45.887 104.877 -85.643 89.551 49.824 132.284 -86.849 89.066 53.504 136.621-113.440 88.167 44.676 128.176 -76.841 90.424 70.349 105.519 -72.145 89.556 -98.598 129.423 -77.272 97.530 -51.475 139.608-112.673 95.674-124.143 111.557 37.325 110.598 -76.628 155.128 -26.326 96.679 -20.291 144.026-131.835 100.467 47.930 101.727 -73.678 92.465 0.000 129.287 -76.474 # 872 total E -1.50761E+02 rmsd from N 0.000 %NC 0.00 93.137 -65.823 126.853 -76.190 94.195 -49.171 115.896 -77.737 91.409 -45.394 103.438 -77.491 90.676 -47.531 128.256 -75.656 90.372 -41.961 139.676-123.511 92.630 -41.353 59.557 -62.483 93.810 -42.013 131.260 36.925 99.295 -35.500 169.958 169.869 92.857 -57.340 120.323-118.385 89.303 -86.817 136.575 -14.351 91.423 127.010 140.841 178.090 97.521 22.379 91.579-117.953 103.910 96.475 106.384 -78.569 130.086-135.582 165.108 -4.336 104.491-114.702 138.418-147.544 93.806 47.881 136.948 144.565 91.843 46.109 133.586 -86.943 90.126 52.090 141.831 -64.463 90.181 50.557 111.805 -30.213 88.937 45.403 109.270 -81.403 88.805 52.133 0.000 0.000 89.040 53.700 148.667-139.905 89.198 41.825 136.702-101.194 90.518 44.405 117.587-126.061 89.113 61.901 113.841 -77.916 87.992 54.762 140.692-109.287 90.147 36.267 133.703-142.448 97.351 -96.250 143.993-129.399 119.875-171.880 111.321 -77.426 100.888 -70.678 97.389 -93.718 94.755 -46.013 113.644 -77.891 96.765-117.653 124.782 -28.270 92.685 50.354 124.298 -7.633 91.548 49.199 129.712 -75.970 90.073 42.153 104.082 -82.419 91.760 45.156 121.569 -31.500 92.085 43.469 136.640 -60.430 92.489 39.484 128.740 -77.294 93.818 96.016 106.291 -86.950 90.518 -72.228 129.213 -77.582 92.588 -53.726 145.499-147.831 91.450 -43.862 126.679 -15.530 95.902 120.331 143.769 -36.503 99.926 17.086 142.978-161.545 99.997 43.825 106.282 -77.989 92.445 0.000 129.384 -76.200 # 873 total E -1.48169E+02 rmsd from N 0.000 %NC 0.00 93.018 -48.372 130.608 -93.054 94.427 -47.751 121.115 -89.224 90.455 -47.304 101.732 -78.289 89.110 -49.097 129.052 -75.545 91.638 -41.836 139.388-132.394 92.897 -42.186 60.919 -63.520 91.648 -39.178 134.276 40.271 101.076 -44.604 164.927 171.785 89.776 -47.969 146.169-118.436 97.987-111.102 144.143 -3.841 96.089 50.247 143.037-147.103 93.146 53.337 96.755-121.156 90.569 55.073 101.247 -84.078 94.655-128.369 121.114 -57.895 105.511 -98.356 140.878-152.255 92.109 53.921 138.263 159.416 91.631 45.877 133.416 -87.941 88.950 57.600 155.277 -58.468 88.032 50.807 121.506 -40.652 88.699 46.202 108.908 -82.602 90.572 46.017 0.000 0.000 88.144 52.882 149.677-132.891 89.566 44.967 112.773-104.092 90.143 42.450 124.525-118.300 90.077 49.647 113.600 -75.761 90.258 45.036 135.051-100.853 93.088 49.643 130.723-140.716 94.640 -75.751 142.444-128.834 121.272 -97.745 113.615 -81.117 119.218 122.145 131.329-142.560 96.796 38.068 115.167 -77.965 92.237 47.585 106.701 -20.117 90.436 48.534 113.671 -80.108 90.254 48.021 129.268 -77.204 86.967 48.916 101.423 -83.318 87.955 57.201 110.831 -47.676 88.108 48.559 135.380 -44.076 89.235 43.056 127.974 -75.802 91.152 69.973 113.570 -98.405 88.487-106.702 129.706 -77.035 95.599 -40.538 147.048 174.314 93.307 -83.198 125.822 5.224 91.765 83.502 149.436 -27.452 94.092 49.203 143.378-156.514 95.510 68.147 97.196 -79.030 92.481 0.000 129.258 -76.409 # 874 total E -1.47361E+02 rmsd from N 0.000 %NC 0.00 93.238 -71.553 130.076 -80.906 121.771-100.488 132.709 -30.431 93.371 44.044 109.019 -76.290 93.735 47.587 130.612 -77.202 93.586 41.412 142.782-125.208 92.364 43.700 75.739 -99.457 91.111 44.446 109.117 -79.120 89.742 47.270 138.870-105.674 88.341 51.779 127.586-124.588 87.678 52.820 78.748 -96.195 90.968 148.382 132.921 -71.013 92.346 76.634 127.231-151.021 94.927 107.652 98.784 -83.306 92.670 -61.156 140.929 -52.185 96.992-127.122 143.737-141.346 91.785 49.049 134.089 125.572 91.556 46.578 135.010 -86.123 90.734 47.691 141.946 -53.381 90.073 48.269 142.212 -22.032 90.333 45.288 142.273-154.960 90.200 44.928 0.000 0.000 89.463 54.421 109.292 -81.028 88.028 49.032 142.507 -82.387 90.339 42.361 119.977-128.932 89.166 51.656 112.822 -76.113 90.766 59.441 138.046-105.166 90.197 53.651 135.465-104.791 92.725 -1.657 142.289-131.400 127.938-179.636 107.431 -80.459 96.951 44.112 134.766-158.020 95.360 43.455 114.502 -77.906 92.707 52.927 143.757-139.409 94.130 119.662 108.455 -72.261 92.098 46.983 128.780 -76.325 94.817 40.332 101.810 -81.862 95.274 118.049 119.937 -45.440 94.578 -43.237 134.813 -84.140 92.495 -56.607 129.278 -77.398 92.722-125.411 117.722-155.164 90.934 52.145 131.510 -77.308 90.697 50.914 141.223-106.084 90.420 48.824 122.905 -28.657 93.238-127.196 132.872 -53.616 97.476 -18.778 135.820-139.863 129.726 89.880 107.401 -78.007 92.416 0.000 129.881 -76.168 # 875 total E -1.51024E+02 rmsd from N 0.000 %NC 0.00 93.115 -68.491 128.404 -75.442 122.036-101.971 132.046 -40.316 92.876 43.606 109.658 -80.136 93.354 48.299 130.880 -77.670 94.299 42.254 152.845-139.297 93.084 44.432 70.619-101.894 88.980 47.446 115.470 -76.829 89.792 60.643 126.712-107.404 86.238 52.127 131.461-130.870 88.340 174.831 81.444 -90.680 94.727 76.718 150.048-154.248 94.791 43.385 93.372-127.043 93.058 44.411 110.021 -89.464 91.749 53.798 139.755-113.827 89.679 54.338 125.992-157.435 90.180 57.981 124.139-124.095 94.144 -76.209 126.622 -87.426 126.638-130.178 137.310 -48.935 94.655 42.145 142.558 -8.520 94.152 45.067 143.352-171.882 89.805 46.548 0.000 0.000 90.615 48.808 101.610 -84.486 89.723 47.187 148.901 -74.261 91.270 40.258 119.050-129.159 90.175 49.342 113.260 -78.202 89.643 60.868 142.081-109.343 89.590 42.103 145.364-136.049 92.683 44.574 152.611 -21.890 98.333 -8.546 120.194 -92.059 131.743-152.477 112.751-106.389 96.006 47.175 114.240 -77.413 90.626 70.292 100.482 -16.435 90.517 56.733 112.033 -9.568 89.424 46.236 130.751 -76.651 88.732 47.564 104.844 -84.640 89.895 50.708 120.944 -25.232 91.446 41.157 135.535 -53.498 93.606 39.922 129.989 -77.392 95.928 120.886 109.070 -90.986 92.122 -49.633 129.813 -77.935 92.661 -43.121 141.974-122.089 90.039 -45.112 125.418 -11.750 92.928 -54.660 157.613 -21.085 90.433 -44.674 114.733 -91.142 95.738 96.248 105.245 -79.322 92.520 0.000 128.961 -76.486 # 876 total E -1.46499E+02 rmsd from N 0.000 %NC 0.00 93.130 -66.495 125.023 -69.882 93.922 -49.798 110.748 -73.690 93.029 -39.348 103.190 -76.525 93.263 -42.251 128.830 -76.006 100.164 -18.686 133.962-106.227 105.304 -38.680 65.133 -66.550 93.334 -23.418 135.411 -31.614 112.077 -22.821 165.246-100.787 102.970 -60.029 115.319 -87.296 88.683 25.290 122.097-130.665 132.427-156.373 137.266-148.386 92.750 76.684 93.872-136.376 94.590 91.963 101.641 -84.718 93.801 -64.084 139.635-101.444 107.139-124.847 137.957-148.815 91.474 51.693 156.495-117.188 92.097 47.552 134.692 -78.884 90.683 46.521 122.532 -36.717 90.726 48.492 115.146 -83.296 89.275 52.075 141.124-163.196 89.667 46.127 0.000 0.000 90.419 47.419 148.516-120.822 89.800 45.990 140.408-100.644 90.453 43.984 118.686-131.015 89.754 47.862 114.057 -77.855 90.915 47.520 131.964-101.923 92.925 56.410 131.200-143.175 92.631 -93.978 139.603-117.248 107.828 173.055 152.923-136.096 129.704 -74.232 118.583-120.408 122.203 -16.774 117.898 -81.300 101.188-141.821 108.814 -57.712 94.619 48.585 134.401 -38.967 92.566 49.553 129.859 -76.249 90.029 44.641 142.630 -11.034 93.779 87.466 128.436 -82.554 79.404 -88.998 152.898-140.281 92.292 -34.697 131.659 -77.961 99.897-132.805 117.434-111.313 91.276 52.471 130.628 -77.127 91.701 48.217 140.619-103.874 89.866 48.267 121.017 -12.723 90.898 57.028 134.613 -89.948 88.725 44.056 139.271-161.359 94.691 91.179 102.963 -80.000 92.442 0.000 128.938 -76.425 # 877 total E -1.46801E+02 rmsd from N 0.000 %NC 0.00 93.230 -67.336 129.259 -82.940 96.476 -41.118 114.344 -86.313 92.254 -58.216 103.464 -77.006 90.923 -12.233 130.801 -77.103 120.131-126.964 162.564 156.362 117.595 13.616 68.573 -76.025 91.841 60.031 122.751 -40.822 92.104 42.689 139.578-104.234 88.307 50.086 139.570-158.603 88.373 55.685 74.779-103.444 90.648 141.213 134.043 -74.791 92.589 86.436 125.482-148.441 93.970 100.746 98.060 -85.010 92.183 -69.832 132.169 -83.543 99.954-116.856 136.502-141.336 91.103 49.371 132.461 103.806 90.722 47.135 134.035 -85.608 89.727 50.586 135.544 12.784 89.667 48.024 140.396 -4.532 89.475 44.488 152.879 -18.815 88.995 50.047 0.000 0.000 88.268 52.030 129.714 -37.176 88.172 48.208 140.981 -81.015 89.407 45.400 124.425-130.410 88.471 50.032 105.664 -71.907 89.808 50.780 135.889 -46.463 90.547 44.184 135.480-129.413 92.300 39.279 112.789 -88.866 97.095 132.134 112.860 -78.163 125.323 163.799 125.599-130.585 94.391 -22.851 113.725 -78.108 101.887-123.836 131.790 -16.785 90.945 52.825 134.342 -20.847 91.304 55.412 130.935 -77.380 87.793 45.910 107.664 -83.834 88.290 56.273 139.458 -99.258 88.444 63.898 144.908-164.434 87.667 41.476 128.018 -76.282 91.604 151.505 91.045 -74.426 92.399 62.360 133.200 -78.397 89.753 44.880 141.662-106.880 91.796 62.731 126.653 -26.189 91.327-104.106 140.489 -54.713 102.500 -27.650 108.486 -85.104 118.365 119.006 105.579 -72.625 92.491 0.000 129.834 -76.279 # 878 total E -1.48609E+02 rmsd from N 0.000 %NC 0.00 92.969 147.704 139.556 -92.676 93.914 46.729 118.928 -24.363 92.449 47.080 105.263 -80.668 92.046 45.989 128.260 -75.366 92.012 46.886 111.211 -78.784 89.687 45.063 88.528 -68.297 87.747 47.390 122.470 -72.369 87.839 50.990 114.216-108.891 86.375 52.798 120.077-104.396 86.569 47.716 91.017 -98.676 91.440 56.740 128.211 -86.048 100.255 -57.561 98.876 -93.401 117.072 170.807 108.834 -83.742 147.853-171.133 171.291-170.234 107.308-114.366 143.482-162.355 94.271 47.361 139.829 134.370 90.959 48.154 134.675 -86.675 90.211 51.173 123.492 -74.136 91.331 48.225 126.977 -28.157 92.482 40.301 107.751 -82.697 90.955 47.426 0.000 0.000 90.363 55.285 105.454 -87.283 87.568 46.907 147.334 -77.067 90.492 42.363 118.728-129.670 90.163 51.505 111.611 -76.935 89.378 51.167 139.002-100.357 91.940 67.837 134.270-143.447 90.438 -77.425 106.101 -86.631 121.756 164.305 163.745-156.007 95.374 -58.165 95.781 -95.296 93.483 -43.288 111.777 -76.635 91.588 -44.411 111.397 -43.721 90.504 -48.006 112.831 -71.403 91.349 -43.565 127.739 -76.321 92.090 -38.914 97.363 -80.779 90.436 -47.592 125.074 -16.265 96.757 -28.029 157.832 -4.741 100.610 -47.175 129.328 -77.251 112.084-112.807 141.139 -16.962 92.261 48.741 129.905 -76.275 92.001 50.871 142.374-112.082 90.867 52.857 126.819 -27.791 92.437-134.077 132.376 -86.858 96.034 49.232 135.372-137.089 121.840 26.435 103.930 -79.418 92.393 0.000 128.663 -76.106 # 879 total E -1.49678E+02 rmsd from N 0.000 %NC 0.00 92.917 157.104 136.292 -81.460 92.597 61.372 152.026 124.338 93.314 42.606 108.262 -80.708 93.460 47.842 131.623 -77.162 93.454 39.435 153.431-148.797 91.943 46.677 70.228-100.163 89.714 46.778 112.917 -72.203 89.687 48.949 133.429-101.022 88.539 55.156 138.351-142.479 89.223 177.291 84.892 -95.742 110.013 56.519 142.803-150.679 92.973 56.661 94.947-122.112 92.605 56.373 104.619 -84.589 95.578-114.941 127.882 -84.023 103.549-113.084 141.047-154.048 93.495 48.689 144.085 152.229 92.256 46.243 135.285 -85.882 90.580 48.752 122.081 -55.780 90.851 50.428 108.974 -32.460 90.263 45.430 153.171 -16.357 90.048 46.306 0.000 0.000 89.903 53.975 110.216 -82.317 87.973 46.073 141.287 -73.717 90.574 43.052 122.710-127.519 89.865 50.786 110.894 -76.744 90.227 43.742 134.372 -94.864 92.809 59.301 135.480 -60.793 94.131 -8.229 106.965 -86.652 120.174 42.202 156.363 -13.423 131.081 39.234 112.276-108.073 123.793 -71.362 123.854 -84.689 118.452-125.330 138.082 -18.919 93.783 47.095 113.993 -75.228 92.434 49.327 129.024 -76.097 89.662 43.099 105.661 -74.408 91.461 53.084 176.440-164.317 89.821 40.294 129.863-150.945 92.039 38.974 127.775 -76.110 91.840 52.470 139.523 -91.932 90.231 44.922 129.828 -77.335 91.694 38.547 137.907-125.721 91.883 48.601 129.281 -44.372 90.634 54.703 130.690-113.872 89.039 42.883 130.532-153.382 95.059 79.805 103.004 -80.153 92.509 0.000 129.001 -76.571 # 880 total E -1.46833E+02 rmsd from N 0.000 %NC 0.00 93.171 -67.321 128.477 -81.189 94.405 -46.390 110.380 -76.491 90.624 -46.450 104.006 -73.388 91.440 -42.199 130.861 -77.067 95.774 -38.945 139.289-123.735 97.234 -39.031 56.738 -62.605 90.994 -42.873 140.412-125.802 97.218 -45.159 171.087-170.070 88.036 -45.364 150.038 -96.692 96.976-115.050 137.773 6.680 96.264 42.234 144.516-129.299 94.494 56.131 97.632-118.612 89.584 68.076 100.778 -83.518 96.079-128.311 111.208 -77.989 103.184-103.892 140.031-155.320 93.429 50.504 146.224 167.568 92.822 45.068 134.001 -86.221 90.039 52.274 123.431 -56.719 89.973 52.719 107.659 -40.962 90.089 44.806 109.761 -82.298 91.826 41.523 0.000 0.000 89.866 57.762 113.546 -81.871 88.138 50.021 130.593 -77.823 90.183 42.542 124.124-122.322 95.238 111.464 110.486 -77.058 93.897 -35.275 154.152-131.637 94.808 -62.664 133.922 -83.419 89.987 -26.872 142.161-125.038 108.796-159.191 153.148 -14.422 92.740 -51.165 97.019 -93.618 89.552 -50.482 111.767 -75.438 90.097 -48.962 115.436 -39.046 89.017 -45.488 118.815 -72.466 91.011 -45.787 127.714 -76.145 88.520 -49.647 101.996 -79.935 89.289 -48.882 144.149 -24.670 92.349 -40.591 161.756 171.824 94.170 -49.881 128.122 -76.775 99.077-107.893 125.392 -68.677 91.301 55.796 128.854 -76.133 92.710 51.045 142.815-122.142 92.850 84.388 129.795 -24.551 88.469 -82.200 139.879 -92.409 94.315 -46.516 133.905-135.634 95.190 -4.267 105.180 -78.627 92.425 0.000 129.928 -76.137 # 881 total E -1.47188E+02 rmsd from N 0.000 %NC 0.00 117.679 144.437 153.129 -99.122 93.574 57.157 135.295 47.194 92.507 43.712 106.992 -81.978 91.824 47.367 130.665 -77.056 92.653 44.298 152.739-146.868 92.834 44.428 57.258 -67.726 89.396 46.759 126.889 -29.269 89.258 52.380 128.891-111.462 87.304 47.453 131.228-121.905 89.154 45.054 78.781 -98.960 91.450 98.322 142.481 -80.009 92.466 107.435 130.779-154.072 89.563 125.864 103.518 -88.008 109.772 -25.395 140.955-116.418 103.577-122.082 135.404-160.777 95.933 42.245 151.896 158.795 93.022 45.782 135.215 -83.939 90.257 50.286 124.253 -57.929 91.772 55.615 129.650 -47.183 89.048 41.370 152.386 -13.495 90.570 45.889 0.000 0.000 90.269 55.857 108.406 -83.007 87.527 46.605 145.105 -82.284 89.874 43.267 119.411-128.956 89.424 51.719 113.144 -75.617 89.709 49.977 136.934-104.203 91.424 49.165 132.594-152.524 93.501-102.417 102.491 -83.376 103.936-156.537 156.343-149.628 103.821 -58.931 94.595-117.643 96.886 -28.972 112.955 -78.705 99.967-118.333 127.161 -53.736 93.360 69.208 116.110 11.054 90.517 56.818 130.973 -76.888 89.982 42.385 99.854 -80.066 90.431 