jlee = 1 nbank = 283 nstep = 40300 25488668 0 1512.21957 # 1 total E -2.40519E+02 rmsd from N 0.000 %NC 0.00 93.613 77.496 137.783-100.217 93.690 48.763 139.522-103.914 93.178 37.448 143.769-134.348 92.526 40.606 129.457 -76.194 93.044 43.121 142.849-146.878 92.924 34.439 139.254-150.382 93.114 40.497 129.828 -87.399 91.511 38.013 138.574 -86.501 91.344 47.590 149.299-122.085 92.688 53.521 138.311-142.079 93.884 67.478 146.359 -38.596 121.573-138.728 121.679-128.520 92.742 73.529 143.299-134.588 91.874 130.594 145.096 -41.446 95.645 65.084 142.163-138.740 93.981 31.842 133.334 -91.556 93.445 49.887 136.916 -90.708 92.729 55.535 135.700 -91.494 92.584 58.204 141.477-131.978 91.974 16.642 143.440-133.191 109.743-117.401 0.000 0.000 125.353-121.950 156.856 174.068 96.330 35.525 143.521 -89.979 93.046 51.434 143.065-122.088 90.309 58.440 115.679 -76.107 91.519 122.401 148.070-114.954 93.933 75.656 141.576-121.156 93.584 -10.595 109.523 -83.539 120.227 141.687 152.252 -18.933 122.507 170.317 120.476-126.221 95.320 34.640 116.663 -76.592 94.093 40.934 137.982-104.258 90.929 49.706 117.117 -76.237 91.833 42.519 129.311 -76.168 87.942 41.133 141.726-130.483 89.966 47.887 148.442-116.367 91.195 36.791 143.380 -44.175 92.680 36.063 129.388 -76.159 93.351 41.595 130.397 -86.705 92.663 37.356 129.565 -76.550 92.557 41.110 139.465 -76.338 92.232 40.916 137.306 -89.950 90.891 51.888 144.532 -42.157 90.401 41.529 141.330-125.135 92.540 66.164 143.058-124.315 93.024 0.000 129.415 -76.270 # 2 total E -2.33027E+02 rmsd from N 0.000 %NC 0.00 93.742 94.151 139.527-106.957 93.263 52.881 139.366-100.510 91.731 39.374 143.308-133.321 92.285 42.534 129.581 -76.246 91.802 40.046 140.453-150.902 90.835 37.069 137.974-146.993 92.150 45.194 128.580 -97.564 89.020 39.458 136.891 -83.873 90.232 49.363 145.627-115.639 91.720 72.467 135.946-139.685 94.773-158.146 145.870 -37.653 92.061 75.418 100.662-113.595 90.888 44.991 141.897-130.476 90.905 67.322 149.335-122.088 92.276 119.803 141.240-127.134 122.292-137.972 152.919-112.883 94.178 60.909 133.934 -89.475 93.566 48.551 137.630-102.674 93.429 137.720 135.364 -37.553 96.493 61.261 111.458 -83.026 94.441 35.272 0.000 0.000 92.493 54.830 139.631-126.199 90.860 39.070 138.860 -91.531 92.502 40.324 136.071-104.535 91.412 43.568 115.298 -76.128 92.105 40.941 148.743-114.668 94.034 52.265 141.816-118.353 93.057 -9.089 143.328-125.483 118.121-146.781 152.036 -19.435 118.964 120.946 122.660-131.763 92.114 45.447 116.116 -76.268 92.713 77.066 136.145 -97.143 91.135 51.125 115.265 -75.673 92.731 37.713 129.395 -76.171 94.443 31.201 143.961-135.345 92.889 45.365 146.870 -37.725 91.089 38.896 143.828 -44.490 91.966 38.327 129.310 -76.132 92.408 42.317 129.780 -87.759 92.511 38.121 129.243 -76.140 92.894 38.755 138.133 -74.815 93.019 39.353 137.297 -90.877 91.936 46.476 144.867 -41.313 91.505 42.073 142.234-132.746 92.462 63.461 143.014-124.289 93.021 0.000 129.414 -76.268 # 3 total E -2.30187E+02 rmsd from N 0.000 %NC 0.00 93.634 78.135 138.192-101.818 93.603 49.416 139.320-102.338 92.966 37.191 143.715-134.081 92.477 42.010 129.531 -76.245 91.604 41.853 141.726-151.670 91.312 37.100 138.502-148.293 92.302 40.559 128.126 -80.737 89.168 45.313 141.044 -87.652 89.302 51.598 147.131-110.327 91.205 75.208 136.244-140.047 105.099-163.803 151.416 -30.994 93.925 55.677 100.656-112.944 96.354 30.774 144.124-135.686 94.082 47.264 146.170 -39.580 92.547 45.715 111.679 -84.455 92.289 41.957 131.994 -93.951 93.067 37.438 130.727 -87.716 93.193 62.762 140.477 -95.110 91.952 62.830 141.574-125.683 91.141 20.965 143.124-132.471 107.464 -82.406 0.000 0.000 123.969-127.975 158.223 177.556 94.172 39.184 142.027 -90.798 93.747 34.975 137.897-111.101 92.492 44.698 115.716 -76.216 91.910 63.375 146.039 -41.637 92.776 36.108 139.099 -96.228 91.781 70.157 109.643 -83.804 94.044 57.346 143.708-123.478 121.514 147.051 121.404-127.998 92.549 42.168 116.207 -76.321 93.862 98.579 137.442-103.976 94.272-175.713 116.011 -76.077 92.981 50.677 129.434 -76.192 94.698 30.814 144.100-135.325 92.511 42.112 149.757-116.692 92.654 37.150 145.160 -41.676 92.478 38.319 129.350 -76.178 92.542 41.137 132.940-102.618 92.140 38.212 129.373 -76.209 92.363 40.143 137.767 -73.120 92.399 41.534 137.307 -90.004 90.041 48.643 146.634-110.796 91.171 42.594 141.495-133.152 92.270 69.870 142.922-124.060 93.020 0.000 129.381 -76.245 # 4 total E -2.41640E+02 rmsd from N 0.000 %NC 0.00 93.621 120.739 134.961 -87.873 94.030 42.147 141.161-108.765 94.652 33.829 144.240-135.594 92.713 41.123 129.780 -76.607 92.884 41.009 135.537 -28.124 93.300 34.892 139.845-149.169 94.258 38.777 130.657 -86.356 94.966 31.409 139.346 -85.975 93.794 41.216 146.087 -39.929 93.917 57.455 139.380-145.624 92.728 68.630 146.531 -39.549 118.268-119.705 121.332-129.659 121.633 -94.704 113.002 -83.786 92.944 49.563 145.767 -39.940 92.214 40.925 143.358-134.450 92.749 48.791 133.228 -82.317 93.187 34.918 133.029 -87.095 92.955 51.980 139.587-103.256 91.884 38.569 138.898-111.783 96.875-114.275 144.586-132.621 93.629 133.475 0.000 0.000 93.480 44.626 135.053-119.854 94.627 34.283 138.097 -90.852 93.853 38.558 136.726-105.800 94.536 38.159 115.562 -76.580 93.080 38.230 149.530-127.599 93.600 46.092 143.268-119.662 91.304 48.349 142.572-123.813 92.618 46.837 142.804-122.750 120.495 167.473 121.723-129.477 93.684 44.304 116.417 -76.420 93.528 40.043 137.399-103.084 90.353 47.391 116.605 -76.180 91.919 41.777 129.272 -76.146 88.100 42.416 141.738-130.860 91.099 43.194 144.963 -40.912 91.169 40.074 144.830 -40.676 92.001 37.537 129.308 -76.120 92.385 43.011 129.796 -87.912 92.478 37.909 129.251 -76.210 92.930 38.823 137.802 -74.530 93.065 39.627 137.301 -90.771 91.989 46.054 144.915 -41.249 91.585 42.225 142.453-133.484 92.445 63.323 143.015-124.162 93.022 0.000 129.413 -76.268 # 5 total E -2.29476E+02 rmsd from N 0.000 %NC 0.00 93.627 79.969 137.993-100.811 93.621 47.849 139.264-102.843 92.923 38.471 143.692-134.175 92.518 40.170 129.467 -76.214 92.561 43.794 142.199-151.717 92.022 34.479 138.848-149.926 92.030 43.844 130.679 -85.263 88.501 46.347 138.129 -86.944 89.371 41.187 146.193-110.018 92.527 56.070 137.072 -22.566 93.172 47.681 145.977 -40.140 92.976 38.390 101.938-115.541 108.860-125.895 151.655 -25.827 122.967 176.102 159.068-136.807 95.086-161.660 144.079-138.272 95.057 46.690 135.733 -94.116 94.569 57.625 133.836 -88.102 94.354 8.639 140.281-116.751 112.330-152.860 147.836-123.531 96.139 56.988 111.475 -82.977 93.655 130.021 0.000 0.000 93.964 40.983 131.445-123.155 92.303 40.021 139.198 -91.148 92.411 40.488 136.153-103.588 90.593 43.033 115.007 -76.348 92.172 41.505 146.356 -38.608 93.192 41.297 141.649-118.335 92.783 24.463 109.146 -83.405 117.034 112.435 151.288 -21.207 93.315 53.237 99.876-112.072 92.337 41.535 116.229 -76.283 93.239 43.183 139.564-104.561 91.508 39.896 116.262 -75.775 92.587 38.379 129.355 -76.197 89.995 41.002 142.261-131.694 90.038 46.522 147.309-119.325 91.058 37.663 143.367 -44.155 92.349 36.002 129.364 -76.145 92.820 43.456 130.416 -86.690 92.675 36.269 129.241 -76.269 93.167 38.911 138.835 -78.578 93.191 38.623 137.228 -91.627 92.195 45.417 144.924 -41.198 91.756 42.182 142.477-134.150 92.451 62.938 142.973-124.353 93.021 0.000 129.413 -76.268 # 6 total E -2.30617E+02 rmsd from N 0.000 %NC 0.00 93.591 82.300 137.192 -97.501 93.953 47.747 138.970-104.053 94.663 34.655 144.235-135.331 92.711 41.268 129.624 -76.282 92.809 44.174 144.252-160.143 91.723 33.764 140.269-152.038 92.304 40.231 129.100 -85.231 88.294 59.272 138.690 -86.563 90.301 47.453 143.192 -45.572 89.103 112.884 138.352-139.951 107.694-131.101 152.554 -30.868 93.474 47.276 100.486-110.397 92.954 46.223 111.622 -82.169 92.662 80.788 146.086 -36.183 91.643 36.816 141.543-139.555 92.935 45.097 133.143 -90.779 93.655 113.388 133.008 -91.973 93.455 73.548 136.405-107.420 91.542 37.762 140.085-110.856 101.662-139.448 146.570-140.043 134.137-121.952 0.000 0.000 125.374 78.625 159.095 171.529 92.295 49.280 141.357 -87.583 93.241 33.342 136.247-106.555 91.516 48.210 115.640 -75.898 93.108 35.570 145.501 -40.760 94.476 52.927 139.978-105.082 94.177 -26.917 143.879-126.379 124.781 -84.244 113.167 -82.190 117.982 177.757 121.493-130.506 129.088 -61.972 122.940 -81.322 93.052 57.487 134.157 -94.909 91.515 51.484 116.471 -75.960 92.767 41.661 129.215 -76.011 95.148 26.257 144.015-136.349 93.936 44.639 147.532 -36.800 91.595 37.915 144.125 -43.927 92.116 39.271 129.316 -76.164 92.400 41.578 129.840 -87.882 92.505 38.420 129.269 -76.184 92.960 38.441 137.854 -76.213 93.078 39.821 137.261 -91.076 91.982 46.023 144.902 -41.265 91.583 42.268 142.461-133.504 92.442 63.329 143.018-124.156 93.018 0.000 129.414 -76.268 # 7 total E -2.27653E+02 rmsd from N 0.000 %NC 0.00 93.582 68.792 137.272 -99.573 93.690 53.772 142.243-109.663 94.689 31.146 150.170 -32.013 92.505 43.479 129.475 -76.157 93.020 39.391 140.035-146.235 93.819 36.093 142.981-156.594 93.810 31.931 131.245 -83.869 92.216 43.356 140.660 -86.679 91.532 38.970 142.733 -46.459 95.114 44.389 138.731-142.411 93.930 145.508 147.355-112.151 120.079 149.315 121.426-128.622 110.248 -74.082 149.076-147.280 93.750 64.634 146.249 -37.797 92.692 34.839 143.478-134.878 93.091 57.785 133.840 -99.064 92.750 70.168 134.656 -86.234 92.841 140.257 137.410-104.570 106.313-153.287 133.013-118.667 96.830 35.203 111.484 -83.042 97.099 40.031 0.000 0.000 95.891 35.517 138.047-125.725 92.926 41.140 140.941 -93.525 92.443 39.702 136.001-103.506 91.286 41.889 114.990 -76.237 91.999 44.129 148.460-114.652 93.792 61.813 139.717-102.152 92.654 -10.843 143.086-124.763 119.112-139.031 152.221 -19.255 118.825 117.127 121.762-130.430 91.850 43.881 116.092 -76.187 93.072 43.574 135.372-100.460 92.339 37.247 115.663 -75.963 92.957 37.879 129.385 -76.204 93.371 34.665 143.313-133.870 91.856 42.975 150.962-133.405 91.316 37.089 144.706 -41.652 92.041 37.722 129.322 -76.137 92.127 44.021 130.721 -88.006 92.133 38.416 129.212 -76.191 92.240 39.126 137.678 -78.688 92.283 52.316 137.265 -91.408 90.243 45.021 144.097-108.101 91.561 45.119 143.644-132.081 92.303 65.471 142.966-124.037 93.024 0.000 129.411 -76.263 # 8 total E -2.37027E+02 rmsd from N 0.000 %NC 0.00 93.597 71.899 137.558-100.001 93.723 50.140 139.397-103.237 93.159 37.312 143.767-134.359 92.525 41.512 129.473 -76.224 92.233 42.199 139.268-143.199 92.746 35.171 138.415-149.643 92.799 42.358 130.093 -86.122 91.026 36.555 138.839 -84.995 92.025 51.474 148.567-112.892 91.238 47.691 137.496-147.410 91.686 54.170 148.261-115.776 120.278 -10.805 121.037-128.056 95.473-172.637 143.711-135.785 93.246 119.783 149.489-127.320 105.396-126.539 147.311-143.202 94.409 62.797 134.172 -90.553 93.833 40.649 133.637 -87.872 93.008 53.761 138.412-101.942 92.857 50.264 143.200-173.798 91.527 39.164 143.415-134.052 93.283 41.906 0.000 0.000 92.838 44.030 136.071-121.428 93.950 34.889 139.354 -92.310 93.633 35.343 136.550-105.501 93.434 41.100 115.302 -76.270 93.106 58.357 147.233 -38.622 92.478 39.382 139.494 -91.374 90.956 46.532 142.359-123.679 93.758 148.215 143.143-123.281 93.137 62.883 99.776-113.710 92.022 43.389 116.206 -76.292 93.268 128.374 135.736 -92.901 93.924 39.329 116.325 -76.554 92.856 42.757 129.416 -76.191 92.560 37.312 143.374-134.018 92.402 43.036 147.245 -37.752 91.175 40.544 145.643 -39.456 91.986 37.445 129.281 -76.114 92.020 41.711 129.506 -88.038 91.947 43.532 129.307 -76.294 92.420 37.899 135.559 -71.020 92.753 40.933 137.444 -89.798 91.824 45.840 144.802 -41.426 91.488 42.458 142.539-132.255 92.463 63.389 142.954-124.467 93.019 0.000 129.411 -76.262 # 9 total E -2.35504E+02 rmsd from N 0.000 %NC 0.00 93.642 81.554 138.252-101.911 93.600 49.011 139.021-101.494 93.944 36.775 143.981-134.834 92.878 39.164 129.504 -76.153 94.448 37.700 142.920-145.551 93.460 36.935 139.304-161.267 92.465 38.187 129.856 -85.102 89.317 46.498 142.484 -88.857 89.134 44.700 143.085 -92.546 93.282 52.501 135.995-143.662 93.833 67.891 148.948-116.818 119.792 -78.798 122.040-129.702 90.783 93.254 142.807-133.015 92.065 107.961 144.321 -42.103 94.244 46.211 142.900-141.124 93.362 35.277 133.341 -90.693 93.960 119.807 132.199 -86.548 94.206 49.898 133.564 -99.469 94.902 30.397 141.264-126.289 95.955 50.969 144.713-136.001 96.610 124.273 0.000 0.000 128.426 -76.507 161.207 166.960 93.054 51.059 141.344 -91.189 93.179 34.568 136.366-107.020 91.809 48.785 115.551 -76.373 91.235 63.310 149.757-124.731 93.021 54.629 139.867-105.703 92.379 13.986 109.274 -83.573 110.713-156.766 151.173 -20.860 123.030 128.040 120.712-126.482 95.290 24.322 116.566 -76.563 93.800 51.687 140.037 -98.227 91.584 41.725 116.584 -76.497 92.261 38.109 129.367 -76.221 88.097 45.579 141.811-130.276 89.477 56.353 148.020-135.475 89.339 40.747 143.412 -42.738 91.494 38.569 129.305 -76.084 91.964 44.555 131.084 -81.234 92.121 41.206 129.364 -76.204 92.453 34.108 137.811 -79.763 92.502 45.217 137.117 -91.475 91.022 45.653 142.861 -45.279 91.451 43.263 142.350-132.397 92.377 63.712 142.995-124.085 93.023 0.000 129.417 -76.269 # 10 total E -2.33982E+02 rmsd from N 0.000 %NC 0.00 93.551 62.833 136.543 -97.451 93.352 54.820 140.777-111.279 91.703 43.505 143.297-133.328 92.460 36.838 129.390 -76.163 92.899 44.528 143.973-152.170 92.230 33.172 138.056-148.850 93.176 42.517 130.698 -83.914 91.658 36.440 139.905 -84.331 91.660 48.038 151.352-130.826 91.440 41.909 137.150-141.886 92.847 32.269 147.924-114.468 120.923-160.577 121.325-128.335 93.606 67.916 143.572-135.785 92.436 64.881 148.580-118.483 92.817 116.966 142.954-130.279 93.833 58.953 133.439 -95.316 93.249 71.791 133.099 -87.597 93.362 62.298 135.151 -99.896 93.023 67.288 142.424 -95.181 91.751 23.179 143.335-133.136 105.318-141.702 0.000 0.000 129.284 -82.354 160.748 163.930 92.965 48.522 142.519 -91.857 92.740 37.964 138.739-102.683 91.071 45.333 115.109 -76.150 91.357 84.579 147.404-118.453 93.668 78.267 141.813-115.039 91.473 57.107 142.567-124.082 93.619-150.342 144.132-124.845 93.040 70.743 99.859-114.687 91.788 43.382 116.129 -76.225 92.869 48.245 137.993-101.365 90.891 41.264 115.546 -75.977 92.315 37.805 129.351 -76.149 90.351 42.248 142.500-132.059 90.904 40.202 144.640-111.071 90.410 43.391 147.257-125.768 91.610 42.147 129.320 -76.106 91.683 42.585 129.883 -83.890 92.352 38.428 129.061 -75.980 93.347 37.036 137.497 -85.984 93.794 38.238 136.816 -93.512 92.633 45.354 146.022 -39.752 91.765 42.225 142.535-134.864 92.396 63.620 143.002-124.143 93.021 0.000 129.407 -76.264 # 11 total E -2.35064E+02 rmsd from N 0.000 %NC 0.00 93.709 79.555 139.550-107.554 93.524 51.607 139.366-102.575 92.974 37.145 143.678-133.959 92.447 41.575 129.532 -76.242 92.436 41.155 139.149-147.167 91.502 37.476 138.523-149.632 91.777 43.836 130.870-108.873 86.988 51.188 140.065 -83.593 88.798 48.709 144.622-107.143 88.869 57.315 137.606-138.144 92.719 175.056 144.787 -39.386 92.289 75.746 100.670-114.375 91.336 44.419 142.386-132.108 92.319 54.055 145.320 -39.401 91.383 46.094 142.880-137.982 93.130 53.506 132.619 -91.989 95.801-163.636 132.000 -90.221 95.300-175.349 138.628-105.817 118.941-128.983 140.524-116.639 94.130 38.935 144.077-134.713 93.872 43.806 0.000 0.000 116.531 18.437 157.749-177.526 92.097 45.866 139.395 -90.616 92.793 38.850 136.705-105.532 91.344 44.057 114.898 -75.669 91.978 43.142 146.716-115.448 93.627 40.711 141.640-111.509 93.000 38.970 143.350-125.512 95.180 148.510 144.075-125.555 93.367 48.154 100.170-113.152 92.823 38.828 116.297 -76.356 93.334 90.474 137.798-104.157 92.835 85.360 116.489 -75.879 92.604 37.960 129.383 -76.166 91.654 37.730 143.136-133.483 91.556 48.417 146.166 -39.611 90.639 45.524 146.892 -39.645 91.074 34.966 129.241 -76.073 90.891 46.582 128.870 -87.493 91.728 47.166 128.986 -76.007 91.791 37.319 138.256 -76.599 92.035 41.260 137.418 -89.871 91.350 46.393 143.473 -43.137 91.588 41.338 141.902-128.883 92.663 63.567 143.098-125.927 93.022 0.000 129.408 -76.263 # 12 total E -2.40812E+02 rmsd from N 0.000 %NC 0.00 93.730 89.397 139.575-107.252 93.265 51.875 139.508-101.723 91.746 40.524 143.311-133.125 92.422 40.059 129.321 -76.019 92.768 41.692 140.597-143.733 93.275 34.235 138.483-149.955 92.323 44.350 131.733 -97.648 87.560 58.950 142.503 -87.923 88.264 50.980 146.117-106.716 87.013 57.943 138.469-140.440 91.998 165.452 143.313 -42.969 119.542 63.250 122.090-130.144 93.960 34.518 143.751-134.961 94.103 43.739 145.769 -39.056 93.097 45.754 111.132 -83.043 92.675 43.695 132.455 -94.291 93.077 34.962 130.862 -88.772 93.920 121.076 141.245-110.071 92.429 58.211 144.303 122.389 90.940 37.876 143.146-133.126 94.510 42.145 0.000 0.000 93.588 38.662 136.653-117.333 94.406 36.515 138.760 -91.323 93.382 39.749 136.370-105.191 93.052 39.111 115.317 -76.541 92.602 47.224 150.490-124.871 93.721 65.254 140.292 -99.686 92.674 -39.614 143.057-124.823 119.540-119.017 152.412 -19.182 118.190 106.775 122.281-131.502 91.032 66.943 115.973 -76.150 93.028 88.011 134.713-101.997 92.217 45.034 115.884 -76.203 92.494 38.931 129.386 -76.168 91.101 41.416 142.900-132.796 90.924 42.512 147.879-122.704 90.758 40.104 144.173 -41.957 91.840 40.212 129.313 -76.122 92.378 44.403 130.882 -85.062 92.519 34.167 129.260 -76.161 93.062 43.575 139.129 -84.645 92.764 54.482 137.172 -91.257 91.013 40.891 146.333-115.113 92.229 47.367 145.303-135.319 92.247 63.903 142.896-124.119 93.020 0.000 129.416 -76.259 # 13 total E -2.29974E+02 rmsd from N 0.000 %NC 0.00 93.572 65.563 137.018 -98.811 93.759 50.791 139.313-104.656 95.882 31.622 150.328 -31.604 92.757 43.276 129.605 -76.150 93.227 39.259 141.435-145.562 93.456 35.957 139.769-150.661 93.466 38.710 130.401 -84.709 91.687 38.997 140.824 -87.168 91.390 43.927 150.200-123.482 92.353 42.067 137.605-140.640 93.583 -89.597 146.537 -41.148 119.418 121.185 122.052-129.868 107.379 114.847 151.199 -28.940 92.958 49.154 145.378 -40.532 91.757 41.009 143.195-134.214 92.992 47.860 135.095 -93.541 92.871 35.785 134.245 -83.101 92.769 52.369 140.247-103.326 91.222 46.056 138.633-111.490 100.540-114.343 150.464 -29.633 95.212 121.878 0.000 0.000 93.312 38.157 130.006 -35.778 94.988 36.529 141.091 -91.189 93.997 35.093 136.812-105.458 93.698 42.339 115.552 -76.331 93.208 41.996 146.431 -39.995 93.370 49.457 140.029 -98.563 92.601 38.210 143.100-124.771 119.959-163.009 152.510 -18.518 93.061 65.985 99.846-114.368 90.846 59.711 115.980 -76.138 92.652 86.086 134.747 -94.677 92.132 41.420 115.937 -76.304 92.906 38.895 129.427 -76.190 96.806 31.165 111.032 -82.890 93.196 39.836 149.971-120.492 92.793 37.277 145.582 -40.839 92.474 38.872 129.343 -76.171 92.579 42.236 131.075 -84.890 92.470 39.258 129.296 -76.203 92.690 37.730 138.182 -76.765 92.790 41.655 137.282 -91.542 90.943 47.322 146.176-113.603 91.297 42.475 142.003-131.786 92.450 65.612 143.018-124.253 93.019 0.000 129.401 -76.254 # 14 total E -2.29316E+02 rmsd from N 0.000 %NC 0.00 93.583 73.208 137.162 -98.319 93.783 50.679 139.667-104.924 93.594 35.743 143.903-134.640 92.541 42.093 129.482 -76.211 92.301 41.579 139.396-147.019 91.878 36.814 138.989-149.759 92.673 40.715 129.534 -87.339 90.953 37.692 137.960 -83.711 91.729 46.998 146.751-116.081 92.842 50.056 138.218-139.996 93.467 51.600 146.967 -39.137 124.150-112.888 118.899-122.588 91.556 112.128 149.906 -33.120 92.791 78.139 144.373 -42.331 93.757 98.400 143.889-139.355 95.117 -30.412 133.106 -89.954 96.222 -98.538 135.332 -80.682 94.930 -82.646 139.369-113.689 113.509-106.264 146.706-116.857 93.981 44.375 144.210-135.376 93.703 42.491 0.000 0.000 92.960 78.341 139.749-128.524 90.805 39.810 139.941 -92.285 92.506 42.362 136.342-104.561 91.405 46.748 115.396 -76.005 91.340 53.205 147.601-114.243 93.707 60.467 139.577-107.849 93.179 -69.958 143.339-125.236 118.153 -90.822 152.676 -19.818 119.128 104.883 121.912-130.306 91.178 53.625 116.011 -76.148 92.637 64.638 137.286-100.086 90.640 43.531 115.712 -75.681 92.400 36.937 129.383 -76.081 91.420 38.183 142.882-133.139 90.966 41.755 146.130-113.399 91.235 40.422 144.472 -42.878 91.902 37.947 129.346 -76.166 92.024 42.111 130.808 -85.420 92.184 40.432 129.257 -76.171 92.626 37.125 136.372 -71.278 92.866 42.792 137.376 -90.840 91.000 45.876 146.212-113.935 91.535 43.132 142.344-133.112 92.398 65.107 142.986-124.153 93.014 0.000 129.399 -76.253 # 15 total E -2.35753E+02 rmsd from N 0.000 %NC 0.00 93.620 76.967 137.964-101.039 93.655 50.698 140.839-105.981 92.577 37.323 143.587-134.080 92.366 41.577 129.455 -76.243 92.108 44.318 141.111-147.312 95.493 28.779 142.666-142.137 96.424 33.532 132.667 -89.359 99.227 26.422 140.210 -85.011 95.403 40.750 146.581 -38.427 94.309 54.606 137.139-152.880 92.869 40.633 145.581 -40.584 94.647 27.206 99.930-109.869 95.634 52.942 110.581 -82.477 92.854 46.320 145.587 -42.514 90.687 54.742 144.840-135.503 93.055 44.158 132.594 -92.625 96.053-121.629 133.193 -88.161 94.316 120.557 137.814-103.933 115.497 173.132 142.891-152.029 94.681 74.815 144.243-135.275 96.631 78.198 0.000 0.000 94.482 36.510 138.506-120.582 94.665 39.744 141.230 -91.377 93.583 31.927 136.346-105.483 93.219 44.915 115.308 -76.436 93.170 57.035 146.358 -39.746 92.797 55.503 140.397 -99.592 90.500 33.936 142.074-122.935 113.680-162.243 151.583 -20.431 93.380 90.754 99.852-114.231 91.270 43.749 116.039 -76.178 92.627 75.262 138.607-109.471 90.443 46.678 115.090 -75.848 92.479 42.276 129.387 -76.146 93.824 32.203 143.728-134.801 93.214 42.026 147.070 -37.025 91.127 39.116 148.568-121.959 92.319 38.166 129.354 -76.159 92.612 38.402 129.765 -88.132 92.245 41.891 129.411 -76.291 92.718 37.759 137.022 -80.311 92.814 40.421 137.191 -91.897 91.735 47.262 144.760 -41.447 91.264 42.046 142.220-131.036 92.471 63.934 143.030-124.265 93.018 0.000 129.410 -76.260 # 16 total E -2.28913E+02 rmsd from N 0.000 %NC 0.00 94.658 -84.807 135.618 -99.012 93.926 9.511 137.976-103.996 96.277-170.953 145.256-132.489 93.130 118.446 129.425 -76.173 135.088 -67.474 105.931 -86.608 94.905 50.439 141.645-157.607 93.896 31.584 130.199 -89.613 91.738 45.919 141.434 -84.902 91.100 46.099 149.319-126.999 91.958 53.807 139.262-143.077 92.152 64.228 149.082-117.122 118.763-156.901 122.077-130.561 93.893 50.260 143.646-135.291 91.958 46.313 149.034-118.910 90.827 42.942 142.385-129.330 93.105 39.638 131.351 -95.593 93.362 44.299 131.475 -87.757 93.930 34.406 136.955-103.836 94.545 124.945 143.825 -42.935 94.157 47.317 111.328 -82.965 92.377 48.809 0.000 0.000 92.858 41.627 135.996-124.761 91.509 40.308 141.382 -92.354 92.752 35.325 136.028-103.927 91.089 43.451 115.062 -76.232 91.145 54.028 144.840 -42.845 92.715 50.676 138.649 -93.596 90.342 52.009 142.031-123.006 92.711-169.982 142.936-123.549 93.070 77.450 99.833-114.660 92.040 42.740 116.161 -76.237 93.181 45.129 138.577-111.854 89.842 41.312 115.431 -75.999 91.858 43.831 129.296 -76.118 89.264 41.700 142.006-131.426 91.931 37.904 144.170 -40.439 92.306 38.079 147.589-115.946 92.916 37.517 129.391 -76.190 93.732 37.978 131.067 -86.802 93.078 36.651 129.410 -76.267 93.942 36.070 137.945 -85.563 93.737 40.389 137.063 -92.845 91.712 43.378 146.705-114.192 92.378 43.257 141.980-138.337 92.390 63.971 142.966-124.405 93.022 0.000 129.406 -76.257 # 17 total E -2.36732E+02 rmsd from N 0.000 %NC 0.00 93.607 70.791 137.739-100.935 93.721 54.111 142.243-111.902 92.316 34.351 143.501-133.828 92.207 44.278 129.477 -76.213 91.348 43.025 139.189-147.016 92.203 35.577 143.543-150.766 93.093 36.085 129.741 -87.440 92.739 36.522 138.507 -85.835 92.641 43.238 143.940 -41.356 93.062 53.775 140.342-149.585 93.179 60.505 146.794 -39.316 121.909 -42.958 120.363-126.031 94.366 74.759 143.874-135.084 92.605 54.142 146.591 -39.733 90.915 49.589 143.488-132.736 92.777 37.549 132.716 -91.375 95.536-179.349 131.855 -83.637 94.912-174.583 140.674-108.907 121.116-115.583 139.164-114.298 92.449 45.761 143.649-133.717 93.444 51.854 0.000 0.000 119.281 14.063 158.092-179.810 92.646 46.218 139.563 -90.699 93.156 38.491 136.202-104.872 92.934 48.010 115.446 -75.653 92.338 35.872 145.936-107.838 94.597 41.248 140.417-117.060 94.013 43.741 143.856-126.343 94.400 149.383 143.582-124.412 93.803 39.368 99.665-113.515 94.265 39.110 116.530 -76.504 93.516 87.148 137.810-104.539 93.228 92.669 116.549 -75.930 92.511 38.258 129.372 -76.156 91.640 37.628 143.129-133.478 91.697 48.257 145.575 -39.717 90.600 38.467 144.372 -46.296 91.823 39.029 129.312 -76.120 91.554 54.797 129.559 -87.105 91.813 48.596 129.277 -76.244 91.676 37.227 137.483 -67.765 92.093 43.288 137.523 -87.736 91.198 47.812 143.649 -42.726 91.138 42.223 141.991-129.865 92.475 64.534 143.023-124.494 93.023 0.000 129.415 -76.271 # 18 total E -2.39311E+02 rmsd from N 0.000 %NC 0.00 93.648 84.490 138.277-101.697 93.608 47.713 139.266-102.598 92.794 38.682 143.649-134.104 92.479 40.114 129.479 -76.234 92.512 43.871 142.723-155.589 91.841 33.553 139.125-149.256 92.613 39.817 129.630 -87.829 88.884 45.241 139.264 -86.476 89.774 47.143 142.976 -44.545 90.717 48.532 136.685-139.881 94.125 39.536 147.115 -37.314 92.651 41.175 102.105-112.255 91.185 43.499 142.387-131.821 92.538 39.454 144.952 -41.084 90.282 51.914 144.268-131.850 92.600 39.830 132.007 -96.668 93.862 60.398 131.094 -89.114 93.966 8.083 136.982 -99.013 114.495-145.419 145.060-112.027 93.790 60.966 144.022-134.722 94.316 166.764 0.000 0.000 125.258 23.690 157.772 175.982 91.156 42.544 141.161 -92.183 92.899 43.034 136.320-105.016 91.858 54.623 115.200 -76.068 91.684 103.161 149.408-117.009 93.329 47.936 139.811-106.716 91.506 62.718 142.666-124.038 92.705-176.774 142.710-123.945 93.511 61.464 99.880-114.682 93.508 35.448 116.396 -76.399 93.240 47.259 138.157-102.037 90.857 45.578 116.080 -76.119 92.299 37.052 129.327 -76.167 91.411 36.863 142.907-132.062 91.971 44.404 145.784 -40.346 91.862 38.073 144.191 -42.576 92.102 37.644 129.296 -76.120 92.372 43.882 127.720-110.104 91.769 44.086 129.276 -76.186 91.788 41.213 137.918 -78.959 92.088 43.092 135.954 -82.244 91.045 50.509 143.536 -42.258 90.653 40.911 141.698-132.450 92.437 67.948 143.033-124.158 93.022 0.000 129.404 -76.259 # 19 total E -2.36570E+02 rmsd from N 0.000 %NC 0.00 93.649 80.636 138.407-102.477 93.540 49.456 139.289-102.281 92.625 38.884 143.599-133.995 92.460 40.478 129.464 -76.221 92.210 42.999 140.589-148.500 91.819 34.740 138.784-148.930 92.522 42.573 129.928 -86.032 90.220 37.491 138.696 -85.734 91.223 51.239 147.902-111.020 91.384 48.258 137.952-140.473 91.750 50.854 148.474-117.070 121.211-111.471 120.177-126.435 92.525 110.830 110.995 -83.136 92.468 59.575 147.974-117.338 92.903 37.855 144.480-131.397 93.469 39.558 133.326 -91.456 93.566 41.122 133.105 -94.040 93.036 47.039 137.827 -92.304 93.088 45.353 138.795-118.567 93.536 19.215 143.943-134.249 121.508-124.880 0.000 0.000 126.153-116.758 158.311 175.971 91.995 41.847 142.505 -91.354 92.822 46.075 136.824-105.121 91.279 58.253 115.430 -76.078 91.757 98.266 149.051-117.672 93.659 50.728 139.840-111.206 92.693 84.843 143.242-125.060 95.343-152.627 145.024-127.825 121.520 7.550 121.067-127.940 93.800 48.301 116.469 -76.413 92.924 37.465 137.200-102.266 90.154 51.511 115.188 -75.738 91.914 42.337 129.273 -76.146 89.983 36.889 142.358-132.147 91.884 43.804 144.701 -38.739 91.275 38.454 144.413 -43.865 92.094 38.038 129.314 -76.128 92.363 42.555 129.787 -85.063 92.443 39.263 129.366 -76.310 92.678 36.728 138.503 -78.331 92.372 42.794 137.075 -90.663 90.606 54.989 143.788 -44.525 89.783 42.757 142.011-131.324 92.481 78.345 143.043-124.677 93.008 0.000 129.363 -76.184 # 20 total E -2.37152E+02 rmsd from N 0.000 %NC 0.00 93.659 82.348 138.496-102.831 93.613 48.338 139.212-102.455 92.782 38.081 143.657-134.089 92.418 41.619 129.622 -76.319 91.751 43.778 144.116-152.737 91.576 35.007 138.468-148.972 91.997 43.211 129.085 -87.893 88.302 44.666 138.507 -88.135 89.861 57.633 145.029-106.214 91.092 37.278 136.554-140.463 92.788 138.478 146.223 -38.879 94.507 69.215 99.817-111.843 97.131 27.383 144.530-137.140 95.717 43.232 146.606 -38.074 95.799 40.470 110.987 -83.646 93.316 47.007 136.202 -96.832 93.763 34.244 131.075 -89.063 94.196 45.301 139.309-100.166 116.159 163.031 140.403 -97.915 93.642 43.206 143.965-134.382 94.285 69.118 0.000 0.000 118.303 20.674 158.335 177.358 90.723 47.713 143.501 -93.540 91.952 38.070 135.984-103.669 90.746 48.243 114.883 -76.048 90.909 47.457 144.699-104.491 93.282 40.160 139.026-101.509 92.086 47.779 142.900-124.639 93.703 153.444 143.201-123.938 93.280 49.286 99.984-114.813 92.775 38.520 116.298 -76.355 93.166 83.812 137.714-103.193 92.041 67.069 116.312 -76.242 92.295 36.817 129.388 -76.152 89.779 44.854 142.508-131.958 91.271 62.378 146.771 -39.354 89.168 45.863 148.472-112.434 91.387 35.901 129.312 -76.079 91.869 43.834 129.520 -86.705 92.147 42.488 129.003 -75.963 92.359 35.796 137.904 -86.633 92.441 43.294 136.899 -93.304 91.294 46.058 143.251 -43.670 91.475 42.672 142.320-132.607 92.425 63.640 143.029-124.270 93.024 0.000 129.415 -76.270 # 21 total E -2.39112E+02 rmsd from N 0.000 %NC 0.00 93.603 57.504 137.580-102.604 93.619 52.329 139.610-103.419 93.229 37.641 143.796-134.571 92.542 39.636 129.853 -76.607 93.016 40.462 136.221 -26.943 92.990 35.256 139.542-149.989 93.080 41.511 129.738 -90.318 91.193 38.209 138.916 -84.799 91.741 52.503 145.118 -41.098 90.366 73.432 137.818-140.709 93.327-167.471 145.572 -39.270 92.756 65.152 100.719-113.688 92.158 46.907 142.642-132.931 92.536 87.174 147.119 -37.781 90.950 48.635 142.626-133.307 92.113 38.533 132.689 -91.124 92.070 50.589 130.370 -91.081 92.353 43.022 125.156 -70.983 92.421 49.900 135.392-166.658 91.234 30.436 143.207-132.594 100.901 -99.478 0.000 0.000 127.169-131.778 158.591 173.176 91.078 44.719 142.245 -91.004 92.730 36.734 136.771-104.885 90.212 44.786 115.363 -76.011 91.009 46.056 144.526 -43.063 92.904 47.973 136.707 -84.081 90.747 55.139 142.236-123.421 92.432-172.300 142.726-123.522 92.675 71.902 99.862-114.875 91.552 44.038 116.101 -76.193 93.160 42.292 137.003 -97.457 92.181 37.984 115.779 -76.142 92.646 37.647 129.361 -76.179 92.142 38.478 142.873-133.138 91.974 38.037 146.203-111.468 92.603 38.038 145.966 -40.879 92.364 38.453 129.341 -76.157 92.300 42.397 130.278 -86.822 92.309 38.702 129.346 -76.249 92.858 38.628 137.969 -75.108 92.988 39.357 137.300 -90.930 91.887 46.855 144.838 -41.346 91.430 42.013 142.049-132.324 92.464 63.622 143.014-124.287 93.022 0.000 129.413 -76.268 # 22 total E -2.27150E+02 rmsd from N 0.000 %NC 0.00 93.622 59.946 137.991-103.893 93.580 60.304 139.793-105.350 93.556 39.325 150.065 -32.160 92.276 42.689 129.859 -76.576 92.725 44.866 136.984 -25.322 92.872 36.572 139.468-152.887 93.428 42.625 129.891 -86.605 93.513-133.492 139.974 -87.536 108.936 153.687 151.359 -27.405 99.085 132.252 138.719-141.194 92.516 114.323 147.215-109.251 119.464 -42.035 121.140-129.008 92.854 161.603 143.420-134.108 121.268-172.367 158.062-139.328 107.193 -85.693 147.999-145.036 93.797 57.890 134.051 -90.193 93.370 48.555 133.456 -87.647 92.865 49.628 137.233-100.878 91.940 43.725 132.070 -39.329 91.419 43.708 143.442-134.366 91.687 45.890 0.000 0.000 92.018 41.084 133.865-117.504 93.302 38.226 139.870 -92.686 93.152 38.035 136.277-104.725 92.570 41.430 115.257 -76.379 92.263 54.688 149.471-125.211 93.306 59.443 139.004 -97.180 93.951 -15.112 109.368 -83.602 120.191-137.032 152.371 -18.957 119.420 116.193 121.725-130.052 91.271 48.220 115.984 -76.169 92.736 60.269 137.996-106.282 90.303 42.447 115.880 -75.745 92.515 37.819 129.388 -76.185 91.328 38.256 142.921-133.043 91.102 46.824 145.635 -40.654 90.814 41.023 144.275 -42.951 91.884 36.250 129.298 -76.110 92.153 44.392 130.368 -85.150 92.276 41.530 129.250 -76.175 92.402 37.199 138.452 -78.352 92.653 40.641 137.265 -91.643 91.199 46.316 145.941-112.845 91.472 42.445 142.374-131.854 92.466 65.034 142.985-124.510 93.019 0.000 129.405 -76.259 # 23 total E -2.41006E+02 rmsd from N 0.000 %NC 0.00 93.868 122.701 139.384-104.219 93.219 46.271 137.635 -97.496 92.771 45.788 143.577-134.166 93.085 33.789 129.458 -76.245 94.554 40.147 145.129-161.312 92.453 35.742 141.963-156.842 92.713 44.071 129.867 -85.962 90.969 36.635 137.580 -83.787 91.771 50.808 145.941-112.818 93.352 76.763 138.028-142.555 107.280-164.915 153.623 -28.460 94.248 55.964 100.545-112.224 93.692 40.045 112.369 -83.138 92.597 85.958 146.430 -37.300 91.542 44.720 142.193-140.332 92.654 42.122 132.926 -90.805 93.096 95.460 131.990 -87.086 93.464 91.107 136.097-102.626 91.783 49.327 134.408 -56.564 92.217 43.401 143.700-135.383 92.293 41.378 0.000 0.000 91.595 51.953 139.151-128.018 89.884 38.829 138.652 -92.545 92.441 41.776 135.865-103.573 90.692 46.260 115.575 -75.867 91.290 44.221 150.413-122.361 93.946 46.594 139.505-109.317 94.701 -5.441 144.136-126.849 116.730 169.906 112.092 -82.557 94.097 64.159 99.765-114.388 96.811 24.189 116.942 -76.737 94.550 44.919 137.969-104.696 92.157 44.259 115.985 -77.077 91.797 43.649 129.331 -76.229 86.990 44.356 141.443-130.025 90.767 46.665 144.707 -39.942 90.182 41.704 145.281 -40.068 91.358 37.553 129.253 -76.069 91.465 45.364 129.477 -86.551 91.958 41.423 129.213 -76.123 92.226 37.177 138.296 -79.920 92.236 43.303 137.177 -90.895 90.930 49.239 143.613 -43.607 90.812 41.973 141.743-127.732 92.503 65.099 143.047-124.349 93.024 0.000 129.417 -76.270 # 24 total E -2.29919E+02 rmsd from N 0.000 %NC 0.00 93.777 92.847 140.259-110.308 93.224 55.064 138.842 -99.524 92.290 39.023 150.149 -35.029 92.042 47.620 129.530 -76.229 92.033 49.286 141.345-142.637 94.332 27.932 138.519-150.645 93.651 42.421 136.549 -81.986 89.966 45.015 140.589 -85.627 90.787 61.867 144.165 -43.877 91.358 103.438 135.623-140.566 94.971-135.682 147.126-104.579 118.898 22.001 121.626-129.666 91.935 58.645 143.164-133.408 91.571 93.999 145.697 -39.765 92.432 52.561 141.937-137.691 92.349 36.985 132.854 -91.065 92.215 57.736 131.076 -85.951 92.796 50.242 129.490 -78.601 95.048 34.291 139.433-107.994 99.393 30.559 150.834 -29.427 97.453 37.002 0.000 0.000 94.173 48.001 139.029-132.747 90.889 37.188 139.064 -92.381 92.395 41.726 135.948-103.802 91.341 44.515 115.511 -75.962 91.797 41.479 149.871-115.588 94.484 36.037 139.637-113.464 96.817 -28.253 145.170-128.868 131.890 -74.493 114.361 -82.031 118.644-130.768 121.330-129.890 126.467-109.328 122.473 -80.211 92.758 49.178 137.221-101.868 89.816 48.902 115.913 -75.974 92.175 43.138 129.112 -75.863 89.977 35.708 142.489-133.525 91.381 45.220 145.511 -40.027 90.789 38.128 143.270 -45.193 92.190 39.499 129.306 -76.136 92.432 41.800 130.821 -86.122 92.299 39.495 129.265 -76.166 92.866 37.334 137.099 -78.309 92.947 42.391 137.258 -92.124 91.050 46.013 146.301-114.129 91.592 42.841 142.334-133.229 92.398 65.178 143.021-124.110 93.015 0.000 129.389 -76.252 # 25 total E -2.36672E+02 rmsd from N 0.000 %NC 0.00 93.616 74.463 137.925-101.091 93.664 49.290 139.597-104.009 92.941 37.718 143.693-134.186 92.552 40.646 129.460 -76.225 92.549 41.452 140.915-144.818 93.968 33.560 138.906-148.007 94.383 37.738 131.534 -84.551 93.138 35.968 141.534 -86.707 92.890 43.312 146.490 -39.773 94.034 56.226 139.472-142.324 92.344 70.848 149.299-118.733 117.797 -94.029 122.395-131.609 94.614 124.073 143.922-135.419 110.506 172.905 152.531 -26.151 107.560 -92.441 148.007-145.261 93.809 55.190 135.789 -90.330 92.974 54.520 133.329 -87.800 92.802 95.449 134.731-102.013 93.233 45.976 132.226-103.134 92.905 46.572 143.801-134.727 94.393 38.843 0.000 0.000 94.430 42.121 141.084-127.283 92.358 37.067 140.539 -95.340 92.929 41.985 136.182-104.689 91.666 50.719 115.257 -76.314 91.050 72.534 147.530-119.804 93.794 70.964 139.893-113.133 93.361 -21.198 143.323-125.520 122.256 155.488 152.525 -18.611 121.667 142.750 120.959-127.713 95.737 31.707 116.710 -76.630 93.899 57.902 137.480-104.075 92.021 106.961 115.893 -76.310 92.451 58.987 129.383 -76.163 91.952 37.446 144.393-131.646 92.825 40.329 146.877 -37.677 92.276 38.522 145.316 -39.661 91.737 40.355 129.273 -76.124 91.588 43.941 120.166 -84.312 92.513 36.266 129.114 -76.231 93.517 38.748 138.304 -81.828 93.771 35.436 136.077 -85.930 92.867 46.296 145.529 -40.648 91.963 40.260 141.671-135.229 92.548 63.143 143.038-124.721 93.006 0.000 129.410 -76.275 # 26 total E -2.33215E+02 rmsd from N 0.000 %NC 0.00 93.612 72.031 137.834-101.249 93.660 54.608 141.796-107.875 92.874 34.045 143.685-134.193 92.268 44.137 129.471 -76.202 91.181 43.178 138.684-146.693 89.995 41.394 141.960-153.186 91.338 40.597 128.990 -88.004 88.938 43.230 139.951 -85.722 91.627 62.628 143.236 -44.161 94.985 94.166 138.598-144.491 120.163-125.503 158.370-128.575 116.547 23.026 122.214-131.935 89.577 58.391 142.393-131.819 90.750 65.605 144.176 -43.166 91.249 60.169 142.102-132.275 92.445 38.007 133.266 -93.303 92.333 47.705 131.247 -87.714 92.982 85.880 132.016 -94.002 93.700 81.666 137.279-113.092 113.603 -23.895 152.583 -23.274 94.838 72.238 0.000 0.000 92.699 42.422 133.217 -36.254 91.484 43.150 142.792 -88.453 92.772 34.551 136.002-103.628 91.909 43.468 115.266 -76.328 91.864 46.406 144.433 -42.544 93.069 48.397 139.993 -98.094 90.898 55.139 142.274-123.280 96.671 46.534 149.802 -23.818 122.106-136.437 121.080-127.321 92.029 98.016 116.212 -76.302 93.495 139.082 133.980 -93.625 93.813 47.193 116.505 -76.230 93.180 36.456 129.428 -76.198 92.773 37.230 143.467-134.133 91.636 45.641 144.933 -41.680 90.569 41.126 143.894 -43.978 91.942 38.659 129.302 -76.116 92.677 41.129 129.805 -84.978 92.561 37.439 129.405 -76.232 93.080 42.320 137.827 -73.117 93.473 34.704 137.338 -90.493 92.678 46.605 145.872 -38.282 92.076 41.075 142.204-137.483 92.453 64.690 142.979-124.564 93.021 0.000 129.400 -76.260 # 27 total E -2.37697E+02 rmsd from N 0.000 %NC 0.00 93.671 81.322 138.804-104.154 93.488 49.932 139.555-102.312 92.254 39.067 143.449-133.685 92.403 40.905 129.451 -76.229 92.201 41.405 141.685-142.771 94.568 32.965 138.750-149.526 94.640 35.016 130.751 -86.932 93.103 38.587 140.218 -85.247 91.905 43.430 144.358 -42.222 92.039 49.628 139.612-141.726 94.353 34.753 146.600 -38.856 94.334 38.021 101.238-108.456 94.420 41.943 143.362-133.778 92.961 38.027 147.722-116.071 92.302 43.741 143.245-134.868 93.617 37.242 132.509 -98.449 94.129 47.029 131.955 -87.954 94.039 14.860 136.990-101.742 121.614-157.556 146.004-145.740 92.433 74.481 144.128-134.531 91.975 63.770 0.000 0.000 91.207 63.437 137.832-125.915 90.050 38.180 137.985 -90.283 92.356 41.720 136.209-104.223 90.488 45.129 115.578 -76.003 91.688 42.225 145.881 -39.158 93.615 41.712 140.365-114.609 93.455 94.807 143.590-125.650 107.756-149.725 151.208-140.247 121.743 7.438 120.971-127.675 94.538 45.523 116.577 -76.474 93.375 35.041 137.339-102.682 91.050 49.270 115.233 -75.762 92.062 42.322 129.275 -76.163 92.965 31.311 143.191-134.156 94.131 39.210 146.288 -35.832 92.889 36.025 145.326 -42.036 92.297 38.374 129.327 -76.169 92.186 44.083 130.198 -82.616 92.709 36.924 129.263 -76.107 93.820 34.147 138.169 -80.535 93.676 40.175 136.936 -92.295 92.016 53.081 145.500 -42.457 90.352 50.498 142.542-134.802 90.947 79.760 142.277-122.855 93.025 0.000 129.324 -76.230 # 28 total E -2.34058E+02 rmsd from N 0.000 %NC 0.00 94.374 169.578 137.792 -98.879 93.344 52.935 139.363 -99.726 94.882 38.021 150.226 -33.075 93.069 36.465 129.489 -76.230 93.966 40.556 143.948-152.840 92.423 36.050 141.501-153.991 93.233 38.792 131.382 -79.951 93.621 32.438 139.724 -84.758 93.683 40.768 148.333-118.548 95.836 52.029 140.472-146.945 91.737 43.159 149.345-117.589 117.865 -95.031 121.725-130.717 103.114-109.402 146.761-142.074 91.771 73.450 151.299-134.246 89.786 64.865 142.474-132.428 93.115 114.636 132.466 -88.375 93.760 76.239 133.664 -95.984 92.988 114.513 137.883-101.212 119.569 -94.739 139.628 -98.529 94.606 46.695 111.346 -82.961 93.199 38.470 0.000 0.000 92.268 49.916 135.343-116.850 93.532 34.042 139.061 -91.779 93.714 33.358 136.509-105.349 93.752 43.720 115.548 -76.242 93.549 34.808 146.164 -41.883 94.200 51.497 140.094-105.347 94.918 41.476 109.802 -83.863 95.204 157.056 145.345-128.396 93.334 46.798 100.003-115.478 93.624 34.842 116.420 -76.431 92.873 57.857 137.744 -98.376 90.276 48.755 114.531 -76.206 91.883 36.988 129.336 -76.160 89.581 42.446 142.376-131.754 90.852 42.377 146.310-114.108 90.539 40.187 145.091 -41.772 91.342 40.066 129.266 -76.080 91.473 44.633 130.258 -95.836 91.769 39.291 129.289 -76.099 92.042 38.802 138.509 -82.956 91.957 52.600 137.092 -92.123 89.771 49.076 143.326-106.896 90.926 43.675 142.502-127.603 92.415 67.334 143.001-124.199 93.024 0.000 129.415 -76.267 # 29 total E -2.31893E+02 rmsd from N 0.000 %NC 0.00 93.639 79.057 138.218-101.817 93.603 48.391 139.259-102.477 92.820 38.463 143.659-134.131 92.480 40.483 129.483 -76.239 92.213 43.321 141.116-150.994 91.825 34.287 139.020-148.892 92.764 39.963 129.627 -87.426 89.522 41.270 139.015 -87.874 89.890 47.919 143.731 -44.101 89.569 57.205 136.562-139.367 92.302 67.522 146.125 -38.562 113.762 -10.890 123.780-135.648 91.822 107.514 144.051-131.658 94.058 -93.415 145.383 -40.964 92.467 84.367 143.264-133.935 93.982 95.440 131.999 -99.049 96.228 135.387 133.192 -88.524 94.460 -95.395 137.661-103.605 93.335 74.499 138.030 -88.543 94.494 48.154 144.358-136.207 94.515 36.423 0.000 0.000 93.483 46.723 139.213-123.886 92.424 37.835 139.004 -91.065 92.850 39.913 136.073-104.448 92.527 42.158 115.345 -76.263 92.387 40.051 149.467-118.378 94.016 43.580 139.540-105.042 94.368 29.622 143.981-126.409 123.528-169.147 152.969 -17.769 92.801 66.922 99.843-114.475 90.655 52.944 115.945 -76.048 92.335 77.641 135.870 -91.946 91.154 41.816 115.592 -76.317 92.495 38.951 129.371 -76.163 92.251 38.103 143.985-136.366 91.246 43.761 150.974-114.727 91.944 34.264 144.901 -41.775 92.674 36.214 129.374 -76.166 92.739 43.485 130.226 -85.957 92.346 39.302 129.293 -76.269 92.850 34.881 137.926 -77.239 93.100 40.633 137.155 -91.437 91.765 44.734 143.768 -43.363 91.815 42.691 142.190-135.283 92.351 63.069 142.969-124.073 93.022 0.000 129.410 -76.266 # 30 total E -2.29473E+02 rmsd from N 0.000 %NC 0.00 93.726 79.171 139.867-108.987 93.436 48.999 138.820-100.179 92.146 39.730 143.453-133.657 92.316 42.274 129.455 -76.204 91.992 41.108 139.595-151.043 90.810 37.593 139.128-147.232 91.897 44.449 129.378 -86.368 88.676 46.272 139.277 -85.836 90.344 35.276 145.799-111.103 94.939 57.934 140.608-142.003 94.512 76.048 147.136 -38.050 119.318-164.467 121.991-129.807 93.771 46.089 143.636-135.333 93.818 171.530 146.545 -37.497 93.998 82.193 144.832-138.297 94.050 41.036 131.617 -92.033 93.835 36.991 134.859 -84.235 93.186 55.544 139.557-107.403 92.088 62.997 144.697-126.184 91.048 40.776 143.183-132.900 93.543 102.637 0.000 0.000 126.732-145.177 157.026 179.338 93.440 47.947 142.226 -90.036 93.316 38.848 134.298-105.830 92.890 57.574 115.332 -76.606 92.013 98.641 147.462-121.509 93.714 72.801 139.692-107.120 92.423 -2.838 143.008-124.741 114.520-147.405 151.682 -20.036 121.965 118.527 120.922-127.482 93.224 32.482 116.273 -76.359 93.359 55.727 140.383-116.869 88.430 48.442 116.418 -75.698 91.403 39.916 129.290 -76.133 86.850 45.858 141.453-129.641 89.033 46.956 143.186 -99.364 90.831 39.349 144.006 -42.870 92.122 36.728 129.330 -76.114 92.712 42.602 130.314 -87.410 92.533 38.099 129.337 -76.268 92.881 38.708 137.864 -74.369 93.022 39.554 137.315 -90.688 91.964 46.304 144.892 -41.267 91.526 42.245 142.426-133.072 92.421 63.409 143.009-124.165 93.016 0.000 129.415 -76.260 # 31 total E -2.32300E+02 rmsd from N 0.000 %NC 0.00 93.651 82.784 138.255-101.793 93.610 52.075 141.218-107.936 92.481 36.233 143.555-133.836 92.284 43.529 129.560 -76.215 92.040 44.410 141.538-155.638 91.585 34.846 139.004-151.846 91.941 47.671 128.979 -86.832 87.661 65.243 137.989 -86.272 89.219 41.496 144.225-111.790 94.008 56.757 140.444-140.577 94.223 76.476 150.817-113.493 119.050 -86.234 122.998-131.655 96.242-179.726 111.298 -83.148 112.541 88.976 155.228-135.439 96.029 90.697 150.522 -30.897 120.926-122.979 154.502-113.205 94.250 41.622 133.941 -89.025 93.205 47.895 137.469-101.844 92.169 61.628 140.809-140.424 91.513 64.454 143.471-136.067 92.295 157.301 0.000 0.000 119.374 61.674 157.488 179.796 90.502 46.103 140.844 -88.977 92.437 40.186 136.443-104.863 90.995 43.166 115.703 -76.001 91.202 44.990 149.612-116.317 93.493 38.031 138.700 -98.872 92.480 54.802 143.109-124.956 94.070 175.788 143.509-125.378 92.472 65.108 99.931-115.111 91.166 44.872 116.044 -76.166 92.571 47.378 135.205 -86.168 90.722 40.483 115.997 -76.344 92.406 38.836 129.339 -76.169 89.302 43.032 142.115-131.205 89.605 49.218 147.708-120.735 90.134 42.107 144.670 -41.436 91.514 37.027 129.287 -76.090 91.722 44.801 129.858 -86.274 91.996 42.944 129.222 -76.164 92.088 37.290 137.771 -77.883 92.301 43.540 137.283 -90.432 91.222 46.375 143.554 -43.170 91.407 42.801 142.316-132.434 92.401 63.920 143.005-124.121 93.027 0.000 129.414 -76.269 # 32 total E -2.27109E+02 rmsd from N 0.000 %NC 0.00 93.621 72.287 138.020-101.889 93.612 50.553 139.727-103.419 92.968 37.107 143.695-134.165 92.559 40.804 129.460 -76.192 93.056 39.610 139.844-141.112 95.214 33.387 139.013-150.639 94.444 35.242 131.212 -85.648 92.423 40.362 141.968 -86.547 91.364 45.588 145.096 -42.340 92.049 49.778 139.270-141.281 92.864 37.775 148.958-115.482 93.266 39.139 101.588-113.358 92.026 41.405 142.615-132.377 91.179 42.721 145.853-114.544 89.426 61.138 140.527-130.420 92.711 56.661 134.480 -91.395 92.674 51.240 131.490 -90.298 93.385 29.478 136.022 -98.399 111.422-132.597 131.706 -45.813 93.797 44.826 144.067-134.547 117.605 -65.123 0.000 0.000 117.249-156.190 154.570 -1.365 91.061 55.204 138.797 -91.428 92.600 49.594 138.056-110.013 90.046 93.811 115.628 -75.756 93.855 -53.551 145.973 -39.620 94.342 92.906 138.948-103.395 93.690-134.635 143.487-125.566 120.666-171.376 152.386 -18.821 120.963 145.676 120.946-127.736 92.839 38.999 116.274 -76.317 93.668 40.615 137.987-101.124 92.927 38.299 116.625 -75.668 92.624 39.396 129.446 -76.289 89.660 40.438 142.084-131.312 89.663 49.431 148.336-120.648 90.820 38.645 143.212 -43.550 92.302 34.882 129.358 -76.142 92.382 44.911 130.001 -85.476 92.340 41.512 129.091 -76.204 92.421 36.944 138.296 -78.662 92.633 40.384 137.224 -90.985 91.638 47.412 144.175 -42.507 91.245 41.913 142.051-130.962 92.474 64.121 143.022-124.237 93.024 0.000 129.415 -76.270 # 33 total E -2.32350E+02 rmsd from N 0.000 %NC 0.00 93.740 101.966 138.967-104.457 93.346 54.721 140.733-102.548 92.130 39.830 143.434-133.661 92.503 39.805 129.461 -76.206 92.472 40.957 141.331-147.294 91.737 37.299 137.627-154.930 91.947 42.335 129.441 -86.591 88.366 42.528 138.378 -85.291 90.483 50.168 144.118-103.808 91.838 42.411 136.424-140.468 93.004-114.185 147.661-111.583 119.467 110.392 121.269-128.917 95.455 40.337 111.321 -83.029 92.316 49.385 151.253-126.174 92.147 34.764 143.422-131.256 93.361 40.416 132.374 -94.167 93.356 40.173 131.352 -86.123 93.110 49.714 138.298 -94.565 93.447 32.452 139.089-118.434 94.453 45.173 144.232-134.980 95.663 91.400 0.000 0.000 93.928 41.494 139.578-125.700 93.786 33.900 138.755 -90.809 93.339 42.200 136.534-104.593 92.800 40.908 115.393 -76.444 91.995 53.115 149.958-127.153 93.344 23.346 139.562-101.928 105.408-139.947 110.343 -82.759 116.814-178.031 152.026 -19.015 119.413-118.068 121.789-130.347 93.825 52.693 116.527 -76.428 93.527 40.771 137.827-101.286 91.633 41.444 116.254 -75.838 92.405 39.703 129.366 -76.182 90.747 39.368 142.437-131.989 91.033 43.584 148.550-115.317 91.410 37.244 146.003-110.844 92.829 35.502 129.417 -76.179 93.190 40.510 130.541 -89.893 92.381 39.744 129.346 -76.320 92.585 42.216 137.341 -82.400 92.536 62.398 137.093 -91.689 90.668 56.862 147.087-120.023 90.244 45.902 143.755-128.991 91.688 80.650 142.649-123.493 93.028 0.000 129.353 -76.246 # 34 total E -2.33236E+02 rmsd from N 0.000 %NC 0.00 93.771 98.959 139.778-107.959 93.357 51.149 139.340-100.894 91.406 41.212 143.184-133.136 92.228 41.080 129.411 -76.165 92.567 44.024 141.616-149.679 91.996 33.226 138.293-148.519 92.450 43.498 130.098 -85.320 89.842 40.898 139.139 -86.309 90.960 47.182 145.557-103.825 93.055 49.456 137.175-140.209 93.670 55.887 148.810-117.691 125.469-147.045 119.683-122.802 113.198 -75.068 112.141 -83.626 94.189 56.587 146.255 -37.826 93.689 36.363 143.815-135.505 93.161 59.721 134.494 -92.955 92.929 42.817 132.367 -91.559 92.956 51.715 137.119-104.630 94.195 103.105 139.234-109.548 117.499-162.196 152.807 -18.440 93.796 59.965 0.000 0.000 92.429 44.928 135.875-121.467 92.649 36.626 139.154 -95.391 92.594 42.151 136.098-103.742 91.543 47.292 115.185 -76.328 91.069 54.869 147.513-114.093 94.006 56.777 139.065-103.086 94.449 -93.608 143.854-126.045 112.974 157.459 151.475 -20.345 122.739 161.819 120.276-126.224 95.087 35.228 116.643 -76.553 94.164 39.794 137.677-103.882 91.758 44.727 116.316 -75.959 92.558 40.417 129.145 -76.134 92.033 34.724 142.905-133.695 93.452 38.911 146.240 -38.897 92.871 38.084 144.365 -40.947 92.638 36.602 129.416 -76.302 93.774 44.005 130.689 -87.321 93.699 30.957 129.384 -76.256 93.951 40.837 142.049 -87.044 93.209 37.403 137.148 -89.674 92.091 46.456 145.018 -41.124 91.520 41.949 142.293-133.277 92.448 63.095 142.986-124.017 93.025 0.000 129.414 -76.268 # 35 total E -2.36413E+02 rmsd from N 0.000 %NC 0.00 93.922 124.106 140.116-106.907 93.203 59.608 141.585-109.384 90.503 40.593 142.906-132.489 92.087 42.129 129.385 -76.098 91.776 41.667 137.985-140.608 91.735 36.326 139.585-155.038 91.812 46.071 129.081 -86.844 88.059 66.924 141.422 -86.896 89.060 39.395 145.673-109.676 92.375 47.559 139.668-143.565 93.515 142.938 146.268-104.380 120.722 98.651 120.930-127.539 104.844-107.703 147.328-143.263 93.531 60.890 146.558 -38.004 92.111 39.242 143.320-134.678 92.480 49.744 131.755 -92.370 92.956 69.287 131.886 -88.963 92.695 55.031 137.123 -98.184 91.560 29.375 139.469-109.075 107.635 -70.246 112.234 -84.132 126.246 -87.844 0.000 0.000 127.619-144.953 158.686 167.890 93.321 43.831 138.742 -89.749 93.352 40.011 136.664-105.457 92.135 41.760 115.800 -76.112 91.955 41.025 148.676-115.726 93.634 43.594 141.436-107.821 92.261 49.866 143.000-124.732 93.755 47.311 143.343-123.838 122.504 174.806 121.346-127.683 91.388 56.136 116.064 -76.198 93.148 47.589 137.251-102.427 89.757 45.879 116.268 -75.436 91.963 41.262 129.346 -76.186 88.803 41.629 142.020-131.258 90.686 46.132 144.934 -40.655 90.406 41.787 144.064 -41.943 91.818 37.483 129.288 -76.100 92.123 41.499 129.599 -88.256 92.181 41.848 129.215 -76.153 92.544 37.733 135.613 -67.778 92.927 40.851 137.453 -89.749 91.889 45.781 144.848 -41.352 91.565 42.522 142.469-133.128 92.428 63.306 142.994-124.157 93.024 0.000 129.414 -76.268 # 36 total E -2.39761E+02 rmsd from N 0.000 %NC 0.00 93.630 74.145 138.176-102.234 93.587 50.029 139.402-102.370 92.913 37.302 143.719-134.160 92.454 41.744 129.539 -76.245 92.046 41.363 139.915-147.314 91.640 35.424 138.557-148.729 92.720 40.548 130.409 -92.492 89.160 40.787 141.239 -86.804 90.132 48.061 143.984 -42.923 91.648 51.341 136.963-139.804 92.393 41.118 146.624-107.271 92.861 37.677 101.106-115.149 90.067 49.028 141.072-129.361 91.119 69.130 144.838-115.175 90.074 50.611 140.562-135.109 92.940 42.755 132.675 -91.586 95.467-142.114 132.243 -90.167 96.221 170.501 139.258-106.728 102.634-160.899 143.072-114.928 95.621 52.349 144.677-136.879 95.948 33.590 0.000 0.000 94.059 43.171 136.808-126.697 91.752 39.626 138.865 -93.165 92.383 43.275 136.065-104.008 90.234 41.356 115.105 -76.133 90.747 46.402 149.092-116.885 93.137 39.728 141.214-113.102 91.438 54.300 142.596-123.941 93.512 55.774 143.148-123.683 121.675 154.242 121.379-127.958 92.868 40.150 116.287 -76.325 93.901 40.022 137.469-103.030 91.833 41.205 116.737 -75.927 92.100 41.742 129.443 -76.289 88.521 41.585 141.762-130.929 90.511 45.631 144.799 -41.205 90.740 38.958 143.058 -43.022 92.158 38.336 129.325 -76.124 92.649 42.631 130.000 -87.876 92.641 37.016 129.289 -76.215 93.050 39.000 138.518 -76.617 93.098 39.339 137.251 -90.988 92.003 46.188 144.925 -41.234 91.577 42.138 142.433-133.484 92.451 63.354 143.021-124.171 93.022 0.000 129.413 -76.268 # 37 total E -2.34540E+02 rmsd from N 0.000 %NC 0.00 93.628 74.255 138.133-102.060 93.583 50.799 139.775-102.905 93.000 36.493 143.717-134.222 92.496 41.724 129.488 -76.220 92.397 40.196 140.270-146.406 92.293 37.438 139.231-152.003 92.522 39.968 129.590 -86.536 89.392 41.376 141.071 -88.070 89.608 51.623 147.572-108.948 89.772 49.981 136.898-140.369 90.970 50.376 147.533-109.386 119.377-112.085 121.169-128.864 92.929 110.783 110.995 -83.024 92.794 62.120 150.072-125.585 92.342 39.863 145.087-136.864 92.987 38.467 133.851 -91.996 92.824 53.178 131.336 -85.662 92.911 88.198 134.566 -94.568 91.369 49.516 136.735-118.073 91.922 30.871 143.428-133.122 111.815-102.355 0.000 0.000 129.565-124.936 159.172 172.166 90.949 46.120 141.815 -88.996 92.591 41.870 136.737-105.016 90.413 42.774 115.135 -76.103 90.880 46.912 147.892-117.813 93.325 53.946 138.012 -97.074 92.422 34.824 143.010-124.690 114.727 -98.056 151.989 -20.519 119.127 100.357 121.749-130.198 91.194 44.341 115.549 -76.042 93.102 56.679 135.328 -97.369 92.973 35.945 115.920 -76.374 93.099 35.783 129.416 -76.208 91.154 43.572 142.808-131.453 91.744 43.462 143.559 -43.573 92.258 35.866 144.914 -41.455 92.792 36.911 129.373 -76.153 93.564 43.159 131.767 -87.223 92.735 37.969 129.385 -76.196 93.426 35.559 137.935 -76.446 93.981 37.390 137.109 -91.885 93.321 42.964 145.661 -40.459 92.336 42.392 142.943-137.580 92.425 61.826 142.997-124.148 93.019 0.000 129.409 -76.267 # 38 total E -2.39923E+02 rmsd from N 0.000 %NC 0.00 93.496 71.414 135.153 -90.993 94.068 46.565 139.096-111.819 92.951 37.861 143.624-136.378 92.434 42.034 129.474 -76.215 92.461 42.811 141.413-151.961 90.682 36.403 139.364-148.611 92.066 43.975 129.264 -86.998 88.823 47.919 139.381 -85.720 90.171 36.466 145.042-107.849 94.101 57.471 140.289-141.481 94.401 71.228 147.136 -38.101 120.602-151.799 121.398-128.081 91.296 65.352 142.890-133.580 92.228 141.741 145.296 -41.875 95.701 70.221 145.829-139.500 94.249 27.009 133.306 -91.958 93.622 48.544 138.904 -91.383 92.463 58.952 135.430 -93.077 91.524 52.762 140.843-113.634 91.950 37.207 143.505-134.861 93.882 37.620 0.000 0.000 91.483 48.813 133.237-116.428 90.694 48.901 138.590 -91.590 92.019 38.524 135.690-103.593 89.798 43.212 114.736 -75.906 92.410 47.172 144.177 -41.179 93.444 47.137 140.381-103.166 93.936 38.679 143.768-126.200 95.840 21.682 144.720-127.088 120.553 150.681 122.189-130.044 94.807 35.965 116.597 -76.532 94.058 42.193 137.658-103.542 93.468 37.156 116.261 -76.541 92.550 43.302 129.385 -76.217 90.565 40.046 142.361-132.475 92.536 38.705 145.905 -39.189 92.169 39.963 146.012 -38.464 92.113 37.606 129.323 -76.166 92.392 42.827 129.829 -87.841 92.455 38.072 129.282 -76.219 92.890 38.775 137.651 -72.822 93.053 39.751 137.366 -90.699 91.971 45.898 144.901 -41.257 91.572 42.383 142.474-133.495 92.433 63.235 142.993-124.088 93.023 0.000 129.402 -76.261 # 39 total E -2.35409E+02 rmsd from N 0.000 %NC 0.00 93.672 76.474 138.967-105.259 93.425 49.962 139.508-102.297 93.356 38.001 149.951 -32.353 92.374 42.304 129.485 -76.221 91.994 41.856 140.609-142.676 92.988 35.598 138.492-148.406 93.457 39.517 129.289 -82.641 92.119 38.102 139.512 -86.417 90.656 47.510 149.747-129.984 90.237 39.210 137.977-140.665 92.211 138.924 145.012 -39.773 93.293 73.270 100.476-113.749 96.746 24.078 110.769 -83.199 94.656 45.574 147.240 -38.082 92.500 45.981 144.774-134.356 92.935 45.315 135.635 -90.656 93.482 34.490 130.953 -89.061 94.053 37.256 138.139-103.211 114.293-156.955 139.932-117.864 94.225 44.862 144.134-134.928 132.543-172.058 0.000 0.000 120.336 15.858 158.815-179.851 91.331 47.289 137.804 -89.917 92.461 45.645 136.255-104.541 90.304 42.996 114.956 -76.067 92.958 44.631 145.926 -36.954 93.932 58.194 140.669-116.694 94.997 -58.533 109.592 -83.766 122.288-136.769 113.028 -82.040 120.228 119.403 121.620-129.427 92.881 38.544 116.270 -76.314 93.139 46.575 137.525 -99.228 91.194 39.288 115.699 -76.314 92.220 41.080 129.343 -76.192 88.717 44.886 141.895-130.865 90.041 44.065 147.937-122.717 90.540 42.162 145.216 -38.610 91.518 37.243 129.281 -76.091 91.424 45.354 129.920 -86.843 91.990 41.152 129.047 -76.111 92.197 37.929 137.293 -77.048 92.354 45.832 137.340 -90.477 91.285 43.768 143.519 -43.289 91.831 44.087 143.451-134.651 92.335 62.916 142.964-124.086 93.022 0.000 129.417 -76.270 # 40 total E -2.34530E+02 rmsd from N 0.000 %NC 0.00 93.603 81.506 137.475 -98.695 93.917 49.426 138.669-103.767 94.222 35.815 144.083-134.969 92.621 42.293 129.589 -76.248 92.592 46.294 143.228-153.254 92.457 32.363 140.119-151.729 93.055 46.210 130.733 -82.961 90.654 81.445 140.403 -86.790 90.832 67.781 148.206-111.810 89.151 96.816 138.246-139.255 93.201-145.341 146.102-108.408 92.311 57.977 100.443-112.140 91.692 76.776 110.411 -82.869 92.606 83.221 144.531 -39.297 91.720 39.565 142.518-135.575 93.022 50.352 133.469 -90.396 93.188 69.982 133.065 -93.020 92.717 81.879 135.643 -92.203 92.037 50.085 139.369-114.341 100.851-121.107 146.466-136.885 94.738 154.879 0.000 0.000 124.994 163.403 156.517 177.330 92.874 57.017 142.198 -88.612 93.227 33.377 136.797-105.185 91.597 48.706 116.165 -75.896 91.077 37.222 146.635-122.378 92.949 46.312 142.246-108.318 90.369 48.204 142.068-122.937 91.357 38.226 142.223-122.048 117.638 142.429 121.243-130.247 95.880 33.542 116.770 -76.630 94.353 39.587 137.864-103.815 95.874 31.768 116.404 -76.719 93.176 41.744 129.549 -76.314 92.065 36.838 142.807-133.294 92.169 41.064 145.769 -39.551 91.917 38.699 145.119 -40.813 92.185 38.375 129.373 -76.193 92.513 42.441 129.931 -87.809 92.579 37.240 129.295 -76.224 92.996 39.106 138.507 -76.257 93.072 39.346 137.133 -90.047 92.014 46.247 144.942 -41.197 91.601 42.010 142.445-133.504 92.468 63.403 143.045-124.231 93.020 0.000 129.413 -76.268 # 41 total E -2.42497E+02 rmsd from N 0.000 %NC 0.00 93.585 87.677 136.848 -95.892 93.638 45.129 139.088-101.446 94.845 38.405 144.251-135.583 93.347 34.733 129.527 -76.274 94.380 40.483 142.922-153.071 92.181 36.252 140.532-155.833 92.508 41.136 129.617 -86.623 90.521 38.112 138.446 -86.365 90.313 49.430 148.078-118.723 89.425 47.729 137.821-141.224 92.336 132.847 145.649 -39.412 92.294 82.107 101.045-115.173 90.401 55.536 142.285-132.384 92.128 153.474 145.366 -41.149 96.886 77.027 145.087-142.673 93.970 23.821 132.794 -91.596 93.408 59.162 136.951 -86.426 92.936 73.739 135.117 -97.320 91.437 47.888 135.202 -55.692 90.972 42.651 143.233-133.644 92.838 41.608 0.000 0.000 93.099 41.662 137.935-120.521 93.509 35.060 138.329 -91.040 93.323 39.119 136.263-104.888 93.385 40.121 115.565 -76.430 92.995 38.727 150.271-125.084 94.163 44.214 141.274-107.817 94.106 39.484 143.889-126.409 95.340 143.364 144.354-127.438 94.099 42.010 99.701-113.253 95.582 31.272 116.730 -76.629 93.308 52.476 137.855-105.890 90.310 59.659 114.961 -76.265 92.025 40.099 129.322 -76.167 89.878 37.441 142.522-132.106 91.527 54.798 146.407 -37.559 89.479 44.026 144.287 -43.085 91.140 36.672 129.250 -76.064 91.288 46.383 129.553 -78.880 91.961 42.856 129.190 -76.085 92.196 35.375 138.114 -80.831 92.345 42.848 137.158 -91.349 91.004 47.428 142.909 -44.309 91.339 42.092 141.338-132.097 92.456 64.208 143.034-124.282 93.023 0.000 129.416 -76.270 # 42 total E -2.42450E+02 rmsd from N 0.000 %NC 0.00 93.724 77.529 139.787-109.029 93.327 51.198 138.219-101.937 91.498 41.339 143.145-133.230 92.149 46.965 129.525 -76.070 91.430 38.588 137.087-146.895 91.255 37.904 140.013-151.481 92.257 43.566 128.493 -88.138 90.166 36.842 137.350 -86.220 91.669 44.893 144.799 -42.304 92.591 38.325 136.988-140.670 92.766 137.259 145.712 -40.010 93.630 73.878 100.086-113.278 94.071 26.680 143.522-134.958 94.037 52.643 145.135 -39.375 95.947 117.589 143.121-132.848 94.892 27.177 133.578 -95.958 94.627 45.534 134.101 -87.523 93.797 60.461 135.961-102.061 93.950 52.747 133.465 -58.725 93.755 33.232 144.024-135.252 94.661 45.172 0.000 0.000 94.655 43.230 138.815-128.998 90.686 40.097 142.202 -93.981 91.968 40.749 135.818-103.236 91.132 47.572 115.307 -76.182 90.747 45.804 147.904-108.315 93.493 35.861 140.351-102.102 93.549 45.970 143.623-125.992 95.049 147.655 143.809-124.969 93.423 45.834 99.772-113.191 92.952 41.149 116.305 -76.363 93.161 94.840 137.821-103.881 92.810 76.800 116.525 -76.207 92.618 36.827 129.373 -76.162 90.934 39.607 142.908-132.871 91.115 56.733 145.871 -40.415 90.307 43.135 143.999 -43.582 91.587 36.897 129.285 -76.084 91.702 49.265 129.271 -87.318 92.127 43.800 128.972 -75.984 92.771 39.241 138.497 -86.667 92.977 40.322 136.884 -92.072 92.002 56.832 144.783 -40.570 91.558 50.363 142.162-134.475 91.826 67.415 142.989-124.505 93.029 0.000 129.413 -76.270 # 43 total E -2.36443E+02 rmsd from N 0.000 %NC 0.00 93.623 74.747 138.155-102.137 93.599 49.578 139.453-102.603 92.891 37.668 143.718-134.199 92.489 40.982 129.500 -76.246 92.278 41.241 139.987-146.858 92.463 35.309 138.703-149.203 93.338 36.823 129.998 -88.008 91.383 40.355 138.962 -85.303 91.100 43.936 144.061 -43.017 91.670 52.002 138.360-140.440 93.520 40.643 146.681 -38.883 92.719 37.109 100.935-112.479 91.652 51.141 110.116 -83.001 91.383 46.639 145.175-116.513 90.527 39.776 142.791-132.267 92.512 40.996 132.493 -92.515 92.741 45.082 131.133 -83.537 92.939 63.329 140.343-109.884 92.448 60.829 138.490-113.523 99.923 -74.978 145.251-135.125 93.500 152.191 0.000 0.000 124.274 32.071 156.585 176.669 91.376 41.205 141.099 -92.367 92.786 43.246 136.350-104.994 92.001 54.106 115.385 -76.363 91.737 104.278 148.722-112.095 93.437 48.401 139.773-106.425 91.842 61.300 142.845-124.386 93.208-176.326 143.140-124.092 93.345 61.195 99.902-114.698 93.067 37.500 116.320 -76.365 93.098 46.357 137.820-104.329 90.140 47.974 115.878 -75.995 92.158 38.473 129.322 -76.166 91.477 35.932 142.930-133.140 91.955 42.831 145.554 -40.603 91.676 38.898 144.067 -43.160 92.032 37.313 129.311 -76.126 92.376 44.115 131.026 -91.112 92.730 36.230 129.235 -76.155 93.435 37.067 138.189 -79.087 93.741 37.737 137.026 -91.770 92.714 44.919 145.572 -40.474 91.855 42.247 142.513-135.883 92.359 64.362 142.973-124.138 93.023 0.000 129.394 -76.253 # 44 total E -2.34095E+02 rmsd from N 0.000 %NC 0.00 93.638 81.759 138.215-101.366 93.600 49.971 139.394-103.229 94.189 36.203 150.116 -31.993 92.450 42.808 129.648 -76.289 92.650 43.363 144.237-150.890 92.287 34.520 138.744-150.822 92.178 44.816 128.562 -84.269 88.598 59.249 139.082 -88.035 89.163 69.589 147.346-113.564 88.361 39.569 137.664-137.833 91.271 150.306 148.105-103.591 92.700 58.021 101.179-113.309 93.607 32.369 110.810 -83.052 93.542 42.522 143.996 -40.320 94.927 37.029 141.437-134.972 94.117 48.660 133.526 -99.512 94.442 31.131 131.396 -88.952 94.517 42.436 138.462-102.872 126.165-158.070 137.290-115.771 93.037 14.886 143.731-133.970 123.101-119.998 0.000 0.000 123.668 1.549 158.722 173.786 90.816 57.068 140.938 -89.508 92.324 39.510 135.157-106.676 90.168 46.419 114.991 -76.122 91.268 62.475 147.116 -97.188 93.101 41.934 139.976-106.665 91.763 46.405 142.775-124.283 94.749-179.443 144.062-125.980 93.027 68.925 99.821-114.581 91.222 50.670 116.011 -76.217 92.602 65.818 136.293 -91.819 91.844 37.356 115.591 -76.239 92.973 38.683 129.442 -76.199 95.753 32.011 144.316-135.859 93.443 40.110 151.856-129.895 91.434 38.116 150.688-129.317 92.175 36.696 129.348 -76.152 92.133 43.060 130.186 -79.559 92.268 39.624 129.053 -76.062 92.667 36.856 137.787 -86.557 92.894 43.760 136.896 -94.054 91.054 44.760 145.270-108.175 91.745 43.777 142.955-135.959 92.312 64.596 143.029-123.739 93.017 0.000 129.397 -76.242 # 45 total E -2.36982E+02 rmsd from N 0.000 %NC 0.00 93.568 68.148 137.002 -98.569 93.907 52.355 141.643-113.567 93.858 33.329 111.198 -82.849 92.195 46.003 129.465 -76.191 91.692 45.276 141.049-147.560 91.575 36.455 139.544-150.545 92.144 41.955 129.493 -86.460 89.025 47.874 140.816 -88.512 89.599 45.556 146.677-106.889 92.925 55.083 138.541-136.442 93.541 69.391 149.441-118.321 118.999-157.311 122.692-131.369 94.010 65.433 111.009 -83.007 91.634 70.647 144.939 -41.637 92.993 115.469 142.246-135.768 93.036 49.260 132.584 -94.746 92.738 40.297 131.546 -86.741 92.680 77.277 132.423 -78.277 92.737 48.430 145.874-138.095 93.624 43.967 143.979-134.516 95.969 132.319 0.000 0.000 93.670 43.625 135.902-118.592 92.881 39.574 139.693 -90.597 93.101 38.815 136.310-104.385 92.620 40.895 115.318 -76.191 92.524 48.304 148.311-125.691 93.748 55.551 139.563 -97.675 92.708 -85.364 143.149-124.778 116.634 -95.266 152.318 -19.877 117.247 128.934 123.124-133.156 91.694 46.992 116.099 -76.185 92.891 42.609 137.440-104.001 90.294 40.664 116.246 -75.913 92.503 43.703 129.359 -76.176 90.308 38.331 142.306-131.755 89.721 50.466 150.223-120.667 89.609 42.563 147.150-125.786 91.431 35.974 129.331 -76.100 92.000 41.966 130.592 -84.528 92.237 41.194 129.110 -75.971 92.487 35.798 137.502 -85.215 92.640 43.827 137.002 -93.675 90.729 46.202 144.213-106.807 91.472 43.192 142.160-132.799 92.404 65.213 143.054-124.166 93.019 0.000 129.422 -76.268 # 46 total E -2.35951E+02 rmsd from N 0.000 %NC 0.00 93.765 99.637 139.564-107.129 93.417 50.027 139.232-101.249 91.823 40.224 143.335-133.377 92.269 41.265 129.616 -76.353 91.722 44.840 143.926-154.879 91.520 34.181 138.598-149.370 92.024 47.384 129.155 -88.008 87.679 66.762 139.337 -87.279 88.285 54.165 146.392-115.062 86.107 54.460 138.262-141.317 92.132 156.935 143.038 -42.604 117.058 54.370 122.723-132.331 92.189 39.009 143.205-133.723 93.830 42.932 146.236 -39.114 93.445 44.833 111.253 -81.949 92.817 42.628 132.085 -95.404 93.226 37.703 130.902 -88.465 94.026 123.744 139.699 -98.717 91.457 54.620 146.254 134.679 90.186 42.053 142.977-133.089 92.586 44.268 0.000 0.000 91.986 44.868 139.950-126.477 89.994 39.893 139.156 -92.309 92.105 45.185 135.684-103.123 89.840 47.015 115.657 -75.873 91.476 38.444 149.757-110.303 94.173 39.061 139.242-108.513 95.471 10.924 144.519-127.382 124.332 -98.849 153.409 -18.836 121.079 -68.653 121.221-128.247 91.910 80.358 116.656 -76.229 92.587 50.713 136.738-100.983 88.897 49.226 115.260 -75.690 92.097 44.300 129.098 -75.993 87.470 41.157 141.484-132.660 89.603 48.473 147.701-116.637 91.259 36.870 142.667 -44.344 92.644 36.233 129.490 -76.249 93.232 45.197 131.526 -85.586 92.638 37.388 129.288 -76.220 92.661 41.213 141.144 -83.608 92.436 41.180 133.356 -69.631 90.966 47.881 146.404-115.172 91.485 41.605 142.131-133.123 92.515 65.773 143.178-124.158 93.021 0.000 129.406 -76.261 # 47 total E -2.36638E+02 rmsd from N 0.000 %NC 0.00 93.610 61.283 137.761-102.634 93.635 47.621 138.927-102.506 92.671 41.423 143.636-134.311 92.509 37.844 129.828 -76.652 92.974 44.538 136.100 -25.518 93.674 31.832 137.327-149.125 93.351 44.040 131.895 -83.859 91.609 39.130 140.314 -85.894 92.297 42.158 144.891 -40.508 95.723 52.738 140.029-138.474 94.776 70.633 148.889-121.060 122.107 -34.811 121.531-127.696 94.812-173.593 144.038-136.547 92.756 49.809 149.359-123.239 95.178 32.713 111.358 -83.245 93.349 43.206 134.072 -90.420 92.833 66.572 130.340 -79.217 93.643 36.859 133.897 -95.590 98.006 26.731 140.534-104.187 101.992 30.391 146.681-140.747 98.455 35.226 0.000 0.000 94.778 40.255 137.023-130.124 92.697 37.725 139.651 -92.259 92.788 40.244 136.179-103.966 91.657 43.726 115.737 -76.707 91.599 47.887 148.869-116.239 93.761 81.658 139.630-105.491 93.410 -53.518 143.315-125.422 119.487 -97.051 152.744 -19.495 119.436 98.979 121.675-129.894 90.929 43.736 115.952 -76.103 92.712 82.798 135.732 -99.677 91.067 42.705 115.668 -76.262 92.349 39.101 129.370 -76.155 92.270 37.662 143.130-132.479 91.791 41.461 151.010-119.746 92.661 36.986 145.279 -40.845 92.729 34.764 129.365 -76.170 92.502 46.823 133.533 -95.084 92.179 38.643 128.980 -76.075 92.838 38.153 137.973 -80.013 93.528 37.710 137.091 -91.697 92.622 45.380 145.535 -39.552 91.829 41.928 142.548-135.181 92.430 63.437 143.011-124.189 93.017 0.000 129.407 -76.264 # 48 total E -2.43849E+02 rmsd from N 0.000 %NC 0.00 93.957 132.595 139.656-104.180 93.143 52.791 138.219-101.825 91.591 44.297 143.258-133.291 92.542 37.971 129.412 -76.178 93.020 40.009 141.961-152.702 91.921 37.626 140.810-164.109 91.393 40.745 129.022 -86.840 87.867 42.845 135.422 -86.426 90.488 46.538 140.974 -47.310 92.527 38.799 137.426-141.637 93.080 130.976 146.296 -38.485 93.588 72.619 99.717-111.738 93.477 29.164 143.338-134.587 93.537 56.165 145.793 -39.052 93.877 109.188 143.042-128.946 94.567 37.452 133.387 -96.100 94.389 36.130 133.880 -87.909 93.708 73.713 137.885-106.973 93.306 58.652 135.925 -68.189 94.663 32.458 144.044-135.371 97.453 38.570 0.000 0.000 98.298 32.056 106.456 -82.140 92.687 46.905 145.217 -91.012 92.997 35.142 137.436-101.773 90.696 45.066 116.452 -76.172 89.747 51.038 147.001-112.356 92.703 47.839 140.640 -97.425 90.360 49.163 142.048-123.111 93.260 47.772 143.146-123.447 120.502 178.562 121.651-129.269 93.140 52.193 116.345 -76.342 93.493 41.019 137.386-103.053 90.554 44.956 116.355 -75.990 91.923 43.208 129.349 -76.209 88.152 42.746 141.685-130.757 90.853 44.096 145.108 -40.530 90.746 39.834 144.195 -41.666 91.883 38.550 129.294 -76.103 92.084 43.867 129.796 -87.874 92.333 37.943 129.253 -76.188 92.874 39.020 138.075 -73.587 93.026 39.313 137.323 -90.670 91.987 46.245 144.894 -41.271 91.545 42.087 142.356-133.083 92.452 63.347 143.012-124.242 93.019 0.000 129.418 -76.271 # 49 total E -2.30250E+02 rmsd from N 0.000 %NC 0.00 93.620 78.769 138.165-101.818 93.594 50.207 139.696-103.717 93.142 38.356 149.996 -32.521 92.467 41.359 129.467 -76.264 92.628 41.498 140.920-145.589 94.619 31.973 140.860-150.031 94.699 36.116 132.540 -82.528 93.726 36.227 140.834 -85.671 92.847 41.841 143.805 -42.677 95.425 54.155 138.878-147.196 92.849 58.878 149.122-119.470 120.514 -19.648 121.157-128.239 92.589-172.122 143.387-135.139 94.901 39.082 148.039-123.969 96.295 36.587 145.363-138.511 94.307 38.840 134.479 -91.929 93.944 42.718 136.055 -92.043 93.041 42.720 134.859 -90.171 94.100 29.908 135.418-143.293 95.662 91.836 144.590-135.545 144.005 -38.102 0.000 0.000 121.166-167.900 156.750-178.444 93.776 48.172 141.042 -89.416 93.957 32.309 137.111-105.899 93.929 47.086 116.955 -75.987 92.457 35.219 149.125-123.150 94.067 56.224 142.507-118.428 92.800 -4.379 142.949-124.420 121.085 152.109 152.174 -18.863 121.453 144.895 120.763-127.403 93.065 38.725 116.247 -76.323 93.362 43.281 135.465 -97.263 92.658 40.526 115.959 -75.692 93.020 35.968 129.427 -76.262 97.905 26.003 111.088 -83.157 94.968 40.597 147.124 -36.651 92.254 38.037 145.267 -42.621 92.078 39.329 129.295 -76.140 92.156 42.215 129.758 -87.727 92.358 38.711 129.253 -76.180 92.924 38.435 137.716 -76.469 93.058 39.881 137.241 -90.984 91.978 46.108 144.892 -41.255 91.588 42.211 142.393-133.130 92.454 63.376 143.002-124.179 93.022 0.000 129.411 -76.263 # 50 total E -2.35431E+02 rmsd from N 0.000 %NC 0.00 93.626 71.802 138.157-102.510 93.558 51.848 139.183-101.514 92.986 36.660 143.728-134.215 92.363 43.890 129.609 -76.274 91.097 41.539 138.277-147.567 90.075 41.801 137.989-146.769 91.989 47.489 129.481 -89.797 89.476 36.957 139.218 -84.791 91.891 57.333 144.909 -40.079 93.153 89.600 137.259-142.310 107.398-156.216 151.441 -28.393 92.748 54.653 100.747-112.437 92.291 33.895 142.721-132.472 92.012 68.661 147.274 -38.794 89.529 47.614 139.837-127.606 91.871 41.643 132.190 -91.849 92.226 44.359 130.922 -85.261 92.591 45.704 133.567 -78.765 92.724 47.638 138.852-145.552 92.547 29.482 143.628-133.596 109.399 -65.749 0.000 0.000 126.257-147.510 158.187 173.912 92.998 45.693 141.468 -89.900 93.001 38.956 136.922-105.103 91.640 44.582 115.835 -76.056 91.355 47.164 148.587-118.734 93.464 32.786 140.966-113.136 92.223 60.622 143.139-126.922 93.967 65.170 143.323-123.806 119.746 146.385 122.115-130.185 91.880 44.416 116.120 -76.227 93.145 44.513 137.335-102.258 90.557 41.273 115.990 -75.536 92.585 38.943 129.281 -76.099 91.911 36.079 142.899-133.628 92.332 42.126 145.807 -39.548 91.641 38.166 144.307 -42.562 92.266 38.095 129.421 -76.239 92.726 42.158 130.038 -87.710 92.697 37.080 129.298 -76.206 92.999 38.772 138.028 -71.208 93.112 39.507 137.494 -91.939 92.003 45.946 144.912 -41.247 91.592 42.281 142.481-133.505 92.440 63.217 143.002-124.159 93.020 0.000 129.413 -76.268 # 51 total E -2.46939E+02 rmsd from N 0.000 %NC 0.00 93.603 75.569 137.617 -99.768 93.693 50.748 140.057-106.087 92.984 35.840 143.706-134.165 92.448 42.445 129.468 -76.192 92.751 39.914 140.917-149.621 92.485 37.066 140.173-166.813 92.463 34.527 129.382 -87.307 88.754 50.102 139.305 -86.139 89.442 43.224 141.440 -47.876 92.427 58.198 137.848-142.471 95.059 76.026 147.098 -38.196 120.004-135.830 122.889-130.922 94.810 43.211 143.832-135.767 92.449 44.438 145.118 -38.699 90.480 42.804 141.702-132.864 93.203 49.474 132.976 -99.439 92.760 32.546 131.295 -89.443 93.462 128.173 139.123-114.172 93.722 63.173 139.112 -97.648 92.520 34.472 143.654-134.335 94.323 42.308 0.000 0.000 93.919 41.700 136.713-122.576 93.633 35.196 140.279 -94.102 92.791 39.577 136.313-104.559 91.067 62.925 115.445 -76.616 92.015 44.326 144.523 -41.911 93.723 36.425 138.579 -91.910 94.510 49.424 144.049-126.631 123.495-171.183 152.825 -18.604 92.812 75.265 99.875-114.546 91.485 46.406 116.127 -76.194 92.324 59.334 135.825 -85.010 90.543 38.408 115.406 -76.577 92.212 44.563 129.392 -76.178 88.382 61.022 141.867-130.589 90.082 52.098 147.848-121.086 91.192 37.276 144.829 -40.426 92.504 36.563 129.375 -76.135 92.821 42.705 130.368 -85.790 92.159 41.339 129.524 -76.519 91.633 41.370 139.015 -77.187 91.652 45.478 137.372 -89.820 90.418 48.820 142.997 -43.224 91.033 42.500 142.023-129.941 92.429 65.405 143.001-124.210 93.023 0.000 129.414 -76.271 # 52 total E -2.33018E+02 rmsd from N 0.000 %NC 0.00 93.679 83.001 138.917-104.442 93.476 47.382 138.784-103.763 91.047 43.838 143.100-132.996 92.209 42.339 129.437 -76.243 91.836 43.691 141.329-146.893 92.294 33.057 140.959-144.953 93.749 45.722 131.295 -84.958 94.127 28.693 140.218 -85.474 93.643 47.874 147.397 -37.802 93.133 49.168 139.876-140.936 92.347 52.187 148.510-116.802 119.778 -16.950 120.968-128.288 94.554 62.150 144.343-135.591 92.628 34.291 150.464-125.260 95.395 44.869 143.786-137.520 95.060 1.459 132.481 -94.623 116.336 174.441 154.481 -98.619 94.867 49.380 140.588-112.730 97.169 25.182 141.528-119.309 99.273 49.794 145.863-138.688 98.436 137.121 0.000 0.000 127.931 -85.015 161.155 167.907 91.908 50.939 140.370 -90.644 93.028 36.752 136.470-103.783 91.889 43.124 115.159 -76.164 92.038 86.921 148.880-119.473 93.743 52.896 140.441-108.940 92.487 44.556 143.098-125.001 94.328 38.342 143.829-124.457 121.820 162.116 121.365-128.020 94.272 38.406 116.521 -76.475 94.038 41.052 136.344 -93.006 93.288 38.445 116.727 -76.196 92.492 42.691 129.421 -76.294 90.114 37.435 142.218-131.952 91.551 43.778 145.272 -39.136 91.561 38.922 144.130 -42.538 92.466 36.170 129.306 -76.141 93.252 41.765 130.059 -87.924 93.070 35.954 129.309 -76.246 92.989 39.615 139.285 -72.682 92.882 38.398 137.418 -90.527 91.745 47.778 144.799 -41.426 91.246 41.704 141.895-131.345 92.478 63.881 143.005-124.216 93.022 0.000 129.413 -76.268 # 53 total E -2.42413E+02 rmsd from N 0.000 %NC 0.00 93.857 113.249 140.013-108.288 93.333 51.982 139.450-100.882 90.966 42.338 143.069-132.819 92.221 40.476 129.380 -76.183 92.711 43.744 142.689-144.565 95.090 30.368 139.056-150.041 94.525 36.347 130.837 -87.101 92.344 40.454 139.361 -86.548 90.871 44.803 144.569 -42.627 90.960 49.742 137.753-140.521 93.520 41.479 147.630 -37.601 92.186 43.659 102.811-112.916 89.520 45.679 141.360-130.117 91.940 83.724 145.176 -40.388 90.990 58.397 143.639-128.617 93.263 46.739 133.751 -90.771 94.256 28.508 131.695 -88.434 94.519 146.388 139.611-112.922 94.890 57.925 139.735-112.747 95.839 35.436 144.711-136.888 96.908 36.272 0.000 0.000 94.497 48.789 140.740-129.921 91.412 37.574 138.210 -90.930 92.705 39.888 136.150-104.465 92.686 38.931 115.473 -76.308 92.426 43.403 150.996-122.492 93.357 40.448 139.706 -97.542 91.916 49.786 142.849-124.461 93.873 176.257 143.505-125.095 92.428 69.047 99.897-115.101 90.907 47.820 116.010 -76.132 92.756 44.844 135.117 -89.508 91.377 38.722 115.754 -76.470 92.406 39.449 129.344 -76.175 89.595 42.804 142.102-131.577 91.414 42.859 143.754 -41.198 92.185 35.973 144.950 -41.273 92.448 37.816 129.338 -76.137 92.752 43.758 129.117 -97.890 92.254 41.125 129.379 -76.116 92.684 37.498 138.034 -78.815 93.360 38.504 137.152 -91.981 91.668 49.314 149.017-117.644 90.671 45.317 143.161-136.610 91.309 76.595 142.470-123.266 93.017 0.000 129.310 -76.225 # 54 total E -2.42981E+02 rmsd from N 0.000 %NC 0.00 93.808 107.522 139.723-107.542 93.328 57.165 141.127-104.143 91.305 38.528 143.188-133.055 92.065 43.914 129.538 -76.264 90.531 43.258 139.357-153.944 89.560 40.679 138.299-149.821 91.196 46.838 128.905 -87.733 86.664 58.364 138.340 -82.435 88.494 47.816 145.142-117.264 88.763 54.678 138.524-138.290 91.839 160.543 144.599 -41.413 93.468 75.249 100.676-114.608 95.462 31.023 143.869-135.635 94.339 41.415 145.599 -39.452 94.663 44.531 110.789 -83.959 93.431 43.787 134.024 -89.717 94.420 36.412 131.445 -88.666 95.016 16.974 140.129-104.896 125.318-159.507 143.987-162.944 94.763 57.100 144.335-135.278 116.756-143.386 0.000 0.000 129.827 -4.632 159.019 170.233 92.524 53.101 141.492 -90.821 93.158 33.503 136.459-105.138 91.907 47.094 115.576 -75.599 91.232 41.516 147.556-123.163 93.247 42.822 139.461 -98.750 91.242 61.980 142.503-123.792 92.714 165.281 142.406-122.365 92.925 47.025 99.959-115.068 91.438 41.142 116.067 -76.202 92.827 47.753 139.030-108.222 88.870 47.455 116.182 -75.807 91.993 37.013 129.332 -76.147 88.643 43.180 142.027-131.047 90.088 52.914 145.269 -42.613 88.883 42.609 146.040-109.282 91.768 37.569 129.321 -76.097 92.297 39.768 129.800 -88.937 91.938 45.057 129.388 -76.238 91.725 37.289 137.927 -84.913 91.594 45.578 136.998 -91.960 90.209 52.248 142.775 -44.466 90.390 41.858 141.189-125.212 92.508 66.688 143.066-124.196 93.025 0.000 129.419 -76.274 # 55 total E -2.43718E+02 rmsd from N 0.000 %NC 0.00 93.648 76.374 138.508-103.338 93.542 51.212 139.746-102.292 92.078 38.932 143.420-133.576 92.357 41.850 129.384 -76.156 92.431 41.966 138.044-142.524 92.836 35.217 139.002-151.533 92.749 40.525 129.647 -87.319 91.225 36.929 136.333 -84.481 92.233 46.190 148.980-122.028 94.200 54.364 138.142-143.764 94.229 71.852 146.900 -38.842 121.471-142.919 121.579-128.500 94.153 44.434 143.773-135.461 92.232 45.704 144.583 -39.036 90.468 47.937 142.370-139.754 92.688 45.499 132.894-103.592 92.995 32.542 130.923 -89.506 93.797 129.790 138.463-110.081 93.946 63.637 139.446-100.878 93.374 35.134 143.928-134.728 95.581 40.396 0.000 0.000 94.897 37.687 137.533-125.457 92.525 39.844 140.703 -93.466 92.648 37.917 136.042-104.101 92.175 39.371 115.150 -76.349 91.213 46.441 148.672-120.564 92.880 43.446 137.313 -80.953 91.547 45.802 142.628-124.389 93.255 129.910 143.315-126.798 93.366 86.421 99.584-113.126 92.549 52.244 116.207 -76.326 93.903 161.420 137.576-101.590 92.571 50.081 116.455 -76.060 92.485 38.642 129.391 -76.152 89.121 44.608 142.245-131.085 89.958 43.209 144.434-115.761 88.825 46.850 149.460-127.525 90.975 41.305 129.265 -76.057 90.906 42.032 129.516 -86.397 91.623 41.338 129.159 -76.006 92.434 40.999 137.881 -86.137 92.509 39.211 137.003 -92.420 90.860 50.147 143.595 -41.454 91.401 40.901 139.721-134.179 92.482 65.801 143.031-124.492 93.023 0.000 129.410 -76.267 # 56 total E -2.38736E+02 rmsd from N 0.000 %NC 0.00 93.670 77.753 138.890-104.806 93.373 53.828 139.531-101.540 92.539 36.866 143.544-133.827 92.395 43.352 129.567 -76.212 92.029 38.264 137.878-146.251 90.768 39.176 137.842-147.688 91.702 45.390 129.089-103.060 87.923 44.442 138.812 -83.030 89.823 43.566 145.052-112.510 91.560 59.359 137.941-139.377 93.450 178.742 145.651 -38.706 91.902 74.015 100.707-114.485 90.290 48.653 142.026-130.985 92.073 48.641 144.387 -39.573 91.085 39.815 142.176-136.922 92.518 44.504 133.282 -93.556 92.449 49.692 130.369 -86.157 92.657 87.356 133.374 -86.942 91.706 51.812 136.897-116.936 92.071 30.521 143.481-133.297 113.744 -54.119 0.000 0.000 127.134 169.901 157.503 172.317 92.762 56.599 139.598 -87.934 93.325 37.608 136.822-105.424 92.255 43.371 116.153 -76.009 93.426 37.782 146.971 -37.153 93.841 58.356 140.987 -96.470 92.216 5.774 142.997-125.242 113.907-154.071 151.541 -20.286 119.061 122.257 122.728-131.771 90.963 44.222 115.932 -76.153 92.523 64.768 135.290 -95.949 90.704 47.947 115.342 -75.395 92.691 34.680 129.389 -76.178 92.814 35.614 143.444-134.218 91.761 46.382 146.018 -40.754 90.422 42.169 144.276 -44.343 91.423 37.234 129.266 -76.087 91.818 43.895 129.501 -87.991 92.286 38.823 129.165 -76.080 92.733 39.142 137.976 -75.476 92.847 39.590 137.301 -90.716 91.780 47.288 144.807 -41.416 91.309 41.951 142.155-131.379 92.478 63.856 143.024-124.314 93.022 0.000 129.414 -76.269 # 57 total E -2.45952E+02 rmsd from N 0.000 %NC 0.00 93.574 69.824 137.053 -98.352 93.805 54.169 141.723-111.686 92.746 34.204 143.634-134.021 92.243 44.754 129.451 -76.164 91.905 42.384 139.562-145.133 92.385 36.202 136.623-158.102 92.601 35.563 129.538 -87.121 88.766 49.295 140.255 -86.015 89.960 47.311 141.756 -46.779 93.434 58.108 137.425-143.639 94.095 75.538 148.526-113.273 120.724-139.124 122.674-130.418 94.456 43.761 143.734-135.551 92.304 44.114 144.928 -38.841 90.352 42.844 141.746-133.543 93.073 47.904 132.272-100.083 92.734 33.178 131.152 -89.341 93.360 124.652 139.627-112.975 93.160 64.556 137.934 -95.942 92.177 34.564 143.541-133.945 94.300 42.589 0.000 0.000 93.859 37.114 134.963-121.709 91.975 42.525 140.448 -94.327 91.985 41.220 135.778-103.309 88.728 49.662 114.937 -76.272 91.101 41.591 144.394 -42.151 93.870 55.956 137.283 -88.629 94.858 -38.785 144.143-126.825 123.413-105.567 153.149 -18.548 118.883 121.153 121.898-130.520 92.261 45.447 116.126 -76.268 92.789 78.664 139.344-102.192 91.000 39.576 115.518 -76.543 92.108 44.562 129.395 -76.173 87.525 61.115 141.723-130.158 89.474 49.163 144.479-111.094 91.248 39.267 144.726 -40.683 92.369 36.138 129.357 -76.125 92.766 42.663 130.314 -85.326 92.328 40.151 129.506 -76.484 91.803 42.406 138.958 -75.239 91.748 45.270 137.435 -89.619 90.740 47.283 143.654 -42.579 91.068 43.085 143.342-129.391 92.401 64.700 142.976-124.175 93.023 0.000 129.414 -76.271 # 58 total E -2.31318E+02 rmsd from N 0.000 %NC 0.00 93.657 59.928 138.675-107.136 93.480 54.228 140.238-105.401 92.609 36.744 143.588-133.929 92.385 42.758 129.450 -76.173 91.993 38.063 136.242-133.894 93.930 38.070 138.285-149.311 93.722 37.810 131.029 -84.408 92.258 36.580 141.736 -87.262 92.391 41.894 149.065-122.686 95.130 56.072 139.526-141.523 92.633 70.675 149.103-118.270 119.726-116.691 121.893-129.791 112.822 -82.633 150.197-149.600 93.445 55.993 145.958 -38.823 91.524 38.088 143.142-134.156 92.385 53.633 133.719 -93.327 92.495 43.622 135.104 -93.922 92.177 38.716 137.000 -95.546 91.467 48.539 139.491-107.273 92.645 47.852 149.061 -34.534 92.222 96.870 0.000 0.000 122.240-150.381 155.528-176.352 94.390 44.875 142.192 -92.135 93.905 40.002 137.183-106.057 93.566 61.685 116.327 -76.106 92.172 81.617 148.368-119.257 93.581 56.439 140.617-116.590 93.108 76.541 143.373-125.265 118.833-150.485 152.744 -18.228 123.546 5.306 120.634-126.083 95.447 44.499 116.732 -76.570 93.085 40.576 139.150-101.711 91.419 44.788 115.428 -75.561 92.538 37.914 129.324 -76.175 92.560 33.682 143.049-132.971 92.307 47.179 147.428 -37.971 90.493 40.418 144.361 -42.648 91.440 37.229 129.256 -76.090 91.617 42.589 127.053 -97.088 91.902 44.209 129.196 -76.101 92.322 37.595 136.886 -74.932 92.901 39.105 137.287 -90.481 92.397 42.511 144.522 -41.355 92.665 41.734 142.645-133.844 92.637 61.755 143.056-125.924 93.021 0.000 129.411 -76.266 # 59 total E -2.41048E+02 rmsd from N 0.000 %NC 0.00 93.936 125.133 140.233-107.480 93.239 52.101 139.193 -99.811 90.800 42.387 143.017-132.726 92.173 41.673 129.388 -76.139 91.500 44.183 144.407-149.199 91.979 33.747 137.784-147.544 92.646 43.468 129.078 -89.071 89.218 42.334 138.761 -88.523 90.065 58.589 147.280-112.861 89.786 101.694 135.891-141.184 102.322-134.237 149.669 -34.368 120.443 20.512 121.694-129.005 92.716 55.742 143.384-134.004 91.948 93.492 146.353 -40.296 92.924 56.954 143.633-136.565 92.289 34.674 132.758 -91.108 92.276 60.700 130.651 -85.071 93.264 44.721 129.912 -83.983 96.534 30.629 139.013-103.329 99.405 30.191 145.835-138.941 98.562 35.269 0.000 0.000 96.372 39.567 139.352-130.702 93.771 34.993 138.715 -91.960 93.198 40.008 136.408-105.097 93.189 41.353 115.434 -76.468 92.217 41.317 149.180-121.234 93.796 41.888 139.921-107.587 93.647 47.085 143.663-125.846 123.985 171.118 112.827 -82.422 93.515 50.952 99.922-114.256 92.746 41.507 116.287 -76.347 92.909 76.175 138.922-103.976 91.435 48.363 115.985 -76.035 92.640 36.174 129.378 -76.165 92.223 37.245 143.280-133.819 91.657 46.319 145.671 -40.445 90.700 40.072 143.591 -44.715 91.988 37.252 129.308 -76.115 92.256 43.525 129.598 -87.804 92.287 39.981 129.173 -76.235 92.310 39.661 138.418 -78.213 92.393 42.547 137.266 -90.719 91.341 47.976 144.336 -41.863 90.948 42.678 142.741-130.165 92.397 64.504 142.957-123.976 93.023 0.000 129.414 -76.270 # 60 total E -2.39435E+02 rmsd from N 0.000 %NC 0.00 93.631 75.054 138.173-102.105 93.589 50.108 139.460-102.558 92.985 36.994 143.726-134.178 92.474 41.739 129.560 -76.264 92.301 41.000 140.704-147.396 91.418 36.326 138.523-148.949 92.190 41.783 127.175 -82.281 90.373 41.309 137.699 -86.517 92.372 33.860 148.161-114.303 96.443 41.060 140.256-143.105 93.798 117.561 146.432 -41.249 94.427 80.454 98.942-108.688 97.772 21.890 144.675-137.695 95.566 48.765 148.128 -35.975 91.725 51.436 113.383 -82.579 92.565 42.550 133.222 -88.564 93.508 56.840 130.957 -88.620 94.003 10.769 136.945 -98.545 113.553-152.728 145.599-109.315 94.249 64.945 144.152-135.010 94.588 164.350 0.000 0.000 124.242 28.343 156.925 171.739 90.567 42.574 141.025 -89.007 92.696 39.622 136.350-104.957 91.609 40.509 115.198 -76.057 91.433 52.679 149.827-115.246 93.290 32.395 136.708 -91.197 92.489 60.060 143.112-125.066 93.993 162.527 142.974-124.962 92.722 51.976 99.938-114.880 90.805 46.968 115.979 -76.144 92.586 58.323 139.176-103.951 89.520 41.800 115.322 -75.774 92.166 39.466 129.341 -76.129 90.733 39.714 142.704-132.634 91.622 40.920 145.434 -40.689 90.592 40.577 147.713-114.964 92.262 36.854 129.346 -76.140 92.218 39.623 129.577 -88.145 92.036 42.339 129.317 -76.320 92.173 40.329 137.301 -78.710 91.976 43.579 137.268 -90.420 90.618 54.220 144.308 -42.273 90.137 41.539 140.941-122.741 92.588 67.161 143.094-124.354 93.026 0.000 129.420 -76.272 # 61 total E -2.38980E+02 rmsd from N 0.000 %NC 0.00 93.649 89.459 138.058-100.658 93.645 46.792 139.366-103.256 92.886 39.177 143.673-134.150 92.553 38.635 129.470 -76.251 93.317 44.536 145.950-155.984 93.931 30.782 139.971-150.907 94.037 36.233 130.520 -87.331 91.226 43.133 138.942 -85.330 90.673 47.677 144.045 -44.306 90.936 47.866 137.268-140.404 93.933 38.413 146.188 -38.367 93.332 41.168 101.614-111.637 91.244 45.928 143.591-134.613 92.189 33.427 145.430-115.057 92.462 55.173 141.967-131.466 93.658 99.612 132.046 -95.125 92.944 55.732 132.527 -93.348 93.009 39.557 137.267-101.931 105.087-166.277 140.784-105.973 94.534 85.024 144.975-137.249 93.091 44.928 0.000 0.000 91.221 51.854 135.284-121.832 91.545 43.853 138.357 -89.916 92.399 39.902 135.980-104.007 90.274 44.365 114.943 -76.090 92.758 55.744 145.497 -39.635 93.231 52.871 140.053-105.882 92.175 25.017 142.892-124.399 120.619-162.998 152.499 -18.662 93.008 70.640 99.845-113.903 90.765 70.633 116.020 -76.151 92.670 89.966 134.150 -93.110 91.817 48.863 116.415 -76.239 92.386 38.568 129.346 -76.143 89.762 44.060 142.448-131.733 90.172 52.621 151.155-127.448 90.871 37.295 144.465 -40.916 92.189 35.701 129.357 -76.130 92.732 44.982 130.514 -84.891 92.498 38.759 129.220 -76.192 92.871 36.017 138.522 -78.966 93.191 39.976 137.146 -91.833 92.159 44.476 144.080 -42.282 91.977 42.449 142.152-136.260 92.406 62.691 142.997-124.163 93.021 0.000 129.412 -76.267 # 62 total E -2.30989E+02 rmsd from N 0.000 %NC 0.00 93.690 86.665 138.955-104.498 93.448 50.569 139.503-101.727 92.234 39.163 143.471-133.623 92.428 40.946 129.390 -76.133 92.327 42.490 139.701-152.333 91.150 36.173 138.865-153.751 91.517 48.653 128.757 -86.021 87.231 63.805 140.857 -87.417 88.301 42.419 144.115-107.663 92.088 54.700 139.605-141.071 92.684 43.849 148.338-109.088 93.146 40.478 101.160-113.927 93.901 77.207 110.200 -83.453 92.964 -81.796 148.477-124.529 112.124 66.545 149.925-148.889 123.906-161.082 155.314-110.415 94.601 64.951 134.949 -89.765 93.856 130.038 137.790-103.395 118.408 6.459 138.969-129.959 132.634 -99.027 113.667 -84.125 93.318 61.450 0.000 0.000 90.765 52.506 134.619-121.356 92.042 36.818 138.176 -91.599 93.232 41.504 136.227-104.237 92.845 37.319 115.509 -76.336 91.900 56.612 151.037-124.828 93.154 59.480 137.947 -90.785 91.841 20.177 142.700-124.228 116.329-105.077 152.106 -20.067 119.262 108.443 121.749-130.115 91.806 51.259 116.102 -76.132 92.589 57.125 131.814 -65.472 93.275 32.444 115.977 -76.446 93.591 35.292 129.444 -76.224 94.254 37.072 143.746-134.685 91.834 43.086 146.000 -41.524 91.019 38.979 144.376 -42.184 92.022 37.464 129.302 -76.124 92.273 44.893 132.898 -83.513 92.311 38.390 129.251 -76.156 92.993 35.499 137.866 -79.239 93.223 41.217 137.063 -91.629 91.891 44.646 144.089 -42.775 91.811 42.681 142.438-134.903 92.402 62.853 143.007-124.125 93.021 0.000 129.413 -76.269 # 63 total E -2.35385E+02 rmsd from N 0.000 %NC 0.00 93.662 89.716 138.100-101.263 93.621 46.990 138.918-102.266 93.071 39.505 143.714-134.288 92.628 38.607 129.498 -76.246 92.940 44.482 144.414-155.111 92.307 33.568 137.159-153.397 92.162 43.823 129.391 -87.385 87.693 49.462 136.918 -86.858 89.477 45.687 139.381 -92.309 91.349 51.558 139.758-141.905 93.123 55.272 147.131 -39.202 120.876 -14.786 121.088-127.464 94.376-176.683 142.921-133.091 93.333 44.236 148.626-123.243 93.887 34.754 143.829-135.457 93.306 49.743 134.379 -84.221 93.370 36.582 126.339 -88.808 93.472 45.934 137.043-109.040 93.947 30.015 139.257-111.568 110.121-118.588 149.424-145.721 112.451-159.251 0.000 0.000 124.305 84.936 157.642 177.466 92.648 44.168 141.561 -89.188 93.350 33.651 136.986-106.006 91.937 48.742 116.493 -76.281 92.030 34.268 144.474 -42.501 94.538 44.698 138.397-100.849 96.022 8.620 144.795-127.954 125.659 146.185 152.982 -17.935 121.278 152.011 120.925-127.638 94.586 32.845 116.544 -76.523 93.517 44.248 137.298-102.828 90.620 82.385 116.347 -75.831 92.125 44.695 129.367 -76.201 89.650 35.825 142.447-132.113 92.030 42.759 143.626 -41.060 92.770 34.204 144.108 -44.833 93.181 40.051 129.399 -76.195 93.739 37.806 130.329 -87.508 92.764 39.719 129.708 -76.500 92.785 37.960 137.814 -71.766 92.947 40.190 137.378 -90.345 91.864 46.383 144.876 -41.326 91.461 42.425 142.370-132.273 92.414 63.474 143.002-124.214 93.022 0.000 129.406 -76.256 # 64 total E -2.43550E+02 rmsd from N 0.000 %NC 0.00 93.904 129.175 139.241-102.907 93.217 45.361 138.088 -98.797 91.909 46.639 143.331-133.559 92.817 34.581 129.415 -76.217 94.302 42.083 146.947-169.859 91.639 34.855 141.771-156.176 92.460 44.233 129.573 -87.184 89.312 41.405 138.349 -86.440 89.341 54.334 146.189-109.351 87.564 52.041 135.178-141.603 92.340 131.949 144.944 -40.388 92.552 76.960 100.977-114.781 92.407 46.511 142.982-133.774 94.028 175.895 146.620 -37.299 94.066 79.351 144.137-139.129 93.551 41.557 131.437 -91.333 92.929 49.350 134.870 -82.205 93.005 53.074 140.541-108.183 91.426 41.129 133.111 -44.409 91.813 43.965 143.566-134.902 92.183 43.016 0.000 0.000 90.919 47.791 136.848-125.768 90.402 37.516 138.483 -92.513 92.567 42.427 135.882-103.530 90.531 45.170 115.745 -76.186 91.233 45.669 150.794-121.903 93.795 47.856 139.587-109.007 94.238 -5.594 143.878-126.209 116.659 169.962 151.886 -19.593 94.124 66.873 99.774-114.398 97.606 19.226 117.043 -76.820 94.683 48.235 138.507-105.108 92.267 41.587 115.789 -77.155 91.843 45.686 129.344 -76.239 86.867 45.642 141.385-129.925 90.804 46.796 144.777 -39.436 90.440 40.975 145.538 -39.759 91.599 37.530 129.273 -76.083 91.770 44.409 129.460 -87.493 91.934 42.434 129.299 -76.211 91.970 38.045 138.285 -78.326 91.960 44.289 137.256 -90.241 90.717 50.844 143.671 -43.495 90.487 41.948 141.732-125.099 92.529 65.804 143.063-124.340 93.024 0.000 129.418 -76.272 # 65 total E -2.35316E+02 rmsd from N 0.000 %NC 0.00 93.628 75.111 138.140-101.962 93.590 50.694 139.773-102.307 92.817 36.957 143.661-134.115 92.472 41.759 129.487 -76.231 92.242 41.070 140.192-147.324 92.136 37.006 140.659-152.671 92.232 40.650 129.401 -87.289 90.501 39.415 138.593 -86.410 90.559 45.914 146.077-107.281 91.926 48.547 137.940-139.891 94.169 37.404 146.629 -38.819 93.774 36.195 100.576-109.544 94.515 43.269 109.984 -83.172 93.083 36.924 146.984-118.952 93.797 40.182 144.696-137.709 93.608 36.559 132.601 -93.606 93.287 40.392 132.782 -92.025 92.816 50.695 138.548 -99.773 91.628 52.107 140.267-126.707 91.164 28.901 143.179-132.605 104.099 -77.071 0.000 0.000 125.864-158.136 157.829 173.926 92.560 48.380 142.102 -90.537 93.018 34.951 136.800-104.728 90.923 47.551 115.879 -75.978 91.774 45.486 145.103 -40.494 92.922 45.310 140.043-103.666 90.875 57.071 142.331-123.376 92.720-169.530 142.821-123.474 93.156 76.877 99.851-114.706 92.778 39.105 116.276 -76.321 93.195 44.251 137.770-106.729 90.109 43.981 115.604 -76.086 92.100 41.400 129.311 -76.134 89.860 38.965 142.300-131.920 91.388 42.139 144.406 -41.507 90.670 40.399 146.139-115.173 92.359 39.543 129.355 -76.151 93.221 36.769 130.127 -88.614 92.682 39.007 129.399 -76.243 93.380 38.050 137.734 -84.833 93.264 42.016 137.413 -93.679 92.102 39.511 144.835 -41.302 92.556 56.446 144.314-135.992 91.859 54.019 142.721-124.316 93.017 0.000 129.468 -76.265 # 66 total E -2.42248E+02 rmsd from N 0.000 %NC 0.00 93.549 72.140 136.507 -95.868 93.936 48.725 139.842-106.682 94.840 34.422 144.279-135.501 92.930 39.675 129.504 -76.223 93.064 42.098 139.948-144.872 91.957 36.757 137.738-158.964 91.899 43.554 129.105 -87.494 87.919 58.999 139.966 -86.244 89.446 40.244 143.004 -98.861 92.836 55.483 140.644-144.292 95.013 67.725 147.164 -38.255 123.623-133.488 120.708-125.410 91.520 73.132 142.959-133.644 91.118 130.440 144.565 -43.375 96.104 66.916 142.431-141.768 93.523 30.438 133.135 -91.444 93.255 47.685 134.882 -87.943 93.034 48.414 135.202 -89.946 93.505 37.274 142.515-120.608 94.464 36.649 144.239-135.703 96.852 33.633 0.000 0.000 94.597 44.908 140.774-128.220 91.867 33.714 139.564 -94.833 92.827 44.424 136.154-104.475 92.007 50.889 116.039 -76.222 90.638 44.899 146.069-100.127 93.944 47.950 140.151-116.944 94.422 -72.421 143.975-126.291 120.134 -97.822 152.797 -19.286 119.395 109.141 122.390-130.968 91.909 46.741 116.111 -76.228 92.671 58.922 136.128 -95.301 90.707 43.546 115.749 -76.600 92.086 39.906 129.369 -76.186 87.835 50.746 141.753-130.245 89.092 59.353 146.164-121.441 89.972 44.240 143.262 -41.929 91.644 38.724 129.310 -76.089 92.269 43.040 130.121 -87.597 92.308 40.394 129.362 -76.231 92.055 40.008 138.981 -77.758 91.999 43.481 137.301 -90.294 90.759 49.489 143.736 -42.850 90.786 42.177 142.136-127.662 92.470 65.322 143.032-124.262 93.024 0.000 129.416 -76.271 # 67 total E -2.28998E+02 rmsd from N 0.000 %NC 0.00 93.611 61.670 137.771-102.611 93.639 47.141 138.811-103.266 92.733 41.151 143.687-134.366 92.466 38.517 129.800 -76.620 92.875 43.561 137.890 -24.864 92.982 33.171 137.122-145.240 93.229 43.314 131.072 -84.866 91.876 34.670 139.774 -86.077 92.368 47.244 144.583 -39.475 93.564 41.693 138.006-140.501 93.382 36.296 148.089-117.422 119.835 1.914 121.908-129.655 97.851 47.276 111.057 -83.891 93.620 34.020 149.123-118.085 94.372 39.690 143.863-138.610 93.645 37.429 132.458 -93.151 93.532 38.972 131.064 -86.030 93.135 53.637 139.971-103.819 91.576 54.755 142.214-141.484 90.855 24.277 143.046-132.323 104.622 -80.515 0.000 0.000 126.054-142.391 158.196 174.664 92.112 45.274 142.678 -91.506 92.725 40.399 136.770-104.680 91.312 46.572 115.830 -75.976 90.945 45.050 146.726-112.148 93.534 35.221 139.680-108.081 95.429 62.448 150.082 -23.448 93.210 -51.394 143.065-123.094 119.776 -84.580 121.343-129.364 115.503 164.295 120.089 -78.704 93.233 53.461 137.966-103.104 91.781 41.893 115.835 -76.196 92.414 43.710 129.404 -76.180 91.104 38.279 142.666-133.062 91.905 40.320 145.545 -40.590 90.879 43.102 145.111 -41.644 91.669 40.111 129.272 -76.120 91.328 41.360 130.072 -86.096 91.789 44.287 129.269 -76.145 92.339 36.455 135.863 -73.218 92.569 43.156 137.367 -90.592 90.766 47.315 146.011-113.699 91.222 42.794 141.917-130.708 92.409 65.805 142.979-124.232 93.015 0.000 129.393 -76.253 # 68 total E -2.43328E+02 rmsd from N 0.000 %NC 0.00 93.645 72.425 138.495-103.843 93.556 53.326 139.685-102.131 92.620 37.130 143.598-133.970 92.386 43.061 129.478 -76.212 91.730 40.185 136.568-142.628 91.577 37.844 138.172-149.414 92.757 42.180 129.698 -86.774 91.998 33.388 137.263 -82.310 92.957 44.464 148.730-130.344 93.275 53.824 138.156-142.948 93.471 66.781 146.876 -38.927 120.450-108.506 121.124-128.086 94.100 143.910 143.839-135.561 109.329-123.406 154.187-132.951 114.917 -92.084 150.908-151.182 93.654 56.137 133.976 -90.470 92.922 44.976 133.286 -87.588 92.567 48.908 136.178 -97.233 92.350 44.522 141.269-110.355 91.768 41.676 143.652-135.514 91.331 44.382 0.000 0.000 91.143 56.357 136.679-122.934 91.504 37.538 139.633 -91.732 93.217 33.930 136.386-105.083 92.593 44.030 115.264 -76.118 91.939 50.247 145.713 -42.232 92.653 44.984 140.657-100.583 90.657 42.086 142.184-123.293 93.373 153.387 143.188-124.043 93.420 62.519 99.660-113.558 92.081 40.613 116.187 -76.284 93.585 128.225 135.988 -93.688 93.706 37.174 116.581 -76.397 92.757 43.908 129.422 -76.203 91.235 40.789 142.969-133.077 91.589 43.417 146.201 -39.165 91.146 41.066 145.152 -39.844 92.075 36.622 129.300 -76.119 92.107 41.763 129.495 -88.143 92.005 43.832 129.340 -76.342 92.303 38.570 135.841 -69.994 92.608 40.272 137.470 -89.537 91.724 46.510 144.768 -41.458 91.370 42.093 142.269-130.472 92.515 63.569 142.975-124.780 93.022 0.000 129.413 -76.268 # 69 total E -2.39567E+02 rmsd from N 0.000 %NC 0.00 93.668 84.377 138.782-103.854 93.598 56.021 142.736-111.934 91.660 35.974 143.317-133.325 91.934 46.098 129.432 -76.167 90.906 46.432 140.962-151.669 89.754 38.218 140.144-152.482 91.495 41.423 129.142 -86.802 87.566 51.758 139.799 -85.912 89.479 43.038 143.796-108.345 93.868 54.588 139.004-138.088 94.070 71.787 149.544-118.488 120.358-147.261 122.253-129.858 93.572 60.604 111.136 -82.983 92.023 45.845 144.710 -41.772 92.474 85.758 144.466-135.431 93.304 41.739 133.408 -94.073 92.977 38.013 132.932 -88.143 93.126 90.585 137.950-106.055 92.343 56.511 138.780-128.074 90.229 40.466 142.992-133.017 91.590 49.425 0.000 0.000 91.749 43.118 134.949-117.387 92.353 38.964 139.086 -90.749 92.868 38.997 136.151-104.407 92.846 43.988 115.422 -76.663 91.730 38.666 148.162-116.922 94.193 79.373 139.119-103.239 94.696 -64.745 143.939-126.441 118.361 -86.311 152.891 -19.955 120.297 101.183 121.489-129.106 92.348 36.912 116.195 -76.273 92.867 78.091 136.288 -95.509 91.591 49.430 116.062 -76.086 92.411 36.525 129.385 -76.160 90.387 42.089 142.683-132.145 90.325 49.869 148.821-126.660 89.211 40.636 147.590-122.528 91.409 42.028 129.327 -76.099 91.366 58.362 131.550 -85.762 91.698 46.145 129.347 -76.222 91.984 37.061 137.824 -74.390 92.053 46.151 137.274 -88.298 90.692 59.938 144.317 -42.840 89.581 46.411 141.600-126.210 91.784 79.872 142.723-123.833 93.027 0.000 129.360 -76.226 # 70 total E -2.41442E+02 rmsd from N 0.000 %NC 0.00 93.755 96.699 139.600-107.313 93.328 50.472 139.335-100.957 91.481 41.012 143.236-133.181 92.271 40.951 129.462 -76.207 92.291 43.191 142.556-148.728 92.244 34.090 138.177-147.596 92.683 43.868 129.196 -85.605 90.468 40.261 138.599 -87.565 89.921 54.087 148.318-122.436 90.292 107.793 136.023-140.559 93.847-135.707 146.827 -39.912 121.846 19.996 121.322-127.710 93.861 55.074 143.741-134.781 93.007 104.323 147.371 -37.210 92.833 54.863 144.453-140.036 92.449 32.982 132.856 -90.953 92.426 65.206 132.478 -84.330 92.849 52.152 128.768 -76.277 95.516 30.280 138.231-103.719 98.849 32.809 145.649-138.662 98.595 33.406 0.000 0.000 95.662 43.703 139.627-130.734 91.577 37.104 138.747 -92.229 92.304 42.737 136.043-104.065 90.585 48.994 115.458 -75.952 92.098 47.250 146.015 -37.361 93.701 48.487 140.302-116.268 94.287 -64.782 143.914-126.189 120.577-108.403 152.684 -19.031 119.793 108.798 122.120-130.357 92.452 46.418 116.206 -76.273 93.054 47.154 136.297 -98.657 91.139 42.384 116.175 -76.036 92.560 38.523 129.346 -76.172 91.383 37.334 142.829-132.962 91.309 49.296 146.361 -39.872 90.601 41.269 143.308 -42.777 91.863 36.345 129.306 -76.108 92.371 44.300 129.637 -87.666 92.636 37.891 129.113 -76.106 92.736 39.615 139.058 -77.811 92.769 38.756 137.241 -90.979 91.793 47.811 144.781 -41.425 91.254 41.581 142.138-130.443 92.526 63.998 143.047-124.590 93.022 0.000 129.413 -76.268 # 71 total E -2.41217E+02 rmsd from N 0.000 %NC 0.00 93.620 82.340 137.786 -99.832 93.542 47.668 140.853-105.704 92.678 37.913 143.611-134.256 92.585 38.806 129.738 -76.583 92.917 40.873 134.482 -28.407 93.560 34.007 139.792-148.721 93.809 41.384 130.326 -86.592 93.569 34.094 139.072 -84.446 93.608 46.360 146.705 -39.361 93.626 94.203 138.286-144.948 106.209-160.185 151.607 -29.434 93.274 54.728 100.699-112.593 94.236 33.832 143.415-134.122 93.771 93.185 147.607 -36.839 92.200 55.448 144.820-142.565 92.330 36.556 132.677 -90.923 92.852 78.809 130.689 -80.113 93.374 75.196 135.042 -99.799 92.840 88.565 140.225-131.800 110.962 -54.495 149.517-146.646 94.920 73.716 0.000 0.000 95.339 33.540 106.432 -82.599 92.364 47.245 142.356 -87.718 93.228 34.498 136.281-104.515 91.882 46.188 116.472 -76.229 91.062 42.012 149.020-118.531 93.065 42.102 142.622-108.678 91.054 52.436 142.404-123.615 93.669 57.901 143.296-125.156 120.419 160.736 122.261-129.932 91.705 48.710 116.102 -76.215 93.245 41.442 137.335-102.543 90.528 43.926 116.383 -75.469 92.301 38.815 129.277 -76.130 90.273 39.286 142.385-132.277 91.689 41.699 144.870 -40.793 91.559 39.411 145.058 -42.106 92.098 