NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7532 8.3501 109.7350 44.3417 0.0000 174.2052 2 A 3.9526 7.9170 126.6490 52.5075 16.7464 177.2798 3 L 4.2692 7.6873 115.1867 56.0963 38.9437 172.8776 4 T 4.2265 8.7835 113.3144 60.8058 71.4001 175.3496 5 E 3.9027 8.6256 121.6784 59.3148 29.6230 178.9597 6 S 4.1854 7.9835 114.1079 61.3859 63.3393 176.3437 7 Q 3.9784 8.2748 121.6012 58.6148 28.4043 178.5393 8 A 3.9643 8.2970 121.9067 54.9411 18.4418 179.5557 9 A 4.0132 7.8670 119.2879 55.1893 18.4777 179.8886 10 L 4.0003 7.8384 117.5929 57.9970 41.6143 179.8971 11 V 3.6280 7.9275 118.2591 65.6480 31.3959 178.0892 12 K 4.2018 8.3649 119.5551 59.5874 32.1501 178.6193 13 S 4.2028 8.1412 113.6238 61.6630 62.3526 176.4288 14 S 4.3983 8.3604 116.4169 60.9853 62.8161 176.1505 15 W 4.5002 8.9113 132.6969 60.2554 30.1324 177.9525 16 E 3.4064 8.2599 118.0441 59.1463 28.7617 178.4849 17 E 4.0249 8.1178 118.6455 59.5470 29.4576 179.2998 18 F 3.8855 8.1018 120.3520 61.1776 39.2120 176.2429 19 N 4.0852 7.4105 113.5571 54.7845 38.8169 176.0684 20 A 4.0139 7.1180 121.0638 54.2809 19.9735 177.2924 21 N 4.7089 7.7551 115.9945 50.8664 39.7330 174.4639 22 I 3.2542 7.5238 124.7558 64.1700 37.2483 176.4103 23 P 4.1861 0.0000 0.0000 65.1137 31.1207 178.5884 24 K 3.9002 7.6562 118.2489 59.8694 32.3495 178.5662 25 H 4.2725 8.1820 117.0605 58.9156 28.3997 178.0237 26 T 4.1868 8.0695 111.9451 64.9199 68.7436 176.2921 27 H 4.4859 8.1160 120.1436 58.6602 29.8127 177.2599 28 R 3.8548 8.1860 120.7712 59.2955 29.9317 177.8111 29 F 4.1337 8.4250 120.5440 61.8874 39.3893 177.3008 30 F 3.8452 7.9180 116.4930 60.2899 38.5131 177.9394 31 I 3.6788 7.7843 119.6414 64.3820 36.5920 178.4740 32 L 3.9104 8.0827 120.0715 57.3436 41.3557 179.4370 33 V 3.4435 7.6691 118.8765 66.2369 31.2274 178.2243 34 L 4.2733 7.7112 117.2956 57.4066 41.4787 179.1182 35 E 4.0901 8.1434 118.6123 59.3573 29.4465 178.8382 36 I 4.2237 7.3335 118.0483 62.8278 38.3849 176.3251 37 A 4.5246 8.1569 122.4641 49.2383 20.4985 174.2439 38 P 4.2402 0.0000 0.0000 66.2725 31.5894 177.8154 39 A 4.0736 8.1925 118.3382 54.9534 18.3278 178.9080 40 A 4.1224 8.1379 118.7305 54.1605 18.4797 179.4980 41 K 4.0444 8.0777 118.9795 59.5281 32.0890 178.4179 42 D 4.4510 7.5529 117.4990 57.1615 40.7169 178.5143 43 L 3.9865 7.6475 118.5240 55.6475 42.0462 177.1231 44 F 4.3264 7.5224 118.2724 55.3646 40.0292 177.1192 45 S 4.1423 8.3113 120.6791 60.9906 62.9671 175.1005 46 F 4.5598 7.4658 113.1343 57.2152 38.5940 175.8393 47 L 4.3816 8.0183 122.0194 55.8748 42.5983 176.9595 48 K 4.1248 7.8407 118.2747 58.0976 32.1691 175.9122 49 G 4.0692 9.0064 112.4629 45.7632 0.0000 173.7097 50 T 4.1126 7.2348 108.2175 61.8009 69.5160 173.8216 51 S 4.4952 8.5970 115.3335 59.2545 63.6138 173.8659 52 E 4.6506 7.6645 116.9487 53.8508 31.8095 175.7636 53 V 3.6390 8.2435 121.0827 62.0911 31.5012 174.1004 54 P 4.2680 0.0000 0.0000 63.8247 31.2134 176.0773 55 Q 4.3083 8.5971 119.0629 56.8636 29.9961 175.6280 56 N 5.0050 7.7969 114.0821 52.0982 39.6241 174.3241 57 N 4.8116 7.7388 116.5290 51.6031 41.5986 172.2951 58 P 4.3405 0.0000 0.0000 65.2674 31.6612 178.6469 59 E 3.7927 8.0532 118.5311 59.2226 29.5171 178.2280 60 L 2.6285 7.2164 120.2301 58.2229 41.9266 179.2333 61 Q 4.0114 7.8711 117.2616 58.9179 28.2038 178.6559 62 A 4.0934 8.0163 121.8439 55.4710 18.5300 178.4749 63 H 4.1430 8.5824 116.6703 59.8398 29.9626 177.1155 64 A 4.2875 9.0601 122.7116 55.1772 18.3266 179.9197 65 G 3.8466 8.3426 104.5620 48.0195 0.0000 176.1905 66 K 4.1429 7.9945 120.4909 59.0592 31.9257 179.3343 67 V 3.5861 7.7500 118.1701 66.4738 31.4164 178.2659 68 F 4.1339 8.4056 