48.188 143.060 -35.480 89.941 53.136 168.266-167.980 89.884 40.652 128.368 -76.937 90.426 46.871 113.504 -56.704 90.878 51.871 129.190 -77.325 90.442 56.172 149.254-132.303 89.764 113.320 133.471 -53.061 92.946 -38.018 125.293 -90.520 97.012 -61.192 106.733 -84.377 95.521 119.617 105.987 -78.778 92.474 0.000 128.882 -75.828 # 882 total E -1.51258E+02 rmsd from N 0.000 %NC 0.00 93.301 -72.930 131.287 -90.281 94.694 -45.218 118.794 -80.000 90.276 -50.078 102.790 -75.717 90.279 -45.522 129.629 -76.317 91.446 -46.519 144.558-147.377 91.976 -39.068 55.577 -68.308 94.248 -96.542 124.587 -40.382 90.478 75.191 139.080-107.116 95.891 66.458 143.520 174.683 90.089 108.900 122.213 -2.672 93.629 -68.305 117.538-116.654 96.961 -55.473 96.098-104.407 93.467 -69.913 105.124 -79.558 111.539-160.214 150.344 -22.794 106.221-116.268 143.541-153.504 93.232 46.783 148.969 133.874 91.785 47.131 133.472 -84.639 90.994 46.802 124.584 -62.004 91.989 47.545 104.919 -25.475 91.566 41.988 106.394 -81.371 90.346 49.246 0.000 0.000 92.408 43.846 100.455 -82.785 91.495 43.757 147.800 -70.231 92.491 39.383 117.096-125.139 92.268 47.396 112.732 -78.141 91.997 43.103 134.546 -98.552 94.165 49.099 139.278-153.348 93.344 26.012 142.829-130.894 109.717 55.175 114.942 -86.630 139.731 177.903 107.668 -93.696 94.701 43.770 115.114 -77.320 90.955 53.685 99.494 -9.422 88.052 58.080 123.448 0.552 89.338 46.266 128.680 -76.868 89.416 46.038 105.003 -84.002 89.428 52.344 120.568 -20.288 88.843 48.967 133.141 -57.390 89.391 44.265 128.126 -76.257 91.956 86.841 118.108-112.215 85.739 -84.534 129.776 -77.121 92.430 -48.444 140.411-121.182 88.115 -47.675 113.322 23.387 91.217 -53.484 147.080 -42.327 90.595 -60.137 105.658 -78.999 90.950 88.815 104.921 -79.137 92.562 0.000 128.769 -76.779 # 883 total E -1.47136E+02 rmsd from N 0.000 %NC 0.00 93.390 173.958 139.105 -97.234 93.987 54.666 133.501 35.637 92.425 43.966 106.144 -82.458 91.194 49.156 132.612 -77.951 91.629 46.519 147.535-134.857 91.750 41.089 57.975 -67.789 90.418 48.982 122.784 -29.166 89.436 49.645 132.755-108.162 86.952 48.198 138.970-160.568 88.426 51.630 75.753-103.739 89.073 140.658 140.139 -82.777 91.189 91.977 104.373-135.286 91.648 65.373 101.697 -87.512 94.564 -82.095 134.244 -89.944 113.030-113.481 140.205-150.324 92.485 47.615 159.746-144.937 91.129 49.725 134.736 -82.311 89.885 50.970 144.293 -18.107 90.472 45.753 124.647 -78.752 89.431 48.349 134.370 173.257 87.150 58.086 0.000 0.000 89.386 46.088 101.349 -81.285 90.896 44.955 147.081 -64.538 92.287 40.629 119.679-126.799 90.602 51.236 111.418 -77.816 89.681 61.276 132.431 -94.163 90.952 42.243 139.084-121.569 93.256 40.498 143.135-130.371 101.058 9.694 142.773-107.454 134.426-117.639 113.069-106.809 126.989 36.487 120.017 -81.758 92.076 -67.129 110.842 -42.445 90.709 -43.865 119.918 -73.784 91.908 -52.982 126.801 -74.955 87.532 -38.711 101.391 -84.718 99.527-109.229 144.173 -17.189 90.133 62.543 146.018 -95.674 90.942 43.554 137.353-102.471 91.739 86.772 119.591-137.124 90.925 -70.612 129.281 -77.421 97.251 -54.314 140.817-114.319 97.509 -7.534 121.266 6.827 107.284 -61.809 148.812 -37.592 91.697 -26.936 144.029-162.219 107.140 106.439 104.246 -79.259 92.574 0.000 129.558 -76.516 # 884 total E -1.53433E+02 rmsd from N 0.000 %NC 0.00 119.088 157.652 153.127-112.484 93.337 56.074 143.332 23.492 92.780 45.275 105.897 -82.069 92.279 45.845 130.680 -77.125 94.737 45.548 138.617-115.473 92.131 40.594 57.906 -75.559 91.924 44.738 124.083 -37.238 92.562 41.709 131.371-103.828 91.155 49.693 138.016-127.388 88.347 47.878 82.160-102.159 93.499 157.669 127.849 -80.490 91.395 75.410 130.551-156.570 94.599 117.173 98.699 -83.035 92.760 -61.797 141.882 -50.596 93.442-126.367 141.702-137.701 90.855 48.310 135.819 128.099 92.194 46.736 134.951 -85.476 91.273 44.555 141.823 -45.168 91.388 46.997 135.344 -26.295 90.351 46.215 143.838-160.760 90.419 44.362 0.000 0.000 90.340 48.809 111.620 -80.455 89.586 46.139 142.523 -79.330 89.265 44.236 119.947-126.757 89.259 49.293 111.871 -80.889 89.959 50.038 138.862-107.562 91.312 48.362 135.149-126.321 92.834-107.224 103.057 -82.511 102.906 172.623 150.020 -16.976 105.591-160.690 88.662 -89.418 92.698 53.730 129.932 37.699 93.073 45.173 107.633 -34.591 91.317 44.273 131.205 -17.901 91.969 45.590 130.558 -77.473 90.986 42.972 101.874 -80.077 89.381 48.982 120.419 -57.416 88.943 57.552 139.210 -51.168 88.622 44.720 128.749 -77.093 89.679 178.013 104.922 -99.613 94.263 84.235 134.197 -78.550 90.743 47.326 141.497-107.784 92.541 53.250 126.777 -31.830 93.499-111.834 143.021 -49.656 98.284 -27.172 105.087 -83.464 107.800-108.800 108.134 -75.384 92.839 0.000 129.645 -76.073 # 885 total E -1.46891E+02 rmsd from N 0.000 %NC 0.00 93.081 -74.753 122.377 -60.402 119.161-104.497 130.829 -40.176 93.379 43.346 109.194 -81.422 93.378 45.874 130.385 -77.177 95.777 41.015 154.012-143.782 92.827 44.149 55.462 -78.089 90.279 44.366 121.603 -31.642 89.927 50.408 128.143 -97.370 89.030 44.682 133.819-112.762 94.762 101.801 84.477 -99.332 94.487 -53.431 142.704-102.489 99.685 -47.621 92.748 -85.619 91.450 -53.517 140.583 -22.122 113.976-111.996 164.011 -12.548 95.363-125.669 140.715-143.595 92.356 50.280 136.912 142.049 92.112 47.150 134.694 -84.950 90.602 46.179 132.447 -59.962 92.479 48.487 123.545 -30.558 92.402 43.142 148.920-158.035 90.401 44.930 0.000 0.000 91.325 50.851 104.027 -84.344 90.004 47.146 146.285 -73.715 91.877 38.801 118.684-127.024 90.956 50.087 112.827 -77.725 90.687 56.421 133.300 -97.602 90.222 49.792 144.444-146.947 91.943 24.820 113.080 -92.358 110.654 5.315 155.462-116.038 133.604-166.008 114.400-110.310 96.394 63.530 115.535 -76.857 92.147 51.059 105.876 -14.852 89.689 51.530 118.213 -75.223 89.326 48.919 129.657 -75.682 87.116 47.088 102.956 -84.816 89.903 46.601 113.707 -41.885 90.428 45.556 136.700 -49.899 92.073 39.553 129.771 -77.245 93.531 120.564 103.458 -92.530 93.448 -38.339 131.401 -78.814 95.544 -53.137 139.992-135.213 93.118 172.753 143.512-110.904 92.757 78.602 142.707 -49.478 90.457 44.719 141.471-150.083 95.049 89.095 103.357 -78.746 92.489 0.000 128.908 -76.447 # 886 total E -1.46775E+02 rmsd from N 0.000 %NC 0.00 93.303-178.682 140.946-106.583 94.430 51.415 129.010 32.148 91.649 47.289 103.037 -76.645 90.961 45.221 130.743 -77.975 92.298 49.397 140.458-128.166 93.858 39.285 54.359 -64.087 91.176 47.655 127.185 -2.588 90.290 46.515 123.846-112.256 91.319 50.941 123.349-115.937 90.835 114.754 92.392-101.247 95.849 -16.673 132.758-114.871 103.304 -71.256 96.845 -93.242 101.540-133.286 145.793 -17.366 123.858-137.047 162.762-151.302 112.101-104.432 108.400 -88.382 93.832 43.489 151.558 158.176 91.820 46.738 137.092 -84.413 90.095 51.587 133.902 2.861 90.103 46.766 127.616 -43.255 89.190 43.891 146.615-152.833 91.056 46.559 0.000 0.000 90.278 45.330 140.093 -22.049 92.151 40.451 133.753 -98.056 89.812 50.413 119.119-124.575 87.602 64.939 106.717 -78.169 88.355 53.256 134.751 -57.064 90.776 33.534 140.521-143.735 98.887 -98.864 144.955-129.118 120.074-166.981 165.330-160.753 104.609-120.653 92.484 -93.461 96.950 47.937 129.424 29.404 93.383 40.666 95.977 -29.687 91.669 51.559 135.638 -18.156 90.162 54.006 129.076 -76.628 87.789 44.345 132.495-106.057 91.163 42.734 133.706-100.315 90.605 53.150 147.662-128.004 90.056 50.877 128.139 -76.897 88.825 162.848 89.731 -77.563 92.587 62.530 132.865 -78.160 90.061 45.612 141.687-104.407 91.526 55.433 122.735 -22.549 92.684-109.213 141.803 -54.409 102.689 -22.323 108.368 -87.314 119.010 124.028 111.451 -76.446 92.584 0.000 129.513 -76.611 # 887 total E -1.52343E+02 rmsd from N 0.000 %NC 0.00 93.172 -65.892 129.665 -85.061 94.623 -46.969 117.386 -80.103 90.999 -47.375 102.998 -78.002 90.338 -46.633 130.134 -76.439 92.683 -40.442 143.131-134.916 93.513 -44.178 62.750 -70.630 90.305 -44.246 129.232 46.092 106.786 -58.010 167.419 162.449 92.138 -31.192 126.590-112.726 106.472-131.834 79.387 -80.183 120.125 66.213 141.716-141.795 95.700 50.273 91.180-114.721 94.968 78.226 113.329 -84.973 88.134-100.173 148.213-126.333 99.279-125.109 152.600 -25.748 92.606 43.707 138.662 154.471 91.934 47.021 137.850 -84.373 89.635 50.342 122.401 -60.626 90.239 54.511 114.907 -37.487 89.618 42.349 150.139-143.895 89.402 46.472 0.000 0.000 89.978 56.342 106.129 -85.628 87.138 47.566 143.773 -74.374 88.991 44.041 120.042-128.048 89.376 50.976 110.687 -77.784 89.430 49.231 140.547-102.012 91.407 48.341 134.532-141.165 93.334-101.633 103.519 -82.789 109.406 167.298 150.649 -16.440 105.439-166.684 89.635 -90.427 93.737 54.505 129.959 35.712 92.972 45.109 112.270 -43.192 91.184 46.081 136.632 -40.941 91.744 44.832 128.792 -76.136 92.223 46.076 103.717 -82.460 91.695 41.348 126.881 -74.986 92.560 51.409 122.878 -86.195 91.553 68.984 129.857 -77.810 88.332-172.493 88.394-105.081 92.705 62.983 130.868 -77.212 91.290 48.092 140.986-107.302 93.143 70.320 127.135 -20.385 91.481 -90.162 147.844-112.298 98.440 -36.654 103.959 -87.048 107.123 127.838 147.228 -19.196 92.562 0.000 129.540 -76.252 # 888 total E -1.46497E+02 rmsd from N 0.000 %NC 0.00 124.319-111.211 147.153 -43.654 125.077-100.762 127.907 -36.329 94.264 42.357 110.730 -80.838 93.585 44.806 130.676 -77.531 95.981 42.762 150.114-130.909 92.258 44.212 57.489 -80.390 90.685 44.658 124.847 -38.437 92.903 41.774 123.331-103.325 90.817 48.969 140.218-128.026 91.723 83.139 85.774-103.978 92.933-153.916 141.280-106.381 92.613 64.907 96.517-123.362 92.219 46.162 101.680 -81.078 90.422 52.188 146.093 -32.785 90.927 43.308 128.092-125.300 94.642 58.093 126.847-113.893 96.616-104.272 126.612 -67.456 91.696 118.107 100.877 -13.498 88.619 66.396 155.568-178.937 92.131 44.905 114.285 -85.548 89.671 43.038 0.000 0.000 87.551 59.937 135.691 -41.358 88.105 51.324 117.575-101.175 88.877 51.997 134.566-163.428 86.317 65.061 109.674 -72.001 89.322 47.334 129.363 -86.086 90.879 58.713 127.114 135.732 93.639 -65.157 104.046 -86.023 122.257 126.512 163.952-154.593 124.598 175.088 120.643-126.930 98.147 54.194 116.068 -77.434 90.819 54.173 107.811 -24.074 89.266 54.550 105.947 -74.832 89.483 49.491 128.019 -74.789 88.196 45.232 102.409 -84.699 91.606 44.062 113.200 -59.182 91.253 45.092 137.900 -53.410 91.113 49.459 129.321 -77.433 92.679 116.259 105.415 -98.501 89.193 -54.060 129.708 -77.851 90.633 -50.298 143.010-118.010 86.839 -54.876 130.366 -11.151 88.813 -54.797 161.041-145.942 90.022 -44.529 101.202 -85.882 95.086 104.045 105.152 -78.462 92.491 0.000 128.874 -76.361 # 889 total E -1.49542E+02 rmsd from N 0.000 %NC 0.00 93.353 -78.046 131.318 -89.882 94.572 -46.690 127.160 -74.864 91.191 -50.137 102.174 -78.987 90.459 -44.849 127.268 -74.694 91.593 -46.288 148.449 179.692 91.633 -47.614 109.576-129.548 92.424 120.739 73.160 -96.833 95.475 40.766 137.262 -92.326 90.308 69.431 150.467-169.683 100.449-158.909 73.118-102.124 116.924 58.278 149.560-146.225 92.622 49.301 95.299-119.220 90.414 52.672 100.470 -81.970 91.994 49.363 137.572 -54.772 91.051 45.624 137.381-125.881 94.507 39.147 127.400-111.406 104.452 -84.306 143.146 -41.207 120.801-159.471 132.148 -47.940 96.257 56.354 124.829 -52.973 95.382 45.791 144.563-164.242 96.335 34.453 0.000 0.000 94.126 47.845 114.380 -84.479 89.154 46.641 144.317 -88.850 90.181 47.144 117.336-126.879 89.459 45.483 107.273 -75.606 90.257 48.573 132.949 -76.626 92.757 44.385 135.637-139.115 93.437 40.659 143.078-130.499 97.078 40.576 114.261 -87.564 138.028-178.753 105.758 -93.437 96.249 43.630 115.357 -77.482 92.192 49.722 99.894 -8.464 89.590 52.415 119.938 -10.433 89.560 50.732 129.328 -76.470 88.145 45.810 103.812 -83.758 91.447 43.937 133.852 -34.426 91.220 46.335 140.161 -84.924 90.693 42.206 128.512 -77.296 91.991 88.995 113.456 -87.452 87.766 -80.586 129.503 -77.614 94.494 -46.499 147.015-144.907 91.631 -40.114 122.908 5.902 92.718 -66.521 143.618 -46.482 91.263 -48.134 139.001-170.487 97.548 42.647 99.046 -80.610 92.433 0.000 129.455 -76.278 # 890 total E -1.47082E+02 rmsd from N 0.000 %NC 0.00 93.193 -68.152 128.326 -80.587 94.524 -47.673 117.259 -72.709 90.959 -47.748 104.109 -78.097 91.022 -43.180 127.091 -74.790 91.405 -50.943 152.850-144.053 91.862 -37.133 94.118 -94.808 96.830 125.111 96.850 -86.594 100.148 43.166 174.664-170.472 86.819 53.097 134.328-176.684 92.569 52.476 70.558-102.498 90.666 130.604 150.127 -79.604 98.390 83.383 119.558-139.217 90.667 103.094 101.781 -86.836 94.816 -72.893 114.951 -95.748 99.109-116.466 136.354-142.171 90.781 55.413 143.204 128.595 92.043 46.506 134.817 -85.338 90.171 48.439 137.492 -35.490 89.600 51.394 130.064 -24.265 88.882 48.723 142.872-145.330 89.840 44.853 0.000 0.000 89.313 53.350 113.894 -80.176 87.902 47.868 137.899 -78.257 89.334 45.345 123.080-126.919 88.861 49.928 112.776 -77.035 89.849 48.251 139.049-105.012 91.579 49.024 133.053-132.316 93.200 -99.659 103.643 -82.910 113.464 167.178 151.580 -15.874 101.215-165.911 92.482 -96.981 95.426 51.428 129.085 40.816 92.754 45.737 119.111 -53.276 91.269 45.696 133.325 -37.568 92.264 46.695 129.299 -76.347 89.202 46.123 112.217 -86.499 89.481 46.758 128.471-102.057 90.293 61.358 147.013-139.915 87.936 46.701 129.249 -77.669 91.087 161.594 94.599 -99.448 92.749 50.305 132.270 -78.187 91.554 50.168 141.536-111.950 91.870 48.901 125.945 -25.959 92.729-124.753 123.328 -69.092 92.459 -37.570 106.216 -84.408 110.312 -60.185 107.342 -72.495 92.684 0.000 129.373 -76.438 # 891 total E -1.47541E+02 rmsd from N 0.000 %NC 0.00 123.027 -99.248 149.834 -58.700 120.003-103.650 133.272 -37.052 92.484 43.027 108.044 -80.753 93.350 51.677 131.077 -77.409 93.390 39.642 153.432-139.737 93.376 42.868 64.254 -92.580 88.998 48.799 111.544 -50.389 88.514 59.715 133.193 -91.673 85.061 47.256 135.169-126.959 89.865 43.191 76.460 -99.295 92.866 174.795 139.127 -76.300 92.527 58.139 112.827-161.354 103.242-140.699 144.167 -23.439 114.411-135.818 158.401-141.793 109.383-112.404 134.817-162.460 93.585 44.486 141.092-109.176 91.790 48.778 136.329 -74.252 91.064 46.972 125.111 -68.447 91.779 45.400 140.104 -25.084 93.319 42.142 142.695-164.906 91.262 44.033 0.000 0.000 90.691 54.834 105.498 -85.465 87.375 48.438 147.510 -81.927 90.458 42.918 117.940-128.774 90.458 49.201 109.935 -76.116 89.502 64.239 136.969 -93.241 90.988 57.384 139.368-125.583 90.619 23.820 140.994-124.087 117.678 41.542 153.598 -19.051 138.372 -90.751 112.192-100.943 124.457 0.418 117.746 -81.366 91.272 -59.109 110.698 -45.604 90.268 -49.572 110.635 -67.095 89.424 -47.301 126.853 -75.539 90.731 -39.976 102.828 -80.845 91.019 -43.195 123.516 -12.517 90.914 -54.306 146.387 -30.854 89.840 -48.990 129.064 -77.221 91.593-141.318 84.346 -76.799 92.445 56.786 131.384 -77.066 93.504 26.367 140.631-112.252 100.503-146.457 117.454 14.799 113.911 -79.177 165.168 -2.406 100.255 -21.037 112.344 -84.707 98.325 76.597 99.363 -78.340 92.643 0.000 128.762 -76.959 # 892 total E -1.46388E+02 rmsd from N 0.000 %NC 0.00 93.197 163.676 138.723 -91.950 92.782 56.983 136.018 42.324 91.795 44.488 106.432 -82.532 91.818 49.441 130.950 -76.650 92.051 41.575 152.022-145.298 92.025 44.268 59.160 -68.322 90.361 45.486 118.894 -33.866 89.267 50.941 134.509 -99.227 88.831 45.690 119.933-111.590 92.289-172.697 83.992 -87.113 109.145 106.023 154.157-166.799 95.107 47.304 91.566-121.230 97.938 58.531 108.668 -86.931 102.999 -83.928 159.613-115.772 104.301-115.899 134.450-158.045 95.737 41.988 156.159 171.897 94.183 46.671 131.051 -85.462 92.450 42.657 127.948 -57.158 94.563 46.345 73.708-114.598 91.885 43.102 162.496 -16.312 89.636 47.723 0.000 0.000 90.695 49.375 103.690 -83.007 89.352 46.006 143.415 -71.420 90.114 41.529 121.182-127.136 91.229 47.864 108.831 -73.194 94.918 32.811 132.266 -80.748 97.321 43.208 136.448-134.998 100.018 -8.448 107.594 -85.994 124.338 69.006 156.194 -13.243 124.162 -80.739 117.463-119.285 116.979 -79.680 111.810 -80.545 93.093 19.509 127.967 -58.869 106.937-175.620 115.821 -75.580 143.977 -91.692 136.724 -95.083 88.186 53.483 101.783 -82.602 88.983 52.870 113.824 -69.000 88.429 54.120 137.936 -43.567 87.931 45.098 128.238 -76.303 88.086 52.057 101.484 -65.839 89.969 48.161 127.487 -76.289 88.123 51.326 124.352 172.198 88.156 59.438 134.147 -56.786 88.451 53.497 132.284 -55.594 90.467 45.426 147.310-122.078 94.690 78.580 104.000 -80.569 92.566 0.000 128.981 -76.672 # 893 total E -1.46480E+02 rmsd from N 0.000 %NC 0.00 92.692 95.872 137.821 -93.904 93.665 61.037 137.886 46.489 94.727 38.460 104.031 -80.150 92.071 50.024 132.158 -77.417 91.149 42.655 146.278-143.573 92.128 45.503 58.831 -66.761 89.514 45.453 120.451 -30.818 89.128 53.078 128.518 -99.986 87.591 43.278 126.819-117.736 95.071 105.482 83.657 -95.899 92.071 -54.931 152.549-105.239 100.012 -42.336 95.171 -94.371 89.964 -45.503 108.207 -77.550 94.072 -65.716 165.936 -16.446 92.731 -92.013 135.756-129.351 90.639 24.527 121.660-133.932 112.042-129.239 154.109 -72.842 141.515 39.189 132.422 -69.697 99.979 53.056 113.256 -9.719 96.614 38.552 106.817 -81.728 94.733 46.865 0.000 0.000 95.103 40.409 105.043 -83.247 92.226 42.014 173.377 160.752 93.541 39.214 100.901-131.970 91.817 46.355 113.802 -78.454 90.360 54.434 147.032-118.274 90.843 44.823 145.478-105.456 92.472 37.970 142.818-128.918 100.070 -0.654 114.939 -89.767 138.732-161.527 103.088 -87.804 95.595 49.105 115.288 -76.909 92.379 51.327 102.320 -13.138 89.875 49.362 122.978 -5.631 91.797 47.360 130.459 -77.513 90.658 39.918 103.227 -84.224 90.640 49.654 115.550 -32.446 91.226 58.377 136.356 -39.570 89.375 33.612 130.464 -77.985 93.861 106.231 100.768 -98.091 105.088 -29.333 137.350 -96.596 94.792 -57.489 137.230-126.214 94.896 -25.826 125.224 -18.278 100.939 -54.073 154.186 -26.887 91.286 -44.895 137.071-107.847 95.605 84.023 104.588 -81.434 92.499 0.000 128.970 -76.691 # 894 total E -1.47200E+02 rmsd from N 0.000 %NC 0.00 93.228 -71.003 128.727 -81.569 94.101 -47.916 119.535 -81.351 90.606 -47.767 103.556 -77.085 89.930 -50.981 127.816 -75.598 90.714 -37.466 138.499-129.011 92.173 -47.298 65.271 -60.931 90.339 -33.816 125.427 -14.975 102.870 -44.128 170.558 148.759 92.498 -41.602 128.477-116.918 94.192 124.096 88.452 -85.512 89.998-175.089 148.832-115.386 96.209 66.020 99.253-141.398 119.961 135.920 107.551 -91.643 137.172-102.236 172.361-165.577 106.122-124.421 137.109-154.485 95.719 43.751 148.889 145.886 92.408 46.320 134.228 -84.746 91.140 48.437 127.425 -66.539 91.512 49.189 129.840 -40.088 91.803 41.872 108.600 -82.601 91.088 44.603 0.000 0.000 90.088 57.242 109.348 -86.440 87.074 46.354 140.107 -83.139 89.402 45.103 119.487-126.380 89.430 50.562 109.978 -77.924 90.016 48.200 137.106 -97.625 92.233 52.687 131.487-144.441 93.363 -92.871 140.553-120.143 113.662 156.839 156.416-144.155 131.295 -67.584 113.100-110.650 105.855 -58.796 112.592 -78.672 119.880-108.469 123.854 -12.929 91.480 54.681 121.914 -25.130 92.065 41.250 129.743 -77.327 93.585 50.320 140.541 -35.392 92.358 50.780 127.378 -73.834 94.892-113.945 116.789 -79.326 93.813 -51.602 127.739 -76.225 105.997-115.381 141.880 127.721 91.015 55.505 130.864 -76.356 91.158 44.596 140.080-102.683 90.271 47.031 130.089 -34.472 90.578 54.391 139.567 -53.455 89.527 43.898 140.070-136.652 94.679 80.604 103.858 -80.249 92.541 0.000 128.881 -76.653 # 895 total E -1.51445E+02 rmsd from N 0.000 %NC 0.00 92.541 135.346 123.990 -48.004 93.997 53.114 146.839 37.930 95.836 38.771 106.928 -81.974 93.127 46.973 129.284 -75.279 92.865 47.777 133.971 -10.244 90.965 41.976 64.769 -75.928 92.733 45.228 122.816 -44.611 100.271 25.981 124.844 -98.393 94.922 51.627 138.045 142.095 89.802 89.574 83.830-113.646 89.335 -80.007 128.412-106.809 98.482 -50.494 94.987 -93.482 94.070 -42.759 143.544 -22.802 119.878-148.220 167.959 -13.170 108.113-132.857 133.375-125.240 96.433 41.416 141.417 149.877 92.941 44.463 135.533 -86.773 89.830 57.083 144.764 -68.165 89.873 54.707 117.062 -34.117 90.243 39.000 148.402-144.556 89.941 48.923 0.000 0.000 89.959 54.802 104.325 -85.181 89.926 46.675 139.593 -73.859 91.613 38.870 120.595-123.127 91.391 51.516 110.556 -76.250 91.505 54.956 132.661 -90.112 90.960 45.103 139.026-144.944 93.360 28.065 142.710-131.788 113.794 12.616 153.026-123.559 133.895-169.189 116.139-111.471 93.852 57.365 129.571 152.388 90.352 51.052 102.967 -4.051 88.324 53.113 143.221 -39.172 89.678 47.969 129.198 -76.191 87.874 45.729 105.264 -84.217 89.038 51.360 114.294 -31.740 87.969 53.334 136.212 -48.680 90.059 37.745 128.464 -76.774 91.823 101.125 108.709-101.546 93.799 -19.136 129.537 -77.889 99.989 -78.388 124.266 -99.074 90.382-138.756 137.522 -56.518 132.652-147.652 175.423 2.698 99.826 28.507 137.150-138.997 113.274 46.734 103.877 -74.330 92.478 0.000 129.140 -76.435 # 896 total E -1.51353E+02 rmsd from N 0.000 %NC 0.00 93.217 -75.361 126.885 -75.857 93.614 -50.174 120.467 -79.436 90.981 -46.765 103.573 -77.422 90.537 -49.726 126.641 -74.933 88.835 -40.342 141.697-132.610 92.199 -46.226 64.837 -56.433 90.106 -36.714 125.314 -8.289 98.587 -43.648 168.595 140.040 94.240 -43.545 130.864-121.481 92.897 122.407 84.053 -87.476 91.865-178.775 142.749-103.771 93.183 78.172 100.017-140.252 112.944 117.691 106.561 -91.112 120.808-102.475 165.711-140.565 104.711-119.053 137.343-151.998 94.503 43.738 147.142-109.739 92.541 46.574 135.606 -76.050 91.168 48.090 121.982 -49.689 90.000 50.350 124.228 -44.620 88.848 46.562 144.697-149.358 91.570 42.718 0.000 0.000 90.342 50.002 123.290 -75.162 89.978 42.073 136.451 -87.672 90.699 46.797 120.662-123.909 89.997 52.614 106.998 -76.242 92.046-124.810 123.563 -73.346 93.719 -78.007 138.932-113.989 94.624 87.422 142.273-177.522 96.560-108.588 102.160 -80.912 106.027-104.171 97.864 -89.684 100.951 -32.960 114.989 -81.647 94.677-117.387 124.645 -29.143 92.470 50.866 130.668 -33.308 91.917 51.458 129.036 -75.863 89.933 43.548 105.193 -80.797 91.278 48.822 138.662 -26.219 88.940 46.160 142.161 -90.931 91.009 41.422 128.307 -76.983 91.232 46.395 117.134 -45.742 90.580 45.111 130.049 -77.620 90.709 47.787 138.805-143.780 89.571 49.720 127.795 -43.307 89.379 53.307 134.757 -90.369 90.365 43.728 133.337-132.193 95.311 74.274 104.186 -80.474 92.517 0.000 128.999 -76.659 # 897 total E -1.47671E+02 rmsd from N 0.000 %NC 0.00 93.127 164.175 138.446 -91.401 92.896 57.203 132.744 48.351 91.829 44.010 105.990 -81.076 92.159 47.384 130.417 -77.022 91.298 44.599 151.850-154.030 92.234 44.278 57.621 -65.974 90.437 45.130 125.782 -26.117 88.781 48.687 136.917-108.544 88.798 52.267 127.134-120.974 87.196 50.445 84.574 -99.373 89.027 177.007 133.604 -84.157 94.321 74.235 131.949-159.360 91.361 46.436 100.555 -81.929 96.267 35.000 138.426 -32.379 99.816 38.413 112.395 -92.593 102.987 2.521 136.254-113.496 118.777 52.622 155.617 -67.142 102.151 -20.056 141.692 -94.538 141.553-173.551 129.154-139.804 90.299 59.866 145.432-172.299 90.794 50.583 0.000 0.000 89.817 45.181 140.570 -19.561 89.960 49.628 142.592 -91.293 88.759 53.536 121.016-135.815 86.905 54.531 108.778 -75.827 89.128 49.616 139.784 -84.534 91.469 52.346 137.078 -76.575 94.095 -99.044 103.319 -83.163 104.941 177.459 151.717 -19.649 105.748 -27.790 95.360-110.308 103.431 -55.706 114.260 -80.425 96.140-116.433 128.797 -56.632 91.159 62.560 119.234 -72.692 92.082 45.270 129.662 -76.680 88.580 45.987 106.339 -81.907 89.267 67.198 145.020 -36.712 85.428 55.429 155.820-149.645 88.198 42.554 127.991 -76.152 89.372 50.571 115.007 -25.254 89.374 46.513 129.088 -76.398 89.623 47.523 136.206-153.156 88.636 53.626 132.674 -50.120 88.214 55.397 134.059 -56.809 89.825 44.271 136.858-116.784 94.666 80.724 103.986 -80.512 92.522 0.000 128.797 -76.797 # 898 total E -1.48554E+02 rmsd from N 0.000 %NC 0.00 93.184 -68.253 129.581 -84.733 94.554 -46.395 118.385 -81.879 90.114 -48.938 103.220 -77.278 89.927 -49.824 128.216 -75.604 91.294 -38.430 138.344-129.815 94.160 -43.526 63.473 -66.840 91.809 -34.677 123.172 -31.987 103.328 -39.803 170.682 149.956 93.347 -44.097 129.053-113.841 94.937 134.266 86.539 -86.522 108.499-133.795 148.665-106.731 125.841 9.568 115.866-119.444 113.160 173.131 102.383 -83.760 129.846-106.315 175.181 1.243 112.021-120.804 144.261-155.801 95.210 43.214 149.714 154.108 91.976 46.334 135.683 -85.215 90.455 51.365 134.350 -67.681 89.996 50.684 137.998 -49.897 89.340 43.567 143.902-149.722 90.213 47.218 0.000 0.000 89.575 52.445 143.936-132.335 88.459 44.471 137.041-103.007 90.699 43.226 118.652-129.171 88.935 52.311 116.862 -77.899 89.897 48.550 137.691-114.266 90.193 47.126 123.930-156.506 94.847 -87.819 104.631 -83.579 127.464 116.778 150.743 -13.454 97.850 130.877 96.998 -88.171 136.487 112.567 167.577 -49.590 97.170-114.333 121.424 -57.756 92.652 45.786 129.469 -2.765 91.106 49.865 129.914 -76.016 89.762 43.338 143.130 -28.817 91.261 44.115 129.262 -38.077 92.195 42.064 139.454 -62.169 92.847 41.530 128.384 -76.909 92.532 49.835 106.578 -62.096 94.028-101.118 129.573 -77.684 119.571 -40.726 154.434-145.382 114.193 -68.557 122.372 21.026 92.866 80.325 146.917 -15.365 91.050 25.755 141.850-150.323 98.108 40.857 102.396 -77.550 92.496 0.000 129.318 -76.329 # 899 total E -1.46888E+02 rmsd from N 0.000 %NC 0.00 93.213 -67.399 128.482 -81.237 94.353 -48.495 117.133 -79.114 91.299 -45.312 103.483 -77.137 90.457 -49.100 129.040 -76.246 91.103 -37.853 139.835-128.647 93.020 -45.818 64.517 -67.001 91.045 -30.003 125.867 -16.257 108.487 -35.716 166.378 129.603 95.896 -44.539 128.693-118.932 93.117 119.101 81.397 -84.845 107.031-167.832 131.054 -85.330 96.373 70.048 126.657-150.262 119.398 131.878 105.827 -85.455 116.018 102.643 176.391-161.384 111.323 -3.511 111.387 -88.239 94.825 62.396 140.315 -86.732 93.662 22.662 119.230 -58.266 102.021-100.265 153.768 85.040 121.570-112.416 109.565 -88.995 88.254 68.020 146.026-154.936 89.147 56.909 0.000 0.000 90.854 42.554 141.409 -26.039 89.903 49.673 174.613-179.098 89.467 53.768 111.559-143.599 87.194 50.040 111.460 -77.339 90.157 51.859 157.695-135.694 89.545 48.570 122.779-160.762 93.787-103.699 103.321 -82.555 115.850 132.084 150.514 -14.804 105.739-174.041 94.814-101.078 91.859 73.809 123.409 55.477 89.356 64.961 107.298 -23.187 89.573 45.319 107.109 -79.342 90.420 56.722 131.168 -76.420 84.956 55.385 132.948 169.123 87.028 50.204 101.263 -66.716 87.688 56.820 136.204 -41.765 89.102 47.642 127.092 -75.273 89.319 115.199 101.714-104.727 92.256 -41.650 129.636 -78.459 93.374 -53.673 146.306-130.469 90.642 -60.040 123.166 3.846 93.740 113.075 156.603 -26.780 98.213 48.358 140.905-162.431 97.732 -10.892 104.619 -76.903 92.492 0.000 129.816 -76.378 # 900 total E -1.51598E+02 rmsd from N 0.000 %NC 0.00 123.682-104.040 148.359 -48.176 123.515-101.192 129.282 -32.413 93.979 39.747 108.210 -78.445 94.066 49.957 130.785 -77.136 93.293 39.617 148.977-135.420 91.271 45.093 62.700 -84.568 90.996 44.353 116.613 -47.253 91.270 42.039 137.097 -94.533 90.352 46.733 136.208-128.378 89.642 49.010 80.285-100.435 91.097-176.613 126.972 -74.670 92.758 55.764 131.669-158.422 103.966-154.565 144.799 -24.155 108.236-143.139 149.815 -30.777 106.055-118.158 136.442-149.260 90.497 51.374 142.024 117.927 91.170 47.118 134.678 -85.451 90.942 46.036 133.724 -56.810 90.796 45.215 136.500 -13.963 90.993 46.406 144.494-156.736 90.384 45.381 0.000 0.000 90.134 47.043 110.123 -83.060 91.069 45.949 137.156 -74.332 91.404 42.378 121.316-118.975 91.847 49.369 112.283 -78.185 95.470 139.782 126.816 -89.262 96.248 24.197 139.046 152.020 97.713 82.529 145.524-131.741 131.383 37.935 156.410 -25.071 99.116 -50.600 102.543-101.879 95.433 -44.262 111.672 -75.561 92.815 -75.112 112.339 -56.603 88.225 105.205 138.864 -66.661 92.876 48.055 128.482 -75.779 88.296 50.136 111.247 -72.184 90.671 46.002 137.891 -30.424 90.228 43.197 143.252-100.795 91.772 41.247 128.272 -76.609 90.571 50.316 116.242 -23.924 89.130 48.895 131.019 -77.912 89.197 43.680 137.706-115.355 89.709 50.577 128.202 -39.164 88.721 56.154 140.717 -51.483 89.188 43.552 138.566-134.620 94.509 84.308 103.726 -80.284 92.599 0.000 128.786 -76.762 # 901 total E -1.51788E+02 rmsd from N 0.000 %NC 0.00 93.142 170.842 135.782 -83.590 92.527 60.838 131.389 -27.123 95.248 40.072 104.917 -82.947 93.099 46.721 128.720 -75.035 90.819 45.699 113.863 -84.590 89.897 46.292 71.893 -68.261 89.281 45.532 122.465 -46.799 88.136 46.366 126.072-104.614 88.554 61.980 119.058-112.483 84.002 54.879 94.656-103.674 90.776 57.769 122.034 -94.710 101.221 -56.590 98.010 -86.745 113.564 161.945 110.210 -82.457 144.874-173.293 170.634-166.253 109.275-107.398 141.177-152.838 93.997 45.510 137.672 131.394 90.487 48.120 134.326 -85.395 89.327 60.149 129.881 -29.919 88.976 47.578 135.914 -25.288 90.889 40.510 145.602-160.023 90.958 48.474 0.000 0.000 88.807 53.154 144.167 -26.317 88.432 48.354 143.518 -91.224 89.199 45.390 121.175-134.792 87.185 65.595 111.818 -71.932 87.861 54.943 141.785 -50.018 89.129 37.858 138.026-153.206 96.303 -90.355 106.064 -83.726 125.453-175.262 154.581 -7.001 99.655-139.461 99.219 -95.268 99.138 43.053 115.325 -77.574 93.491 44.427 100.796 -7.632 93.434 43.330 126.977 15.131 91.050 50.501 130.941 -77.414 89.937 43.105 102.803 -85.248 90.507 45.484 117.890 -21.868 90.393 50.095 136.847 -55.302 89.774 42.434 129.511 -77.970 91.210 