jlee = 1 nbank = 200 nstep = 40400 34698396 0 887.36100 nglob_csa = 66 eglob_csa = -1.56369E+02 # 1 total E -1.49867E+02 rmsd from N 0.000 %NC 0.00 1 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 # 2 total E -1.53646E+02 rmsd from N 0.000 %NC 0.00 0 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 # 3 total E -1.48966E+02 rmsd from N 0.000 %NC 0.00 1 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 # 4 total E -1.54088E+02 rmsd from N 0.000 %NC 0.00 1 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 # 5 total E -1.52407E+02 rmsd from N 0.000 %NC 0.00 1 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 # 6 total E -1.52741E+02 rmsd from N 0.000 %NC 0.00 1 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 # 7 total E -1.50591E+02 rmsd from N 0.000 %NC 0.00 1 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 # 8 total E -1.51598E+02 rmsd from N 0.000 %NC 0.00 0 123.682-104.040 148.359 -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 # 9 total E -1.50739E+02 rmsd from N 0.000 %NC 0.00 0 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 # 10 total E -1.54338E+02 rmsd from N 0.000 %NC 0.00 1 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 # 11 total E -1.50432E+02 rmsd from N 0.000 %NC 0.00 1 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 # 12 total E -1.49542E+02 rmsd from N 0.000 %NC 0.00 1 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 # 13 total E -1.51992E+02 rmsd from N 0.000 %NC 0.00 1 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 # 14 total E -1.48879E+02 rmsd from N 0.000 %NC 0.00 1 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 # 15 total E -1.48831E+02 rmsd from N 0.000 %NC 0.00 1 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 # 16 total E -1.51835E+02 rmsd from N 0.000 %NC 0.00 1 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 # 17 total E -1.50962E+02 rmsd from N 0.000 %NC 0.00 1 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 # 18 total E -1.51258E+02 rmsd from N 0.000 %NC 0.00 1 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 # 19 total E -1.54005E+02 rmsd from N 0.000 %NC 0.00 1 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 # 20 total E -1.50828E+02 rmsd from N 0.000 %NC 0.00 1 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 # 21 total E -1.54341E+02 rmsd from N 0.000 %NC 0.00 1 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 # 22 total E -1.49154E+02 rmsd from N 0.000 %NC 0.00 1 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 # 23 total E -1.51669E+02 rmsd from N 0.000 %NC 0.00 1 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 # 24 total E -1.49146E+02 rmsd from N 0.000 %NC 0.00 1 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 # 25 total E -1.50598E+02 rmsd from N 0.000 %NC 0.00 1 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 # 26 total E -1.55749E+02 rmsd from N 0.000 %NC 0.00 0 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 # 27 total E -1.49356E+02 rmsd from N 0.000 %NC 0.00 1 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 # 28 total E -1.51103E+02 rmsd from N 0.000 %NC 0.00 1 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 # 29 total E -1.53397E+02 rmsd from N 0.000 %NC 0.00 1 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 # 30 total E -1.52741E+02 rmsd from N 0.000 %NC 0.00 0 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 # 31 total E -1.49689E+02 rmsd from N 0.000 %NC 0.00 1 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 # 32 total E -1.52603E+02 rmsd from N 0.000 %NC 0.00 1 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 # 33 total E -1.52579E+02 rmsd from N 0.000 %NC 0.00 1 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 # 34 total E -1.52082E+02 rmsd from N 0.000 %NC 0.00 1 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 # 35 total E -1.51728E+02 rmsd from N 0.000 %NC 0.00 1 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 # 36 total E -1.53433E+02 rmsd from N 0.000 %NC 0.00 0 119.088 157.652 153.127-112.484 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 # 37 total E -1.52042E+02 rmsd from N 0.000 %NC 0.00 1 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 # 38 total E -1.56279E+02 rmsd from N 0.000 %NC 0.00 0 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 # 39 total E -1.53735E+02 rmsd from N 0.000 %NC 0.00 1 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 # 40 total E -1.51000E+02 rmsd from N 0.000 %NC 0.00 1 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 # 41 total E -1.50973E+02 rmsd from N 0.000 %NC 0.00 1 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 # 42 total E -1.49018E+02 rmsd from N 0.000 %NC 0.00 1 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 # 43 total E -1.49755E+02 rmsd from N 0.000 %NC 0.00 1 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 # 44 total E -1.52113E+02 rmsd from N 0.000 %NC 0.00 1 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 # 45 total E -1.49301E+02 rmsd from N 0.000 %NC 0.00 1 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 # 46 total E -1.51400E+02 rmsd from N 0.000 %NC 0.00 1 122.440 -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 # 47 total E -1.50014E+02 rmsd from N 0.000 %NC 0.00 1 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 # 48 total E -1.49027E+02 rmsd from N 0.000 %NC 0.00 1 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 # 49 total E -1.51184E+02 rmsd from N 0.000 %NC 0.00 0 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 # 50 total E -1.54351E+02 rmsd from N 0.000 %NC 0.00 1 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 # 51 total E -1.50189E+02 rmsd from N 0.000 %NC 0.00 1 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 # 52 total E -1.50811E+02 rmsd from N 0.000 %NC 0.00 1 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 # 53 total E -1.49038E+02 rmsd from N 0.000 %NC 0.00 1 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 # 54 total E -1.56007E+02 rmsd from N 0.000 %NC 0.00 1 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 # 55 total E -1.50095E+02 rmsd from N 0.000 %NC 0.00 1 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 # 56 total E -1.49682E+02 rmsd from N 0.000 %NC 0.00 0 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 # 57 total E -1.53228E+02 rmsd from N 0.000 %NC 0.00 1 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 # 58 total E -1.50099E+02 rmsd from N 0.000 %NC 0.00 1 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 # 59 total E -1.49194E+02 rmsd from N 0.000 %NC 0.00 1 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 # 60 total E -1.52101E+02 rmsd from N 0.000 %NC 0.00 1 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 # 61 total E -1.53424E+02 rmsd from N 0.000 %NC 0.00 1 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 # 62 total E -1.52494E+02 rmsd from N 0.000 %NC 0.00 1 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 # 63 total E -1.51155E+02 rmsd from N 0.000 %NC 0.00 1 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 # 64 total E -1.51355E+02 rmsd from N 0.000 %NC 0.00 1 119.287 120.549 145.224 -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 # 65 total E -1.53045E+02 rmsd from N 0.000 %NC 0.00 1 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 # 66 total E -1.51149E+02 rmsd from N 0.000 %NC 0.00 1 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 # 67 total E -1.52412E+02 rmsd from N 0.000 %NC 0.00 1 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 # 68 total E -1.50406E+02 rmsd from N 0.000 %NC 0.00 1 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 # 69 total E -1.52498E+02 rmsd from N 0.000 %NC 0.00 1 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 # 70 total E -1.50388E+02 rmsd from N 0.000 %NC 0.00 1 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 # 71 total E -1.50783E+02 rmsd from N 0.000 %NC 0.00 1 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 # 72 total E -1.50332E+02 rmsd from N 0.000 %NC 0.00 1 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 # 73 total E -1.53454E+02 rmsd from N 0.000 %NC 0.00 1 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 # 74 total E -1.51911E+02 rmsd from N 0.000 %NC 0.00 1 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 # 75 total E -1.51636E+02 rmsd from N 0.000 %NC 0.00 0 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 # 76 total E -1.49941E+02 rmsd from N 0.000 %NC 0.00 0 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 # 77 total E -1.52087E+02 rmsd from N 0.000 %NC 0.00 1 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 # 78 total E -1.51495E+02 rmsd from N 0.000 %NC 0.00 1 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 # 79 total E -1.49668E+02 rmsd from N 0.000 %NC 0.00 1 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 # 80 total E -1.51276E+02 rmsd from N 0.000 %NC 0.00 1 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 # 81 total E -1.53390E+02 rmsd from N 0.000 %NC 0.00 0 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 # 82 total E -1.55626E+02 rmsd from N 0.000 %NC 0.00 1 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 # 83 total E -1.50481E+02 rmsd from N 0.000 %NC 0.00 1 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 # 84 total E -1.53476E+02 rmsd from N 0.000 %NC 0.00 1 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 # 85 total E -1.48860E+02 rmsd from N 0.000 %NC 0.00 1 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 # 86 total E -1.49717E+02 rmsd from N 0.000 %NC 0.00 0 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 # 87 total E -1.51191E+02 rmsd from N 0.000 %NC 0.00 1 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 # 88 total E -1.49213E+02 rmsd from N 0.000 %NC 0.00 1 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 # 89 total E -1.56369E+02 rmsd from N 0.000 %NC 0.00 1 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 # 90 total E -1.50183E+02 rmsd from N 0.000 %NC 0.00 0 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 # 91 total E -1.55471E+02 rmsd from N 0.000 %NC 0.00 1 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 # 92 total E -1.49971E+02 rmsd from N 0.000 %NC 0.00 1 93.044 149.829 141.563 -98.880 93.257 51.052 107.856 8.193 90.897 48.152 106.295 -80.070 92.097 46.577 128.272 -75.541 96.456 31.274 135.257-101.838 100.057 39.556 137.883 159.945 96.144 36.954 112.362 -59.779 92.984 52.678 144.150 -84.570 90.681 65.782 147.149-146.002 87.990 124.728 118.681-170.801 94.477-117.196 125.109-124.753 93.834 52.564 95.196-118.675 95.285 40.861 103.038 -84.029 92.389 52.281 167.251-152.787 91.888 42.427 120.889-159.751 92.614 42.870 122.274-120.202 94.059 43.069 138.084 -78.294 96.401-122.944 145.153-109.729 113.654-105.086 118.303 -67.090 92.841 47.320 147.908-154.806 90.135 51.340 0.000 0.000 87.744 56.118 135.983 -25.977 88.443 48.877 139.456 -84.820 90.053 45.536 132.504-154.779 87.160 62.147 111.390 -74.339 87.516 59.514 132.040 -51.687 89.160 51.835 131.951 -52.376 91.053 43.345 141.845-125.308 95.766-110.574 106.826 -81.455 95.699 -49.629 96.136 -87.350 93.021 -53.894 109.789 -73.669 89.861 -43.379 128.967-152.416 91.541 -59.690 112.673 -73.696 91.694 112.543 130.139 -75.811 95.410 37.150 102.344 -82.469 90.637 54.438 138.804 -34.038 89.368 53.002 147.111 -29.989 88.677 44.038 128.612 -77.151 88.852 51.271 112.765 -36.832 90.048 48.126 129.294 -76.401 89.621 47.060 152.105-120.347 89.114 48.281 130.493 -44.730 89.980 54.315 134.421 -57.036 89.648 44.175 138.189-122.158 94.823 79.757 103.865 -80.644 92.538 0.000 128.889 -76.711 # 93 total E -1.53371E+02 rmsd from N 0.000 %NC 0.00 1 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 # 94 total E -1.53127E+02 rmsd from N 0.000 %NC 0.00 1 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 # 95 total E -1.53432E+02 rmsd from N 0.000 %NC 0.00 1 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 # 96 total E -1.51941E+02 rmsd from N 0.000 %NC 0.00 1 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 # 97 total E -1.54107E+02 rmsd from N 0.000 %NC 0.00 1 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 # 98 total E -1.50270E+02 rmsd from N 0.000 %NC 0.00 1 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 # 99 total E -1.49521E+02 rmsd from N 0.000 %NC 0.00 1 123.836-101.285 147.717 -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 # 100 total E -1.55414E+02 rmsd from N 0.000 %NC 0.00 1 118.442 151.961 153.292-107.435 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 # 101 total E -1.55040E+02 rmsd from N 0.000 %NC 0.00 1 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 # 102 total E -1.49172E+02 rmsd from N 0.000 %NC 0.00 1 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 # 103 total E -1.51861E+02 rmsd from N 0.000 %NC 0.00 1 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 # 104 total E -1.49978E+02 rmsd from N 0.000 %NC 0.00 1 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 # 105 total E -1.53303E+02 rmsd from N 0.000 %NC 0.00 1 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 # 106 total E -1.50697E+02 rmsd from N 0.000 %NC 0.00 1 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 # 107 total E -1.50353E+02 rmsd from N 0.000 %NC 0.00 1 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 # 108 total E -1.49819E+02 rmsd from N 0.000 %NC 0.00 1 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 # 109 total E -1.50626E+02 rmsd from N 0.000 %NC 0.00 1 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 # 110 total E -1.52317E+02 rmsd from N 0.000 %NC 0.00 1 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 # 111 total E -1.51752E+02 rmsd from N 0.000 %NC 0.00 1 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 # 112 total E -1.52372E+02 rmsd from N 0.000 %NC 0.00 1 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 # 113 total E -1.48857E+02 rmsd from N 0.000 %NC 0.00 1 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 # 114 total E -1.52678E+02 rmsd from N 0.000 %NC 0.00 1 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 # 115 total E -1.49540E+02 rmsd from N 0.000 %NC 0.00 1 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 # 116 total E -1.51626E+02 rmsd from