37.876 129.313 -76.132 92.450 42.480 129.847 -87.875 92.460 38.261 129.274 -76.213 92.898 38.666 137.633 -73.586 93.059 39.790 137.320 -90.671 91.983 45.970 144.914 -41.248 91.591 42.283 142.475-133.515 92.441 63.293 143.013-124.155 93.022 0.000 129.413 -76.268 # 72 total E -2.38681E+02 rmsd from N 0.000 %NC 0.00 94.143 141.857 140.614-108.417 93.270 68.233 139.494-100.649 91.655 41.151 143.298-133.499 92.238 42.079 129.751 -76.530 91.810 37.689 135.749 -29.172 92.211 39.640 138.846-148.773 92.842 46.324 129.434 -86.758 90.707 34.856 139.251 -84.407 91.947 51.845 148.820-122.273 92.573 91.041 137.732-141.671 106.089-159.127 151.392 -29.785 92.985 55.686 100.658-112.384 92.531 33.471 142.886-132.781 92.425 70.831 146.871 -38.333 89.862 46.161 140.601-130.852 92.206 43.067 133.128 -92.147 92.675 45.741 131.265 -87.256 92.817 106.592 134.181 -78.161 92.881 71.036 138.912-108.036 112.513 -34.058 152.362 -23.969 95.563 70.974 0.000 0.000 95.079 31.905 136.061-124.400 93.246 41.777 140.526 -92.881 92.666 38.010 136.066-103.860 92.657 43.221 115.352 -76.467 92.189 35.674 148.675-116.080 94.358 51.371 138.267 -95.707 94.430 16.990 143.956-126.501 122.804-176.140 152.966 -17.212 92.733 65.458 100.012-115.017 91.766 43.009 116.151 -76.274 92.445 80.831 137.704 -96.567 90.711 60.952 115.896 -76.262 92.390 34.612 129.380 -76.164 90.211 46.002 142.705-132.193 91.423 68.420 146.266 -40.075 89.162 47.712 147.727-114.478 91.335 36.837 129.310 -76.069 91.835 43.118 129.542 -87.164 92.154 40.140 129.079 -76.010 92.727 38.450 137.137 -80.908 92.744 41.111 137.123 -91.603 91.532 47.633 144.494 -41.802 91.223 41.914 142.073-130.628 92.504 64.408 143.045-124.516 93.028 0.000 129.405 -76.264 # 73 total E -2.27525E+02 rmsd from N 0.000 %NC 0.00 93.866 -33.207 134.380 -93.592 124.817 -97.264 149.342 -96.478 92.063 44.523 111.137 -82.836 92.068 50.524 129.445 -76.192 91.332 42.866 140.042-146.115 91.790 35.865 141.354-151.802 92.308 41.924 129.269 -84.708 90.173 39.526 138.449 -85.599 90.499 49.557 146.519-111.816 90.854 48.338 136.866-140.268 92.608 54.561 147.398 -38.989 118.928 25.920 121.277-129.046 91.883 104.162 142.867-133.504 92.787-168.390 146.478-127.134 95.535 47.564 144.274-136.934 93.856 33.579 133.500 -90.646 93.431 67.971 139.584 -88.118 93.230 40.599 135.317 -97.989 92.788 37.641 137.637 -59.146 93.574 41.652 144.018-135.190 94.485 37.249 0.000 0.000 94.178 37.661 135.864-126.438 94.043 33.523 137.585 -91.280 93.111 41.741 136.380-104.882 91.775 41.615 115.496 -76.041 93.652 35.655 146.594 -38.456 94.696 37.993 139.362-107.977 96.002 39.018 144.818-127.955 123.298-166.866 153.174 -17.860 121.272 2.629 121.100-128.119 94.550 55.237 116.565 -76.473 93.366 32.915 138.330-106.128 89.944 51.513 115.964 -76.127 91.344 46.495 129.270 -76.167 87.499 43.635 110.687 -82.882 90.638 41.764 144.399 -40.083 90.996 40.034 144.617 -41.573 91.765 38.168 129.290 -76.105 91.595 46.479 129.973 -77.955 92.509 36.653 128.960 -76.013 93.613 34.857 137.906 -82.586 93.859 39.646 136.935 -93.143 92.653 42.156 144.310 -42.291 92.650 42.902 142.033-140.233 92.387 61.547 142.982-124.183 93.022 0.000 129.414 -76.266 # 74 total E -2.28500E+02 rmsd from N 0.000 %NC 0.00 93.610 70.110 137.860-101.194 93.576 49.505 139.527-104.581 92.517 37.033 143.553-133.915 92.412 41.484 129.477 -76.220 92.034 42.336 140.034-146.216 91.383 36.528 138.211-154.224 91.583 44.132 128.991 -87.462 87.304 53.190 139.236 -86.755 89.194 40.914 142.801 -96.399 92.048 55.935 139.859-142.293 93.468 64.765 146.853 -38.969 119.659 -71.370 120.904-128.096 91.760 168.613 143.045-133.365 111.298 147.630 153.728 -26.451 112.049 -78.039 149.750-148.649 93.905 59.447 135.314 -88.878 93.180 39.672 133.355 -87.830 92.593 55.717 136.765-100.022 91.156 55.784 137.568 -49.318 90.706 37.976 142.554-132.356 90.852 46.827 0.000 0.000 90.752 47.735 132.249-119.144 90.887 42.460 137.744 -89.777 92.557 39.643 136.548-108.800 90.664 45.068 115.085 -76.133 92.705 85.309 145.358 -39.567 93.209 48.947 139.359-100.019 92.020 66.486 109.682 -83.825 93.379 32.930 143.422-121.425 122.561-127.964 120.622-126.320 91.034 110.575 116.078 -76.202 93.847 150.197 134.659 -92.618 91.616 52.562 116.167 -75.972 92.719 41.948 129.414 -76.187 93.835 33.962 149.677 -32.128 90.958 44.308 148.862-124.769 90.474 43.848 144.219 -42.951 91.499 41.198 129.284 -76.118 91.593 41.402 130.251 -83.409 92.270 39.534 129.316 -76.181 92.585 38.929 137.729 -75.148 92.560 41.210 137.308 -90.401 91.270 48.224 144.422 -41.847 91.084 42.089 141.975-130.509 92.444 64.878 143.013-124.157 93.026 0.000 129.400 -76.266 # 75 total E -2.31603E+02 rmsd from N 0.000 %NC 0.00 93.597 62.584 137.652-102.443 93.620 50.411 139.522-103.393 93.130 37.647 143.823-134.013 92.508 40.025 129.867 -76.591 93.162 41.351 137.494 -25.321 91.995 35.863 138.922-149.749 92.596 42.673 130.243 -98.623 88.719 42.264 138.390 -85.699 90.959 57.714 143.269 -42.438 90.349 101.420 136.386-141.488 103.105-145.595 149.244 -32.155 92.243 53.083 100.161-112.410 91.815 41.604 141.965-131.557 92.822 68.259 146.391 -36.735 91.766 32.246 141.074-133.865 93.066 49.342 133.275 -91.205 93.421 94.233 130.728 -99.468 93.139 77.697 137.521-100.573 91.810 46.001 140.007-111.626 100.864 -85.662 146.253-139.499 124.801 130.953 0.000 0.000 93.663 51.672 138.726-125.596 92.200 37.794 138.895 -91.516 93.016 40.802 136.348-104.871 91.655 42.260 115.212 -76.232 91.700 48.138 147.696-117.433 93.532 66.371 138.363 -97.083 94.195 -6.074 109.434 -83.628 118.403-131.523 152.194 -19.380 120.526 108.425 121.298-128.814 92.609 35.217 116.195 -76.290 93.065 53.852 138.180-107.654 89.725 45.129 116.266 -75.790 92.071 37.347 129.322 -76.152 88.883 41.669 142.159-131.257 90.520 53.246 144.958 -40.863 89.262 43.035 144.568 -43.259 91.205 37.550 129.246 -76.068 91.082 47.348 129.158 -86.500 91.488 49.568 129.145 -76.028 91.566 39.027 137.757 -83.176 91.990 43.938 137.144 -90.673 90.967 47.957 143.166 -42.194 91.370 42.231 141.811-132.894 92.412 64.976 143.051-124.093 93.033 0.000 129.399 -76.257 # 76 total E -2.35665E+02 rmsd from N 0.000 %NC 0.00 93.784 104.007 139.583-107.165 93.286 52.836 139.250-100.725 91.654 40.640 143.294-133.283 92.302 41.118 129.533 -76.233 92.033 42.021 141.303-150.829 91.389 35.102 137.986-147.282 92.291 45.672 129.351 -92.959 88.983 40.892 138.670 -86.275 89.621 62.193 146.045-116.089 89.950 72.881 136.550-141.627 91.328 133.100 144.561 -96.151 93.774 13.186 100.484-112.677 98.678 75.816 144.917-137.687 94.634 8.706 150.377-118.890 98.402 160.175 145.731-139.282 94.298 44.758 133.957 -92.942 94.068 40.097 133.728 -87.669 92.989 84.763 134.790 -88.635 94.714 53.824 136.483-129.233 95.972 20.019 144.712-136.466 97.520 44.291 0.000 0.000 95.958 29.348 130.943 -38.028 95.458 40.612 141.645 -91.372 93.450 37.823 136.707-105.125 93.016 40.850 115.687 -76.333 92.794 66.582 152.486-130.803 93.222 60.706 140.753-100.224 91.896 -12.845 142.729-124.504 117.257-158.619 151.927 -19.592 120.733 126.233 121.588-129.056 92.240 45.507 116.150 -76.284 93.013 83.042 135.366 -93.305 92.627 45.507 116.122 -75.984 93.218 35.530 129.437 -76.204 95.159 32.138 144.200-135.876 92.362 47.602 146.499 -39.447 91.119 40.020 142.798 -44.265 92.130 37.627 129.326 -76.136 93.115 41.123 129.926 -87.999 92.991 37.152 129.434 -76.249 92.966 39.350 138.976 -72.949 93.027 38.287 137.350 -90.462 92.153 45.621 144.948 -41.131 91.920 41.225 142.435-132.264 92.609 63.148 143.161-125.164 93.021 0.000 129.412 -76.267 # 77 total E -2.32037E+02 rmsd from N 0.000 %NC 0.00 93.791 101.388 139.894-108.682 93.307 52.777 139.378-100.128 91.033 41.532 143.098-132.884 92.167 42.493 129.463 -76.235 91.438 42.209 140.930-139.822 92.785 34.378 137.879-148.140 93.565 41.010 130.951 -84.531 92.348 35.201 140.758 -86.014 91.776 45.801 149.420-121.924 92.560 49.223 138.531-140.955 92.983 36.810 149.345-119.866 94.068 49.834 101.059-110.390 93.379 87.435 141.719-132.936 107.452-154.922 152.456-135.125 95.455 51.210 144.253-136.694 94.089 33.655 133.590 -90.827 93.614 75.897 137.316 -93.612 93.494 84.821 137.140-105.822 93.003 66.737 139.804-111.759 124.785 -42.538 113.590 -84.176 96.668 150.607 0.000 0.000 132.154 -87.989 161.367 163.677 93.857 36.842 138.879 -90.803 93.353 48.509 136.761-106.128 91.939 52.993 115.182 -76.125 92.900 111.868 151.172-121.076 93.734 34.896 140.374-109.964 93.272 104.220 143.514-125.478 122.749-147.775 152.930 -18.383 121.506 9.178 121.052-127.892 93.789 46.710 116.467 -76.416 92.604 43.086 137.261 -97.127 90.575 45.266 115.107 -75.989 92.444 39.810 129.358 -76.168 94.177 31.960 143.656-134.902 93.948 38.747 145.948 -37.267 92.588 38.997 148.218-123.550 92.751 35.451 129.386 -76.195 93.250 38.361 130.244 -83.787 92.845 39.097 129.326 -76.296 93.272 37.235 137.877 -83.940 93.134 38.160 137.010 -92.562 91.828 50.207 145.685 -40.996 90.508 45.298 143.097-133.100 91.589 73.750 142.615-123.609 93.017 0.000 129.342 -76.228 # 78 total E -2.35637E+02 rmsd from N 0.000 %NC 0.00 93.642 75.470 138.480-103.299 93.525 51.736 139.517-102.300 92.726 37.424 143.607-134.048 92.461 41.914 129.495 -76.215 92.180 40.075 139.736-142.016 92.831 36.622 138.600-148.462 93.434 39.144 129.948 -86.485 92.407 37.129 140.457 -86.118 91.857 44.708 149.641-118.168 92.320 51.013 138.213-140.062 93.783-176.915 146.260 -38.457 92.218 70.819 100.824-114.554 91.881 46.852 142.570-132.550 92.779 40.992 144.819 -40.499 92.898 42.293 111.110 -82.752 92.925 42.269 132.172 -93.914 93.303 34.207 130.846 -88.301 93.196 52.817 139.874 -97.526 91.898 40.648 140.343-126.054 92.536 55.704 143.613-133.726 94.908 163.436 0.000 0.000 121.412 27.282 159.258 174.429 91.851 42.793 139.877 -88.677 92.815 40.850 136.415-104.981 91.681 43.256 115.174 -76.042 92.124 44.453 149.381-122.052 93.583 37.094 140.315-106.040 92.912 48.905 143.369-125.340 94.361 155.261 143.480-125.224 93.038 51.843 99.877-114.493 92.182 41.975 116.206 -76.296 93.084 87.555 140.759-104.310 90.809 46.487 116.049 -76.148 92.208 38.614 129.365 -76.140 89.853 42.090 142.284-130.935 90.988 49.471 145.195 -40.145 89.952 39.522 144.937-104.985 92.022 37.496 129.389 -76.151 92.898 41.946 129.226 -70.340 92.590 37.207 129.267 -76.143 93.625 33.641 137.497 -85.722 93.720 40.469 136.505 -93.736 92.153 45.004 144.752 -43.100 91.586 42.415 142.619-132.782 92.423 63.054 143.002-124.171 93.025 0.000 129.414 -76.264 # 79 total E -2.40469E+02 rmsd from N 0.000 %NC 0.00 93.664 78.084 138.723-103.970 93.620 50.527 139.529-102.447 92.588 37.305 143.577-133.909 92.363 43.075 129.442 -76.159 91.663 42.478 141.102-147.844 92.730 34.315 138.642-150.029 92.799 38.546 129.486 -87.872 88.120 56.400 141.278 -88.108 89.286 50.965 143.020 -45.603 88.120 93.725 137.348-139.364 93.537-157.705 145.614 -41.328 93.248 59.007 100.662-113.231 94.183 35.000 143.414-134.205 93.942 90.940 147.475 -36.454 92.624 46.288 142.994-136.805 92.599 41.081 132.878 -90.967 92.970 50.698 132.241 -85.078 92.982 47.129 133.197 -70.255 94.903 30.188 140.603-136.792 98.040 33.783 145.398-138.011 98.210 33.025 0.000 0.000 95.845 41.799 140.012-132.994 93.150 33.101 138.938 -92.286 93.216 38.119 136.425-105.097 92.035 45.022 115.310 -76.179 92.724 38.434 145.270 -40.613 94.366 44.422 139.494-107.806 95.992 -14.807 144.758-127.868 124.914-145.533 153.138 -17.958 92.794 77.075 99.880-114.562 91.443 56.026 116.086 -76.208 92.401 58.754 136.418 -99.041 89.861 49.496 115.396 -75.352 92.513 36.540 129.357 -76.158 92.338 35.420 143.278-133.881 91.489 45.481 146.156 -41.430 90.062 43.371 143.705 -44.137 91.400 38.703 129.255 -76.083 91.479 42.774 129.363 -88.417 92.055 39.895 129.109 -76.119 92.571 40.241 136.523 -73.775 92.674 42.834 137.394 -90.359 91.652 44.477 144.690 -41.579 91.768 43.357 143.346-134.125 92.387 63.004 142.951-124.259 93.021 0.000 129.416 -76.267 # 80 total E -2.29210E+02 rmsd from N 0.000 %NC 0.00 94.017 139.664 139.343-102.254 93.255 51.723 140.167-109.504 89.568 47.287 142.641-131.653 92.028 44.355 129.383 -76.168 91.713 40.468 140.304-149.207 91.524 36.123 141.902-157.715 92.266 40.581 129.311 -86.119 89.909 39.603 138.289 -83.687 91.816 50.160 144.565 -43.694 92.221 54.033 137.758-139.404 92.840-121.566 148.204-111.467 92.672 106.313 100.384-112.413 95.595 44.776 109.966 -84.119 93.001 94.329 145.447 -39.171 109.110 -66.849 148.141-149.098 94.755 76.935 134.560 -90.386 94.600 22.266 133.400 -88.317 94.220 114.913 140.678-110.992 93.602 55.741 137.441 -76.668 94.450 38.509 144.363-137.108 94.865 36.898 0.000 0.000 93.176 66.755 139.561-127.897 90.532 41.473 138.498 -90.594 92.768 38.089 136.292-104.636 92.216 39.827 115.262 -76.192 91.433 57.375 149.236-128.683 92.893 64.322 138.869 -93.002 90.432 41.399 142.039-123.036 92.178 163.792 142.892-123.578 93.541 56.812 99.905-115.001 93.354 32.241 116.346 -76.356 93.682 46.235 138.400-101.296 92.608 38.918 115.747 -76.190 92.626 38.026 129.350 -76.151 92.164 37.836 110.792 -82.934 91.552 43.727 149.445-123.577 90.971 37.875 147.621-112.287 92.530 35.623 129.406 -76.162 93.272 40.319 131.386 -85.646 92.787 37.199 129.263 -76.110 93.414 37.048 138.170 -87.077 93.348 40.310 138.060 -98.006 91.370 47.170 146.850-114.946 93.429 37.898 150.038 -34.644 93.654 68.063 110.016 -83.159 93.023 0.000 129.420 -76.249 # 81 total E -2.33969E+02 rmsd from N 0.000 %NC 0.00 93.656 83.092 138.481-102.578 93.576 48.887 139.261-101.943 92.670 37.881 143.608-134.009 92.389 42.278 129.687 -76.360 91.250 43.569 143.949-153.819 91.125 34.458 138.745-148.503 92.628 42.898 130.079 -85.011 89.641 36.653 138.509 -87.837 91.776 48.303 144.110 -42.593 92.345 51.796 137.765-140.989 91.452 51.195 148.705-116.429 120.786-110.857 119.693-125.861 88.988 114.396 142.182-131.956 92.784 109.449 145.051-121.144 92.391 49.288 143.089-136.365 93.533 42.134 133.177 -90.756 96.332-168.167 132.439 -83.554 94.525 163.380 138.079-104.166 122.414-157.224 138.020 -65.018 92.213 66.534 144.360-134.869 93.318 161.395 0.000 0.000 93.176 100.176 133.264-122.220 93.857 39.716 138.554 -89.258 93.275 42.975 136.490-105.287 92.591 45.031 115.491 -76.675 92.001 76.003 151.072-125.076 93.567 61.376 140.012-110.751 93.161 69.081 143.368-125.360 119.355-148.946 152.744 -18.306 123.128 5.232 120.737-126.481 94.865 44.374 116.623 -76.535 92.812 42.520 137.733-101.593 90.402 56.442 115.422 -75.515 92.229 37.828 129.322 -76.180 90.243 38.213 142.567-132.130 90.129 51.939 147.918-125.371 89.470 50.735 144.731 -42.338 90.779 37.895 129.228 -76.051 90.750 43.804 129.153 -87.216 91.791 43.193 129.108 -76.044 92.482 38.704 136.827 -74.237 92.732 38.907 137.338 -90.049 92.353 44.001 144.654 -40.858 92.280 41.698 142.674-133.875 92.549 62.767 143.083-125.365 93.021 0.000 129.409 -76.265 # 82 total E -2.27287E+02 rmsd from N 0.000 %NC 0.00 93.632 77.038 138.171-101.865 93.601 48.891 139.331-102.551 92.876 37.916 143.680-134.158 92.475 40.980 129.479 -76.223 92.368 42.290 141.160-149.192 91.711 35.802 138.667-148.380 92.425 41.205 129.457 -87.180 89.632 41.226 139.905 -88.665 89.321 45.636 148.839-114.140 89.950 51.380 136.314-139.059 92.931 40.262 144.930 -40.946 93.214 37.840 102.117-112.787 95.035 40.480 150.102 -32.512 93.628 36.675 145.508 -39.501 91.226 54.777 143.785-138.387 92.434 41.905 129.555 -85.403 93.107 56.241 131.465 -88.219 93.597 11.327 136.770-104.128 113.529-134.021 138.892 -53.170 95.445 40.201 111.406 -82.973 123.676 -50.587 0.000 0.000 127.024-145.659 160.077 168.915 119.743 -92.553 165.134-121.907 93.130 45.322 137.161-105.192 90.993 52.162 115.626 -76.169 91.061 45.018 146.665-110.684 92.812 51.670 141.088-110.315 90.019 69.954 141.915-122.532 91.477-170.513 142.397-122.411 121.270 0.700 121.232-128.329 92.481 60.345 116.228 -76.251 93.233 38.104 137.787-105.271 91.714 41.846 116.371 -75.913 92.390 39.942 129.462 -76.235 90.552 41.510 110.716 -82.871 89.800 51.540 151.030-126.095 90.016 38.195 145.760-109.381 92.431 35.498 129.406 -76.153 93.293 39.798 130.642 -86.224 92.623 38.960 129.225 -76.172 93.146 36.870 137.765 -84.162 93.158 39.898 136.991 -92.824 92.042 45.868 144.662 -41.631 91.618 42.182 142.358-133.871 92.448 63.239 143.034-124.170 93.022 0.000 129.414 -76.268 # 83 total E -2.42533E+02 rmsd from N 0.000 %NC 0.00 93.856 113.410 140.055-108.420 93.276 52.944 139.252-100.770 91.164 42.351 143.141-132.853 92.253 40.580 129.507 -76.241 92.065 44.333 141.685-140.197 93.545 31.931 138.326-148.966 93.742 41.831 128.960 -81.547 94.297 31.517 137.561 -85.306 92.661 47.434 149.575-132.558 91.898 50.728 140.375-142.623 92.154 52.803 146.442 -39.463 120.487 -90.212 119.968-126.395 96.765-125.154 144.661-137.263 109.657 137.116 152.516 -26.882 130.443 -77.299 113.478 -84.811 93.874 58.180 133.974 -90.504 93.538 43.617 133.751 -87.277 93.075 43.315 134.865 -94.483 93.530 37.503 138.962 -96.208 94.833 41.489 144.382-136.105 96.459 30.176 0.000 0.000 95.098 41.643 139.267-126.688 95.650 30.802 137.801 -91.743 94.142 38.748 136.953-106.369 93.299 38.603 115.429 -76.273 93.299 46.176 146.786 -38.799 93.177 52.452 139.703 -95.536 91.935 25.532 142.760-124.194 118.071-160.732 152.260 -18.954 93.115 67.010 99.854-114.184 90.914 76.031 115.990 -76.156 92.935 78.820 135.512 -98.092 91.420 43.237 115.856 -75.819 92.444 38.538 129.378 -76.159 91.299 40.038 142.927-132.919 91.111 42.003 147.406-114.678 91.711 37.823 145.560 -41.131 92.179 38.846 129.337 -76.139 92.864 42.052 130.476 -86.757 92.679 35.792 129.460 -76.241 93.417 38.767 138.948 -77.601 93.346 38.103 137.216 -90.979 92.171 46.014 144.902 -41.190 91.868 41.579 141.603-135.372 92.482 63.289 143.041-124.339 93.021 0.000 129.412 -76.267 # 84 total E -2.33005E+02 rmsd from N 0.000 %NC 0.00 93.624 87.772 137.620 -99.066 93.620 52.717 141.743-108.668 92.746 35.365 143.631-134.039 92.421 41.178 129.464 -76.186 92.879 42.357 143.797-155.454 92.661 34.407 142.249-154.640 93.409 33.895 130.102 -87.097 91.156 44.725 140.173 -84.498 90.673 45.829 143.050 -45.174 92.577 33.531 137.465-141.066 94.179-108.490 147.787-111.926 118.676 102.586 121.730-130.035 120.573 175.556 152.938-154.880 109.223-144.829 155.955-135.453 115.179-109.445 150.913-151.159 93.863 53.939 134.332 -91.906 93.259 42.233 133.314 -87.735 92.924 102.416 139.852-105.712 92.767 88.505 141.642-156.129 92.418 35.172 149.857 -32.522 92.204 128.456 0.000 0.000 140.500 -54.307 108.264 -89.299 93.055 47.779 138.521 -87.015 94.581 29.689 135.091-104.241 95.441 42.021 116.368 -76.804 92.576 94.258 151.040-132.647 93.450 52.616 140.167-103.173 92.101 42.806 142.918-124.690 93.490 32.722 143.435-124.687 118.453 157.050 122.625-131.792 92.967 46.698 116.313 -76.333 93.381 43.267 137.368-102.567 92.446 38.746 115.811 -75.759 92.295 42.406 129.498 -76.318 89.762 40.529 142.135-131.799 91.384 41.960 145.216 -39.980 91.065 41.029 145.301 -40.553 91.848 37.723 129.259 -76.097 92.169 42.520 129.677 -88.168 92.406 38.221 129.236 -76.178 92.884 38.724 137.596 -73.137 93.039 39.704 137.341 -90.796 91.970 46.052 144.907 -41.256 91.561 42.261 142.445-133.299 92.442 63.303 143.006-124.151 93.022 0.000 129.413 -76.268 # 85 total E -2.40202E+02 rmsd from N 0.000 %NC 0.00 93.622 68.177 138.042-102.595 93.564 51.340 138.962-102.936 92.945 37.115 143.691-134.163 92.483 42.915 129.485 -76.196 92.567 37.106 137.765-142.855 92.542 39.621 140.792-159.196 92.428 37.954 129.352 -87.304 89.459 42.567 140.104 -85.270 90.476 52.844 143.116 -44.915 88.952 66.851 137.195-141.819 91.839 100.395 144.474 -42.071 93.711 60.526 99.560-109.420 94.533 74.861 143.632-135.010 110.062-173.483 153.806-135.784 95.665 52.139 144.289-136.866 94.010 30.899 133.444 -90.785 93.150 67.833 138.161 -88.332 93.107 44.970 132.626 -95.174 93.871 33.969 140.239 -94.475 95.742 36.861 144.661-136.425 96.083 32.614 0.000 0.000 97.633 40.781 153.364-148.551 93.675 33.645 137.666 -91.061 93.303 42.196 136.430-105.256 92.690 39.092 115.442 -76.320 92.570 48.087 151.689-123.648 93.399 33.571 140.327-101.911 93.059 48.862 143.399-125.493 95.163 162.497 143.804-127.092 92.775 58.455 99.836-114.473 90.779 52.769 115.957 -76.114 92.678 68.567 138.941-101.582 90.477 39.814 115.351 -76.237 92.121 42.544 129.349 -76.150 89.748 42.823 142.469-132.481 91.422 44.988 145.752 -37.926 91.118 36.994 144.585 -41.740 92.209 38.255 129.326 -76.123 92.539 45.193 131.687 -86.490 92.370 38.417 129.218 -76.117 93.208 34.692 137.865 -81.374 93.598 40.486 136.990 -92.650 92.298 43.897 144.704 -42.345 91.941 42.799 142.813-135.265 92.404 62.495 143.003-124.136 93.022 0.000 129.414 -76.268 # 86 total E -2.35109E+02 rmsd from N 0.000 %NC 0.00 93.624 75.052 138.037-101.540 93.628 50.212 140.104-104.081 92.671 37.954 143.622-134.146 92.386 41.961 129.480 -76.233 91.690 44.041 139.528-147.890 91.863 34.275 139.825-144.191 92.989 44.668 130.593 -85.587 91.578 34.065 139.568 -86.017 92.573 50.001 144.550 -38.193 92.093 46.462 135.226-146.368 92.125 45.812 148.009-115.602 122.498 -9.482 120.592-126.220 98.316 67.668 144.988-136.864 92.171 93.779 151.138-121.191 92.740 86.169 142.069-131.208 96.592 -74.998 134.197 -92.776 94.559 93.441 134.166 -88.373 93.372 81.691 135.461 -92.048 93.379 59.692 144.261 -89.164 94.613 33.581 150.323 -31.131 94.321 40.423 0.000 0.000 92.913 54.742 140.174-129.259 90.837 37.877 138.206 -90.617 92.409 39.979 135.995-104.533 93.748 40.188 115.677 -76.266 93.598 35.855 147.395-103.920 94.894 38.050 141.001-124.175 93.022 52.786 143.428-125.439 94.004 157.340 143.125-126.256 92.622 49.061 99.801-114.670 90.789 44.216 115.976 -76.157 92.658 103.697 137.978 -97.318 90.521 57.379 116.417 -76.237 92.197 37.514 129.356 -76.147 90.419 39.986 142.703-132.341 89.912 46.264 147.575-118.206 89.864 41.104 143.393 -44.692 91.419 40.372 129.283 -76.087 91.465 44.230 130.468 -86.658 92.041 39.477 129.138 -76.045 92.721 36.798 137.838 -80.834 92.900 42.304 137.140 -92.122 91.667 43.896 143.461 -42.738 92.177 42.874 141.783-137.946 92.413 62.781 143.011-124.433 93.021 0.000 129.415 -76.268 # 87 total E -2.38727E+02 rmsd from N 0.000 %NC 0.00 93.922 123.798 140.129-107.185 93.257 56.169 139.293-101.514 91.663 41.431 143.289-133.325 92.361 39.685 129.437 -76.195 92.112 42.016 140.457-147.224 92.637 34.370 138.891-149.480 93.045 39.764 130.245 -85.817 90.134 39.570 140.242 -86.184 91.390 48.503 144.081 -41.944 91.503 49.870 137.634-140.782 91.804 46.935 148.478-116.103 121.412-112.208 119.500-125.281 91.088 133.404 142.691-132.008 115.656-161.233 154.405-140.043 106.303-112.522 146.391-143.919 94.026 40.339 135.885 -91.122 93.294 45.887 133.523 -87.761 93.017 104.715 137.715-106.681 93.124 61.739 141.428-108.189 92.931 36.112 143.854-135.596 94.234 39.133 0.000 0.000 92.308 47.663 136.103-123.537 89.766 44.136 139.998 -93.866 92.091 37.103 135.521-103.192 90.842 44.651 115.107 -76.175 91.731 86.757 144.810 -42.600 93.760 87.811 139.336-100.959 94.372 11.938 109.841 -84.063 95.676 171.762 145.093-126.359 123.046 134.592 119.801-125.130 94.033 31.680 116.407 -76.420 93.855 47.538 137.822-109.159 90.344 46.679 116.559 -75.814 91.972 39.054 129.346 -76.205 88.447 41.344 141.904-130.062 90.682 45.876 144.114 -42.997 90.647 39.703 143.841 -43.620 91.946 37.635 129.295 -76.102 92.345 42.554 129.574 -94.493 92.262 40.050 129.280 -76.210 92.508 39.892 137.801 -75.476 92.846 39.431 137.244 -90.526 91.899 46.716 144.728 -40.707 91.534 41.875 142.218-133.592 92.450 63.858 143.016-124.175 93.023 0.000 129.411 -76.269 # 88 total E -2.37426E+02 rmsd from N 0.000 %NC 0.00 93.644 82.376 138.381-102.182 93.578 48.821 139.677-103.039 92.653 38.465 143.614-134.003 92.493 39.981 129.472 -76.232 92.727 43.195 142.414-149.613 93.623 32.563 139.497-151.838 93.675 36.529 130.183 -87.416 90.712 42.015 138.692 -86.627 90.610 45.849 142.703 -45.476 90.626 51.958 137.432-143.128 92.677 55.345 146.642 -39.626 119.355 -15.328 121.013-128.280 93.254-174.555 142.469-132.620 109.420 36.906 152.567 -27.469 93.166 37.206 143.683-135.281 93.343 54.769 133.915 -90.639 93.450 46.752 130.479 -91.553 93.211 87.490 139.725-108.738 113.346 -80.704 141.069-117.318 93.866 74.255 144.149-134.777 93.590 35.082 0.000 0.000 115.844 33.467 159.429 175.375 92.552 36.808 139.926 -89.545 93.630 34.115 136.624-105.973 93.397 44.391 115.596 -76.063 92.832 41.313 146.350 -39.748 93.623 39.167 139.000 -96.396 93.817 54.400 143.748-125.965 121.647-164.948 152.578 -18.958 92.881 71.928 99.900-114.567 91.815 42.046 116.146 -76.225 92.588 49.274 137.252 -95.309 90.923 39.376 115.528 -75.954 92.793 37.547 129.372 -76.182 93.593 33.441 143.525-134.473 92.316 44.366 147.224 -38.424 90.982 39.678 144.247 -42.997 91.932 37.258 129.286 -76.118 91.735 44.047 129.412 -87.448 91.989 43.776 129.257 -76.227 92.367 37.326 137.624 -77.576 92.727 39.612 137.284 -90.713 91.948 47.131 144.583 -41.528 91.339 41.859 142.076-131.642 92.487 63.765 143.018-124.313 93.024 0.000 129.414 -76.271 # 89 total E -2.38373E+02 rmsd from N 0.000 %NC 0.00 93.637 76.119 138.307-102.442 93.569 49.821 139.364-102.249 92.876 37.482 143.708-133.758 92.502 41.641 129.515 -76.220 92.142 41.530 139.681-149.923 91.463 36.416 138.650-147.934 92.230 44.480 129.565 -87.309 90.655 36.530 136.204 -82.350 90.993 49.634 146.651-114.794 92.706 43.983 137.233-140.522 95.016 34.475 147.956 -36.945 95.215 34.798 100.895-108.176 94.923 41.320 142.545-132.781 93.689 36.864 145.189 -41.037 93.152 52.300 144.093-135.685 92.883 38.533 133.415 -94.189 94.177 53.561 131.946 -88.464 94.913 -52.296 137.833 -97.065 123.439-116.214 144.730-124.423 94.724 66.583 111.405 -82.971 93.680 75.096 0.000 0.000 91.975 56.951 135.866-123.575 91.201 40.156 138.794 -90.389 92.756 38.620 136.250-104.549 91.963 40.194 115.274 -76.221 91.306 47.497 149.596-126.069 92.710 42.054 140.964 -99.709 90.828 51.988 142.290-123.571 93.233 44.781 143.031-123.142 120.545-173.357 121.772-129.317 92.017 58.046 116.201 -76.241 93.418 42.057 137.350-102.693 91.040 41.374 116.240 -75.636 92.296 41.650 129.380 -76.214 89.740 39.344 142.102-131.659 91.616 42.770 144.802 -39.719 92.401 35.917 144.887 -42.479 92.898 37.529 129.378 -76.173 93.198 42.021 130.075 -87.528 92.526 40.014 129.427 -76.369 92.472 39.149 139.263 -77.357 92.634 39.419 137.308 -91.229 91.879 47.165 144.805 -41.374 91.226 41.970 142.725-130.298 92.484 63.703 143.009-124.386 93.022 0.000 129.416 -76.271 # 90 total E -2.39685E+02 rmsd from N 0.000 %NC 0.00 93.616 118.252 135.060 -88.467 94.043 41.464 140.757-108.045 94.386 34.894 144.166-135.436 92.710 40.897 129.768 -76.611 92.879 41.875 134.498 -28.613 92.584 35.249 137.029-150.672 93.293 45.442 130.071 -86.822 93.906 30.679 138.422 -85.568 92.776 47.451 152.718-125.698 93.386 37.153 137.720-144.944 93.694 150.700 145.889 -39.092 124.317 146.288 119.721-123.965 92.185 28.453 143.003-133.953 92.434 61.559 145.686 -39.370 90.253 51.069 142.589-128.380 92.654 46.310 132.967 -95.526 93.677 30.455 131.217 -88.942 94.210 140.279 139.006-107.150 94.492 61.180 140.088-109.495 95.150 36.649 144.498-136.223 96.582 36.756 0.000 0.000 94.373 43.457 138.155-127.073 92.801 36.948 138.148 -91.087 93.241 38.595 136.267-105.393 94.150 37.313 115.505 -76.517 92.768 38.954 149.711-123.391 93.690 50.251 143.731-126.340 90.963 46.309 142.383-123.407 92.424 47.416 142.806-122.747 119.571 166.354 121.989-130.573 94.297 46.296 116.492 -76.477 93.511 39.470 137.393-103.127 90.437 47.848 116.212 -76.063 92.157 42.995 129.191 -76.080 89.770 38.599 142.241-132.002 92.007 42.579 146.130 -38.978 91.471 39.408 145.093 -40.325 92.072 38.177 129.309 -76.131 92.433 42.693 129.823 -87.887 92.506 37.870 129.268 -76.209 92.952 38.797 137.928 -74.931 93.072 39.626 137.290 -90.818 91.993 46.055 144.917 -41.245 91.580 42.217 142.457-133.483 92.448 63.322 143.016-124.166 93.023 0.000 129.413 -76.271 # 91 total E -2.31080E+02 rmsd from N 0.000 %NC 0.00 93.761 106.844 138.980-104.200 93.402 54.245 140.931-106.502 91.993 38.735 143.394-133.530 92.296 40.596 129.439 -76.187 92.058 43.335 142.236-152.021 91.581 35.397 139.157-152.090 92.538 39.145 129.692 -86.943 89.350 42.391 137.917 -84.497 90.797 49.414 143.271 -45.850 90.944 43.134 136.612-141.095 92.210 129.368 147.940-114.093 93.295 77.044 100.499-111.037 92.361 90.052 142.933-133.981 93.580-140.990 148.555-118.763 93.198 58.457 143.582-135.360 93.467 45.557 132.793 -90.124 93.275 73.658 136.389 -77.036 93.198 47.010 137.839-110.979 93.224 83.634 140.055-106.471 131.472 -40.946 113.655 -84.232 96.495 155.254 0.000 0.000 124.197-137.607 159.577 170.110 95.099 39.326 141.527 -91.810 94.148 32.626 137.320-103.003 92.651 45.533 115.684 -76.267 92.082 58.848 144.513 -43.590 92.927 51.151 139.425 -98.377 90.842 54.509 142.296-123.431 93.362-171.656 143.298-124.574 93.111 69.777 99.872-114.631 91.531 44.051 116.086 -76.208 92.803 51.159 137.445-101.350 91.904 37.756 115.477 -76.008 93.188 37.130 129.453 -76.225 98.004 27.420 144.911-137.554 95.869 36.880 147.262 -36.343 93.101 37.143 150.224-127.440 92.815 37.912 129.400 -76.175 93.381 37.626 131.173 -85.622 92.675 39.514 129.406 -76.249 93.089 36.632 137.548 -83.023 92.995 42.490 137.084 -92.784 90.997 46.191 146.257-114.049 91.498 43.015 142.270-133.030 92.406 65.233 143.011-124.157 93.018 0.000 129.406 -76.259 # 92 total E -2.33759E+02 rmsd from N 0.000 %NC 0.00 93.482 69.923 135.348 -91.913 93.555 54.207 139.768-104.635 94.597 33.571 144.092-135.008 93.144 39.559 129.384 -76.130 94.332 32.626 137.824-138.681 96.374 41.118 138.930-149.514 95.058 32.566 131.205 -84.715 94.399 37.243 142.836 -86.322 92.794 38.129 149.195-118.941 94.485 57.023 141.493-143.249 92.967 63.311 146.789 -39.587 122.317-109.679 119.634-124.705 94.079 152.904 149.878 -31.658 117.176 116.525 157.129-135.876 93.676 82.492 143.612-135.196 95.860 -54.217 135.561 -90.724 96.627 -69.322 135.028 -88.135 95.448-125.208 139.006-107.620 114.017-138.553 142.965-127.329 94.123 67.703 144.379-135.854 94.504 43.129 0.000 0.000 92.734 39.757 134.362-122.726 91.413 44.334 139.875 -92.816 92.210 41.314 135.820-103.771 89.534 41.345 114.830 -76.108 90.311 55.419 149.335-126.618 92.464 45.456 140.585-101.372 89.949 51.417 141.866-122.774 92.942 49.777 142.932-122.864 119.916 177.104 121.713-129.573 94.063 45.401 116.490 -76.493 93.656 38.220 137.414-103.231 90.570 47.985 116.815 -76.068 91.808 44.051 129.338 -76.199 87.558 41.849 141.519-130.469 90.983 43.326 144.049 -40.518 91.871 37.870 144.641 -42.081 92.447 37.567 129.358 -76.151 93.056 43.042 130.102 -87.663 92.892 35.392 129.193 -76.192 93.234 39.525 138.014 -71.711 93.217 39.410 137.372 -90.265 92.086 44.620 144.911 -41.263 91.987 42.610 142.537-136.102 92.431 62.601 142.960-124.154 93.015 0.000 129.401 -76.257 # 93 total E -2.35761E+02 rmsd from N 0.000 %NC 0.00 93.618 75.378 137.922-101.055 93.658 52.573 141.243-106.538 92.615 35.507 143.604-134.006 92.270 43.440 129.472 -76.207 91.544 43.816 140.029-150.066 91.090 36.339 140.750-149.868 92.178 41.060 129.247 -87.773 90.241 39.312 138.563 -86.701 90.091 49.006 147.994-111.016 90.838 46.224 137.080-139.827 93.830 35.578 146.707 -38.903 93.254 41.203 101.037-110.035 93.679 40.344 110.711 -82.456 94.092 36.884 146.146 -39.216 94.132 34.831 143.543-134.932 92.936 47.757 131.395 -91.050 92.934 69.827 132.225 -91.278 92.385 51.842 138.022 -99.884 91.369 28.717 139.795-110.393 99.925 -86.037 145.903-136.695 126.928 -72.714 0.000 0.000 130.852 -79.866 160.219 162.914 92.881 44.648 141.973 -92.013 92.986 41.618 136.830-104.984 91.782 53.871 115.544 -76.532 90.866 84.726 149.404-121.213 93.753 66.731 139.096-113.496 93.468 -7.154 143.496-125.665 123.160 143.852 152.631 -18.369 120.916 156.181 121.315-128.498 94.656 38.645 116.542 -76.538 93.623 42.815 137.347-103.403 91.548 84.458 116.406 -75.818 92.762 47.733 129.403 -76.225 92.901 28.803 143.518-134.342 92.017 50.982 146.822 -38.701 90.406 42.256 143.706 -45.005 91.779 37.937 129.297 -76.121 91.780 42.241 129.375 -81.746 92.198 42.628 129.111 -76.077 93.113 36.788 135.360 -72.058 93.415 38.541 137.369 -90.604 92.489 48.634 145.903 -40.266 91.033 46.227 142.577-135.054 91.606 71.376 142.602-123.603 93.019 0.000 129.362 -76.240 # 94 total E -2.28439E+02 rmsd from N 0.000 %NC 0.00 93.781 -21.873 135.018 -95.275 124.708-101.083 149.478 -96.393 92.453 43.885 111.201 -82.815 92.164 50.878 129.443 -76.178 92.229 39.170 142.295-149.419 91.613 40.653 144.673-166.214 91.259 39.627 128.912 -87.523 88.872 48.788 136.497 -83.771 91.515 39.652 144.989-118.765 95.249 36.823 142.399 -18.838 95.043 152.580 146.226 -38.015 121.463 145.277 120.877-127.121 88.014-132.831 141.600-131.053 118.239 167.597 158.040-142.630 110.508 -79.876 149.169-147.422 94.006 60.739 134.101 -90.481 93.428 40.601 133.359 -86.719 92.696 55.688 137.364 -99.461 92.123 47.058 137.558-103.677 91.637 43.561 143.569-134.997 91.687 44.154 0.000 0.000 91.212 61.959 131.717-121.120 89.529 48.347 138.052 -90.193 92.129 40.529 134.259 -98.401 91.629 41.441 114.861 -75.699 92.700 53.852 149.856-125.468 93.802 58.541 139.461 -99.070 95.108 -94.159 109.319 -83.476 111.942 157.976 151.312 -20.546 121.895-171.857 121.280-128.249 92.024 57.924 116.134 -76.258 92.796 51.956 134.197 -90.349 91.466 42.384 115.411 -76.065 91.963 41.753 129.361 -76.198 90.112 42.622 110.766 -82.953 91.762 41.713 144.692 -39.112 92.033 39.700 146.329 -39.471 92.313 36.058 129.313 -76.123 92.491 42.649 129.675 -87.776 92.189 43.887 129.288 -76.227 92.158 38.047 137.574 -72.691 92.498 40.392 137.411 -89.711 91.725 48.132 144.749 -41.506 91.014 41.911 142.308-128.837 92.499 64.194 143.064-124.369 93.022 0.000 129.413 -76.265 # 95 total E -2.27842E+02 rmsd from N 0.000 %NC 0.00 93.623 77.225 138.016-101.212 93.662 50.572 140.734-106.981 92.594 36.693 143.544-133.998 92.336 42.260 129.494 -76.231 91.938 43.477 140.928-151.305 91.787 34.537 138.564-152.010 92.577 38.531 129.492 -87.274 88.480 47.375 139.457 -86.429 89.450 55.889 142.137 -47.819 90.676 62.776 136.399-138.710 92.562 68.180 147.615-108.588 120.517-121.311 121.666-128.991 93.057 98.788 143.376-134.868 91.649 73.153 149.559-123.161 91.427 55.064 143.214-132.639 93.633 71.929 132.932 -90.760 96.603-125.957 134.210 -90.395 94.723 142.306 137.962-104.127 110.221-158.332 142.146 -93.958 94.135 70.771 144.127-134.838 93.965 121.049 0.000 0.000 93.203 43.484 135.596-125.557 91.176 40.580 141.092 -93.137 92.542 39.902 136.019-103.594 90.773 43.816 115.029 -76.045 90.838 47.357 147.780-115.441 93.434 44.053 136.574 -90.235 93.798 24.963 143.677-126.000 120.935-111.716 152.586 -19.266 120.026 124.162 121.611-129.452 91.653 52.058 117.046 -76.087 92.920 40.382 136.172 -93.622 91.397 38.748 115.610 -76.099 92.684 42.659 129.346 -76.177 91.827 35.445 142.617-129.273 92.244 42.946 146.267 -38.249 91.590 37.869 144.556 -42.188 92.261 38.640 129.332 -76.151 92.592 41.925 130.406 -91.548 92.495 38.275 129.292 -76.202 92.941 38.183 137.778 -75.219 93.083 40.013 137.253 -90.907 91.960 45.894 144.823 -41.479 91.603 42.343 142.497-133.485 92.433 63.279 143.016-124.142 93.019 0.000 129.419 -76.277 # 96 total E -2.41436E+02 rmsd from N 0.000 %NC 0.00 93.610 84.323 137.449 -98.398 93.773 48.527 140.727-107.126 93.442 35.606 143.849-134.520 92.577 40.461 129.487 -76.242 93.304 42.696 145.328-156.924 93.902 32.966 141.617-152.305 94.253 33.312 130.403 -87.559 91.920 44.741 139.273 -86.011 91.169 44.853 142.718 -46.482 92.989 84.583 137.685-142.721 95.701-166.874 147.432 -36.940 93.017 62.482 100.902-114.135 93.218 31.834 143.053-133.545 91.967 75.651 144.840 -40.725 92.016 49.418 137.394-132.132 93.272 47.784 133.169 -91.823 93.934 31.237 131.365 -88.315 94.380 115.128 143.327-106.501 91.895 50.990 134.992 -38.673 91.053 44.774 143.242-133.107 93.730 45.877 0.000 0.000 93.566 34.128 135.290-117.233 93.577 41.210 142.213 -95.773 92.740 39.061 136.049-103.929 90.830 46.998 114.842 -76.061 90.616 57.237 145.640-117.567 93.020 48.896 139.335-107.164 91.231 74.395 142.455-123.721 93.772-161.965 143.444-125.228 122.073 2.639 121.069-127.612 93.917 50.791 116.475 -76.442 92.753 49.894 137.142-102.387 91.361 86.376 115.495 -75.855 92.398 42.481 129.366 -76.185 89.903 38.648 142.533-131.719 90.224 54.159 148.429-117.755 90.194 51.502 144.633 -41.478 90.835 39.974 129.237 -76.055 91.048 48.879 131.305 -91.897 92.152 40.580 129.000 -75.743 92.766 36.667 138.666 -86.135 93.282 37.655 136.796 -92.841 92.453 44.490 144.672 -41.164 92.720 39.792 142.507-134.126 92.864 63.221 143.275-127.064 93.021 0.000 129.415 -76.276 # 97 total E -2.28739E+02 rmsd from N 0.000 %NC 0.00 93.597 57.993 137.493-102.156 93.629 52.046 139.725-104.214 94.636 35.022 150.233 -32.440 92.566 41.592 129.741 -76.535 93.061 39.268 135.799 -28.362 93.654 36.570 139.354-149.613 93.436 45.851 130.893 -82.623 91.288 35.381 142.117 -89.509 91.257 57.257 154.750-128.546 91.791 64.367 139.421-141.376 91.017 -52.021 147.004-109.660 117.448-107.385 121.521-130.568 93.545 -17.991 145.240-138.098 106.691 133.735 155.126-132.602 112.261 -78.157 152.359 -24.420 93.849 56.732 133.979 -90.657 93.737 35.318 131.211 -86.843 93.327 56.273 140.219-108.930 91.336 37.960 137.999-104.872 90.594 46.822 143.051-132.656 92.979 46.613 0.000 0.000 94.275 28.987 135.623-116.962 96.567 40.406 139.785 -91.537 93.973 35.628 136.346-104.245 93.696 40.778 115.299 -76.125 93.780 92.183 148.410-134.177 93.594 61.931 139.981-105.120 92.197 -16.085 142.963-124.494 117.475-156.195 151.995 -19.514 120.318 125.726 121.689-129.497 91.178 49.976 115.952 -76.166 92.932 71.701 138.945-104.212 90.472 41.609 115.601 -75.655 92.339 38.487 129.390 -76.152 92.014 38.883 143.138-133.261 91.514 39.811 144.998-103.022 90.845 40.272 147.868-130.538 92.057 39.094 129.335 -76.119 92.152 38.801 129.876 -84.475 92.025 42.300 129.412 -76.295 92.260 37.969 137.414 -83.560 92.084 45.034 137.061 -92.074 90.608 49.559 143.520 -43.585 90.806 42.281 141.752-127.893 92.469 65.534 143.007-124.233 93.022 0.000 129.419 -76.275 # 98 total E -2.33742E+02 rmsd from N 0.000 %NC 0.00 93.700 85.170 139.216-105.635 93.396 51.028 139.591-101.823 91.859 39.648 143.347-133.415 92.346 41.204 129.395 -76.138 92.980 40.836 141.280-143.070 93.423 35.154 138.681-149.387 93.494 39.341 130.033 -86.965 91.615 39.240 140.866 -88.444 90.148 44.681 149.330-123.011 91.085 52.874 137.378-139.806 93.309 64.994 146.822 -39.030 119.252 -10.743 122.176-129.994 95.943 160.184 110.918 -83.432 92.099 51.413 148.275-117.063 90.866 49.087 142.799-133.322 93.089 102.687 136.417 -92.740 93.260 66.585 133.280 -86.271 92.870 83.682 137.343-102.157 107.368-137.090 137.207 -96.135 94.086 65.338 144.141-134.848 95.868 54.673 0.000 0.000 125.709 -11.045 159.218 171.971 90.787 58.818 140.564 -91.997 92.342 38.205 136.180-103.787 89.045 46.515 115.091 -75.639 91.207 44.396 144.957 -40.335 93.105 51.423 139.132-100.440 91.655 64.009 142.638-123.921 114.687-158.033 151.740 -20.151 93.231 65.854 99.858-114.485 93.145 37.079 116.319 -76.351 93.333 45.100 138.485-111.947 89.631 42.177 115.529 -76.648 91.485 49.500 129.285 -76.140 86.601 51.383 141.148-129.714 90.709 40.896 144.125 -40.689 92.312 37.658 145.276 -39.788 92.728 38.038 129.361 -76.146 93.323 41.097 130.125 -87.495 92.707 37.975 129.528 -76.393 92.905 38.598 138.140 -72.866 93.034 39.580 137.328 -90.501 91.964 46.175 144.888 -41.280 91.532 42.230 142.400-133.088 92.443 63.347 143.006-124.164 93.022 0.000 129.414 -76.269 # 99 total E -2.33580E+02 rmsd from N 0.000 %NC 0.00 93.913 151.866 135.442 -88.655 93.758 40.174 138.479-104.070 93.408 38.354 143.851-134.685 92.534 41.770 129.793 -76.604 93.014 37.002 135.788 -28.054 92.622 38.840 142.364-167.161 91.671 38.459 129.073 -86.571 88.355 46.121 138.652 -86.420 90.192 44.450 141.424 -45.935 91.273 53.006 137.911-141.139 93.182 59.748 146.692 -39.373 122.022-140.505 120.681-126.346 121.693 -65.115 112.673 -83.993 93.472 60.685 145.831 -39.071 93.607 32.396 143.715-135.538 93.406 61.249 138.634 -97.875 92.708 65.225 135.901 -82.214 92.681 125.129 137.418-105.245 118.144-101.295 136.677-119.663 94.558 45.449 111.355 -82.969 94.281 36.808 0.000 0.000 93.019 56.188 140.746-125.566 93.308 32.170 139.707 -94.211 93.260 37.124 136.577-105.189 91.669 53.240 115.342 -76.420 92.115 48.535 143.201 -43.552 94.463 25.829 140.089-115.414 98.751 49.373 110.405 -83.762 97.385 16.836 145.621-126.445 121.324-175.821 123.090-131.031 92.722 55.268 116.285 -76.322 93.211 41.631 137.196-102.786 88.552 49.373 116.136 -76.231 91.562 48.879 129.243 -76.156 85.946 45.106 141.026-129.432 89.876 46.649 144.571 -41.168 90.199 39.743 143.249 -43.174 92.022 38.630 129.307 -76.115 92.046 42.089 129.728 -88.199 92.001 42.024 129.285 -76.229 92.539 38.063 136.214 -71.704 92.828 40.556 137.395 -90.089 91.794 46.758 144.817 -41.397 91.386 42.199 142.283-131.952 92.450 63.714 143.012-124.206 93.023 0.000 129.419 -76.267 # 100 total E -2.44634E+02 rmsd from N 0.000 %NC 0.00 93.652 83.636 138.361-102.082 93.571 51.577 140.839-105.936 92.540 36.579 143.574-133.872 92.342 42.490 129.488 -76.198 91.812 43.488 140.834-155.953 90.985 36.377 138.612-153.996 91.661 44.893 128.775 -87.339 86.733 57.873 137.990 -85.790 88.449 48.990 144.103-105.682 89.296 51.585 138.898-138.600 93.166 58.085 147.014 -38.681 120.260 -69.239 121.544-128.613 94.600-176.840 143.695-134.670 111.678 161.916 152.716 -25.967 103.458 -95.308 146.644-142.016 93.755 52.182 134.289 -90.344 93.355 64.954 133.473 -87.517 93.014 80.331 136.287-100.491 92.355 45.086 137.919 -94.648 91.268 47.735 143.366-133.974 91.879 49.351 0.000 0.000 92.315 44.500 139.467-126.334 90.603 39.159 140.328 -91.817 92.446 39.220 135.906-103.645 91.421 42.410 115.305 -76.214 90.893 45.784 148.886-120.946 93.315 38.216 138.538 -97.646 91.964 56.688 142.854-124.510 93.590 164.622 143.032-124.841 92.679 56.210 99.967-115.204 91.175 43.256 116.037 -76.174 92.698 49.331 138.084-101.874 89.526 43.663 115.810 -76.000 92.092 40.306 129.314 -76.151 88.762 41.841 142.026-131.125 90.246 54.321 146.312 -40.398 89.723 42.503 143.703 -42.642 91.431 37.093 129.273 -76.077 91.774 45.091 129.509 -86.413 92.090 42.076 129.209 -76.102 92.311 36.757 137.912 -78.755 92.564 42.089 137.231 -90.945 91.542 46.238 143.891 -42.606 91.409 42.570 142.445-132.318 92.420 63.646 143.016-124.132 93.022 0.000 129.414 -76.269 # 101 total E -2.27600E+02 rmsd from N 0.000 %NC 0.00 93.550 66.236 136.420 -96.601 93.784 53.437 142.145-111.062 92.952 33.604 143.720-134.207 92.368 43.876 129.505 -76.192 91.817 41.585 139.933-145.832 91.444 39.428 139.722-154.760 92.041 38.845 129.149 -87.967 88.741 44.300 139.732 -86.571 89.428 59.717 145.225-111.476 88.750 61.178 136.742-140.556 90.701 57.648 146.822-109.907 119.283-124.271 121.169-129.159 93.226 80.681 143.491-134.975 92.168 58.490 148.360-116.899 94.109 40.814 149.645 -27.843 93.599 40.737 134.435 -91.790 94.245 33.262 131.778 -87.792 94.671 133.688 139.651-113.617 92.891 57.396 142.102-106.354 94.088 39.355 111.342 -82.981 95.333 38.471 0.000 0.000 93.742 39.921 135.652-121.292 93.508 36.622 138.065 -92.172 93.144 41.199 136.258-104.496 92.037 39.273 115.297 -76.011 92.537 46.528 151.609-133.399 93.957 53.449 140.010-101.369 96.892 -18.896 150.370 -23.276 112.861-173.885 112.152 -82.827 93.995 52.683 99.844-113.888 96.270 28.570 116.822 -76.751 95.004 39.627 139.589-106.682 94.456 39.735 116.075 -75.561 93.187 38.035 129.358 -76.384 94.086 34.462 143.577-137.778 92.630 99.595 147.756-117.935 111.535-154.736 154.211 -26.594 92.606 54.451 129.529 -76.246 93.116 39.805 130.083 -99.693 92.168 45.349 129.402 -76.077 92.884 35.211 138.000 -88.804 92.951 51.354 136.256 -93.995 91.587 93.450 147.430-119.934 91.706 73.491 143.295-132.583 92.079 74.024 142.867-123.960 93.002 0.000 129.452 -76.183 # 102 total E -2.41255E+02 rmsd from N 0.000 %NC 0.00 93.883 118.662 140.018-107.478 93.368 55.487 140.809-104.781 91.284 39.448 143.168-133.017 92.115 42.749 129.529 -76.232 91.798 43.270 143.538-146.444 93.911 31.544 139.237-151.593 94.281 35.580 130.886 -85.777 91.341 41.616 140.730 -86.911 91.286 45.560 143.432 -45.390 92.741 52.300 138.355-141.226 93.109 65.439 149.018-117.131 120.706 -17.976 121.900-128.964 95.083 172.456 143.924-136.675 92.493 50.070 148.952-121.724 92.804 35.553 143.443-134.736 92.814 45.589 134.263 -91.708 92.423 43.342 130.127 -93.167 92.648 53.453 135.807 -99.734 91.997 35.251 139.036-110.650 100.016 -97.366 146.016-138.409 125.638-104.400 0.000 0.000 124.264 11.871 158.201 171.917 90.222 55.393 138.924 -89.405 92.007 45.816 135.908-103.922 88.626 46.219 114.933 -76.233 92.072 52.051 144.806 -37.283 93.121 39.149 140.115-111.129 91.734 60.924 142.775-124.163 94.044-175.050 143.409-124.574 92.957 73.900 99.896-114.827 91.751 43.192 116.107 -76.223 92.676 51.798 138.560-101.993 90.174 42.154 115.567 -75.938 92.429 38.558 129.348 -76.169 90.893 38.678 142.702-132.323 90.277 48.405 150.638-135.882 89.822 40.763 143.962 -42.253 91.461 37.880 129.288 -76.094 91.579 44.677 130.686 -84.624 92.026 41.327 129.243 -76.167 92.284 35.541 137.763 -79.040 92.354 44.947 137.152 -90.899 90.973 46.448 143.121 -44.526 91.305 43.028 142.350-131.504 92.392 64.063 143.003-124.103 93.023 0.000 129.415 -76.270 # 103 total E -2.29138E+02 rmsd from N 0.000 %NC 0.00 93.658 93.648 137.890-100.018 93.483 48.102 140.326-105.722 92.173 40.516 143.408-133.641 92.625 37.786 129.448 -76.223 93.595 42.682 146.032-154.073 91.893 34.408 136.649-151.051 92.729 42.793 129.734 -86.992 90.226 43.543 139.010 -85.262 90.678 42.044 148.396-112.430 93.671 36.324 138.854-141.748 94.846 154.216 146.143 -38.204 121.147 142.221 120.698-127.255 91.386-130.595 142.604-133.264 117.041 169.261 158.286-139.406 108.193 -86.957 148.294-145.605 93.912 57.189 134.288 -90.780 93.410 41.667 133.441 -87.183 92.690 59.433 136.783 -96.448 92.029 46.508 136.089 -92.109 91.884 47.852 143.627-133.742 94.105 96.398 0.000 0.000 127.162-157.007 161.081 169.397 91.246 48.652 141.998 -89.570 93.317 34.442 135.058-103.726 92.056 47.206 116.456 -76.181 90.495 41.678 146.428-117.628 93.099 47.930 139.675-102.365 90.708 51.729 142.171-122.950 105.248 -68.302 151.373 -22.813 119.998-103.731 121.251-128.864 92.674 130.830 116.476 -76.251 93.421 65.226 136.733-106.965 92.649 161.878 115.972 -75.595 92.530 55.608 129.404 -76.163 91.251 40.986 110.853 -82.756 91.079 42.102 147.390-108.313 91.502 40.433 148.219-118.789 92.384 35.986 129.386 -76.164 92.146 41.843 130.245 -89.077 92.243 41.971 128.975 -76.122 92.689 37.028 137.800 -87.377 92.818 41.252 136.884 -93.767 92.164 43.247 144.176 -42.072 92.118 43.451 143.354-135.738 92.320 62.722 142.854-124.667 93.024 0.000 129.414 -76.256 # 104 total E -2.41215E+02 rmsd from N 0.000 %NC 0.00 93.630 74.714 138.168-102.082 93.596 49.509 139.496-102.596 92.925 37.592 143.778-134.115 92.501 40.842 129.498 -76.248 92.280 41.169 140.027-146.911 92.415 35.232 138.937-149.617 93.541 36.791 130.116 -86.692 91.612 39.377 139.282 -85.824 91.209 43.420 144.134 -42.716 91.633 53.229 138.128-143.461 93.036 40.977 145.727 -39.653 92.481 36.463 100.930-113.154 91.632 51.368 110.125 -83.222 91.516 42.587 143.732-108.800 92.158 40.625 143.423-133.590 93.331 37.625 132.539 -93.255 93.239 40.435 131.345 -86.447 93.040 55.724 139.281-101.982 91.777 53.335 140.707-127.669 91.503 24.007 143.283-132.857 109.144 -66.095 0.000 0.000 125.820-152.635 158.130 175.653 92.276 48.951 143.598 -90.876 92.952 35.275 136.749-104.597 91.509 45.239 115.644 -76.150 90.762 49.597 147.641-117.336 92.849 46.287 140.792 -98.546 90.927 48.463 142.333-123.602 93.614 44.461 143.334-123.755 120.566 179.536 121.886-129.601 93.089 52.938 116.352 -76.357 93.410 41.266 137.319-102.755 90.350 44.996 116.080 -75.755 92.076 45.339 129.311 -76.162 89.581 38.335 142.113-131.744 91.820 43.590 146.194 -37.504 91.344 38.952 144.804 -42.042 92.115 37.594 129.309 -76.131 91.926 44.292 129.621 -88.569 92.042 42.666 129.330 -76.284 92.174 38.005 138.883 -78.389 92.394 40.463 137.263 -90.714 91.617 46.958 144.203 -42.272 91.244 42.065 142.576-130.156 92.491 63.668 142.997-124.508 93.022 0.000 129.414 -76.269 # 105 total E -2.42152E+02 rmsd from N 0.000 %NC 0.00 93.646 78.435 138.418-102.733 93.585 51.357 139.570-102.395 92.731 37.251 143.625-134.009 92.417 42.362 129.470 -76.181 92.290 41.280 140.242-146.145 92.175 35.909 138.887-149.397 93.513 38.384 130.073 -86.859 93.516 35.254 137.847 -83.136 93.210 40.230 148.173-124.637 95.774 37.070 138.771-142.172 94.949 150.457 146.329 -38.161 121.870 143.925 120.579-126.458 91.299 34.139 142.663-133.302 92.131 52.198 144.998 -40.367 91.276 41.633 144.404-129.456 92.911 48.569 134.246-100.089 93.623 30.525 131.483 -89.133 94.252 155.213 138.650-100.726 94.359 59.885 146.916-127.218 95.878 25.393 144.658-135.822 96.593 36.216 0.000 0.000 120.019 17.025 157.929-175.118 92.717 45.121 138.865 -92.920 92.787 39.183 136.727-105.958 91.991 42.521 115.451 -76.087 91.650 39.498 149.502-115.917 93.884 43.100 139.510-100.345 93.051 22.368 143.367-125.398 115.171 149.615 110.969 -82.284 93.612 44.224 99.993-114.409 93.195 41.133 116.364 -76.401 93.430 77.170 137.651-104.176 93.064 115.283 117.183 -75.935 92.257 40.567 129.363 -76.158 88.220 45.451 142.060-131.007 90.317 53.674 145.061 -41.181 89.864 42.618 143.834 -41.859 91.391 36.774 129.267 -76.072 91.267 46.281 129.250 -86.660 91.887 44.093 129.122 -76.097 92.224 35.742 137.959 -80.067 92.472 41.569 137.196 -91.141 91.498 46.942 143.753 -43.066 91.322 42.085 142.163-131.208 92.452 64.239 143.013-124.511 93.022 0.000 129.411 -76.269 # 106 total E -2.38638E+02 rmsd from N 0.000 %NC 0.00 93.641 72.962 138.328-103.053 93.571 54.166 140.460-105.102 92.924 35.532 143.681-134.040 92.373 43.554 129.519 -76.211 90.936 41.449 137.685-145.139 90.061 41.264 137.941-153.614 91.245 42.059 128.278 -83.390 87.497 45.223 138.800 -86.869 89.886 40.755 144.221-108.474 92.839 60.906 138.942-140.379 93.341 75.170 146.628 -39.295 117.391 165.857 122.617-131.959 93.341 45.658 143.451-135.197 92.196 53.044 145.456 -39.876 92.092 123.880 142.813-133.269 93.326 50.843 133.124 -95.784 92.380 49.325 133.037 -87.810 92.788 98.069 135.662 -94.122 92.475 47.496 141.238-137.506 90.740 46.601 143.062-132.986 93.045 75.501 0.000 0.000 92.009 46.629 138.096-119.365 91.911 37.292 140.347 -91.476 92.978 38.963 136.221-104.362 92.137 42.632 115.354 -76.341 91.767 46.800 150.494-127.103 93.454 45.982 139.667-103.218 93.353 5.010 143.463-125.523 117.182-163.382 151.876 -19.738 121.605 134.982 121.296-128.170 93.830 34.665 116.383 -76.422 93.366 43.719 136.409 -96.744 91.249 41.611 115.568 -75.998 92.359 43.000 129.342 -76.180 90.931 35.170 142.568-132.511 91.958 45.693 146.434 -37.951 90.358 39.993 146.249-113.793 92.219 37.895 129.357 -76.148 92.953 38.457 129.987 -88.223 92.628 39.176 129.271 -76.169 93.199 37.694 137.578 -83.981 93.142 40.156 137.029 -92.495 91.959 45.931 144.882 -41.271 91.586 42.348 142.466-133.535 92.442 63.336 143.042-124.162 93.020 0.000 129.412 -76.271 # 107 total E -2.28292E+02 rmsd from N 0.000 %NC 0.00 93.650 19.370 137.187-103.866 94.805-161.531 137.487-110.988 95.108 38.335 144.542-136.432 92.735 42.417 129.501 -76.223 92.846 40.596 141.998-151.064 92.521 38.306 142.963-156.240 92.372 39.947 129.311 -82.171 90.171 46.017 139.214 -86.541 92.116 42.161 