91.669 113.402 -99.271 90.184 -66.681 129.303 -77.812 97.508 -63.524 135.323-111.596 93.188-169.181 134.751 -50.789 117.967 -81.047 161.839 -18.938 109.910 37.609 148.296-132.912 118.938 24.143 109.402 -79.647 92.361 0.000 128.585 -76.370 # 902 total E -1.47667E+02 rmsd from N 0.000 %NC 0.00 93.212 -80.229 123.250 -62.883 119.246-102.128 130.868 -37.664 93.425 42.985 109.413 -81.817 93.145 46.848 130.206 -77.053 94.001 44.780 151.872-137.881 91.568 44.535 59.324 -76.328 90.354 44.743 128.761 -34.071 90.731 45.080 127.400-111.311 88.079 54.336 137.197-145.278 86.570 59.935 79.300-105.247 89.927 41.979 129.232 -81.000 102.953 -99.800 97.352 -85.202 117.924 176.427 106.464 -84.315 150.634 165.501 176.450 175.551 109.019 -88.749 141.387-155.067 93.271 55.189 133.323 114.520 90.891 45.076 133.651 -85.329 89.413 58.957 133.369 24.048 88.021 47.354 142.158 0.638 88.402 46.404 145.054-150.760 89.101 51.939 0.000 0.000 88.011 48.364 135.811 -32.853 89.720 43.049 135.192 -94.271 90.326 55.785 122.321-129.510 86.424 66.356 108.896 -75.693 88.584 53.883 124.546 -85.230 90.525 39.749 139.403-130.576 97.263-119.565 104.690 -82.031 109.702-173.911 152.504 -13.963 106.310-120.298 95.167 -94.129 94.190 49.603 114.431 -76.517 91.279 47.860 98.899 -16.916 90.071 50.250 123.710 -1.437 91.425 44.417 129.304 -76.775 91.756 39.196 101.352 -81.463 89.510 56.315 119.093 -33.341 90.906 52.994 139.224 -37.113 89.845 40.588 128.128 -76.257 92.282 50.748 114.000 -84.806 96.433-118.103 127.757 -76.272 93.165 -38.983 140.125-118.504 94.102 -73.097 129.094 -23.215 88.688 -52.550 159.986-132.727 92.293 -40.471 132.753-109.534 98.271 131.874 104.844 -79.057 92.493 0.000 128.977 -75.893 # 903 total E -1.53029E+02 rmsd from N 0.000 %NC 0.00 93.307 -72.598 128.402 -80.636 93.888 -49.645 115.400 -75.920 91.191 -44.503 103.415 -76.630 92.243 -44.666 127.831 -75.673 95.890 -25.675 146.183-138.088 105.340 -34.153 57.159 -77.868 95.745 -27.921 120.014 -44.592 105.664 -31.714 167.305 -85.116 100.506 -48.592 135.966-115.049 96.567 141.876 91.191 -91.433 139.355-159.581 152.176-102.139 95.753 -48.459 96.682-105.556 96.691 -65.651 105.111 -79.663 112.600-161.690 151.308 -22.784 105.128-112.976 142.377-156.623 93.620 45.787 149.431 130.554 92.297 46.775 134.073 -84.054 91.427 44.163 125.393 -70.335 93.535 49.519 100.656 -22.198 93.044 38.047 105.090 -80.216 92.363 47.145 0.000 0.000 97.587 34.545 102.312 -87.493 96.574 38.342 152.205 -79.278 96.343 37.246 112.178-121.666 92.756 51.339 112.765 -78.381 91.511 51.163 123.218 -89.775 91.639 46.338 139.945-150.162 93.989 24.771 143.268-131.580 118.006 57.810 115.075 -85.827 138.162-176.933 106.711 -92.884 97.102 44.104 115.485 -77.491 92.053 47.302 101.319 -4.859 89.214 52.542 133.971 -2.154 90.567 46.821 128.361 -76.447 90.084 43.281 103.887 -84.102 89.911 51.316 120.335 -21.679 90.007 47.848 132.501 -57.498 90.351 43.876 128.032 -76.221 92.303 77.506 116.493-103.973 89.535 -92.998 128.321 -76.293 93.406 -41.675 143.404-122.425 90.606 -48.025 117.975 7.022 92.852 -59.753 142.932 -37.368 90.115 -24.955 139.763-137.672 108.001 107.675 97.328 -77.831 92.557 0.000 129.616 -76.441 # 904 total E -1.49142E+02 rmsd from N 0.000 %NC 0.00 93.166 159.823 142.928-105.975 94.212 50.575 127.929 43.557 90.630 46.673 105.746 -79.079 91.233 48.078 129.903 -77.257 92.187 47.145 150.976-145.797 92.071 41.269 55.883 -65.521 91.022 46.156 127.286 -24.643 89.677 48.523 132.815-111.490 89.127 47.328 114.744-105.316 86.908 52.692 85.389 -85.647 91.191 55.505 135.464 -67.237 94.360 29.335 100.574 -95.927 95.464 60.903 111.663 -84.616 95.308 -56.872 124.876 -96.628 128.458-133.172 109.560 -87.045 111.749 45.912 147.646 128.359 96.208 40.316 135.651 -85.808 92.212 47.415 124.109 38.159 90.084 54.906 123.423 169.243 88.491 47.796 156.177 -43.172 88.854 49.004 0.000 0.000 88.046 64.860 128.446 -33.032 86.541 59.177 139.321 -77.190 88.931 43.269 122.535-128.916 89.183 52.031 111.415 -73.761 88.410 54.722 134.079 -48.724 89.933 46.445 131.171-117.851 89.774 47.073 112.882 -88.657 95.268 59.609 113.794 -79.071 95.226-118.522 104.024 -92.593 102.147 -56.919 114.379 -78.296 92.780-174.451 115.103 -21.665 91.711 -50.209 112.606 -76.459 90.804 -47.389 126.465 -75.105 88.799 -43.854 102.127 -79.286 89.602 -48.106 139.853 -31.489 91.668 -41.807 141.089 -56.835 91.031 -44.827 128.607 -76.150 87.906 -56.103 127.900 1.940 90.144 -52.712 127.164 -75.142 90.570 -35.563 141.251-142.014 92.500 -47.661 124.454 -15.703 91.450 -57.643 154.839 -25.439 89.961 -51.713 137.722-152.840 93.422 89.005 103.413 -79.887 92.482 0.000 128.961 -76.579 # 905 total E -1.46874E+02 rmsd from N 0.000 %NC 0.00 92.916 150.419 136.984 -83.614 93.414 56.986 139.505 47.461 92.599 45.371 106.502 -81.285 92.069 44.667 131.019 -77.416 94.936 47.087 154.784-134.140 92.673 39.532 56.325 -73.301 92.928 44.856 130.362 -31.060 93.486 41.162 128.395-107.744 89.865 50.833 142.316 174.292 89.933 72.060 76.863-101.539 91.495 -73.788 146.563 -86.839 108.905 -67.742 92.733 -81.117 102.985-146.574 143.901 -34.171 109.867 -81.023 144.293-124.346 98.731-117.919 110.541 -85.324 92.532 49.616 143.893 145.003 92.484 46.527 136.572 -85.068 90.476 47.097 131.549 -47.204 92.137 49.591 114.613 -32.623 90.881 43.500 108.719 -82.363 88.858 50.225 0.000 0.000 89.768 56.664 103.084 -82.395 87.613 43.226 142.329 -78.995 90.003 46.501 117.965-124.524 89.393 55.662 110.477 -77.119 88.893 49.496 135.965 -97.685 92.213 43.908 130.101-138.774 97.078 -92.705 143.641-129.144 117.528-171.813 111.265 -78.434 137.158-174.592 111.082-102.964 97.881 41.613 115.396 -77.482 92.478 48.150 103.616 -7.893 89.349 54.755 134.465 -19.848 89.761 46.649 128.120 -76.634 89.744 48.331 103.177 -77.686 90.581 45.886 133.832 -37.223 90.911 73.000 130.497 -83.185 91.255 -30.502 127.025 -76.361 116.324-158.547 134.013 17.016 92.476 43.240 130.874 -77.776 93.346 44.402 143.025-123.268 94.260 81.445 129.069 -41.761 90.482 -75.959 143.824-135.217 97.838 -47.912 106.028 -87.284 97.456 177.119 106.957 -78.484 92.981 0.000 128.779 -76.872 # 906 total E -1.47391E+02 rmsd from N 0.000 %NC 0.00 124.280-104.782 146.627 -38.242 123.800-104.075 130.496 -36.927 93.666 42.439 109.481 -80.298 93.492 48.325 130.704 -76.782 95.060 39.805 152.689-146.850 91.939 43.434 59.997 -83.975 91.583 44.545 116.684 -43.933 92.214 42.594 139.830 -90.608 89.615 46.523 144.340-149.802 90.005 44.570 76.543-102.152 92.355-167.948 125.600 -69.588 92.980 38.922 133.952-161.621 111.550-114.271 147.653 1.208 119.786-129.166 154.150-122.194 114.822 -98.767 142.073 179.059 97.289 38.663 150.090 166.523 91.179 50.704 138.053 -81.312 90.447 51.666 110.780 -91.981 94.416 47.344 127.845 -58.462 100.295 24.240 145.227-163.132 101.017 37.058 0.000 0.000 93.375 58.595 111.892 -87.211 89.494 49.264 131.909 -88.399 91.192 40.116 117.628-119.527 91.409 50.788 111.576 -76.208 91.562 56.216 131.270 -92.764 90.749 52.139 134.728-147.300 93.604 11.009 107.992 -86.758 125.567 88.319 147.471 -20.108 139.807 175.200 107.065 -92.189 96.665 41.567 114.360 -77.508 91.927 49.911 125.193 -54.772 88.405 60.959 120.202 28.053 87.766 58.990 129.374 -76.594 87.732 42.886 97.258 -80.386 89.929 49.223 144.211 -24.818 88.603 51.086 152.961-118.741 88.982 42.194 128.192 -76.842 88.557 50.905 115.238 -34.538 90.042 45.266 128.460 -77.277 90.699 50.232 137.734-129.739 90.843 67.967 131.005 -44.015 89.837-131.246 131.482 -72.299 98.177 49.184 107.625 -85.753 115.840 61.783 108.724 -78.536 92.468 0.000 129.619 -76.224 # 907 total E -1.46695E+02 rmsd from N 0.000 %NC 0.00 92.880 126.304 140.980 -99.491 94.160 53.596 136.756 47.093 92.033 44.850 106.769 -81.792 91.630 49.008 130.802 -77.562 93.017 48.234 155.198-143.421 92.815 38.453 61.731 -75.634 93.862 41.735 126.936 -42.014 96.402 36.575 129.288-105.752 94.521 49.678 148.814 174.423 90.207 70.161 89.619-106.810 95.142 -65.113 127.972-101.015 110.990 -70.928 92.631 -81.401 108.700-146.807 144.555 -34.112 116.221 -81.275 152.426-141.553 101.217-125.395 104.293 -90.601 94.707 42.464 144.098 147.215 92.416 46.163 136.162 -85.916 89.722 52.026 154.754 -34.075 90.368 52.014 122.733 -35.889 89.702 42.054 146.620-160.255 89.753 47.278 0.000 0.000 89.652 57.944 104.950 -80.526 87.075 48.256 145.470 -78.120 89.404 42.088 119.403-130.670 89.604 52.279 109.374 -74.908 90.147 44.795 145.119 -98.874 93.482 52.478 130.708-159.364 93.714 11.232 142.904-131.454 111.913 169.354 112.923 -86.138 118.515 51.066 135.007-149.995 99.647 27.485 115.597 -78.521 94.836 46.998 112.066 -12.890 93.027 46.708 113.742 -68.673 90.687 53.640 130.131 -76.898 88.177 33.653 102.744 -83.426 94.845-126.670 105.948 -47.518 96.774 -47.356 146.857 -18.208 91.101 -38.998 130.894 -76.679 95.886-147.445 104.337 -45.849 91.448 49.789 132.522 -78.678 90.802 51.830 142.145-114.297 90.669 56.412 127.383 -20.561 91.142-132.547 134.960 -89.083 97.224 34.223 138.559-141.497 117.510 28.494 103.689 -76.881 92.441 0.000 128.917 -76.260 # 908 total E -1.46448E+02 rmsd from N 0.000 %NC 0.00 93.238 -71.163 129.643 -84.819 94.315 -46.919 120.440 -82.513 90.477 -48.745 103.265 -77.131 89.701 -51.361 128.519 -75.742 92.436 -35.020 139.620-133.049 92.280 -48.102 62.775 -59.415 90.308 -36.180 128.381 -10.202 102.345 -60.661 173.126 173.726 90.353 -22.310 132.724-113.907 105.024 109.930 73.981 -81.699 97.380-168.435 151.723 -42.699 96.728 53.259 105.112-118.705 120.326 140.888 110.698 -83.177 115.808-108.281 162.438 -16.888 107.843-113.468 142.665-161.733 96.412 38.196 140.107-108.585 92.909 47.398 140.215 -74.767 90.826 49.428 129.230 -99.071 91.139 55.900 51.850 135.974 90.012 40.988 141.608-152.894 92.638 43.199 0.000 0.000 90.180 57.438 137.987 -25.458 88.448 55.774 138.518 -89.607 89.212 42.217 122.112-132.318 89.784 50.492 109.185 -70.158 91.144 47.593 140.184 -45.585 92.046 44.769 135.021-128.276 91.843 36.554 115.286 -89.784 107.718 158.620 105.294 -80.486 93.558 54.360 134.416-160.884 92.307 46.767 113.428 -77.348 92.349 114.514 144.084 -97.461 90.926 55.027 116.795 -74.609 90.942 44.197 129.298 -76.486 88.511 48.006 112.210 -88.364 87.999 55.688 138.517-114.895 87.183 53.299 138.208-165.827 87.461 46.383 127.758 -76.116 87.190 58.170 108.177 -52.303 88.311 52.274 127.333 -74.561 88.331 43.135 139.744-135.942 89.949 49.543 130.877 -45.761 88.854 55.066 136.905 -55.980 89.718 43.999 135.771-125.224 94.595 81.549 103.870 -80.412 92.553 0.000 128.870 -76.632 # 909 total E -1.47501E+02 rmsd from N 0.000 %NC 0.00 92.973 -51.891 129.959 -89.179 94.649 -46.831 115.683 -80.615 90.893 -46.719 103.170 -77.503 90.180 -48.387 128.991 -76.100 91.808 -39.414 138.149-126.479 93.525 -42.128 60.227 -65.979 93.184 -37.314 131.295 42.167 102.490 -38.838 168.529-171.129 91.437 -48.692 128.103-118.029 90.001 -71.564 76.237 -77.385 104.517-160.619 154.696 165.104 93.823 -57.122 99.182-105.280 101.175 171.376 103.909 -81.234 117.253-130.091 176.420-158.879 105.872-109.022 137.694-147.547 92.484 47.280 141.422 137.731 91.657 46.105 134.739 -85.855 90.092 50.589 150.729 -31.905 89.042 49.840 137.196 -30.453 88.131 47.804 144.656-153.265 89.769 45.861 0.000 0.000 90.286 46.744 159.151-145.038 90.143 43.860 139.091-103.606 90.929 43.514 118.120-128.326 89.246 49.637 111.814 -73.186 90.862 45.347 135.099 -92.925 93.594 37.972 131.205-133.640 94.637 42.000 143.938-131.236 97.211 128.499 109.166 -88.247 91.756 58.433 133.230-160.260 93.721 69.408 114.227 -77.888 91.996 -85.026 110.002 -42.173 99.020-150.553 116.317 -72.667 91.953 63.626 130.183 -76.946 89.037 47.246 101.813 -82.596 91.076 48.518 119.333 -30.163 92.292 41.473 135.350 -42.113 91.844 44.080 129.684 -75.844 93.255 41.392 107.144-113.573 96.911 34.093 128.337 -76.103 96.739 35.645 145.770-135.275 94.083 46.213 130.495 -83.542 90.988 50.181 116.472-134.696 89.962 41.731 129.280-140.566 95.288 47.977 101.362 -79.862 92.581 0.000 128.904 -77.160 # 910 total E -1.49717E+02 rmsd from N 0.000 %NC 0.00 93.162 -63.996 128.827 -82.455 94.803 -46.680 115.307 -79.867 90.968 -46.693 103.204 -77.141 90.661 -45.560 130.013 -76.278 92.764 -40.642 141.546-127.495 94.878 -41.001 61.471 -60.450 90.960 -41.621 130.867 15.567 99.656 -46.000 167.839 162.774 90.840 -64.568 116.759-116.877 87.712 -80.960 82.295 -88.719 109.537 158.141 138.836 166.585 106.641 -16.124 91.918 -96.717 99.459 114.408 111.342 -83.068 101.871-134.261 155.344-152.383 111.470-110.144 141.350-159.731 93.713 45.592 142.390 155.255 92.039 45.982 134.465 -85.553 90.195 49.868 128.455 -66.052 91.702 50.585 113.629 -35.468 92.081 39.665 107.680 -82.034 90.243 48.289 0.000 0.000 89.979 61.401 104.894 -85.656 86.510 46.719 143.142 -77.863 89.173 44.649 117.331-125.190 89.854 52.031 109.148 -76.801 88.947 50.241 140.900 -96.899 91.700 44.450 131.537-135.630 95.737 -96.482 143.046-124.331 116.770-178.949 151.811 -16.426 136.714-168.519 109.013 -99.883 96.787 43.534 115.274 -77.536 92.762 46.867 103.792 -12.724 90.048 53.908 133.049 -10.562 89.776 44.324 128.581 -77.309 92.359 51.344 102.141 -82.948 93.401 89.199 132.448 -36.258 90.264 -76.830 137.848-109.364 93.413 -61.928 129.527 -78.280 91.559-152.302 104.557-111.347 93.569 43.463 130.441 -76.519 94.576 43.313 140.458-116.561 94.795 37.695 124.101 0.534 93.751 55.338 154.699 -27.906 89.530 43.523 138.016-144.466 94.918 83.001 104.376 -80.303 92.532 0.000 128.800 -76.657 # 911 total E -1.46511E+02 rmsd from N 0.000 %NC 0.00 93.233 168.354 140.478-100.001 93.426 55.141 140.994 31.979 92.520 44.089 106.568 -82.882 91.923 47.988 130.282 -76.789 93.190 44.682 144.166-121.359 91.825 42.487 59.796 -72.914 90.861 45.113 122.292 -34.909 90.340 45.953 127.767 -97.771 89.567 49.591 133.881-112.708 88.532 47.804 84.342-100.690 92.672-177.278 126.578 -80.147 95.210 86.159 135.941-162.389 92.921 177.701 108.437 -84.875 138.361 -92.658 151.803-141.224 98.446-120.293 134.340-153.004 94.264 47.198 127.312 140.027 91.324 48.488 135.306 -84.689 90.523 48.823 130.190 -64.003 92.711 46.974 128.871 -30.138 92.474 41.413 146.102-171.049 89.721 48.701 0.000 0.000 91.500 51.352 102.487 -85.016 89.621 42.433 144.648 -74.321 92.853 40.576 117.346-122.799 93.124 55.540 112.549 -76.892 94.989 114.844 130.137 -94.576 90.528 56.867 131.930 152.626 113.889 -43.779 108.883 -85.356 135.620 133.681 152.544 -12.587 95.657 -46.558 99.640 -95.896 91.434 -46.088 110.925 -76.671 88.540 -53.840 113.205 -45.668 88.138 -53.698 101.311 -70.817 89.311 -41.560 128.251 -76.859 89.265 -48.511 100.847 -80.759 87.373 -58.657 144.179 -34.285 87.905 -51.342 158.919-137.615 88.830 -44.653 128.311 -76.819 94.555-126.083 131.271 -10.033 89.601 53.614 