116.5947 60.1031 38.6268 177.7269 69 K 3.9427 8.4748 119.6881 59.4662 32.0931 178.8632 70 L 3.9277 7.8465 119.1028 57.7869 41.5238 179.6407 71 V 3.5407 7.6154 118.2681 66.0438 31.2986 177.4980 72 Y 3.6173 7.8539 119.2532 60.5990 38.5580 177.8590 73 E 2.9825 7.7520 119.2220 58.5568 29.3810 178.9982 74 A 3.7645 7.5500 120.6722 55.2482 18.5188 179.5015 75 A 3.7369 7.5179 118.9792 55.2679 18.2140 179.9500 76 I 3.5821 7.0277 118.2955 64.2509 37.2618 178.1502 77 Q 3.8199 7.8530 120.4175 59.2783 28.7368 178.6304 78 L 4.0269 7.8973 120.0239 57.5532 41.3520 179.0920 79 E 4.0283 7.8028 118.5368 58.9957 29.6546 178.7530 80 V 3.6572 7.8776 117.9534 66.0113 31.7968 176.8475 81 T 4.1276 7.8214 106.9675 61.5701 69.6707 175.9556 82 G 3.9377 8.6379 109.4480 44.7740 0.0000 172.7984 83 V 4.3833 7.2026 110.7665 59.3582 35.4709 174.8657 84 V 3.9259 7.9745 120.5659 61.2344 31.7615 175.4410 85 V 3.6848 8.1403 128.0375 62.3786 31.4059 175.5655 86 T 3.9825 8.4707 125.4357 63.6311 68.7395 173.2586 87 D 5.1564 8.1926 127.9820 51.2666 42.4340 175.9806 88 A 4.0236 8.5577 118.8842 56.0399 18.1823 180.0656 89 T 3.8350 7.8371 113.8098 66.9118 68.6301 176.7510 90 L 4.1812 7.8430 120.9008 57.4815 41.5022 179.6715 91 K 4.1448 8.1613 118.7754 59.3665 31.9602 178.8964 92 N 4.3649 8.4525 117.4747 56.2155 38.6769 176.8708 93 L 4.1364 8.4738 121.3669 57.9598 41.8984 179.6782 94 G 3.7515 8.1786 105.4342 47.7995 0.0000 175.6689 95 S 4.1331 7.9465 115.7014 61.2992 62.3835 176.7171 96 V 3.6788 7.8676 121.8089 65.1166 31.0366 178.0429 97 H 4.2307 8.1064 116.9549 58.3735 28.4680 177.8819 98 V 3.6127 7.7733 119.7845 66.2209 31.1976 178.1389 99 S 4.1168 7.9326 113.5405 61.2688 62.7289 176.0033 100 K 4.3212 7.6655 118.2401 55.9243 32.1117 177.4326 101 G 3.8388 7.9988 107.7923 45.5547 0.0000 173.6235 102 V 3.7553 7.6497 119.1248 61.8537 32.2713 175.2867 103 A 4.9577 8.6706 128.4901 49.9125 22.1565 176.5977 104 D 4.7283 8.7751 118.2645 57.5754 40.8776 178.5913 105 A 4.4865 7.9455 119.0722 53.3350 19.2440 178.4211 106 H 4.4332 8.4222 114.4982 58.6128 28.6746 177.4515 107 F 4.1870 8.2889 119.2770 60.4111 38.7574 175.8557 108 P 4.4575 0.0000 0.0000 64.6079 31.0972 178.7923 109 V 3.5326 7.6897 117.9032 66.1322 31.4952 178.2908 110 V 3.6209 7.7193 117.2558 65.3599 31.2768 177.8944 111 K 2.8948 7.8229 119.7018 59.2857 32.0740 178.7347 112 E 3.8818 8.1499 118.6220 59.2796 29.3266 179.2892 113 A 4.1031 7.7098 121.0749 55.0511 18.4070 179.7499 114 I 3.9308 7.9173 118.7020 64.3041 37.1809 178.5970 115 L 4.0647 8.1949 120.3677 57.4567 41.4879 179.6619 116 K 3.9455 8.5468 118.9712 59.5616 32.0117 179.3001 117 T 3.9176 7.9684 115.9893 67.1041 68.5087 176.7701 118 I 3.8536 8.2210 121.3861 63.8060 36.7194 178.4136 119 K 4.0396 8.1411 120.8553 58.9757 31.6828 178.8833 120 E 3.9242 7.8921 118.4437 59.2557 29.6043 178.6284 121 V 3.6603 7.8266 117.2350 66.2108 31.6088 177.8977 122 V 4.2908 7.7675 111.9861 59.7996 32.2164 177.9585 123 G 3.9046 8.3798 107.6563 46.2263 0.0000 176.8039 124 A 4.2094 8.7730 127.2232 53.9847 18.1503 178.6338 125 K 4.2828 7.6766 114.0400 56.8468 32.4839 177.4264 126 W 4.2481 8.0973 130.2907 57.4283 31.3250 175.4191 127 S 4.5288 7.1483 118.2827 55.5750 67.0973 175.1637 128 E 3.4616 8.2221 121.0142 59.4011 29.2652 178.8390 129 E 3.8319 8.0944 118.8607 59.5501 29.4760 178.6722 130 L 3.9702 7.6186 120.0245 58.0198 42.1445 178.4426 131 N 4.4846 7.7134 117.4268 56.3703 38.8762 177.1081 132 S 4.0767 8.4114 116.0250 61.4894 63.1516 176.1764 133 A 3.9718 7.9977 125.0326 54.6734 18.1339 179.5807 134 W 4.1979 8.5621 116.7753 59.5658 29.2114 179.1564 135 T 4.1332 8.1524 116.3282 66.4524 67.9071 