149.431-122.728 93.930 56.860 145.663-147.334 91.444 67.347 151.314-126.696 117.667-145.972 121.966-131.198 95.141 46.119 144.062-136.543 91.688 52.615 149.130-118.260 91.168 48.326 143.186-133.368 93.120 41.175 134.661 -96.391 93.236 35.979 131.496 -88.823 93.560 62.328 136.166-104.213 94.811 138.234 127.205 -49.309 93.661 56.850 150.333 -30.679 93.574 46.403 0.000 0.000 91.757 50.253 137.950-124.398 88.385 46.883 138.775 -90.735 91.690 42.966 135.704-103.739 88.829 41.847 114.704 -75.686 91.528 55.691 145.094 -40.048 93.140 72.726 139.918-103.969 91.949 33.466 109.257 -83.716 111.232-147.858 151.248 -20.852 120.920 81.682 121.197-128.480 93.591 33.952 116.382 -76.349 93.293 48.534 136.757 -97.248 92.979 37.503 115.762 -76.344 92.937 37.331 129.409 -76.204 94.719 33.187 110.909 -83.143 93.352 42.300 146.582 -38.312 90.399 40.905 149.928-126.970 91.825 37.911 129.331 -76.123 92.341 39.918 129.785 -87.749 92.114 42.288 129.315 -76.121 92.227 37.677 137.534 -84.424 92.203 45.372 136.984 -92.157 90.959 48.012 143.422 -43.465 91.103 40.020 142.582-130.489 95.295 66.645 149.710 -23.507 93.020 0.000 129.406 -76.261 # 108 total E -2.41522E+02 rmsd from N 0.000 %NC 0.00 93.882 151.624 134.927 -86.876 93.902 43.063 141.843-117.554 92.044 36.582 143.596-134.709 91.965 44.716 129.805 -76.635 90.730 43.642 133.065 -29.846 92.882 33.584 139.255-141.779 93.539 41.404 130.131 -88.846 92.123 35.040 138.641 -86.017 92.408 48.037 145.472 -40.157 91.608 50.080 138.723-142.123 93.314 55.283 146.876 -39.405 121.541 -24.930 120.606-126.625 94.392-160.329 144.491-136.841 111.507 26.284 152.801 -27.187 95.129 43.908 144.387-136.599 93.938 41.198 133.713 -91.154 93.545 44.660 135.419 -92.161 92.874 43.712 138.869 -90.778 93.869 35.998 138.238 -85.983 96.097 37.744 144.784-137.272 95.351 34.900 0.000 0.000 93.613 48.805 140.236-130.966 91.340 36.725 138.774 -92.718 92.647 41.543 136.061-104.184 91.796 45.285 115.460 -75.981 91.655 43.489 147.528-116.269 93.793 35.319 140.105-109.674 93.379 50.611 143.560-125.744 94.325 153.788 143.372-124.429 93.195 47.850 99.876-114.267 92.374 41.698 116.232 -76.313 93.025 91.533 137.942-103.071 91.888 60.861 116.324 -76.214 92.620 36.874 129.379 -76.163 91.828 37.451 143.181-133.485 91.245 49.107 146.322 -40.485 90.903 43.894 143.797 -43.216 91.832 35.168 129.294 -76.106 92.192 46.157 132.878 -96.163 92.174 38.519 129.054 -76.074 92.588 40.063 137.866 -77.148 92.872 40.018 137.229 -90.526 91.898 46.682 145.075 -40.412 91.448 42.196 142.506-132.713 92.432 63.990 143.010-124.192 93.022 0.000 129.411 -76.268 # 109 total E -2.29601E+02 rmsd from N 0.000 %NC 0.00 93.643 83.644 138.203-101.511 93.603 47.658 139.172-102.524 92.801 39.069 143.695-134.138 92.492 39.977 129.450 -76.228 92.264 44.602 142.362-154.295 91.910 33.922 139.201-149.323 92.733 40.127 129.080 -88.169 89.331 43.804 137.545 -87.648 90.644 56.588 143.358 -44.878 91.321 97.154 136.550-141.924 105.741-158.228 149.494 -30.878 92.783 56.096 100.702-112.413 92.732 33.058 142.862-132.948 92.230 64.218 146.077 -40.701 92.703 134.654 140.118-127.286 123.734-136.509 151.814-117.630 94.088 58.122 133.753 -89.788 93.455 47.343 137.580-102.506 93.355 135.476 140.958 -63.805 93.215 45.934 144.192-135.751 91.572 43.461 0.000 0.000 91.268 53.643 135.924-124.593 92.763 32.567 137.259 -92.129 93.242 38.572 136.617-105.564 91.987 43.399 115.469 -76.251 93.021 41.346 144.354 -41.787 95.268 26.029 137.721-101.509 99.066 47.440 146.491-132.363 96.122 19.702 144.606-125.933 120.399 167.642 123.044-131.503 91.361 51.535 116.345 -76.228 93.548 39.776 137.429-103.286 90.679 39.851 115.904 -75.739 91.885 46.131 129.564 -76.508 86.359 44.636 140.567-129.873 89.146 47.590 144.534 -42.133 89.670 40.409 141.641 -44.298 92.386 36.486 129.254 -76.074 93.471 44.087 130.293 -87.255 93.495 33.607 129.358 -76.237 93.923 37.834 140.834 -82.265 93.336 39.070 139.002 -94.572 92.061 45.637 144.876 -41.322 91.569 42.403 142.407-133.474 92.420 62.852 142.927-124.029 93.022 0.000 129.417 -76.276 # 110 total E -2.30656E+02 rmsd from N 0.000 %NC 0.00 94.206 156.450 138.484 -99.899 93.371 52.166 141.827-107.702 90.982 42.126 143.054-132.812 92.420 38.267 129.455 -76.242 92.432 46.411 144.574-152.759 92.356 31.276 139.099-156.332 93.230 47.613 129.824 -87.932 90.876 84.586 139.468 -85.545 90.642 53.489 146.627-110.810 93.578 57.670 139.557-143.019 114.885-173.866 154.882 -22.710 93.359 62.191 100.344-109.542 95.154 36.346 143.588-134.861 93.802 41.253 145.926 -38.886 93.136 44.196 112.292 -84.019 92.986 44.093 132.647 -93.938 93.907 36.876 131.028 -88.890 93.970 54.139 138.520 -98.547 116.452-169.971 141.062-122.177 93.035 38.214 143.791-134.140 93.899 171.140 0.000 0.000 93.152 42.234 133.133 -37.493 93.010 40.246 141.584 -89.287 93.405 35.362 136.364-104.557 92.360 45.578 115.177 -76.240 92.564 36.965 143.387 -45.277 94.713 42.691 141.848-119.711 95.481 50.616 144.524-127.363 100.307 43.842 150.933 -20.501 120.175-153.023 123.496-132.200 94.740 108.910 116.319 -76.636 93.825 162.577 134.915 -97.342 96.599 43.611 116.900 -76.579 93.574 32.237 129.467 -76.214 91.214 46.500 142.944-132.737 91.362 56.817 144.388 -43.353 89.688 40.028 147.308-115.959 91.956 37.844 129.353 -76.104 93.002 40.429 131.120 -84.648 92.507 41.405 129.322 -76.075 93.027 33.512 137.530 -84.627 92.971 42.988 136.877 -93.309 91.878 49.780 144.138 -42.417 90.478 46.886 142.147-137.656 91.336 79.562 142.497-123.269 93.018 0.000 129.320 -76.211 # 111 total E -2.28271E+02 rmsd from N 0.000 %NC 0.00 93.631 73.965 138.124-102.106 93.576 50.818 139.522-102.438 92.912 37.158 143.668-134.210 92.485 41.633 129.469 -76.218 92.106 40.981 139.252-146.023 91.844 37.051 138.951-149.407 92.714 40.718 129.586 -87.535 91.160 37.521 138.507 -85.479 91.265 47.643 149.618-118.813 92.689 37.284 138.166-142.467 93.805 155.063 145.714 -38.867 122.924 143.648 120.436-125.841 88.046-113.589 141.616-131.229 92.202 94.298 154.116-134.268 89.914 54.405 142.460-132.365 93.258 122.019 129.623 -84.810 97.389-169.487 135.348 -86.427 94.205-100.770 136.392-102.777 93.464 54.602 141.055-121.101 94.474 47.175 143.815-133.013 120.225 5.998 0.000 0.000 94.022 47.545 134.306-123.552 94.992 27.984 138.913 -90.919 93.712 41.065 139.963-110.822 92.354 39.910 115.073 -75.910 93.119 36.427 146.040 -40.623 94.090 44.191 139.672-106.350 93.829 45.061 143.767-125.771 116.831-169.442 152.493 -18.785 121.730 0.846 121.007-127.730 94.472 57.354 116.605 -76.479 93.826 30.879 138.148-105.503 91.597 46.622 116.325 -76.178 91.845 43.315 129.297 -76.180 88.262 42.867 141.665-130.904 91.106 40.410 144.564 -39.900 91.815 38.947 146.221 -40.176 92.326 37.938 129.324 -76.137 92.135 41.550 129.471 -87.996 91.825 45.104 129.376 -76.314 92.073 38.849 136.712 -71.769 92.287 41.480 137.462 -89.299 91.388 49.275 144.654 -41.688 90.800 41.872 141.973-127.229 92.507 64.845 143.035-124.414 93.011 0.000 129.427 -76.274 # 112 total E -2.34797E+02 rmsd from N 0.000 %NC 0.00 93.613 72.800 137.820-100.967 93.689 52.330 141.432-109.337 92.573 35.688 143.596-133.982 92.232 43.683 129.462 -76.189 91.505 44.810 140.234-147.459 91.087 36.328 138.910-154.253 91.710 40.778 129.102 -89.057 89.083 51.987 138.420 -86.560 91.333 93.823 141.952 -45.731 103.574 -40.798 139.914-149.181 109.423 149.731 153.048 -26.373 119.354-136.756 121.453-129.391 94.443 37.915 143.882-136.680 92.835 48.092 145.730 -39.403 90.968 48.511 144.076-138.677 92.583 43.486 134.542 -91.635 93.195 33.464 130.972 -88.946 93.388 105.893 137.651 -99.405 94.491 89.291 147.661-141.173 94.114 25.202 150.212 -31.823 94.385 48.008 0.000 0.000 92.811 37.274 131.051 -38.509 92.042 43.462 143.059 -93.441 92.396 35.786 136.143-102.680 90.471 45.476 115.175 -76.218 90.991 48.788 143.771 -43.466 92.953 45.146 139.047 -95.377 91.197 57.378 142.424-123.579 96.690 41.222 149.797 -23.917 121.438-134.062 121.381-128.151 92.300 108.223 116.261 -76.325 93.909 150.297 136.426 -97.490 92.155 52.685 116.216 -76.056 92.622 41.412 129.395 -76.168 91.022 38.569 142.861-132.381 90.449 45.599 149.042-125.832 90.528 41.000 144.410 -42.050 91.618 37.897 129.298 -76.104 91.571 44.669 130.240 -80.882 92.171 42.058 129.212 -76.230 92.452 34.575 137.731 -78.708 92.217 48.160 137.137 -90.641 90.644 53.706 143.362 -45.920 89.928 44.877 142.036-129.725 91.937 75.959 142.775-123.659 93.023 0.000 129.362 -76.235 # 113 total E -2.34231E+02 rmsd from N 0.000 %NC 0.00 93.626 75.328 138.102-101.889 93.592 49.380 139.357-102.288 92.914 37.759 143.713-134.104 92.482 41.187 129.467 -76.227 92.215 42.096 140.342-147.428 92.023 35.845 138.854-148.434 92.713 41.258 129.581 -87.153 90.583 38.177 138.206 -86.419 90.931 46.151 149.291-124.888 91.975 55.794 137.414-140.152 93.375 65.316 146.160 -39.900 121.862-168.809 120.789-126.891 93.917 33.351 143.683-135.351 92.758 51.326 145.595 -38.068 90.153 49.959 143.489-139.270 92.022 45.196 133.049-101.820 92.240 38.386 130.607 -88.757 93.434 160.724 134.309 -96.290 93.571 64.229 142.946-143.386 92.267 36.227 143.547-133.324 95.889 156.210 0.000 0.000 136.405 -70.366 110.073 -87.348 92.417 48.509 141.241 -90.077 93.289 32.861 134.449 -96.924 92.896 46.575 115.967 -76.407 91.931 40.560 150.711-121.928 93.464 52.410 139.647 -98.474 92.435 35.265 143.018-124.638 118.931-165.519 152.322 -18.927 92.885 65.788 99.896-114.492 91.072 45.202 116.003 -76.163 92.471 51.681 134.191 -83.646 92.933 36.620 115.766 -76.201 93.619 32.221 129.448 -76.231 98.771 27.790 145.196-138.133 95.136 38.236 146.736 -38.047 92.811 37.404 145.604 -41.778 92.272 38.900 129.317 -76.151 92.252 42.216 129.882 -87.214 92.309 38.925 129.351 -76.261 92.792 38.914 138.040 -76.101 92.896 39.525 137.287 -91.074 91.801 47.187 144.815 -41.372 91.304 41.958 142.159-131.784 92.490 63.698 143.008-124.203 93.017 0.000 129.430 -76.289 # 114 total E -2.39431E+02 rmsd from N 0.000 %NC 0.00 93.596 74.569 137.585 -99.867 93.688 54.549 141.729-105.609 91.862 34.917 143.287-133.449 92.195 44.903 129.460 -76.200 91.920 43.568 140.668-149.472 90.993 36.023 139.534-148.812 91.780 42.531 129.470 -86.578 87.881 50.924 139.800 -86.658 89.877 40.726 144.461 -99.800 95.378 54.788 139.584-141.846 94.553 73.619 149.208-117.469 121.151-139.714 122.124-129.334 93.669 44.640 143.641-135.173 92.123 45.426 144.911 -39.065 89.922 45.195 142.110-133.295 92.734 45.956 132.173-103.971 92.867 32.699 131.051 -89.312 93.549 127.980 138.983-108.033 93.422 68.563 140.170 -99.996 93.042 34.176 143.796-134.415 95.430 41.935 0.000 0.000 94.284 34.414 133.419-123.303 91.943 44.597 139.825 -93.230 91.971 41.037 135.909-103.025 89.201 42.017 114.798 -76.135 91.221 42.547 144.299 -41.714 92.893 48.721 140.658-105.925 90.286 54.907 142.023-122.798 91.460 44.176 142.152-121.865 119.333 164.439 121.405-129.589 94.878 38.357 116.623 -76.529 94.113 39.144 137.650-103.786 92.811 39.747 116.481 -76.535 92.318 43.579 129.433 -76.254 89.113 40.696 141.906-131.343 91.213 43.028 145.367 -40.159 91.269 39.471 144.584 -40.840 92.104 38.292 129.320 -76.135 92.457 42.490 129.888 -87.960 92.496 38.035 129.283 -76.214 92.934 38.735 137.849 -74.401 93.071 39.712 137.301 -90.731 91.996 46.016 144.917 -41.240 91.577 42.272 142.472-133.528 92.446 63.304 143.012-124.147 93.021 0.000 129.410 -76.268 # 115 total E -2.40394E+02 rmsd from N 0.000 %NC 0.00 93.544 71.507 136.407 -95.622 93.781 47.746 139.338-103.887 94.049 36.084 144.043-134.949 92.767 39.736 129.492 -76.221 93.205 41.289 141.750-148.803 92.517 36.019 139.464-149.783 93.165 39.814 129.861 -86.923 92.164 36.936 138.857 -86.085 91.763 44.986 148.464-119.884 93.243 44.432 138.238-142.910 93.826 142.161 145.764 -39.123 123.023 146.092 119.836-124.809 91.917 31.406 142.926-133.764 92.478 63.979 146.102 -39.483 90.547 43.206 140.469-122.074 93.272 52.438 133.585 -93.379 93.727 32.186 132.489 -88.866 94.304 150.530 140.755-108.548 93.811 63.451 142.778-120.684 93.738 27.804 143.996-134.421 94.154 57.802 0.000 0.000 119.527 31.501 157.203 175.292 91.619 39.510 139.774 -89.977 92.664 41.747 136.399-104.887 91.698 46.082 115.242 -76.210 91.394 45.017 151.596-116.574 93.806 40.358 140.633-117.526 94.278 49.648 143.967-126.421 131.368 169.398 113.793 -81.937 94.153 41.560 99.430-112.050 93.360 44.362 116.383 -76.404 92.890 70.416 138.857-103.673 92.871 35.849 115.149 -76.531 92.507 42.188 129.389 -76.179 92.227 41.781 143.186-133.824 93.405 36.527 146.041 -38.026 92.786 39.394 147.381 -37.317 92.246 37.319 129.310 -76.139 92.490 43.516 129.900 -87.254 92.391 37.896 129.352 -76.265 92.796 39.445 138.766 -75.662 92.865 38.858 137.299 -90.872 91.854 47.212 144.830 -41.363 91.349 41.736 142.127-131.427 92.496 63.710 143.014-124.454 93.020 0.000 129.417 -76.269 # 116 total E -2.38722E+02 rmsd from N 0.000 %NC 0.00 93.642 80.871 138.262-101.860 93.595 48.513 139.333-102.394 92.875 37.959 143.740-134.187 92.475 40.800 129.496 -76.227 92.391 42.361 141.988-152.963 91.147 35.070 138.765-148.256 92.443 42.927 131.735 -87.601 90.137 39.018 139.219 -85.814 89.724 44.597 147.573-117.330 91.673 54.454 136.491-138.765 93.608 45.247 145.386 -39.424 93.428 33.966 100.949-114.146 91.272 55.181 142.233-131.743 91.869 89.079 146.331-121.190 90.796 56.482 142.958-136.214 93.127 50.247 132.480 -91.248 95.572-177.073 132.059 -91.076 94.323 61.346 137.866-106.559 95.734 119.375 140.629-102.657 122.293 -99.228 154.246 -13.040 96.631 38.445 0.000 0.000 92.224 48.147 138.759-121.348 92.301 37.341 139.063 -93.105 92.963 40.075 136.291-105.871 91.348 41.143 115.200 -76.217 91.191 56.294 149.192-123.225 92.760 45.129 137.555 -88.736 91.169 49.605 142.451-123.845 93.334-178.160 143.283-124.348 92.981 68.637 99.891-114.787 91.818 42.817 116.139 -76.231 92.894 47.445 136.166 -91.940 91.357 40.296 115.859 -76.314 92.418 37.660 129.351 -76.173 90.588 41.167 142.549-132.187 90.831 43.199 148.413-121.788 90.736 40.972 145.379 -40.783 91.598 37.469 129.291 -76.104 91.265 48.443 129.932 -80.351 92.091 40.247 128.823 -75.958 92.797 36.182 137.855 -83.997 93.436 40.384 136.983 -92.849 92.628 41.762 144.469 -41.053 92.616 43.297 143.119-139.910 92.375 61.445 142.980-124.139 93.020 0.000 129.414 -76.266 # 117 total E -2.27146E+02 rmsd from N 0.000 %NC 0.00 93.802 104.735 139.932-108.866 93.031 55.961 144.747-118.847 89.485 40.081 142.646-132.486 91.825 43.240 129.416 -76.161 90.148 42.203 139.339-136.189 91.842 38.637 137.959-150.587 91.984 39.925 129.022 -88.383 88.866 41.457 138.337 -86.986 89.964 52.982 144.696-111.643 90.579 68.960 136.767-139.548 93.494 108.140 146.116 -39.334 121.830-165.627 119.512-124.962 94.490 95.348 143.762-135.669 117.188-131.871 156.392-134.988 93.185 49.720 143.597-135.222 93.387 38.913 132.867 -90.375 92.859 56.610 135.184 -80.782 93.116 43.236 136.913-110.352 92.935 103.694 138.658 -98.738 123.730 -20.016 112.814 -84.971 94.014 147.290 0.000 0.000 126.438-107.250 156.396 178.878 94.374 35.160 140.404 -90.845 93.417 39.832 137.091-105.655 91.440 47.579 115.476 -76.016 92.833 47.332 145.199 -40.320 93.750 32.947 139.839-109.699 93.597 59.863 143.675-125.977 96.201-175.392 144.541-127.495 92.570 68.422 99.831-114.852 90.561 53.042 115.914 -76.119 92.259 66.082 137.433-101.478 89.437 42.973 115.222 -75.987 92.744 39.585 129.402 -76.171 98.287 25.233 111.101 -82.988 94.211 40.947 147.326 -37.027 91.642 39.371 144.832 -42.776 91.855 41.367 129.276 -76.116 91.716 41.272 130.086 -83.234 92.144 39.031 129.301 -76.214 92.248 40.979 137.550 -76.746 92.083 53.420 137.283 -90.728 89.876 49.686 145.128-112.178 90.829 43.603 142.862-127.104 92.432 67.913 143.022-124.064 93.019 0.000 129.417 -76.258 # 118 total E -2.33921E+02 rmsd from N 0.000 %NC 0.00 93.628 76.432 138.110-101.686 93.607 50.358 140.022-102.902 92.702 37.497 143.599-133.878 92.499 40.812 129.482 -76.272 92.472 42.104 140.394-146.637 94.867 30.956 142.166-151.136 95.784 33.242 132.289 -86.778 98.111 28.935 140.198 -85.008 94.680 38.509 145.467 -39.222 95.306 55.563 137.414-153.505 92.822 43.400 145.196 -40.350 94.207 35.336 100.044-109.868 96.117 65.756 143.397-133.803 124.405-133.504 160.192-140.261 108.278 -91.847 148.389-145.946 94.286 56.203 134.609 -91.837 93.578 39.555 133.510 -87.781 92.804 74.475 135.582 -97.052 93.795 40.413 129.204-109.988 94.916 40.004 144.325-135.843 96.983 32.280 0.000 0.000 96.204 41.081 142.761-130.638 91.756 41.232 142.580 -94.310 92.109 38.989 136.074-103.057 90.658 45.477 114.858 -75.924 91.233 48.062 145.692-115.249 93.349 38.795 139.621-106.981 92.166 45.552 142.947-124.682 94.181 156.001 143.409-124.694 93.155 51.697 99.914-114.043 91.823 41.719 116.144 -76.256 93.000 92.017 137.925-102.931 91.702 58.860 116.465 -76.185 92.551 39.148 129.370 -76.159 91.868 35.925 143.178-133.515 91.374 54.744 147.458 -38.238 89.631 44.552 144.598 -42.121 91.100 36.908 129.244 -76.063 91.168 45.805 129.237 -87.489 91.793 43.024 129.022 -76.068 92.083 37.842 137.269 -78.525 92.280 44.311 137.258 -90.359 91.128 48.021 143.653 -42.682 91.138 42.181 142.085-130.384 92.486 64.795 143.045-124.418 93.025 0.000 129.422 -76.276 # 119 total E -2.41854E+02 rmsd from N 0.000 %NC 0.00 93.590 75.240 137.346 -98.746 93.761 51.094 140.954-106.827 93.128 35.405 143.757-134.305 92.475 41.793 129.492 -76.235 92.308 43.237 141.341-147.451 92.839 34.680 139.238-159.035 92.613 36.542 129.474 -88.154 88.755 48.330 138.017 -87.273 89.503 58.689 139.260 -51.707 88.105 70.251 135.435-140.175 92.354-167.415 144.957 -40.931 92.799 67.077 100.837-113.885 92.076 50.576 142.669-132.726 93.147 95.891 147.001 -37.064 91.389 60.119 144.741-140.306 92.012 38.813 133.491 -91.957 92.131 55.484 131.962 -87.133 92.443 94.827 132.715 -89.335 91.848 53.996 137.273-123.235 90.437 45.944 143.255-134.165 91.185 47.729 0.000 0.000 90.162 54.340 135.810-117.615 90.616 40.307 139.169 -90.669 92.618 38.983 135.706-103.137 91.792 43.390 115.385 -76.065 91.729 45.057 149.179-121.476 93.365 43.382 140.404-107.214 92.460 7.869 143.066-124.825 119.740 146.793 111.737 -82.124 93.243 48.104 100.076-115.037 92.530 39.994 116.253 -76.330 93.388 63.283 137.663-104.195 92.623 139.406 116.540 -75.869 92.473 44.052 129.366 -76.156 90.037 40.504 142.621-131.976 91.382 44.580 143.931 -41.005 91.620 36.415 144.233 -43.966 92.365 40.395 129.340 -76.132 92.855 42.579 131.595 -94.317 92.507 37.445 129.425 -76.207 93.279 36.803 138.060 -80.770 93.871 37.717 136.989 -92.356 92.789 44.383 145.833 -39.726 92.012 42.187 142.679-136.018 92.420 62.967 143.003-124.176 93.021 0.000 129.407 -76.264 # 120 total E -2.33033E+02 rmsd from N 0.000 %NC 0.00 93.782 104.263 139.463-106.385 93.440 50.840 139.306-101.709 92.004 40.010 143.423-133.547 92.307 40.776 129.434 -76.172 92.556 43.975 143.162-159.129 91.081 34.603 138.783-148.179 92.540 42.998 129.528 -87.378 90.013 39.336 137.309 -85.101 90.299 47.492 146.637-110.929 91.130 44.189 136.635-139.949 92.818 34.455 147.733 -39.228 119.042 140.105 120.649-127.773 96.183 35.389 143.970-140.700 93.951 46.481 146.128 -38.662 94.231 31.532 143.733-134.870 93.699 56.122 140.598 -97.250 92.759 49.417 133.075 -92.140 93.030 83.944 137.321 -99.020 108.510-155.505 139.520-116.922 94.218 48.546 144.098-134.927 94.156 59.366 0.000 0.000 120.586 -0.297 158.009 175.673 91.805 56.668 138.145 -90.109 92.445 42.736 136.208-104.291 88.681 58.377 115.431 -76.169 91.748 48.399 143.973 -41.428 94.144 69.950 139.803-111.068 94.024 -61.893 143.678-125.863 115.973-149.551 151.856 -19.789 123.776 121.048 120.155-125.234 96.441 17.540 116.837 -76.703 94.188 54.260 137.619-103.558 91.437 48.108 116.056 -75.875 92.505 42.231 129.411 -76.242 90.854 37.777 142.789-133.103 91.663 55.432 145.436 -39.522 90.597 46.935 148.736-122.987 91.835 35.763 129.388 -76.100 93.096 39.172 129.782 -88.922 92.822 38.137 129.215 -76.099 93.084 41.705 140.064 -93.279 92.852 37.132 136.599 -91.411 91.856 44.361 144.910 -41.167 91.943 42.701 142.187-132.295 92.322 61.936 142.938-123.346 93.018 0.000 129.412 -76.269 # 121 total E -2.36461E+02 rmsd from N 0.000 %NC 0.00 93.632 78.634 138.142-101.553 93.580 50.166 139.647-102.582 93.005 36.899 143.720-134.234 92.492 41.398 129.480 -76.211 92.350 41.463 140.811-151.182 90.945 37.930 139.367-151.174 91.871 41.191 129.212 -87.214 89.549 42.628 137.517 -84.356 91.237 41.652 145.852-107.122 94.944 35.710 139.016-142.954 95.161 156.822 146.211 -38.039 121.481 142.596 120.926-127.326 88.843-136.058 141.832-131.591 117.803 166.544 158.332-142.510 110.621 -79.604 149.206-147.500 94.056 61.348 134.257 -90.638 93.452 39.089 133.383 -87.073 92.690 59.875 137.452 -99.401 92.108 48.394 137.469-107.420 91.621 42.632 143.631-135.068 91.604 44.423 0.000 0.000 91.324 61.475 133.557-123.464 88.534 44.933 137.929 -90.336 92.053 37.676 133.633 -96.340 91.900 43.795 114.800 -75.108 93.134 35.811 147.188 -39.346 93.997 42.650 139.712-106.539 93.663 36.537 143.628-125.659 116.659-166.523 152.152 -19.700 121.974 1.523 120.941-127.487 94.800 57.653 116.652 -76.499 93.967 29.497 138.235-105.781 91.718 48.066 116.669 -76.232 91.824 43.216 129.306 -76.197 87.800 43.469 141.548-130.590 90.685 42.128 144.774 -40.751 91.231 39.316 145.088 -41.043 92.232 37.815 129.315 -76.125 92.282 40.892 129.588 -88.084 91.998 42.760 129.352 -76.265 92.207 39.269 136.421 -70.548 92.370 42.367 137.458 -89.532 91.325 48.016 144.603 -41.779 91.022 42.260 142.324-128.528 92.479 64.565 143.015-124.432 93.023 0.000 129.415 -76.270 # 122 total E -2.35181E+02 rmsd from N 0.000 %NC 0.00 93.893 125.743 139.481-104.185 93.194 48.235 137.960 -97.528 93.319 44.054 143.752-134.549 93.238 32.796 129.476 -76.247 94.459 40.659 143.951-159.345 92.252 35.811 141.667-157.529 92.388 44.568 129.878 -85.691 89.759 37.389 138.064 -84.917 91.580 56.645 146.891-116.844 92.642 61.502 138.386-143.076 91.349-120.431 147.568-110.011 120.857 96.190 120.954-127.677 114.459 175.322 153.331 -18.531 92.523 63.231 151.797-129.924 93.560 30.168 143.669-135.159 92.926 48.038 136.718 -83.311 92.557 46.298 130.365 -91.546 93.044 52.692 137.648 -97.423 105.291 1.657 141.683-110.479 110.312 38.209 152.173 -24.420 94.821 36.156 0.000 0.000 92.282 53.346 135.065-127.398 89.778 40.566 138.671 -91.929 92.239 40.861 135.813-103.198 91.011 43.550 115.414 -75.991 91.967 61.241 149.561-119.716 93.813 68.998 139.575-105.286 92.479 -61.938 142.964-124.651 114.730-146.893 151.709 -20.037 122.429 114.313 120.552-126.651 94.772 26.769 116.578 -76.511 93.959 50.118 137.591-103.063 92.192 38.057 115.979 -76.663 92.052 42.199 129.375 -76.253 87.456 47.677 141.573-130.234 90.644 47.857 144.693 -40.955 90.255 40.764 145.194 -39.268 91.573 37.271 129.271 -76.079 91.728 44.717 129.531 -86.351 91.911 43.146 129.312 -76.211 92.010 36.139 137.777 -78.020 92.134 44.764 137.298 -90.715 90.970 46.325 143.253 -44.299 91.196 42.898 142.655-129.002 92.454 63.821 142.976-124.556 93.023 0.000 129.416 -76.271 # 123 total E -2.40024E+02 rmsd from N 0.000 %NC 0.00 93.758 97.155 139.491-107.095 93.374 51.444 139.298-101.469 91.790 40.686 143.331-133.410 92.327 40.629 129.402 -76.133 92.697 43.351 141.227-148.784 92.479 34.234 138.271-148.307 92.574 44.267 129.722 -92.215 89.576 42.541 138.483 -87.244 89.972 62.104 147.308-117.385 90.988 101.231 136.274-141.559 100.645-135.424 148.848 -34.232 120.427 20.240 121.688-129.016 92.990 55.281 143.472-134.154 92.135 95.714 146.984 -39.332 92.574 55.098 143.771-136.766 92.103 34.553 132.773 -91.169 92.146 60.396 131.411 -87.853 92.863 47.827 129.684 -79.952 95.862 29.831 137.744 -99.395 98.878 32.512 145.681-138.680 98.393 33.689 0.000 0.000 95.833 41.786 140.047-130.309 94.842 31.930 138.896 -91.990 93.811 36.357 136.647-105.959 93.342 43.419 115.728 -76.697 92.084 45.043 144.960 -39.297 93.086 37.038 139.738-101.038 92.709 47.440 143.199-125.096 94.661 -98.817 143.620-123.767 119.863 -97.682 121.413-129.371 92.427 81.287 116.353 -76.280 92.948 67.115 136.616-102.392 90.952 99.966 115.435 -76.027 92.977 54.654 129.265 -75.987 95.057 24.900 144.192-136.200 93.525 45.532 146.476 -38.215 91.975 36.363 142.398 -45.958 92.831 40.583 129.077 -76.064 93.842 41.008 130.520 -88.457 93.869 29.639 129.428 -76.292 94.441 42.492 142.588 -90.897 93.314 37.103 135.522 -80.400 92.479 43.112 145.156 -40.788 93.084 35.813 142.709-134.007 93.804 42.809 143.477-124.806 93.045 0.000 129.532 -76.371 # 124 total E -2.44165E+02 rmsd from N 0.000 %NC 0.00 93.704 89.296 139.063-104.939 93.388 50.187 139.474-101.515 91.725 40.506 143.305-133.334 92.330 40.598 129.410 -76.183 92.692 42.450 142.268-146.284 93.262 34.254 138.625-148.465 93.308 41.331 129.953 -87.051 91.384 37.880 138.742 -86.212 91.244 47.761 148.511-114.925 92.328 51.350 137.781-140.300 93.649 60.683 147.095 -38.281 120.914 171.843 120.919-127.677 94.902 38.401 143.822-136.018 93.483 41.270 145.017 -39.512 92.405 57.485 142.586-141.203 92.990 38.207 130.669 -92.299 93.851 44.647 132.201 -88.477 94.396 14.368 138.607-105.939 118.792-173.507 145.731 -94.930 94.581 63.596 144.543-135.624 116.722 177.877 0.000 0.000 124.105 51.717 158.589 170.257 92.544 34.931 140.370 -89.276 93.496 37.145 135.330-106.864 92.388 49.659 115.592 -76.581 92.204 38.763 144.475 -41.340 94.162 55.340 139.593-111.654 95.432 -21.321 144.436-127.220 125.931 173.593 152.993 -17.783 121.892 134.790 119.972-126.112 96.732 25.864 116.879 -76.715 94.020 48.183 139.105-102.760 91.733 37.999 116.188 -76.459 92.567 41.602 129.395 -76.212 92.250 34.595 143.047-133.539 92.194 41.950 145.623 -39.558 90.828 41.011 146.780-122.303 92.075 37.534 129.335 -76.142 92.283 38.557 129.629 -88.359 92.246 41.122 129.313 -76.260 92.825 38.403 137.673 -85.319 92.742 39.887 136.991 -92.851 91.626 48.232 144.761 -41.467 91.080 41.757 142.042-129.782 92.505 64.303 143.033-124.334 93.022 0.000 129.415 -76.268 # 125 total E -2.30864E+02 rmsd from N 0.000 %NC 0.00 93.604 62.647 137.727-102.209 93.634 50.813 139.975-103.601 93.205 36.544 143.788-134.569 92.514 40.273 129.814 -76.595 93.056 39.872 138.383 -25.343 92.641 37.586 140.854-155.113 92.544 39.339 129.403 -87.064 89.705 41.594 138.705 -86.714 91.058 45.543 144.275 -42.821 92.212 53.841 137.694-140.144 93.737 65.689 146.974 -38.960 119.467 -89.044 121.973-130.006 121.294-105.836 113.218 -83.701 94.766 51.654 146.907 -38.037 94.320 30.550 143.963-136.263 93.040 54.863 134.945 -86.128 93.289 48.462 129.430 -94.623 93.280 34.832 137.040 -88.986 94.821 44.060 141.700-156.093 94.055 28.205 144.161-134.353 112.082 -70.236 0.000 0.000 127.326-154.798 157.853 173.766 90.681 50.207 140.937 -89.770 92.374 40.657 136.454-103.768 89.789 46.006 115.587 -75.719 91.930 40.834 145.148 -39.128 93.366 43.407 139.928-108.820 91.768 57.790 142.776-124.135 92.914-172.428 143.303-123.649 92.694 74.857 99.900-114.983 92.003 41.061 116.094 -76.183 93.064 43.535 136.130 -90.977 91.963 38.914 115.876 -76.301 92.592 37.601 129.347 -76.180 90.987 39.972 142.544-132.136 90.994 41.696 146.256-113.476 91.582 39.121 144.789 -41.882 92.169 37.844 129.335 -76.137 92.423 42.488 130.180 -86.847 92.463 38.520 129.320 -76.244 92.882 38.286 137.778 -74.771 93.045 39.868 137.301 -90.807 91.960 46.032 144.812 -41.424 91.584 42.289 142.426-133.515 92.439 63.339 143.014-124.153 93.021 0.000 129.416 -76.272 # 126 total E -2.42137E+02 rmsd from N 0.000 %NC 0.00 93.637 84.427 138.128-100.996 93.617 46.650 139.079-102.678 92.739 39.835 143.629-134.090 92.496 39.209 129.456 -76.242 92.434 45.829 142.935-154.327 92.483 31.752 139.498-149.764 92.965 40.565 129.869 -87.661 90.076 39.863 136.952 -86.024 90.959 52.447 143.957 -41.934 90.084 40.237 137.147-139.685 93.212 32.850 147.003 -40.212 122.846 3.738 120.020-124.580 96.890 47.356 143.344-134.857 93.434 35.696 146.121 -39.092 91.203 47.730 142.349-136.064 92.698 42.566 134.095 -87.769 93.101 39.132 130.922 -89.148 93.347 43.549 137.143-101.667 106.686 169.126 135.066-106.489 93.753 55.790 144.513-135.398 93.703 46.531 0.000 0.000 93.243 106.588 138.415-127.710 91.002 44.183 139.695 -89.791 92.387 40.067 136.492-104.956 90.318 45.090 115.183 -75.945 91.686 43.676 144.399 -40.859 92.938 40.080 140.649-111.265 90.460 62.596 142.136-122.955 92.370 48.577 142.485-122.271 120.059 144.254 121.623-129.219 92.382 39.772 116.193 -76.264 93.548 43.063 137.813-100.784 92.174 38.430 116.562 -75.899 92.480 39.744 129.395 -76.237 88.646 44.001 141.801-130.702 89.461 49.889 147.445-120.483 90.707 37.713 142.985 -43.248 92.327 35.746 129.360 -76.128 92.899 43.782 130.493 -86.636 92.691 36.144 129.239 -76.278 93.177 38.909 138.797 -78.519 93.212 38.730 137.231 -91.646 92.215 45.159 144.919 -41.208 91.812 42.286 142.548-134.599 92.429 62.629 142.973-124.331 93.020 0.000 129.401 -76.259 # 127 total E -2.28392E+02 rmsd from N 0.000 %NC 0.00 93.791 95.925 140.348-110.877 93.344 55.534 139.318-100.443 92.833 37.818 149.984 -32.541 92.135 45.890 129.478 -76.080 91.220 42.056 140.241-147.543 91.569 35.814 137.773-148.094 92.212 43.534 128.858 -85.816 88.899 43.838 137.799 -86.045 89.751 49.947 145.985-112.206 91.694 77.485 136.868-140.171 108.463-156.242 151.729 -28.320 92.803 62.689 100.853-112.960 93.478 33.190 142.980-132.618 92.219 81.873 149.925-116.280 95.219 54.718 141.954-136.761 119.480 -14.770 154.270-112.654 93.940 56.534 133.855 -87.748 93.577 55.152 139.725-118.823 91.942 45.226 134.979 -66.729 92.623 37.995 111.333 -82.926 93.644 39.905 0.000 0.000 93.079 44.202 137.366-122.604 92.520 35.150 139.202 -92.595 92.623 41.649 136.120-104.178 92.338 43.248 115.511 -76.334 92.164 42.798 148.015-110.002 94.278 30.497 140.039-107.455 94.715 53.013 144.220-127.000 95.191 155.999 143.676-125.496 92.816 47.321 99.854-114.265 91.776 45.358 116.131 -76.255 92.811 95.316 138.696-104.008 90.761 66.594 116.106 -76.526 92.148 43.400 129.382 -76.141 90.720 39.987 110.756 -82.765 90.142 47.962 148.626-115.408 90.345 40.223 145.354-104.669 92.550 35.664 129.406 -76.164 93.527 39.357 130.291 -87.699 92.805 37.399 129.335 -76.313 93.423 47.482 138.434 -86.508 93.384 27.755 136.792 -90.100 106.734 177.224 150.728 -29.201 92.582 69.659 144.334-135.226 92.381 96.082 142.967-125.118 93.033 0.000 129.351 -76.191 # 128 total E -2.30649E+02 rmsd from N 0.000 %NC 0.00 93.615 72.344 137.935-101.503 93.580 50.129 139.408-102.547 92.988 37.585 143.712-134.238 92.523 40.985 129.478 -76.223 91.930 41.668 137.468-147.130 91.636 35.743 138.747-150.223 92.150 42.525 129.622 -86.332 89.246 38.332 138.439 -85.027 91.873 52.650 144.731 -39.624 90.393 46.507 137.360-140.624 91.700 48.389 148.009-115.899 121.869-117.788 119.644-125.319 92.788 125.216 143.330-134.184 113.511-149.142 156.182-138.587 108.593-116.186 147.443-145.923 94.108 38.376 135.705 -88.409 93.294 45.861 133.526 -87.675 93.021 97.144 138.059-107.908 92.699 65.151 143.425 -98.765 91.766 34.146 143.456-134.317 93.158 43.055 0.000 0.000 91.859 45.626 134.696-120.914 89.742 46.996 141.522 -92.504 91.855 36.388 135.535-102.757 90.273 46.449 114.995 -76.139 91.590 79.621 144.507 -43.118 93.701 91.752 140.078-109.311 92.150 46.402 109.469 -83.743 113.555-118.510 151.957 -19.326 122.036 15.674 121.009-127.520 94.430 128.073 116.650 -76.466 94.886 -75.332 136.625 -98.929 92.466 82.987 115.169 -75.515 92.651 47.220 129.270 -76.178 90.693 39.863 142.256-131.480 92.309 39.953 148.102-117.672 92.047 37.709 148.217-122.616 92.263 37.970 129.424 -76.224 92.197 45.257 130.225 -86.678 92.421 36.069 129.265 -76.243 92.920 40.165 139.742 -76.330 92.895 38.044 137.274 -90.880 91.872 47.335 144.831 -41.370 91.341 41.739 142.072-131.697 92.478 63.655 142.979-124.352 93.022 0.000 129.412 -76.268 # 129 total E -2.29028E+02 rmsd from N 0.000 %NC 0.00 93.604 54.371 137.602-103.373 95.149-142.602 139.857-110.505 94.952 47.514 111.283 -82.941 92.749 41.567 129.757 -76.582 93.960 37.481 136.057 -27.778 93.833 37.274 140.973-155.176 93.403 44.522 130.122 -86.636 93.238 32.696 139.731 -85.823 92.251 50.047 153.538-142.932 90.130 37.298 139.267-141.905 92.279 166.607 145.107 -40.145 122.483 151.811 121.797-128.029 79.160-162.315 138.840-125.673 93.517 63.172 152.473-138.939 92.436 33.302 143.270-134.537 93.348 44.834 133.565 -90.068 93.251 52.381 132.199 -82.658 93.177 52.782 138.017 -98.833 103.008 0.894 141.296-110.447 109.949 40.743 152.114 -25.451 95.536 34.274 0.000 0.000 93.709 51.756 139.704-128.980 91.212 38.305 138.441 -91.869 92.816 39.842 136.523-102.655 92.450 43.026 115.512 -75.758 92.359 38.741 148.720-118.889 94.179 43.000 139.456-106.637 94.678 31.359 144.156-126.641 123.368-171.293 152.927 -17.807 92.915 67.245 99.848-114.370 91.300 47.048 116.072 -76.180 92.396 80.209 136.257 -92.947 91.499 45.549 115.661 -76.229 92.818 36.489 129.410 -76.181 94.594 34.671 143.974-135.268 92.220 39.992 147.824-109.961 92.604 42.720 144.995 -41.940 92.700 33.553 129.342 -76.167 93.019 45.154 142.439 -95.467 92.031 36.927 129.336 -76.235 92.150 42.734 137.500 -72.131 92.066 48.750 137.311 -89.388 89.756 50.549 146.131-111.711 90.689 42.726 142.344-126.366 92.450 67.989 143.019-124.180 93.020 0.000 129.422 -76.271 # 130 total E -2.33140E+02 rmsd from N 0.000 %NC 0.00 93.568 67.954 136.910 -98.061 93.830 49.503 138.858-103.175 93.657 37.179 143.927-134.627 92.503 42.065 129.440 -76.295 90.877 44.825 136.265-145.964 88.780 48.940 138.463-149.265 91.809 37.587 131.033 -90.686 88.552 51.008 142.793 -80.272 90.845 29.514 145.931-113.276 94.515 47.914 140.262-143.375 93.729 117.143 145.044 -41.610 93.968 88.279 100.002-111.841 122.985-111.127 113.637 -84.227 106.755 47.963 151.054 -29.363 92.539 38.943 143.506-134.700 93.065 55.943 137.169 -88.156 93.227 34.146 132.513 -88.130 93.360 49.224 138.574-108.218 94.134 55.136 139.095-110.523 115.669 -92.410 152.704 -21.416 95.545 97.130 0.000 0.000 119.732 29.810 160.143 171.657 93.251 37.801 138.787 -88.605 94.038 35.001 136.892-106.219 93.784 41.796 115.663 -76.015 92.895 40.446 146.922 -39.063 93.391 55.614 139.886 -96.485 92.133 52.877 142.870-124.304 116.576-162.447 152.056 -19.271 93.005 61.218 99.888-114.485 91.925 40.932 116.139 -76.255 92.829 46.283 135.153 -86.027 93.787 36.675 116.092 -76.378 93.865 30.600 129.473 -76.256 98.812 28.960 145.216-138.223 94.607 37.982 146.558 -39.767 92.445 40.386 145.399 -40.982 91.671 37.947 129.272 -76.126 91.343 45.717 129.427 -85.271 92.379 38.577 129.061 -76.055 93.152 36.476 137.947 -80.466 93.591 38.347 137.054 -92.180 92.612 44.885 145.150 -40.998 91.882 42.034 142.549-135.110 92.452 62.701 143.023-124.223 93.021 0.000 129.412 -76.266 # 131 total E -2.43318E+02 rmsd from N 0.000 %NC 0.00 93.698 86.658 139.010-104.797 93.363 51.525 139.493-101.274 91.866 38.991 143.355-133.383 92.283 42.663 129.606 -76.282 92.201 40.193 142.920-145.615 92.533 35.848 138.437-148.313 93.132 40.652 128.417 -82.152 90.904 40.592 139.508 -84.091 90.579 47.318 148.284-117.777 92.954 50.060 137.193-140.242 94.307 58.976 147.201 -37.185 123.288 170.690 120.360-125.271 94.103 31.720 143.729-135.672 93.124 49.372 145.970 -38.926 89.660 53.659 142.182-129.480 92.622 42.505 128.656 -93.550 93.318 44.424 131.256 -88.674 93.875 21.839 137.386-101.214 115.654-175.406 144.268-123.065 94.539 47.159 144.381-135.406 111.864-171.790 0.000 0.000 121.302 47.439 155.991 179.210 90.073 47.889 140.275 -88.559 92.626 36.671 134.636-107.258 91.955 42.382 115.199 -76.206 92.056 79.910 149.772-118.891 93.234 53.095 139.734-104.331 91.092 39.823 142.441-123.755 93.773 179.950 143.668-124.772 92.963 72.445 99.823-114.682 91.204 46.125 116.062 -76.156 92.910 46.154 135.318 -92.170 92.226 38.585 115.952 -76.103 92.843 38.325 129.383 -76.170 92.203 36.974 143.019-133.342 91.819 47.641 148.178 -38.812 89.100 41.889 147.739-109.161 91.472 37.300 129.300 -76.091 91.877 43.100 129.696 -81.848 92.359 39.374 129.144 -76.006 93.120 35.082 137.709 -86.544 93.318 40.826 136.812 -94.012 92.205 43.814 144.154 -42.265 92.009 42.942 142.704-136.853 92.373 62.395 143.027-123.921 93.015 0.000 129.420 -76.275 # 132 total E -2.28663E+02 rmsd from N 0.000 %NC 0.00 93.557 74.383 136.662 -96.164 93.861 49.074 140.370-108.780 94.954 33.508 150.232 -31.635 92.575 41.950 129.479 -76.208 92.667 44.251 142.978-153.288 91.122 36.383 142.064-156.563 91.450 42.641 129.220 -86.233 87.782 56.655 139.480 -87.021 89.479 46.880 144.466-101.476 91.774 51.263 140.779-139.153 92.603 50.729 148.329-116.387 120.833 -81.713 121.351-128.451 104.095-149.013 147.122-142.936 93.299 62.681 149.007-119.349 94.179 33.248 143.881-135.889 93.444 48.949 133.542 -90.002 93.634 73.805 128.341 -87.107 93.393 59.953 139.140-110.484 111.888 -16.264 142.807-119.079 127.223 30.110 113.262 -84.244 95.386 43.063 0.000 0.000 120.692 8.224 157.659 178.508 90.252 51.571 140.113 -91.098 92.058 46.949 136.847-106.507 89.184 44.603 114.673 -75.741 90.755 40.788 140.961 -84.902 94.308 43.170 139.036-115.771 93.869 45.428 143.751-125.897 97.115 37.540 150.059 -23.214 119.486-138.784 122.622-131.541 93.933 105.239 116.527 -76.486 93.993 149.662 137.161-103.266 93.527 50.388 116.414 -76.223 92.601 39.316 129.396 -76.179 89.800 43.492 142.467-131.663 90.488 46.880 146.684-112.456 91.436 36.303 144.383 -42.455 92.625 36.137 129.382 -76.154 93.299 41.980 129.897 -82.739 92.693 37.398 129.398 -76.351 93.067 37.973 138.054 -73.749 93.276 37.873 137.284 -90.767 92.332 45.734 145.194 -40.619 91.695 42.152 142.529-134.580 92.357 64.421 142.952-124.393 93.021 0.000 129.401 -76.262 # 133 total E -2.42954E+02 rmsd from N 0.000 %NC 0.00 93.609 68.952 137.785-101.398 93.625 52.315 140.115-104.985 92.907 35.597 143.684-134.138 92.437 43.149 129.487 -76.215 92.285 38.358 138.924-143.232 92.447 39.321 141.887-158.686 92.672 35.659 130.430 -84.658 90.785 41.118 140.058 -85.297 92.724 37.149 142.651 -43.978 95.844 52.447 138.032-147.654 92.286 32.512 149.129-118.524 119.833-106.322 120.374-127.542 90.721 -51.173 143.120-133.045 107.092-107.090 152.406 -27.855 106.312-132.684 148.079-147.145 94.410 39.644 134.363 -90.943 93.519 48.564 133.649 -87.525 93.286 98.841 139.654-113.157 92.849 51.252 133.735 -55.450 92.346 41.457 143.637-134.541 93.647 42.865 0.000 0.000 93.723 42.253 138.316-122.400 93.654 35.222 138.710 -91.048 93.615 39.350 136.398-105.137 93.340 39.246 115.394 -76.347 92.894 75.940 152.011-137.247 93.097 61.100 140.599-104.275 92.309 -6.849 142.934-124.641 124.376 148.655 152.682 -18.138 120.793 148.507 120.862-127.738 94.766 39.071 116.484 -76.565 93.663 43.673 135.187 -97.364 93.004 92.608 115.691 -75.712 92.757 44.740 129.406 -76.215 93.782 30.599 143.786-134.948 93.223 45.952 147.680 -37.015 91.630 40.759 145.194 -41.481 92.163 36.395 129.309 -76.146 91.957 42.483 129.267 -87.959 92.021 48.684 129.270 -76.279 92.383 36.425 135.987 -73.419 92.945 39.934 137.380 -89.894 92.580 44.864 144.973 -40.966 92.302 40.883 143.005-132.119 92.731 63.054 143.139-126.180 93.021 0.000 129.412 -76.267 # 134 total E -2.30171E+02 rmsd from N 0.000 %NC 0.00 93.542 51.738 136.181 -97.900 93.680 52.309 140.196-103.986 94.290 37.796 144.102-135.154 93.001 35.228 129.499 -76.229 94.673 43.087 148.287-163.545 91.393 35.835 141.193-156.280 91.813 41.700 129.531 -85.462 88.613 49.045 139.652 -85.255 90.172 44.052 142.696-101.734 92.454 50.939 138.003-144.080 93.088 39.801 149.544-121.681 93.616 55.117 101.211-111.608 92.736 90.439 149.761 -33.294 91.325 -77.296 146.875-117.300 93.984 119.319 143.797-135.392 122.078 153.739 153.663-134.706 94.462 87.616 136.123 -82.172 93.654 101.705 137.579-102.850 106.666-173.945 139.860-131.408 95.601 56.863 111.401 -82.998 93.894 44.429 0.000 0.000 92.757 39.979 133.640-122.505 91.690 41.793 139.686 -92.740 92.492 41.740 135.822-103.629 91.012 41.557 115.025 -75.901 91.574 42.783 147.478-116.953 93.386 46.059 140.360-105.840 91.522 43.577 142.635-124.052 93.133 150.787 143.174-127.058 93.297 62.287 99.896-114.875 92.245 37.146 116.167 -76.266 93.160 47.320 137.445-105.733 89.884 47.656 115.851 -76.000 91.954 40.381 129.335 -76.155 89.499 41.297 110.640 -82.803 90.241 52.971 151.453-131.084 89.335 38.439 146.792-113.049 91.960 36.911 129.372 -76.130 92.349 44.499 131.322 -76.314 92.293 40.985 129.165 -76.068 93.029 31.741 137.467 -84.773 93.176 43.778 136.921 -94.042 91.792 42.982 143.233 -45.109 91.973 43.678 143.053-135.193 92.364 62.143 142.996-124.104 93.019 0.000 129.416 -76.268 # 135 total E -2.37910E+02 rmsd from N 0.000 %NC 0.00 93.623 73.230 138.053-101.844 93.594 50.019 139.462-102.718 92.957 37.475 143.701-134.203 92.508 41.165 129.481 -76.219 92.353 41.293 140.058-144.202 92.530 36.013 138.806-149.221 92.950 40.750 130.212 -87.504 91.625 36.853 138.165 -83.963 92.029 46.900 147.546-123.521 91.920 37.778 137.976-141.921 92.086 137.607 148.775-112.071 92.612 61.700 100.972-112.102 91.683 102.105 142.824-133.584 106.460-154.240 150.826 -29.960 94.287 54.608 144.071-135.784 94.413 31.641 131.739 -90.184 93.938 48.699 138.707 -74.132 93.781 35.190 133.598 -95.238 97.113 30.160 139.597-106.955 98.855 32.484 145.618-138.511 97.942 33.494 0.000 0.000 95.619 40.027 142.965-133.207 92.848 37.725 139.283 -92.022 92.853 40.901 136.301-103.968 91.728 43.682 115.154 -76.183 91.872 46.897 148.223-124.444 93.855 90.282 139.581-106.303 93.893 -63.776 143.541-125.999 117.998 -90.167 152.706 -19.925 119.978 90.820 121.533-129.368 91.610 38.698 116.071 -76.195 92.762 68.129 135.057 -95.752 91.712 46.706 116.000 -75.973 92.823 34.308 129.391 -76.178 93.104 36.323 143.542-134.199 91.822 46.746 146.387 -40.969 90.938 41.611 143.903 -43.143 91.814 36.201 129.288 -76.106 92.135 44.371 130.521-101.000 92.023 41.070 129.257 -76.108 92.323 41.791 137.875 -76.459 92.893 37.524 137.270 -90.331 92.010 48.118 145.207 -39.270 91.431 41.268 141.885-133.240 92.483 64.531 143.030-124.242 93.022 0.000 129.409 -76.267 # 136 total E -2.36776E+02 rmsd from N 0.000 %NC 0.00 93.642 73.906 138.377-103.078 93.535 51.425 139.400-102.293 92.848 37.052 143.655-134.132 92.433 42.538 129.549 -76.223 91.947 40.299 138.121-147.656 90.649 38.114 137.203-148.687 91.795 44.298 129.343 -84.163 89.550 45.480 138.623 -82.420 91.105 33.035 145.915-114.935 96.503 57.219 98.313 -80.402 95.358 78.455 147.092 -37.390 121.717 152.225 121.374-127.532 87.168 134.828 141.620-130.891 112.428 -80.474 153.519-131.192 105.981 -95.028 147.616-143.913 93.888 56.334 134.041 -90.637 93.569 42.906 133.582 -87.637 93.022 44.719 137.323 -99.316 92.587 45.653 140.620 -90.697 92.178 39.666 143.635-134.767 93.260 38.922 0.000 0.000 92.529 42.229 133.859-121.080 92.662 38.728 138.573 -93.345 92.970 39.805 136.167-104.720 91.397 42.026 115.132 -76.256 91.492 68.581 147.152-122.385 93.480 67.347 140.463-108.039 91.188 -18.153 142.375-123.701 116.359-173.169 151.823 -19.782 120.769 130.620 121.551-128.935 92.773 38.932 116.242 -76.338 93.510 107.006 137.332-104.857 92.886 45.730 115.560 -76.414 92.432 41.834 129.407 -76.192 91.387 43.220 143.012-133.169 91.900 39.395 149.283-118.185 91.094 41.151 152.105-135.707 91.905 36.351 129.304 -76.058 91.656 46.922 129.939 -87.085 92.089 39.847 129.051 -76.139 92.460 39.400 138.065 -70.666 92.695 38.982 137.440 -89.743 91.820 47.799 144.821 -41.427 91.210 41.521 142.087-130.198 92.564 64.016 143.055-124.570 93.016 0.000 129.416 -76.269 # 137 total E -2.42628E+02 rmsd from N 0.000 %NC 0.00 93.632 102.942 136.809 -95.800 93.754 46.661 139.600-104.627 94.273 35.221 144.130-135.290 92.704 40.093 129.854 -76.592 93.156 40.528 141.004 -22.308 90.143 38.241 138.675-149.663 91.730 43.171 129.554 -91.353 89.241 38.711 140.254 -85.734 90.832 45.467 144.916 -42.294 92.631 52.821 136.946-140.186 92.376 43.010 146.776-109.193 93.373 42.635 100.865-114.421 92.959 76.781 141.682-131.452 115.139-123.835 153.533-129.420 94.246 149.673 143.870-135.750 125.949-148.943 153.262-109.389 93.801 55.413 133.660 -89.022 92.798 96.902 136.821 -97.783 92.937 63.965 135.261 -91.292 93.572 37.755 144.052-136.155 93.649 39.577 0.000 0.000 91.604 48.930 134.517-124.536 90.474 41.682 138.148 -92.905 92.273 41.025 135.896-103.900 91.002 42.206 115.208 -76.154 90.886 42.611 146.464-112.675 93.465 42.968 140.843-111.729 91.843 50.059 142.780-124.322 93.196 43.795 143.039-123.192 120.937 168.938 121.812-129.301 92.422 51.442 116.223 -76.293 93.348 42.051 137.450-103.636 90.057 46.548 116.508 -75.686 91.776 41.731 129.368 -76.235 87.569 44.297 141.556-130.385 90.102 48.007 144.423 -41.532 90.459 40.796 143.118 -42.310 91.964 37.453 129.310 -76.107 92.548 42.584 129.805 -88.013 92.606 38.074 129.254 -76.192 92.896 38.676 137.999 -74.449 93.039 39.391 137.304 -90.822 91.984 46.348 144.898 -41.265 91.528 42.080 142.359-133.026 92.457 63.405 143.018-124.199 93.022 0.000 129.413 -76.268 # 138 total E -2.39684E+02 rmsd from N 0.000 %NC 0.00 93.635 79.689 138.177-101.587 93.586 49.361 139.448-102.495 92.932 37.555 143.698-134.206 92.483 41.171 129.479 -76.215 92.335 42.048 141.152-152.327 90.991 37.057 138.743-149.095 92.004 42.586 129.196 -87.413 89.115 42.468 138.914 -86.799 89.751 47.018 145.942-111.469 89.651 48.541 136.555-143.129 92.265 146.302 144.917 -39.721 92.651 82.646 100.935-116.651 91.360 52.641 142.545-133.282 92.780 140.813 145.814 -40.063 96.146 75.551 145.223-135.780 94.395 26.561 133.265 -91.596 93.920 55.278 135.755 -87.897 93.457 105.731 136.011-107.029 93.118 59.432 135.724 -66.843 92.973 38.519 143.895-135.478 93.234 44.017 0.000 0.000 91.684 50.876 137.498-128.574 89.109 41.195 138.346 -92.249 92.048 41.038 133.112 -92.375 91.708 44.172 115.069 -75.469 92.248 37.658 149.508-122.447 94.426 36.950 139.415-109.114 95.418 34.769 144.491-127.505 107.829-172.227 150.719-137.894 120.315 -1.110 121.325-129.006 93.895 58.865 116.506 -76.404 93.585 34.161 137.390-103.331 90.789 46.447 116.125 -76.457 91.651 48.713 129.280 -76.176 87.396 48.222 141.436-130.428 90.793 41.563 145.060 -39.100 91.113 41.036 146.296 -38.605 91.780 37.827 129.276 -76.093 91.624 43.841 129.370 -88.025 91.820 42.839 129.275 -76.196 92.383 38.460 137.611 -75.714 92.600 39.760 137.335 -90.239 91.706 48.608 144.778 -41.450 91.041 41.544 141.915-128.923 92.539 64.411 143.067-124.508 93.023 0.000 129.415 -76.269 # 139 total E -2.29129E+02 rmsd from N 0.000 %NC 0.00 93.632 74.739 138.160-102.091 93.597 49.239 139.353-102.514 92.836 38.039 143.677-134.150 92.477 40.883 129.482 -76.242 92.156 42.311 139.962-146.927 92.364 34.565 138.893-149.127 92.999 39.720 130.045 -84.126 90.651 39.006 139.641 -85.895 91.561 47.256 144.576 -42.172 92.312 48.758 137.739-140.035 93.262 38.586 148.763-116.377 94.107 36.840 101.036-112.085 94.730 36.667 143.289-133.524 93.337 39.597 145.401 -40.118 92.340 57.033 143.924-130.909 93.238 42.375 133.732 -92.333 93.600 56.992 131.763 -89.094 94.430 7.895 138.202-113.805 115.936-144.837 143.680 -85.920 96.232 74.999 111.495 -82.987 94.421 147.684 0.000 0.000 125.027 46.140 155.463 173.121 90.626 44.119 139.784 -88.387 92.475 43.285 136.428-104.609 91.421 42.967 115.734 -75.999 91.698 50.432 148.724-112.056 93.738 35.333 139.712-105.533 109.335-118.928 110.798 -82.901 115.897 166.136 151.975 -19.887 120.738 -96.513 121.326-128.825 92.803 49.877 116.343 -76.315 93.179 41.384 138.000-102.574 90.008 44.743 116.450 -75.941 91.844 39.364 129.256 -76.110 88.341 43.479 141.749-130.712 89.989 42.865 144.755-107.154 90.837 40.739 144.789 -42.648 91.805 39.365 129.290 -76.098 91.678 43.989 129.977 -87.099 91.947 43.687 129.285 -76.146 92.124 36.774 138.040 -79.979 92.389 42.570 137.217 -91.103 91.373 48.009 144.045 -42.441 90.786 42.936 142.531-129.752 92.351 64.414 142.942-123.582 93.022 0.000 129.420 -76.274 # 140 total E -2.29055E+02 rmsd from N 0.000 %NC 0.00 93.626 73.465 138.156-102.254 93.585 50.974 139.533-102.490 93.021 36.296 143.710-134.163 92.460 42.584 129.578 -76.270 92.131 40.155 140.240-147.102 91.156 37.234 138.327-149.137 91.692 44.825 128.116 -97.046 87.496 49.050 140.186 -86.794 89.506 44.897 145.617-111.818 94.507 59.650 141.193 -20.268 92.440 92.812 148.931-108.247 93.873 56.608 99.423-107.531 96.407 98.768 144.212-136.544 93.952 -78.327 152.165-121.557 113.591 -96.954 150.361-149.938 93.947 55.623 134.294 -91.616 93.120 36.074 133.342 -87.681 92.238 60.137 134.521 -92.864 92.696 48.578 128.877-110.404 92.770 39.982 143.770-135.045 93.980 37.883 0.000 0.000 92.913 43.256 134.282-124.279 91.020 45.060 137.706 -93.395 92.166 59.546 135.801-103.928 89.528 64.188 115.421 -75.990 91.261 59.049 147.992-112.048 93.530 15.695 140.021-108.674 108.579-170.620 111.061 -82.626 116.837 169.051 152.201 -18.953 121.311 -91.540 121.042-128.132 91.525 53.122 116.156 -76.189 92.841 44.366 137.069-101.653 90.023 43.301 115.842 -75.848 92.217 40.351 129.322 -76.166 89.288 40.634 142.095-131.462 90.542 48.624 144.776 -41.127 90.825 40.356 143.414 -43.177 92.157 37.014 129.323 -76.121 92.824 42.107 129.847 -88.061 92.635 39.072 129.301 -76.225 92.871 38.955 137.703 -72.764 93.129 37.822 137.381 -90.999 92.513 43.909 145.055 -40.883 92.400 41.197 142.697-133.243 92.697 62.293 143.098-126.079 93.021 0.000 129.407 -76.262 # 141 total E -2.43246E+02 rmsd from N 0.000 %NC 0.00 93.879 125.833 139.225-103.161 93.223 45.635 137.947 -98.404 92.312 46.157 143.452-133.849 92.929 34.183 129.437 -76.229 94.318 41.560 146.065-168.116 91.681 35.312 142.161-156.507 92.304 44.125 129.518 -87.023 89.098 41.527 138.462 -86.479 89.360 54.693 146.364-109.882 87.477 52.704 135.197-141.638 92.292 132.740 144.895 -40.457 92.548 77.233 100.979-114.790 92.376 45.856 142.969-133.746 94.022 176.004 146.624 -37.304 94.046 79.230 144.136-139.166 93.542 41.840 131.436 -91.333 92.939 48.790 134.828 -81.947 93.010 51.361 140.121-107.197 91.460 41.764 133.581 -46.917 91.942 43.791 143.585-134.845 92.389 42.347 0.000 0.000 91.044 45.718 134.953-123.708 90.840 38.116 138.338 -91.977 92.651 42.370 135.898-103.580 90.875 42.188 115.526 -76.089 92.016 58.186 150.008-120.732 93.811 68.444 139.581-104.509 92.655 -61.329 143.044-124.802 114.887-148.222 151.724 -20.007 122.602 115.390 120.401-126.329 95.112 25.779 116.634 -76.544 94.090 49.864 137.652-103.334 92.604 36.213 115.929 -76.616 92.154 43.789 129.383 -76.262 88.034 46.387 141.706-130.611 91.068 45.896 144.860 -39.668 90.661 40.278 145.755 -39.239 91.714 37.252 129.282 -76.090 91.869 44.590 129.496 -87.298 91.935 42.766 129.306 -76.226 91.931 37.548 138.310 -78.478 91.948 44.509 137.253 -90.303 90.709 50.336 143.501 -43.785 90.563 42.024 141.831-125.653 92.518 65.635 143.058-124.337 93.024 0.000 129.418 -76.272 # 142 total E -2.32921E+02 rmsd from N 0.000 %NC 0.00 93.694 91.606 138.777-103.663 93.438 49.557 139.549-102.048 91.950 40.049 143.374-133.376 92.398 40.126 129.545 -76.291 92.429 42.325 144.247-148.636 94.027 31.394 139.056-150.024 94.393 36.615 131.630 -86.554 92.012 39.625 141.211 -85.426 91.857 45.776 143.511 -43.679 92.266 50.881 138.794-141.843 91.834 47.101 148.895-118.943 120.298-109.336 120.871-127.843 91.791 114.475 143.077-134.000 92.489 114.802 148.474-120.837 92.198 52.116 142.997-135.736 93.554 48.717 133.085 -90.558 96.170 173.781 133.471 -81.965 94.569 159.981 138.048-104.023 119.918-128.923 142.629-119.409 93.600 68.389 144.205-135.150 94.136 107.477 0.000 0.000 92.409 59.862 139.176-129.395 90.035 39.908 138.660 -90.149 92.533 40.773 136.026-104.636 92.000 41.778 115.400 -76.109 91.637 37.811 147.786-112.854 93.938 48.040 140.417-112.637 92.106 