132.950 -77.229 90.426 46.396 142.414-101.795 89.703 46.202 129.832 -35.697 90.055 57.706 142.066 -43.325 88.763 43.221 131.769-125.179 94.747 84.977 103.648 -79.912 92.444 0.000 128.809 -76.798 # 912 total E -1.46723E+02 rmsd from N 0.000 %NC 0.00 92.929 151.386 138.607 -89.027 93.139 52.094 124.289 -31.305 93.875 44.559 105.346 -81.195 92.751 44.761 128.139 -74.857 91.090 45.796 107.076 -77.250 89.482 46.154 88.378 -65.893 88.276 46.883 117.383 -59.225 87.987 46.374 121.150 -97.775 88.758 49.393 119.314 -98.868 88.282 47.073 97.051 -96.679 91.094 54.988 130.167 -98.338 101.398 -53.174 96.073 -95.804 118.200 130.110 111.433 -88.913 145.187-129.856 158.135-116.939 105.294-119.533 134.885-150.830 96.213 44.746 139.722 141.073 91.599 48.106 134.801 -85.674 89.853 58.456 117.666 -44.451 91.318 52.441 120.134 -34.346 91.996 38.060 151.408-158.983 91.227 48.788 0.000 0.000 90.139 66.659 129.339 -43.832 86.487 53.136 145.758 -82.898 89.669 43.104 116.713-129.516 89.925 51.531 108.865 -69.641 90.531 48.441 137.457 -44.492 92.352 41.056 134.952-127.853 94.711 41.054 108.601 -86.513 113.999 -18.318 154.747 -24.020 114.056-114.188 95.327 -88.225 97.798 4.497 114.671 -74.694 115.968-175.682 127.724 20.559 144.404 177.757 143.906 -39.435 92.312 47.149 128.792 -76.020 94.652 46.640 100.714 -82.710 91.841 51.944 138.863 -16.501 91.723 40.700 123.571 -82.805 93.381 40.993 129.438 -77.171 97.632 113.991 112.642-102.255 89.692 -59.275 129.604 -77.295 90.739 -44.433 146.186-132.373 89.283 -47.064 131.584 -19.037 91.034 -54.892 160.620-169.966 90.024 -41.764 126.526-161.149 95.378 109.736 105.355 -79.712 92.609 0.000 128.738 -76.535 # 913 total E -1.51691E+02 rmsd from N 0.000 %NC 0.00 92.988 156.154 137.584 -86.431 93.686 55.506 130.155 56.515 91.651 44.650 106.100 -80.925 91.985 47.454 129.110 -76.370 91.411 48.605 156.233-176.709 92.873 39.079 60.111 -68.865 94.350 40.751 126.866 -25.338 93.030 42.739 139.522-107.896 89.809 54.939 130.609 142.350 88.854 81.884 82.261-101.500 83.896 -83.072 137.694 -99.196 95.599 -45.376 94.031 -93.446 87.957 -54.578 107.766 -74.841 92.153 -37.834 141.360 -86.730 94.412 -54.080 137.403-174.612 96.580 -33.564 130.572-145.753 96.072 108.545 133.130 -87.780 91.948 48.256 108.388 -46.188 97.074 114.951 117.433 105.348 88.090 51.499 147.765-173.638 89.571 49.963 0.000 0.000 89.866 47.598 133.599 -26.810 89.188 49.059 146.579 -80.323 89.079 46.796 121.174-133.949 88.401 49.663 106.329 -70.825 91.301 45.235 137.153 -48.746 92.985 39.950 135.321-129.747 94.156 40.274 115.270 -89.379 106.003 157.548 106.198 -80.326 93.191 57.281 133.782-160.839 91.978 44.454 113.321 -77.287 92.231 113.475 144.761 -97.348 90.588 58.379 120.220 -76.353 91.185 42.552 128.973 -76.333 88.418 49.538 115.411 -90.401 87.739 60.588 132.747-117.952 86.583 58.340 140.100-168.576 86.531 47.982 127.528 -75.920 88.338 53.630 121.439 -98.001 88.756 46.898 129.265 -75.402 89.661 45.908 138.632-128.362 89.074 55.595 132.074 -49.097 87.869 58.492 135.115 -59.483 89.164 43.470 129.348-106.552 94.706 83.136 103.856 -80.157 92.546 0.000 128.838 -76.739 # 914 total E -1.49290E+02 rmsd from N 0.000 %NC 0.00 93.025 150.879 140.646 -95.934 93.446 56.258 132.083 47.240 92.031 43.493 106.433 -81.391 91.676 47.795 130.550 -76.975 91.720 45.739 151.485-150.974 92.120 43.475 57.980 -66.119 90.330 45.123 131.653 -27.720 88.140 53.540 131.432-111.540 88.520 43.934 123.088-113.796 91.994 63.686 88.146 -96.080 95.154 -38.551 143.582 -91.587 115.323 -93.951 92.394 -78.025 110.533-122.487 151.893 5.274 137.260-132.932 157.735-152.557 118.114-107.909 107.987 -88.888 93.884 46.636 152.023 166.890 92.079 46.992 137.477 -81.863 90.335 49.783 149.513 -42.711 90.975 46.583 139.593 -68.189 90.953 44.353 140.011-171.090 88.596 49.769 0.000 0.000 90.388 51.737 105.840 -83.664 89.258 42.838 144.366 -75.634 89.977 43.877 117.324-123.459 89.148 57.680 110.935 -81.148 88.235 54.628 142.871-113.515 89.398 37.910 131.507-138.763 96.459-107.371 104.861 -82.542 115.596 179.724 152.237 -15.434 98.779 -67.248 96.638 -94.653 91.094 -48.715 112.131 -73.032 92.571 -71.626 102.133 -15.511 91.332 102.998 125.296 -23.167 92.825 52.240 130.211 -77.296 90.605 46.269 103.444 -73.460 90.682 45.174 136.828 -32.540 90.616 48.331 141.793 -83.367 89.805 40.903 127.685-107.886 90.263 48.861 116.790 -62.522 90.789 45.740 128.158 -76.429 91.339 43.554 139.628-115.991 91.164 46.095 130.446 -46.572 91.104 51.871 134.098-109.353 90.544 43.531 132.218-142.523 95.736 69.983 104.259 -80.374 92.577 0.000 129.073 -76.582 # 915 total E -1.47576E+02 rmsd from N 0.000 %NC 0.00 93.082 149.021 139.232 -90.389 92.005 54.211 146.384 61.375 90.952 48.858 106.428 -83.484 93.008 44.226 130.135 -77.242 96.615 41.334 152.155-130.478 91.723 44.255 57.205 -82.538 90.682 46.559 123.901 -41.396 91.608 42.840 126.376-103.303 89.210 48.189 143.150-146.667 88.536 56.256 78.605-104.583 90.464 141.615 131.809 -81.966 91.248 78.843 126.456-150.411 93.335 106.872 97.253 -84.102 91.366 -67.200 125.890 -72.738 96.284-118.284 138.324-137.766 90.257 50.592 134.080 103.316 91.269 47.241 133.812 -85.726 90.565 47.065 140.873 13.483 90.056 47.359 136.220 -5.795 89.722 46.510 156.064 -16.840 89.080 48.154 0.000 0.000 88.646 49.376 127.372 -50.004 87.449 54.474 147.912 -73.049 88.609 47.488 128.118-141.537 88.694 43.272 109.193 -76.252 89.341 57.545 144.671 -96.423 88.461 54.707 147.626-166.096 88.436 37.966 113.259 -90.200 94.251 49.867 116.907 -83.296 93.328 71.324 103.732-103.255 88.901 56.188 111.510 -77.178 90.634 61.134 130.284-105.392 97.208-165.455 108.378 -75.056 91.365 65.367 129.076 -75.890 88.081 52.671 102.782 -82.613 88.929 55.460 171.287-136.789 89.570 45.013 129.709-155.085 90.730 40.209 128.012 -76.290 90.302 54.038 121.140-124.480 89.612 51.610 128.521 -76.448 90.185 38.607 139.531-127.932 93.677 69.342 129.091 -40.099 91.287 -70.414 140.159 -60.183 111.721 -57.748 108.298 -82.988 94.239 125.540 103.516 -77.071 92.575 0.000 128.495 -76.345 # 916 total E -1.47082E+02 rmsd from N 0.000 %NC 0.00 93.121 -63.742 129.912 -86.206 94.560 -46.279 118.023 -82.548 90.110 -48.868 103.095 -77.376 89.761 -50.962 128.212 -75.765 89.754 -40.654 135.833-128.375 93.164 -43.241 64.339 -66.244 93.368 -32.245 124.953 -42.966 102.662 -36.299 172.093 153.716 96.248 -47.976 130.200-109.914 92.596 132.851 84.622 -78.154 92.917-178.026 141.262 -96.032 95.787 71.996 122.691-145.467 98.353 99.752 98.925 -82.939 111.141-106.609 157.664 -28.248 113.918-125.965 145.731-157.734 95.819 43.819 155.201 -96.055 92.695 45.466 136.247 -76.225 90.888 48.225 127.715 -66.405 92.098 49.621 115.835 -62.976 90.778 42.243 143.183 174.506 88.607 48.517 0.000 0.000 92.545 47.721 101.668 -87.711 88.493 44.559 151.607 -81.714 90.713 54.789 115.598-131.635 90.491 112.376 110.784 -77.614 90.935 57.709 158.107-153.884 89.980 39.721 118.176 170.811 96.030-111.078 106.462 -83.159 123.413-173.899 155.161 -7.257 100.922-134.541 96.570 -92.315 109.344 51.035 127.265 34.904 93.851 38.915 98.459 -50.656 93.353 52.842 114.312 -67.989 90.960 43.801 130.148 -77.806 89.061 44.352 141.414-132.662 89.835 47.641 111.798-120.853 88.152 62.365 141.484-146.867 87.565 41.393 128.300 -77.152 91.379 67.807 90.992 -90.116 92.580 -60.250 128.207 -76.180 114.815 -62.716 148.189-145.731 96.890 -54.807 124.206 -2.685 96.324 114.285 153.622 -24.567 92.546 57.774 139.711-156.869 97.787 -1.219 97.343 -84.677 92.384 0.000 129.739 -76.212 # 917 total E -1.47153E+02 rmsd from N 0.000 %NC 0.00 93.373 -87.060 125.001 -69.114 115.348-117.563 130.413 -48.777 93.666 39.815 108.281 -81.431 93.006 51.569 127.621 -74.427 92.437 42.202 140.483 -21.399 90.593 46.851 64.063 -77.494 89.566 48.678 120.940 -43.364 89.684 44.789 132.210-106.316 89.676 49.488 143.652 152.689 89.419 72.626 80.228-104.869 92.923 -62.208 139.097 -91.455 112.589 -65.265 91.030 -74.167 99.824-144.336 141.447 -44.000 121.987 -87.943 173.168 -8.323 100.728-131.967 142.308-147.444 96.255 40.608 142.318 158.590 92.893 45.926 135.170 -84.727 90.330 50.630 124.254 -58.268 91.150 53.882 120.552 -42.643 89.946 41.229 146.982-166.777 89.785 46.601 0.000 0.000 90.276 62.671 104.522 -81.458 85.432 49.595 152.430 -79.695 89.048 42.634 115.450-132.640 88.973 53.782 112.757 -74.743 89.617 42.525 151.121-119.347 93.068 51.737 131.490-132.649 95.009 -62.214 105.973 -85.641 127.387 74.697 167.818-162.652 134.068-176.259 109.738-101.759 87.095 85.353 117.572 -75.056 90.553 60.749 115.543 -87.750 93.823 37.176 109.811 -71.477 94.343 41.021 129.758 -75.975 93.005 43.583 109.760 -94.075 91.463 44.231 108.808 -84.777 89.836 50.098 130.698 -64.676 90.474 44.650 129.616 -77.863 90.854 116.271 99.768-105.955 92.831 -41.387 129.068 -78.149 93.204 -51.872 144.504-139.798 89.982 -49.753 122.018 6.875 96.153 123.485 160.208 -20.408 102.891 47.358 140.875-165.397 98.601 35.592 106.432 -75.354 92.437 0.000 129.441 -76.333 # 918 total E -1.48294E+02 rmsd from N 0.000 %NC 0.00 93.137 -65.087 128.407 -81.012 94.659 -47.161 115.383 -79.277 91.136 -46.440 103.220 -77.314 90.651 -45.602 129.926 -76.470 92.501 -41.131 141.532-127.102 94.129 -41.581 61.476 -61.621 90.988 -42.391 131.903 23.720 100.032 -43.218 165.616 169.091 90.076 -62.394 121.434-116.356 88.669 -80.423 84.711 -87.647 107.972 158.157 138.711 171.032 107.608 -19.694 91.053 -97.957 100.757 121.120 108.940 -80.658 98.824-127.688 155.334-132.494 106.013-113.104 140.583-157.179 92.909 46.400 141.190 154.674 92.039 46.463 134.197 -85.436 90.289 48.380 124.673 -60.358 91.538 50.309 112.201 -35.952 91.327 41.896 108.508 -81.838 90.098 46.846 0.000 0.000 89.757 61.604 108.832 -83.914 86.380 46.341 143.318 -79.537 88.850 44.892 117.371-125.716 89.248 53.941 109.555 -76.050 88.609 51.886 143.612-100.342 90.982 37.848 129.833-140.589 97.729-118.139 144.327-125.640 115.750 173.326 152.801 -15.899 97.191 -56.233 94.201 -97.819 88.068 -54.033 111.139 -75.372 88.902 -55.403 134.427 -34.843 89.797 -45.872 118.882 -74.777 91.638 -41.627 127.111 -75.626 88.941 -49.726 99.943 -73.899 90.855 -51.695 151.225 -19.431 91.183 -75.238 136.840 -90.535 89.397 95.170 127.913 -76.080 93.153 59.729 103.715 -60.732 90.839 48.355 129.952 -76.049 90.661 42.059 138.788 -46.394 92.090 45.410 128.441 -39.713 91.483 51.791 137.981-104.169 90.498 43.433 132.271-146.811 95.472 72.457 104.108 -80.138 92.487 0.000 129.002 -76.672 # 919 total E -1.46649E+02 rmsd from N 0.000 %NC 0.00 93.058 156.650 140.659 -97.239 93.294 53.709 152.914 123.157 91.968 46.071 107.315 -80.358 90.666 49.287 129.957 -75.672 91.018 43.429 153.197-151.624 91.667 42.948 130.406 177.012 91.779 41.883 109.193 -61.124 94.212 44.083 139.865 -77.910 91.189 38.899 148.593-124.785 93.069 44.340 84.371-108.981 93.630 48.012 131.575 -92.732 101.933-148.569 99.979 -95.964 102.566-166.265 138.533-162.652 108.767 -52.910 147.299-126.457 96.668-118.210 137.133-151.425 92.651 46.801 147.387 135.443 92.317 47.129 134.026 -84.931 91.010 45.902 128.329 -56.786 92.022 48.454 131.749 -36.150 90.772 43.507 109.073 -82.362 90.807 44.532 0.000 0.000 90.236 55.363 113.551 -81.629 87.350 43.624 142.140 -88.666 89.350 46.691 118.191-127.815 88.007 56.216 109.320 -76.366 89.424 46.762 142.137 -98.108 91.314 40.086 128.426-146.785 100.558 -50.461 106.655 -84.457 134.220 81.810 154.259 -13.233 126.848 159.304 109.287-105.379 94.954 65.597 118.342 -78.399 92.041 48.239 122.038 -52.747 93.126 39.547 120.620 -42.380 92.676 48.777 128.893 -75.056 90.197 42.412 105.296 -86.099 93.268 39.315 120.095 -82.214 94.469 40.488 128.856 -75.617 92.307 42.457 130.420 -77.483 91.390 45.891 103.434 -81.419 92.232 40.941 128.361 -76.452 93.318 40.998 137.970-125.863 92.005 46.343 134.864 -83.031 91.155 50.645 122.972-124.552 90.808 43.024 130.843-142.064 95.864 65.738 103.761 -80.637 92.463 0.000 129.087 -76.658 # 920 total E -1.47395E+02 rmsd from N 0.000 %NC 0.00 93.055 -63.981 127.896 -79.269 94.543 -47.047 115.459 -79.520 91.067 -46.428 103.009 -77.488 90.520 -46.007 129.742 -76.269 92.626 -40.642 141.522-123.278 94.494 -40.654 61.354 -63.322 92.013 -42.398 131.003 27.461 99.808 -41.682 168.402 169.179 90.653 -63.877 122.799-119.068 87.584 -79.241 83.002 -87.574 108.338 160.091 139.069 165.263 105.184 -20.920 92.385 -97.102 98.878 112.026 110.746 -81.999 100.161-135.768 154.123-142.834 114.263-107.924 143.481-163.940 94.574 44.029 145.226 168.788 92.258 46.316 134.752 -85.462 90.261 50.108 122.442 -65.645 91.430 51.279 109.799 -41.952 91.416 41.157 108.890 -81.582 90.498 46.856 0.000 0.000 89.464 68.783 113.384 -86.731 85.400 46.080 138.294 -93.057 89.300 48.191 114.405-123.515 88.260 60.648 109.469 -73.339 87.947 53.021 140.067 -97.266 90.119 39.665 134.174-129.603 97.277 -92.672 105.934 -83.529 119.618-145.456 156.055 -19.319 132.398 152.920 114.675-109.008 99.276 39.526 117.338 -78.266 95.189 111.103 133.644-113.194 114.971 -21.479 115.735 -75.630 93.929 -51.365 128.350 -76.838 96.476 -30.152 97.549 -82.077 91.664 -51.410 122.810 9.600 94.945 -28.362 153.662 -3.207 100.979 -38.965 130.338 -77.377 112.733-115.441 147.949-108.999 91.310 54.643 131.182 -77.057 91.525 43.539 141.012-105.688 89.424 49.964 131.641 -38.682 90.404 63.394 138.907 -48.886 86.935 45.200 139.065-136.558 94.144 78.585 100.989 -78.686 92.504 0.000 129.287 -76.491 # 921 total E -1.46929E+02 rmsd from N 0.000 %NC 0.00 92.641 140.527 131.240 -66.199 94.572 50.891 138.854 31.533 94.451 43.651 106.003 -75.099 92.700 44.722 127.907 -74.566 95.649 61.194 143.174 -32.754 96.495 -65.233 64.423 -82.421 113.886-142.187 133.879 34.763 96.787 53.781 134.829-107.928 88.679 57.291 140.669 172.596 89.703 100.384 85.906 -96.199 91.188 -64.769 137.978-102.882 99.165 -57.601 96.398 -95.320 91.047 -73.129 106.385 -78.633 110.902-147.264 154.100 -19.810 104.597-118.886 143.782-141.601 92.344 48.274 145.760 142.686 91.770 47.183 133.628 -85.408 90.980 46.762 128.438 -60.251 90.918 48.062 109.711 -29.598 90.121 45.295 107.489 -81.872 90.985 47.198 0.000 0.000 93.510 35.563 113.442 -84.420 99.900 35.598 139.491 -77.222 100.071 35.899 125.817-118.728 93.293 46.951 114.378 -79.026 92.584 55.083 130.155 -95.953 91.105 49.205 137.980-156.093 92.373 26.824 142.720-130.238 115.123 50.527 114.027 -85.488 140.008-176.556 105.444 -89.154 96.325 45.056 115.399 -77.336 91.681 49.068 103.260 -9.012 89.051 54.640 135.580 -0.110 89.329 51.792 128.443 -76.646 88.948 46.871 102.984 -83.429 90.693 45.580 134.854 -40.876 89.782 50.815 135.052 -83.418 89.742 48.165 128.325 -77.101 92.312 84.556 113.484-107.245 87.885 -78.448 129.804 -76.983 92.362 -48.999 139.153-120.636 85.868 -57.314 