176.9212 136 I 3.7084 7.9710 121.4987 64.4953 37.2093 178.3419 137 A 3.9463 8.0974 121.5349 55.1693 18.0463 179.1858 138 Y 3.8874 8.2866 118.0166 61.0288 38.9378 177.5789 139 D 4.5125 8.4119 119.8516 57.6305 40.6250 178.8089 140 E 3.9352 8.2232 119.0196 59.2557 29.4394 179.1814 141 L 3.9275 8.0382 120.2801 57.8201 42.0578 178.8347 142 A 3.7418 8.0989 121.3191 54.7649 18.0909 179.5459 143 I 3.4691 7.5843 118.5676 64.4951 37.1243 178.8103 144 V 3.5137 7.1871 117.6109 66.0148 31.3951 178.2521 145 I 3.6944 7.6866 119.5531 64.3246 37.0732 178.5807 146 K 3.7137 7.8220 119.4190 58.9571 31.8100 179.3557 147 K 3.8468 7.5368 120.1164 59.6339 32.2368 178.8023 148 E 4.1001 8.0669 118.1876 58.9352 29.0206 179.2735 149 M 4.2543 7.8905 118.7147 58.3576 32.3601 177.9300 150 D 4.5079 7.9763 118.7530 57.5474 40.7659 178.6267 151 D 4.3964 7.9167 117.8585 56.8539 40.8828 177.8166 152 A 4.3145 7.7364 118.6359 52.5759 18.9867 177.0784 153 A 4.1596 7.6251 125.3593 52.2078 18.6988 177.3681 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 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.92 3.95 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 3 L 7.69 4.27 0.00 1.64 2.02 0.84 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.78 4.23 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 1.29 0.00 0.00 5 E 8.63 3.90 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 2.37 2.36 0.00 6 S 7.98 4.19 0.00 4.08 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.27 3.98 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 8 A 8.30 3.96 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.87 4.01 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 10 L 7.84 4.00 0.00 1.94 1.77 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.93 3.63 1.93 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 0.46 0.00 0.00 0.56 0.00 0.00 12 K 8.36 4.20 0.00 2.08 1.92 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.72 1.78 7.81 13 S 8.14 4.20 0.00 4.11 4.07 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 0.00 0.00 0.00 14 S 8.36 4.40 0.00 4.46 4.41 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.91 4.50 0.00 3.65 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.26 3.41 0.00 2.14 1.91 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 2.36 2.65 0.00 17 E 8.12 4.02 0.00 2.27 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 2.34 2.53 0.00 18 F 8.10 3.89 0.00 2.90 2.91 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 19 N 7.41 4.09 0.00 1.67 2.23 0.00 0.00 7.25 7.85 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 20 A 7.12 4.01 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.76 4.71 0.00 2.43 2.04 0.00 0.00 7.00 8.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.52 3.25 1.73 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.59 0.86 0.00 0.00 23 P 0.00 4.19 0.00 2.06 2.17 0.00 3.43 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 24 K 7.66 3.90 0.00 1.69 1.63 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.45 7.81 25 H 8.18 4.27 0.00 2.23 2.94 0.00 5.67 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 26 T 8.07 4.19 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 27 H 8.12 4.49 0.00 3.36 3.49 0.00 5.78 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.19 3.85 0.00 2.14 2.18 0.00 3.23 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.73 0.00 29 F 8.43 4.13 0.00 3.54 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 F 7.92 3.85 0.00 3.12 2.91 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 31 I 7.78 3.68 1.99 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 1.53 