35.446 142.919-124.417 107.064-111.954 110.567 -82.719 120.223 171.050 121.367-129.108 117.449-117.690 120.526 -78.787 92.905 50.768 137.558 -99.210 91.613 44.722 115.455 -75.878 92.517 38.808 129.281 -76.017 91.738 36.797 143.038-133.399 91.884 40.681 147.850-117.665 92.234 37.998 145.016 -41.747 92.347 37.422 129.402 -76.218 92.603 42.624 130.413 -87.018 92.541 37.659 129.269 -76.226 92.950 38.826 137.967 -73.838 93.074 39.648 137.324 -90.663 91.990 46.022 144.929 -41.250 91.593 42.303 142.469-133.526 92.434 63.279 142.985-124.146 93.011 0.000 129.419 -76.274 # 143 total E -2.38240E+02 rmsd from N 0.000 %NC 0.00 93.710 94.428 138.935-104.388 93.411 49.467 139.476-101.905 91.736 41.043 143.314-133.343 92.379 39.584 129.484 -76.267 92.508 43.406 143.815-147.894 94.340 30.750 138.996-149.955 94.400 37.067 131.162 -85.278 92.010 39.501 140.454 -85.692 91.910 47.940 143.738 -43.525 91.875 50.374 139.101-142.183 91.575 48.833 148.611-115.857 120.280-111.032 120.961-128.127 91.743 113.413 142.848-135.071 92.455 115.607 148.458-120.516 92.214 52.575 143.011-135.706 93.572 48.675 133.081 -90.578 96.181 173.145 133.547 -82.028 94.589 160.000 138.174-104.108 119.776-127.570 142.804-120.821 93.757 67.507 144.266-135.251 94.219 107.692 0.000 0.000 92.765 63.563 140.018-129.491 90.370 38.927 138.981 -90.456 92.602 41.647 136.136-104.831 91.979 43.227 115.435 -76.070 91.899 36.587 147.510-110.958 94.392 48.950 139.924-111.648 94.751 4.223 144.177-126.708 123.654 142.352 152.658 -18.352 121.750 147.975 120.722-127.114 94.615 30.710 116.542 -76.510 93.655 44.716 137.341-102.306 90.625 45.322 116.544 -76.156 92.132 42.012 129.354 -76.173 89.456 38.143 142.224-131.687 91.162 46.425 144.522 -40.704 90.918 37.964 142.717-107.026 92.794 38.296 129.401 -76.173 93.750 36.373 130.221 -88.254 92.926 39.502 129.511 -76.374 93.188 37.557 138.152 -84.914 93.045 40.010 137.017 -92.234 91.872 46.569 144.853 -41.330 91.435 42.132 142.297-132.343 92.459 63.613 143.022-124.241 93.020 0.000 129.414 -76.267 # 144 total E -2.32378E+02 rmsd from N 0.000 %NC 0.00 93.604 60.690 137.731-102.621 95.078-135.179 138.110-100.237 92.956 49.755 111.176 -82.827 92.288 50.835 130.011 -76.756 91.103 40.892 138.033 -26.285 89.230 43.143 140.826-157.278 90.860 49.705 129.125-100.773 86.065 58.202 141.084 -83.730 88.473 47.225 144.844-101.109 88.114 49.687 138.625-142.071 92.601 150.097 144.445 -41.160 119.970 75.834 121.671-129.176 92.348 40.415 143.241-133.740 93.712 46.660 145.656 -37.808 91.876 41.446 112.481 -82.336 92.915 47.240 132.942 -94.915 93.748 30.915 131.267 -88.979 94.055 148.651 139.706-103.867 93.959 61.357 142.145-118.876 95.308 26.287 144.486-135.352 96.960 45.548 0.000 0.000 123.214 -1.620 158.401 176.976 92.208 55.495 138.764 -91.199 92.586 39.793 136.537-106.225 88.296 46.379 114.929 -75.953 91.644 51.735 143.726 -41.950 93.707 60.920 138.278-100.058 94.482 -28.859 109.279 -83.544 120.210-137.125 152.383 -18.886 118.632 115.870 122.271-131.224 91.710 53.380 116.059 -76.169 93.182 111.558 136.728-102.867 92.120 48.396 115.883 -76.458 92.054 41.414 129.372 -76.155 88.814 49.771 142.233-131.281 90.503 38.055 146.269-116.743 90.463 47.875 145.509 -38.251 91.029 43.994 129.235 -76.064 91.303 44.118 129.266 -83.161 92.415 35.524 129.187 -76.087 92.866 40.746 138.671 -82.392 92.400 49.694 137.119 -91.448 90.155 47.714 145.443-114.077 90.949 43.848 143.236-127.933 92.389 66.817 142.995-124.282 93.018 0.000 129.356 -76.238 # 145 total E -2.27104E+02 rmsd from N 0.000 %NC 0.00 93.571 62.315 137.195-100.177 93.593 46.987 140.265-107.213 92.490 39.006 143.582-133.851 92.693 38.765 129.475 -76.237 93.095 40.509 142.186-140.497 94.475 34.641 137.440-148.292 93.565 40.245 130.141 -87.257 91.409 39.623 140.194 -87.673 90.562 49.170 147.362-107.946 90.984 47.410 136.969-142.952 93.717 143.772 145.430 -39.282 121.216 144.927 120.672-127.090 97.694 -60.248 144.680-137.921 92.871 174.688 148.967-118.001 109.886-124.250 148.282-146.438 93.732 45.157 133.963 -90.545 93.320 56.774 133.580 -82.420 93.287 61.056 140.213-113.654 93.085 125.058 140.336-106.249 109.801-104.913 149.187-145.507 94.607 43.518 0.000 0.000 91.740 49.652 135.733-117.872 91.849 41.156 140.762 -94.573 92.762 40.803 136.308-105.816 92.057 55.002 115.154 -76.076 92.295 107.724 146.495-125.682 94.025 76.153 140.602-111.672 91.939 -65.809 142.793-124.211 116.249-146.473 151.930 -19.577 122.880 119.224 120.156-125.606 96.256 19.303 116.808 -76.799 93.976 53.170 137.668-102.619 92.120 44.208 116.283 -76.273 93.107 33.683 129.378 -76.207 97.117 28.649 144.544-137.697 97.104 35.565 147.510 -36.785 95.074 34.713 145.494 -39.312 92.973 37.595 129.592 -76.452 93.926 43.853 131.312 -84.986 93.488 31.811 129.365 -76.192 93.730 41.262 142.193 -90.827 93.181 37.306 136.475 -88.266 92.101 46.668 145.079 -41.036 91.553 41.720 142.176-133.260 92.431 63.250 143.008-124.045 93.026 0.000 129.419 -76.267 # 146 total E -2.37783E+02 rmsd from N 0.000 %NC 0.00 93.705 98.135 138.612-103.010 93.507 47.793 139.144-102.146 92.315 40.938 143.496-133.790 92.465 38.484 129.458 -76.243 92.819 45.526 145.292-157.155 92.511 31.671 139.609-149.489 93.332 39.121 130.039 -87.487 90.304 41.118 137.860 -86.910 90.229 47.544 143.539 -45.791 90.631 54.240 137.007-140.063 92.757 61.013 146.368 -37.879 116.790 146.285 122.098-131.676 96.139 42.978 144.326-137.785 93.265 41.918 145.909 -38.927 90.671 44.840 142.577-135.095 92.599 46.527 127.555 -92.083 92.950 55.834 131.239 -89.102 93.294 66.860 137.103-101.255 112.715-124.043 142.520 -97.578 94.033 26.723 144.091-134.676 128.151-101.836 0.000 0.000 129.147 -93.817 160.431 169.875 92.117 41.467 139.896 -92.328 92.961 39.010 135.215-107.141 91.426 51.762 114.942 -76.029 92.676 101.291 145.975 -40.930 93.621 73.432 138.132 -95.630 93.344 4.314 143.454-125.863 106.309-174.226 150.149-137.066 120.792 133.695 121.220-128.560 92.665 38.615 116.124 -76.303 93.026 48.712 138.297-108.688 89.487 47.666 116.311 -75.701 92.093 38.049 129.343 -76.162 88.984 41.959 142.142-131.306 90.257 51.631 145.153 -42.916 88.533 45.418 145.917-110.014 91.539 38.259 129.296 -76.082 91.982 39.396 129.464 -89.120 91.836 43.450 129.432 -76.345 92.044 41.806 137.209 -82.577 91.844 45.508 137.242 -91.137 90.514 50.008 143.690 -42.747 90.800 42.373 141.989-128.078 92.443 65.968 143.013-124.209 93.022 0.000 129.415 -76.272 # 147 total E -2.40794E+02 rmsd from N 0.000 %NC 0.00 93.654 81.604 138.453-102.561 93.535 49.529 139.617-102.828 92.756 37.830 143.634-134.047 92.457 40.926 129.569 -76.266 92.559 42.689 142.386-150.558 92.366 34.817 139.318-151.196 92.409 42.799 129.297 -87.030 89.977 38.339 135.788 -85.085 90.603 52.714 148.313-129.195 89.042 49.314 137.171-139.916 92.213 53.686 145.961 -40.278 120.393 -70.963 120.850-127.762 95.912-162.897 144.400-136.536 109.415 128.333 152.101 -27.176 107.741 -75.995 148.273-145.321 94.045 73.747 134.224 -90.165 93.653 45.620 133.358 -87.827 93.042 55.097 139.025 -97.822 93.315 36.421 140.525-103.220 95.092 40.261 144.481-136.438 96.328 33.197 0.000 0.000 94.338 45.876 140.139-127.224 92.222 35.903 138.300 -92.244 93.113 40.081 136.267-105.174 92.736 40.692 115.412 -76.316 92.489 40.598 148.738-120.446 94.104 55.345 138.970-100.169 96.057 -23.789 109.640 -83.467 124.218-121.726 153.036 -18.153 118.377 115.632 121.869-130.815 91.394 46.741 116.009 -76.177 92.428 56.485 136.312 -94.278 92.702 37.958 115.588 -75.921 93.501 33.644 129.428 -76.210 94.991 33.977 144.080-135.626 92.107 46.301 146.760 -41.250 90.194 42.690 144.233 -42.974 91.465 38.595 129.278 -76.104 91.954 42.229 129.487 -88.014 92.139 40.377 129.340 -76.221 92.259 40.545 137.676 -74.666 92.228 43.041 137.357 -89.904 90.965 49.922 144.371 -42.097 90.701 42.088 142.007-127.265 92.465 65.470 143.043-124.194 93.026 0.000 129.422 -76.275 # 148 total E -2.33495E+02 rmsd from N 0.000 %NC 0.00 93.722 97.716 138.912-104.256 93.481 48.837 139.517-102.488 92.079 40.184 143.417-133.574 92.426 39.213 129.446 -76.227 93.207 43.268 145.755-152.399 94.808 30.454 139.517-150.313 94.519 35.891 131.023 -85.890 91.381 43.374 141.665 -88.054 90.326 48.166 144.254 -42.707 90.763 49.131 137.431-140.517 92.907 39.977 148.174-107.555 93.723 36.789 101.919-113.207 93.716 39.765 142.652-132.065 93.103 37.441 146.084-114.309 93.641 69.203 143.516-137.493 92.875 57.705 133.308 -93.539 93.348 58.685 132.524 -89.456 94.830-113.335 138.419-110.097 94.777 105.322 140.429-111.762 118.754-126.964 151.657 -20.003 92.911 -17.772 0.000 0.000 121.963-176.525 157.569 177.244 93.617 49.437 142.263 -89.594 93.820 29.876 136.316-105.233 94.487 51.100 117.195 -76.217 92.386 34.163 148.056-114.752 94.551 51.010 139.602-105.768 95.099 -19.945 144.287-126.940 123.668-158.918 153.018 -17.657 92.757 63.088 99.935-114.813 91.286 48.869 116.068 -76.201 92.413 75.005 137.185 -97.392 90.732 48.073 115.096 -76.164 92.194 38.660 129.354 -76.127 90.198 40.546 142.636-132.321 91.452 44.896 145.900 -40.315 89.999 39.641 147.235-115.870 91.657 39.873 129.317 -76.107 91.556 51.504 130.285 -80.142 92.381 39.103 129.014 -75.939 93.656 33.329 137.646 -85.358 93.971 40.818 136.842 -93.713 92.580 49.381 145.670 -41.190 90.735 49.918 143.430-137.710 90.849 79.263 142.271-122.820 93.019 0.000 129.305 -76.216 # 149 total E -2.27854E+02 rmsd from N 0.000 %NC 0.00 93.616 55.152 137.488-102.814 95.271-132.384 139.806-109.810 94.441 45.263 111.232 -82.935 92.550 48.563 129.742 -76.528 93.976 32.554 138.621 -27.291 93.736 42.675 141.477-159.435 91.852 49.744 129.035 -85.363 88.846 51.417 137.175 -84.651 90.579 37.738 147.290-120.843 93.898 41.682 140.515-143.825 94.296 146.845 145.677 -39.255 122.850 144.808 120.089-125.321 97.183 30.641 144.556-137.459 94.024 47.729 145.838 -37.245 91.658 46.771 114.706 -83.426 92.221 47.740 135.085 -86.602 92.917 36.576 130.889 -89.097 93.681 158.760 136.981-101.704 94.878 65.976 147.592-139.780 95.858 20.155 144.669-136.127 96.436 43.709 0.000 0.000 123.071 10.799 158.420-178.926 92.773 48.173 139.659 -92.377 92.765 35.811 136.033-104.399 92.033 43.579 115.286 -76.017 91.410 43.237 150.080-120.335 93.398 42.430 139.029 -95.310 91.825 59.449 142.746-124.172 120.247-178.437 152.054 -20.793 118.974 -3.145 121.440-129.899 92.027 66.633 116.216 -76.219 92.990 86.319 138.357-106.708 91.140 115.736 116.292 -75.794 92.538 50.743 129.361 -76.149 91.043 34.600 142.962-132.783 90.550 47.810 150.868-124.693 90.582 40.810 144.882 -41.357 91.813 38.190 129.307 -76.124 91.144 44.943 130.204 -81.471 91.647 54.007 129.385 -76.278 92.244 31.923 137.274 -78.829 92.767 48.549 137.230 -91.952 92.022 39.780 144.293-107.571 107.021-129.728 146.305-136.468 92.240 82.308 143.043-124.407 93.010 0.000 129.408 -76.172 # 150 total E -2.30196E+02 rmsd from N 0.000 %NC 0.00 94.345 164.573 138.548-101.312 93.453 53.098 139.076-102.691 93.211 40.810 149.889 -32.655 92.468 39.070 129.162 -76.028 92.424 43.688 140.209-149.232 92.932 33.951 139.194-149.621 93.442 37.977 129.955 -82.290 90.453 42.886 140.381 -86.590 91.093 56.677 144.498 -42.917 91.406 64.530 138.091-141.109 91.759 -79.518 148.460-112.439 124.052 -5.628 120.330-124.990 115.598-122.014 151.458-152.297 94.306 43.441 146.518 -38.171 92.970 38.843 143.552-135.517 92.695 50.770 133.760 -88.926 93.101 47.539 126.171 -91.723 93.352 34.978 136.906-101.646 94.608 59.874 139.873-115.173 118.616 -20.481 153.211 -21.013 94.997 63.318 0.000 0.000 93.397 29.848 131.491 -37.585 93.192 46.247 141.428 -88.702 92.851 35.949 135.243-101.223 93.143 41.245 115.485 -76.581 93.236 96.429 151.081-128.011 93.512 63.012 140.928-108.967 91.274 -11.001 142.529-123.782 115.714-171.442 151.769 -19.970 120.255 134.753 121.762-129.611 91.523 47.909 116.000 -76.187 93.023 46.258 137.621-100.430 91.333 39.739 116.075 -75.574 92.652 37.677 129.367 -76.160 91.118 40.651 142.617-132.529 90.709 41.759 144.869-111.646 90.399 43.172 145.892-114.818 91.940 40.923 129.341 -76.127 92.681 36.929 129.772 -93.243 92.426 40.948 129.376 -76.149 92.717 39.567 137.589 -84.461 92.503 43.186 137.090 -92.282 91.151 48.785 144.763 -41.702 90.810 42.477 142.387-128.258 92.465 65.422 143.013-124.231 93.028 0.000 129.416 -76.262 # 151 total E -2.36191E+02 rmsd from N 0.000 %NC 0.00 93.611 82.295 137.516 -98.691 93.833 48.211 139.021-103.557 93.995 36.091 144.020-134.878 92.604 41.195 129.565 -76.263 92.447 44.057 143.292-157.466 91.866 34.161 139.729-150.738 92.636 39.497 129.238 -87.090 89.054 45.876 136.534 -85.531 90.494 57.191 142.841 -45.727 89.483 107.665 135.848-140.818 102.936-138.931 150.861 -33.715 93.500 50.130 100.725-112.169 91.431 59.712 112.242 -83.037 91.936 89.032 144.666 -39.159 92.130 41.742 142.244-136.408 93.019 45.182 133.287 -90.776 93.266 98.041 131.926 -95.863 93.430 82.980 134.300-102.712 92.457 48.168 140.131-112.638 104.238-119.321 147.407-141.721 122.974-136.341 0.000 0.000 126.096 68.038 159.024 168.291 92.732 40.884 140.918 -88.058 93.513 35.893 136.500-106.264 92.018 46.202 115.909 -76.174 92.163 47.725 145.662 -39.654 93.154 51.339 139.924-104.056 91.973 52.977 142.791-124.178 117.490-163.785 152.101 -19.442 93.242 65.603 99.916-114.376 91.990 42.274 116.147 -76.245 92.756 55.534 137.181 -91.416 93.454 35.040 116.040 -76.222 93.668 34.821 129.460 -76.225 98.227 26.574 145.075-137.779 94.452 44.441 147.772 -36.159 91.159 38.219 144.609 -42.451 91.725 38.532 129.289 -76.129 92.235 43.788 129.294 -81.509 92.552 38.359 129.304 -76.093 93.272 34.966 137.897 -79.287 93.565 39.828 137.087 -92.299 92.559 43.214 144.782 -42.065 92.074 42.960 143.255-136.454 92.371 62.143 142.990-124.010 93.015 0.000 129.416 -76.270 # 152 total E -2.29258E+02 rmsd from N 0.000 %NC 0.00 93.629 75.702 138.176-102.038 93.589 49.996 139.498-102.667 92.969 37.017 143.721-134.160 92.480 41.687 129.556 -76.246 92.397 41.205 140.810-148.300 91.562 35.673 138.468-149.625 92.045 43.463 130.741 -84.131 89.248 44.391 139.843 -85.255 91.458 36.880 144.355-104.586 96.055 55.825 140.111-142.171 93.887 45.739 150.063-125.287 119.915-107.573 121.929-129.592 93.951 163.412 143.063-135.360 124.985 178.329 161.131-140.017 98.263 -83.083 145.016-138.684 94.120 65.073 135.908 -90.985 93.816 43.066 133.544 -88.015 93.013 86.514 138.218-100.212 92.151 51.046 136.174 -90.232 93.281 41.982 143.754-134.816 96.861 32.370 0.000 0.000 95.087 38.712 137.485-124.413 92.852 38.324 139.347 -93.267 92.588 40.996 136.683-102.958 90.294 39.572 115.024 -76.215 91.359 47.639 145.990 -40.309 92.720 45.727 137.575 -90.922 92.375 45.489 109.153 -83.511 97.486 -78.326 150.248 -23.446 121.276-174.666 121.169-128.099 91.615 117.537 116.720 -76.172 95.288 -65.008 137.243-106.020 94.648 79.478 116.545 -76.526 93.002 34.228 129.364 -76.151 90.827 48.486 142.969-133.787 90.126 43.469 147.999-128.923 89.719 43.895 148.104-112.704 91.663 38.206 129.319 -76.095 92.007 43.742 130.522 -72.099 92.422 37.613 129.058 -76.006 93.490 35.227 137.489 -85.711 93.709 39.868 136.816 -93.664 92.371 44.595 145.275 -41.511 91.806 42.560 142.542-134.707 92.410 62.962 143.018-124.143 93.024 0.000 129.420 -76.268 # 153 total E -2.33829E+02 rmsd from N 0.000 %NC 0.00 93.926 152.273 135.536 -88.870 93.727 40.342 137.455-101.094 93.195 38.566 143.867-134.247 92.500 45.419 129.781 -76.622 93.566 32.134 135.582 -29.965 93.345 41.828 145.315-157.553 92.561 43.374 130.979 -93.494 89.882 37.523 138.808 -86.154 90.787 46.583 150.301-121.789 92.271 53.993 137.256-137.272 93.830 69.721 146.988 -38.866 118.599-157.010 122.460-131.178 93.823 47.391 143.608-135.068 91.907 43.780 148.962-118.985 90.594 44.846 142.477-127.211 93.518 36.662 129.821 -96.415 94.064 43.331 131.874 -87.670 94.359 33.484 137.319-103.284 95.436 126.407 139.558 -29.510 96.153 51.463 111.420 -83.033 94.187 47.422 0.000 0.000 93.144 48.337 138.318-127.209 89.779 43.183 141.517 -92.542 91.958 37.570 135.731-103.253 91.310 42.421 115.175 -76.165 90.695 43.816 147.134-112.515 92.789 42.971 140.749-101.711 90.544 51.998 142.146-123.205 92.367 46.040 142.564-122.353 119.553 177.014 121.941-130.161 91.670 58.004 116.135 -76.220 93.247 46.783 137.387-102.419 91.907 38.202 115.997 -75.744 92.531 41.148 129.412 -76.230 90.309 41.675 142.335-132.019 91.678 41.666 145.313 -40.346 91.671 39.921 145.532 -39.381 92.084 37.568 129.312 -76.129 92.558 43.086 129.926 -87.823 92.602 37.280 129.290 -76.226 92.979 39.004 138.190 -74.737 93.078 39.472 137.283 -90.758 91.987 46.181 144.924 -41.243 91.564 42.179 142.444-133.480 92.445 63.367 143.020-124.155 93.022 0.000 129.404 -76.260 # 154 total E -2.29876E+02 rmsd from N 0.000 %NC 0.00 93.707 91.552 139.005-104.999 93.484 47.268 138.411-101.367 92.778 43.152 111.173 -82.877 92.239 40.928 129.476 -76.354 90.646 53.017 141.487-150.696 88.020 57.149 138.260-149.400 90.945 56.808 128.520 -83.949 87.265 60.965 141.209 -83.948 88.706 40.557 148.561-112.057 90.653 124.609 139.136 -22.717 92.914 125.633 145.727 -42.698 119.548 -19.688 121.708-129.706 93.630 147.143 143.641-134.544 108.224 -74.243 154.325-131.212 107.095-100.256 147.990-144.665 93.728 61.090 134.021 -90.737 93.512 41.888 133.385 -87.755 92.923 48.310 136.145 -91.780 93.581 34.136 134.581 -98.098 93.177 55.268 143.917-134.646 93.477 52.636 0.000 0.000 94.363 28.216 133.459-116.985 95.642 42.556 140.871 -93.449 93.435 38.325 136.427-105.234 91.947 45.624 115.094 -76.308 91.549 60.317 146.482-128.396 93.696 78.328 137.749 -95.650 94.454 -16.876 143.826-126.582 125.052 95.806 152.971 -18.037 121.856-152.905 121.702-128.545 91.407 61.227 116.103 -76.195 92.605 60.917 137.851-102.555 88.973 53.219 115.999 -75.775 92.020 38.602 129.395 -76.162 89.364 46.147 142.313-131.582 91.442 69.130 145.819 -38.606 89.590 44.596 146.377-118.382 91.595 38.722 129.327 -76.095 92.294 41.790 130.026 -85.324 92.238 42.465 129.247 -75.984 92.324 35.642 137.625 -84.134 92.545 44.728 137.032 -93.055 91.504 42.223 143.236 -43.595 92.149 44.248 143.746-136.009 92.345 61.915 142.962-124.334 93.031 0.000 129.436 -76.289 # 155 total E -2.30737E+02 rmsd from N 0.000 %NC 0.00 93.632 78.450 138.167-101.857 93.565 48.440 138.733 -99.096 93.179 38.603 144.242-134.087 92.670 39.155 129.505 -76.277 92.810 41.886 140.276-147.501 92.854 33.737 139.382-147.250 93.648 39.840 133.436 -83.164 92.592 34.390 139.483 -84.908 92.876 40.039 145.224 -40.645 93.512 53.387 136.927-141.850 93.524 44.996 146.803 -39.015 92.897 38.022 101.230-111.448 92.544 39.272 142.158-131.123 108.262 148.322 152.517 -28.666 117.317 -81.901 153.338-154.156 94.397 50.443 134.261 -90.909 93.315 38.902 133.438 -87.680 92.876 96.457 133.594 -98.492 94.215 57.052 140.732-104.208 94.686 33.022 144.365-137.021 95.844 36.850 0.000 0.000 94.236 62.086 142.093-130.864 91.156 37.265 138.489 -90.973 92.953 35.401 136.435-105.045 92.989 41.630 115.476 -76.249 93.317 36.655 145.365 -41.032 94.579 37.559 140.288-103.757 99.053 36.306 150.542 -22.821 96.016 21.636 144.674-125.346 121.345 175.316 122.398-130.107 91.961 55.029 116.174 -76.243 93.295 48.909 137.242-102.003 90.969 41.452 115.741 -75.718 92.109 42.323 129.319 -76.171 88.796 42.443 141.929-131.230 91.590 40.071 144.508 -41.128 92.173 38.808 145.875 -39.907 92.333 37.595 129.343 -76.154 92.647 42.538 129.972 -87.704 92.493 38.344 129.296 -76.252 92.914 38.390 137.557 -74.054 93.078 39.983 137.308 -90.843 92.013 45.628 144.863 -41.353 91.681 42.323 142.525-133.887 92.445 63.172 143.025-124.197 93.023 0.000 129.412 -76.269 # 156 total E -2.28002E+02 rmsd from N 0.000 %NC 0.00 93.816 105.498 139.677-107.466 93.334 52.088 139.500-101.564 91.640 41.332 143.257-132.979 92.365 39.185 129.342 -76.117 92.818 43.063 141.696-148.279 93.895 32.279 139.344-151.947 93.322 38.613 130.169 -87.365 89.620 45.465 139.629 -87.488 90.143 47.991 144.822 -43.472 90.242 50.280 145.717 -21.328 91.800 47.403 146.337 -40.635 121.576-113.940 119.091-124.132 93.264 111.830 149.879 -31.161 94.270-177.381 148.562-121.816 110.051-100.597 148.971-148.061 94.023 41.833 134.372 -89.462 93.124 47.639 133.317 -87.443 92.764 72.082 133.444 -85.951 94.105 45.809 142.355 -84.544 96.388 23.830 144.888-136.899 96.730 43.943 0.000 0.000 93.922 35.531 131.124 -38.698 94.369 38.741 140.782 -90.295 93.382 34.346 136.357-105.156 93.874 40.957 115.830 -76.499 93.734 37.447 146.402 -38.991 93.773 42.645 139.680 -92.692 93.715 45.450 143.652-125.799 97.549 27.265 150.117 -23.599 121.388-167.192 121.984-129.250 91.641 75.764 116.102 -76.289 93.695 111.538 137.404-103.710 92.830 149.535 116.475 -75.740 92.697 51.743 129.388 -76.172 91.145 34.924 143.008-132.810 91.696 47.502 146.339 -37.993 90.395 40.098 144.445 -42.797 91.562 38.601 129.273 -76.100 91.280 46.129 129.792 -79.929 92.045 42.172 129.080 -76.205 92.400 33.455 137.613 -81.825 92.163 50.994 136.928 -90.887 90.499 48.321 142.495 -47.545 90.733 48.529 142.630-131.895 92.559 68.372 143.103-124.570 92.990 0.000 129.445 -76.187 # 157 total E -2.29458E+02 rmsd from N 0.000 %NC 0.00 93.697 90.080 138.940-104.415 93.446 49.580 139.582-102.231 92.026 39.655 143.388-133.360 92.392 40.209 129.427 -76.183 93.466 41.639 144.817-146.285 93.926 33.209 138.893-149.418 93.511 40.785 131.546 -92.535 90.931 41.180 142.054 -87.399 90.384 50.087 147.934-106.592 90.899 49.085 136.648-140.084 92.669 55.956 146.431-111.541 121.048-124.568 121.549-128.691 125.452 -70.449 112.942 -84.157 93.790 69.148 146.041 -38.607 93.963 34.041 143.752-135.437 93.594 60.726 137.380 -88.887 93.437 59.958 132.628 -89.125 93.693 118.213 137.305-101.903 117.473-124.205 146.541-113.533 95.100 36.528 144.511-135.433 117.684-172.895 0.000 0.000 122.391 35.014 156.584 171.181 90.893 44.442 140.307 -88.260 92.777 39.338 136.381-104.970 91.399 40.035 115.138 -76.222 91.533 55.986 150.369-124.562 92.805 62.226 142.683-100.195 91.059 24.363 142.288-123.505 97.430 136.548 149.828 -23.131 94.758 124.503 98.764-108.488 95.236 25.625 116.681 -76.551 94.228 44.699 137.245-100.843 93.684 38.027 116.847 -76.235 93.074 40.717 129.402 -76.184 94.673 27.312 143.784-135.235 93.553 44.675 147.441 -37.837 91.448 38.172 143.847 -44.263 92.112 38.957 129.334 -76.155 92.467 41.684 129.875 -87.759 92.566 38.044 129.263 -76.199 92.986 38.609 138.030 -76.512 93.091 39.682 137.237 -91.130 91.991 46.061 144.918 -41.237 91.576 42.279 142.454-133.634 92.421 63.385 142.995-124.099 93.029 0.000 129.426 -76.285 # 158 total E -2.31681E+02 rmsd from N 0.000 %NC 0.00 93.770 107.621 139.006-104.310 93.310 52.209 139.451-101.710 91.904 41.071 143.360-133.445 92.478 38.819 129.454 -76.205 92.814 42.293 143.715-150.614 92.345 35.003 138.523-151.158 92.185 43.163 129.415 -86.691 88.104 53.472 140.210 -87.190 89.585 36.580 142.757 -99.876 92.969 58.576 140.419-141.908 94.149 69.679 146.409 -39.547 122.219-145.127 121.247-126.976 91.070 71.965 142.292-132.358 91.972 122.478 145.226 -41.823 94.028 64.643 143.028-135.130 93.540 33.825 133.124 -91.450 93.026 48.866 135.309 -89.317 92.677 48.758 132.697 -91.438 92.522 59.290 139.484-135.564 92.443 42.966 143.573-133.482 94.143 107.351 0.000 0.000 124.876 161.695 156.363 176.593 114.592 -99.840 139.838 -86.007 92.774 47.989 137.487-106.349 89.116 48.199 115.261 -75.934 90.625 48.869 143.809 -43.516 93.209 53.645 138.198 -97.958 93.136 92.505 109.313 -83.549 116.412-117.032 152.151 -20.488 92.792 79.437 100.067-114.267 91.154 42.191 115.865 -76.129 92.968 47.814 138.626-104.081 90.622 37.919 115.608 -75.957 92.375 39.817 129.341 -76.167 89.683 42.420 142.177-131.333 90.182 42.858 146.260-114.108 90.869 39.323 144.524 -41.689 91.864 38.367 129.319 -76.116 92.040 44.463 131.426 -84.651 92.335 37.214 129.291 -76.199 92.984 37.185 137.766 -79.200 93.225 43.110 137.176 -91.964 92.115 39.660 143.534 -42.562 93.229 44.684 142.524-144.110 92.308 60.678 142.928-124.044 93.018 0.000 129.411 -76.262 # 159 total E -2.36429E+02 rmsd from N 0.000 %NC 0.00 93.649 71.598 138.517-103.999 93.544 53.069 141.773-111.596 91.534 37.131 143.245-133.261 92.109 44.047 129.446 -76.188 91.340 42.401 139.463-142.727 92.090 36.105 140.193-146.945 92.999 40.290 130.497 -84.803 91.418 36.927 139.993 -87.010 91.584 44.945 148.078-120.133 94.236 53.315 138.670-139.520 93.004 68.043 149.146-118.235 120.342 -88.443 121.439-128.807 96.503-167.291 144.628-138.864 92.325 55.358 150.558-124.441 91.828 36.972 143.164-134.424 93.007 53.079 134.298 -89.721 93.213 89.838 132.357 -79.483 93.447 55.418 136.231-102.425 106.558 -26.665 142.133-117.712 116.242 71.914 112.541 -83.742 137.266 -15.625 0.000 0.000 94.232 47.847 137.411-124.254 94.097 33.224 138.993 -91.398 93.429 41.123 137.789-108.782 93.287 37.985 115.442 -76.439 92.425 40.061 148.503-117.906 93.596 45.193 142.731-123.718 91.194 49.664 142.513-123.668 92.556 49.624 142.738-122.637 121.526 167.309 120.977-127.681 94.407 38.675 116.529 -76.496 93.908 39.690 137.547-103.645 90.921 47.540 116.643 -75.945 92.027 42.555 129.345 -76.211 88.935 38.212 142.019-131.419 91.259 44.416 145.133 -40.213 91.057 39.411 143.746 -42.979 92.177 37.972 129.327 -76.135 92.514 40.984 129.818 -88.097 92.449 39.661 129.306 -76.231 92.731 38.251 137.034 -69.825 92.983 39.950 137.412 -90.308 91.939 45.915 144.870 -41.308 91.581 42.296 142.384-133.033 92.446 63.262 142.996-124.257 93.027 0.000 129.415 -76.266 # 160 total E -2.30733E+02 rmsd from N 0.000 %NC 0.00 93.624 76.451 137.812-100.318 93.603 49.246 139.373-103.834 93.590 35.960 143.753-134.452 92.625 41.637 129.590 -76.206 92.078 41.560 141.129-153.127 91.409 35.625 138.787-148.917 92.059 43.625 129.106 -87.684 88.989 40.105 137.676 -87.522 89.664 52.239 146.575-110.860 87.892 58.939 135.472-138.249 91.533-173.561 143.795 -41.779 92.259 74.730 100.492-114.028 93.340 42.455 143.012-133.555 94.783 32.314 145.014 -38.122 95.981 41.218 145.307-142.130 93.859 44.087 134.520 -94.797 94.200 57.534 131.472 -87.820 94.352 -21.050 138.028 -94.677 122.182-110.720 142.776-151.216 94.862 56.861 144.306-135.502 123.380-122.809 0.000 0.000 133.167 -23.967 160.301 164.700 95.051 54.421 140.544 -90.546 94.094 27.778 137.050-106.310 93.505 50.680 116.545 -76.018 91.936 38.852 149.936-132.106 93.058 46.729 142.808-105.442 91.649 36.197 142.689-124.235 93.160 153.766 143.173-124.602 93.708 66.479 99.791-114.279 92.675 39.369 116.245 -76.371 93.774 68.643 138.212-105.428 93.291 153.409 116.762 -75.930 92.787 49.614 129.418 -76.185 91.862 33.876 143.146-131.317 91.677 48.154 146.123 -38.603 91.813 42.315 144.008 -42.531 92.476 34.690 129.337 -76.156 92.552 43.266 133.382-103.408 92.027 44.676 129.293 -76.161 92.069 43.251 137.429 -71.479 92.475 37.563 137.454 -88.624 91.873 49.186 144.947 -39.499 91.327 41.001 141.704-132.451 92.507 64.624 142.960-124.123 93.002 0.000 129.387 -76.237 # 161 total E -2.28671E+02 rmsd from N 0.000 %NC 0.00 93.618 79.199 138.277-101.887 93.581 50.076 139.609-102.729 92.933 36.807 143.653-134.142 92.477 41.791 129.513 -76.237 92.599 40.984 142.511-149.404 91.974 36.396 138.700-150.589 92.048 44.445 130.867 -86.718 88.864 44.557 138.980 -85.198 90.896 40.061 145.474-120.810 96.301 55.779 140.291-141.996 94.358 79.660 151.080-116.230 119.216 -85.634 122.772-131.324 94.643 178.721 143.917-135.302 118.871 161.749 157.845-136.601 104.597 -80.804 147.101-142.909 93.958 59.055 134.239 -90.433 93.570 43.254 133.512 -87.846 92.811 53.666 137.559 -99.258 91.186 45.787 138.057 -63.747 90.534 42.530 143.117-133.810 92.245 40.447 0.000 0.000 91.944 42.673 133.321-114.931 96.106 30.218 137.379 -90.465 94.823 33.576 136.938-107.446 97.413 36.128 116.124 -76.671 95.888 32.270 148.676 -37.506 94.050 49.728 142.243-107.196 93.126 31.310 109.188 -83.273 116.992-142.836 152.021 -19.687 119.694 14.872 121.482-129.557 95.831 172.657 116.794 -76.609 93.910-135.823 138.473 -99.903 95.623 45.082 116.571 -76.612 93.660 39.622 129.502 -76.218 95.523 32.238 145.848-133.285 93.504 42.850 151.370-136.458 92.563 37.463 149.995-118.399 92.721 33.660 129.390 -76.176 93.027 43.612 130.536-114.505 91.697 46.675 129.192 -76.146 91.723 42.829 137.618 -84.397 92.164 43.839 137.064 -89.522 91.237 51.248 144.295 -40.140 90.392 39.187 141.856-133.084 92.456 65.675 143.094-124.113 93.012 0.000 129.428 -76.260 # 162 total E -2.38314E+02 rmsd from N 0.000 %NC 0.00 93.629 74.307 138.153-102.106 93.593 49.650 139.389-102.489 92.912 37.501 143.711-134.183 92.468 41.448 129.487 -76.226 92.245 41.291 140.220-147.105 91.688 36.890 138.355-148.343 92.571 40.458 129.364 -87.360 90.584 40.061 138.565 -85.704 90.144 46.524 147.407-113.075 91.420 49.691 137.068-140.134 93.791 40.570 147.316 -38.023 92.743 38.744 101.180-112.500 89.754 51.651 141.132-130.072 90.764 50.996 144.675-115.539 90.380 42.931 142.752-132.212 92.476 37.437 132.630 -92.332 92.372 46.985 130.761 -85.371 92.584 58.701 132.290 -87.467 92.247 53.224 138.126-109.987 92.058 14.937 143.463-133.186 111.626-121.047 0.000 0.000 124.703-112.206 158.272 176.417 92.053 39.574 143.416 -91.996 93.052 49.331 137.057-105.741 92.010 67.444 115.751 -76.034 91.630 103.433 149.381-119.500 93.695 53.416 139.579-110.158 92.518 82.306 143.153-124.918 94.558-155.004 144.569-127.051 121.520 6.316 121.083-127.959 93.586 49.197 116.440 -76.389 92.944 37.885 137.222-102.292 90.329 49.424 115.282 -75.801 91.996 41.590 129.285 -76.134 89.278 39.479 142.104-131.532 91.279 45.289 145.102 -39.763 90.919 40.197 146.394-113.114 92.219 35.464 129.360 -76.136 92.775 41.430 130.164 -88.113 92.831 38.310 129.010 -76.057 93.357 35.465 137.874 -88.251 93.470 39.354 136.707 -94.500 92.431 43.669 144.522 -41.833 92.091 42.835 142.628-136.880 92.325 63.437 142.919-124.304 93.020 0.000 129.403 -76.262 # 163 total E -2.35455E+02 rmsd from N 0.000 %NC 0.00 93.629 76.486 137.994-101.355 93.607 50.073 139.569-102.735 93.124 36.840 143.746-134.291 92.487 41.340 129.551 -76.353 91.405 41.878 141.190-147.127 91.255 39.418 139.241-153.741 92.808 35.196 129.468 -87.492 89.001 45.664 141.883 -87.131 89.859 41.187 141.467 -46.103 91.524 57.098 137.420-140.686 92.953 68.407 146.627 -39.328 116.998 170.555 122.381-131.683 93.580 46.512 143.568-135.489 93.093 41.172 145.740 -39.898 91.967 41.457 143.166-130.687 93.132 46.074 130.921 -95.840 93.433 52.713 131.234 -88.830 93.580 84.507 138.332 -98.489 114.731-107.630 145.299-112.730 93.488 -29.514 143.283-133.069 111.187 -52.699 0.000 0.000 129.666 -78.982 160.283 169.050 92.667 50.877 140.157 -90.235 93.158 32.944 136.576-106.795 92.379 46.495 115.350 -76.248 93.655 92.548 146.175 -39.022 93.661 62.439 141.988-114.661 93.642 19.163 143.688-126.064 97.145 175.918 145.465-128.006 122.356 135.093 120.373-126.364 93.925 33.085 116.310 -76.423 93.382 48.021 136.255-106.243 89.371 46.296 115.881 -76.064 91.899 43.069 129.324 -76.155 90.089 36.417 142.416-132.073 91.284 47.765 147.693 -37.395 89.333 42.778 146.323-106.649 91.668 35.623 129.303 -76.089 91.740 41.257 129.346 -87.400 92.068 41.772 129.196 -76.248 92.369 38.249 137.986 -86.157 92.150 41.749 136.945 -92.503 90.755 51.556 143.414 -43.141 90.732 41.255 140.194-128.443 92.542 65.995 143.081-124.303 93.031 0.000 129.409 -76.282 # 164 total E -2.39777E+02 rmsd from N 0.000 %NC 0.00 93.629 74.547 138.161-102.108 93.593 49.372 139.406-102.584 92.871 37.837 143.694-134.158 92.488 40.920 129.491 -76.244 92.211 41.663 139.941-146.849 92.373 35.059 138.703-149.129 93.198 37.962 130.316 -86.824 91.064 39.927 138.903 -85.217 90.979 45.201 144.298 -42.426 91.199 50.956 137.610-141.046 93.522 39.425 146.827 -38.576 92.731 38.876 101.059-112.314 90.113 51.818 141.256-129.504 91.188 51.800 146.393-113.746 91.305 37.628 142.598-133.020 92.688 39.533 132.629 -91.416 92.835 71.692 130.602 -82.311 93.424 44.334 135.018-101.488 94.110 31.724 139.277-101.453 94.583 46.281 144.379-135.829 94.018 42.674 0.000 0.000 93.810 40.423 138.206-128.033 93.678 33.068 138.418 -91.488 93.229 43.765 136.396-104.959 92.281 44.029 115.628 -76.375 91.235 44.476 149.858-121.919 93.936 46.040 139.327-106.954 95.494 -78.950 144.504-127.347 120.161 -94.702 152.900 -19.374 120.394 111.037 122.084-129.961 92.702 39.554 116.236 -76.313 92.665 58.077 136.446 -99.324 89.963 51.008 115.354 -76.033 92.087 38.952 129.338 -76.133 90.069 39.703 142.566-132.188 91.099 47.895 146.163 -40.612 89.643 41.419 145.745-107.493 91.905 36.957 129.334 -76.115 92.639 40.405 129.977 -86.623 92.632 38.010 129.153 -76.072 93.407 37.250 137.583 -85.248 93.545 38.614 136.899 -93.046 92.521 44.487 145.143 -40.455 92.010 42.603 142.510-137.370 92.306 64.187 142.950-124.084 93.021 0.000 129.400 -76.260 # 165 total E -2.34432E+02 rmsd from N 0.000 %NC 0.00 93.662 91.984 138.105-100.859 93.620 47.334 139.491-103.220 92.895 38.847 143.668-134.134 92.526 39.068 129.463 -76.220 93.452 44.823 147.304-156.763 92.774 33.646 139.639-152.774 92.183 42.547 129.423 -87.756 88.606 53.562 137.756 -86.335 90.463 49.957 144.916-100.553 91.159 38.831 138.944-141.332 93.600 127.158 146.264 -40.774 94.592 60.582 99.596-107.997 95.953 32.856 143.722-136.590 94.925 46.848 146.552 -37.549 95.820 37.555 111.502 -81.349 94.435 45.701 134.900-103.677 95.884 22.186 131.939 -89.732 96.167 55.456 139.922-106.259 126.586-179.503 139.830-150.663 93.223 65.751 144.287-135.698 93.008 48.106 0.000 0.000 90.935 70.287 136.798-125.048 89.012 46.284 138.627 -90.638 91.989 43.423 135.937-103.801 89.736 42.749 114.899 -75.852 90.678 51.796 148.853-117.598 92.889 53.489 142.468-117.306 90.882 7.435 142.068-121.954 120.080 145.116 151.606 -20.409 122.120 143.136 120.396-126.340 94.444 35.008 116.227 -76.523 93.797 57.035 138.481-101.554 91.480 42.140 117.224 -75.584 92.796 32.624 129.396 -76.198 94.897 34.557 144.055-135.638 93.328 39.454 145.022 -40.272 92.123 38.907 145.231 -42.603 92.155 37.956 129.310 -76.141 92.436 42.462 129.884 -87.618 92.453 38.223 129.268 -76.211 92.928 38.610 137.786 -75.041 93.063 39.773 137.295 -90.817 91.980 46.083 144.924 -41.270 91.556 42.249 142.408-133.449 92.442 63.355 142.987-124.158 93.020 0.000 129.413 -76.264 # 166 total E -2.32340E+02 rmsd from N 0.000 %NC 0.00 93.478 30.015 133.971 -91.330 95.784-126.868 139.354-116.428 92.516 55.905 143.589-133.870 92.512 48.827 129.473 -76.233 93.056 40.612 142.887-152.244 92.090 37.422 142.771-167.543 91.912 45.448 128.945 -87.523 89.163 74.565 138.852 -85.537 90.847 31.101 150.111-127.091 94.580 50.625 142.324-147.196 94.852 127.485 146.180 -38.590 123.760-122.428 119.377-123.733 94.576 11.493 143.999-136.318 110.796-154.413 152.691 -25.103 95.138 54.046 144.075-132.908 95.123 32.706 132.430 -91.603 94.246 42.987 136.346 -82.631 93.520 44.403 137.572-114.374 93.056 46.423 143.855-138.343 91.762 40.518 143.437-136.251 91.627 47.772 0.000 0.000 91.149 50.205 133.442-121.955 89.187 50.625 140.840 -90.496 91.618 44.474 135.596-103.268 90.099 50.716 114.944 -76.149 91.841 131.616 147.188-114.513 94.023 74.550 140.150-109.992 91.615 -13.313 142.628-124.007 113.915 161.737 151.671 -19.304 93.566 126.323 100.256-114.422 91.506 37.312 115.917 -76.256 92.491 55.176 138.349 -99.968 90.542 40.011 114.941 -76.132 91.774 42.074 129.331 -76.152 87.837 48.611 141.737-130.470 90.169 41.125 144.852-104.706 91.514 40.288 145.561 -39.638 92.041 37.533 129.335 -76.126 92.322 43.602 130.544 -84.327 92.387 38.551 129.265 -76.159 92.757 37.966 137.756 -75.083 92.900 41.790 137.340 -91.432 91.022 46.370 146.111-113.359 91.498 42.862 142.123-133.073 92.445 65.229 143.045-124.242 93.027 0.000 129.413 -76.279 # 167 total E -2.32391E+02 rmsd from N 0.000 %NC 0.00 93.642 82.281 138.250-101.602 93.586 48.100 139.213-102.345 92.844 38.698 143.697-134.134 92.509 40.142 129.472 -76.220 92.734 43.000 143.278-150.685 92.239 34.843 139.083-148.052 92.789 41.793 129.662 -87.463 90.465 39.162 139.355 -87.819 90.174 48.286 148.443-108.255 90.084 51.180 136.702-139.573 92.710 55.643 146.710 -39.691 119.664 148.144 121.024-128.276 94.864 39.387 143.946-136.837 93.079 44.915 145.868 -39.597 90.869 46.480 142.629-131.892 92.862 44.050 127.523 -88.528 93.546 49.434 131.337 -88.804 93.845 79.789 137.559 -96.875 117.844-100.489 141.171 -39.286 95.210 -25.922 143.808-133.640 129.171 -65.031 0.000 0.000 126.684-109.363 159.173 173.332 92.783 40.151 141.715 -94.101 92.643 49.659 137.195 -98.501 90.448 58.857 115.209 -76.024 91.742 101.659 149.961-121.667 93.561 53.696 140.068-108.761 92.419 86.370 143.042-124.715 118.786-150.321 152.531 -19.239 122.358 5.438 120.882-127.159 94.369 46.941 116.571 -76.445 93.107 39.574 138.179-102.153 91.101 45.612 115.571 -75.903 92.195 38.562 129.315 -76.149 90.898 39.717 110.725 -82.965 90.604 43.918 147.074-115.424 90.606 42.009 147.319-116.362 92.287 36.277 129.379 -76.150 93.049 38.464 131.075 -85.580 92.541 40.339 129.355 -76.301 92.552 39.093 138.068 -84.820 92.281 44.448 137.096 -92.875 90.486 47.014 145.981-113.637 91.099 43.318 143.005-129.744 92.390 65.749 143.015-124.174 93.020 0.000 129.407 -76.261 # 168 total E -2.41973E+02 rmsd from N 0.000 %NC 0.00 93.692 55.465 139.291-110.889 93.701 48.531 140.166-105.969 94.618 31.539 143.855-133.949 92.632 43.467 129.532 -76.208 92.418 41.034 138.938-151.900 91.305 37.461 140.441-155.422 91.639 40.651 128.836 -87.728 88.089 43.111 137.165 -87.470 90.000 48.197 142.501-100.533 90.637 52.658 136.734-141.420 92.523 60.379 146.613 -39.747 119.365 -71.667 121.350-129.028 94.460 176.579 143.655-134.504 110.367 157.916 152.344 -26.268 105.232 -91.542 147.224-143.295 93.754 51.666 134.046 -90.378 93.335 57.319 133.468 -87.487 92.835 72.649 135.884 -96.012 91.582 53.003 137.785 -39.078 90.757 42.088 143.375-134.742 90.879 46.864 0.000 0.000 90.826 57.382 136.853-121.428 91.369 38.576 138.500 -90.865 92.787 38.994 136.230-104.487 92.031 42.996 115.345 -76.205 91.416 49.428 149.762-130.882 92.701 35.310 140.914-108.601 91.213 57.750 142.489-123.767 93.454 46.285 143.048-122.987 119.670 146.637 122.516-130.676 91.673 43.900 116.099 -76.200 93.511 41.847 137.437-102.722 92.127 37.707 116.218 -75.716 92.689 40.761 129.348 -76.206 91.140 39.377 142.542-132.691 92.063 41.262 145.701 -39.710 91.868 38.205 144.933 -40.650 92.322 38.260 129.377 -76.200 92.786 43.149 130.092 -87.612 92.683 36.437 129.305 -76.225 93.107 39.320 138.857 -77.827 93.112 39.093 137.221 -91.015 92.019 46.278 144.942 -41.207 91.575 42.081 142.421-133.477 92.454 63.371 143.026-124.178 93.022 0.000 129.413 -76.268 # 169 total E -2.28836E+02 rmsd from N 0.000 %NC 0.00 93.645 78.390 138.325-102.312 93.575 48.598 139.364-102.227 92.914 38.498 144.176-134.241 92.554 40.053 129.478 -76.211 92.097 41.248 139.722-150.208 90.800 37.617 138.404-147.735 92.133 44.564 127.938 -93.652 89.392 36.890 137.652 -84.008 90.199 50.785 145.537-110.897 92.152 45.487 136.879-141.505 92.370 48.423 148.547-111.847 119.257 -12.208 121.949-130.224 95.347 61.104 144.090-135.469 92.569 128.485 149.093-123.775 92.751 63.084 143.023-140.879 93.594 96.106 132.851 -90.194 96.340-161.132 132.840 -82.713 94.882-162.426 137.625-104.801 117.939 -76.762 142.182-106.422 96.314 -37.584 150.402 -30.872 95.315 103.839 0.000 0.000 115.981 18.072 153.848 -3.269 90.721 46.943 140.130 -87.207 92.731 39.198 136.260-101.311 91.523 39.542 115.257 -76.179 92.262 45.619 146.831 -37.410 92.944 58.610 137.841 -87.017 90.887 52.888 142.242-123.229 109.373-161.263 151.110 -21.120 93.153 71.964 99.804-114.366 93.534 36.440 116.400 -76.411 93.751 39.807 136.566 -98.630 93.882 36.987 115.983 -76.390 93.133 37.293 129.394 -76.222 95.750 29.825 143.990-135.769 95.083 37.028 146.591 -36.680 93.798 35.960 146.895 -40.683 92.754 37.794 129.351 -76.181 92.405 42.959 130.018 -86.438 92.174 41.284 129.283 -76.312 92.500 38.317 138.464 -78.300 92.785 39.847 137.295 -91.534 92.096 45.885 144.841 -41.280 91.480 42.313 142.961-131.852 92.461 63.203 142.985-124.408 93.021 0.000 129.415 -76.270 # 170 total E -2.40474E+02 rmsd from N 0.000 %NC 0.00 93.540 72.565 136.308 -95.101 93.880 49.051 140.772-107.332 94.558 33.468 144.197-135.315 92.864 40.057 129.516 -76.257 93.238 39.907 141.296-147.802 94.270 34.710 141.571-154.324 94.456 31.659 131.359 -85.856 94.476 37.040 140.193 -86.129 93.598 36.053 144.628 -43.386 96.741 52.521 140.966-146.205 92.157 31.452 149.065-118.065 119.338-106.867 120.670-128.388 91.117 -46.702 142.925-133.433 102.897-102.225 150.842 -30.675 108.941-133.864 149.044-146.150 93.903 38.509 134.844 -91.610 93.105 47.073 133.457 -87.548 92.954 97.051 139.872-108.805 91.979 46.914 135.732-106.590 91.013 45.495 143.242-133.528 93.356 40.468 0.000 0.000 93.197 40.799 138.544-121.021 93.152 35.471 138.827 -91.668 93.078 40.528 136.232-104.858 92.388 41.048 115.280 -76.273 92.075 41.088 150.160-117.098 93.828 46.431 141.397-117.374 92.723 76.372 143.236-124.957 95.071-158.064 144.290-128.541 121.456 5.001 121.134-128.067 93.255 46.157 116.372 -76.372 92.419 44.667 137.090-101.774 89.508 53.531 114.441 -75.651 91.688 39.194 129.274 -76.133 88.917 40.959 142.156-131.492 91.465 41.181 144.258 -41.723 91.221 41.038 144.657 -42.950 92.015 38.203 129.296 -76.114 92.384 41.477 130.731 -92.578 92.225 38.543 129.403 -76.306 92.361 41.542 137.660 -72.832 92.116 44.586 137.373 -89.510 90.595 51.451 144.281 -42.455 90.500 42.022 141.608-125.546 92.512 66.284 143.050-124.253 93.024 0.000 129.416 -76.273 # 171 total E -2.28247E+02 rmsd from N 0.000 %NC 0.00 93.632 77.546 138.154-101.731 93.616 48.931 139.641-103.460 92.692 38.630 143.622-134.013 92.479 40.668 129.480 -76.238 92.140 44.699 140.965-147.706 92.240 34.091 138.025-153.724 92.210 46.771 129.979 -85.131 89.322 66.375 139.238 -88.033 90.682 45.640 144.913-108.119 100.055 -99.542 143.256-149.944 107.670 155.985 152.140 -28.834 119.135 -15.466 121.147-129.055 92.031 111.244 143.156-133.564 92.385 96.328 147.693-115.971 92.864 54.205 111.304 -83.396 93.176 56.326 132.792 -90.529 95.632 171.139 132.443 -88.505 93.697 66.001 138.075-104.165 93.400 116.282 140.429-109.316 117.695-129.102 151.562 -22.318 91.979 55.163 0.000 0.000 91.403 50.432 136.282-122.385 91.806 38.649 138.454 -88.855 93.020 38.462 136.181-104.835 92.890 40.555 115.392 -76.145 92.834 39.416 149.420-129.304 93.667 52.618 140.765-105.684 92.302 14.737 142.965-124.445 115.889-164.095 152.314 -19.209 121.479 2.545 121.109-128.011 93.094 53.433 116.376 -76.330 93.215 37.274 138.262-105.589 91.368 43.834 115.653 -75.384 92.591 39.154 129.409 -76.207 92.637 33.963 143.042-134.017 92.612 41.512 145.890 -39.473 91.608 38.080 142.761 -45.027 92.747 37.414 129.318 -76.257 93.984 42.511 130.608 -87.950 93.803 30.391 129.400 -76.268 94.133 41.663 142.451 -90.539 93.200 37.914 137.096 -88.023 91.945 44.620 144.935 -41.258 91.954 40.771 142.332-133.370 92.874 58.812 143.107-123.714 93.026 0.000 129.439 -76.289 # 172 total E -2.36065E+02 rmsd from N 0.000 %NC 0.00 93.655 82.136 138.445-102.534 93.544 48.983 139.318-102.404 92.587 39.361 143.593-134.102 92.463 39.937 129.478 -76.230 92.219 43.588 140.722-148.980 92.248 33.171 139.052-149.434 92.994 40.280 130.252 -85.816 90.574 38.340 138.865 -85.139 92.045 48.841 144.580 -41.930 91.876 49.952 138.054-141.430 91.951 51.667 148.713-117.224 120.874-110.677 120.286-126.759 91.618 105.707 142.995-133.294 92.811 150.206 146.312-114.704 111.606 -93.538 149.867-152.070 93.696 52.830 133.932 -94.695 92.948 46.187 133.232 -87.608 92.754 48.318 134.090 -92.521 93.415 36.738 137.313-101.399 94.659 40.873 144.340-136.102 96.314 32.682 0.000 0.000 94.719 41.083 136.393-121.833 95.222 32.143 137.887 -92.808 94.020 38.313 136.150-104.272 94.645 38.451 115.629 -76.521 94.833 102.740 147.501 -36.035 93.503 65.433 140.370-105.488 94.105 14.843 109.835 -84.020 106.040-154.395 150.401-136.351 121.276 124.022 121.188-128.264 94.952 28.165 116.533 -76.538 93.193 54.750 139.600 -93.878 91.000 43.218 116.809 -76.054 92.607 33.660 129.381 -76.216 91.393 39.488 142.927-133.123 90.699 44.893 144.586 -45.402 90.246 42.503 143.918 -43.396 91.385 37.200 129.246 -76.077 91.353 44.983 129.266 -89.303 91.988 41.979 129.121 -76.155 92.251 37.162 137.869 -78.871 92.219 44.445 137.076 -90.053 90.702 53.216 143.524 -43.984 89.956 42.254 142.303-133.431 92.669 77.229 143.162-124.806 93.011 0.000 129.379 -76.169 # 173 total E -2.34335E+02 rmsd from N 0.000 %NC 0.00 93.638 76.920 138.281-102.464 93.464 50.212 139.421-102.119 92.664 38.112 143.606-133.981 92.504 40.933 129.444 -76.199 91.879 40.665 138.644-146.689 91.744 37.203 138.645-148.137 92.721 39.773 129.154 -88.366 90.115 40.768 139.297 -84.622 91.228 50.253 144.361 -42.787 90.625 103.680 136.795-141.040 94.313-143.307 145.068 -39.736 91.721 59.260 100.656-112.966 89.415 65.697 141.585-129.158 92.054 82.884 144.748 -39.151 92.057 89.008 142.154-135.686 95.245 -50.435 132.179 -93.144 95.730 -72.586 134.407 -86.788 94.728 -94.486 139.864-105.721 117.201-103.250 143.546-118.079 92.725 47.603 143.926-135.759 92.558 41.583 0.000 0.000 91.466 60.933 140.035-130.018 89.110 39.389 138.322 -92.264 92.338 44.700 135.786-103.316 90.979 46.795 115.906 -75.477 91.058 45.646 147.034-109.694 94.034 42.411 139.366-108.667 95.163 -94.326 144.338-126.974 118.012 -78.946 153.057 -20.040 119.834 122.936 122.256-130.330 92.004 46.441 116.116 -76.249 92.881 99.382 136.257 -99.972 92.780 51.858 115.438 -76.380 92.379 37.775 129.382 -76.162 90.946 42.770 142.860-132.803 91.446 39.356 146.712-114.254 91.753 41.793 145.624 -39.840 91.905 38.811 129.308 -76.117 92.087 42.595 129.999 -87.416 92.406 38.818 129.304 -76.208 92.756 39.008 138.133 -74.411 92.873 39.582 137.332 -90.734 91.819 46.858 144.813 -41.399 91.402 41.997 142.224-131.806 92.479 63.644 143.017-124.419 93.022 0.000 129.413 -76.268 # 174 total E -2.38234E+02 rmsd from N 0.000 %NC 0.00 93.616 70.534 137.917-101.717 93.614 53.153 140.982-107.036 92.603 35.770 143.588-133.963 92.306 43.216 129.469 -76.198 91.532 42.102 138.475-143.483 91.169 38.078 137.679-155.218 91.653 41.454 129.625 -85.387 88.105 48.300 139.670 -85.071 91.388 38.626 143.073 -42.696 94.894 48.358 141.440-141.587 93.127 25.623 148.686-117.949 121.173-109.577 120.557-127.204 92.371 -50.151 143.008-133.544 94.654-103.284 150.902-121.833 102.139-115.726 147.014-138.934 93.870 35.411 134.100 -90.814 93.526 51.874 133.664 -87.346 93.191 93.780 141.788-107.426 91.453 48.667 136.062 -57.479 90.462 43.458 143.092-133.600 92.431 41.606 0.000 0.000 92.494 43.864 137.526-116.672 94.463 31.750 138.061 -91.952 93.708 41.211 136.594-105.714 94.056 38.189 115.590 -76.460 93.106 42.717 150.593-122.059 93.999 32.406 140.281-100.707 95.397 49.692 144.504-127.628 95.715 19.971 144.268-125.317 122.663-157.561 121.378-127.541 90.496 56.800 115.948 -76.147 93.103 90.397 136.994-102.300 90.664 84.564 116.354 -75.995 91.953 49.147 129.332 -76.114 88.040 43.354 141.991-130.878 90.745 45.771 144.052 -40.369 90.270 38.805 145.400-117.601 92.177 39.023 129.354 -76.123 92.636 39.367 130.052 -87.914 92.382 39.325 129.294 -76.147 93.151 36.800 136.777 -79.411 93.241 40.454 137.157 -91.911 91.944 45.777 144.809 -41.364 91.534 42.397 142.317-133.203 92.451 63.326 143.024-124.328 93.022 0.000 129.414 -76.268 # 175 total E -2.29075E+02 rmsd from N 0.000 %NC 0.00 93.630 75.050 138.028-101.455 93.627 51.876 140.444-105.089 92.688 35.994 143.598-134.069 92.342 42.785 129.465 -76.195 91.833 42.505 139.739-148.881 91.599 36.418 140.005-149.247 92.463 41.415 129.692 -86.429 90.447 39.172 138.571 -85.461 91.174 49.565 147.060-122.446 90.321 40.404 136.453-143.145 91.463 142.046 146.939-107.564 93.033 83.091 101.713-113.148 92.002 91.352 142.832-133.750 93.031 178.772 147.520-120.113 95.677 53.246 144.330-136.969 94.056 31.076 133.587 -90.823 93.090 62.512 135.694 -87.027 93.100 46.693 130.165 -91.545 94.145 38.455 137.674 -76.285 95.314 37.510 144.514-137.011 95.293 37.213 0.000 0.000 93.545 50.149 138.060-126.397 93.403 30.992 137.145 -90.138 93.885 41.915 136.667-105.728 94.055 25.243 115.984 -76.576 117.172-170.442 155.016-128.811 94.136 41.482 140.815-123.953 93.159 175.132 143.574-124.914 94.471 54.388 144.259-122.221 94.490 37.627 99.648-113.805 96.353 34.145 116.765 -76.668 94.134 42.144 139.572-112.281 92.165 39.617 115.747 -76.297 92.636 40.596 129.352 -76.203 93.600 34.410 110.837 -83.075 92.681 43.283 147.388 -36.990 91.502 39.749 145.898 -39.797 91.821 37.127 129.290 -76.130 91.904 45.051 129.596 -87.190 92.287 40.051 129.014 -76.036 92.818 36.808 137.949 -78.441 93.144 39.365 137.214 -91.438 92.226 45.410 144.618 -41.614 91.758 42.126 142.292-134.657 92.468 62.922 143.054-124.207 93.020 0.000 129.419 -76.276 # 176 total E -2.28032E+02 rmsd from N 0.000 %NC 0.00 93.646 81.534 138.315-101.861 93.634 38.575 135.194 -97.492 93.068 47.384 143.702-134.417 92.967 36.197 129.485 -76.302 94.311 38.709 142.699-148.213 94.239 33.532 139.609-154.112 94.145 38.522 131.514 -83.731 91.076 40.127 141.273 -85.364 91.760 42.943 144.915 -43.023 93.529 54.853 136.975-142.207 92.066 67.615 149.494-118.163 117.306 -12.332 122.483-131.923 94.743 176.267 143.669-135.014 92.193 66.504 149.495-121.148 90.265 50.025 142.627-132.863 93.280 111.517 135.648 -80.381 93.519 59.412 136.223 -89.100 93.113 72.615 137.414-102.387 107.923 -44.190 138.243 -99.870 95.836 -70.641 110.297 -82.820 93.148 -18.256 0.000 0.000 121.265-153.776 157.099 175.567 94.027 45.403 140.484 -89.447 93.685 37.793 138.321-108.271 92.519 42.996 116.226 -76.039 92.707 45.878 149.826-125.140 93.860 76.211 139.535 -97.690 93.062 -38.576 143.216-125.152 120.037-108.045 152.610 -19.200 117.835 104.920 121.964-131.227 90.354 53.532 115.836 -75.906 92.760 48.819 135.605-104.333 91.675 35.979 115.396 -76.040 92.692 41.126 129.371 -76.152 91.582 37.142 142.705-133.042 91.975 47.663 146.930 -36.719 89.708 36.972 146.767-116.168 91.900 40.050 129.335 -76.116 92.558 39.963 127.672 -89.835 92.247 40.651 129.284 -76.121 92.503 35.058 137.416 -84.057 92.486 47.381 137.009 -93.489 90.353 45.425 142.554-103.519 91.630 44.029 142.238-133.610 92.338 65.082 142.991-124.071 93.021 0.000 129.409 -76.256 # 177 total E -2.27345E+02 rmsd from N 0.000 %NC 0.00 93.628 75.415 138.075-101.315 93.603 49.072 139.282-102.475 93.043 37.714 143.692-134.148 92.514 40.736 129.482 -76.210 92.202 42.082 138.700-150.825 91.353 35.302 138.731-148.836 91.951 41.793 129.612 -85.598 87.933 46.280 140.329 -86.538 90.122 44.876 142.958 -43.615 91.537 51.864 137.756-139.602 93.361 58.902 150.852-121.804 122.211-102.245 120.734-126.199 92.057 113.117 143.670-136.360 92.781 60.817 147.185-126.310 105.966-148.615 147.629-145.564 94.496 54.615 134.390 -91.829 93.565 41.785 133.350 -87.999 93.164 98.355 138.491-108.994 93.424 61.509 140.701-142.908 91.382 37.585 143.439-133.972 91.980 57.199 0.000 0.000 91.851 56.999 135.726-118.863 91.409 35.370 137.484 -89.224 93.425 43.156 136.576-105.207 93.730 13.971 116.024 -76.283 117.520 175.962 156.363-131.685 94.183 52.937 141.607-128.674 92.186 150.743 143.112-124.079 94.182 56.034 143.416-121.502 93.647 41.573 99.751-114.512 94.590 38.791 116.488 -76.500 93.986 38.211 137.557 -99.698 93.375 40.031 116.267 -76.206 93.059 36.113 129.412 -76.246 95.214 35.470 110.930 -82.990 92.589 37.682 146.552-115.854 91.399 44.257 148.177-128.318 91.790 39.774 129.329 -76.160 92.118 37.985 129.812 -87.769 92.395 40.636 129.192 -76.072 92.986 38.219 137.898 -87.009 92.873 39.638 136.839 -93.399 91.711 47.392 144.739 -41.513 91.227 41.950 