NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9658 8.3549 109.7373 45.3925 0.0000 172.6634 2 L 4.2500 7.9664 118.6931 51.2747 42.8734 176.1615 3 S 4.4365 9.7078 118.9987 58.0286 65.9796 174.8939 4 D 4.6652 8.8500 122.3563 57.8118 40.5679 179.4548 5 G 3.6870 8.1304 105.4361 47.8617 0.0000 175.4616 6 E 3.9030 8.0398 120.8705 58.9231 29.4355 179.1692 7 W 4.6049 8.1151 119.1803 60.1445 29.0488 178.3144 8 Q 4.0686 8.3354 119.2001 59.2464 28.4309 178.2851 9 Q 4.0160 8.1842 119.0193 58.9949 28.7835 178.7288 10 V 3.7050 8.1324 119.5278 66.4890 31.4316 178.1717 11 L 4.2194 8.5532 118.4701 57.2695 41.1793 179.1345 12 N 4.3213 8.2554 117.0914 56.6812 39.2272 176.4883 13 V 3.7160 8.0691 119.8897 66.0840 31.5461 177.7730 14 W 4.1245 8.6721 127.9711 60.2760 30.2397 177.8580 15 G 3.7719 7.8188 105.1070 47.8312 0.0000 175.4681 16 K 3.9788 7.9805 120.5098 59.2835 32.1409 179.5648 17 V 2.6973 6.9614 117.9003 65.7145 31.0651 177.6893 18 E 3.8752 7.5915 116.6046 58.6255 29.3226 178.7427 19 A 4.2045 7.2672 119.8357 54.0382 19.9838 177.6068 20 D 4.6404 7.7127 116.3209 52.0401 42.6937 175.1557 21 I 3.5783 7.9720 123.5477 63.6240 38.5516 176.6179 22 A 4.1532 7.4332 122.5694 54.4650 18.2470 179.6883 23 G 3.8402 8.1374 105.4495 47.8434 0.0000 175.6797 24 H 4.1289 8.3804 119.3900 58.2176 28.6697 178.1720 25 G 3.5448 8.3535 107.8612 47.7751 0.0000 175.2767 26 Q 3.8135 8.4354 122.9128 58.9815 28.9821 178.4492 27 E 3.8540 8.0317 119.3579 59.2150 29.3592 179.4586 28 V 3.5082 7.7701 118.2024 66.0984 31.5171 178.1525 29 L 3.3714 7.5815 118.4973 57.4965 41.3595 179.5226 30 I 3.5243 7.6922 120.0846 64.2482 37.0552 178.2848 31 R 3.7837 8.0933 119.8252 59.3321 29.8863 178.1325 32 L 3.9367 7.8330 120.0696 58.4125 41.8362 179.0879 33 F 4.5963 8.0109 118.1294 60.6424 38.5853 177.7836 34 T 4.1107 7.9571 108.8461 64.4854 69.0069 177.0020 35 G 3.6488 7.9670 107.4566 46.1502 0.0000 173.6796 36 H 4.7232 8.0239 117.7143 52.2244 29.6411 171.9498 37 P 4.4924 0.0000 0.0000 64.3711 30.9205 177.3841 38 E 4.0529 8.3396 116.6191 59.6550 29.1092 179.3022 39 T 3.8751 8.0117 111.0107 64.5331 68.9498 176.2292 40 L 3.4405 7.7592 122.9258 58.0073 41.7439 178.8142 41 E 4.1231 7.7792 116.0024 58.6869 29.4406 178.7588 42 K 4.4826 8.2793 117.4913 56.8467 32.6943 176.7517 43 F 4.6318 8.2300 119.0341 55.3924 39.0998 175.7252 44 D 4.3896 8.7543 126.9164 57.1256 40.7198 178.3108 45 K 4.1876 7.7894 114.7436 57.4574 33.1173 176.9108 46 F 5.0854 7.8162 117.8481 57.2746 40.5973 177.1235 47 K 4.0182 8.0962 119.3824 59.0485 32.7374 177.9152 48 H 4.1965 8.2359 114.6465 57.8898 28.5042 175.2517 49 L 4.0755 7.5564 120.6821 54.5185 40.8866 176.6709 50 K 4.2951 9.3705 124.8326 57.4391 33.0675 177.7255 51 T 4.7377 7.4928 107.9778 58.8433 73.2645 174.1654 52 E 3.9226 8.7363 121.5760 59.3078 29.5847 179.0106 53 A 3.9635 7.9033 120.4717 55.1135 18.3326 179.1847 54 E 3.9066 7.8912 115.8408 59.7775 29.8329 179.1604 55 M 4.1333 7.9396 118.5908 58.4879 31.8827 178.7352 56 K 3.8702 8.3416 118.1803 59.0056 32.3989 177.6044 57 A 4.5848 7.6430 118.0578 51.0736 19.2482 176.8304 58 S 4.3757 7.6275 114.2594 57.4356 62.5618 174.6904 59 E 4.0727 8.7944 128.7996 59.2775 29.2570 178.6680 60 D 4.4509 8.1507 117.9729 57.1062 41.3272 177.7321 61 L 3.5470 8.2390 121.0559 57.8964 41.9337 179.2146 62 K 3.9046 7.8730 118.4111 59.1622 31.9968 178.9780 63 K 3.8819 8.1957 119.9844 60.1513 32.0341 178.2999 64 H 4.4281 8.7837 118.5025 59.0145 29.8048 177.2758 65 G 3.6438 8.4199 108.0294 48.0736 0.0000 175.7178 66 T 3.8792 8.0942 118.0148 66.3491 68.5160 176.6837 67 V 3.6981 7.7369 120.0890 66.0549 31.5337 178.1428 68 V 3.6212 7.9460 117.8618 66.2897 31.4723 178.1020 69 L 4.3258 8.0961 118.4468 57.7944 41.4186 179.6913 70 T 4.0149 8.1913 115.9368 66.4854 68.4859 176.4967 71 A 3.9983 8.1063 122.7214 55.1358 18.3841 179.4802 72 L 3.7143 8.0869 119.0123 57.9523 42.1330 179.3325 73 G 2.9883 8.5796 106.2712 47.4560 0.0000 175.5886 74 G 3.7304 7.8117 107.2050 47.6561 0.0000 175.4430 75 I 3.8235 7.4415 121.9179 64.1155 37.1828 178.6251 76 L 3.9534 7.6632 119.8286 57.5906 41.1511 179.5062 77 K 3.9870 7.6216 116.8618 58.2515 32.2718 178.6949 