0.78 0.87 0.00 0.00 32 L 8.08 3.91 0.00 1.70 1.61 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.67 3.44 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 1.03 0.00 0.00 0.15 0.00 0.00 34 L 7.71 4.27 0.00 1.73 1.71 1.01 1.05 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 35 E 8.14 4.09 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 2.32 2.49 0.00 36 I 7.33 4.22 1.93 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.51 0.89 0.00 0.00 37 A 8.16 4.52 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 38 P 0.00 4.24 0.00 2.17 2.15 0.00 3.62 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 39 A 8.19 4.07 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 40 A 8.14 4.12 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.08 4.04 0.00 1.90 1.84 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.49 7.81 42 D 7.55 4.45 0.00 2.79 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 43 L 7.65 3.99 0.00 1.23 1.15 0.61 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 44 F 7.52 4.33 0.00 2.58 1.51 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.31 4.14 0.00 3.98 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 7.47 4.56 0.00 3.03 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 47 L 8.02 4.38 0.00 1.90 1.70 0.56 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 48 K 7.84 4.12 0.00 1.72 1.76 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.61 7.81 49 G 9.01 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.23 4.11 4.34 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 1.27 0.00 0.00 51 S 8.60 4.50 0.00 3.84 3.90 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 52 E 7.66 4.65 0.00 1.98 1.84 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 2.22 2.26 0.00 53 V 8.24 3.64 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 0.82 0.00 0.00 0.92 0.00 0.00 54 P 0.00 4.27 0.00 2.20 2.08 0.00 3.82 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 55 Q 8.60 4.31 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.53 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 56 N 7.80 5.00 0.00 2.60 2.71 0.00 0.00 6.75 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.74 4.81 0.00 2.70 2.54 0.00 0.00 6.82 7.71 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 58 P 0.00 4.34 0.00 2.28 2.26 0.00 3.71 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 59 E 8.05 3.79 0.00 2.18 1.89 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 2.44 2.39 0.00 60 L 7.22 2.63 0.00 0.79 1.49 0.69 1.09 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 61 Q 7.87 4.01 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 62 A 8.02 4.09 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.58 4.14 0.00 3.48 3.53 0.00 5.80 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 64 A 9.06 4.29 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.34 3.85 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 0.00 0.00 0.00 66 K 7.99 4.14 0.00 2.11 1.95 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.66 7.81 67 V 7.75 3.59 2.20 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 0.76 0.00 0.00 1.00 0.00 0.00 68 F 8.41 4.13 0.00 2.82 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.47 3.94 0.00 2.30 1.95 0.00 1.84 0.00 0.00 1.86 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.70 7.81 70 L 7.85 3.93 0.00 1.84 1.66 0.95 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 71 V 7.62 3.54 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.95 0.00 0.00 72 Y 7.85 3.62 0.00 2.73 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 E 7.75 2.98 0.00 1.94 1.68 