142.126-131.242 92.444 63.956 142.991-124.175 93.015 0.000 129.401 -76.256 # 178 total E -2.28692E+02 rmsd from N 0.000 %NC 0.00 93.828 135.812 137.040 -94.696 93.597 34.685 133.960 -91.935 94.217 64.150 144.557-139.160 92.942 115.976 129.498 -76.271 117.039-112.624 149.747-170.263 94.341 38.414 142.851-155.725 93.430 39.842 131.062 -86.273 90.496 41.526 139.544 -88.245 90.900 46.305 143.542 -45.179 91.045 55.743 136.523-142.785 93.974 139.962 145.807 -37.326 115.403 57.347 122.064-132.300 90.546 48.994 142.660-132.605 92.027 49.006 144.706 -41.218 91.656 37.576 142.334-130.325 93.684 54.266 134.530 -90.589 93.484 38.774 132.469 -88.835 93.837 152.512 139.796-111.901 94.161 61.830 146.444-130.795 94.173 24.508 144.161-134.857 94.014 46.700 0.000 0.000 115.792 26.829 156.477-171.828 91.951 41.469 139.532 -91.624 92.627 39.739 136.110-104.422 92.232 45.140 114.898 -76.050 91.987 38.752 147.216-112.383 94.454 42.851 139.381-108.209 95.976 2.665 144.804-127.908 125.997-158.509 153.303 -17.492 92.819 72.464 99.690-113.705 90.966 60.946 116.062 -76.158 92.376 72.985 136.595 -95.191 90.832 42.255 115.439 -75.935 92.543 40.344 129.387 -76.144 91.758 37.781 143.072-133.132 90.987 44.729 148.944-114.371 91.425 37.818 146.961-120.301 92.816 35.105 129.428 -76.183 93.707 37.879 131.483 -85.382 92.694 40.198 129.407 -76.303 92.822 36.812 137.299 -80.074 92.781 42.121 137.179 -92.347 90.909 46.837 146.166-113.692 91.334 42.675 142.078-131.539 92.423 65.458 142.957-124.318 93.022 0.000 129.407 -76.259 # 179 total E -2.30485E+02 rmsd from N 0.000 %NC 0.00 93.654 76.558 138.507-103.705 93.421 52.237 139.888-102.511 91.971 39.342 143.333-133.457 92.373 42.214 129.493 -76.173 91.504 42.874 138.021-139.835 92.423 34.518 137.742-155.219 93.795 50.774 130.295 -88.730 93.844 -6.030 140.235 -83.029 112.690-166.508 153.260 -23.988 104.343 122.859 142.656-155.145 105.805-124.092 151.095 -32.059 117.315 20.689 122.400-131.693 90.924 66.224 142.807-132.547 91.998 55.932 145.849 -40.175 89.095 45.911 143.600-130.491 92.382 44.236 132.450 -92.363 92.911 41.654 131.093 -88.452 92.826 93.790 135.293 -86.797 93.828 57.705 139.737-128.860 94.847 23.445 144.329-135.323 96.248 85.324 0.000 0.000 116.595 16.753 155.474 -1.263 90.884 49.679 141.652 -86.550 92.097 39.773 135.847-103.164 90.522 44.878 115.044 -76.470 91.532 46.591 150.260-111.700 93.320 47.067 139.881-104.092 92.786 20.644 143.179-125.063 119.918-158.469 152.499 -18.826 93.216 69.885 99.833-114.138 91.239 75.554 116.071 -76.268 93.037 72.022 137.683-103.079 91.100 36.892 115.569 -75.829 92.565 41.652 129.409 -76.161 93.643 35.790 143.597-134.496 92.731 37.274 146.280-100.716 93.295 36.519 146.669-119.294 93.252 35.518 129.421 -76.213 93.886 39.487 131.570 -84.856 93.003 35.017 129.257 -76.270 93.455 42.135 138.080 -86.250 93.013 56.293 137.239 -90.456 91.395 35.915 146.277-113.986 93.399 50.062 145.788-141.365 92.232 61.548 142.803-124.043 92.991 0.000 129.417 -76.251 # 180 total E -2.27392E+02 rmsd from N 0.000 %NC 0.00 93.610 72.890 137.807-101.011 93.782 53.210 139.310-102.772 93.739 34.445 143.940-134.727 92.479 44.322 129.727 -76.371 90.969 40.946 139.516-146.171 91.337 37.869 139.175-149.669 92.431 37.929 129.358 -87.229 89.631 42.538 139.223 -83.659 91.364 41.886 143.319 -43.501 93.560 46.923 137.588-141.247 93.960 27.993 148.118 -38.638 122.856-108.102 119.037-123.177 91.009 -41.131 142.839-132.872 94.214 -78.990 150.824-122.268 102.317-113.906 146.681-136.116 93.347 47.551 134.336 -92.376 92.981 47.333 131.671 -86.529 92.871 86.886 138.911-103.127 91.966 58.259 136.916-120.635 91.357 28.125 143.262-132.710 101.164-119.785 0.000 0.000 126.323-136.979 157.924 176.192 92.056 44.613 142.978 -89.480 93.430 31.050 136.479-104.616 92.732 46.097 115.673 -76.332 92.539 89.590 144.855 -42.286 93.747 52.379 140.595-111.632 94.679 23.978 109.966 -83.930 98.359 174.123 146.375-128.268 121.074 143.925 121.004-127.774 95.018 31.931 116.439 -76.534 93.724 41.664 137.084-104.014 90.210 43.634 116.062 -76.851 91.718 47.762 129.322 -76.177 87.343 40.905 141.374-130.017 89.384 45.543 148.340-116.199 90.922 38.665 143.362 -43.170 92.202 38.951 129.338 -76.123 92.573 41.918 131.084 -85.724 92.544 38.257 129.338 -76.194 92.857 37.869 138.024 -76.354 92.925 41.807 137.278 -91.549 91.011 46.372 146.314-113.942 91.499 42.799 142.260-132.900 92.413 65.297 142.999-124.176 93.020 0.000 129.405 -76.266 # 181 total E -2.27312E+02 rmsd from N 0.000 %NC 0.00 93.658 76.589 138.594-103.473 93.528 51.489 139.370-101.938 92.705 37.509 143.639-134.055 92.411 42.330 129.531 -76.231 91.728 41.156 138.424-148.176 91.054 38.282 138.230-148.567 91.577 45.154 129.065 -87.078 88.164 48.232 138.735 -85.447 89.949 41.751 145.662-114.588 91.434 49.447 140.604 -21.647 92.592 159.795 144.904 -39.426 114.553 67.456 123.350-134.843 89.870 48.553 142.446-131.986 92.358 45.071 144.777 -40.479 91.604 42.584 112.188 -82.941 92.857 43.766 132.338 -93.236 93.459 32.901 130.970 -88.467 93.038 55.402 142.946-106.066 91.379 47.116 144.013-138.075 91.100 41.294 143.430-134.472 92.360 41.581 0.000 0.000 91.764 64.167 138.779-123.681 90.258 40.802 139.518 -92.347 92.455 40.075 136.163-103.963 91.057 46.729 115.233 -76.067 91.375 60.319 150.454-119.932 92.829 46.754 139.733-106.896 92.179 18.505 142.923-124.479 117.989-114.706 152.219 -19.834 122.850 112.650 120.973-126.953 112.698-104.774 120.419 -78.283 126.590-132.809 151.101 -84.867 93.663 45.336 116.859 -76.583 92.658 41.330 129.460 -76.307 90.072 41.362 143.205-137.287 90.582 46.004 145.544 -40.416 90.175 42.504 144.871 -41.221 91.542 37.352 129.256 -76.039 91.766 43.149 130.196 -86.529 92.221 39.371 129.122 -76.100 92.755 37.543 136.474 -74.147 92.915 42.244 137.452 -92.733 91.031 45.820 146.152-114.041 91.603 43.086 142.295-133.094 92.411 64.899 142.943-124.286 93.023 0.000 129.426 -76.288 # 182 total E -2.33438E+02 rmsd from N 0.000 %NC 0.00 93.674 78.531 138.954-105.011 93.527 51.592 139.782-103.169 93.357 37.774 150.010 -32.409 92.367 42.429 129.421 -76.182 92.677 41.653 140.674-138.050 95.613 32.472 138.514-150.844 94.973 37.442 132.448 -83.033 94.862 33.207 140.601 -85.889 93.712 43.238 150.392-129.478 95.582 55.840 140.225-147.140 93.338 75.097 149.386-118.430 118.953-141.340 122.966-131.930 96.172 46.224 111.189 -83.051 91.891 56.172 144.717 -38.865 91.221 66.668 142.255-137.594 93.663 36.921 132.743 -88.155 94.143 36.861 132.681 -88.103 94.295 116.110 138.545-116.387 94.051 58.357 143.642-162.005 92.599 37.941 143.639-134.368 94.812 44.768 0.000 0.000 93.897 40.115 137.492-122.932 92.100 39.731 140.769 -93.592 92.679 39.367 135.982-104.114 91.827 42.879 115.159 -76.287 91.296 44.732 147.379-114.199 93.422 53.902 140.057-105.209 93.045 -0.173 143.315-125.263 124.613 143.545 152.757 -18.146 121.414 146.637 120.643-127.069 94.501 -25.213 116.496 -76.459 95.588-168.886 138.214-108.898 123.372-118.623 122.276 -79.760 92.880 54.216 129.433 -76.186 91.595 40.050 143.742-136.004 90.550 43.926 149.400-113.744 91.128 37.570 146.495-110.027 92.440 38.832 129.383 -76.181 93.077 38.538 128.319 -83.275 93.016 36.590 129.202 -76.148 94.152 35.040 137.406 -84.623 94.007 38.851 136.920 -92.307 92.722 44.406 146.014 -40.828 91.861 42.218 142.764-134.629 92.422 62.778 143.004-124.076 93.012 0.000 129.399 -76.258 # 183 total E -2.29802E+02 rmsd from N 0.000 %NC 0.00 93.623 70.025 138.067-102.408 93.575 52.295 139.797-102.897 92.979 36.202 143.720-134.250 92.462 42.735 129.491 -76.210 92.124 39.591 138.511-142.648 92.161 39.355 138.302-149.894 92.433 41.201 129.026 -88.320 90.075 50.158 140.681 -86.086 90.780 86.511 147.600-112.388 118.814-102.909 147.776-160.671 108.031 -54.998 154.028-122.112 120.176 -81.421 120.952-128.298 93.131 48.372 143.534-134.768 92.309 42.362 145.506 -40.011 89.617 48.052 141.774-130.311 92.335 42.699 130.587-102.998 93.009 46.802 130.955 -89.053 93.584 28.787 137.352 -98.007 108.241 176.541 143.790-105.619 94.607 79.772 144.248-135.004 95.242 155.208 0.000 0.000 125.824 54.857 159.758 166.730 91.964 38.300 141.929 -89.714 93.350 36.566 136.877-105.882 91.232 51.490 115.627 -76.003 91.508 57.484 144.766 -41.731 93.054 44.849 140.549-114.907 92.208 94.549 142.984-124.523 108.640-150.664 151.658-141.023 122.591 9.066 120.833-126.967 94.630 48.085 116.607 -76.488 92.930 38.306 137.550 -98.714 90.980 47.177 115.153 -76.106 92.313 44.120 129.311 -76.147 91.298 35.219 142.676-132.853 91.932 45.772 147.241 -37.655 89.668 44.400 148.874-118.366 91.598 36.411 129.301 -76.105 91.778 40.717 129.209 -87.932 92.074 42.541 129.177 -76.193 92.370 39.621 137.850 -85.736 92.240 40.946 136.971 -92.152 90.793 53.671 143.793 -42.364 90.655 40.775 139.585-127.904 92.582 66.790 143.100-124.422 93.025 0.000 129.417 -76.270 # 184 total E -2.32396E+02 rmsd from N 0.000 %NC 0.00 93.634 77.656 138.198-102.001 93.603 48.270 139.337-102.717 92.822 38.824 143.704-132.257 92.667 39.387 129.352 -76.179 92.619 42.762 139.893-148.416 92.857 34.161 139.178-149.520 93.367 39.275 131.734 -86.338 90.260 39.743 140.393 -87.777 91.073 47.822 143.913 -43.487 91.308 43.613 137.527-141.597 91.874 133.919 149.551-115.343 92.007 61.607 101.248-113.055 88.060 53.668 141.541-127.183 91.788 49.908 143.171 -42.482 93.180 40.339 141.837-131.221 94.567 35.913 133.449 -92.070 96.979 143.135 138.084 -90.726 93.731 67.540 138.062-105.560 109.678 -26.419 144.070-129.286 121.938 62.646 112.889 -83.953 121.620 4.446 0.000 0.000 92.578 93.382 136.205-124.425 93.036 38.877 138.499 -89.399 93.191 41.127 136.638-105.983 93.796 37.743 115.521 -76.297 92.918 42.711 151.922-130.035 93.140 43.810 142.424-106.811 91.244 49.214 142.462-123.895 93.198 41.993 143.023-123.221 121.934 161.599 121.295-127.746 93.274 40.546 116.314 -76.377 93.686 41.647 137.445-103.119 90.675 46.909 116.882 -75.831 91.937 41.978 129.431 -76.272 88.249 40.381 141.765-130.843 90.370 48.286 144.419 -41.036 90.775 41.733 144.106 -42.935 91.957 36.230 129.299 -76.115 92.118 44.270 129.442 -87.970 92.269 42.145 128.990 -76.095 92.573 37.899 137.117 -78.053 92.831 39.704 137.326 -91.237 91.947 46.806 144.827 -41.346 91.364 41.957 142.389-131.590 92.479 63.541 142.998-124.295 93.012 0.000 129.412 -76.247 # 185 total E -2.32307E+02 rmsd from N 0.000 %NC 0.00 93.924 125.153 140.055-106.687 93.202 58.565 141.314-109.732 90.622 40.877 142.952-132.605 92.111 41.723 129.384 -76.111 91.883 40.991 139.001-143.316 91.519 37.088 139.671-151.526 91.805 42.584 129.511 -85.612 88.556 42.736 139.273 -86.088 90.083 46.972 145.813-112.397 92.613 50.370 137.249-140.294 92.889 44.385 148.807-116.911 92.948 37.200 101.831-116.600 92.753 60.399 149.676 -33.048 92.099 -16.897 146.341-117.131 120.609-137.722 113.091 -84.383 94.536 78.007 134.774 -87.455 94.341 55.822 133.957 -88.229 94.219 159.568 138.657-103.398 114.931-151.688 145.651-145.351 119.983-152.217 154.561 -19.442 95.130 83.408 0.000 0.000 93.157 83.938 138.964-127.230 91.289 41.306 138.479 -88.627 92.690 41.358 136.443-105.466 91.737 40.951 115.200 -76.102 91.705 42.403 148.190-114.759 93.572 42.462 140.941-106.201 92.282 51.021 143.007-124.761 93.688 47.302 143.281-123.709 122.430 173.037 121.399-127.787 91.172 56.275 116.027 -76.177 93.113 49.056 137.240-102.288 89.873 45.336 116.241 -75.380 92.057 40.792 129.347 -76.180 89.183 41.096 142.153-131.524 90.794 46.310 144.945 -40.537 90.549 41.740 144.216 -41.873 91.803 37.293 129.292 -76.103 92.216 41.958 129.634 -88.182 92.297 40.843 129.213 -76.146 92.591 38.030 136.073 -67.375 92.945 40.491 137.448 -89.776 91.899 45.882 144.856 -41.341 91.562 42.436 142.436-133.107 92.432 63.312 142.992-124.173 93.020 0.000 129.414 -76.268 # 186 total E -2.27303E+02 rmsd from N 0.000 %NC 0.00 93.646 81.178 138.415-102.460 93.565 48.900 139.271-102.385 92.641 39.001 143.637-133.999 92.465 40.291 129.489 -76.233 92.339 43.533 141.317-149.209 92.362 33.195 139.026-149.450 93.047 40.975 130.615 -84.460 91.476 36.465 137.949 -83.224 92.735 47.694 145.182 -40.828 92.302 45.838 138.306-141.362 92.561 38.055 148.539-116.024 121.837-118.541 121.003-127.209 93.352 148.582 143.281-136.352 113.616-114.764 154.454-130.622 108.211 -83.061 148.393-145.868 96.038 130.397 135.019 -89.618 120.562-132.837 154.189 -98.248 93.832 57.247 137.998-103.483 93.598 46.648 140.269-118.676 93.507 46.215 144.223-132.536 95.523 115.448 0.000 0.000 125.167-135.190 158.898 175.886 93.901 39.949 140.854 -89.656 93.869 35.072 137.153-106.178 92.582 44.764 115.969 -76.135 92.432 40.526 146.391 -40.875 93.508 58.324 143.107-121.001 92.229 9.403 142.888-124.308 120.800 126.890 152.263 -18.973 124.241 152.738 119.275-123.371 95.821 26.252 116.725 -76.622 94.351 47.307 137.541-102.657 92.324 41.893 116.893 -76.401 92.374 41.910 129.335 -76.107 91.448 34.998 142.845-133.182 92.903 40.847 145.274 -39.220 92.754 36.428 145.191 -42.595 92.764 38.307 129.354 -76.173 93.247 40.956 130.167 -87.429 92.754 37.888 129.495 -76.397 92.912 38.826 138.541 -75.217 92.967 39.338 137.259 -90.733 91.892 46.706 144.865 -41.314 91.435 41.994 142.232-132.260 92.449 63.583 142.967-124.260 93.020 0.000 129.411 -76.267 # 187 total E -2.30364E+02 rmsd from N 0.000 %NC 0.00 93.740 88.558 139.718-107.937 93.359 50.684 139.431-101.031 91.457 40.561 143.254-133.113 92.245 41.794 129.406 -76.174 92.075 42.873 141.104-144.624 92.556 35.025 138.158-149.554 92.364 45.546 129.260 -87.646 89.709 56.754 138.663 -86.376 91.334 89.814 146.564-112.972 113.433 -87.385 145.102 -11.717 101.254 150.283 148.862 -33.597 120.075-137.414 120.944-128.456 94.375 34.991 143.816-136.320 92.883 46.547 145.346 -39.931 91.529 50.871 144.229-136.536 92.855 41.427 132.227 -91.656 92.975 34.100 131.104 -88.581 93.251 85.936 137.222-101.868 93.232 53.963 138.953-105.786 95.029 34.253 150.308 -31.128 95.755 37.556 0.000 0.000 94.221 47.392 140.285-131.151 92.256 34.790 140.009 -94.386 92.663 46.774 136.211-104.407 92.278 61.256 116.108 -76.806 90.620 55.414 149.008-111.580 93.281 29.903 139.525-104.942 95.401 162.729 109.573 -83.164 119.391-176.217 153.163 -18.583 122.273 -88.931 120.881-127.272 92.415 51.746 116.283 -76.299 92.508 44.281 137.035-100.553 88.625 49.820 115.616 -75.939 92.039 41.484 129.322 -76.128 89.024 41.377 142.044-131.200 89.619 51.841 147.253-114.757 89.601 43.873 144.309-117.115 91.687 36.986 129.347 -76.107 92.024 40.340 130.070 -88.042 92.165 42.730 129.160 -76.101 92.782 37.058 136.336 -80.631 92.967 40.146 137.173 -92.012 91.969 47.823 144.874 -41.250 91.530 40.584 142.364-131.139 92.703 64.447 143.289-125.846 93.023 0.000 129.415 -76.273 # 188 total E -2.29174E+02 rmsd from N 0.000 %NC 0.00 93.605 42.095 137.388-104.400 93.499 51.704 139.202-102.102 92.801 39.774 143.629-134.082 92.550 39.321 129.502 -76.228 92.571 42.122 140.900-153.961 91.388 36.282 139.042-148.013 91.806 45.501 129.973 -84.437 88.779 43.729 138.127 -87.064 90.793 40.597 147.334-113.611 94.420 40.449 139.325-143.732 93.127 150.397 146.848-109.050 122.105 161.677 120.707-126.442 91.880-125.285 143.207-134.530 93.974 57.371 146.952 -37.629 92.625 42.988 143.460-135.113 92.885 42.483 133.035 -87.708 93.117 61.052 137.508 -79.115 93.327 36.172 132.998 -83.569 94.431 34.810 136.723 -50.655 95.190 43.197 151.619 -32.869 93.379 39.904 0.000 0.000 92.840 43.194 138.061-127.556 94.220 29.781 138.123 -92.420 93.196 48.174 136.294 -97.823 92.201 50.943 115.897 -77.007 91.042 49.531 149.216-117.808 93.732 12.854 139.375-106.001 118.034-148.403 111.890 -82.445 115.266 163.946 151.973 -19.429 122.878 -90.195 119.880-125.493 90.053 55.277 115.854 -76.051 92.295 57.311 137.950-108.257 87.446 49.612 114.675 -75.589 91.407 44.008 129.287 -76.094 88.600 41.911 141.891-130.447 89.991 42.132 144.255 -93.752 91.273 39.922 144.332-109.516 92.765 37.368 129.432 -76.200 93.631 36.354 130.356 -87.552 92.948 38.340 129.499 -76.440 93.241 40.117 138.183 -83.381 92.705 40.686 137.020 -90.266 91.009 54.067 145.174 -41.238 90.292 41.038 140.328-124.364 92.606 67.119 143.146-124.585 93.027 0.000 129.405 -76.261 # 189 total E -2.32996E+02 rmsd from N 0.000 %NC 0.00 93.617 76.448 138.031-101.391 93.579 49.222 139.440-103.454 91.839 39.413 143.399-133.574 92.459 41.136 129.456 -76.259 92.657 40.201 140.837-146.725 92.427 35.956 140.657-154.431 92.718 41.109 129.624 -86.938 91.601 37.268 139.022 -85.684 91.194 44.998 147.550-110.657 92.320 51.262 138.543-143.342 92.402 49.393 146.928 -39.565 120.230 -97.679 120.276-126.852 100.048-114.332 145.815-139.699 107.358 158.605 152.813 -28.830 119.464 -78.954 152.598-155.478 94.170 58.051 134.232 -91.700 93.138 43.361 133.327 -87.773 92.763 86.142 134.144-101.906 93.184 109.168 135.300-124.258 93.071 70.508 143.506-133.211 94.016 124.438 0.000 0.000 127.617 11.642 159.386 170.687 93.033 46.428 139.574 -88.915 93.172 37.216 136.446-105.040 92.514 42.527 115.358 -76.046 92.435 45.989 150.061-126.136 93.400 48.643 140.257 -98.021 92.420 -2.663 143.109-125.852 120.842 156.149 112.778 -82.000 93.061 50.941 100.131-115.252 92.072 41.048 116.166 -76.301 93.263 65.951 138.050-104.814 92.051 141.843 116.233 -75.847 92.650 47.338 129.385 -76.164 91.556 36.000 143.142-132.403 91.858 43.510 145.647 -40.101 91.671 37.776 144.455 -43.379 92.250 38.387 129.326 -76.148 91.985 43.395 129.381 -86.653 92.328 40.177 129.027 -76.115 92.691 37.169 137.952 -78.815 93.053 39.813 137.172 -91.475 92.113 45.492 144.687 -41.410 91.692 42.225 142.284-134.282 92.425 63.181 142.999-124.098 93.012 0.000 129.397 -76.258 # 190 total E -2.30422E+02 rmsd from N 0.000 %NC 0.00 93.633 74.266 138.151-102.083 93.534 50.115 139.235-102.238 92.908 38.045 143.686-134.170 92.471 41.494 129.538 -76.284 91.543 42.344 139.820-144.890 91.048 41.401 138.243-148.655 92.274 38.912 131.368 -92.359 88.668 48.452 142.042 -83.534 89.414 45.894 146.403-112.894 89.979 99.246 136.867-140.208 93.692-157.709 147.164 -40.624 93.860 60.264 100.498-112.439 93.039 58.873 112.011 -82.964 92.896 121.229 145.572 -38.483 94.303 54.507 143.824-133.701 94.213 33.583 133.616 -90.598 94.404 91.340 136.938 -87.684 93.831 130.416 137.624 -96.886 107.414-127.480 143.437-130.928 93.636 54.965 144.324-136.218 94.912 40.597 0.000 0.000 95.203 36.724 137.472-125.735 93.164 37.773 139.676 -93.827 92.947 40.703 135.482-103.524 92.130 45.126 115.251 -76.359 91.812 35.324 149.047-120.062 93.459 54.003 144.837-112.886 90.977 41.634 142.167-123.952 92.923 48.718 143.169-123.519 121.242 168.175 121.176-128.282 94.162 43.606 116.482 -76.513 93.573 44.335 137.392-103.446 91.020 76.269 117.006 -75.769 92.267 42.426 129.358 -76.203 88.939 39.247 142.280-131.620 90.811 52.239 145.150 -41.182 90.693 39.850 142.262 -44.899 92.362 37.606 129.383 -76.131 93.567 43.318 130.264 -88.162 93.381 33.932 129.346 -76.191 93.615 40.591 140.592 -83.808 93.744 34.618 135.643 -86.969 93.534 44.089 145.520 -40.022 93.401 37.208 143.075-134.422 93.660 60.138 143.627-127.021 93.017 0.000 129.437 -76.279 # 191 total E -2.30071E+02 rmsd from N 0.000 %NC 0.00 93.643 78.165 138.385-102.559 93.585 48.945 139.316-102.736 92.882 38.363 143.676-134.131 92.517 40.178 129.411 -76.178 92.631 42.578 140.759-147.535 92.325 35.008 138.923-149.110 92.710 41.351 130.041 -84.930 90.436 38.793 140.480 -88.873 90.398 47.742 146.652-107.970 92.277 48.757 137.352-140.462 93.227 38.069 148.939-117.077 93.302 36.676 100.881-112.512 94.167 41.232 110.202 -83.577 92.502 41.554 146.878-115.937 91.250 42.603 142.078-132.228 92.937 40.754 130.947 -95.772 93.140 49.659 131.418 -88.243 93.329 51.532 136.625-104.642 109.673-105.541 141.461-119.631 94.691 121.586 144.326-135.171 134.832 -85.719 0.000 0.000 125.767 168.461 157.384 173.626 92.909 56.433 140.832 -88.591 93.316 34.285 136.851-105.155 91.283 48.002 116.055 -75.925 91.976 38.643 145.363 -41.317 93.372 52.867 139.949-100.397 92.677 40.099 109.386 -83.492 112.502-101.829 151.635 -20.831 120.440 109.571 121.479-129.069 92.929 36.942 116.522 -76.400 93.107 46.970 138.915 -95.052 91.811 36.961 115.821 -76.045 92.621 39.353 129.368 -76.181 90.122 41.375 142.272-131.402 90.428 45.514 147.600-121.424 90.516 37.029 146.670-115.271 92.284 36.558 129.383 -76.145 92.541 42.007 130.772 -88.888 92.397 39.253 129.144 -76.176 93.099 33.703 137.440 -84.721 93.122 43.043 136.856 -93.461 91.678 43.751 143.538 -44.162 91.917 43.365 142.629-135.492 92.361 62.745 142.987-124.096 93.022 0.000 129.415 -76.269 # 192 total E -2.37631E+02 rmsd from N 0.000 %NC 0.00 93.785 135.922 136.316 -91.345 93.736 43.680 140.340-105.505 93.913 35.122 144.050-135.086 92.624 40.300 129.749 -76.539 92.997 40.929 138.993 -25.483 92.224 37.290 139.985-155.160 91.662 40.372 128.878 -87.534 88.406 46.315 138.579 -87.859 90.426 52.184 142.924 -43.765 89.757 94.403 137.560-142.310 93.722-152.601 145.827 -39.956 93.044 56.784 100.668-113.075 93.179 38.290 143.020-133.387 93.326 87.154 146.982 -37.515 92.024 49.546 142.531-135.674 92.813 44.504 133.521 -92.968 93.145 42.497 132.067 -87.574 92.922 81.322 137.045 -80.321 93.111 35.583 135.881-112.778 93.530 37.917 143.618-133.308 117.175 14.429 0.000 0.000 94.650 45.366 135.114-121.505 94.956 31.085 139.010 -90.884 93.455 42.899 139.243-108.266 92.969 36.407 115.499 -76.428 92.952 42.171 150.169-120.802 94.052 37.069 140.830-103.643 94.608 46.944 144.145-126.930 95.390 24.984 144.221-125.236 122.779-161.610 121.629-127.999 90.930 61.020 116.013 -76.176 92.898 58.511 137.101-101.886 89.032 51.607 115.926 -75.382 92.092 41.293 129.338 -76.163 89.080 38.874 142.229-131.561 90.629 49.075 145.325 -40.654 90.180 42.811 143.642 -43.179 91.715 37.305 129.282 -76.096 92.034 41.949 129.446 -88.380 92.151 42.529 129.297 -76.209 92.349 39.029 136.433 -69.745 92.603 40.622 137.483 -89.525 91.701 47.107 144.805 -41.417 91.386 41.655 142.377-130.474 92.575 63.953 143.087-124.803 93.023 0.000 129.412 -76.260 # 193 total E -2.28940E+02 rmsd from N 0.000 %NC 0.00 93.638 78.530 138.163-101.698 93.531 49.618 138.752 -97.101 93.626 37.069 144.011-136.883 92.602 39.407 129.501 -76.233 92.139 41.394 140.327-147.354 91.883 37.962 139.937-150.887 92.325 40.159 129.362 -87.817 89.644 39.089 138.275 -86.626 90.540 48.790 147.456-113.829 91.485 52.051 136.042-132.486 93.340 60.930 146.915 -39.129 120.539 176.858 121.033-127.967 94.251 33.915 143.812-135.879 92.643 47.501 145.697 -39.933 89.999 50.729 142.221-130.395 92.795 41.808 128.925 -94.545 92.965 36.730 133.307 -91.569 93.127 49.953 140.557-113.100 92.547 46.088 133.021 -88.265 101.485 -54.733 145.922-139.116 126.057 -40.204 0.000 0.000 124.949-123.423 158.493 175.641 93.225 39.432 140.395 -90.890 93.328 37.635 137.010-105.517 92.501 42.832 115.751 -76.187 93.216 37.194 146.217 -40.175 94.032 48.153 139.571-102.879 93.310 16.096 143.466-125.407 118.027-145.781 152.038 -19.598 120.184 124.450 121.314-129.004 93.463 35.510 116.296 -76.363 93.447 44.422 138.087-111.921 90.276 39.881 115.627 -76.203 92.095 44.662 129.320 -76.182 89.322 38.432 142.048-131.418 91.118 46.205 146.169 -37.782 90.533 39.270 144.289 -42.243 91.727 37.964 129.286 -76.096 91.645 44.967 128.825 -91.531 91.991 41.344 129.106 -76.093 92.290 37.840 137.852 -80.098 92.761 41.454 137.118 -91.192 91.718 45.854 144.449 -41.231 91.600 42.504 142.491-133.733 92.437 63.559 143.065-124.145 93.021 0.000 129.415 -76.266 # 194 total E -2.38002E+02 rmsd from N 0.000 %NC 0.00 93.701 102.422 138.410-101.967 93.470 45.899 138.287-100.071 92.683 43.352 143.584-134.061 92.885 34.632 129.470 -76.275 93.801 43.704 145.267-151.390 94.198 30.982 139.070-148.819 94.082 42.835 131.400 -85.289 92.930 34.180 140.102 -84.930 92.306 50.396 151.817-135.312 91.776 45.370 139.365-141.211 92.836 45.056 148.316-117.488 121.954 -74.996 120.898-127.055 114.880-139.268 112.342 -83.662 122.421 55.976 156.301-133.987 95.949 35.438 144.496-137.267 93.785 44.385 134.016 -91.386 93.650 40.720 130.221 -99.400 93.075 43.963 135.560 -86.671 94.489 33.452 138.486-103.164 96.913 37.336 145.021-137.281 97.321 30.448 0.000 0.000 95.893 43.049 140.360-132.044 93.204 35.501 139.043 -91.486 92.947 38.291 136.370-104.677 91.706 43.434 115.224 -76.591 92.404 41.641 145.279 -41.131 93.512 49.545 139.786-105.316 92.932 33.995 143.268-125.015 119.864-175.645 152.550 -18.269 93.276 68.336 99.789-114.153 91.685 44.647 116.079 -76.222 92.776 101.094 136.953-101.127 92.469 52.901 116.161 -76.494 92.623 36.290 129.379 -76.167 90.819 41.991 142.843-132.440 90.114 48.203 148.107-127.826 89.412 43.536 144.125 -42.841 91.156 40.410 129.247 -76.047 91.440 44.489 128.522 -76.146 92.214 37.991 129.118 -76.088 92.840 38.271 137.959 -80.754 93.157 39.669 136.530 -89.409 91.964 47.017 145.010 -41.141 91.309 41.728 142.263-133.824 92.336 66.224 142.989-124.071 93.016 0.000 129.397 -76.259 # 195 total E -2.37565E+02 rmsd from N 0.000 %NC 0.00 93.641 78.296 138.384-102.544 93.589 48.611 139.188-102.359 92.755 38.893 143.625-133.395 92.551 40.092 129.372 -76.167 92.052 43.230 139.329-150.011 91.734 35.552 138.978-148.719 92.579 42.117 130.973 -89.202 90.308 37.187 136.657 -83.112 91.596 48.945 144.074 -43.421 93.150 46.070 138.125-141.410 94.475 34.903 147.176 -38.280 94.934 35.680 100.721-109.825 94.989 51.294 144.755-137.267 93.054 26.814 144.882 -41.153 96.061 129.824 110.647 -85.346 94.808 82.970 135.237 -90.592 94.804 1.124 132.800 -88.037 95.450 174.318 139.865-105.323 93.602 56.773 147.708 -96.105 92.986 34.847 143.808-134.688 94.377 42.806 0.000 0.000 93.219 42.077 137.028-124.990 90.463 40.671 141.206 -94.746 92.273 37.918 135.911-103.518 91.166 41.773 115.214 -76.196 89.972 47.447 147.579-113.471 92.729 43.668 140.218 -99.704 90.690 50.601 142.166-123.460 92.979 43.593 142.915-122.977 120.038-174.589 121.826-129.774 92.633 54.535 116.241 -76.265 93.442 40.533 137.381-102.797 90.844 45.055 116.525 -75.472 92.363 39.872 129.320 -76.171 89.805 38.381 142.221-131.834 91.649 43.638 145.069 -40.507 92.111 37.085 144.461 -42.922 92.740 36.786 129.368 -76.171 92.968 42.814 129.859 -87.630 92.547 40.192 129.279 -76.291 92.425 39.262 139.134 -76.435 92.596 39.176 137.312 -90.941 91.806 47.698 144.793 -41.469 91.154 41.780 142.532-129.891 92.513 63.863 143.014-124.336 93.020 0.000 129.418 -76.279 # 196 total E -2.36649E+02 rmsd from N 0.000 %NC 0.00 94.313 160.012 139.294-103.730 93.317 54.044 139.327-101.080 91.677 40.496 143.257-133.125 92.349 40.488 129.526 -76.274 92.405 40.806 140.803-149.701 91.109 36.249 138.045-147.361 92.091 45.728 130.537-103.269 88.681 40.718 138.700 -82.837 89.573 54.736 146.003-115.654 91.151 63.207 135.677-139.250 93.387-153.758 147.218 -37.145 123.420 9.683 121.129-126.575 100.433 53.221 145.792-139.590 95.057 26.838 145.858 -36.882 95.674 47.327 145.895-148.607 93.080 40.536 135.825 -98.657 93.111 37.877 131.536 -87.888 93.355 116.833 138.488-107.590 93.116 67.458 141.368-100.929 93.709 33.239 150.186 -31.779 93.955 43.114 0.000 0.000 92.744 43.111 135.939-122.367 92.067 40.467 139.928 -93.416 92.610 37.907 136.150-103.594 91.509 42.943 115.090 -75.906 91.840 50.105 148.703-119.887 93.314 37.829 139.812 -97.320 93.384 39.288 143.518-125.826 96.068 160.511 144.564-129.166 93.252 54.267 99.726-113.448 92.006 50.135 116.173 -76.276 93.303 112.156 138.553-101.054 91.946 45.634 116.227 -76.268 92.278 43.886 129.378 -76.159 90.489 43.149 142.699-132.406 91.011 40.346 148.074-109.911 92.173 40.560 146.300 -38.788 92.158 35.813 129.325 -76.131 92.212 43.491 130.101 -87.019 92.352 39.479 129.256 -76.329 92.626 38.374 137.386 -72.732 92.853 39.487 137.404 -90.609 91.790 46.563 144.780 -41.447 91.119 42.709 142.129-130.220 92.347 63.349 142.969-123.560 93.022 0.000 129.413 -76.268 # 197 total E -2.27774E+02 rmsd from N 0.000 %NC 0.00 93.627 75.877 138.171-101.991 93.588 49.594 139.407-102.683 92.920 37.622 143.729-134.359 92.491 41.444 129.498 -76.213 92.343 42.675 140.630-148.174 91.712 36.152 138.392-150.446 92.337 45.958 129.048 -83.841 90.783 72.858 139.048 -85.149 91.623 23.296 147.246-115.866 113.185 -94.142 145.734 -10.779 101.732 164.394 148.472 -32.344 119.076 -74.547 120.941-128.935 91.253 96.226 149.990 -31.798 92.123 150.520 144.603 -44.897 96.701 70.288 145.611-140.735 93.716 23.880 132.836 -91.464 93.240 66.103 140.506 -87.776 92.737 47.722 135.205 -93.749 91.661 38.381 142.398-101.619 94.054 42.106 143.899-135.200 97.590 28.073 0.000 0.000 95.167 42.132 138.163-120.427 93.238 37.740 140.462 -94.045 92.644 40.402 136.712-102.573 91.271 48.913 115.178 -76.316 93.810 127.336 144.652 -38.841 93.785 48.078 139.957-109.635 93.683 45.675 143.643-125.835 118.842-163.293 152.600 -18.597 93.862 99.759 99.931-114.185 94.960 29.675 116.723 -76.515 93.284 54.390 142.372 -99.694 91.200 37.297 116.122 -76.201 92.303 39.479 129.339 -76.178 90.063 41.992 142.428-131.982 91.846 43.210 144.749 -39.461 91.295 37.012 145.283 -41.478 92.114 37.940 129.294 -76.103 92.218 44.688 130.119 -94.651 91.922 41.907 129.270 -76.160 92.204 35.578 137.793 -79.847 92.497 44.440 137.143 -91.261 91.109 45.969 143.294 -43.931 91.462 42.954 142.361-132.562 92.387 63.781 143.016-124.065 93.026 0.000 129.407 -76.269 # 198 total E -2.35006E+02 rmsd from N 0.000 %NC 0.00 93.663 85.225 138.528-102.537 93.608 48.863 139.286-102.598 92.739 38.534 143.642-134.014 92.453 40.605 129.508 -76.261 92.570 43.538 143.619-149.815 92.238 33.182 138.980-149.222 92.918 42.234 130.462 -86.424 91.167 37.211 139.550 -86.694 91.040 48.708 149.296-116.387 91.829 47.944 137.485-140.364 93.179 40.170 148.614-115.554 93.203 42.764 101.539-113.386 92.134 65.910 141.493-131.771 91.783-102.119 145.953-116.421 92.741 108.251 143.405-134.662 123.252-129.285 151.812-101.414 95.056 -75.371 133.903 -87.097 94.775 -91.192 143.419-112.789 116.635-103.464 143.914-145.930 93.640 40.387 144.233-136.403 92.569 44.500 0.000 0.000 91.238 64.768 136.779-125.511 90.365 39.166 138.230 -91.497 92.446 40.338 136.188-104.430 92.442 41.404 115.551 -76.189 91.865 38.305 147.469-110.309 93.805 41.655 140.902-113.509 92.081 50.408 142.928-124.502 92.595 42.915 142.709-122.566 120.933 150.897 121.857-129.253 92.265 40.543 116.174 -76.259 93.404 43.559 137.367-102.567 91.236 42.161 116.292 -75.612 92.183 40.527 129.355 -76.203 89.604 40.334 142.183-131.783 91.409 43.412 145.613 -40.116 90.922 40.216 144.773 -40.366 91.963 37.979 129.310 -76.127 92.210 42.271 129.711 -88.038 92.251 39.994 129.257 -76.203 92.750 38.169 136.582 -71.781 93.018 40.398 137.368 -90.381 91.954 45.768 144.902 -41.277 91.597 42.415 142.527-133.548 92.419 63.273 143.014-124.141 93.022 0.000 129.421 -76.275 # 199 total E -2.36114E+02 rmsd from N 0.000 %NC 0.00 93.582 72.113 137.238 -98.793 93.779 48.827 139.804-106.366 93.298 37.054 143.810-134.453 92.509 41.201 129.476 -76.216 92.427 43.572 141.449-144.473 92.124 35.652 136.967-153.886 91.791 42.218 129.090 -87.759 87.772 48.956 138.508 -88.142 89.084 47.383 146.057-107.099 90.919 55.438 138.762-142.069 94.679 68.856 147.086 -38.383 121.013-133.355 122.300-129.452 94.026 70.354 143.556-134.545 91.741 129.369 145.580 -40.531 96.297 68.434 141.385-142.585 93.560 29.932 133.047 -91.397 93.253 52.932 134.647 -87.255 92.987 57.945 133.739 -89.975 93.490 61.982 140.890-139.306 92.856 4.924 143.636-133.576 118.150 -92.557 0.000 0.000 124.471 -99.862 159.647 170.292 94.835 41.805 142.432 -90.928 92.956 37.618 140.930-111.471 91.107 41.934 114.878 -76.016 92.750 42.994 145.033 -41.911 93.527 44.123 140.375 -99.493 92.525 49.044 143.120-124.987 94.684 27.745 143.798-124.619 122.681-162.807 121.603-127.950 91.265 63.477 116.075 -76.201 92.972 55.002 137.105-101.906 89.309 45.635 115.601 -75.913 91.830 43.719 129.312 -76.149 87.775 44.005 141.745-130.586 90.794 43.756 144.593 -40.650 91.061 41.237 144.958 -39.941 91.824 37.505 129.290 -76.098 92.275 43.555 129.723 -88.019 92.540 37.259 129.235 -76.178 92.937 39.391 138.476 -75.691 93.007 39.303 137.273 -90.866 91.956 46.348 144.910 -41.257 91.538 42.038 142.402-132.833 92.473 63.438 143.034-124.320 93.022 0.000 129.412 -76.266 # 200 total E -2.30775E+02 rmsd from N 0.000 %NC 0.00 93.640 79.694 138.277-102.041 93.594 48.022 139.264-102.469 92.766 38.800 143.616-134.077 92.471 40.227 129.450 -76.214 92.190 43.816 141.243-150.788 92.006 33.579 139.140-149.041 92.768 41.229 129.869 -81.431 90.583 38.105 138.503 -86.951 90.849 47.737 144.251 -43.214 91.909 51.843 137.634-140.683 93.345 42.100 145.350 -38.096 93.756 30.486 101.104-114.826 97.844 41.959 110.520 -82.876 93.920 35.072 147.619-116.235 93.182 51.124 145.479-142.601 93.410 31.914 133.886 -85.031 94.600 44.705 132.728 -87.337 94.579 8.337 137.349-104.821 121.435-149.823 144.119-102.029 93.589 70.809 143.976-134.301 119.555-174.693 0.000 0.000 127.487 17.879 160.651 169.102 91.985 46.661 139.820 -89.244 93.023 39.579 136.509-106.126 94.791 53.837 115.570 -76.559 93.913 -49.806 150.530-121.284 124.862-128.661 145.687 -91.055 91.940 46.858 143.012-124.644 95.305 151.962 109.255 -82.890 119.978 159.702 121.932-130.021 93.200 46.279 116.353 -76.353 93.288 39.336 137.220-102.455 90.418 46.484 116.288 -75.709 92.449 42.122 129.263 -76.123 90.298 37.722 142.481-132.289 90.951 48.305 146.230 -40.461 89.286 45.862 146.392-118.395 91.200 37.733 129.315 -76.107 91.159 45.661 129.456 -77.368 92.363 38.515 128.781 -75.817 93.389 36.352 137.536 -86.717 93.939 37.804 136.721 -94.169 93.298 41.628 145.193 -40.070 92.771 42.806 143.062-140.752 92.407 61.040 142.989-124.236 93.019 0.000 129.411 -76.262 # 201 total E -2.33818E+02 rmsd from N 0.000 %NC 0.00 94.322 162.170 138.965-102.700 93.326 53.059 139.356-100.517 91.395 40.807 143.234-132.811 92.252 41.570 129.579 -76.275 91.944 42.076 141.410-151.580 91.359 35.652 137.858-147.924 91.904 45.432 129.046 -87.106 88.536 44.417 138.150 -84.183 90.417 46.791 146.174-114.078 91.437 50.584 138.222-139.427 92.177 62.382 149.926-126.532 112.546 21.254 122.930-134.920 87.682 67.544 141.601-130.305 90.976 120.655 143.751-116.439 96.017 99.443 143.363-138.109 96.546 -51.790 134.209 -92.919 94.626 84.150 134.263 -87.956 93.492 54.720 137.790-103.944 93.176 56.895 138.522 -50.053 91.828 36.121 143.594-134.616 91.506 49.434 0.000 0.000 91.741 50.454 135.297-123.844 91.771 36.157 138.218 -91.263 93.079 39.106 136.320-104.850 93.660 40.324 115.606 -76.412 92.646 38.565 148.360-111.313 94.342 40.684 141.455-115.595 94.243 46.731 143.993-126.444 94.972 35.970 144.017-124.954 122.256 174.400 121.926-128.832 93.139 47.528 116.337 -76.382 93.497 39.484 137.334-103.229 89.232 53.778 116.807 -75.713 91.723 43.216 129.244 -76.148 87.670 40.480 141.619-130.755 90.887 44.611 144.574 -40.715 90.666 39.732 144.326 -43.466 91.866 37.842 129.307 -76.112 91.748 43.803 129.660 -87.999 92.007 40.692 129.234 -76.207 92.482 38.876 138.512 -77.610 92.664 39.352 137.326 -91.099 91.849 46.970 144.775 -41.374 91.262 42.007 142.576-130.480 92.468 63.658 142.999-124.383 93.026 0.000 129.409 -76.264 # 202 total E -2.29089E+02 rmsd from N 0.000 %NC 0.00 94.049 158.476 135.952 -91.124 93.792 41.964 139.810-103.608 93.239 36.329 143.739-133.906 92.365 42.603 129.965 -76.742 91.289 41.764 137.582 -25.851 89.941 37.269 137.695-148.747 91.655 43.244 128.551-102.284 86.972 44.612 140.458 -86.879 89.667 48.240 143.090 -44.663 91.430 55.462 137.951-140.452 91.607 66.590 147.810-107.451 117.162-134.417 123.385-133.516 95.680 69.041 143.810-135.430 92.547 142.533 150.589-121.804 94.980 67.208 111.718 -83.516 93.520 54.376 133.148 -90.790 96.057-163.127 133.933 -88.539 93.826 52.820 137.889-105.382 92.910 143.003 137.677 -95.349 138.048 -93.159 113.010 -85.128 93.500 51.144 0.000 0.000 93.034 45.597 138.003-127.411 90.509 39.003 139.357 -90.540 92.516 38.367 136.103-104.132 90.910 43.784 115.232 -76.214 91.872 37.398 144.616 -41.948 94.005 46.694 140.185-106.671 94.503 33.661 144.052-126.757 94.728-167.688 144.109-125.479 121.425 122.485 121.046-127.923 94.347 25.472 116.477 -76.463 93.658 48.814 135.765 -95.058 92.746 39.861 116.155 -76.351 92.804 35.363 129.393 -76.226 92.334 36.055 143.135-133.766 92.413 40.667 144.169 -43.131 91.897 38.626 145.015 -43.223 92.207 38.233 129.308 -76.138 92.480 42.088 129.924 -87.770 92.440 38.676 129.320 -76.235 92.859 38.613 137.776 -75.348 93.003 39.973 137.325 -90.860 91.939 46.264 144.906 -41.200 91.479 42.381 142.400-133.061 92.456 63.398 143.033-124.146 93.017 0.000 129.415 -76.274 # 203 total E -2.32722E+02 rmsd from N 0.000 %NC 0.00 93.639 77.512 138.306-102.460 93.591 51.034 141.439-108.761 93.237 37.464 150.016 -32.466 92.414 42.045 129.470 -76.227 92.488 42.301 142.471-141.345 94.037 34.339 138.207-150.260 93.284 39.701 131.388 -83.025 92.157 36.623 139.948 -86.605 92.528 44.265 145.706-102.858 93.962 50.769 138.313-147.948 91.785 43.961 148.743-117.757 118.271 -84.889 121.354-130.033 101.485-120.080 112.793 -82.331 93.882 56.475 148.762-123.621 96.697 55.080 145.421-142.607 94.864 29.536 136.387 -76.866 94.130 48.371 139.940 -79.502 93.120 44.406 140.815-104.568 92.641 48.049 141.484-134.340 92.553 25.747 143.616-133.574 110.534 -67.535 0.000 0.000 124.770-154.918 158.015 176.407 92.135 49.457 143.409 -90.789 92.968 35.039 136.742-104.628 91.854 44.304 115.716 -76.143 90.880 44.752 147.304-116.842 92.776 47.356 141.446-100.255 90.262 48.457 142.000-122.942 92.696 42.655 142.591-120.583 119.909 178.023 122.315-130.733 94.367 50.488 116.681 -76.483 93.241 42.966 139.091-101.190 89.374 46.099 116.339 -76.130 91.789 42.263 129.233 -76.118 86.861 45.499 141.308-129.869 90.286 44.362 144.498 -42.587 90.867 39.817 144.287 -40.667 92.045 37.819 129.302 -76.105 92.406 42.907 129.819 -87.971 92.428 38.332 129.256 -76.206 92.873 38.706 137.570 -73.119 93.052 39.783 137.320 -90.533 91.984 45.970 144.910 -41.256 91.585 42.303 142.467-133.492 92.446 63.294 143.008-124.157 93.022 0.000 129.413 -76.268 # 204 total E -2.34025E+02 rmsd from N 0.000 %NC 0.00 93.632 73.482 138.166-102.251 93.582 50.702 139.438-102.220 93.026 36.633 143.902-133.840 92.424 42.657 129.592 -76.282 91.839 40.458 140.239-147.106 90.650 38.511 137.971-148.198 92.060 41.681 125.677-102.356 88.237 42.993 138.029 -86.284 89.038 53.174 146.192-111.816 92.081 46.790 136.491-143.222 92.568 40.189 151.687-111.802 93.659 39.420 100.954-115.056 94.639 81.050 142.323-133.207 93.819-124.681 148.341-120.329 94.506 149.442 143.939-136.019 125.658-148.492 153.619-115.726 93.931 58.303 133.691 -89.016 92.820 100.767 136.801 -98.143 93.290 67.813 136.244-103.874 93.518 34.553 144.044-136.410 93.373 41.008 0.000 0.000 91.537 53.194 135.480-126.021 90.545 42.144 137.355 -92.111 91.931 41.411 135.888-103.563 89.208 49.664 115.238 -76.137 91.486 52.057 144.970 -40.346 93.228 32.759 139.715-107.210 92.651 54.083 143.237-125.133 94.271 152.058 143.209-123.850 93.074 56.533 99.874-114.135 92.069 42.053 116.173 -76.282 92.938 107.353 137.161 -99.127 93.221 49.881 116.180 -77.064 92.414 40.764 129.414 -76.198 89.997 46.750 142.597-132.250 91.675 46.922 146.530 -38.466 90.249 45.538 146.427 -36.779 91.047 36.099 129.238 -76.061 90.839 47.604 128.937 -87.501 91.721 44.217 128.948 -76.029 91.984 38.013 137.534 -79.143 92.246 43.126 137.287 -90.336 91.182 46.988 143.443 -42.614 91.383 42.539 141.931-132.640 92.429 64.234 143.032-124.124 93.020 0.000 129.413 -76.273 # 205 total E -2.32962E+02 rmsd from N 0.000 %NC 0.00 93.628 71.931 138.150-102.370 93.583 52.204 139.359-103.424 94.060 34.649 144.055-134.913 92.726 41.499 129.580 -76.224 92.556 38.239 137.794-144.903 92.437 38.027 139.089-148.971 92.673 40.986 129.569 -86.769 90.928 37.724 138.972 -85.650 91.258 46.412 148.268-124.255 93.368 67.587 137.711-140.294 93.678 177.017 146.698 -38.795 93.758 67.388 100.226-113.227 97.721 24.192 144.597-137.120 94.747 47.074 146.385 -37.925 93.592 41.011 110.387 -84.112 93.170 46.321 135.083 -94.489 94.027 33.605 131.056 -88.875 94.195 49.241 138.201 -92.148 119.093-136.540 141.723-117.477 92.519 -8.567 143.093-132.702 113.254 -65.602 0.000 0.000 127.734 -90.052 160.255 170.388 92.559 41.495 141.732 -92.524 92.742 47.221 137.263-103.070 91.130 56.476 115.121 -76.178 91.806 106.902 149.644-119.480 93.559 68.034 140.305-108.084 92.623 1.052 109.377 -83.556 109.419-174.996 151.036 -21.032 123.264 135.608 120.644-126.281 92.981 33.725 116.248 -76.347 93.360 47.751 135.497 -98.517 89.889 48.053 116.230 -75.858 91.907 39.708 129.328 -76.180 90.824 37.573 142.726-132.583 91.024 41.671 147.171-114.266 90.744 42.618 144.205 -43.833 91.589 42.079 129.278 -76.093 91.782 41.260 129.571 -86.478 92.317 38.740 129.336 -76.187 92.580 39.993 138.499 -79.188 92.364 43.311 137.234 -90.831 90.880 50.634 144.284 -42.304 90.629 42.084 141.723-127.126 92.508 65.784 143.060-124.189 93.018 0.000 129.420 -76.274 # 206 total E -2.27978E+02 rmsd from N 0.000 %NC 0.00 93.646 77.459 138.195-102.037 93.607 50.229 139.201-102.043 93.101 36.545 143.755-134.359 92.428 43.228 129.742 -76.367 90.989 42.467 141.950-151.929 90.816 35.813 138.594-148.091 92.445 44.769 130.007 -85.234 89.785 34.645 138.383 -87.116 92.038 49.637 144.883 -40.926 91.796 50.044 138.073-140.629 91.106 46.535 148.501-115.737 119.059-121.442 120.686-128.529 92.938 143.185 144.706-136.784 106.681-150.055 151.713-126.424 97.270 11.367 145.484-142.104 98.635 -83.421 134.478 -89.477 98.024 171.519 138.345 -77.439 94.735 175.325 135.658-102.097 94.332 73.970 139.002-125.660 95.050 55.762 145.581-141.718 95.456 27.013 0.000 0.000 93.871 50.661 138.169-122.862 94.278 30.444 137.236 -93.609 93.953 39.608 136.183-104.566 93.972 40.073 115.635 -76.507 94.095 97.635 146.956 -37.180 93.484 61.951 141.048-106.815 94.565 19.174 109.834 -83.953 96.706-171.092 145.735-126.675 121.376 129.977 120.974-127.893 94.928 28.212 116.249 -76.461 93.382 54.375 138.737 -92.131 91.966 43.379 117.072 -75.992 92.941 31.094 129.400 -76.228 93.161 37.823 143.505-134.093 91.618 42.488 144.127 -46.020 91.491 40.449 143.693 -44.033 92.084 36.037 129.322 -76.120 92.502 42.786 130.211 -91.722 92.751 37.636 129.150 -76.164 93.069 38.269 137.681 -73.002 93.263 38.326 137.272 -90.688 92.722 43.999 144.996 -40.491 92.136 42.462 142.692-137.290 92.390 62.496 142.978-124.123 93.020 0.000 129.410 -76.266 # 207 total E -2.27284E+02 rmsd from N 0.000 %NC 0.00 94.057 160.414 135.726 -90.257 93.720 44.390 139.934-104.267 93.856 34.997 144.003-135.031 92.541 41.944 129.843 -76.596 92.469 39.469 138.637 -26.212 90.832 40.469 139.204-150.461 91.766 47.596 129.051 -87.072 89.782 34.550 137.886 -86.212 91.125 51.242 151.365-118.901 90.953 48.299 137.064-139.966 93.540 57.350 146.953 -39.143 121.863 -67.006 120.936-126.894 95.193-166.541 143.695-133.041 114.260-169.493 153.292 -23.660 100.660-102.030 145.297-141.157 94.104 53.555 134.182 -90.508 93.756 79.604 133.563 -87.439 93.608 82.482 137.728-110.322 92.176 69.986 147.459 -90.463 92.555 17.396 143.706-134.153 132.222 -84.521 0.000 0.000 124.861-164.921 158.829 176.322 92.640 51.285 143.989 -88.368 93.176 31.970 138.103-111.062 91.874 45.329 115.780 -76.189 90.880 47.809 146.790-117.334 92.883 49.080 140.864 -95.138 90.751 43.963 142.237-123.413 93.692 38.860 143.456-123.966 121.074-179.007 121.658-128.938 92.082 59.824 116.194 -76.262 93.264 50.568 137.315-102.320 91.106 41.035 115.867 -75.996 92.294 41.910 129.286 -76.130 89.342 43.437 142.127-131.513 91.667 43.628 145.491 -40.339 91.894 36.586 144.332 -40.557 92.512 38.885 129.381 -76.165 93.196 43.984 130.330 -87.471 92.904 34.805 129.322 -76.213 93.320 39.855 139.914 -81.848 93.160 38.525 137.126 -91.247 92.046 46.554 144.952 -41.175 91.559 41.913 142.382-133.429 92.468 63.450 143.036-124.202 93.022 0.000 129.413 -76.270 # 208 total E -2.41173E+02 rmsd from N 0.000 %NC 0.00 93.931 128.130 139.888-105.545 93.236 57.871 141.657-110.554 90.727 40.416 142.979-132.674 92.112 41.531 129.376 -76.110 92.129 41.637 141.018-144.674 91.742 36.566 140.727-150.253 92.548 40.074 129.399 -87.344 90.660 40.307 139.050 -85.365 91.116 44.957 147.993-114.972 92.467 32.695 136.990-140.362 93.293 140.181 146.342 -39.806 94.052 70.069 99.902-112.134 95.531 26.570 143.999-136.020 95.107 45.832 147.031 -38.083 92.965 41.489 144.030-132.414 93.156 45.029 134.683 -95.941 94.182 46.462 131.212 -88.681 94.478 -14.821 136.938 -87.863 124.681-169.844 146.401-144.593 94.183 77.880 111.390 -82.928 94.718 66.118 0.000 0.000 93.626 37.636 136.564-123.165 92.892 38.143 139.671 -92.356 92.987 40.293 136.189-104.319 91.969 41.574 115.191 -76.332 91.253 42.725 148.030-114.956 93.610 39.219 139.905-102.333 92.964 53.653 143.321-125.404 93.788 45.251 143.274-123.693 121.773 173.650 121.779-128.790 91.108 56.489 116.020 -76.169 93.020 48.753 137.214-102.173 89.824 44.911 116.157 -75.410 92.082 40.799 129.346 -76.181 89.191 40.931 142.144-131.512 90.723 46.657 144.892 -40.595 90.602 41.673 144.032 -41.868 91.841 37.138 129.297 -76.104 92.349 41.973 129.693 -88.141 92.430 39.832 129.228 -76.156 92.673 38.291 136.690 -68.597 92.965 40.094 137.423 -90.029 91.913 46.026 144.863 -41.326 91.552 42.321 142.387-133.031 92.442 63.335 142.999-124.202 93.022 0.000 129.414 -76.267 # 209 total E -2.32897E+02 rmsd from N 0.000 %NC 0.00 93.670 78.314 138.935-104.476 93.564 46.362 138.145-103.085 91.795 40.750 143.356-133.353 92.182 46.612 129.720 -76.358 91.613 38.511 145.830-149.928 92.019 38.315 142.709-161.014 92.438 38.629 129.239 -87.856 89.606 41.452 138.994 -86.197 89.851 48.637 147.399-118.178 89.288 52.537 137.272-139.611 92.158 56.363 146.287 -40.286 119.237 -71.314 121.278-128.838 94.861-175.267 144.093-135.647 111.043 159.252 152.347 -26.121 102.347 -94.064 146.357-141.199 93.764 59.646 134.155 -90.283 93.585 66.987 133.530 -87.707 93.179 72.581 139.060-104.581 91.751 52.187 143.633 -98.500 91.740 55.248 143.387-133.207 93.853 162.699 0.000 0.000 92.668 72.799 136.139-121.846 93.034 36.197 138.879 -90.267 93.176 43.402 136.553-105.110 92.555 46.170 115.458 -76.459 91.708 75.908 149.877-116.137 93.417 62.113 140.715-115.871 92.671 67.478 142.803-122.946 120.790-146.960 152.859 -17.687 123.075 7.846 120.734-126.509 95.003 44.223 116.634 -76.534 92.648 43.519 137.037 -92.387 91.280 47.507 115.415 -75.971 92.404 37.491 129.330 -76.177 91.158 37.611 142.757-132.520 90.792 51.749 151.433-134.061 90.043 39.340 144.194 -43.364 91.885 36.296 129.329 -76.116 92.337 42.213 130.477 -86.879 91.982 42.541 129.286 -76.187 92.566 36.427 136.103 -72.088 92.964 40.679 137.408 -90.396 92.077 43.943 144.549 -41.865 91.990 42.734 142.609-134.265 92.444 62.401 143.000-124.515 93.021 0.000 129.408 -76.267 # 210 total E -2.30834E+02 rmsd from N 0.000 %NC 0.00 93.600 73.926 137.406 -98.840 93.937 52.139 139.090-104.112 94.982 32.471 144.287-135.544 92.745 43.128 129.636 -76.256 92.223 40.637 140.302-150.242 92.476 36.416 140.082-151.330 93.009 37.418 129.522 -87.699 89.861 43.469 139.750 -86.385 91.292 52.129 143.338 -44.556 92.193 93.562 137.500-141.384 106.030-157.714 150.451 -29.434 92.721 55.294 100.814-112.916 93.594 34.383 143.130-131.386 93.997 92.446 148.189 -35.087 91.918 44.641 144.047-143.952 92.411 38.017 132.707 -90.881 93.202 112.053 131.626 -87.777 93.670 66.655 133.853 -98.060 91.357 35.328 140.539-123.670 93.650 53.157 143.737-134.417 95.091 116.560 0.000 0.000 125.722-108.122 158.461 176.428 90.063 49.733 142.420 -90.943 92.328 39.731 135.400-107.485 90.522 48.408 114.948 -75.745 91.528 49.869 147.872-115.955 93.841 86.134 139.750-109.592 120.521 -30.500 112.570 -83.237 121.490-100.686 152.990 -18.898 118.879 56.096 121.618-130.126 91.309 42.673 116.020 -76.172 92.474 50.371 137.232 -97.284 90.522 44.230 115.755 -76.095 92.278 36.514 129.336 -76.166 90.148 41.752 142.523-132.076 90.368 43.292 143.701-106.524 90.927 41.460 144.441 -43.245 92.022 38.136 129.326 -76.111 92.517 40.346 129.895 -89.301 92.247 40.397 129.515 -76.351 92.423 43.024 137.674 -70.443 92.637 36.800 137.401 -89.688 91.499 51.318 145.613 -39.591 90.850 41.344 141.074-130.752 92.401 67.331 143.015-124.226 93.034 0.000 129.392 -76.259 # 211 total E -2.28433E+02 rmsd from N 0.000 %NC 0.00 93.628 74.233 138.178-102.139 93.588 49.970 139.447-102.536 92.954 37.182 143.753-134.193 92.457 41.712 129.521 -76.235 92.339 41.272 140.293-147.286 91.598 36.050 138.375-149.178 92.157 43.737 132.437 -89.411 88.540 43.638 140.290 -86.380 90.629 39.577 146.559-111.715 94.702 51.358 139.143-141.772 92.882 105.604 148.063-113.110 93.471 83.871 99.275-107.993 93.711 27.350 143.044-133.805 108.167-146.503 151.476 -27.985 92.296 59.076 143.467-135.314 93.228 65.742 132.884 -86.304 93.119 66.322 134.036 -86.598 93.478 113.419 138.313-110.117 118.304-100.093 141.380-115.116 92.663 52.739 143.991-136.282 92.342 41.460 0.000 0.000 91.456 53.279 136.260-121.114 91.027 39.470 138.745 -89.852 92.936 38.275 135.524-102.651 92.782 42.547 115.384 -76.285 92.934 95.006 150.066-124.656 93.766 65.996 140.538-108.786 91.745 -23.423 142.692-124.089 114.192 177.488 151.629 -19.914 93.794 73.338 100.282-113.209 96.208 26.422 116.834 -76.684 94.412 42.452 138.095-104.118 92.403 41.638 116.123 -76.805 92.233 42.421 129.298 -76.169 89.502 38.047 142.155-132.275 91.556 43.518 145.491 -40.227 91.251 38.437 143.172 -43.160 92.487 37.833 129.259 -76.114 93.376 43.226 130.363 -87.840 93.384 32.438 129.366 -76.252 93.773 40.541 141.570 -84.895 93.095 37.839 136.908 -85.959 92.095 46.710 145.056 -41.071 91.577 41.693 142.351-133.371 92.474 63.332 143.052-124.156 93.023 0.000 129.413 -76.269 # 212 total E -2.31351E+02 rmsd from N 0.000 %NC 0.00 93.631 77.508 138.245-102.114 93.591 49.363 139.351-102.540 92.863 37.643 143.717-134.093 92.461 41.403 129.545 -76.242 92.448 41.974 141.106-149.928 91.331 35.771 138.182-148.782 91.960 43.650 128.528 -88.134 87.850 45.340 139.966 -89.206 88.511 51.225 146.943-114.015 90.427 52.895 136.840-138.151 92.178 43.704 146.005-100.631 92.099 45.728 101.574-120.108 91.389 73.443 141.674-131.749 92.248-161.634 148.072-121.248 94.916 63.225 144.006-136.508 93.783 43.116 133.321 -90.457 93.558 82.796 135.611 -95.555 93.679 105.043 136.848-102.196 93.461 50.651 139.980-116.374 119.115 -71.884 113.220 -84.222 106.237-169.922 0.000 0.000 129.080 8.322 157.082 169.699 92.227 49.201 140.888 -89.932 93.107 35.061 136.362-105.067 92.089 44.143 115.292 -76.121 92.031 71.004 149.720-129.809 93.616 63.394 139.958-103.386 91.907 -26.272 142.743-124.274 118.613-149.987 152.122 -19.302 118.590 124.850 122.586-131.576 90.250 62.076 115.844 -76.066 92.612 63.213 134.045 -90.950 92.588 35.405 115.897 -76.217 92.848 41.576 129.400 -76.180 93.137 38.221 143.408-134.251 93.146 38.601 146.513 -39.059 92.659 38.979 146.527 -38.773 92.300 37.394 129.327 -76.154 92.756 42.921 130.047 -87.480 92.666 37.051 129.323 -76.249 92.985 39.112 138.492 -75.106 93.056 39.393 137.261 -90.775 91.973 46.212 144.902 -41.267 91.570 42.146 142.402-133.317 92.451 63.361 143.018-124.195 93.021 0.000 129.412 -76.267 # 213 total E -2.30097E+02 rmsd from N 0.000 %NC 0.00 93.574 80.475 137.084 -97.173 93.840 42.277 138.663-102.117 95.183 38.068 144.379-135.826 93.307 35.556 129.526 -76.278 94.610 40.419 143.953-154.664 91.750 36.930 139.998-154.593 91.999 41.604 130.191 -83.830 89.735 50.490 138.685 -85.645 91.237 20.044 143.861-101.931 102.855 64.359 142.535-151.863 93.615 91.785 146.265 -39.545 120.236-148.164 120.377-127.216 94.183 39.376 143.695-135.554 