107.943 21.786 90.904 -59.406 145.117 -28.094 89.179 -33.841 114.641 -84.675 105.607 115.549 104.287 -77.800 92.482 0.000 129.757 -76.031 # 922 total E -1.48725E+02 rmsd from N 0.000 %NC 0.00 93.067 -65.089 126.001 -69.052 120.689-102.689 132.117 -34.834 93.819 41.017 110.084 -80.664 93.802 49.931 130.640 -76.808 93.530 39.594 151.132-141.946 91.040 46.805 66.861 -94.138 89.926 44.526 113.557 -57.300 89.850 47.953 133.103 -91.287 90.911 38.876 126.726-107.537 97.593 100.985 92.765 -97.468 101.633 -49.073 147.607-115.980 98.770 -61.529 91.610 -91.210 88.022-111.331 134.959-148.962 100.293 -50.986 154.262 -34.478 95.879-113.209 147.680-145.672 92.395 50.176 141.559 112.390 92.904 44.738 134.056 -84.703 90.583 46.843 158.263 -46.601 91.102 52.053 157.939 -46.203 88.175 45.014 145.448-143.352 91.099 43.267 0.000 0.000 91.018 47.812 132.450 -99.412 90.831 42.046 128.380-109.238 90.519 45.792 117.146-123.842 88.865 55.705 114.265 -76.668 89.074 48.660 133.992-105.192 91.273 42.747 132.801-147.388 96.770 -86.912 107.026 -85.020 119.227-107.426 162.812-152.643 126.120 117.136 128.609-134.659 94.024 43.876 114.983 -77.426 91.870 49.005 106.631 -21.024 89.957 49.729 116.028 -74.392 90.238 46.065 129.989 -77.567 88.539 47.926 101.947 -83.486 88.409 92.074 109.809 -46.253 87.015 59.399 139.482 -48.803 88.296 43.141 128.162 -76.241 89.387 52.550 133.028 -52.532 89.930 44.046 128.746 -76.085 90.724 47.732 145.445-163.948 89.733 49.975 128.498 -44.393 89.545 53.004 134.272 -87.970 90.463 43.996 134.398-132.504 95.220 74.589 104.241 -80.662 92.556 0.000 128.986 -76.603 # 923 total E -1.50183E+02 rmsd from N 0.000 %NC 0.00 92.903 146.069 138.587 -88.109 93.747 53.641 138.351 43.142 90.762 50.084 106.707 -82.867 92.580 45.794 129.635 -77.055 95.573 41.919 153.213-131.543 92.844 43.191 55.096 -74.440 91.137 45.975 122.847 -29.766 90.746 47.754 125.657 -97.955 89.812 44.493 135.529-112.406 95.927 115.172 86.274-101.128 103.589 -48.359 142.954-109.892 96.979 -49.078 92.849 -88.418 91.641 -55.880 142.448 -14.457 129.954-118.919 173.302 1.215 107.304-122.318 139.173-164.536 96.166 46.024 142.619 146.306 92.145 46.572 135.365 -84.128 90.631 50.375 126.894 -72.624 92.593 51.050 132.592 -37.257 93.988 39.081 145.483-160.188 91.852 44.224 0.000 0.000 91.444 64.153 102.531 -85.142 86.474 51.326 146.888 -80.797 89.879 40.938 115.103-128.624 90.583 50.982 113.207 -74.510 89.808 47.006 141.185-104.823 91.820 54.381 136.932-147.924 92.065 -94.079 101.754 -82.774 118.050-174.510 153.772 -10.155 126.472 -7.202 116.907-118.271 112.967 -25.950 117.015 -80.465 98.556-121.895 127.225 -24.489 93.479 44.964 113.111 -75.896 94.412 54.196 129.442 -75.972 101.124 16.650 103.244 -75.382 97.121 51.136 152.611 -17.833 90.446 46.768 148.411-127.338 91.001 42.301 128.442 -77.201 90.460 46.610 114.331 -27.809 90.918 50.354 129.666 -76.510 89.978 45.641 137.774-128.812 91.731 71.703 131.204 -45.932 89.545 -91.450 138.831 -57.640 98.099 -37.398 136.400-134.901 101.284 -89.727 103.582 -68.276 92.886 0.000 129.628 -76.314 # 924 total E -1.47341E+02 rmsd from N 0.000 %NC 0.00 93.201 161.492 140.432 -96.634 93.625 54.169 151.609 113.713 92.201 44.571 108.120 -81.267 92.471 50.586 129.894 -76.443 92.609 42.019 155.647-156.691 93.119 42.228 75.654-103.594 91.930 43.154 110.008 -79.240 89.644 54.897 138.989-102.107 90.466 57.335 112.754-101.031 86.108 170.216 93.089 -90.504 105.816 59.309 147.852-158.684 94.171 40.858 98.115-128.916 96.618 37.254 100.176 -81.688 92.781 51.913 133.922 -49.276 91.425 45.774 105.310 -93.771 91.591 44.335 131.890-118.371 93.671 23.363 121.283 -81.444 113.397 157.394 136.169 -73.082 91.902 52.532 143.279 102.901 92.291 55.231 142.908-160.359 93.522 40.433 0.000 0.000 91.401 45.558 156.201-130.914 91.260 45.778 124.513-124.238 90.458 44.651 116.862-127.614 89.846 45.158 115.643 -79.010 91.384 47.358 139.173-111.623 91.845 51.345 128.767-146.944 91.997-102.507 103.763 -83.889 112.139 177.997 156.994-141.784 123.426-163.235 112.348-113.419 93.934 48.708 113.790 -76.128 95.306 37.107 87.127 -53.369 95.969 42.682 143.504 -58.203 93.334 43.086 129.295 -77.492 90.168 47.333 109.782 -88.764 89.397 51.523 126.794 -99.405 88.519 52.654 138.995-113.678 88.242 45.058 128.152 -76.867 90.539 68.825 101.692 -69.445 89.793-100.408 129.663 -77.411 97.946 -51.307 138.971-112.048 96.421-124.543 112.038 35.599 115.607 -87.284 156.738 -23.302 96.850 -17.373 144.124-135.200 100.510 16.877 103.183 -73.305 92.474 0.000 129.571 -76.446 # 925 total E -1.48581E+02 rmsd from N 0.000 %NC 0.00 92.898 146.449 138.126 -86.271 93.615 54.376 136.287 50.314 91.208 48.534 106.993 -82.510 92.018 45.286 129.301 -76.861 94.272 47.239 156.719-143.694 94.381 39.705 56.949 -71.947 91.899 46.242 128.277 -25.341 91.037 46.063 126.951-109.672 89.494 54.071 142.872-179.218 86.379 47.356 77.915-111.500 92.561-169.687 122.980 -79.840 97.240 85.527 135.376-160.771 99.135-177.663 107.714 -83.467 136.654-103.196 162.907-158.273 113.127-108.919 136.933-148.985 92.786 48.434 149.445 158.395 91.149 48.726 133.591 -83.538 89.985 51.329 148.057 30.591 89.211 48.217 149.655 -84.564 88.903 49.391 141.891-163.905 88.440 50.093 0.000 0.000 89.328 49.722 107.900 -78.601 89.468 44.261 142.125 -75.783 90.142 45.155 120.873-125.394 89.033 52.313 111.794 -79.272 89.433 48.901 138.921-105.930 90.603 45.274 130.109-148.002 94.907 -91.531 104.559 -83.817 125.731 167.010 166.704-161.994 118.861-158.155 118.798-126.329 100.199 47.317 115.607 -77.564 93.523 43.481 105.639 -15.445 93.606 44.165 118.877 -76.269 93.438 40.575 129.173 -77.525 95.372 41.735 101.724 -83.140 91.268 58.821 144.799 -22.865 88.931 50.214 133.418-100.309 89.474 41.561 128.123 -76.815 92.148 69.255 120.849-116.703 90.074-106.641 129.436 -77.169 95.938 -41.058 139.615-111.169 97.281-117.334 119.457 34.874 98.967 -72.674 145.786 -38.338 93.063 -6.760 142.158-135.865 110.330 50.180 101.060 -72.891 92.457 0.000 129.219 -76.471 # 926 total E -1.51636E+02 rmsd from N 0.000 %NC 0.00 93.176 -72.712 127.999 -80.371 94.105 -48.255 119.270 -80.452 90.661 -47.504 103.150 -77.115 90.067 -50.240 128.024 -75.723 90.510 -38.381 139.847-129.688 92.800 -45.780 64.022 -67.711 90.999 -33.619 124.022 -20.547 107.001 -35.063 168.439 132.478 93.966 -43.667 131.220-121.901 94.920 122.370 86.780 -90.062 116.010-168.215 136.986 -96.095 95.335 80.609 98.801-122.539 115.516 108.648 113.136 -89.317 128.308-107.286 168.648-151.558 112.038-117.676 140.492-157.204 95.825 43.650 154.112 170.012 92.542 46.268 134.442 -82.234 90.963 49.268 125.342 -65.258 91.305 50.559 126.334 -51.517 92.388 41.410 108.731 -82.933 92.035 42.352 0.000 0.000 90.276 62.673 109.297 -85.500 87.550 50.167 139.080 -83.166 90.186 39.655 117.769-123.715 90.813 52.471 108.507 -75.489 91.327 72.258 144.375 -89.443 90.855 62.929 138.064-149.196 91.351 -18.716 141.422-129.555 119.820-117.182 109.018 -77.755 113.084-129.568 133.783-149.328 138.188 -88.299 123.026 -86.752 106.409-115.155 132.041 -23.572 92.835 49.194 126.138 19.902 91.029 51.672 128.820 -75.822 88.798 45.743 102.092 -78.537 90.843 46.952 143.787 -31.671 89.101 47.034 166.116-154.514 90.430 42.694 128.220 -76.646 89.937 48.043 115.866 -47.127 90.316 46.459 129.625 -77.307 90.322 46.374 139.844-122.562 90.132 47.679 127.428 -41.441 89.942 53.232 137.663 -93.716 90.233 43.423 131.899-132.722 95.483 73.526 104.683 -80.034 92.521 0.000 128.892 -76.643 # 927 total E -1.50354E+02 rmsd from N 0.000 %NC 0.00 93.317 -82.979 125.079 -68.368 116.383-103.546 134.557 -20.919 93.427 44.869 107.754 -80.625 93.116 48.036 130.797 -77.625 93.625 42.746 138.468-122.826 91.349 44.367 59.730 -77.542 91.171 43.581 121.549 -42.017 89.890 45.535 136.924-104.228 89.380 50.258 126.410-120.804 88.197 51.783 84.910 -99.014 90.404 147.188 132.984 -85.822 94.766 87.037 125.492-148.652 93.139 102.669 99.514 -86.253 93.912 -67.381 128.368 -93.742 99.096-121.936 137.023-145.164 91.570 51.440 137.345 116.695 91.716 46.897 134.966 -85.767 90.907 47.085 132.076 -50.901 90.219 48.387 135.515 -19.074 90.603 46.437 151.825 -25.626 90.650 44.575 0.000 0.000 89.017 55.275 109.561 -78.498 88.475 50.366 138.945 -77.638 89.627 41.431 122.640-125.600 89.917 48.761 109.708 -75.980 90.328 53.939 144.802 -99.372 90.143 48.035 134.045 -88.731 90.981 31.169 114.267 -89.881 107.038 151.602 110.298 -78.108 96.804 128.295 135.176-159.968 114.607 -2.393 118.754 -80.182 113.233-130.205 128.265 -8.581 96.392 45.282 137.849 -30.805 92.528 47.178 129.013 -76.111 89.303 45.820 114.210 -85.883 91.018 45.866 126.470-101.179 89.987 50.550 151.430-153.979 89.492 42.672 127.876 -76.576 91.304 67.874 103.550-100.059 90.592 -88.626 129.424 -76.876 106.684 -72.256 111.343-108.786 92.628-136.514 113.089 52.212 117.859 -87.109 165.975-150.532 98.393 -11.959 106.724 -90.735 101.237 67.208 103.119 -78.447 92.508 0.000 129.205 -76.424 # 928 total E -1.48657E+02 rmsd from N 0.000 %NC 0.00 92.971 -63.363 128.583 -81.714 94.546 -47.859 115.614 -79.198 91.474 -45.569 103.305 -77.380 90.766 -46.258 129.311 -76.104 91.418 -41.577 141.971-127.733 93.894 -41.180 60.546 -59.791 91.303 -42.150 130.557 24.580 98.612 -43.745 166.938 164.531 90.880 -61.529 120.678-118.249 88.721 -81.081 82.482 -88.182 109.431 161.429 140.083 169.058 106.388 -24.544 91.870-100.445 100.757 123.259 107.374 -80.757 95.305-126.825 154.621-137.331 107.557-112.763 142.493-160.436 93.440 45.308 142.825 161.037 92.352 45.983 134.354 -85.544 90.401 48.536 119.528 -59.774 90.936 52.036 112.550 -39.137 90.535 43.158 109.112 -81.878 90.263 44.741 0.000 0.000 89.630 60.432 111.708 -84.712 86.744 47.385 140.356 -80.614 89.076 44.061 119.065-125.317 89.515 51.341 109.683 -77.564 89.662 52.501 137.375 -96.888 91.965 51.113 133.020-139.482 94.595-105.111 108.405 -86.287 96.568-179.631 147.646-121.841 110.503 -38.489 89.941-114.562 108.999 -39.380 112.761 -80.603 93.833-120.587 121.181 -24.009 94.377 48.608 110.639 -76.611 91.732 55.159 130.476 -76.697 89.978 42.092 103.099 -79.521 92.679 77.573 112.152 -40.485 90.390 -79.039 139.480 -53.419 96.168 -55.282 129.257 -77.163 97.813-136.526 99.641 -56.548 91.459 47.084 129.765 -75.975 93.805 46.940 142.174-121.651 94.607 98.679 125.483 -12.421 92.685 -56.764 142.980 -91.753 97.201 -59.689 101.820 -87.487 93.463 107.622 104.948 -78.590 92.549 0.000 128.692 -76.500 # 929 total E -1.46904E+02 rmsd from N 0.000 %NC 0.00 93.074 156.238 138.548 -89.286 93.365 57.051 131.555 49.361 92.030 44.023 107.038 -81.498 91.834 46.456 130.208 -76.825 91.929 46.225 153.519-155.505 93.098 43.517 57.050 -65.192 89.107 47.908 132.586 -24.714 87.287 60.507 129.269-123.979 87.578 46.596 129.360-135.317 90.482 51.523 82.858-101.886 103.567 -36.621 140.382 -82.772 115.576 -84.976 90.758 -68.069 120.513 161.644 146.818 -0.684 118.693 172.721 144.193-116.364 127.387 -80.150 146.671 173.428 94.683 46.162 150.637 144.289 92.621 42.207 134.599 -85.441 90.982 51.314 138.098 -52.035 89.801 46.530 134.545 -32.265 88.747 45.775 144.550-160.085 89.397 48.849 0.000 0.000 89.818 46.493 113.871 -78.860 90.636 41.996 140.912 -84.653 90.586 46.920 119.694-124.482 88.943 51.606 112.047 -80.671 89.606 50.220 137.422-105.497 90.560 43.863 129.381-147.415 95.617 -98.363 105.329 -84.151 117.308 177.382 160.810-150.052 133.933-164.078 109.024-102.014 97.439 43.455 115.309 -77.568 93.216 45.799 103.171 -4.172 91.626 46.416 125.270 -1.785 90.244 48.208 130.630 -77.366 89.503 44.297 104.297 -84.314 89.098 47.661 117.883 -23.110 89.703 50.856 137.180 -45.292 89.065 43.081 128.330 -76.557 89.998 67.588 115.077 -46.323 89.488-101.547 130.551 -77.936 98.325 -53.665 130.328-121.101 93.179-117.304 124.224 -0.801 108.503-110.928 154.035 -22.051 96.852 27.747 137.137-143.567 99.478 36.138 101.023 -76.070 92.518 0.000 129.066 -76.715 # 930 total E -1.49419E+02 rmsd from N 0.000 %NC 0.00 92.983 158.583 135.716 -81.059 93.547 59.466 144.300 25.229 93.825 44.373 107.451 -79.013 92.015 46.029 132.322 -77.883 94.535 46.918 144.349-112.916 92.410 37.956 56.667 -78.042 92.635 44.459 162.549 160.800 94.162 38.979 129.880 -92.175 92.708 42.699 152.704-154.544 94.452 53.955 81.016-107.980 94.004 -34.379 147.803-115.846 127.719-101.144 111.606-109.005 105.115-158.061 143.195-176.805 120.018 -87.058 143.965-131.331 97.010-119.695 136.633-145.808 93.585 44.389 141.238 143.254 92.061 46.937 134.685 -85.474 90.042 50.637 114.928 -26.857 90.594 51.339 117.778 -32.857 89.861 42.090 153.719 -14.088 89.545 49.379 0.000 0.000 88.698 56.582 126.885 -42.432 87.885 49.675 143.528 -85.343 89.365 44.028 120.987-130.565 88.793 54.843 105.922 -72.965 89.222 54.168 134.813 -51.216 90.639 45.188 133.393-126.295 92.339 38.072 142.443-128.999 99.308 133.844 111.508 -81.708 127.008 170.445 127.176-131.620 96.772 -21.454 112.702 -78.329 96.573-125.806 123.445 -14.817 93.361 48.304 139.253 -25.725 92.093 49.385 130.171 -76.897 90.976 43.062 102.399 -79.010 92.752 45.929 130.757 -39.047 93.572 42.796 130.399 -77.223 92.654 38.240 130.194 -78.172 94.562 100.584 103.738 -83.621 90.408 -73.141 133.306 -99.825 91.841 -48.669 145.248-132.023 91.522 -51.946 129.456 -32.138 94.966 117.178 146.070 -33.023 98.182 25.482 141.452-169.936 99.430 22.041 105.242 -77.701 92.396 0.000 129.705 -76.055 # 931 total E -1.46901E+02 rmsd from N 0.000 %NC 0.00 93.174 163.921 141.605-103.236 93.963 52.378 135.833 28.225 91.465 46.130 106.084 -82.145 91.540 49.344 130.546 -77.534 92.531 47.162 144.200-125.068 90.841 43.791 60.725 -72.844 90.333 45.919 129.752 -40.496 90.679 48.319 122.853-113.525 87.850 45.912 139.976-156.068 90.933 65.485 82.235-104.467 91.552 -61.394 141.039 -98.583 117.771 -74.418 118.991-123.986 102.304-152.728 142.134 176.908 123.199-102.471 142.324-157.736 109.821-112.434 142.354-153.662 95.601 41.496 150.729 151.673 92.110 46.232 134.803 -84.327 89.921 53.932 117.194 -34.484 90.720 51.511 138.680 -51.485 90.645 38.448 152.372 -15.991 90.964 48.317 0.000 0.000 88.715 58.910 135.076 -37.792 87.779 48.819 138.802 -91.829 89.165 44.965 120.843-130.310 88.377 58.255 110.136 -72.024 90.746 42.980 136.742 -47.916 93.767 41.769 137.952-130.241 96.517 28.287 144.156-128.996 114.419-105.596 162.360 -21.333 130.809 -82.675 104.511 -96.224 92.074 63.917 119.793 -76.688 91.092 45.756 110.616 -46.597 88.394 51.891 109.809 -71.866 90.870 46.833 125.421 -73.636 89.581 41.714 106.865 -89.671 93.569 41.891 121.624 -87.710 95.151 38.244 128.673 -81.501 93.483 40.427 129.693 -76.352 94.303 38.849 114.314-121.664 96.691 34.685 128.825 -76.980 98.689 32.660 138.027-115.007 94.704 45.936 135.605 -64.665 92.101 46.769 113.966-120.868 