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 1.92 2.22 0.00 74 A 7.55 3.76 1.20 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 0.00 0.00 0.00 75 A 7.52 3.74 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 I 7.03 3.58 1.50 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 0.94 0.52 0.77 0.00 0.00 77 Q 7.85 3.82 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.31 0.00 78 L 7.90 4.03 0.00 1.81 1.62 0.86 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 79 E 7.80 4.03 0.00 1.92 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 2.60 0.00 80 V 7.88 3.66 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.91 0.00 0.00 81 T 7.82 4.13 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 82 G 8.64 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 83 V 7.20 4.38 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 0.66 0.00 0.00 0.88 0.00 0.00 84 V 7.97 3.93 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 0.68 0.00 0.00 0.82 0.00 0.00 85 V 8.14 3.68 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 0.81 0.00 0.00 0.89 0.00 0.00 86 T 8.47 3.98 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 87 D 8.19 5.16 0.00 2.76 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.56 4.02 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 89 T 7.84 3.83 4.44 0.00 0.00 0.00 0.00 0.00 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 90 L 7.84 4.18 0.00 1.62 1.69 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.16 4.14 0.00 1.97 1.86 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.61 7.81 92 N 8.45 4.36 0.00 2.86 2.83 0.00 0.00 7.16 6.27 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 93 L 8.47 4.14 0.00 1.86 1.84 0.99 0.87 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 94 G 8.18 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.95 4.13 0.00 3.87 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 V 7.87 3.68 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.90 0.00 0.00 97 H 8.11 4.23 0.00 3.30 3.44 0.00 5.82 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.77 3.61 2.27 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 1.12 0.00 0.00 1.06 0.00 0.00 99 S 7.93 4.12 0.00 4.02 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 0.00 100 K 7.67 4.32 0.00 1.77 1.65 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.48 7.81 101 G 8.00 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 0.00 102 V 7.65 3.76 2.24 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 0.71 0.00 0.00 0.79 0.00 0.00 103 A 8.67 4.96 1.28 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 0.00 0.00 104 D 8.78 4.73 0.00 2.82 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.95 4.49 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 H 8.42 4.43 0.00 3.40 3.19 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 F 8.29 4.19 0.00 3.34 3.37 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 0.00 108 P 0.00 4.46 0.00 2.20 2.14 0.00 3.93 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.23 0.00 109 V 7.69 3.53 2.34 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 0.98 0.00 0.00 0.98 0.00 0.00 110 V 7.72 3.62 2.15 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 1.30 0.00 0.00 0.99 0.00 0.00 111 K 7.82 2.89 0.00 1.17 1.72 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.27 1.10 7.81 112 E 8.15 3.88 0.00 1.98 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 2.48 2.45 0.00 113 A 7.71 4.10 1.20 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 0.00 0.00 0.00 114 I 7.92 3.93 1.74 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.63 0.60 0.00 0.00 