93.564 41.886 145.867 -39.415 92.027 42.224 143.264-131.343 93.307 45.479 133.977 -97.849 93.868 39.155 131.373 -88.859 94.041 22.675 138.421 -97.783 117.037-171.543 144.838-140.720 121.728 -19.697 112.635 -83.963 130.985 -89.294 0.000 0.000 122.288 18.790 157.767 175.114 91.954 46.634 139.932 -89.319 92.869 39.003 136.452-104.813 91.745 44.889 115.220 -76.118 91.624 40.356 148.442-117.910 93.770 43.252 140.605-109.968 93.071 8.541 143.412-125.438 118.658 144.274 111.660 -82.139 93.341 47.865 100.043-114.882 92.865 39.679 116.313 -76.345 93.457 62.512 137.642-104.037 92.845 142.060 116.641 -76.174 92.716 42.881 129.381 -76.160 90.699 40.001 142.973-132.862 91.358 41.659 143.879 -42.522 92.584 39.482 144.436 -42.944 92.960 35.490 129.380 -76.179 93.170 40.592 132.603 -88.014 92.577 41.525 129.431 -76.386 92.420 38.839 137.444 -67.757 92.452 39.435 137.341 -88.833 91.815 47.052 143.864 -42.055 91.419 41.538 141.878-133.910 92.417 64.839 142.977-124.222 93.024 0.000 129.397 -76.258 # 214 total E -2.28382E+02 rmsd from N 0.000 %NC 0.00 93.632 58.563 137.876-103.622 94.375-176.342 136.510-100.088 94.117 44.159 144.020-135.154 92.909 40.858 129.520 -76.289 94.006 37.707 142.740-147.100 94.503 36.701 142.216-159.439 93.691 37.625 131.166 -84.445 92.463 36.883 139.963 -86.154 92.661 43.195 149.987-127.580 95.675 56.377 141.395-141.704 92.806 73.828 148.980-118.002 118.638-144.326 122.597-131.831 94.971 48.193 144.021-136.276 92.154 60.722 144.843 -38.753 92.295 69.641 143.128-137.390 94.183 34.495 133.234 -87.576 94.696 37.245 133.299 -88.091 94.562 114.816 139.015-116.913 94.366 53.533 144.230-156.338 92.375 42.107 144.447-139.471 92.802 48.855 0.000 0.000 92.300 47.434 138.522-127.539 89.281 45.492 140.169 -90.105 92.222 36.144 136.593-107.989 93.058 48.150 115.292 -76.440 92.631 24.354 148.060-117.263 116.542-133.882 149.578 -93.574 94.691 25.374 144.220-126.832 123.883 155.592 152.665 -18.178 118.916 141.728 121.475-129.991 94.699 39.542 116.603 -76.569 93.521 46.155 137.816-101.053 92.434 35.751 115.587 -76.465 92.389 44.149 129.474 -76.250 88.928 47.988 141.787-131.067 90.607 40.835 147.279-118.008 91.624 40.533 145.742 -38.736 92.047 37.260 129.331 -76.128 92.321 43.665 130.265 -87.176 92.400 38.018 129.238 -76.220 92.913 38.884 137.615 -74.017 93.057 39.652 137.282 -90.490 92.029 46.127 144.908 -41.063 91.540 42.266 142.406-133.342 92.454 63.293 143.059-124.147 93.028 0.000 129.390 -76.254 # 215 total E -2.27291E+02 rmsd from N 0.000 %NC 0.00 93.636 81.156 138.373-102.118 93.636 48.414 139.207-102.487 92.765 38.547 143.654-134.080 92.415 41.224 129.466 -76.219 92.384 44.083 142.131-150.623 91.929 34.133 138.646-148.447 92.578 43.197 129.534 -87.161 90.165 40.633 139.121 -86.900 89.836 58.033 149.524-125.724 88.679 45.159 136.422-142.119 91.158 158.959 144.155-100.559 122.604 111.465 121.223-126.924 91.178 34.241 142.498-131.987 92.363 49.981 143.878 -42.035 92.967 43.209 141.476-127.926 93.703 44.902 132.728 -97.014 94.217 27.560 131.159 -89.051 94.580 97.662 140.638-115.504 94.972 73.470 145.002-120.060 95.978 2.496 144.666-136.042 97.090 74.593 0.000 0.000 129.226 -1.773 158.858 169.812 91.842 52.885 139.354 -89.658 92.719 52.129 136.517-106.804 91.834 147.327 115.553 -76.476 92.395 49.630 148.316-114.093 93.766 43.308 139.451-105.328 92.590 32.738 143.161-124.792 117.417 149.730 111.726 -82.586 93.167 43.615 99.979-114.732 91.323 44.075 116.078 -76.180 92.507 50.498 136.979-110.610 88.557 49.808 115.257 -75.903 91.579 43.698 129.289 -76.112 89.019 39.027 142.087-131.172 91.550 47.982 145.190 -36.501 90.310 37.032 146.422-120.328 92.100 38.807 129.337 -76.130 91.865 53.444 129.604 -96.110 91.722 61.194 129.216 -76.172 92.109 37.821 137.620 -86.637 93.165 141.526 137.113 -92.442 93.203 64.843 146.442 -39.102 91.457 41.984 143.412-133.531 92.518 76.419 142.936-123.752 93.039 0.000 129.450 -76.274 # 216 total E -2.37209E+02 rmsd from N 0.000 %NC 0.00 93.589 66.774 137.359-100.125 93.598 50.138 139.605-104.735 93.929 36.608 143.942-134.660 92.951 37.430 129.421 -76.179 94.745 36.707 140.702-136.794 98.235 33.486 138.658-150.004 95.919 33.854 132.725 -82.840 95.951 34.372 143.503 -88.647 93.208 42.182 152.594-134.929 93.772 53.286 142.627-145.113 91.913 42.585 149.206-119.115 93.511 50.886 100.765-112.768 92.746 85.224 141.870-132.851 107.184-154.128 152.360-133.957 95.482 52.588 144.249-136.642 94.133 34.510 133.653 -90.763 93.644 76.861 136.736 -95.091 93.732 102.762 136.828-107.250 93.094 52.615 140.048-118.087 120.060 -73.941 112.781 -83.827 107.509-168.254 0.000 0.000 128.417 12.901 158.076 169.725 91.190 47.908 141.952 -90.923 92.667 35.949 136.242-104.756 91.385 43.267 115.108 -76.075 90.858 45.398 148.357-118.392 92.880 45.636 141.536-101.550 90.871 47.995 142.296-123.540 93.407 43.640 143.206-123.497 121.088-179.361 121.572-128.764 92.680 52.744 116.283 -76.323 93.493 40.317 137.341-102.828 90.326 46.574 116.651 -75.750 91.900 40.962 129.232 -76.115 87.492 44.506 141.493-130.367 91.213 40.931 143.885 -41.642 92.427 38.536 145.599 -39.567 92.680 35.403 129.357 -76.156 93.128 42.028 130.074 -87.727 92.660 38.603 129.303 -76.316 92.537 39.750 137.739 -68.089 92.601 39.719 137.445 -89.657 91.426 48.836 144.674 -41.655 91.007 41.688 141.687-129.549 92.497 64.497 143.020-124.261 93.022 0.000 129.414 -76.269 # 217 total E -2.31724E+02 rmsd from N 0.000 %NC 0.00 93.475 64.483 135.078 -91.715 93.962 48.370 139.167-104.508 94.956 34.268 144.312-135.588 92.957 39.838 129.513 -76.250 92.983 40.506 138.304-146.124 93.107 35.824 139.867-150.991 93.285 37.597 129.963 -87.007 91.158 38.146 138.998 -86.862 91.844 44.894 144.939 -41.103 91.070 54.699 138.937-141.430 92.040 57.531 146.748 -39.859 117.065 -83.367 120.909-129.627 92.119 -64.390 143.301-134.189 105.373-141.859 154.115-131.066 93.818 50.680 143.584-136.943 94.165 32.605 132.261 -96.268 94.173 70.881 136.502 -86.049 93.487 -1.895 135.251-100.637 116.585-141.469 144.845-126.549 92.864 56.366 143.721-134.160 93.624 174.923 0.000 0.000 124.897 39.066 158.020 174.860 92.538 36.382 141.578 -90.501 93.603 39.238 136.921-106.628 92.536 69.423 115.469 -76.389 92.553 107.639 145.676 -42.755 94.050 67.132 139.960-116.727 93.949 83.326 143.677-126.007 97.629-154.366 147.034-130.105 121.569 8.415 121.104-127.954 93.350 46.651 116.388 -76.371 92.351 45.304 137.925 -98.344 89.748 45.460 114.687 -75.857 92.130 39.530 129.301 -76.118 90.088 39.442 142.349-132.032 90.943 44.473 145.499 -41.519 90.139 41.407 146.184-111.454 91.830 36.786 129.332 -76.129 92.784 38.936 129.508 -89.177 92.993 37.413 129.235 -76.150 93.624 35.786 137.841 -86.404 93.211 41.191 136.886 -93.635 91.138 46.570 146.159-117.781 91.402 42.548 142.075-131.762 92.409 65.597 142.981-124.340 93.017 0.000 129.391 -76.243 # 218 total E -2.29830E+02 rmsd from N 0.000 %NC 0.00 93.620 75.776 138.174-102.140 93.615 49.533 139.865-104.169 92.853 37.471 144.017-135.115 92.523 40.565 129.474 -76.226 92.464 41.050 140.383-147.387 91.951 36.339 139.485-152.385 92.404 41.570 131.955 -85.046 89.837 38.410 139.515 -86.022 90.268 47.845 146.964-112.692 92.101 48.456 138.632-138.458 93.701 38.210 150.414-126.346 94.231 30.577 100.576-111.593 92.158 52.514 109.881 -83.421 90.873 71.310 141.658 -50.072 90.468 51.899 140.607-132.007 93.634 66.785 132.924 -90.852 96.512-124.466 134.912 -90.492 94.943 136.386 138.017-104.465 106.291 170.235 143.448 -98.223 94.693 68.132 144.667-137.288 93.357 40.244 0.000 0.000 92.375 61.794 140.505-128.702 91.431 35.154 138.906 -91.850 92.786 48.825 136.412-104.984 92.357 61.026 116.045 -76.134 91.091 60.911 149.527-112.531 93.862 26.511 139.631-106.840 96.317-122.969 144.766-127.344 107.444 163.885 111.043 -82.639 122.948 -67.628 120.595-126.502 91.282 63.940 116.066 -76.225 92.651 46.063 137.906-109.390 88.927 43.618 115.251 -75.911 91.838 42.751 129.307 -76.139 89.301 40.385 141.939-131.525 90.878 42.724 145.450 -40.061 90.740 40.697 144.886 -41.586 91.875 38.969 129.303 -76.122 91.872 41.395 129.549 -87.069 91.985 42.109 129.270 -76.226 92.632 37.880 135.859 -72.382 92.957 40.514 137.443 -90.870 92.030 45.032 144.950 -41.226 91.665 42.846 142.645-132.854 92.454 62.912 143.013-124.263 93.020 0.000 129.408 -76.255 # 219 total E -2.29056E+02 rmsd from N 0.000 %NC 0.00 93.569 67.053 137.034 -98.518 93.798 51.452 140.250-105.166 93.700 34.445 143.964-134.739 92.593 42.480 129.485 -76.212 92.220 41.083 138.939-143.788 90.820 40.194 140.083-151.321 91.461 46.048 129.759 -85.671 90.275 34.118 139.237 -86.541 91.872 51.216 144.452 -38.232 91.891 44.998 138.355-141.880 93.088 46.296 148.095-116.344 122.512 -13.965 120.645-126.284 96.737 55.198 144.448-136.155 93.768 36.150 146.335 -39.491 92.520 49.041 142.591-136.032 93.475 55.405 131.978 -94.229 96.219-107.883 132.438 -90.529 94.127 118.469 137.850-103.722 116.348-162.766 143.525 -93.305 123.306 -6.764 112.849 -83.979 132.366 -84.650 0.000 0.000 120.234 28.961 157.172 178.856 91.004 47.728 139.912 -89.203 92.431 41.013 136.141-104.121 91.304 44.596 115.299 -76.161 91.821 41.102 147.526-108.861 93.880 42.488 141.595-114.621 94.730 35.183 109.873 -83.846 95.673 147.712 144.892-126.371 93.689 43.766 99.637-112.640 93.424 39.561 116.369 -76.407 93.411 88.351 137.902-104.543 93.138 98.306 116.728 -76.052 92.555 38.081 129.374 -76.150 90.556 39.924 142.794-132.557 90.940 50.549 144.978 -41.107 90.219 41.857 144.246 -43.140 91.516 36.875 129.270 -76.089 91.582 44.976 129.419 -88.831 91.866 48.016 129.361 -76.259 91.632 33.641 137.783 -79.379 91.375 51.567 137.215 -90.307 90.159 56.031 140.637 -47.318 89.932 47.280 141.529-134.988 91.812 80.294 142.725-123.498 93.005 0.000 129.352 -76.189 # 220 total E -2.28726E+02 rmsd from N 0.000 %NC 0.00 93.670 81.172 139.036-104.581 93.645 81.395 138.995-104.250 93.528 40.276 143.845-134.709 92.386 43.454 129.980 -76.512 92.368 38.125 138.630 -25.577 92.293 36.685 140.097-152.882 92.835 41.175 129.533 -86.009 89.967 39.520 140.637 -85.749 91.732 51.444 144.431 -43.307 93.494 65.925 137.914-141.516 92.927-171.732 149.178-110.117 93.246 50.914 100.269-110.183 95.900-163.272 144.254-136.110 119.367-111.823 156.123-142.169 116.978 -93.246 153.246 -21.837 93.890 53.809 134.177 -90.863 93.263 43.998 133.443 -87.471 92.758 82.273 136.909 -98.657 92.584 62.719 139.306-145.283 93.827 26.783 149.742 -32.347 93.996 134.866 0.000 0.000 144.214 -66.378 110.269 -89.309 93.719 43.493 138.213 -86.529 93.741 34.623 134.877-102.825 94.662 40.110 115.967 -76.491 93.793 37.913 151.451-134.033 93.416 42.871 140.961 -93.180 91.129 46.275 142.450-123.844 92.975 148.271 142.611-122.556 93.057 45.223 99.894-114.506 91.100 42.697 116.020 -76.167 92.979 101.505 137.915-101.355 91.156 52.000 116.823 -76.193 92.397 36.435 129.387 -76.174 90.632 39.734 142.806-132.710 90.739 49.593 145.835 -40.277 89.467 42.863 143.789 -43.769 91.183 37.646 129.275 -76.094 91.148 45.447 129.416 -87.950 91.713 43.161 129.175 -76.072 92.306 38.036 137.180 -75.422 92.552 40.396 137.353 -89.945 91.523 48.176 144.401 -41.844 91.120 41.785 141.892-130.350 92.513 64.273 143.041-124.247 93.018 0.000 129.401 -76.264 # 221 total E -2.28737E+02 rmsd from N 0.000 %NC 0.00 93.668 76.021 138.770-104.618 93.540 54.649 142.133-109.429 91.640 36.740 143.286-133.279 92.074 44.426 129.440 -76.171 91.171 43.669 139.267-144.740 91.144 37.022 137.845-153.698 91.379 42.375 128.933 -87.412 86.545 58.146 140.049 -87.411 89.789 47.216 141.970 -44.530 90.848 54.661 139.202-139.976 92.983 65.907 148.767-115.997 118.987-116.247 122.695-131.354 96.495 149.522 144.621-137.284 106.158 174.078 152.533-117.287 107.868 -97.027 148.820-146.795 94.051 38.329 134.092 -90.696 94.520 61.201 134.043 -87.298 93.828 -32.245 135.680 -91.752 117.340-111.917 146.815-111.057 115.806 -49.038 112.685 -83.704 128.246 -34.388 0.000 0.000 140.674 -76.270 111.842 -88.859 91.848 48.249 141.148 -91.813 93.545 34.704 134.358-100.532 91.769 47.116 115.654 -75.904 91.198 53.313 148.820-126.033 93.239 52.799 139.453-102.169 92.494 15.552 143.036-124.735 116.937 35.025 152.348 -19.668 120.396-175.467 121.881-129.671 93.803 55.803 116.477 -76.423 93.451 39.518 137.349-103.185 90.067 46.293 115.751 -75.758 92.234 47.310 129.424 -76.263 89.444 36.232 142.036-131.804 91.342 42.671 145.165 -39.948 91.310 41.461 143.086 -43.052 92.173 37.054 129.260 -76.137 92.870 41.075 129.934 -88.208 93.242 34.488 129.331 -76.256 93.598 39.512 139.541 -74.869 93.114 38.361 138.146 -93.419 91.996 44.439 144.897 -41.259 91.786 42.815 142.443-133.278 92.380 62.141 142.912-123.800 93.027 0.000 129.426 -76.278 # 222 total E -2.27971E+02 rmsd from N 0.000 %NC 0.00 93.638 78.133 138.174-101.737 93.607 49.026 139.297-102.514 92.877 37.756 143.638-134.117 92.465 41.267 129.482 -76.223 92.289 42.305 141.108-151.498 91.362 36.237 138.472-148.536 92.107 42.666 129.211 -87.319 88.874 43.770 138.761 -86.396 89.123 50.762 145.424-108.306 89.584 59.833 136.127-139.643 92.441 -97.224 146.052 -41.076 122.080 -24.276 121.246-127.402 96.091 124.169 144.306-135.809 93.971 150.814 147.006 -37.934 117.390 -80.530 151.584-153.114 93.738 53.442 132.693 -96.025 92.938 44.845 133.375 -87.806 92.666 51.980 136.590 -99.775 92.083 41.062 135.828 -79.213 91.151 45.314 143.176-133.628 91.430 49.990 0.000 0.000 92.007 40.930 132.983-115.425 95.163 32.922 139.400 -90.495 93.858 35.498 136.716-105.631 93.277 42.770 115.418 -76.790 92.482 43.055 145.199 -41.061 93.153 39.660 139.935 -99.556 91.861 55.265 142.786-124.394 93.757 175.922 143.023-122.997 119.727 -5.196 121.527-129.642 92.691 62.922 116.319 -76.323 93.192 87.943 137.155-103.123 93.479 140.871 116.366 -75.863 92.418 46.410 129.380 -76.167 90.146 40.252 142.713-132.237 90.436 46.807 148.342-113.227 91.746 35.439 144.401 -42.606 92.671 37.044 129.372 -76.162 92.923 42.373 130.338 -85.261 92.519 38.562 129.324 -76.282 92.926 37.176 138.088 -76.339 93.296 38.075 137.196 -91.042 92.285 46.051 145.291 -41.021 91.288 41.461 142.270-135.883 92.460 67.036 142.969-124.294 93.002 0.000 129.398 -76.204 # 223 total E -2.30056E+02 rmsd from N 0.000 %NC 0.00 93.507 67.473 135.605 -93.170 93.900 49.861 139.395-104.618 95.094 32.993 144.364-135.634 92.945 40.822 129.564 -76.267 93.252 38.223 139.638-145.602 93.265 38.252 139.650-150.165 93.203 37.612 129.821 -86.880 91.196 40.051 140.319 -85.216 91.068 44.917 148.954-115.491 91.934 53.633 138.013-140.577 93.225 60.596 146.778 -39.340 121.517-176.739 120.599-126.642 94.176 32.634 143.770-135.652 92.675 50.157 145.792 -39.346 89.824 51.052 142.320-130.253 92.824 42.326 130.780 -96.202 93.039 34.258 131.024 -88.713 93.310 48.597 137.983-100.828 92.971 46.025 137.597 -91.955 93.050 36.919 143.732-135.082 94.280 37.269 0.000 0.000 93.213 46.784 135.828-122.764 91.206 43.189 141.338 -92.921 93.006 40.008 136.112-104.859 97.122 80.125 116.017 -76.864 95.115 -57.995 155.170-138.457 96.261 -60.191 139.558-113.062 96.976 -51.138 145.046-128.346 94.631 115.530 143.508-122.875 93.915 40.415 100.270-117.343 97.286 27.014 116.878 -76.800 94.032 57.567 145.130-112.970 90.438 42.053 115.607 -76.015 92.759 34.851 129.371 -76.197 93.585 35.549 143.634-134.680 91.735 44.032 146.571 -40.867 90.630 41.860 143.792 -42.832 91.532 37.557 129.265 -76.102 91.549 44.591 129.270 -86.355 92.301 39.584 129.095 -76.082 92.845 37.326 137.887 -78.141 93.116 39.396 137.200 -91.368 92.161 45.626 144.730 -41.477 91.683 42.230 142.399-134.140 92.441 63.049 143.020-124.180 93.021 0.000 129.413 -76.268 # 224 total E -2.29284E+02 rmsd from N 0.000 %NC 0.00 93.618 71.123 138.104-102.522 93.560 51.622 139.489-102.508 92.832 37.498 143.666-134.132 92.482 41.783 129.481 -76.218 92.074 40.655 137.891-141.013 92.463 36.927 138.399-149.089 92.803 41.992 129.542 -87.654 91.206 37.177 138.999 -86.049 91.385 52.662 149.176-120.263 93.492 106.549 139.135-141.321 94.520-146.780 147.866 -37.669 122.856 12.715 120.852-126.445 95.267 56.677 144.149-135.703 92.632 41.590 150.307-125.034 92.637 41.053 144.139-128.519 93.629 38.778 133.560-102.604 94.111 42.304 131.785 -87.599 93.822 49.196 137.085-101.334 117.130-147.987 138.464 -81.803 92.740 69.350 143.698-133.779 122.581 -88.951 0.000 0.000 128.639-141.966 158.770 172.875 91.416 48.082 143.216 -90.033 92.676 38.632 136.678-104.501 90.542 45.120 115.349 -76.120 90.794 51.368 147.156-117.557 93.493 60.093 138.775-104.934 92.769 -6.822 143.125-124.985 124.104 143.504 152.749 -18.166 122.503 147.769 120.194-125.617 95.379 28.021 116.671 -76.577 94.043 45.600 138.091-101.253 92.281 40.555 116.105 -76.036 92.533 39.053 129.477 -76.361 89.746 41.814 142.523-133.807 89.822 50.593 147.015-115.633 90.067 39.306 144.016-105.991 92.560 38.162 129.321 -76.006 93.487 37.287 130.676 -88.372 93.019 37.408 129.306 -76.220 93.693 38.152 138.594 -92.433 93.196 39.579 136.567 -92.477 91.997 45.989 144.926 -41.198 91.593 42.188 142.463-133.463 92.455 63.270 143.026-124.123 93.028 0.000 129.419 -76.267 # 225 total E -2.31403E+02 rmsd from N 0.000 %NC 0.00 93.607 61.556 137.716-102.502 93.554 50.063 138.834 -96.849 93.768 39.625 144.093-135.629 92.891 35.445 129.813 -76.651 93.399 41.848 133.697 -27.807 94.984 32.167 137.413-151.597 94.087 40.965 131.636 -84.882 93.911 31.650 140.316 -85.531 93.643 49.204 148.233 -36.291 92.714 47.682 143.062-136.555 93.932 37.985 148.378-115.691 95.543 32.653 100.426-110.973 96.536 45.811 144.231-134.495 94.233 169.742 152.182-129.520 108.361-101.398 149.044-148.247 94.669 29.708 134.314 -91.262 94.832 55.570 134.268 -87.345 94.452 -31.529 138.691-102.914 119.345 -98.333 142.055-105.065 119.074 -55.758 112.671 -83.802 141.817 -75.743 0.000 0.000 142.555 -70.091 110.128 -89.205 92.384 46.525 138.882 -88.451 94.074 32.514 134.537-101.360 94.528 43.691 115.923 -76.333 93.372 108.033 149.779-127.555 93.589 60.206 140.837-111.110 92.673 -9.507 109.367 -83.528 116.212-174.012 151.773 -19.769 120.547 141.160 121.621-129.197 92.325 45.489 116.139 -76.266 93.321 39.233 135.804-104.330 90.506 45.583 116.537 -75.751 92.217 39.999 129.310 -76.174 90.164 37.230 142.332-132.028 90.871 47.213 145.946 -40.494 90.345 40.390 142.607 -44.785 91.762 38.209 129.292 -76.104 91.968 44.597 129.374 -86.621 92.598 37.643 128.956 -76.002 93.336 36.613 137.721 -79.560 93.674 38.575 137.104 -92.422 92.861 42.701 145.011 -40.957 92.407 42.737 142.798-137.817 92.424 61.549 142.956-124.341 93.020 0.000 129.413 -76.265 # 226 total E -2.30552E+02 rmsd from N 0.000 %NC 0.00 93.736 86.925 139.839-108.818 93.425 46.789 137.848-100.834 91.102 44.752 143.123-132.883 92.198 43.413 129.438 -76.275 91.001 41.363 139.921-146.102 90.641 37.787 140.328-155.745 92.361 40.408 129.489 -78.239 91.203 36.733 138.528 -85.478 92.263 41.510 144.602 -41.868 93.613 53.126 137.467-143.102 94.196 137.020 146.155 -38.088 117.159 48.976 121.186-130.057 91.438 49.602 143.035-133.246 92.969 41.916 145.362 -39.902 109.972 165.181 112.060 -83.847 94.482 51.540 134.155 -91.836 96.534-100.589 133.621 -93.799 94.764 -64.439 139.869-101.944 112.343-124.307 143.876-143.632 94.313 49.300 144.417-134.981 93.119 42.600 0.000 0.000 91.633 52.822 136.129-123.935 91.121 41.442 138.775 -89.541 92.583 39.232 136.045-104.339 92.315 40.808 115.254 -76.294 92.490 39.425 146.494-110.512 94.212 43.565 140.558-104.853 95.664 33.831 144.664-127.816 96.449 21.814 144.926-126.503 122.705 159.844 121.053-127.214 96.353 26.365 116.819 -76.645 94.374 46.414 137.734-104.025 92.604 43.686 116.599 -76.249 92.557 42.576 129.422 -76.167 91.431 34.695 142.883-133.433 92.324 43.770 145.861 -39.243 90.791 43.167 146.858-110.663 92.516 35.350 129.329 -76.125 94.134 37.885 130.406 -88.934 93.653 34.419 129.342 -76.234 93.882 41.101 140.591 -88.813 93.033 38.274 137.394 -87.845 92.047 42.516 144.943 -41.142 92.857 38.914 142.595-133.749 93.218 54.619 143.540-123.600 93.030 0.000 129.463 -76.310 # 227 total E -2.26955E+02 rmsd from N 0.000 %NC 0.00 93.576 47.840 136.727-100.519 93.717 76.986 139.020-104.925 92.880 41.331 143.645-134.161 92.517 41.010 129.484 -76.220 92.363 40.450 138.930-153.994 90.698 39.552 140.356-154.380 91.321 42.882 128.945 -87.331 88.024 45.098 138.618 -85.267 90.037 45.618 144.227-107.204 90.594 59.582 137.985-141.033 93.272 168.392 145.326 -40.117 116.281 58.116 122.774-132.990 91.104 45.432 142.876-132.966 92.436 89.645 145.766 -38.698 91.137 60.056 142.727-137.690 92.264 44.092 133.519 -89.904 92.604 50.567 131.647 -87.720 93.135 134.935 135.912-100.056 93.370 86.313 140.421-131.260 92.621 47.639 143.630-133.493 93.933 74.981 0.000 0.000 127.902 177.330 159.017 174.807 118.805 -96.404 165.384-120.144 93.472 44.074 137.241-105.599 90.954 60.959 115.524 -75.909 91.687 55.283 145.553-109.644 93.964 40.234 139.847-112.612 94.267 -2.190 143.967-126.616 128.985 167.330 113.187 -81.900 93.194 63.016 100.594-112.780 92.882 39.589 116.168 -76.151 93.371 61.521 138.291-105.662 92.617 140.572 116.464 -75.824 92.511 43.985 129.389 -76.172 89.805 40.464 142.556-132.208 91.064 47.526 144.696 -40.906 91.725 35.212 143.938 -43.839 92.693 39.862 129.353 -76.135 93.450 40.819 130.290 -87.287 92.844 38.242 129.462 -76.225 92.962 37.261 139.222 -77.122 93.156 38.874 137.238 -91.398 92.154 46.255 144.756 -41.351 91.485 41.975 142.221-132.683 92.507 63.226 143.038-124.394 93.018 0.000 129.412 -76.268 # 228 total E -2.31514E+02 rmsd from N 0.000 %NC 0.00 93.625 75.152 138.150-101.920 93.590 50.245 139.746-103.247 92.906 37.205 143.661-134.223 92.478 41.536 129.480 -76.206 92.334 41.714 140.765-145.923 92.129 36.780 137.822-151.809 92.327 42.344 129.374 -88.636 88.894 47.180 140.648 -88.477 89.150 80.019 145.733-103.927 90.654 91.838 136.190-140.699 91.218-175.387 145.348 -42.347 94.144 64.699 100.468-112.867 97.214 21.191 144.430-136.727 95.239 47.871 146.666 -38.326 93.888 49.728 111.695 -84.071 92.773 39.863 133.303 -86.576 93.336 50.789 131.233 -87.799 93.993 -3.418 132.423 -84.028 129.347-158.390 147.216-146.304 92.915 46.545 143.766-133.987 92.752 175.432 0.000 0.000 95.864 33.662 128.855-120.397 94.478 39.207 139.750 -90.925 93.325 36.100 136.563-104.876 92.696 42.564 115.230 -76.342 93.347 36.492 146.802 -38.730 93.856 42.412 140.447-107.453 92.669 35.829 143.223-124.994 113.641 -85.195 111.417 -82.619 120.319 -76.125 121.174-128.766 92.877 143.129 116.897 -76.258 93.249 47.393 137.060-106.813 89.211 48.416 115.839 -75.618 92.319 41.071 129.050 -76.000 89.405 41.083 142.336-132.399 91.377 44.020 145.581 -40.452 90.422 39.602 143.548 -94.023 92.511 37.632 129.352 -76.144 93.431 38.725 130.091 -88.233 93.091 36.650 129.356 -76.223 93.368 38.403 139.536 -83.864 93.157 39.263 137.054 -91.963 91.999 46.236 144.907 -41.211 91.557 42.089 142.347-133.178 92.477 63.379 143.104-124.202 93.024 0.000 129.403 -76.260 # 229 total E -2.28872E+02 rmsd from N 0.000 %NC 0.00 93.622 74.393 138.211-102.162 93.592 50.241 139.388-102.556 92.940 37.083 143.739-134.143 92.452 42.037 129.511 -76.227 92.160 41.233 140.359-147.455 91.343 37.335 137.969-149.199 92.068 42.638 128.559 -88.490 88.635 48.627 139.404 -86.412 89.451 58.189 145.881-110.363 91.087 123.859 136.779-140.538 105.049-109.001 151.890 -31.178 121.900 -74.840 119.244-124.490 84.531-137.155 140.905-128.450 120.168-113.079 158.559 -17.603 109.094-107.040 148.594-145.789 94.157 55.399 134.824 -92.176 93.468 37.354 133.492 -87.809 92.843 79.331 139.134-102.645 93.587 40.744 134.061 -93.634 95.449 38.622 144.242-135.920 99.256 27.242 0.000 0.000 97.559 40.101 142.553-131.152 94.676 32.938 140.218 -92.818 93.140 38.159 137.655-104.774 91.643 45.422 115.079 -75.952 92.896 40.129 144.862 -42.231 93.954 36.213 141.038-121.314 93.180 73.755 143.438-125.477 95.996-156.786 144.385-126.473 118.342 9.364 121.717-130.673 92.385 82.314 116.290 -76.260 92.850 107.756 136.796 -97.968 91.770 61.591 116.184 -76.139 92.472 42.931 129.367 -76.153 90.842 39.227 142.853-132.498 90.376 46.366 149.929-129.259 89.518 46.606 145.424 -40.198 90.770 43.263 129.228 -76.049 90.654 45.594 129.850 -80.733 91.817 40.308 129.127 -75.979 92.728 36.488 138.669 -86.115 92.782 41.405 136.854 -93.251 91.561 45.954 143.713 -43.054 91.616 42.371 141.981-133.614 92.408 63.509 142.953-124.436 93.023 0.000 129.430 -76.289 # 230 total E -2.38827E+02 rmsd from N 0.000 %NC 0.00 93.630 80.813 138.043-100.945 93.629 46.658 138.774-101.405 92.778 40.085 143.650-134.183 92.581 39.242 129.481 -76.250 92.731 43.804 142.284-149.692 92.185 33.297 137.347-148.235 92.761 44.411 129.767 -86.163 91.568 41.107 139.045 -84.813 91.434 42.773 148.354-117.826 91.671 43.212 139.683-144.137 93.421-179.572 145.834 -39.015 92.502 72.636 101.139-115.200 92.288 48.504 142.666-132.804 92.888 47.272 144.924 -39.890 92.751 70.171 111.794 -82.634 93.653 34.069 133.113 -94.023 94.553 67.097 132.831 -88.221 94.508 -1.154 139.261-108.458 119.568-129.755 142.547 -91.155 93.352 58.718 143.902-134.501 93.084 169.532 0.000 0.000 128.210 10.621 157.249 178.145 90.360 49.200 141.456 -91.915 92.569 37.335 136.245-104.584 90.772 42.980 114.992 -75.996 90.182 47.122 147.501-117.088 92.891 51.270 141.776-103.263 90.372 46.146 142.027-123.036 93.059 49.280 143.072-122.717 120.986 177.293 121.480-128.849 93.724 50.519 116.443 -76.431 93.346 43.737 136.892 -94.829 90.753 45.093 116.781 -76.266 91.939 41.767 129.323 -76.184 88.599 42.986 141.895-131.070 91.115 45.181 145.445 -39.553 90.888 40.076 144.624 -40.160 91.922 37.465 129.302 -76.106 92.433 43.603 129.812 -87.825 92.541 37.225 129.233 -76.177 92.977 39.088 138.193 -75.064 93.073 39.350 137.282 -90.768 91.999 46.189 144.919 -41.247 91.574 42.147 142.416-133.424 92.450 63.348 143.019-124.177 93.022 0.000 129.413 -76.268 # 231 total E -2.27520E+02 rmsd from N 0.000 %NC 0.00 93.632 76.600 138.201-101.883 93.611 48.321 139.156-102.540 92.764 38.797 143.684-134.120 92.465 40.631 129.466 -76.228 92.124 43.237 140.689-148.368 92.236 34.009 138.631-146.657 93.030 39.997 128.461 -92.371 90.206 43.093 138.865 -86.783 90.223 61.477 144.275 -42.283 87.540 82.966 136.519-139.058 92.091 62.257 144.448 -41.103 93.068 49.081 99.963-111.208 96.948-112.746 143.554-138.049 112.515 106.086 155.759-134.553 93.528 41.392 143.477-134.691 95.743 156.747 135.034 -92.298 94.076 79.360 136.389 -92.358 93.277 59.492 137.442-102.476 101.024 176.471 140.610-108.260 96.841 104.280 145.901-139.458 95.313 36.972 0.000 0.000 93.094 53.878 143.821-128.088 92.059 34.496 139.218 -92.119 93.075 38.197 136.299-105.426 91.763 44.541 115.336 -76.149 92.297 44.705 145.687 -39.689 93.355 45.209 140.016-107.133 92.817 53.861 143.227-124.937 119.956-164.474 152.389 -18.857 93.198 65.229 99.897-114.267 91.537 45.216 116.088 -76.209 92.574 64.067 137.070 -94.267 91.584 39.626 115.799 -76.086 93.109 35.705 129.432 -76.206 96.461 30.904 144.542-136.491 92.963 41.503 149.650-124.072 91.679 38.131 144.969 -41.966 91.903 38.178 129.319 -76.151 91.872 43.426 130.071 -83.722 92.301 39.205 129.262 -76.175 92.894 35.904 137.843 -77.655 92.910 41.716 137.187 -91.219 91.484 47.232 143.936 -43.558 91.257 42.256 141.743-131.465 92.433 64.304 143.001-124.166 93.023 0.000 129.418 -76.280 # 232 total E -2.30382E+02 rmsd from N 0.000 %NC 0.00 93.577 76.429 137.053 -97.457 93.814 47.018 139.555-103.748 96.489 33.105 150.428 -31.404 93.071 39.438 129.530 -76.257 93.067 41.594 140.805-152.389 90.893 37.932 139.560-156.505 91.592 41.911 130.306 -82.999 88.785 41.013 139.486 -86.188 89.639 49.959 144.628 -99.061 91.472 47.658 137.759-138.981 91.761 47.699 148.924-120.904 119.299-104.203 120.533-128.023 105.385-107.989 111.967 -82.970 91.718 59.682 148.844-119.933 93.402 67.029 143.636-135.602 93.501 31.091 133.181 -86.625 95.580 152.270 138.317 -95.214 93.836 64.684 138.405-106.250 92.487 117.262 140.270-108.957 118.757-127.389 152.473 -24.679 92.584 53.043 0.000 0.000 91.836 50.226 137.161-124.348 91.486 37.366 139.476 -90.957 92.913 41.179 136.218-104.700 91.579 44.130 115.348 -76.221 91.478 47.888 148.286-117.800 93.543 64.484 140.484-110.753 92.617 -0.643 143.059-124.738 117.416-137.753 152.027 -19.605 121.398 109.361 121.041-127.977 93.517 32.639 116.342 -76.380 93.278 60.416 137.965-106.937 90.107 48.857 116.240 -75.825 92.053 36.883 129.336 -76.132 88.972 43.004 142.234-131.330 90.711 51.869 145.098 -41.248 89.058 43.347 147.734-116.529 91.475 36.737 129.298 -76.082 91.864 43.028 128.998 -85.079 91.967 43.733 129.241 -76.106 92.032 38.806 137.615 -84.847 92.494 44.950 137.126 -92.451 91.745 40.685 143.289 -42.018 92.753 44.907 143.595-140.765 92.283 61.282 142.929-124.038 93.019 0.000 129.432 -76.287 # 233 total E -2.31163E+02 rmsd from N 0.000 %NC 0.00 93.684 73.767 139.176-106.772 93.469 51.968 139.519-101.256 92.130 38.188 143.443-133.541 92.269 43.549 129.378 -76.121 91.663 40.759 137.643-144.584 91.259 38.902 137.777-148.378 91.896 43.719 129.211 -84.112 88.716 51.843 139.495 -83.347 90.325 42.292 146.454-114.292 92.192 102.959 139.304-142.102 110.374-135.883 153.479 -27.430 117.907 20.602 122.233-131.189 92.172 57.929 143.181-133.685 91.628 79.755 146.281 -39.754 91.707 50.522 142.826-135.395 92.418 37.423 132.798 -91.026 92.547 74.943 130.652 -86.356 93.207 68.110 129.950 -89.715 93.875 55.079 141.195-169.993 94.671 -14.497 144.273-135.135 118.063-175.060 0.000 0.000 94.193 43.463 138.941-130.026 89.373 49.318 137.103 -91.547 91.692 53.393 135.570-102.831 89.137 41.822 114.732 -75.948 91.851 42.169 145.764 -37.837 93.462 44.002 139.475-109.810 92.873 41.276 143.303-125.002 94.895-103.226 110.047 -82.918 119.277-113.517 121.657-130.039 91.743 55.666 116.088 -76.210 93.246 48.583 137.326-101.750 92.963 35.574 116.270 -76.129 92.831 39.848 129.651 -76.299 92.133 36.131 142.858-134.966 91.331 45.848 145.516 -39.948 90.222 41.501 144.189 -43.961 91.977 37.955 129.168 -75.948 92.402 42.079 129.801 -86.836 92.646 38.590 129.307 -76.235 93.216 37.183 138.063 -75.697 93.141 40.460 138.358 -93.611 91.912 45.039 144.822 -41.390 91.580 43.050 142.462-133.539 92.344 62.716 142.888-123.791 93.020 0.000 129.407 -76.255 # 234 total E -2.28311E+02 rmsd from N 0.000 %NC 0.00 93.750 -1.652 137.331-103.292 123.538-155.467 151.269-133.853 93.644 75.762 143.958-134.791 92.630 64.251 129.511 -76.242 92.601 39.632 136.138-125.251 93.771 38.892 137.417-158.703 92.835 37.652 129.389 -87.805 91.765 40.217 140.005 -87.033 90.476 45.287 147.812-120.467 90.298 45.041 137.375-141.592 92.800 133.522 145.712 -39.177 92.186 81.019 101.006-115.357 90.923 53.255 142.450-132.742 92.453 159.074 145.678 -39.845 96.550 80.567 144.993-142.128 94.164 27.453 132.523 -92.170 93.482 51.741 135.688 -84.403 92.927 65.519 132.849 -95.302 92.952 49.339 139.214-120.459 93.890 62.319 144.047-134.644 133.710 -43.233 0.000 0.000 93.393 62.318 137.935-122.568 94.571 29.774 138.333 -89.365 93.629 44.596 136.905 -98.519 92.035 37.509 115.495 -76.233 92.685 48.819 152.405-139.039 93.047 54.980 142.348-114.866 91.901 72.049 142.740-124.099 116.523-150.434 152.292 -19.228 123.288 5.269 120.709-126.353 94.912 46.232 116.596 -76.494 93.097 39.239 137.679-103.648 91.246 46.090 114.691 -75.839 92.049 43.230 129.298 -76.159 92.107 35.331 142.989-133.562 93.840 38.301 146.599 -36.632 92.308 37.569 146.463 -40.272 92.068 40.604 129.306 -76.144 91.800 44.321 129.958 -88.082 91.997 40.474 129.250 -76.174 92.732 36.337 136.963 -78.717 92.834 46.745 137.365 -93.197 91.404 51.853 144.156 -42.542 91.249 40.843 142.425-134.947 92.379 66.883 143.676-121.918 93.028 0.000 129.410 -76.274 # 235 total E -2.28352E+02 rmsd from N 0.000 %NC 0.00 93.666 71.758 139.009-106.416 93.525 53.445 141.249-108.065 91.649 38.611 143.245-137.650 91.947 44.510 129.449 -76.160 89.771 45.684 137.288-139.679 91.456 37.297 137.696-148.565 92.258 41.357 129.388 -87.729 92.395 33.310 138.374 -85.925 92.323 46.607 148.674-106.662 91.946 52.051 138.925-148.428 92.136 58.017 146.426 -40.143 119.778 -17.791 120.750-127.801 93.623-171.015 143.489-136.912 93.314 49.498 148.981-125.056 94.349 44.930 143.590-136.098 94.655 96.646 135.973 -90.654 122.245-151.265 155.161-116.406 94.128 80.431 137.860-105.445 93.825 125.025 150.125-164.865 101.166 -4.771 146.776-143.447 95.560 140.069 0.000 0.000 124.498 84.929 158.988 174.458 94.121 40.438 141.274 -89.154 93.990 35.031 137.270-106.769 93.758 43.806 116.535 -76.380 92.676 43.402 146.967 -38.538 93.243 48.946 139.196 -95.327 92.186 52.522 142.885-124.347 117.394-164.688 152.053 -19.649 92.996 68.258 99.880-114.484 91.684 43.081 116.095 -76.207 92.745 49.063 137.332 -93.650 91.943 38.439 115.779 -76.130 92.924 36.295 129.398 -76.202 93.141 37.178 143.377-134.110 91.713 41.436 147.634-116.979 92.165 39.570 145.305 -41.014 92.295 34.731 129.334 -76.151 91.946 45.802 129.823 -86.215 92.190 43.346 129.122 -76.276 92.221 37.440 138.252 -78.495 92.615 40.482 137.259 -90.585 92.025 45.180 144.317 -41.700 91.734 42.310 142.928-133.653 92.470 62.910 143.020-124.539 93.020 0.000 129.409 -76.268 # 236 total E -2.27228E+02 rmsd from N 0.000 %NC 0.00 93.618 55.995 137.741-103.400 93.850 34.657 137.584-102.647 108.314 177.828 150.161-142.117 92.527 41.419 129.500 -76.221 91.791 46.114 138.429-141.335 92.137 35.616 138.447-150.451 92.723 45.752 130.741 -86.747 93.022 29.032 139.284 -86.477 93.980 45.201 147.015 -38.177 94.675 53.646 138.330-141.127 93.197 69.148 149.347-117.699 118.132-115.623 121.999-130.923 95.172 -35.956 144.231-136.205 116.301-147.244 155.049-131.620 100.034-175.756 145.602-131.721 94.542 36.439 134.993 -94.356 93.582 41.639 133.669 -87.659 93.083 77.222 136.884-106.421 92.746 51.736 134.383 -90.528 92.576 36.537 143.629-134.755 94.033 39.046 0.000 0.000 93.464 46.635 138.936-124.667 90.925 38.917 141.466 -96.014 92.216 40.825 135.931-103.551 91.491 49.248 115.382 -76.057 90.923 42.175 144.850-103.777 93.759 36.973 140.213-113.205 93.330 52.144 143.491-125.621 93.949 36.472 143.257-122.978 120.541 147.963 122.622-130.717 92.214 48.715 116.147 -76.299 93.399 67.030 137.252-103.427 92.253 133.739 116.229 -75.732 92.471 63.814 129.362 -76.137 90.352 40.994 142.781-132.611 91.488 43.589 146.030 -38.930 89.838 46.300 150.491-119.573 91.811 37.376 129.319 -76.134 92.245 42.532 129.163 -89.703 92.487 113.607 129.270 -76.206 93.532 62.078 138.778 -87.692 93.685 28.773 137.357 -88.801 93.539 48.878 146.604 -37.965 93.195 35.279 144.352-133.972 93.455 53.472 143.410-126.093 93.034 0.000 129.458 -76.341 # 237 total E -2.27369E+02 rmsd from N 0.000 %NC 0.00 93.773 -22.025 134.646 -96.987 94.471-166.110 137.028-109.390 95.836 38.544 111.302 -82.963 92.938 42.836 129.533 -76.310 94.387 36.104 141.468-149.206 94.109 38.061 143.634-165.454 92.949 37.959 130.479 -85.459 92.164 38.021 139.958 -85.754 91.594 47.166 149.252-119.397 92.719 48.371 141.399-143.624 93.480 35.364 149.215-118.729 94.405 33.957 100.099-110.109 93.879 80.983 110.630 -83.484 93.014 50.350 145.217 -41.552 93.100 30.407 143.332-135.167 93.613 51.222 133.406 -90.768 93.645 80.231 133.874 -89.273 92.783 51.025 137.014-101.271 92.280 30.040 140.068-111.168 105.062-121.481 147.749-142.352 134.083 -72.479 0.000 0.000 123.546 34.838 159.957 168.890 92.647 39.284 140.807 -88.635 93.694 34.752 136.785-106.130 92.952 41.930 115.348 -76.462 92.105 55.895 145.567 -40.254 93.329 44.730 138.973 -92.580 95.732 38.150 109.989 -83.903 97.124 15.542 145.595-126.168 121.682 177.759 122.355-129.784 93.762 53.609 116.415 -76.476 93.560 42.903 137.004-101.935 90.612 57.249 115.770 -75.754 92.331 71.306 129.322 -76.148 90.793 37.600 149.524 -33.861 90.788 42.802 147.850-113.848 91.900 39.707 144.067 -41.843 92.468 37.894 129.294 -76.174 93.253 42.760 131.102 -84.715 93.389 32.955 129.417 -76.311 93.608 40.195 140.913 -79.997 93.122 38.142 137.228 -89.059 92.036 46.283 145.005 -41.174 91.545 42.039 142.408-133.345 92.443 63.113 142.959-124.026 93.026 0.000 129.424 -76.268 # 238 total E -2.27912E+02 rmsd from N 0.000 %NC 0.00 94.369 165.225 138.753-102.396 93.283 54.238 139.169 -99.205 91.776 40.230 143.706-133.751 92.313 41.263 129.581 -76.258 91.693 40.084 140.475-151.416 90.130 40.069 137.428-148.014 91.736 42.527 121.363 -92.159 89.457 53.975 136.148 -85.194 91.464 19.305 146.093-113.168 106.994 61.008 144.566 -11.130 92.787 77.289 147.190 -36.893 92.480 13.623 100.136-113.069 99.538-128.633 150.536 -29.439 119.780 167.151 158.232-141.833 100.151-159.236 145.502-140.999 94.272 55.853 135.248 -91.928 94.055 59.715 133.572 -87.963 93.841 14.303 139.876-106.523 108.871 163.548 142.900 -95.627 96.459 42.436 111.415 -83.019 95.949 45.868 0.000 0.000 94.290 37.653 136.599-124.901 92.429 39.033 140.430 -94.752 92.530 47.128 136.036-103.460 90.565 53.701 115.302 -76.159 90.899 46.405 147.248-108.090 93.757 74.966 139.726-109.690 93.955 -56.974 143.615-125.943 113.000-165.420 153.821-144.320 120.957 136.597 120.778-127.786 94.955 35.709 116.616 -76.515 93.767 41.142 137.513-103.363 91.865 39.916 115.715 -76.294 92.365 44.949 129.352 -76.215 90.903 36.738 142.542-132.591 92.151 40.765 145.630 -38.587 91.324 41.509 145.932 -41.084 91.663 39.599 129.264 -76.112 91.331 43.076 129.371 -88.284 91.911 41.862 129.210 -76.156 92.516 38.153 137.872 -77.362 92.765 39.807 137.299 -91.225 91.931 46.383 144.791 -41.326 91.410 42.068 142.764-131.741 92.458 63.401 142.986-124.359 93.032 0.000 129.416 -76.262 # 239 total E -2.26993E+02 rmsd from N 0.000 %NC 0.00 93.642 78.310 138.188-101.802 93.588 48.663 139.253-102.448 92.880 38.156 143.674-134.163 92.473 40.929 129.475 -76.228 92.281 42.753 141.117-150.948 91.548 35.721 138.627-148.138 92.329 42.749 129.367 -87.569 89.462 40.542 138.728 -87.468 89.665 51.441 147.856-115.906 88.265 45.770 135.822-140.264 91.860 131.079 144.464 -42.181 93.899 102.617 100.298-112.612 123.613-116.172 113.713 -84.747 112.389 41.375 153.319 -25.168 94.348 34.234 144.030-136.999 93.296 56.972 136.762 -81.741 93.862 36.642 127.803 -90.215 94.181 36.343 141.667-111.586 96.960 32.547 140.124-109.215 96.954 16.233 145.053-135.603 126.666-123.034 0.000 0.000 128.682-115.737 159.259 172.737 90.583 46.986 141.681 -90.130 92.526 41.233 136.081-102.549 90.889 44.573 115.011 -76.042 91.931 89.767 149.884-121.604 93.643 70.071 142.152-119.508 92.318 58.267 110.002 -83.427 93.204-154.000 143.817-121.284 92.845 67.142 99.849-114.870 91.928 42.815 115.882 -76.186 93.079 47.127 138.647-110.309 90.706 42.592 115.522 -76.041 92.174 40.507 129.333 -76.137 90.761 38.855 142.532-131.948 91.282 43.747 145.573 -96.878 91.959 35.841 147.335-122.351 92.891 35.185 129.430 -76.188 93.559 39.657 130.966 -95.141 92.613 39.091 129.313 -76.266 93.098 35.482 137.636 -84.251 93.113 41.361 136.913 -92.961 91.792 45.335 144.228 -42.724 91.641 42.605 142.374-133.703 92.417 63.178 142.993-124.154 93.022 0.000 129.413 -76.264 # 240 total E -2.27833E+02 rmsd from N 0.000 %NC 0.00 93.648 85.164 138.293-101.635 93.611 47.623 139.214-102.652 92.772 38.883 143.659-134.088 92.480 40.017 129.439 -76.221 92.456 44.525 143.207-155.473 91.448 34.415 138.936-150.000 91.875 44.213 130.110 -89.079 87.324 54.417 140.338 -87.364 88.844 43.457 144.685-103.512 91.616 51.442 139.367-140.174 93.245 44.060 150.651-122.724 92.959 36.870 102.376-113.046 93.002 59.856 149.745 -32.753 91.983 -52.763 146.359-116.601 121.132-125.316 112.860 -84.145 94.106 68.400 136.211 -89.754 93.843 89.859 133.684 -87.976 93.575 14.662 136.496-101.823 110.981-133.074 144.970 -96.667 93.795 48.264 143.768-133.911 115.996-178.521 0.000 0.000 132.775 -52.114 158.561 162.606 96.485 49.533 140.557 -90.364 94.235 29.077 137.281-106.912 94.422 50.220 116.682 -76.743 92.187 47.673 150.185-123.804 93.260 35.125 139.449 -97.374 92.983 53.552 143.348-125.375 94.314 159.561 143.426-124.838 93.168 54.042 99.982-114.825 92.390 42.212 116.255 -76.317 92.869 71.269 137.788-102.283 90.964 51.052 115.523 -76.078 92.416 41.885 129.371 -76.139 92.002 36.052 143.188-133.620 92.034 45.796 146.692 -38.232 89.979 42.849 147.648-116.100 91.872 37.515 129.347 -76.131 92.530 38.727 129.675 -88.392 92.400 41.082 129.253 -76.154 92.897 37.707 137.019 -83.930 92.918 40.650 137.040 -92.729 91.792 47.013 144.739 -41.457 91.335 42.065 142.461-132.100 92.459 63.850 143.035-124.173 93.025 0.000 129.402 -76.261 # 241 total E -2.27491E+02 rmsd from N 0.000 %NC 0.00 93.598 78.958 137.545 -99.174 93.748 47.739 139.114-102.842 93.250 38.125 143.809-134.311 92.558 40.310 129.394 -76.156 92.674 44.950 141.065-151.654 92.016 33.378 139.602-149.668 92.911 42.054 129.387 -84.388 91.061 39.549 138.689 -86.584 90.645 54.583 149.241-112.742 91.930 48.894 137.759-140.955 93.466 108.930 146.862 -37.824 94.427 39.367 98.637-106.806 93.893 51.197 143.577-134.492 92.692 162.281 150.070-129.722 94.265 90.830 144.132-139.458 95.256 -88.556 132.780 -91.535 119.166 160.364 155.218-113.062 93.464 69.815 133.052 -82.100 115.943 -86.367 143.870-148.468 95.554 -33.905 111.482 -82.991 94.468 157.113 0.000 0.000 125.151 23.849 158.254 173.272 93.101 42.109 138.953 -89.080 93.404 38.007 136.784-106.152 93.883 37.830 115.454 -76.334 93.013 41.642 151.482-126.848 92.948 44.527 142.315 -96.972 91.870 48.624 109.615 -83.883 93.137 41.678 143.258-122.019 121.338-174.637 121.425-128.447 92.202 57.030 116.206 -76.308 93.085 55.440 137.051-101.169 90.311 51.238 116.192 -75.343 92.176 40.899 129.392 -76.208 91.020 37.200 149.644 -32.970 91.036 54.883 146.547 -38.784 89.937 43.123 142.705 -42.569 91.627 37.603 129.290 -76.091 92.108 43.455 129.701 -87.325 92.445 38.807 129.182 -76.104 92.765 38.933 137.822 -73.696 92.922 39.327 137.340 -90.654 91.880 46.723 144.850 -41.370 91.454 41.936 142.223-131.889 92.489 63.860 143.023-124.367 93.023 0.000 129.414 -76.268 # 242 total E -2.28449E+02 rmsd from N 0.000 %NC 0.00 93.658 83.497 138.432-102.094 93.581 48.314 139.421-102.565 92.643 38.651 143.674-133.964 92.462 40.656 129.469 -76.216 92.557 44.290 142.363-154.152 92.006 33.916 139.062-149.908 92.305 46.374 129.339 -87.426 88.652 66.824 139.643 -85.600 90.252 33.764 144.801-103.197 94.386 57.105 140.976-141.822 95.875 72.734 147.717 -37.366 124.171-160.918 119.865-123.623 90.527 81.036 141.992-135.724 92.221 77.159 143.494 -41.456 93.074 83.452 142.671-137.100 96.145 -77.214 134.009 -93.224 95.834 125.723 134.911 -87.795 93.886 -13.051 138.218-107.155 107.428 -92.309 143.981 -82.071 94.887 -27.489 144.389-135.349 147.239 -89.084 0.000 0.000 132.064 20.524 105.917 -85.046 93.201 41.214 140.916 -90.649 93.609 33.557 137.031-106.750 91.918 51.362 115.668 -76.072 91.844 44.720 144.398 -40.649 93.828 56.262 139.849-109.880 94.067 -19.786 143.766-126.102 125.255 176.221 113.038 -82.070 123.563 131.154 119.644-124.684 98.222 11.560 117.112 -76.877 94.496 58.637 137.729-102.762 91.826 40.648 115.935 -76.724 92.045 42.442 129.339 -76.169 88.892 43.719 142.099-131.609 91.986 37.091 144.202 -42.111 90.911 44.100 152.506-132.567 91.767 36.795 129.317 -76.127 92.484 39.541 129.827 -88.927 92.461 38.438 129.244 -76.139 93.070 39.058 138.503 -86.318 92.840 40.185 136.865 -92.433 91.617 47.911 144.761 -41.431 91.234 41.917 142.348-131.644 92.404 63.912 143.026-123.599 93.025 0.000 129.415 -76.266 # 243 total E -2.29451E+02 rmsd from N 0.000 %NC 0.00 93.776 118.604 137.899-104.232 123.788-118.433 150.386 -81.930 92.028 49.276 143.531-133.536 92.432 45.289 129.293 -76.081 92.982 42.769 141.522-152.922 93.020 33.760 141.555-156.197 92.591 39.708 129.576 -88.257 88.433 58.028 140.181 -87.881 89.275 49.150 143.170 -45.554 88.120 93.629 137.698-139.446 93.730-159.353 145.512 -41.227 93.078 60.456 100.688-113.362 94.410 33.154 143.481-134.339 94.063 91.022 147.721 -35.723 92.553 46.844 143.044-136.636 92.480 40.906 132.862 -90.906 92.873 52.004 132.219 -84.955 93.109 43.603 132.074 -71.454 95.834 29.653 140.994-135.618 98.542 33.848 145.602-138.461 98.019 33.866 0.000 0.000 95.086 45.976 139.540-130.411 93.027 32.702 140.019 -93.206 93.432 48.097 136.559-105.480 95.055 75.295 116.301 -76.519 92.306 113.613 151.685-121.693 94.290 -84.257 139.298-104.459 93.528 74.372 143.821-125.999 95.519 157.011 144.629-126.612 118.091 139.986 123.004-132.632 92.200 49.905 116.167 -76.291 93.066 46.260 136.140 -97.330 91.644 38.832 115.992 -76.162 92.824 37.545 129.367 -76.175 92.566 36.316 143.133-133.671 91.881 45.004 146.420 -39.081 91.301 38.948 144.990 -41.353 92.286 36.382 129.321 -76.137 92.354 42.584 129.535 -87.798 92.048 45.523 129.274 -76.237 92.088 37.830 137.208 -73.893 92.493 40.552 137.436 -89.835 91.797 47.357 144.718 -41.450 91.093 42.083 142.678-129.817 92.475 63.919 142.966-124.245 93.022 0.000 129.399 -76.259 # 244 total E -2.29811E+02 rmsd from N 0.000 %NC 0.00 93.588 77.719 137.306 -98.844 93.704 48.408 138.657-100.581 94.966 34.727 144.290-135.530 93.113 38.758 129.510 -76.218 94.580 36.222 142.642-147.111 93.861 39.537 140.171-162.977 92.601 37.184 129.604 -86.592 89.801 42.059 139.653 -86.552 90.183 49.826 143.676 -99.578 91.014 49.367 138.318-139.812 93.297 57.516 146.604 -39.745 122.052 -19.094 121.170-127.074 96.165 178.465 144.298-137.676 92.806 49.315 148.088-118.594 93.525 35.808 143.687-135.230 92.911 47.493 134.415 -91.702 92.514 42.876 127.355 -95.457 92.772 54.310 135.963-102.187 92.494 39.117 139.040-110.768 102.612 -97.754 146.889-140.404 121.999-107.257 0.000 0.000 126.647 0.406 158.010 168.259 91.024 62.477 140.315 -89.566 92.280 40.749 135.836-104.727 89.059 48.225 115.120 -76.216 92.150 64.713 144.483 -38.864 93.088 48.374 140.101-111.693 91.482 41.600 142.630-123.944 114.938 -70.761 112.497 -82.676 120.141-100.498 121.384-129.148 124.911-136.082 121.987 -79.954 93.166 57.502 139.208 -88.724 91.873 38.127 116.212 -76.016 92.696 38.923 129.402 -76.173 92.711 36.092 142.896-133.090 91.437 42.422 147.982-116.296 91.677 38.424 144.679 -42.308 92.218 38.050 129.330 -76.146 92.489 42.251 130.351 -87.192 92.484 38.043 129.263 -76.225 92.943 38.721 137.731 -74.940 93.078 39.690 137.332 -90.865 91.988 45.965 144.890 -41.184 91.581 42.284 142.522-133.514 92.475 63.298 143.026-124.204 93.024 0.000 129.417 -76.272 # 245 total E -2.31088E+02 rmsd from N 0.000 %NC 0.00 93.669 83.902 138.519-102.746 93.466 51.154 139.348-101.513 92.465 39.129 143.539-133.894 92.470 40.605 129.490 -76.233 92.212 41.659 139.961-147.539 91.370 36.241 138.657-148.624 92.543 42.479 129.552 -87.332 90.644 37.194 138.690 -84.654 91.939 48.944 145.293 -40.639 91.998 65.131 137.484-143.236 107.623-112.642 152.446 -30.514 93.379 87.986 100.514-109.026 117.240 110.395 150.758-150.788 92.912 -38.155 145.460 -39.759 96.419-106.869 145.074-138.567 93.861 44.324 132.139 -93.271 93.869 57.926 133.741 -87.295 93.283 40.969 139.135-104.713 93.280 48.957 148.653 -97.710 91.907 34.995 143.434-135.155 93.626 41.043 0.000 0.000 94.334 39.325 134.514-118.059 95.081 34.858 138.734 -91.961 93.390 39.615 136.578-105.261 93.285 41.609 115.533 -76.595 92.375 41.699 151.220-122.356 94.053 37.641 139.854-105.662 94.878 3.580 144.260-127.172 125.895 152.478 112.689 -82.008 93.369 47.013 99.914-114.893 92.838 41.349 116.296 -76.366 93.503 61.545 137.879-104.789 92.615 140.219 116.422 -76.017 92.604 46.311 129.380 -76.168 90.588 37.054 142.823-132.760 91.207 50.777 146.235 -38.588 90.074 40.904 144.240 -43.968 91.679 37.519 129.293 -76.104 91.280 45.602 129.272 -87.531 91.629 47.035 129.036 -76.129 91.554 38.543 138.104 -82.074 92.053 42.313 137.282 -91.231 90.939 45.733 142.818 -42.371 91.345 46.203 142.111-132.161 92.195 61.434 142.945-125.034 93.019 0.000 129.429 -76.267 # 246 total E -2.35492E+02 rmsd from N 0.000 %NC 0.00 93.629 76.837 138.088-101.547 93.612 49.171 139.817-103.589 92.790 38.318 143.646-134.214 92.427 41.078 129.485 -76.251 91.886 44.479 140.650-148.246 92.306 33.490 140.133-144.593 93.468 42.095 130.138 -87.233 93.062 33.668 138.819 -85.943 91.913 47.123 151.483-127.416 91.387 48.243 139.230-139.800 93.889 36.089 146.516 -39.491 93.748 37.569 100.632-109.911 94.053 42.602 110.378 -83.705 93.101 38.715 145.281 -40.984 91.379 43.602 143.879-134.900 92.558 44.753 131.889 -89.429 93.240 35.414 132.594 -88.376 93.235 48.130 137.681-101.923 92.986 35.720 138.503-113.481 102.672-134.142 146.901-139.487 94.259 99.969 0.000 0.000 123.571 167.676 157.181 176.698 92.868 56.587 141.701 -89.390 93.200 35.851 136.815-105.032 91.298 47.558 116.004 -75.863 90.901 41.250 147.913-119.537 92.942 47.084 142.540-109.240 90.539 49.135 142.162-123.156 92.582 51.894 142.829-122.901 119.340 172.061 121.968-130.446 93.786 46.386 116.465 -76.429 93.495 39.673 136.534 -95.114 91.775 43.409 116.709 -75.946 92.506 40.100 129.373 -76.219 90.274 37.406 142.365-132.039 91.430 49.571 146.493 -38.485 90.253 40.431 144.010 -43.124 91.713 36.466 129.295 -76.111 91.596 47.508 129.427 -87.074 91.975 44.230 128.979 -76.035 92.176 36.302 138.025 -79.956 92.586 41.395 137.232 -90.949 91.631 46.682 143.804 -42.399 91.440 42.162 141.978-132.835 92.450 63.739 143.032-124.193 93.020 0.000 129.400 -76.254 # 247 total E -2.39213E+02 rmsd from N 0.000 %NC 0.00 93.694 81.386 139.406-106.763 93.326 48.379 138.111-102.424 91.123 43.470 143.147-132.891 92.147 45.912 129.499 -76.205 92.323 36.828 141.186-144.197 92.268 39.938 139.951-153.620 92.397 40.502 127.461 -95.731 88.812 50.431 139.521 -82.012 89.747 40.865 145.676-111.423 92.569 54.670 139.397-140.764 94.136 54.220 147.604 -37.723 123.813 178.181 119.668-123.593 93.336 32.930 143.522-135.098 93.103 48.445 145.888 -39.449 89.913 52.541 142.636-127.553 92.860 40.874 129.229 -93.642 93.742 41.302 131.431 -88.563 94.367 15.141 138.117 -98.723 125.502 172.050 149.934-140.049 93.212 62.073 144.093-135.034 95.586 175.240 0.000 0.000 120.512 45.523 155.799-174.907 91.361 40.823 139.782 -88.674 92.604 40.440 134.716-106.142 92.522 42.330 115.399 -76.572 92.204 42.292 147.871-107.234 94.184 33.001 139.452-102.248 95.643 48.006 144.608-127.807 95.633 19.629 144.184-124.612 123.700-162.918 120.716-125.983 90.394 49.150 115.937 -76.130 93.661 116.351 137.378-103.444 92.039 108.476 116.524 -75.953 92.454 68.320 129.362 -76.114 91.801 32.662 143.133-133.450 91.921 47.693 146.838 -36.025 90.683 36.738 145.892-114.093 92.304 39.643 129.366 -76.154 92.463 40.306 130.129 -84.896 92.516 38.900 129.202 -76.104 93.178 34.921 138.128 -87.491 93.229 41.045 136.763 -94.288 91.851 45.077 143.900 -42.556 91.577 43.048 142.268-134.614 92.348 62.910 143.001-123.717 93.019 0.000 129.415 -76.269 # 248 total E -2.29392E+02 rmsd from N 0.000 %NC 0.00 93.648 83.750 138.257-101.711 93.595 48.175 139.397-102.780 92.731 38.962 143.628-134.046 92.508 39.577 129.469 -76.242 92.687 43.579 142.900-150.728 93.239 32.419 139.577-150.193 93.618 37.312 130.194 -87.454 90.887 41.149 138.860 -85.772 91.094 46.903 144.307 -42.857 91.547 50.934 138.361-139.673 94.383 59.854 147.114 -38.661 123.315-101.646 120.254-124.930 93.924 140.046 149.088 -34.396 131.393 -72.137 162.821-154.886 95.822 155.867 142.604-132.779 123.137-149.184 151.705-130.130 93.701 64.895 136.731 -89.386 93.173 53.941 136.555-101.872 103.400-159.941 141.893-134.384 93.722 77.309 144.336-135.419 92.502 54.272 0.000 0.000 92.171 43.764 133.033-119.671 92.732 36.098 139.209 -91.967 93.061 38.897 136.357-104.533 91.579 43.760 115.235 -76.194 92.507 44.748 145.667 -39.131 93.427 43.809 139.779-105.196 93.059 46.996 143.356-125.191 121.445-167.124 152.638 -18.531 93.005 68.873 99.819-114.343 90.759 52.247 115.953 -76.135 92.382 66.507 135.546 -93.309 91.311 41.225 115.510 -76.248 92.699 38.103 129.384 -76.181 92.104 38.862 143.204-133.427 90.965 44.641 148.116-116.080 90.919 43.392 144.601 -42.216 91.861 40.462 129.278 -76.089 92.079 42.404 129.616 -90.158 92.100 43.994 129.317 -76.208 92.358 42.041 137.677 -76.568 92.659 40.599 137.290 -89.940 91.529 49.498 144.716 -41.224 91.039 43.099 142.270-132.845 92.165 68.077 142.872-124.064 93.018 0.000 129.389 -76.251 # 249 total E -2.37756E+02 rmsd from N 0.000 %NC 0.00 93.627 72.458 138.138-102.329 93.578 50.786 139.476-102.493 92.934 37.159 143.694-134.171 92.484 41.736 129.511 -76.232 92.197 40.720 139.320-144.062 92.539 36.517 138.833-148.808 93.105 40.604 129.537 -85.087 92.179 35.356 137.424 -85.368 91.916 43.609 148.401-126.226 92.904 45.756 138.239-141.743 93.098 121.479 145.989 -38.948 92.913 64.278 100.290-112.444 94.578 35.354 143.740-135.359 93.858 41.292 145.966 -37.986 91.991 46.233 111.777 -83.728 92.737 42.877 131.418 -96.027 93.289 51.747 130.954 -88.713 93.713 6.698 134.563 -90.387 122.610-146.900 146.803-146.780 92.591 74.642 143.835-133.994 92.452 73.279 0.000 0.000 91.874 61.570 137.802-127.140 90.319 37.304 138.905 -90.903 92.376 45.320 136.207-104.091 91.236 49.643 115.990 -75.792 90.947 43.828 149.723-112.697 94.253 46.822 139.425-109.119 95.612 -72.810 144.553-127.426 117.813-114.995 152.189 -19.163 120.618 118.593 123.061-131.406 91.700 45.537 116.089 -76.229 92.640 58.543 136.472 -98.494 89.009 58.114 116.135 -76.121 91.874 40.037 129.217 -75.990 88.280 42.894 141.973-130.921 89.882 44.465 145.322-111.153 90.646 44.007 143.902 -42.321 91.573 39.436 129.288 -76.095 92.026 42.815 129.889 -87.400 92.586 38.009 129.202 -76.080 92.940 38.763 138.053 -75.104 93.064 39.477 137.299 -90.999 92.062 45.346 144.863 -41.330 91.800 42.097 142.550-133.807 92.488 63.045 143.026-124.545 93.021 0.000 129.413 -76.268 # 250 total E -2.39393E+02 rmsd from N 0.000 %NC 0.00 93.665 82.223 138.659-103.439 93.491 49.984 139.245-101.968 92.414 39.420 143.530-133.855 92.425 40.510 129.453 -76.215 92.086 43.000 140.071-147.394 91.740 34.883 138.627-148.258 92.693 41.900 129.581 -87.287 90.492 37.300 138.452 -87.282 90.594 48.038 150.983-122.451 90.587 52.597 137.732-138.445 92.967 62.871 146.793 -39.317 118.843-160.892 121.939-130.077 93.076 53.355 143.415-134.848 92.625 45.084 145.474 -40.273 91.103 45.873 143.165-137.289 92.176 41.685 131.863-100.889 92.126 47.662 130.543 -88.483 92.856 95.004 135.783 -89.381 91.886 42.639 137.992-108.353 90.711 47.578 143.045-132.393 93.748 79.736 0.000 0.000 92.408 39.428 137.418-119.223 93.503 37.593 139.752 -90.905 93.152 39.729 136.343-104.426 92.304 43.040 115.293 -76.370 91.951 40.832 149.056-119.668 93.973 40.730 139.947-107.874 93.934 6.112 143.798-126.183 121.455 148.977 111.993 -82.087 93.270 48.467 100.000-115.100 92.785 40.665 116.293 -76.356 93.454 61.078 137.736-104.408 92.682 141.201 116.542 -76.072 92.655 44.372 129.383 -76.166 90.487 38.759 142.778-132.641 91.131 46.517 144.371 -41.188 91.563 37.588 143.758 -44.343 92.679 38.321 129.366 -76.156 93.391 38.914 129.937 -87.577 92.651 40.147 129.527 -76.356 92.652 40.382 137.803 -69.925 92.996 36.431 137.364 -89.934 92.229 47.133 145.477 -40.026 91.322 40.137 142.922-136.415 92.938 69.195 143.233-124.965 93.010 0.000 129.387 -76.217 # 251 total E -2.36599E+02 rmsd from N 0.000 %NC 0.00 93.946 125.476 140.092-106.499 93.139 60.306 141.325-102.668 90.396 40.217 143.024-132.507 92.190 41.756 129.415 -76.152 91.996 38.880 136.876-140.780 91.585 37.758 140.273-155.006 91.888 40.763 130.126 -83.876 88.980 40.369 139.509 -85.498 92.021 40.895 143.899 -42.894 95.040 55.167 137.890-141.085 93.566 69.303 149.676-121.346 121.708-168.470 121.004-127.004 92.951 14.907 143.379-134.790 105.306-129.306 150.876 -29.889 95.370 101.657 144.623-140.605 94.329 93.929 134.681 -85.680 95.869 -71.427 130.595 -86.447 92.860 97.827 135.972 -92.650 92.630 64.510 134.101-142.304 92.624 40.522 143.777-134.646 93.361 37.452 0.000 0.000 91.846 43.939 133.616-122.903 91.861 38.236 137.199 -95.589 92.616 40.952 135.944-104.587 91.137 41.526 115.200 -76.148 90.681 42.223 146.940-113.174 93.453 44.678 140.359-106.116 92.007 49.211 142.946-124.258 96.349 51.883 149.780 -23.943 121.203 177.985 121.621-128.778 91.728 55.516 116.188 -76.243 93.162 44.722 137.307-102.205 90.178 44.793 116.259 -75.503 92.070 40.531 129.327 -76.147 89.207 41.097 142.062-131.533 90.973 44.767 145.224 -40.716 90.491 41.497 144.583 -41.168 91.868 37.913 129.263 -76.080 92.015 41.087 129.583 -88.307 92.023 42.986 129.219 -76.185 92.543 37.345 135.251 -69.914 92.941 41.264 137.358 -89.779 91.843 45.775 144.734 -41.464 91.551 42.651 142.380-133.199 92.472 63.335 142.962-124.186 93.010 0.000 129.410 -76.272 # 252 total E -2.33947E+02 rmsd from N 0.000 %NC 0.00 93.788 96.110 140.206-110.392 93.266 49.883 138.078-102.693 91.015 44.450 143.153-132.849 92.184 45.629 129.506 -76.215 91.825 38.215 141.248-142.589 93.009 39.662 141.178-159.749 93.401 52.551 129.506 -88.139 93.127 -1.145 139.941 -82.838 115.500-152.565 155.021 -22.182 92.856 94.597 139.744-145.070 94.390-169.094 145.327 -39.480 92.224 70.815 100.723-113.322 91.116 41.478 142.232-131.825 91.941 48.103 144.455 -40.424 91.896 39.052 141.434-127.900 93.657 48.419 132.544 -96.496 93.928 32.950 131.225 -89.035 94.261 117.219 142.626-117.396 93.012 61.119 145.857-167.650 91.461 36.304 143.444-134.146 91.879 51.817 0.000 0.000 91.002 51.565 134.823-121.882 92.014 37.249 138.232 -90.324 93.259 37.359 136.373-104.799 92.573 42.752 115.341 -76.023 92.857 59.222 145.874 -41.162 93.818 71.425 139.270 -99.372 92.286 -72.854 142.829-124.427 113.778-128.870 151.663 -20.254 121.719 106.245 121.304-128.057 94.540 24.984 116.539 -76.496 93.739 50.822 137.456-103.097 91.370 42.106 116.108 -75.814 92.459 41.283 129.365 -76.187 90.886 36.480 142.659-132.824 91.648 48.995 145.537 -39.600 90.444 38.318 144.146-106.805 92.517 41.805 129.565 -76.261 93.023 36.179 130.312 -88.670 92.249 46.012 129.241 -76.173 93.647 33.155 132.542 -93.776 93.303 45.967 137.989-106.911 91.458 51.312 144.592 -41.743 91.309 40.042 142.462-132.755 92.661 66.543 143.723-123.728 93.029 0.000 129.414 -76.272 # 253 total E -2.29254E+02 rmsd from N 0.000 %NC 0.00 93.626 74.293 138.093-101.862 93.646 47.798 139.536-105.092 92.276 40.462 143.640-136.153 92.296 41.227 129.481 -76.233 91.562 43.095 140.039-145.542 91.799 35.288 136.625-145.136 92.731 41.748 129.774 -87.205 91.515 36.677 138.861 -86.181 90.942 43.182 145.621-104.489 93.222 50.647 136.875-143.891 94.138 39.711 146.725 -37.961 92.944 37.834 100.313-109.591 92.599 58.851 109.971 -84.743 91.726 90.123 146.902-114.223 93.996 61.637 142.527-138.092 121.072-126.986 155.148-106.399 94.187 60.373 133.938 -89.009 93.256 77.366 137.598-102.370 93.166 96.953 136.256-113.448 93.938 70.934 144.167-135.739 93.633 158.894 0.000 0.000 127.519 24.317 158.561 171.880 92.585 41.077 140.619 -91.149 93.178 44.555 136.496-105.573 92.653 56.676 115.369 -76.308 92.586 103.539 151.762-127.869 93.704 47.137 140.019-110.638 93.408 90.376 143.601-125.785 110.409-154.742 152.736-142.742 122.424 5.314 120.885-127.136 94.512 46.360 116.579 -76.481 92.818 39.764 137.313-101.568 90.208 51.068 114.924 -75.971 92.103 45.318 129.306 -76.144 90.483 35.143 142.589-131.058 92.008 48.336 146.047 -37.037 90.509 38.702 146.699-116.710 91.952 38.732 129.336 -76.119 92.717 38.738 127.993 -98.331 92.219 45.432 129.397 -76.220 92.509 46.800 138.089 -89.103 93.237 34.345 136.164 -90.590 92.418 49.769 145.803 -39.029 91.488 39.756 141.929-132.503 92.645 64.517 143.051-124.707 93.018 0.000 129.424 -76.279 # 254 total E -2.29669E+02 rmsd from N 0.000 %NC 0.00 93.634 71.473 138.392-103.552 93.503 51.760 139.670-102.642 92.745 37.334 143.690-133.980 92.482 41.564 129.424 -76.144 92.607 39.612 136.859-143.833 92.820 35.735 138.581-149.709 93.132 40.367 130.632 -84.688 91.445 36.418 140.422 -84.999 92.258 45.696 145.566 -39.860 92.820 49.845 138.424-141.139 92.978 40.824 149.410-117.614 93.507 41.964 101.385-112.506 91.484 62.419 141.825-133.381 92.044-118.667 145.793-115.734 93.179 108.874 143.567-135.179 94.426 40.856 131.251 -94.766 122.363 153.429 152.704 -97.868 94.265 35.382 137.899-104.234 94.662 49.624 141.441-115.743 93.762 68.881 144.242-135.286 94.408 137.545 0.000 0.000 125.799-136.116 157.532 177.111 91.393 46.714 142.247 -90.870 92.672 40.481 136.625-104.160 90.395 44.660 115.341 -76.005 90.892 65.200 150.195-123.714 92.800 37.121 139.999-106.471 91.043 60.574 142.395-123.584 93.180 -34.735 143.149-123.077 120.587-133.092 120.607-127.705 92.569 59.249 116.290 -76.350 93.097 61.386 140.193-109.330 90.482 40.925 115.675 -75.728 92.203 40.789 129.368 -76.255 88.614 42.210 142.035-131.443 90.977 40.838 144.084 -43.454 91.528 39.752 144.027 -41.455 92.104 37.854 129.364 -76.171 92.495 42.384 129.822 -87.874 92.684 36.417 129.246 -76.195 93.200 38.521 137.925 -74.226 93.179 39.357 137.765 -94.606 92.010 46.071 144.908 -41.268 91.538 42.231 142.377-133.257 92.433 63.258 142.950-124.160 93.017 0.000 129.409 -76.264 # 255 total E -2.28551E+02 rmsd from N 0.000 %NC 0.00 93.639 76.709 138.219-102.081 93.575 50.118 139.514-102.341 92.835 37.253 143.630-134.098 92.468 41.701 129.489 -76.206 92.361 41.328 140.369-149.175 91.631 37.111 138.786-148.825 92.331 41.987 129.385 -87.237 90.180 39.649 136.843 -84.020 91.724 41.876 145.044-112.126 95.052 37.549 137.952-140.937 95.250 125.425 147.579 -36.259 92.931 67.680 99.604-111.108 93.201 33.987 143.308-134.490 104.963 174.424 150.025 -30.230 93.826 85.411 144.305-132.625 93.904 32.873 132.503 -90.675 93.836 77.511 134.516 -93.192 93.760 -32.332 132.822 -88.516 112.034-115.991 139.732-101.029 92.036 66.866 143.430-133.350 95.253 83.750 0.000 0.000 120.098 27.553 160.062 168.331 92.279 39.798 140.792 -90.597 93.421 31.751 136.578-105.506 93.059 50.192 115.521 -75.734 92.697 33.374 146.210 -41.524 94.779 51.667 139.383-109.342 96.777 -32.321 145.157-128.612 121.759-166.224 152.563 -18.668 123.332 126.617 119.592-124.916 99.328 18.400 117.272 -76.969 95.201 48.959 137.943-104.714 93.705 31.517 116.237 -76.971 92.260 53.449 129.408 -76.098 91.054 39.365 142.331-132.718 94.810 30.276 145.888 -37.436 94.401 38.229 148.102 -37.883 92.456 40.714 129.327 -76.170 91.425 45.381 130.090 -84.559 91.980 37.923 128.974 -76.094 93.431 36.675 137.931 -82.133 93.780 38.648 137.028 -93.122 93.023 42.274 145.164 -40.760 92.495 42.633 142.953-137.131 92.496 61.465 142.981-124.740 93.037 0.000 129.404 -76.264 # 256 total E -2.27838E+02 rmsd from N 0.000 %NC 0.00 94.230 160.665 138.154 -99.062 93.310 52.301 139.335-101.800 91.525 42.194 143.250-133.249 92.361 39.513 129.459 -76.197 92.213 42.918 141.023-149.844 92.170 34.365 138.117-147.808 92.231 43.804 129.128 -86.447 88.866 44.012 138.427 -86.079 90.131 62.307 143.670 -43.875 89.775 75.442 135.211-139.969 91.771-161.448 146.709-104.165 93.036 60.201 100.523-111.589 92.062 54.494 142.958-133.292 92.609 93.778 146.920 -37.933 91.136 55.342 142.980-135.085 92.484 41.635 133.835 -91.213 92.375 57.321 132.720 -85.232 92.666 99.877 134.656 -91.937 91.571 49.229 137.585-124.183 94.687-134.565 144.312-134.986 139.519-123.902 0.000 0.000 118.208 79.980 157.643 179.454 92.295 46.953 140.710 -88.854 92.965 41.293 136.674-105.587 91.370 50.732 116.227 -76.045 91.170 43.540 148.804-114.070 94.132 57.261 139.408-109.863 94.806 -65.257 144.144-126.659 119.195-138.849 152.246 -19.175 122.297 120.799 120.730-126.936 94.729 30.058 116.587 -76.503 93.670 46.366 137.736-100.353 91.642 39.696 115.730 -76.374 92.085 42.023 129.355 -76.220 88.904 41.803 141.922-131.106 90.343 43.491 146.444-111.728 91.718 37.794 143.677 -42.000 92.507 37.737 129.363 -76.158 93.311 42.751 130.685 -86.976 93.176 33.557 129.322 -76.249 93.656 39.792 139.325 -78.456 93.369 39.115 137.321 -90.146 92.244 43.922 145.013 -41.076 92.290 42.319 142.667-137.743 92.468 62.437 143.063-124.627 93.021 0.000 129.414 -76.269 # 257 total E -2.27301E+02 rmsd from N 0.000 %NC 0.00 93.695 81.799 139.393-106.635 93.394 48.671 139.362-101.320 91.473 41.032 143.253-133.210 92.270 41.012 129.420 -76.193 92.025 44.091 141.121-142.012 93.031 32.553 138.145-148.382 93.451 41.874 130.738 -85.288 92.057 35.799 140.131 -87.340 91.010 49.121 151.293-129.329 91.559 49.426 138.578-140.799 92.194 38.218 148.933-118.000 93.084 63.468 101.330-113.476 92.360 132.647 141.782-133.993 111.960-106.692 152.707-127.568 93.931 45.407 143.774-135.642 93.417 39.293 133.434 -90.762 92.873 64.156 135.048 -92.806 92.994 82.555 136.965-104.839 91.553 50.510 139.060-115.664 112.240 -76.290 111.872 -83.334 122.644-155.805 0.000 0.000 122.004 23.808 158.540 172.922 90.512 44.550 141.639 -90.668 92.592 39.645 136.267-104.652 90.843 44.372 115.082 -76.182 90.523 44.926 146.899-108.966 93.307 50.552 139.877-106.573 91.345 28.691 142.510-123.740 112.020-117.352 111.081 -82.494 120.445 159.107 121.236-128.760 124.583 -86.878 121.839 -79.725 93.255 50.388 137.070-102.151 91.179 42.125 116.227 -76.038 92.530 41.958 129.291 -76.106 91.500 34.528 142.678-134.437 92.067 43.594 145.724 -39.503 91.838 36.472 143.613 -44.128 92.596 39.169 129.372 -76.183 93.089 40.879 130.077 -87.744 92.730 37.768 129.408 -76.291 92.994 38.497 138.598 -75.726 93.056 39.408 137.323 -90.864 91.978 46.346 144.894 -41.281 91.530 42.165 142.327-133.104 92.434 63.407 143.001-124.175 93.020 0.000 129.415 -76.274 # 258 total E -2.33210E+02 rmsd from N 0.000 %NC 0.00 93.921 153.150 135.350 -88.344 93.762 41.129 139.778-103.960 93.483 37.494 143.905-134.913 92.469 40.424 129.764 -76.486 93.251 44.245 147.951 -12.788 89.643 37.783 138.913-143.712 91.334 43.306 128.710 -87.329 88.116 44.730 138.738 -86.366 90.769 41.673 142.653 -42.212 92.627 53.894 137.948-143.704 93.870 63.327 146.867 -38.788 123.248-149.042 120.412-125.090 119.307 -68.617 112.518 -83.903 93.726 57.318 145.943 -39.271 93.429 37.133 143.691-135.412 92.863 53.458 136.558-100.472 92.162 46.088 135.114 -86.957 92.104 48.145 135.165 -92.001 91.805 52.765 139.138-108.795 96.738-112.484 144.479-130.439 94.229 127.478 0.000 0.000 92.657 44.017 134.832-123.710 91.565 42.243 140.519 -91.645 92.350 40.297 135.974-103.253 90.641 43.211 114.816 -75.936 91.698 49.692 148.766-116.080 93.150 40.811 139.821-103.809 91.977 48.665 142.851-124.458 94.517 179.363 143.863-126.052 92.876 65.338 99.881-114.704 91.169 47.474 116.041 -76.179 92.501 57.081 134.757 -86.074 91.457 41.006 115.786 -76.159 92.774 35.674 129.392 -76.185 93.383 36.734 143.561-134.145 91.637 42.820 148.103-122.753 91.027 39.188 144.499 -42.717 92.027 38.564 129.324 -76.139 92.434 41.391 129.865 -85.537 92.425 38.259 129.385 -76.283 92.763 40.331 137.685 -73.822 92.782 40.513 137.339 -90.216 91.571 48.209 145.034 -41.007 91.064 42.013 142.264-129.843 92.485 64.479 143.029-124.199 93.022 0.000 129.410 -76.266 # 259 total E -2.27095E+02 rmsd from N 0.000 %NC 0.00 93.545 37.924 135.812 -97.922 126.907-129.051 148.373 -75.166 91.889 76.412 143.422-133.289 92.694 108.336 129.599 -76.282 92.930 43.770 141.514-153.943 90.159 40.318 140.639-152.585 91.706 45.712 127.719 -96.245 88.708 38.917 137.166 -83.265 90.551 49.491 144.387 -42.215 89.468 40.169 135.941-139.607 91.901 47.660 146.689 -38.652 97.702 35.419 125.848-145.898 89.585 58.679 141.831-133.567 91.690 47.178 145.387-114.879 98.533 177.313 144.300-134.679 94.451 46.811 134.723 -93.343 93.670 38.611 133.652 -87.873 93.196 94.176 137.566-107.453 93.680 62.447 136.889 -96.801 92.915 34.140 143.782-134.408 95.413 40.672 0.000 0.000 95.043 36.874 135.480-115.916 94.652 38.204 140.131 -92.443 93.159 36.625 136.339-104.859 93.475 40.025 115.216 -76.597 92.782 48.618 149.383-123.888 93.717 77.517 139.423 -93.286 92.020 -41.539 142.682-124.341 117.645-105.796 152.293 -19.657 117.504 99.790 122.298-131.858 91.530 65.467 116.064 -76.192 92.855 83.834 135.449 -97.487 91.733 44.360 115.666 -75.579 93.047 35.525 129.431 -76.195 97.481 27.787 144.858-137.260 94.004 39.752 149.097-111.755 93.929 34.113 145.083 -43.401 93.257 35.500 129.418 -76.229 92.962 42.223 130.681 -85.789 92.455 40.112 129.165 -76.332 92.542 38.350 137.776 -72.257 92.795 39.447 137.383 -90.341 91.898 47.053 144.811 -41.388 91.315 41.915 142.321-131.336 92.493 63.682 143.031-124.293 93.025 0.000 129.412 -76.267 # 260 total E -2.29193E+02 rmsd from N 0.000 %NC 0.00 93.929 126.212 140.000-106.156 93.242 54.970 139.055-100.280 91.679 40.611 143.234-132.661 92.309 41.560 129.654 -76.335 91.086 43.205 142.245-155.574 90.396 38.842 138.475-148.606 91.800 47.969 128.219 -85.351 87.966 66.581 138.650 -82.452 89.570 44.896 145.579-113.985 91.288 51.750 139.201-139.177 93.978-178.806 146.008 -38.428 93.175 69.995 100.975-114.615 94.576 41.389 143.495-134.506 93.687 52.455 146.767 -37.735 91.961 50.314 112.573 -82.342 92.600 42.308 132.330 -92.876 93.523 33.979 130.912 -88.437 93.428 61.399 140.985-104.614 91.400 53.649 137.033-158.920 92.086 45.527 111.236 -82.909 93.984 103.663 0.000 0.000 121.284 170.100 156.704-177.239 114.616-101.694 139.853 -85.774 92.877 45.554 137.201-105.528 89.198 47.947 115.277 -75.914 90.555 49.577 143.630 -44.079 93.341 53.981 137.514 -96.864 93.486 100.770 109.374 -83.511 116.833-126.650 152.165 -20.079 92.815 70.424 100.029-114.500 91.804 41.172 116.076 -76.235 92.935 49.016 136.809 -83.889 91.513 38.181 115.899 -76.136 92.446 38.518 129.364 -76.179 89.691 45.454 142.234-131.632 90.706 39.978 140.962 -97.406 92.040 38.900 145.499 -41.073 92.380 37.564 129.346 -76.140 93.017 42.168 130.687 -83.975 92.789 35.711 129.452 -76.257 93.455 38.904 138.042 -73.715 93.531 37.074 137.262 -90.382 92.487 46.810 145.939 -39.931 91.447 41.644 142.578-132.535 92.457 63.869 143.025-124.170 93.021 0.000 129.408 -76.266 # 261 total E -2.29169E+02 rmsd from N 0.000 %NC 0.00 94.373 164.455 139.159-103.711 93.465 52.050 139.109-100.898 91.665 40.666 143.383-132.393 92.268 41.609 129.522 -76.279 91.125 43.925 141.418-150.757 91.528 34.151 138.263-147.956 92.513 44.013 133.680 -90.010 88.801 38.592 139.222 -86.303 89.707 51.694 146.955-113.098 91.611 49.824 137.082-139.697 92.483 38.588 145.893-103.890 93.961 38.801 100.405-114.826 94.986 81.340 142.568-133.447 92.612 -70.989 149.786-122.375 95.683 -54.429 143.832-136.290 117.973 -83.059 154.016-112.358 94.172 59.321 136.929 -84.844 93.700 78.150 137.716-103.157 113.773 6.869 139.071-130.294 114.606 -52.905 113.631 -83.398 95.385 177.516 0.000 0.000 124.972 -0.496 158.136-173.356 92.814 53.834 137.449 -90.401 93.338 36.940 136.613-105.777 93.459 40.208 115.575 -76.083 93.038 36.092 151.150-128.398 93.870 51.443 145.020-129.803 91.086 44.516 142.503-123.635 92.718 50.088 142.997-123.265 121.927 166.994 120.870-127.393 94.611 38.656 116.488 -76.516 93.715 41.860 137.465-103.536 90.296 59.632 117.011 -75.988 91.968 42.171 129.260 -76.166 87.799 41.077 141.830-130.745 90.754 47.691 144.778 -41.661 90.544 40.713 143.911 -43.087 91.802 37.735 129.288 -76.105 92.175 43.640 129.621 -87.972 92.325 39.757 129.254 -76.165 92.538 39.028 138.634 -74.694 92.683 39.103 137.392 -90.703 91.765 47.613 144.708 -41.543 91.245 41.645 142.294-130.385 92.515 63.876 143.010-124.462 93.023 0.000 129.401 -76.261 # 262 total E -2.27738E+02 rmsd from N 0.000 %NC 0.00 93.592 76.684 137.309 -98.455 93.683 49.267 139.535-103.478 93.012 38.052 143.690-134.251 92.591 40.601 129.489 -76.237 92.891 41.562 141.567-145.521 92.351 35.972 137.826-148.413 92.610 41.680 129.658 -86.503 90.361 45.619 139.978 -86.576 91.281 38.274 148.859-120.324 95.311 102.282 139.440-148.211 114.250-138.435 154.884 -23.917 118.609 22.482 122.042-130.478 93.139 53.073 143.484-134.190 91.465 55.447 144.169 -40.845 91.992 70.748 139.547-134.521 93.503 31.833 132.827 -92.835 94.645 54.527 133.350 -87.646 94.509 -10.154 137.607 -98.038 119.611-112.310 137.733 -92.433 94.863 1.177 150.221 -31.433 118.644-131.637 0.000 0.000 139.307 -64.996 111.086 -88.399 91.300 58.540 139.516 -87.242 92.698 58.663 135.404-106.762 91.095 93.938 115.807 -76.456 91.795 50.056 148.741-110.945 93.970 43.531 139.272-105.935 93.802 51.863 143.679-125.910 123.677 174.866 112.886 -82.450 93.538 50.794 99.889-114.141 92.627 42.006 116.236 -76.330 92.948 79.794 139.670-104.451 91.022 47.973 116.074 -76.128 92.294 36.865 129.362 -76.163 89.926 42.909 142.605-131.924 90.092 45.092 146.345-118.740 89.907 41.886 144.352 -42.395 91.322 39.026 129.275 -76.079 91.390 45.438 130.663 -84.924 92.067 38.023 129.072 -76.095 92.507 39.041 137.899 -81.495 92.674 46.460 137.164 -92.395 90.455 43.682 144.500-106.422 91.959 47.135 143.826-137.285 91.972 63.295 142.785-123.819 93.024 0.000 129.407 -76.264 # 263 total E -2.30683E+02 rmsd from N 0.000 %NC 0.00 93.627 34.055 137.406-105.760 93.469 53.836 139.268-102.352 92.480 41.653 143.568-133.888 92.506 37.973 129.482 -76.240 92.849 43.069 143.213-152.761 92.881 33.063 139.453-149.535 93.099 38.931 129.948 -87.343 89.793 42.448 139.086 -85.651 90.562 48.616 143.758 -43.716 90.098 49.674 136.550-140.067 92.941 59.723 147.473 -38.628 117.897 -2.961 122.262-130.895 91.677 141.411 143.170-134.005 113.199-135.098 154.081 -25.569 92.360 57.906 143.470-136.420 93.057 65.252 131.861 -90.101 93.111 80.514 131.116 -83.133 93.038 60.655 137.843-107.417 92.572 46.060 139.989-111.606 108.376 -91.759 150.946 -27.403 93.620 116.529 0.000 0.000 119.867 34.542 158.066 177.861 93.402 37.655 139.823 -91.596 93.708 35.303 136.878-105.991 92.654 44.022 115.324 -76.258 92.169 50.600 145.095 -42.169 93.023 53.510 139.781 -99.653 91.442 39.536 142.521-123.730 116.383-144.540 151.832 -20.020 120.726 123.942 121.249-128.622 93.625 36.842 116.270 -76.362 93.364 50.750 142.118-121.039 89.097 40.396 115.534 -75.828 91.968 43.074 129.312 -76.155 88.730 42.725 142.009-128.064 90.194 43.766 146.190-108.062 91.502 37.368 144.719 -41.539 92.326 36.971 129.348 -76.139 92.548 43.159 131.252 -91.977 92.346 39.112 129.273 -76.230 92.726 37.029 137.739 -75.732 92.850 41.486 137.240 -90.671 91.655 45.538 143.955 -42.805 91.623 42.578 142.393-133.902 92.403 63.392 142.982-124.117 93.022 0.000 129.417 -76.268 # 264 total E -2.33392E+02 rmsd from N 0.000 %NC 0.00 93.609 63.508 137.780-102.344 93.639 51.010 140.239-104.391 93.093 37.018 143.763-134.498 92.404 40.308 129.796 -76.542 93.137 43.341 141.919 -21.024 89.364 40.295 138.413-156.829 90.659 44.519 128.347 -87.211 86.949 46.343 138.546 -87.739 89.821 42.547 143.646 -42.709 90.687 56.678 139.129-140.786 92.543 67.452 145.975 -39.996 116.631 -64.683 122.775-132.483 121.572-100.414 112.636 -83.969 92.882 76.640 146.065 -38.878 91.465 54.351 142.993-133.654 92.994 47.247 133.481 -81.912 93.435 43.747 132.095 -93.466 93.650 119.662 137.482 -99.859 119.771 -97.849 141.580 -96.737 93.822 -12.352 143.573-133.400 113.358-105.266 0.000 0.000 146.059 -48.593 114.799 -91.871 96.960 34.981 140.909 -87.365 94.124 42.332 140.676-100.992 94.110 35.250 116.059 -76.826 94.011 141.031 151.634-133.373 93.830 49.995 141.384-115.107 91.705 54.159 142.781-124.279 92.846 60.027 143.144-123.082 119.340 157.531 122.117-130.722 94.395 39.749 116.531 -76.473 93.483 41.297 137.310-102.734 90.465 42.977 115.569 -76.561 91.637 50.012 129.333 -76.204 86.858 45.751 141.202-130.019 90.673 42.511 143.934 -40.354 92.331 35.622 144.260 -41.844 93.033 39.032 129.389 -76.171 93.699 39.796 130.319 -87.529 92.817 38.096 129.619 -76.454 92.940 38.441 138.362 -73.562 93.026 39.602 137.326 -90.449 91.942 46.176 144.881 -41.293 91.516 42.279 142.369-132.934 92.441 63.347 142.994-124.184 93.022 0.000 129.415 -76.271 # 265 total E -2.28509E+02 rmsd from N 0.000 %NC 0.00 93.640 77.385 138.145-101.857 93.593 48.990 139.249-102.458 92.926 37.800 143.643-134.156 92.494 41.002 129.506 -76.236 92.330 42.191 141.071-149.633 91.638 36.019 138.821-148.385 92.469 41.604 129.475 -87.198 90.010 39.823 138.531 -85.706 90.275 46.779 146.565-110.914 90.839 52.699 136.781-139.591 92.961 59.306 146.893 -39.240 118.504-137.412 121.965-130.314 93.320 94.140 143.579-135.725 93.217 119.861 145.693 -40.526 104.521-108.441 146.168-140.849 93.665 47.710 134.815 -91.196 93.599 60.609 133.387 -87.743 93.178 27.428 136.698-101.371 101.094-160.482 145.654-122.955 94.439 47.450 144.283-135.054 112.653-176.873 0.000 0.000 120.666 28.344 157.704 172.928 91.236 42.492 140.053 -89.020 92.685 41.098 136.417-104.842 91.162 43.538 115.146 -76.111 91.463 45.204 149.320-116.460 93.341 42.523 139.665-104.277 92.057 53.972 142.943-124.756 93.458 154.002 143.048-123.749 93.482 45.597 99.945-115.108 93.178 36.238 116.311 -76.384 92.936 54.371 137.785-102.543 90.758 47.089 114.970 -75.728 92.590 35.170 129.377 -76.176 94.475 32.679 143.965-135.451 93.690 40.202 145.710 -38.885 91.792 39.698 145.165 -42.988 91.975 38.252 129.313 -76.131 91.943 42.109 129.589 -86.906 92.114 42.236 129.433 -76.342 92.211 36.874 138.006 -75.646 92.116 43.100 137.253 -90.121 90.540 50.086 142.880 -44.674 91.069 44.374 141.218-133.291 91.934 67.762 142.727-124.024 93.024 0.000 129.402 -76.275 # 266 total E -2.29559E+02 rmsd from N 0.000 %NC 0.00 93.690 84.720 139.002-104.703 93.363 51.858 139.367-101.088 92.116 39.071 143.523-133.157 92.333 42.043 129.572 -76.248 91.730 41.335 139.485-150.003 90.945 37.119 137.921-148.125 91.887 47.726 131.925 -82.389 88.359 43.726 138.903 -84.658 92.004 34.865 144.885 -41.639 97.169 55.364 140.400-139.773 94.873 59.787 150.180-127.117 93.192 105.043 101.929-114.221 111.800 163.378 111.871 -84.659 93.017 56.805 148.719-119.739 91.876 45.970 143.123-134.006 93.396 89.158 134.695 -92.917 93.837 48.305 132.649 -78.439 93.443 33.562 137.452-102.542 94.109 59.264 139.957-109.899 133.798-169.485 112.927 -84.356 93.413 101.519 0.000 0.000 95.112 57.427 104.771 -79.786 91.578 45.667 142.238 -90.207 92.941 36.814 136.467-104.675 92.344 47.527 116.474 -75.968 91.321 44.804 148.355-112.268 93.733 32.701 141.574-115.075 93.013 59.348 143.383-125.337 95.055 66.385 143.924-124.867 121.447 143.191 121.502-128.364 93.420 37.089 116.317 -76.425 93.282 51.892 137.287-102.979 88.653 65.436 116.623 -75.606 91.781 43.204 129.312 -76.156 88.540 38.382 142.127-131.268 90.442 49.974 144.576 -40.033 89.937 42.819 143.627 -44.752 91.473 37.420 129.285 -76.094 91.560 43.647 129.391 -88.140 92.022 41.785 129.188 -76.140 92.439 38.502 137.857 -76.712 92.668 39.616 137.348 -90.848 91.841 46.999 144.771 -41.407 91.274 41.931 142.612-130.718 92.498 63.676 143.011-124.369 93.027 0.000 129.412 -76.270 # 267 total E -2.34931E+02 rmsd from N 0.000 %NC 0.00 93.915 152.364 135.294 -88.206 93.735 41.865 140.094-105.108 93.561 37.347 143.902-134.874 92.611 39.302 129.805 -76.638 92.432 42.239 134.830 -27.861 93.589 33.835 138.381-150.175 93.438 41.393 130.151 -87.207 91.587 36.764 138.841 -86.039 91.970 48.994 145.294 -40.253 91.206 49.603 138.301-140.891 93.348 55.548 146.865 -39.434 121.430 -24.711 120.712-126.863 94.280-159.551 144.529-136.957 112.300 24.655 153.248 -26.593 95.291 44.497 144.624-137.003 93.886 40.832 133.633 -91.020 93.518 47.154 135.223 -90.848 93.026 41.798 138.302 -90.485 94.023 38.021 141.309 -86.507 95.665 37.223 144.648-136.456 96.251 34.878 0.000 0.000 94.903 40.535 137.891-124.355 94.481 35.023 138.346 -92.364 93.569 39.886 136.450-105.217 92.593 41.591 115.352 -76.464 92.066 66.141 149.158-128.873 93.440 70.271 140.804-106.522 92.296 -20.745 142.886-124.604 122.784 155.587 152.586 -18.439 121.988 142.428 120.716-126.919 96.231 25.548 116.797 -76.688 94.024 57.845 137.520-104.009 91.611 98.487 116.262 -76.498 92.236 59.648 129.378 -76.178 90.017 39.249 142.624-132.326 91.549 46.604 146.025 -37.255 90.755 40.408 144.994 -41.180 91.808 38.496 129.293 -76.107 91.920 42.472 129.553 -87.887 92.097 41.186 129.226 -76.122 92.886 37.428 136.951 -74.842 93.301 38.646 137.260 -91.017 92.729 43.650 145.063 -40.772 92.630 40.939 143.024-133.867 92.740 62.388 143.145-126.390 93.019 0.000 129.412 -76.267 # 268 total E -2.28896E+02 rmsd from N 0.000 %NC 0.00 93.640 84.514 138.160-101.229 93.494 49.958 138.640 -94.300 94.226 36.350 144.102-135.295 92.941 37.796 129.518 -76.266 93.318 40.625 141.992-148.282 93.588 35.552 140.617-151.407 93.589 39.351 131.251 -85.415 92.818 34.012 139.950 -86.495 92.002 47.196 147.638-123.288 93.369 50.691 140.033-149.565 92.040 34.832 147.795-109.166 95.230 33.916 99.460-110.609 98.447 23.717 110.101 -82.956 111.081 178.856 152.834 -26.376 104.431 -88.335 147.079-148.862 94.487 54.715 134.274 -91.411 94.692 64.444 133.983 -87.724 94.298 -24.330 138.751-107.678 115.644-130.039 143.998-110.012 95.446 64.434 144.630-135.895 135.074-142.553 0.000 0.000 126.964 -2.100 158.950 173.213 91.645 53.898 140.231 -90.348 92.989 37.002 136.334-104.623 91.114 42.022 115.105 -75.703 91.392 58.777 151.066-130.991 92.721 57.913 139.266 -93.979 90.681 35.180 142.157-123.365 92.661 161.793 143.420-124.584 93.509 77.225 99.864-114.869 93.157 33.675 116.391 -76.358 93.706 44.009 137.396-102.126 92.041 40.459 115.676 -75.947 92.471 40.681 129.351 -76.168 91.780 35.245 142.878-133.198 93.136 40.495 145.800 -38.415 92.299 36.422 147.746-116.282 93.169 37.876 129.413 -76.203 94.098 36.276 130.486 -87.710 92.890 39.745 129.617 -76.440 92.963 37.905 138.125 -82.091 92.807 40.914 137.118 -91.575 91.465 48.348 144.701 -41.580 90.878 43.141 142.009-131.360 92.243 64.329 142.881-122.734 93.023 0.000 129.411 -76.263 # 269 total E -2.28367E+02 rmsd from N 0.000 %NC 0.00 93.704 66.226 139.459-109.649 93.589 72.054 140.018-101.971 92.933 37.451 143.683-133.926 92.262 44.116 129.734 -76.303 91.405 41.222 143.088-155.339 91.643 36.632 141.611-158.813 92.064 38.411 129.004 -87.605 86.986 51.290 138.097 -86.376 89.540 41.491 140.736 -50.267 92.128 55.704 138.996-139.942 94.205 68.129 146.905 -38.806 120.290 -33.705 121.633-128.780 94.331-156.084 144.184-137.812 93.472 54.737 146.407 -38.971 92.083 45.841 143.287-134.367 93.734 105.811 133.975 -84.579 96.435 155.767 132.377 -80.027 93.644-113.976 136.662-101.891 93.526 49.301 141.738 -94.682 95.606 50.712 144.640-136.678 97.266 25.549 0.000 0.000 95.523 49.323 143.859-132.119 89.704 42.054 140.800 -92.386 91.995 39.987 135.872-103.667 90.911 42.316 115.144 -76.095 90.767 42.033 146.728-114.062 93.245 62.527 140.442-107.689 92.052 78.314 109.399 -83.473 109.811-145.547 151.168 -20.922 93.326 67.315 99.824-114.179 94.295 33.826 116.491 -76.432 94.003 40.170 137.703-104.648 92.842 39.697 116.060 -76.331 92.660 41.117 129.338 -76.161 90.826 36.959 142.497-132.194 92.011 43.815 145.688 -39.206 90.519 40.280 147.581-117.888 92.184 37.425 129.343 -76.140 92.962 38.661 129.855 -88.430 92.614 39.071 129.298 -76.192 93.176 37.744 137.541 -83.917 93.110 40.211 137.037 -92.664 91.956 46.056 144.898 -41.262 91.532 42.348 142.508-133.342 92.424 63.093 143.047-124.149 93.037 0.000 129.441 -76.310 # 270 total E -2.32457E+02 rmsd from N 0.000 %NC 0.00 93.659 80.914 138.580-103.159 93.505 50.063 139.362-102.034 92.679 38.207 143.617-134.019 92.461 41.114 129.458 -76.198 91.967 42.020 140.459-150.578 91.341 37.129 138.720-148.843 92.091 41.744 128.954 -85.753 89.043 41.449 137.953 -85.925 90.066 46.238 145.311-110.318 91.233 52.292 136.866-139.650 92.986 58.266 146.569 -40.077 121.022 -70.266 120.622-127.008 93.714-174.781 143.860-135.185 109.537 85.401 152.127 -27.786 94.953 105.066 144.159-136.181 122.440-153.136 153.702-109.482 94.057 48.531 133.781 -89.065 92.998 56.701 137.663-100.499 92.288 48.493 130.046 -51.045 93.130 40.685 143.685-133.390 93.692 42.012 0.000 0.000 92.950 40.756 134.552-122.866 92.003 41.771 140.095 -91.947 92.480 38.651 136.223-101.056 92.115 40.141 115.219 -76.351 91.810 39.167 147.738-118.513 93.427 49.262 142.529-127.434 89.929 47.896 141.826-122.312 91.549 54.286 142.294-121.977 119.353 170.274 121.711-130.111 93.084 49.769 116.347 -76.350 93.423 41.881 137.425-102.879 91.677 41.537 116.247 -75.959 92.397 41.098 129.502 -76.252 90.582 38.478 142.451-132.744 91.308 44.813 145.483 -39.934 90.621 40.429 144.011 -43.221 92.108 38.543 129.177 -75.993 92.676 42.778 129.979 -88.251 92.975 34.824 129.323 -76.254 93.360 39.950 139.868 -78.732 93.093 38.442 137.529 -91.540 91.988 45.624 144.938 -41.206 91.658 42.290 142.396-133.413 92.427 62.875 142.995-123.945 93.022 0.000 129.410 -76.266 # 271 total E -2.32956E+02 rmsd from N 0.000 %NC 0.00 93.986 137.965 139.317-102.345 93.131 56.801 138.836-100.131 92.208 41.537 143.438-133.680 92.690 36.629 129.424 -76.131 93.645 40.379 141.078-147.374 91.881 36.591 137.478-160.719 91.278 41.733 129.007 -86.583 86.689 51.523 139.463 -86.944 88.843 42.178 141.157 -46.985 90.354 52.586 138.931-140.131 93.645 38.629 145.456 -39.311 93.304 43.376 101.264-111.649 91.284 57.987 141.062-130.419 92.055-119.513 145.373-115.480 92.844 109.406 143.454-134.958 96.773 173.804 132.705 -95.364 118.700 110.143 156.270-124.100 94.882-173.875 137.091-103.190 117.811-137.660 143.987-110.134 94.814 24.158 144.231-135.375 124.372-109.261 0.000 0.000 125.875-146.704 157.839 174.766 92.187 47.310 141.498 -90.127 93.076 38.322 136.797-105.147 91.038 42.890 115.496 -76.082 90.760 50.180 147.691-116.415 93.068 50.076 140.977 -99.389 91.080 45.944 142.388-123.755 93.905 46.185 143.535-124.153 121.675 176.580 121.445-128.348 93.009 53.489 116.333 -76.349 93.451 42.457 137.358-103.085 90.083 45.595 116.202 -76.040 91.773 45.529 129.339 -76.202 87.821 44.045 141.595-130.587 90.735 44.483 145.143 -39.697 90.614 40.747 144.391 -40.849 91.813 38.042 129.286 -76.097 92.021 43.062 129.670 -88.001 92.242 39.174 129.237 -76.177 92.768 38.583 137.291 -71.802 93.004 39.783 137.367 -90.443 91.969 45.975 144.892 -41.281 91.584 42.241 142.413-133.177 92.451 63.279 143.002-124.233 93.022 0.000 129.414 -76.268 # 272 total E -2.27014E+02 rmsd from N 0.000 %NC 0.00 93.865 129.306 138.602-100.206 93.270 51.785 139.297-104.267 92.088 43.778 143.414-133.634 92.655 34.360 129.426 -76.200 93.509 46.134 146.867-156.226 93.814 29.115 140.867-150.236 94.386 38.705 131.796 -85.071 94.388 34.125 139.396 -83.895 93.096 44.898 146.038 -43.098 93.888 50.878 141.289-140.332 91.826 41.303 148.306-113.939 123.900-121.695 118.877-122.938 96.739 -92.963 111.583 -82.531 92.947 46.892 147.877-113.930 96.700 61.970 144.639-137.435 97.075-166.930 134.359 -82.061 116.122 169.062 155.196 -94.861 94.380-169.318 135.613 -97.650 123.236-162.175 141.005-122.136 93.212 3.231 142.494-133.953 103.234 -66.797 0.000 0.000 126.543-158.004 158.069 174.097 91.683 48.933 144.126 -90.508 92.989 36.029 138.266-103.605 90.799 45.008 115.874 -75.893 89.869 44.034 145.590-114.418 92.898 48.563 140.484-102.350 90.510 47.106 142.110-123.115 92.079 43.158 142.579-122.369 119.116 159.885 121.518-129.948 93.461 45.731 116.400 -76.390 93.964 40.541 137.677-103.337 94.520 34.903 116.239 -76.073 92.986 40.987 129.441 -76.302 91.336 39.548 142.584-132.683 92.026 42.578 145.634 -40.037 92.466 35.670 144.253 -40.906 92.571 39.375 129.476 -76.238 93.163 42.890 130.295 -87.657 92.800 35.227 129.315 -76.207 93.207 40.354 139.290 -80.778 93.038 38.458 136.596 -87.639 92.036 46.696 144.990 -41.127 91.573 41.730 142.367-133.403 92.482 63.444 143.059-124.194 93.024 0.000 129.415 -76.269 # 273 total E -2.27041E+02 rmsd from N 0.000 %NC 0.00 93.681 75.750 138.910-105.071 93.457 55.315 140.420-103.515 92.257 36.427 143.508-133.689 92.272 44.202 129.490 -76.151 91.786 40.186 136.333-144.556 90.690 38.755 137.631-152.834 91.348 45.536 130.131 -84.767 88.283 41.205 138.826 -84.885 89.961 46.234 145.757-113.681 92.963 51.837 138.040-140.671 91.895 56.030 148.473-108.870 121.856-127.115 120.057-125.778 101.166-119.786 111.731 -83.052 118.440 83.459 159.158-145.047 96.198 95.623 150.547 -30.789 122.572-105.039 155.957-113.742 94.503 43.441 134.127 -88.645 93.074 49.317 136.608 -87.894 92.923 40.859 133.577-115.437 92.485 49.809 143.380-136.913 93.847 117.195 0.000 0.000 122.938 17.070 161.117 173.115 93.396 44.320 139.624 -90.217 93.881 36.180 136.545-106.147 93.997 41.919 115.643 -76.027 92.555 66.452 151.437-133.105 93.391 76.441 139.998 -99.158 91.838 -47.207 142.656-124.262 120.023 179.714 152.277 -19.058 121.652 132.354 120.133-126.382 95.664 30.577 116.723 -76.660 94.383 43.471 138.305-103.501 96.043 31.084 116.275 -76.441 93.714 36.339 129.542 -76.297 97.289 29.728 144.485-136.928 95.806 36.092 147.173 -37.120 93.892 35.753 146.479 -39.159 92.867 38.796 129.332 -76.146 93.381 44.957 130.756 -86.082 93.272 31.622 129.371 -76.270 93.955 41.341 142.098 -91.934 93.231 37.206 136.805 -90.540 92.136 46.276 145.017 -41.128 91.731 40.951 142.291-133.260 92.610 62.685 143.120-124.464 93.018 0.000 129.420 -76.268 # 274 total E -2.39043E+02 rmsd from N 0.000 %NC 0.00 93.639 103.775 136.927 -96.107 93.714 46.680 139.471-104.336 94.077 36.183 144.073-135.181 92.685 39.615 129.864 -76.644 92.586 41.542 139.985 -23.221 89.715 38.886 138.799-149.712 91.804 42.492 129.656 -85.861 89.951 37.257 140.845 -85.520 91.311 44.492 145.134 -41.789 92.953 52.923 137.100-140.271 92.613 44.112 149.587-116.914 92.989 42.551 101.015-114.733 93.384 83.840 141.809-131.807 115.691 -86.273 155.765-135.320 110.842 -97.926 149.383-147.774 94.269 72.317 134.480 -90.541 93.673 40.203 133.487 -88.163 92.969 86.738 136.801 -99.814 94.451 119.792 138.681-151.790 92.599 42.343 143.617-133.649 93.417 159.636 0.000 0.000 143.065 -69.039 110.569 -89.571 92.448 48.742 140.474 -88.920 93.716 32.684 134.706-102.054 93.154 41.812 115.514 -76.306 91.827 57.725 148.496-128.435 92.841 56.664 141.613 -92.668 90.335 40.523 142.007-123.095 93.912 44.203 143.666-124.396 121.323 164.768 121.460-128.441 92.892 50.384 116.285 -76.348 93.363 45.021 137.545-104.125 90.243 48.720 116.405 -75.640 91.844 40.544 129.267 -76.162 87.812 44.887 141.726-130.633 90.609 47.300 144.759 -41.440 90.890 39.801 143.456 -41.298 92.103 37.348 129.328 -76.121 92.871 43.208 129.960 -87.855 92.864 36.150 129.274 -76.192 93.054 39.328 139.171 -75.845 93.074 38.730 137.278 -90.866 92.009 46.579 144.919 -41.237 91.510 41.935 142.311-132.958 92.465 63.518 143.021-124.208 93.025 0.000 129.426 -76.277 # 275 total E -2.34194E+02 rmsd from N 0.000 %NC 0.00 93.593 66.705 137.585-100.856 93.760 45.067 138.734-109.800 91.194 48.189 143.142-132.950 92.266 50.774 129.456 -76.214 92.820 33.456 138.340-138.579 93.025 42.200 143.087-171.105 91.693 36.461 129.176 -86.802 89.627 42.417 138.349 -84.959 91.235 44.619 142.977 -45.156 91.465 52.677 138.108-141.791 92.565 52.861 146.721 -39.674 121.782-115.636 119.563-124.849 91.092 130.979 142.825-133.678 93.940 40.721 145.733 -41.121 94.071 41.356 146.200-135.917 93.363 40.692 133.661 -92.005 93.473 37.484 131.108 -87.215 93.364 66.750 141.003 -89.060 92.913 29.869 138.997-114.467 95.492 44.523 144.540-135.672 99.552 141.781 0.000 0.000 118.827 26.230 162.071 166.502 91.576 41.202 139.084 -88.082 93.267 41.430 136.556-105.575 91.968 41.130 115.271 -75.988 91.896 43.998 153.868-138.184 93.572 47.702 141.339-108.716 93.538 -0.236 143.630-125.783 114.231 151.399 111.314 -82.230 94.340 85.347 99.499-112.378 98.355 16.187 117.222 -76.905 95.580 45.584 138.348-104.383 95.993 30.121 116.057 -76.546 93.090 45.124 129.443 -76.259 94.121 29.887 143.401-134.630 94.324 38.547 147.859 -37.294 93.038 35.558 145.119 -40.965 92.425 42.330 129.330 -76.167 92.379 43.359 130.432 -80.115 92.894 35.614 129.244 -76.130 94.054 33.810 138.270 -84.977 94.147 39.917 136.835 -93.995 92.993 38.307 143.723 -42.839 93.786 43.927 142.130-143.779 92.400 59.562 142.825-124.857 93.013 0.000 129.418 -76.266 # 276 total E -2.29445E+02 rmsd from N 0.000 %NC 0.00 93.617 72.359 138.082-101.942 93.618 51.532 140.214-104.369 93.035 36.633 143.687-134.251 92.357 43.341 129.463 -76.199 91.480 42.327 138.555-147.212 90.251 40.314 136.880-148.713 91.484 45.854 128.957 -88.134 89.209 39.104 139.305 -85.624 90.395 53.675 151.590-119.778 89.583 59.627 137.370-140.331 92.611 176.847 144.881 -40.814 118.942 51.757 122.223-130.752 92.595 40.539 143.384-134.290 92.963 88.873 146.302 -38.922 92.083 60.838 142.539-132.774 92.445 36.571 133.151 -95.015 93.482 52.897 131.164 -87.053 93.654 4.009 132.939 -84.930 118.215 166.550 136.317 -88.263 97.216 32.418 145.127-137.217 96.383 57.130 0.000 0.000 93.440 49.538 138.345-127.090 92.082 35.965 138.215 -89.827 92.988 40.486 136.378-104.838 91.780 41.513 115.395 -76.291 92.605 47.327 146.753 -38.914 93.262 42.998 143.232-126.223 91.186 129.294 142.480-123.329 129.443 -67.923 114.314 -83.518 120.105-101.033 121.126-128.831 92.982 54.058 116.459 -76.356 93.239 39.694 137.207-102.479 90.211 43.005 116.243 -76.536 92.023 43.251 129.328 -76.180 88.078 43.184 141.629-130.840 90.265 46.452 144.716 -41.045 91.067 39.140 143.436 -41.598 92.409 37.878 129.337 -76.145 93.141 40.338 130.033 -88.207 92.686 39.279 129.460 -76.301 92.777 39.117 137.587 -69.691 93.000 38.394 137.447 -90.355 92.231 44.592 145.041 -41.034 92.077 41.669 142.465-132.427 92.594 62.584 143.107-125.606 93.008 0.000 129.419 -76.268 # 277 total E -2.32579E+02 rmsd from N 0.000 %NC 0.00 93.569 59.727 136.709 -98.872 93.562 54.004 139.042-101.711 94.741 41.682 144.216-135.798 93.403 30.882 129.830 -76.584 95.852 41.725 142.499 -18.327 92.549 36.388 137.049-156.099 91.483 43.285 129.378 -86.373 87.244 51.156 139.144 -87.355 89.666 49.530 142.091 -45.852 87.779 78.511 137.521-139.700 93.121-151.746 144.117 -42.787 92.318 58.390 100.574-112.766 90.084-152.181 142.104-131.003 120.664-112.649 156.498-145.805 112.437-119.393 148.959-149.346 93.902 81.606 134.024 -89.541 93.889 89.933 134.958 -88.497 92.864 73.127 137.096 -87.978 93.039 95.204 138.621-105.171 110.904 -59.516 149.451-146.567 94.558 75.949 0.000 0.000 94.398 46.091 105.224 -79.544 92.724 46.124 140.655 -88.763 93.726 32.252 136.483-105.495 93.534 43.367 116.445 -76.235 92.019 43.030 148.629-120.877 93.225 43.785 141.341 -95.955 92.172 44.830 142.958-124.705 94.771 32.173 143.942-124.866 122.647-169.892 121.409-127.578 91.404 61.658 116.097 -76.204 93.177 50.996 137.083-101.968 89.828 43.879 116.112 -75.727 92.182 44.208 129.209 -76.078 88.997 40.773 142.047-131.346 91.041 47.101 146.124 -39.110 90.624 41.394 145.054 -40.083 91.601 37.474 129.283 -76.095 92.136 43.951 129.723 -87.908 92.430 37.846 129.151 -76.086 92.844 38.941 137.757 -73.661 92.972 39.934 137.306 -90.574 91.874 46.598 144.834 -41.348 91.446 42.042 142.368-132.273 92.491 63.616 143.010-124.353 93.033 0.000 129.412 -76.265 # 278 total E -2.30302E+02 rmsd from N 0.000 %NC 0.00 93.606 63.795 137.739-102.001 93.683 42.179 136.386-102.491 92.533 44.059 143.551-134.142 92.505 42.083 129.802 -76.608 94.423 33.976 139.153 -23.877 93.543 40.423 143.992-168.046 92.428 36.826 129.411 -86.268 89.036 46.446 139.341 -86.684 90.272 49.595 141.328 -46.745 90.988 94.641 136.253-141.571 103.254-162.011 149.714 -32.759 92.742 60.004 100.795-113.183 92.725 31.041 142.860-132.956 92.428 72.884 144.938 -39.633 93.710 98.415 140.729-135.144 93.638 82.056 132.474 -92.972 95.865 -61.740 132.711 -89.899 93.679 103.229 136.854 -98.750 93.113 68.353 137.603 -92.561 93.152 36.762 144.278-138.103 92.688 45.158 0.000 0.000 92.814 86.321 135.998-124.932 91.659 42.670 139.337 -88.695 92.831 38.514 136.454-105.501 93.524 40.487 115.470 -76.062 93.097 39.990 150.587-124.559 93.482 46.281 140.363-101.940 91.798 68.122 142.773-124.253 93.427-110.240 143.144-123.987 120.973 -85.005 121.067-128.278 92.886 49.939 116.302 -76.457 92.892 37.236 137.092-102.260 88.533 50.437 115.338 -75.756 92.143 42.213 129.066 -76.201 88.831 39.883 142.087-133.189 90.827 47.933 145.270 -40.351 90.712 39.576 143.604 -43.647 92.032 39.402 129.283 -76.005 92.412 41.372 129.859 -88.608 92.619 37.454 129.298 -76.225 93.070 38.721 138.137 -75.850 93.100 39.555 137.352 -91.695 91.971 45.858 144.907 -41.261 91.576 42.393 142.453-133.499 92.420 63.139 142.987-124.015 93.022 0.000 129.414 -76.268 # 279 total E -2.32846E+02 rmsd from N 0.000 %NC 0.00 93.550 66.389 137.034 -98.838 93.722 53.741 140.818-108.869 93.009 35.128 143.667-134.150 92.343 43.633 129.476 -76.186 91.326 42.031 136.550-143.327 90.167 39.237 137.437-153.532 91.495 41.365 129.161 -87.555 88.782 40.182 138.119 -85.144 90.774 44.872 143.057 -42.776 91.071 50.883 136.685-140.287 93.733 36.070 146.788 -39.571 94.571 42.938 101.043-110.123 95.374 92.387 144.191-134.041 92.317 -72.138 150.335-125.479 93.978 113.739 143.827-135.370 95.940 145.584 135.387 -88.991 93.607 51.721 134.173 -87.984 93.286 125.996 137.565-102.719 116.095-129.177 127.235 -56.776 91.235 74.186 143.139-132.484 95.186 139.202 0.000 0.000 127.311 -77.366 160.607 170.726 92.779 50.570 142.017 -90.366 93.285 34.606 137.073-105.357 91.605 44.581 115.596 -76.387 90.237 49.478 146.960-118.661 93.258 41.340 138.611 -95.572 92.996 44.274 143.372-125.233 94.697 24.531 143.928-124.489 121.439-165.366 121.543-128.619 92.353 57.968 116.223 -76.356 93.382 60.207 136.852-103.546 90.893 63.271 116.152 -75.354 93.025 48.195 129.271 -76.116 98.802 16.966 145.323-138.090 96.325 44.700 148.395 -34.357 93.387 35.322 145.840 -40.088 92.534 39.922 129.366 -76.184 93.075 41.609 130.027 -87.955 93.152 34.884 129.356 -76.234 93.222 40.479 141.055 -82.673 92.838 37.862 136.744 -88.620 91.777 48.336 144.865 -41.308 91.191 41.275 141.845-130.640 92.534 63.990 143.017-124.369 93.012 0.000 129.408 -76.256 # 280 total E -2.28739E+02 rmsd from N 0.000 %NC 0.00 93.994 155.675 135.664 -90.161 93.762 39.307 137.800-103.530 93.008 39.678 143.831-134.743 92.352 46.097 129.801 -76.549 92.151 33.661 144.870 -25.204 91.883 41.921 126.840 -36.899 91.192 47.668 129.479 -86.529 87.394 49.124 138.641 -87.635 89.549 43.088 143.192 -96.325 91.555 56.564 138.282-137.412 94.034 169.588 146.300 -38.371 92.302 76.896 100.692-114.630 90.978 65.628 142.301-132.271 91.817 129.601 144.780 -42.183 94.978 64.438 144.031-138.529 93.428 28.263 133.128 -91.273 93.014 72.126 135.740 -89.495 92.970 67.543 132.957 -92.895 92.997 43.859 138.157 -90.832 92.881 42.589 143.932-135.797 92.715 44.412 0.000 0.000 92.746 55.690 140.621-128.892 91.668 32.604 137.545 -91.091 93.191 41.219 136.421-105.019 92.078 44.377 115.578 -76.007 92.352 43.895 146.195 -37.938 93.443 36.055 139.591-107.781 93.459 38.701 143.576-125.670 124.927 -73.452 113.385 -82.360 121.164 -89.658 120.954-127.950 94.766 133.912 116.707 -76.371 93.348 48.978 134.080 -97.090 92.556 112.722 115.581 -75.709 92.615 49.063 129.416 -76.227 93.551 31.656 143.678-134.792 93.207 44.007 146.521 -36.384 91.654 39.433 145.532 -41.181 91.998 38.396 129.312 -76.150 92.110 41.681 129.560 -87.890 92.271 40.586 129.258 -76.171 92.799 37.667 137.140 -72.808 93.166 39.254 137.342 -90.745 92.413 44.504 144.993 -41.026 92.194 41.562 142.670-133.757 92.614 62.549 143.073-125.440 93.017 0.000 129.412 -76.268 # 281 total E -2.28794E+02 rmsd from N 0.000 %NC 0.00 93.648 78.003 138.443-102.881 93.528 49.619 139.572-102.903 92.670 38.208 143.605-133.984 92.457 40.992 129.473 -76.211 92.346 41.849 141.253-147.511 91.732 36.672 137.886-150.078 91.945 43.167 129.248 -87.107 88.671 45.228 138.289 -85.217 90.634 41.642 145.529-109.376 93.195 54.196 139.355-140.843 94.013 66.449 147.015 -38.638 121.957-144.647 120.938-126.909 92.843 68.380 143.384-134.627 92.707 144.064 146.501 -39.729 96.259 77.962 144.290-140.818 93.802 29.533 133.480 -89.555 93.605 69.568 133.878 -73.514 93.582 134.314 137.924-114.960 116.288 -96.219 144.159-151.731 94.108 37.217 143.322-135.946 94.189 49.810 0.000 0.000 92.943 45.053 136.494-121.823 91.805 40.018 141.325 -91.244 92.897 34.115 135.555-102.155 92.355 42.697 115.256 -76.315 92.171 51.936 145.491 -41.554 93.107 66.682 139.022 -92.718 91.133 43.602 142.305-123.522 114.998-157.585 151.830 -19.780 92.999 65.268 99.854-114.393 91.424 44.285 116.088 -76.192 92.850 46.825 135.727 -91.091 94.042 34.942 115.917 -76.333 93.837 32.692 129.472 -76.251 98.867 28.149 145.173-138.179 95.141 37.717 147.121 -38.334 92.743 38.839 145.993 -40.510 92.037 39.195 129.299 -76.136 91.999 42.689 129.762 -87.562 92.313 38.757 129.252 -76.171 92.767 39.288 138.307 -76.872 92.824 39.571 137.285 -90.947 91.732 47.673 144.827 -41.398 91.260 41.696 142.105-130.973 92.517 64.052 143.028-124.463 93.022 0.000 129.412 -76.268 # 282 total E -2.27993E+02 rmsd from N 0.000 %NC 0.00 93.620 73.172 137.963-101.392 93.624 51.959 140.302-103.842 93.060 35.363 143.765-134.194 92.468 42.248 129.481 -76.215 92.206 40.647 140.224-145.469 92.548 37.840 140.270-156.469 92.468 39.439 129.605 -87.225 89.426 42.025 138.939 -86.374 90.379 53.734 148.741-130.247 90.686 50.839 138.234-134.361 92.184 63.174 148.211-116.607 117.882 -84.804 122.801-132.415 114.019-135.871 150.651-152.445 92.678 46.440 146.303-108.516 94.356 43.112 143.281-136.786 93.533 58.331 134.540 -89.843 95.693-167.394 130.339-102.112 94.717-168.826 138.528-105.555 122.866-104.447 133.693-130.977 95.203 -26.919 144.274-135.193 95.541 98.367 0.000 0.000 93.591 55.691 141.568-128.640 90.201 41.368 140.915 -92.217 92.386 38.087 136.075-103.992 91.375 42.851 115.181 -75.964 90.773 44.863 147.010-115.795 92.618 44.550 141.946-109.999 89.894 50.290 141.830-122.548 92.162 47.179 142.475-121.909 119.716 159.787 121.458-129.248 93.969 39.224 116.490 -76.440 94.093 39.334 137.700-103.649 93.671 37.379 116.426 -76.097 92.721 41.490 129.481 -76.303 91.060 37.119 142.502-132.557 91.725 42.964 145.620 -39.806 91.393 38.627 144.492 -42.555 92.140 38.697 129.352 -76.151 92.353 42.088 129.761 -87.929 92.311 39.359 129.265 -76.197 92.815 38.326 137.101 -72.825 93.042 40.179 137.336 -90.412 91.973 45.925 144.912 -41.244 91.587 42.321 142.496-133.575 92.443 63.305 143.037-124.113 93.020 0.000 129.417 -76.266 # 283 total E -2.36601E+02 rmsd from N 0.000 %NC 0.00 93.580 66.802 137.081 -98.984 93.837 55.256 142.742-114.656 92.597 34.093 143.632-134.033 92.048 47.155 129.463 -76.191 90.688 45.496 138.309-146.856 90.071 40.774 140.024-148.551 91.933 39.662 129.028 -88.323 89.487 42.857 138.817 -85.243 90.976 48.692 143.274 -44.873 92.403 86.873 136.559-140.338 95.944-163.385 147.758 -36.486 93.171 59.496 100.666-113.385 93.642 36.080 143.262-133.820 92.994 88.833 146.571 -38.657 92.636 56.031 142.903-140.162 92.623 37.353 132.851 -91.125 92.735 73.426 130.843 -86.422 93.336 79.252 131.972 -97.680 93.140 48.630 134.938 -57.612 93.451 40.026 144.080-135.995 93.300 43.066 0.000 0.000 92.841 52.369 139.977-131.357 89.897 37.576 137.835 -92.279 92.734 42.536 136.128-104.205 91.637 42.944 115.844 -75.853 91.065 45.066 150.104-118.279 93.268 40.474 139.530-106.275 92.839 80.915 143.293-125.076 94.053-100.842 143.826-124.025 120.154 -91.336 121.197-128.942 92.678 51.482 116.305 -76.329 93.161 39.439 137.211-102.484 90.026 43.269 115.639 -75.839 92.301 43.579 129.245 -76.177 90.633 36.134 142.387-132.524 92.057 42.123 145.744 -39.041 91.327 38.249 144.444 -43.885 92.102 40.553 129.364 -76.209 91.694 42.893 129.760 -88.191 91.669 44.388 129.185 -76.146 92.998 37.198 135.746 -84.173 93.149 39.065 137.397 -94.635 92.410 44.526 145.041 -40.976 92.124 40.990 142.428-131.333 92.782 62.653 143.032-126.748 93.018 0.000 129.405 -76.262