91.966 45.320 108.883 -91.110 95.625 62.416 103.749 -80.349 92.510 0.000 129.240 -76.683 # 932 total E -1.49458E+02 rmsd from N 0.000 %NC 0.00 92.919 139.688 137.024-102.862 129.499 57.973 135.296 89.561 98.518 34.523 102.211 -81.034 92.318 52.178 130.831 -77.178 92.289 47.866 156.380-162.466 92.572 37.663 63.582 -76.331 94.751 41.297 124.645 -39.273 94.759 37.648 135.589 -99.337 92.727 55.530 145.394 155.762 90.364 84.673 97.755-134.746 91.800 -69.953 123.035-119.761 98.460 -50.385 92.441 -95.697 90.385 -39.374 107.197 -70.816 115.275-122.758 158.494 -17.116 95.465-121.994 135.469-125.122 90.410 52.937 142.654 120.502 91.693 47.986 134.306 -85.155 91.010 46.344 142.133 -49.178 91.014 44.763 133.365 -19.086 91.152 47.639 145.229-160.056 90.238 45.325 0.000 0.000 90.493 47.579 110.325 -82.714 89.568 45.505 144.572 -81.987 90.259 44.917 119.780-127.927 88.381 51.437 113.858 -78.723 89.837 49.407 137.858-108.209 91.455 46.823 133.971-142.672 94.087 -98.327 141.947-121.160 121.360 172.312 153.020 -13.047 123.905-128.003 117.489-121.979 116.221 20.338 117.975 -79.766 91.779 52.463 104.290 -6.995 92.437 40.303 113.829 -77.046 94.726 46.261 128.589 -76.056 97.577 18.762 103.857 -83.101 105.737 37.097 145.224 -27.191 95.105 45.589 138.162 -84.232 91.236 42.095 128.942 -77.610 91.569 78.061 102.351 -99.596 90.879 -83.246 129.032 -77.437 97.364 -48.728 140.924-116.646 92.749 -40.479 123.011 36.981 94.817 -64.182 129.629 -86.826 90.794 -60.616 105.366 -89.148 95.118 62.015 104.304 -78.600 92.354 0.000 129.598 -75.948 # 933 total E -1.49682E+02 rmsd from N 0.000 %NC 0.00 93.216 -70.619 130.300 -86.860 94.420 -46.266 119.694 -81.277 90.321 -49.372 102.916 -76.823 90.066 -47.848 129.405 -76.261 93.499 -35.531 142.720-139.613 97.875 -40.287 61.596 -73.397 92.963 -32.326 118.844 -40.994 105.614 -36.998 171.005 177.998 93.312 -46.360 133.702-119.305 94.489 123.747 92.904 -95.274 126.990-119.060 145.184-106.823 101.320 -32.282 97.812 -98.906 101.478 -65.277 106.824 -77.447 109.863-146.594 152.507 -35.319 107.840-128.310 133.522-153.811 95.846 41.913 146.459 128.212 91.692 47.156 134.797 -87.715 90.586 52.035 140.165 -87.464 91.408 48.425 119.569 -25.593 92.942 37.003 106.658 -82.559 90.917 50.124 0.000 0.000 90.303 52.463 103.519 -87.775 90.278 47.804 144.541 -71.752 91.841 38.198 119.888-126.307 91.357 52.940 112.045 -77.265 91.364 68.315 133.116 -95.308 89.358 45.929 143.592-155.355 91.625 36.438 142.686-129.196 109.870 -2.900 114.324 -88.462 140.191-159.605 102.705 -83.891 92.970 57.658 114.984 -76.186 91.680 49.194 97.964 -15.686 90.382 47.502 132.326 -4.796 90.567 47.896 129.583 -76.505 88.839 46.803 102.198 -83.431 90.213 48.024 137.751 -29.494 90.751 46.347 140.436 -85.017 89.516 41.074 128.983 -77.592 88.452 66.388 121.553 -67.962 90.413 44.451 127.413 -76.008 91.321 44.561 137.195 -29.303 92.993 46.558 125.541 -36.069 95.342-142.290 128.746 -82.164 93.362 38.052 138.605-143.063 119.541 166.410 104.996 -77.107 92.661 0.000 129.545 -75.979 # 934 total E -1.47573E+02 rmsd from N 0.000 %NC 0.00 93.329 -78.372 130.880 -89.272 94.086 -48.534 122.847 -72.817 91.424 -47.870 102.917 -78.712 90.595 -46.812 129.561 -75.769 93.288 -38.441 144.749-168.588 93.560 -53.019 76.389 -92.023 86.777 -63.322 131.841 53.984 101.653 -31.904 166.387 157.771 101.476 -46.330 122.588 -95.144 92.725-116.890 99.583 -83.113 114.394 71.731 123.763 177.252 93.248 58.642 93.144-123.190 95.241 61.854 104.410 -85.136 93.423-101.164 137.347 -79.303 101.138-120.693 151.526 -33.411 92.480 48.913 139.359 151.662 92.065 46.439 137.803 -83.723 90.217 48.398 123.405 -48.749 90.202 52.441 116.041 -34.693 89.092 47.103 148.783-138.260 89.901 43.879 0.000 0.000 90.370 54.622 118.829 -82.387 87.105 47.810 144.181 -88.379 88.417 46.640 118.918-130.549 88.364 51.633 108.571 -78.483 89.200 49.851 139.796 -96.495 90.562 48.643 130.506-140.538 93.795-100.716 104.328 -83.392 116.085 114.131 159.191-147.204 105.434 160.886 90.693 -85.835 99.330 39.031 149.428-113.329 95.707 46.918 127.953 90.148 97.686 104.182 112.384 -74.710 91.961 -64.687 130.087 -77.285 92.579 -42.317 103.318 -82.386 88.940 -92.841 105.046 -52.977 90.779 -59.591 146.372 -36.635 90.756 -33.844 130.502 -77.704 100.733-155.593 115.914-125.724 93.134 52.672 130.504 -76.110 91.826 43.019 139.858-105.629 90.280 50.392 130.164 -21.027 91.178 58.178 136.236-115.259 87.837 39.292 129.341-163.105 95.556 79.606 103.427 -79.923 92.477 0.000 128.940 -76.634 # 935 total E -1.47036E+02 rmsd from N 0.000 %NC 0.00 93.230 -73.826 125.862 -69.046 115.146-106.355 137.033 -34.712 92.352 45.495 107.374 -81.124 93.236 48.248 130.615 -77.449 95.474 40.984 149.625-124.912 92.408 42.895 57.876 -82.218 90.097 46.033 118.247 -39.420 91.090 48.608 128.501 -94.517 87.576 44.520 140.038-128.397 90.568 45.418 75.770 -99.253 93.344-176.100 126.056 -63.755 92.871 64.673 136.830-165.212 111.270-161.388 143.269 -29.552 119.256-128.148 153.350-115.624 110.407-111.836 139.976-161.230 94.026 44.672 141.695-108.486 92.198 47.833 136.987 -74.504 91.103 46.153 123.110 -64.621 92.528 47.045 132.655 -24.784 92.441 42.219 145.076-165.181 90.810 45.524 0.000 0.000 91.081 50.793 106.870 -84.276 90.059 45.925 143.966 -73.741 91.687 39.918 119.789-125.994 91.016 49.151 111.845 -77.328 90.849 53.205 132.311 -94.661 91.390 42.483 139.922-160.652 94.790 35.266 143.131-127.125 102.100 10.678 155.596 -20.477 130.351 170.481 110.358-105.542 100.965 42.905 116.072 -78.245 94.995 44.021 132.811-107.618 92.685 58.212 115.449 -72.264 94.409 172.693 129.134 -75.430 92.867 -40.222 95.547 -83.592 91.262 -41.919 125.869 -3.066 102.983 -31.896 156.688 -17.083 94.414 -51.843 129.060 -76.242 93.215-120.054 117.783 -97.778 90.829 49.880 131.319 -77.139 91.183 53.099 141.340-106.715 90.258 51.220 111.299 -7.952 92.394-125.383 145.441 -36.003 97.704 10.156 107.478 -88.040 121.560 125.509 99.970 -75.490 92.630 0.000 129.509 -76.536 # 936 total E -1.49797E+02 rmsd from N 0.000 %NC 0.00 93.389-108.931 132.706 -90.685 95.651 -37.435 149.071-128.523 100.374-100.487 112.452 -77.916 90.826 68.250 130.147 -77.211 93.924 54.933 147.327-137.886 93.048 39.168 55.210 -69.246 92.062 46.317 128.207 -28.684 93.075 43.669 128.161-110.526 89.896 49.240 144.038-170.147 88.050 49.412 77.527-103.098 93.436 142.277 132.034 -78.781 89.191 76.307 105.297-129.037 93.478 108.793 97.496 -84.086 91.957 -64.406 135.121 -56.881 94.423-121.396 141.362-136.358 90.238 50.640 135.954 120.252 91.946 46.869 133.065 -85.818 91.129 44.559 148.579 -3.715 90.666 48.932 136.381 -21.910 88.508 50.422 110.815 -82.739 89.652 44.949 0.000 0.000 89.082 48.770 121.527 -78.056 90.442 44.660 130.392 -84.511 89.260 46.676 123.053-120.455 88.714 49.999 109.772 -82.099 89.748 52.682 135.738-101.413 90.744 45.480 131.309-130.270 93.782-110.862 103.381 -82.338 100.504 174.062 150.292 -16.249 107.492-153.262 86.873 -89.984 93.550 54.514 129.345 31.163 93.219 44.344 103.079 -21.590 90.852 46.127 128.089 -21.105 90.319 49.279 130.061 -77.604 89.315 48.153 101.590 -81.679 89.306 45.222 121.464 -52.332 89.795 53.940 132.916 -61.351 89.760 54.218 128.753 -77.005 89.346-176.697 110.026-100.805 93.038 78.889 131.445 -77.336 91.443 41.693 140.883-105.743 93.147 66.331 125.628 -13.475 92.293 -80.898 144.400 -50.865 110.854 -49.131 108.440 -83.898 96.456 125.577 146.894 -21.999 92.531 0.000 128.592 -76.144 # 937 total E -1.48060E+02 rmsd from N 0.000 %NC 0.00 92.688 -26.581 127.565 -75.625 128.804 -31.379 142.569 -48.547 119.807 -77.780 110.270 -78.369 91.183 66.349 128.159 -75.223 91.580 44.130 119.170 -28.984 93.509 42.576 67.350 -65.938 91.932 40.730 115.969 -39.063 110.291 20.617 106.680 -75.113 94.445 38.077 142.369 -38.421 108.299 14.279 83.790 -99.221 104.451 36.347 148.676-149.816 100.929 30.843 88.623-109.522 93.339 51.930 134.247-115.954 93.150 43.166 106.805-116.587 92.408 43.906 133.465-138.742 94.091 51.464 121.449-122.568 99.781 -82.312 128.317 -95.526 127.019-110.579 140.748 -60.914 116.753 27.977 146.451 -61.132 94.423 47.012 108.460 -83.492 88.532 52.829 0.000 0.000 93.046 45.726 99.302 -86.362 89.650 43.829 154.960 -77.229 91.908 43.474 113.326-128.863 90.298 51.014 108.187 -76.214 89.377 56.761 138.532 -86.033 90.553 39.239 136.779-139.742 93.674 45.527 143.574-130.213 98.415 3.426 116.620 -90.731 135.262-165.426 106.971 -95.213 94.874 50.522 114.784 -76.991 92.282 48.616 113.132 -14.989 89.397 48.749 133.381 -13.950 90.674 49.978 130.048 -77.807 88.874 45.664 101.738 -83.279 89.378 49.460 133.513 -51.592 88.900 58.518 143.816 -94.379 87.560 43.013 128.331 -77.167 91.181 82.077 109.757-106.445 88.645 -77.817 129.202 -77.202 92.770 -57.185 142.618-121.948 89.384 -50.751 110.832 32.355 90.290 -58.959 138.845 -47.558 89.970 -15.937 115.501 -83.698 112.151 112.362 103.100 -76.907 92.550 0.000 129.773 -76.249 # 938 total E -1.48139E+02 rmsd from N 0.000 %NC 0.00 93.167 162.084 141.366-101.929 93.975 52.773 132.973 33.771 91.339 45.748 106.360 -81.360 91.369 49.896 131.374 -77.660 91.605 45.889 147.898-133.782 90.834 44.277 59.167 -68.641 89.895 47.780 134.723 -31.127 89.136 50.497 126.905-112.731 86.494 45.528 137.642-157.158 90.737 66.680 78.067-102.793 87.565 -69.670 145.649 -93.515 118.536 -67.097 123.435-131.632 102.558-150.992 141.207 176.910 135.786-114.243 143.775-164.582 114.084-106.188 141.746-158.588 94.537 45.555 153.106 156.432 92.092 46.009 136.095 -84.620 90.545 50.094 129.937 -68.271 90.653 50.200 142.691 -71.025 90.487 42.762 150.705 -25.366 90.892 46.699 0.000 0.000 89.048 57.876 134.343-108.656 88.372 44.857 132.204-107.707 90.613 42.130 117.970-125.617 89.899 53.783 113.023 -79.149 89.833 55.632 141.376-111.401 89.269 54.705 121.414-151.201 93.312 -35.058 142.325-130.045 138.032-127.810 117.184 -78.058 92.913 70.511 135.941-163.802 86.787 59.884 113.925 -75.743 89.462 57.601 99.739 -45.852 89.965 41.750 109.971 -74.334 91.689 48.286 129.444 -76.277 88.272 49.409 103.691 -84.669 89.199 47.735 107.187 -68.744 89.183 54.295 143.135 -35.201 89.146 48.729 128.265 -76.586 90.681-176.551 102.276 -94.698 93.069 74.291 132.365 -77.750 90.828 50.179 141.126-104.385 91.472 49.211 118.971 -13.846 94.701-140.185 144.039 -46.291 97.842 37.201 106.045 -84.322 118.697 87.657 105.702 -77.601 92.560 0.000 129.484 -76.750 # 939 total E -1.48270E+02 rmsd from N 0.000 %NC 0.00 93.197 -80.200 125.197 -68.017 120.203-118.161 127.070 -58.097 94.243 41.015 106.195 -76.786 94.223 44.987 128.309 -76.266 96.099 43.858 137.668 -10.376 92.923 43.056 63.603 -83.762 92.792 42.008 126.162 -58.295 102.292 26.891 118.986-101.404 94.835 47.979 148.533 159.066 90.920 71.983 86.143-113.979 93.439 -73.542 127.380-103.560 108.232 -65.720 88.219 -79.431 91.348 -71.036 141.892 -39.560 123.377-153.455 161.340-174.098 101.385-113.704 137.226-154.824 92.746 48.487 140.035 135.500 91.500 47.881 135.062 -84.747 90.674 47.714 123.229 -58.914 91.668 46.851 127.825 -29.108 91.131 44.584 147.140-164.481 90.339 45.733 0.000 0.000 91.572 47.620 103.371 -81.013 89.738 44.413 144.659 -74.697 91.705 41.632 119.609-125.974 91.463 47.672 111.773 -77.684 90.801 42.987 135.628 -95.580 94.484 54.265 137.280-137.779 94.491 12.480 107.795 -86.603 114.557 60.792 148.329 -19.984 110.826-179.678 89.565 -90.671 94.287 48.217 128.288 24.917 91.207 51.104 106.203 -20.229 87.979 56.573 133.041 -33.113 89.751 49.417 128.991 -77.168 88.779 44.856 102.212 -83.246 90.067 49.244 130.994 -62.948 89.053 61.634 143.819 -89.552 88.441 52.171 128.513 -77.113 89.827 176.850 85.619 -69.487 92.921 64.460 132.716 -77.777 90.525 49.412 141.307-104.450 90.987 48.675 121.504 -16.706 94.678-129.296 135.275 -46.699 94.145 -3.858 106.325 -85.082 125.431 3.121 99.836 -77.370 92.325 0.000 129.280 -75.613 # 940 total E -1.49941E+02 rmsd from N 0.000 %NC 0.00 93.161 -65.268 127.132 -77.213 94.468 -47.948 115.974 -79.045 90.832 -46.623 103.623 -77.419 90.549 -47.361 128.612 -75.928 90.858 -41.429 139.595-118.690 94.420 -40.764 60.093 -57.936 91.931 -40.106 134.597 5.795 99.554 -39.804 166.035 167.546 90.847 -63.536 111.109-113.007 85.407 -86.043 134.156 -5.647 90.953 102.344 147.730 176.654 99.367 34.575 91.093-114.689 96.357 42.276 151.779-149.515 92.230 46.972 146.349 -44.674 96.956 37.318 99.198 -88.486 95.816 42.334 137.556-105.127 96.261 34.178 143.784 -96.115 120.408 -91.914 154.979-152.826 131.302-101.530 103.281 -87.210 91.602 60.491 111.792 -81.740 91.497 47.178 0.000 0.000 89.269 49.285 136.012 -17.903 89.211 52.627 142.146 -88.785 88.682 47.321 123.814-137.135 87.759 51.220 109.217 -70.254 90.405 45.338 133.693 -51.985 91.526 45.007 139.644-140.922 95.376 -78.352 105.975 -84.640 128.864-173.217 155.007 -16.365 92.272 -50.971 103.047-104.792 90.878 -53.368 110.740 -76.022 90.909 -66.384 102.456 -43.953 86.965 114.312 146.473-104.524 93.958 45.843 128.287 -76.302 90.204 45.851 101.038 -78.053 91.407 86.163 143.825 -41.581 88.012 55.015 156.646-152.740 89.912 40.731 127.960 -76.082 91.325 49.106 116.902 -20.599 90.276 50.124 129.890 -76.344 91.495 42.381 140.113-132.744 94.338 104.988 132.006 -51.044 92.493 -48.477 143.047 -74.370 97.325 -56.866 106.610 -85.139 95.441 157.345 106.002 -78.296 92.757 0.000 128.698 -76.279 # 941 total E -1.48029E+02 rmsd from N 0.000 %NC 0.00 125.130-116.147 145.477 -36.378 124.191-103.531 131.598 -40.645 92.738 47.425 109.061 -76.000 94.378 39.641 130.556 -77.987 97.355 40.849 145.771-127.746 96.974 39.964 47.756 -73.983 92.745 43.672 128.017 -20.738 92.216 44.427 137.358-109.677 89.983 48.381 139.169-142.400 88.668 45.617 73.605 -98.715 92.913 177.166 129.302 -61.115 90.520 101.446 133.841-162.531 94.664 75.664 142.628 -50.597 88.787 -91.896 151.323-125.834 102.008-122.287 137.371-160.945 93.908 40.136 158.925 -74.654 91.964 47.342 136.884 -77.816 90.782 48.248 140.719 -80.849 91.442 46.044 107.400 -71.213 91.464 40.060 142.172 179.420 91.162 45.557 0.000 0.000 90.565 46.977 104.037 -85.184 90.154 48.846 146.378 -79.400 90.934 40.447 120.491-133.998 90.254 50.242 114.392 -78.994 89.972 68.646 135.188-104.680 90.964 60.681 142.842-135.525 91.279 3.383 141.130-124.934 122.924 78.359 148.460 -19.620 108.956 -93.525 95.329 -77.947 100.804 -34.639 116.448 -75.958 94.006 -55.894 94.540 -45.942 91.746 147.791 145.798 -74.657 92.007 51.908 128.829 -76.875 90.349 41.025 97.923 -77.350 90.922 54.878 147.995 -25.540 87.919 49.449 157.448-140.541 90.028 39.553 128.160 -76.525 90.657 48.397 118.955 -36.119 90.626 45.084 128.993 -77.237 91.148 46.877 137.941-118.712 90.480 47.698 128.363 -41.802 90.521 50.702 130.057 -72.699 90.947 45.349 109.898 -89.453 95.042 74.923 