115 L 8.19 4.06 0.00 1.66 1.76 0.97 0.97 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 0.00 116 K 8.55 3.95 0.00 1.82 1.82 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.53 7.81 117 T 7.97 3.92 4.66 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 1.33 0.00 0.00 118 I 8.22 3.85 1.50 0.00 0.00 0.44 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 -0.36 0.68 0.00 0.00 119 K 8.14 4.04 0.00 1.81 1.73 0.00 1.18 0.00 0.00 0.70 0.00 0.00 2.13 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.97 0.29 7.81 120 E 7.89 3.92 0.00 2.10 1.97 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 2.29 2.47 0.00 121 V 7.83 3.66 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 0.83 0.00 0.00 0.70 0.00 0.00 122 V 7.77 4.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.24 0.00 0.00 123 G 8.38 3.90 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 0.00 0.00 0.00 124 A 8.77 4.21 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 0.00 125 K 7.68 4.28 0.00 1.97 1.93 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.43 7.81 126 W 8.10 4.25 0.00 3.52 3.23 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 0.00 127 S 7.15 4.53 0.00 3.86 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.22 3.46 0.00 1.95 1.96 0.00 0.00 0.00 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 2.34 0.00 129 E 8.09 3.83 0.00 2.01 1.89 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 2.35 2.41 0.00 130 L 7.62 3.97 0.00 1.72 1.47 1.21 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 131 N 7.71 4.48 0.00 2.60 2.81 0.00 0.00 6.95 7.64 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 0.00 132 S 8.41 4.08 0.00 4.06 4.16 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 0.00 133 A 8.00 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 W 8.56 4.20 0.00 3.48 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.15 4.13 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 136 I 7.97 3.71 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.76 0.89 0.00 0.00 137 A 8.10 3.95 1.22 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 0.00 0.00 0.00 0.00 0.00 138 Y 8.29 3.89 0.00 3.17 2.97 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 0.00 139 D 8.41 4.51 0.00 3.04 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 E 8.22 3.94 0.00 1.93 1.92 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 2.57 2.41 0.00 141 L 8.04 3.93 0.00 1.65 1.60 0.82 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.10 3.74 1.03 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 0.00 0.00 0.00 0.00 0.00 143 I 7.58 3.47 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.89 0.84 0.00 0.00 144 V 7.19 3.51 1.99 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 0.97 0.00 0.00 0.93 0.00 0.00 145 I 7.69 3.69 1.81 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.71 1.02 0.00 0.00 146 K 7.82 3.71 0.00 1.57 1.59 0.00 0.61 0.00 0.00 1.03 0.00 0.00 2.65 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.14 0.21 7.81 147 K 7.54 3.85 0.00 1.91 1.95 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.43 7.81 148 E 8.07 4.10 0.00 2.15 1.99 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 2.56 2.60 0.00 149 M 7.89 4.25 0.00 2.05 2.32 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.81 0.00 150 D 7.98 4.51 0.00 2.85 2.70 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 0.00 0.00 0.00 151 D 7.92 4.40 0.00 2.76 2.73 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 0.00 152 A 7.74 4.31 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 7.63 4.16 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00