78 K 3.9389 7.9356 118.4442 55.9986 32.7249 176.4997 79 K 2.0000 8.1918 118.2187 56.3753 29.6679 175.7339 80 G 3.9389 7.7796 105.9405 45.8877 0.0000 173.5836 81 H 4.5504 7.3209 119.0172 55.5025 27.6290 174.9871 82 H 5.1140 7.3421 110.8593 54.0783 29.9060 175.6676 83 E 3.9221 8.6315 122.2528 60.2550 28.9933 178.8676 84 A 4.0321 7.9236 118.3618 54.9377 18.4891 178.9181 85 E 4.1295 8.0700 116.8429 59.1262 29.7252 178.9039 86 L 3.9825 8.4739 120.7994 57.8221 42.1921 178.3570 87 K 3.8226 8.1397 120.0451 59.3913 31.9606 176.6656 88 P 4.3061 0.0000 0.0000 65.8100 30.9999 178.2928 89 L 4.0194 7.5112 115.4261 57.5425 41.6178 178.9445 90 A 4.1167 8.1928 120.9596 55.6619 18.2281 179.8016 91 Q 3.8928 8.5086 116.8977 59.1079 28.7351 179.1667 92 S 4.0711 8.4249 115.5778 61.5868 63.0116 176.2785 93 H 4.1387 8.7254 120.1011 58.2984 27.8926 177.6483 94 A 2.5800 7.7467 122.5810 54.8761 17.9513 179.8538 95 T 3.6526 7.5388 112.9941 65.8436 68.7484 176.3293 96 K 4.0260 7.4405 119.8794 59.0137 32.6696 177.2807 97 H 4.3487 7.8565 113.6430 55.8264 29.5259 175.3492 98 K 3.6997 7.4079 116.8129 56.3182 28.8883 176.1350 99 I 4.3139 7.8448 118.9729 58.9010 38.4132 175.1155 100 P 4.5535 0.0000 0.0000 62.1116 32.0842 177.4426 101 I 3.5329 8.6540 120.9368 64.2060 37.6563 177.8601 102 K 3.5563 8.0825 119.8939 60.0742 31.7107 178.0058 103 Y 4.0385 7.9238 116.6163 60.8391 37.7455 178.1880 104 L 4.1480 7.8926 119.7233 57.5222 41.7443 178.8265 105 E 3.9126 8.0158 119.3673 59.3927 29.5660 178.6484 106 F 4.4908 8.0395 117.9763 61.1081 39.0621 177.6737 107 I 3.9072 8.1487 117.7296 63.7341 37.8038 178.0686 108 S 4.2359 8.2433 116.4425 61.7448 62.6551 176.2605 109 D 4.4433 8.3326 121.2602 57.3752 40.5772 178.6736 110 A 4.0315 8.2966 121.2456 55.2169 18.2811 179.6458 111 I 3.6396 7.9402 118.1555 64.6353 37.2872 178.4962 112 I 3.8576 7.7326 120.3545 64.7919 36.9443 177.7575 113 H 4.0969 8.4714 118.8704 59.4844 29.7339 177.1838 114 V 3.5258 8.2516 120.2520 66.0816 31.2689 177.9104 115 L 3.8292 8.1472 118.8337 58.1306 41.1359 179.2760 116 H 4.3562 7.9252 114.7956 58.8713 28.7034 177.5874 117 S 4.1756 7.9322 114.1759 61.3824 62.3680 176.1137 118 K 4.0318 8.2518 119.9701 58.1256 33.0295 176.8907 119 H 4.9570 8.1255 115.9764 53.7755 29.3166 171.9933 120 P 4.5207 0.0000 0.0000 64.1159 31.9067 177.5443 121 G 3.9767 9.1372 110.7626 45.7031 0.0000 172.9413 122 D 4.9712 8.3495 117.8870 53.6967 41.5426 176.2185 123 F 4.9865 7.8880 119.8713 55.2210 39.4759 174.6580 124 G 3.8683 8.0498 112.8947 43.0332 0.0000 170.8583 125 A 3.8795 8.3427 121.6396 54.9565 18.1862 179.5736 126 D 4.2083 7.9770 116.8830 56.6605 39.4605 178.4936 127 A 3.9759 7.8462 122.1413 54.6388 18.3416 179.1970 128 Q 3.5182 7.8551 118.4348 58.9336 29.0637 178.3720 129 G 3.6769 7.9682 106.5357 47.9254 0.0000 175.3119 130 A 3.8443 8.0976 123.8534 54.8500 18.4804 179.3255 131 M 4.0298 8.2696 116.7946 59.0494 32.2260 178.3879 132 T 3.9021 8.1608 115.9581 66.6815 68.6802 176.3473 133 K 3.7748 7.9508 119.9614 59.6464 32.1296 178.9932 134 A 3.8595 7.8636 120.5826 55.3360 18.1736 179.7505 135 L 4.1204 8.1296 117.3461 57.9261 41.7211 179.5739 136 E 4.0027 8.6182 119.0373 58.9953 29.3127 179.0831 137 L 3.9657 8.1518 120.6312 58.1064 42.2109 178.4774 138 F 4.1854 8.3981 120.5336 61.6246 39.2363 176.9838 139 R 3.5300 8.3907 118.2203 59.4194 29.8981 178.0838 140 N 4.2642 8.6358 117.1953 56.6928 38.7158 176.6853 141 D 4.3792 8.2790 120.5291 57.1215 40.8107 178.8031 142 I 3.5116 7.4881 120.2281 64.2071 36.9562 178.2061 143 A 3.6937 8.0523 121.7454 54.9940 18.2059 179.4344 144 A 3.9362 7.9827 119.2181 55.4455 18.5807 180.0931 145 K 4.0418 7.8554 116.8114 59.6465 31.9865 179.2976 146 Y 4.2030 8.4298 117.4721 60.9913 37.7538 178.3481 147 K 3.9246 8.4573 120.8109 59.4791 32.0377 178.1176 148 E 3.9337 7.8923 118.1998 59.4714 29.6774 178.3954 149 L 4.3080 7.8295 115.2350 54.4424 41.9193 177.1921 150 G 3.9213 7.9574 107.0890 46.3231 0.0000 173.3282 151 F 4.5179 8.3521 121.7976 56.7717 40.3403 175.5642 152 Q 3.8599 7.3674 125.1045 55.8639 29.0425 175.3263 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 G 8.35 