104.192 -79.736 92.545 0.000 128.997 -76.570 # 942 total E -1.47848E+02 rmsd from N 0.000 %NC 0.00 93.409 -96.974 131.237 -87.290 114.011-129.624 141.253 -19.808 94.922 45.500 109.151 -80.204 94.162 46.451 130.202 -76.860 94.599 37.239 154.844-155.492 93.173 45.295 71.294-104.731 90.631 45.218 109.942 -59.005 90.295 46.584 132.085 -85.827 91.556 41.066 133.246-110.234 97.584 108.751 91.465-101.336 106.051 -44.620 145.081-116.926 96.742 -47.816 93.203 -91.660 90.100 -51.705 140.930 -23.474 112.254 -97.884 162.274 -9.611 98.421-114.594 142.721-144.966 92.621 48.534 145.897 149.757 92.019 46.745 135.902 -88.137 90.765 49.521 146.736 -94.383 89.272 49.189 135.949 -43.994 89.451 46.682 142.671-139.972 91.519 43.343 0.000 0.000 89.882 49.236 141.435-121.615 89.336 45.750 126.227-110.667 90.055 45.940 120.113-127.687 88.848 49.051 113.440 -77.611 90.315 47.885 133.088-100.857 91.542 50.802 132.275-142.929 93.486 -97.481 104.176 -83.776 116.258 179.372 159.780-147.632 123.820-151.099 117.951-123.054 114.797 20.147 117.992 -79.812 91.520 54.764 106.061 -1.959 90.524 45.290 112.002 -77.050 92.239 51.438 129.854 -76.627 94.636 35.817 103.903 -82.854 91.239 48.175 147.960 -26.242 90.299 55.226 127.385-113.032 88.477 42.066 128.447 -77.435 90.769 76.991 115.063-110.860 89.333 -83.140 128.870 -77.169 96.419 -48.166 144.035-135.187 91.550 -44.541 111.969 26.497 92.074 -56.145 141.016 -47.343 90.864 -38.750 138.117-151.886 99.821 48.004 103.156 -79.312 92.359 0.000 129.558 -75.927 # 943 total E -1.48590E+02 rmsd from N 0.000 %NC 0.00 93.330 -87.160 128.561 -81.572 92.772 -51.023 117.604 -69.753 91.677 -44.267 103.567 -74.651 91.937 -46.661 128.590 -76.240 100.025 -17.227 146.637-160.914 103.403 -36.929 55.892 -67.558 95.390 -30.749 164.630 -82.353 102.044 -44.454 147.743 -88.391 91.264 -47.874 140.608-121.499 92.225 -59.166 76.403 -84.214 102.864-168.746 142.302-175.088 105.464 -23.300 94.274-107.002 103.092 144.772 107.792 -85.884 146.718-142.971 176.433-170.530 102.248-120.520 138.894-150.226 94.551 47.663 139.739 144.797 92.332 46.902 134.027 -85.877 91.021 47.425 124.570 -57.189 91.801 49.885 109.876 -29.653 90.772 44.272 107.818 -81.872 89.642 48.807 0.000 0.000 90.631 54.604 107.160 -84.268 87.518 43.760 150.306 -85.186 89.083 51.857 115.433-130.636 88.053 62.663 106.619 -76.771 87.987 53.135 143.699 -85.569 90.762 38.987 135.182-138.208 97.408 -92.650 144.344-126.832 123.143-177.269 153.212 -15.041 135.498-158.272 108.155 -99.019 98.101 43.243 115.140 -77.787 92.495 46.811 98.104 -10.840 90.796 51.246 119.924 1.055 89.611 50.363 129.660 -76.980 88.656 48.700 102.228 -82.854 92.102 74.837 135.594 -37.177 88.354 -89.940 153.719-109.312 95.426 -38.567 130.243 -78.127 99.763-131.079 104.167 -56.711 93.026 44.016 129.962 -76.362 93.649 51.830 141.873-116.134 92.712 65.300 124.101 -14.076 93.801 -99.370 122.659 -86.020 99.981 -17.581 102.129 -86.380 127.903 108.419 103.525 -75.627 92.503 0.000 129.853 -76.479 # 944 total E -1.46524E+02 rmsd from N 0.000 %NC 0.00 124.573 -91.367 144.906 -26.939 119.593-112.419 133.411 -38.130 93.263 46.428 109.066 -81.009 94.636 41.129 130.111 -77.600 98.621 38.253 153.982-134.116 95.909 42.121 53.195 -83.758 92.103 43.724 124.369 -35.133 91.683 45.257 133.156-101.256 89.119 49.839 144.257-141.762 88.483 46.005 78.386-105.296 92.506 175.884 127.816 -77.560 95.610 89.482 135.695-162.556 91.962 176.106 106.398 -84.486 127.902 -91.347 151.700-147.073 101.807-117.603 135.976-149.799 94.607 43.070 145.797 138.603 92.083 46.977 134.686 -84.531 90.454 49.530 122.429 -35.133 92.413 48.091 123.193 -30.854 91.779 39.375 151.060 -6.825 89.554 50.995 0.000 0.000 89.508 57.609 122.696 -46.776 86.882 46.461 145.665 -79.108 89.456 45.667 120.505-130.857 89.478 51.871 106.162 -70.714 91.236 40.369 137.813 -55.353 94.902 41.075 139.806-140.564 97.398 18.017 114.605 -90.498 116.839 149.158 111.084 -75.434 122.114-105.340 120.959-125.657 97.411 -16.864 115.252 -78.627 96.945-121.110 131.180 -43.427 91.496 54.661 116.337 -74.563 93.186 51.485 129.324 -76.031 92.702 35.029 104.995 -78.147 91.984 52.776 174.224-160.805 89.636 48.103 137.905-167.380 91.698 35.695 128.137 -76.573 92.137 53.682 126.445 -40.532 91.137 102.811 130.084 -78.144 91.134 43.916 140.859-172.636 93.099 88.817 126.994 -44.502 92.487 -64.489 148.063 -43.796 98.858 -55.232 107.091 -81.483 95.722 165.342 103.418 -76.889 92.752 0.000 128.648 -76.489 # 945 total E -1.47440E+02 rmsd from N 0.000 %NC 0.00 92.747 134.851 135.731 -79.510 93.185 54.919 141.580 131.552 90.629 48.543 107.672 -80.676 91.858 48.960 128.788 -75.474 92.702 42.714 158.556-178.036 93.137 40.463 76.869-112.335 92.734 44.194 105.143 -72.062 93.077 116.159 141.049 -87.511 88.464 61.847 127.040-141.023 102.238 104.796 76.996 -99.770 97.372 -43.669 172.993-154.159 96.996 -59.229 91.901 -96.418 85.988 -65.847 143.910 -18.098 92.477 -40.876 139.902 147.732 93.768 -55.534 124.825-162.224 94.648 63.964 138.833-121.305 125.333-166.583 145.634 -93.929 145.364 -12.335 113.492 24.929 95.201 42.691 165.198-177.819 98.551 34.492 107.631 -83.015 97.911 39.393 0.000 0.000 90.638 48.370 150.193-156.147 92.388 42.103 107.485-118.413 90.173 47.195 118.571-117.113 88.376 57.447 112.951 -79.872 89.048 53.988 138.699-106.617 90.063 40.524 135.311-148.933 95.603-101.473 105.372 -83.150 108.789-170.052 150.686 -15.403 110.001-152.213 93.660 -82.577 89.338 59.751 114.544 -75.559 92.103 47.180 100.209 -23.774 90.393 44.340 126.420 -1.714 90.170 47.829 129.398 -76.881 87.857 50.952 136.378-138.765 88.910 46.534 136.398 -44.359 89.075 46.532 148.546-104.316 90.102 43.892 128.160 -76.703 88.831 51.117 109.138 -44.447 90.058 45.558 127.669 -76.693 90.237 48.751 135.662-139.234 91.158 61.017 128.858 -43.942 90.290-147.727 136.283 -84.049 95.540 45.402 139.332-144.257 108.585 159.767 101.285 -76.894 92.674 0.000 129.485 -76.140 # 946 total E -1.47199E+02 rmsd from N 0.000 %NC 0.00 93.135 156.087 142.472-102.492 93.745 50.916 140.707 33.127 90.952 48.271 106.320 -82.751 91.440 49.682 130.276 -77.094 95.347 43.496 147.188-126.476 92.792 39.549 59.216 -80.263 90.594 47.179 116.973 -42.024 90.746 52.853 130.351 -89.154 87.117 42.077 147.029-129.134 92.461 40.465 76.353-102.611 95.042 40.399 133.112 -75.192 106.442-157.367 98.449 -86.137 99.338-162.179 147.143 -16.419 108.816 -87.224 151.485-103.675 104.529-106.065 109.864 -86.524 93.352 45.962 153.547 171.041 92.342 45.665 136.991 -86.094 90.648 51.102 149.699 -67.595 89.328 47.007 130.014 -52.902 91.027 42.442 108.058 -83.160 94.959 38.189 0.000 0.000 91.746 46.774 150.530-124.797 90.944 44.125 121.076-125.351 91.071 43.744 115.834-127.481 88.121 51.867 117.415 -78.523 90.069 50.896 135.655-114.721 90.231 46.245 125.214-158.931 94.354 -96.768 142.258-122.703 122.886 171.073 152.799 -15.395 129.585 -42.771 111.332-107.126 106.493 -31.684 112.164 -79.261 93.094 -45.639 111.780 -52.069 90.811 -48.246 112.137 -76.520 89.864 -48.237 127.644 -75.636 88.759 -43.864 99.397 -80.472 92.974 -34.808 138.433 -16.088 95.943 -46.801 145.864 -42.227 91.765 -46.008 131.235 -78.151 93.222-147.862 103.764 -44.328 93.270 46.644 130.603 -77.077 93.818 44.395 137.348 168.235 93.966 137.609 129.786 -21.287 126.913 94.808 168.931 -6.030 94.692 59.404 110.783 -85.808 98.105 78.033 99.772 -77.930 92.398 0.000 129.306 -76.026 # 947 total E -1.50147E+02 rmsd from N 0.000 %NC 0.00 92.793 135.445 134.419 -98.397 131.036 54.399 129.012 85.850 97.289 36.282 103.452 -79.448 92.120 50.705 130.388 -77.066 91.692 49.076 154.898-177.916 93.323 35.957 61.643 -72.504 95.826 37.908 127.283 -37.820 97.931 32.557 132.542-101.226 94.995 56.260 144.446 144.839 88.630 77.962 99.289-142.539 91.879 -71.343 115.433-121.659 101.653 -58.041 90.692 -97.029 90.698 -67.693 107.831 -76.675 116.755-145.287 163.557 -11.280 108.912-105.055 145.620-143.470 92.899 46.458 146.328 159.714 92.145 45.616 135.737 -86.657 91.040 47.287 135.928 -90.264 92.366 43.060 118.419 -38.763 95.692 36.407 107.869 -82.477 100.732 29.443 0.000 0.000 96.272 48.636 116.749 -79.531 88.279 44.808 147.317 -89.441 89.947 44.920 113.895-127.140 89.911 47.376 107.801 -75.970 89.248 46.097 135.785 -80.144 93.795 42.389 133.831-136.164 94.462 40.878 143.589-131.424 96.406 39.446 114.696 -88.011 136.677-176.830 105.399 -94.293 95.388 44.776 115.106 -77.141 92.508 48.492 105.128 -16.729 89.815 50.283 131.215 -16.235 90.267 49.500 129.031 -76.700 88.186 46.046 102.218 -83.968 91.467 43.848 131.035 -48.454 91.729 45.745 137.043 -80.881 91.713 41.850 128.541 -77.151 92.911 87.107 105.878 -91.370 90.776 -73.506 128.961 -77.197 95.658 -55.537 144.111-132.709 93.287 -26.292 123.715 -5.245 113.860 52.611 146.736 -23.502 137.082 126.480 122.869 -87.527 94.983 81.420 101.674 -82.838 92.598 0.000 128.926 -76.639 # 948 total E -1.50147E+02 rmsd from N 0.000 %NC 0.00 93.181 -70.308 128.151 -75.318 118.413-101.541 138.882 -19.599 95.142 40.858 109.327 -80.996 93.724 48.373 130.615 -76.814 94.458 41.697 138.456-115.454 90.429 44.942 63.753 -84.313 90.343 46.218 118.271 -46.190 91.791 39.029 129.749 -95.646 92.462 48.611 134.513-113.694 92.227 88.182 88.233-101.166 92.566-121.228 131.347-100.584 111.354 27.906 121.686-135.148 103.985-179.607 145.612 -36.714 103.339 -64.159 147.900 -47.861 93.023-121.807 138.443-130.378 91.620 44.960 140.667 117.384 91.045 49.679 135.040 -94.990 90.366 49.284 153.946 141.442 89.866 45.634 142.163 -31.689 90.241 44.417 142.836-134.347 91.667 46.060 0.000 0.000 89.325 48.055 142.068-124.619 91.502 42.157 116.357-111.624 90.390 45.158 119.744-120.394 89.035 54.429 113.964 -77.667 89.251 47.620 133.165-104.672 91.551 44.827 133.034-145.941 95.847 -85.835 106.600 -85.359 120.172-107.635 163.356-153.503 121.753 106.140 129.999-139.927 92.968 45.602 114.938 -77.398 91.864 48.631 107.192 -22.336 90.728 47.373 112.022 -72.576 89.813 45.550 130.129 -77.338 88.860 46.007 102.300 -84.411 89.096 48.834 114.127 -41.791 91.716 41.501 137.336 -50.318 92.357 43.729 128.485 -76.457 92.914 64.399 107.917 -83.770 91.410-106.438 128.804 -77.028 95.745 -31.473 142.202-119.099 90.903 -57.682 121.756 -1.783 91.060 -52.500 155.642 -27.673 91.255 -39.430 140.560-147.467 97.370 115.873 103.650 -78.119 92.462 0.000 128.978 -75.941 # 949 total E -1.48960E+02 rmsd from N 0.000 %NC 0.00 116.225 130.380 152.075 -81.314 93.543 53.006 129.645 -16.357 93.806 43.972 106.194 -84.092 93.831 44.968 128.022 -75.629 91.870 50.388 114.466 -70.136 93.572 39.734 70.537 -74.034 91.089 41.927 162.781 147.442 96.245 38.908 100.038 -88.684 90.634 46.491 136.032 -62.854 90.918 47.487 95.640-103.126 90.973 78.058 135.572-113.283 122.542 -68.087 112.427-115.237 100.941 143.384 101.669 -82.701 101.094 -57.464 148.354-108.112 94.727-124.228 135.704-146.409 91.800 48.011 135.832 126.443 92.003 46.938 134.980 -85.076 90.565 46.219 125.179 -44.645 91.288 50.425 139.331 -23.500 89.152 47.131 144.302-162.413 90.793 44.013 0.000 0.000 90.805 49.004 118.169 -80.389 89.602 47.297 144.671 -83.362 89.341 44.561 119.994-129.680 89.774 48.852 111.680 -78.519 90.567 47.510 138.630-101.234 92.523 48.277 134.702-146.033 94.427 -95.329 149.194 -27.721 114.746 174.513 151.058 -15.652 134.841-170.051 107.499 -99.150 95.879 48.309 128.223 45.230 93.810 43.220 111.190 -37.922 91.804 46.432 131.733 -26.681 91.545 45.798 130.070 -77.580 90.990 46.070 103.123 -81.159 90.133 46.201 122.635 -70.657 90.069 57.994 129.147 -65.982 89.437 54.057 128.841 -76.965 91.757-177.782 84.824 -81.696 90.459 68.843 132.216 -77.723 91.345 46.772 141.098-108.991 93.841 79.320 124.807 -21.441 91.641 -69.891 151.182 -91.890 100.367 -53.802 100.978 -88.984 95.168 132.244 104.707 -78.086 92.621 0.000 128.372 -76.571 # 950 total E -1.46399E+02 rmsd from N 0.000 %NC 0.00 120.389 168.826 151.514 -94.592 93.679 59.803 141.939 32.577 94.288 42.130 105.512 -78.897 92.075 48.077 133.017 -78.220 93.620 46.605 143.373-126.213 93.473 36.391 56.798 -75.685 93.311 45.218 159.537 140.338 95.594 37.055 134.306 -90.396 92.894 44.041 148.421-136.141 91.039 45.777 80.889-106.845 93.547 160.813 128.570 -85.791 91.322 89.378 130.605-157.914 92.898 110.492 100.505 -84.213 90.920 -67.197 134.762 -96.192 96.988-123.867 138.491-151.944 91.609 47.189 139.180 133.775 91.249 48.332 135.100 -85.664 90.378 48.145 127.354 -53.214 90.603 47.500 126.561 -28.520 90.279 45.261 146.406-156.507 90.327 45.127 0.000 0.000 89.906 53.657 115.979 -78.135 87.528 47.566 145.303 -84.263 89.175 44.651 119.726-131.864 88.423 51.862 112.087 -78.751 89.578 48.222 141.937-109.533 91.181 50.533 131.787-142.396 93.768 -90.712 103.253 -82.798 119.872 116.135 150.244 -15.992 104.512-178.365 91.959 -92.636 94.894 68.808 124.249 43.286 91.924 71.411 87.952 41.595 94.287 93.564 110.204 -71.419 94.704-151.316 129.811 -75.617 90.102 53.606 97.060 -88.566 90.699 55.711 104.880 -64.702 88.974 59.551 149.113 -28.500 88.632 47.934 127.760 -75.972 91.256 176.702 100.997-102.976 91.801 69.133 133.165 -78.229 89.530 52.470 141.589-104.352 90.461 51.116 121.503 -31.138 93.212-134.834 137.550 -53.783 97.318 28.218 107.734 -85.816 123.993 100.648 106.095 -76.885 92.607 0.000 129.618 -76.647 # 951 total E -1.48252E+02 rmsd from N 0.000 %NC 0.00 93.131 -63.156 129.003 -84.375 94.758 -46.742 116.575 -80.308 90.915 -47.434 103.072 -77.498 90.321 -46.537 129.398 -76.193 92.226 -41.908 142.157-130.460 93.108 -40.489 61.976 -70.611 93.611 -46.447 129.615 41.271 100.791 -41.246 171.654 167.972 93.692 -51.840 120.282-117.674 96.373-108.843 84.318 -86.636 116.768 71.931 137.165-166.343 93.501 59.164 93.980-124.101 93.129 55.290 102.179 -80.504 98.388-110.934 128.807 -72.690 104.037-108.205 151.852 -33.025 93.515 48.826 141.062 141.746 92.171 45.261 136.986 -84.496 89.972 51.313 135.324 -60.968 90.646 51.166 100.763 -24.984 88.820 45.051 149.639 -13.774 88.854 52.052 0.000 0.000 89.593 50.745 148.520-138.712 90.574 42.248 139.746 -73.508 89.999 42.628 121.699-120.219 91.417 48.844 109.503 -80.043 90.409 50.224 137.156 -97.809 92.258 39.694 135.937-139.238 96.398-126.965 107.871 -84.235 99.634-178.532 149.197 -9.641 127.485-112.860 108.519-106.313 95.170 46.120 129.426 30.600 93.746 41.002 100.634 -24.593 91.817 47.778 140.358 -23.709 90.121 47.311 128.569 -76.684 88.409 47.060 101.260 -80.551 90.217 45.480 135.279 -55.101 89.924 48.163 142.320 -96.706 91.156 47.558 128.383 -77.035 92.883-177.433 113.122 -97.809 93.802 62.654 131.433 -77.251 94.659 79.757 140.464-108.548 95.698 8.885 122.671 -6.237 98.817 -96.420 144.392 -40.087 89.115 -26.686 114.890 -84.261 108.775 -64.548 149.790 1.572 92.717 0.000 129.429 -76.451