N 0.000 %NC 0.00 1 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 # 117 total E -1.51992E+02 rmsd from N 0.000 %NC 0.00 1 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 # 118 total E -1.52205E+02 rmsd from N 0.000 %NC 0.00 1 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 # 119 total E -1.52816E+02 rmsd from N 0.000 %NC 0.00 0 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 # 120 total E -1.50255E+02 rmsd from N 0.000 %NC 0.00 1 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 # 121 total E -1.48833E+02 rmsd from N 0.000 %NC 0.00 1 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 # 122 total E -1.49908E+02 rmsd from N 0.000 %NC 0.00 1 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 # 123 total E -1.49039E+02 rmsd from N 0.000 %NC 0.00 1 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 # 124 total E -1.49902E+02 rmsd from N 0.000 %NC 0.00 1 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 # 125 total E -1.52080E+02 rmsd from N 0.000 %NC 0.00 1 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 # 126 total E -1.54450E+02 rmsd from N 0.000 %NC 0.00 1 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 # 127 total E -1.55597E+02 rmsd from N 0.000 %NC 0.00 0 117.842 147.710 153.492-111.442 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 # 128 total E -1.50305E+02 rmsd from N 0.000 %NC 0.00 0 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 # 129 total E -1.51788E+02 rmsd from N 0.000 %NC 0.00 0 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 # 130 total E -1.52482E+02 rmsd from N 0.000 %NC 0.00 1 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 # 131 total E -1.53552E+02 rmsd from N 0.000 %NC 0.00 1 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 # 132 total E -1.49414E+02 rmsd from N 0.000 %NC 0.00 1 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 # 133 total E -1.49060E+02 rmsd from N 0.000 %NC 0.00 1 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 # 134 total E -1.51058E+02 rmsd from N 0.000 %NC 0.00 1 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 # 135 total E -1.49268E+02 rmsd from N 0.000 %NC 0.00 1 125.840-108.047 143.374 -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 # 136 total E -1.53798E+02 rmsd from N 0.000 %NC 0.00 1 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 # 137 total E -1.51098E+02 rmsd from N 0.000 %NC 0.00 1 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 # 138 total E -1.51084E+02 rmsd from N 0.000 %NC 0.00 1 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 # 139 total E -1.50274E+02 rmsd from N 0.000 %NC 0.00 1 122.608 -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 # 140 total E -1.51569E+02 rmsd from N 0.000 %NC 0.00 1 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 # 141 total E -1.49655E+02 rmsd from N 0.000 %NC 0.00 1 124.125-101.003 147.261 -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 # 142 total E -1.51466E+02 rmsd from N 0.000 %NC 0.00 1 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 # 143 total E -1.49629E+02 rmsd from N 0.000 %NC 0.00 1 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 # 144 total E -1.54342E+02 rmsd from N 0.000 %NC 0.00 0 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 # 145 total E -1.51301E+02 rmsd from N 0.000 %NC 0.00 1 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 # 146 total E -1.50634E+02 rmsd from N 0.000 %NC 0.00 1 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 # 147 total E -1.55901E+02 rmsd from N 0.000 %NC 0.00 1 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 # 148 total E -1.54649E+02 rmsd from N 0.000 %NC 0.00 0 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 # 149 total E -1.50345E+02 rmsd from N 0.000 %NC 0.00 1 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 # 150 total E -1.49929E+02 rmsd from N 0.000 %NC 0.00 1 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 # 151 total E -1.51014E+02 rmsd from N 0.000 %NC 0.00 1 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 # 152 total E -1.51727E+02 rmsd from N 0.000 %NC 0.00 1 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 # 153 total E -1.50478E+02 rmsd from N 0.000 %NC 0.00 1 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 # 154 total E -1.49409E+02 rmsd from N 0.000 %NC 0.00 1 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 # 155 total E -1.52821E+02 rmsd from N 0.000 %NC 0.00 1 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 # 156 total E -1.51076E+02 rmsd from N 0.000 %NC 0.00 1 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 # 157 total E -1.50976E+02 rmsd from N 0.000 %NC 0.00 1 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 # 158 total E -1.54612E+02 rmsd from N 0.000 %NC 0.00 1 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 # 159 total E -1.49605E+02 rmsd from N 0.000 %NC 0.00 1 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 # 160 total E -1.51242E+02 rmsd from N 0.000 %NC 0.00 0 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 # 161 total E -1.53029E+02 rmsd from N 0.000 %NC 0.00 0 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 # 162 total E -1.51096E+02 rmsd from N 0.000 %NC 0.00 1 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 # 163 total E -1.50242E+02 rmsd from N 0.000 %NC 0.00 1 125.452-111.705 144.347 -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 # 164 total E -1.51543E+02 rmsd from N 0.000 %NC 0.00 1 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 # 165 total E -1.52343E+02 rmsd from N 0.000 %NC 0.00 1 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 # 166 total E -1.50015E+02 rmsd from N 0.000 %NC 0.00 1 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 # 167 total E -1.49354E+02 rmsd from N 0.000 %NC 0.00 1 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 # 168 total E -1.49381E+02 rmsd from N 0.000 %NC 0.00 1 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 # 169 total E -1.56188E+02 rmsd from N 0.000 %NC 0.00 1 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 # 170 total E -1.49628E+02 rmsd from N 0.000 %NC 0.00 1 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 # 171 total E -1.49798E+02 rmsd from N 0.000 %NC 0.00 1 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 # 172 total E -1.53279E+02 rmsd from N 0.000 %NC 0.00 1 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 # 173 total E -1.54050E+02 rmsd from N 0.000 %NC 0.00 1 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 # 174 total E -1.51475E+02 rmsd from N 0.000 %NC 0.00 1 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 # 175 total E -1.50650E+02 rmsd from N 0.000 %NC 0.00 1 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 # 176 total E -1.51586E+02 rmsd from N 0.000 %NC 0.00 1 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 # 177 total E -1.52547E+02 rmsd from N 0.000 %NC 0.00 1 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 # 178 total E -1.50430E+02 rmsd from N 0.000 %NC 0.00 0 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 # 179 total E -1.50913E+02 rmsd from N 0.000 %NC 0.00 1 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 # 180 total E -1.49166E+02 rmsd from N 0.000 %NC 0.00 1 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 # 181 total E -1.51727E+02 rmsd from N 0.000 %NC 0.00 1 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 # 182 total E -1.51908E+02 rmsd from N 0.000 %NC 0.00 1 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 # 183 total E -1.54323E+02 rmsd from N 0.000 %NC 0.00 1 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 # 184 total E -1.52501E+02 rmsd from N 0.000 %NC 0.00 1 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 # 185 total E -1.49869E+02 rmsd from N 0.000 %NC 0.00 1 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 # 186 total E -1.51458E+02 rmsd from N 0.000 %NC 0.00 1 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 # 187 total E -1.52357E+02 rmsd from N 0.000 %NC 0.00 1 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 # 188 total E -1.51445E+02 rmsd from N 0.000 %NC 0.00 0 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 # 189 total E -1.50852E+02 rmsd from N 0.000 %NC 0.00 1 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 # 190 total E -1.49406E+02 rmsd from N 0.000 %NC 0.00 1 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 # 191 total E -1.53765E+02 rmsd from N 0.000 %NC 0.00 1 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 # 192 total E -1.54685E+02 rmsd from N 0.000 %NC 0.00 0 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 # 193 total E -1.50105E+02 rmsd from N 0.000 %NC 0.00 1 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 # 194 total E -1.55877E+02 rmsd from N 0.000 %NC 0.00 1 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 # 195 total E -1.49349E+02 rmsd from N 0.000 %NC 0.00 1 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 # 196 total E -1.51092E+02 rmsd from N 0.000 %NC 0.00 1 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 # 197 total E -1.52662E+02 rmsd from N 0.000 %NC 0.00 1 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 # 198 total E -1.50274E+02 rmsd from N 0.000 %NC 0.00 1 123.428 -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 # 199 total E -1.51087E+02 rmsd from N 0.000 %NC 0.00 0 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 # 200 total E -1.51691E+02 rmsd from N 0.000 %NC 0.00 1 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