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 L 7.97 4.25 0.00 0.45 0.64 0.52 -0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.71 4.44 0.00 4.02 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.85 4.67 0.00 2.77 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.13 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.04 3.90 0.00 2.05 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 7 W 8.12 4.60 0.00 3.51 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.34 4.07 0.00 2.22 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 9 Q 8.18 4.02 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.51 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 10 V 8.13 3.71 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.88 0.00 0.00 11 L 8.55 4.22 0.00 1.81 1.79 0.91 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.26 4.32 0.00 2.85 3.03 0.00 0.00 7.11 8.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.07 3.72 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.18 0.00 0.00 14 W 8.67 4.12 0.00 3.62 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.82 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.98 3.98 0.00 1.59 1.45 0.00 1.50 0.00 0.00 1.15 0.00 0.00 3.14 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.30 1.37 7.81 17 V 6.96 2.70 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.13 0.00 0.00 18 E 7.59 3.88 0.00 1.88 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.16 0.00 19 A 7.27 4.20 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.71 4.64 0.00 2.73 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.97 3.58 1.79 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.27 0.89 0.00 0.00 22 A 7.43 4.15 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.14 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.38 4.13 0.00 3.14 3.21 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.35 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.44 3.81 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.74 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 27 E 8.03 3.85 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 28 V 7.77 3.51 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.94 0.00 0.00 29 L 7.58 3.37 0.00 1.44 0.68 0.80 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.69 3.52 1.76 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.92 0.86 0.00 0.00 31 R 8.09 3.78 0.00 1.90 2.09 0.00 3.02 0.00 0.00 2.94 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 32 L 7.83 3.94 0.00 1.77 1.46 1.08 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.01 4.60 0.00 3.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 7.96 4.11 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 35 G 7.97 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 H 8.02 4.72 0.00 2.99 3.01 0.00 5.63 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.49 0.00 2.15 2.09 0.00 3.84 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 38 E 8.34 4.05 0.00 2.30 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.56 0.00 39 T 8.01 3.88 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 40 L 7.76 3.44 0.00 1.46 1.77 -0.19 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.78 4.12 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 42 K 8.28 4.48 0.00 1.95 1.80 0.00 1.94 0.00 0.00 1.81 0.00 0.00 3.24 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.78 2.03 7.81 43 F 8.23 4.63 0.00 3.25 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.75 4.39 0.00 2.63 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.79 4.19 0.00 1.61 1.72 0.00 1.36 0.00 0.00 1.48 0.00 0.00 2.60 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.77 0.21 7.81 46 F 7.82 5.09 0.00 2.81 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.10 4.02 0.00 1.86 1.95 0.00 1.60 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.71 1.45 7.81 48 H 8.24 4.20 0.00 3.30 3.50 0.00 5.53 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.56 4.08 0.00 1.60 1.60 0.82 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.37 4.30 0.00 1.88 1.85 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.58 1.51 7.81 51 T 7.49 4.74 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 52 E 8.74 3.92 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 53 A 7.90 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 7.89 3.91 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 55 M 7.94 4.13 0.00 2.05 2.26 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.55 0.00 56 K 8.34 3.87 0.00 1.77 1.96 0.00 1.62 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.48 7.81 57 A 7.64 4.58 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.63 4.38 0.00 4.02 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.79 4.07 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 60 D 8.15 4.45 0.00 2.91 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.24 3.55 0.00 1.23 1.62 0.72 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.87 3.90 0.00 1.97 1.84 0.00 1.71 0.00 0.00 1.54 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.42 7.81 63 K 8.20 3.88 0.00 2.02 2.15 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.52 7.81 64 H 8.78 4.43 0.00 3.69 3.62 0.00 5.85 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.42 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 T 8.09 3.88 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 67 V 7.74 3.70 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.99 0.00 0.00 68 V 7.95 3.62 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.03 0.00 0.00 69 L 8.10 4.33 0.00 1.80 1.84 0.80 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.19 4.01 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 71 A 8.11 4.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.09 3.71 0.00 1.63 1.80 -0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.58 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.81 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.44 3.82 1.82 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.89 0.91 0.00 0.00 76 L 7.66 3.95 0.00 1.13 1.55 -0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.62 3.99 0.00 1.82 1.77 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.38 7.81 78 K 7.94 3.94 0.00 1.85 1.80 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.58 1.68 7.81 79 K 8.19 2.00 0.00 1.11 0.74 0.00 1.44 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.55 1.02 7.81 80 G 7.78 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 7.32 4.55 0.00 3.17 3.22 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.34 5.11 0.00 3.27 3.42 0.00 5.67 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.63 3.92 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 84 A 7.92 4.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.07 4.13 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 86 L 8.47 3.98 0.00 1.72 1.73 0.71 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.14 3.82 0.00 2.01 1.83 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.49 7.81 88 P 0.00 4.31 0.00 2.33 2.31 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.15 0.00 89 L 7.51 4.02 0.00 2.02 1.80 1.07 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.19 4.12 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.51 3.89 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 92 S 8.42 4.07 0.00 3.91 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.73 4.14 0.00 3.45 3.55 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.75 2.58 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.54 3.65 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 96 K 7.44 4.03 0.00 1.51 1.50 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.26 1.34 7.81 97 H 7.86 4.35 0.00 3.03 3.15 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.41 3.70 0.00 1.94 2.00 0.00 1.82 0.00 0.00 1.50 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.37 7.81 99 I 7.84 4.31 2.08 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.98 1.18 0.00 0.00 100 P 0.00 4.55 0.00 1.73 1.72 0.00 2.20 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.75 0.00 101 I 8.65 3.53 1.77 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.05 0.85 0.00 0.00 102 K 8.08 3.56 0.00 1.75 1.64 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.19 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.19 0.65 7.81 103 Y 7.92 4.04 0.00 3.21 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.89 4.15 0.00 1.77 1.70 0.74 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.02 3.91 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 106 F 8.04 4.49 0.00 3.30 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.15 3.91 2.05 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.41 1.14 0.00 0.00 108 S 8.24 4.24 0.00 4.17 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.33 4.44 0.00 3.02 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 A 8.30 4.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.94 3.64 2.10 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.88 1.00 0.00 0.00 112 I 7.73 3.86 2.15 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.33 1.16 0.00 0.00 113 H 8.47 4.10 0.00 3.31 3.51 0.00 5.80 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.25 3.53 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.96 0.00 0.00 115 L 8.15 3.83 0.00 1.32 0.49 0.49 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.93 4.36 0.00 3.36 3.39 0.00 5.66 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.93 4.18 0.00 3.75 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.25 4.03 0.00 1.50 1.45 0.00 1.45 0.00 0.00 1.24 0.00 0.00 2.62 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.27 1.30 7.81 119 H 8.13 4.96 0.00 3.21 3.18 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.52 0.00 2.19 2.08 0.00 3.87 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 121 G 9.14 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.35 4.97 0.00 2.63 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 F 7.89 4.99 0.00 2.78 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 8.05 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.34 3.88 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 7.98 4.21 0.00 3.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.85 3.98 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 7.86 3.52 0.00 1.26 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 129 G 7.97 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.10 3.84 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 M 8.27 4.03 0.00 2.46 2.32 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.82 0.00 132 T 8.16 3.90 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 133 K 7.95 3.77 0.00 1.82 1.66 0.00 1.58 0.00 0.00 1.49 0.00 0.00 2.78 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.40 7.81 134 A 7.86 3.86 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.13 4.12 0.00 1.94 1.83 1.02 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.62 4.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 137 L 8.15 3.97 0.00 1.90 2.00 0.99 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.40 4.19 0.00 3.16 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 8.39 3.53 0.00 2.09 2.01 0.00 3.14 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.50 0.00 140 N 8.64 4.26 0.00 2.94 2.78 0.00 0.00 7.25 8.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.28 4.38 0.00 2.78 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 I 7.49 3.51 1.45 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.17 0.21 0.00 0.00 143 A 8.05 3.69 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.98 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 K 7.86 4.04 0.00 1.99 1.94 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.67 1.63 7.81 146 Y 8.43 4.20 0.00 3.14 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.46 3.92 0.00 1.85 1.99 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.47 7.81 148 E 7.89 3.93 0.00 2.27 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 149 L 7.83 4.31 0.00 1.82 1.67 0.80 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.96 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 F 8.35 4.52 0.00 2.74 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 7.37 3.86 0.00 1.73 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.42 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00