NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3170 8.3001 118.1928 54.8129 32.1974 175.0815 2 A 4.2323 8.4610 126.0118 51.4818 20.0829 174.4475 3 T 4.5703 9.4205 114.7088 61.9376 72.9823 172.2278 4 V 4.6048 8.3680 125.4416 61.9645 32.9940 174.5222 5 H 4.8873 9.3219 126.4367 54.2304 30.5663 174.6911 6 K 4.5077 8.8184 124.3775 55.2698 32.9663 177.0078 7 V 2.0000 7.6205 126.6289 63.6382 31.5822 176.9328 8 G 3.7422 5.7588 114.0096 44.8613 0.0000 173.4777 9 D 4.1744 7.9261 120.5676 54.8689 40.1690 176.7734 10 S 4.2180 8.8687 117.9205 62.5188 62.9678 176.1502 11 T 3.8472 7.8542 117.5961 64.2444 68.7531 176.0432 12 G 3.7499 7.6183 110.0362 44.5186 0.0000 171.5792 13 W 4.8482 8.6144 131.9626 56.6013 30.5415 176.2980 14 T 4.2912 8.2230 119.2460 61.6693 70.0074 173.0968 15 T 4.4530 7.9694 117.9358 62.5258 70.3338 174.9421 16 L 4.0375 8.0423 124.4199 57.6724 41.9950 177.2874 17 V 4.5980 7.2330 107.5120 58.4641 35.7009 173.3339 18 P 4.4002 0.0000 0.0000 63.0287 31.8626 175.8840 19 Y 4.3468 8.1628 122.3412 55.2015 41.6361 173.6946 20 D 4.7042 7.7385 126.7929 53.6061 40.3019 175.8424 21 Y 4.5795 8.4694 123.7649 60.2277 38.1828 177.5333 22 A 4.2669 8.3819 121.9923 55.1878 18.4035 179.6374 23 K 4.1443 8.4366 117.5504 58.4202 32.4900 179.1937 24 W 4.2369 8.2979 128.6872 60.3601 30.6669 177.7707 25 A 3.9400 8.7401 121.1404 55.3363 17.8092 179.7905 26 S 4.1305 8.3721 112.4229 60.7679 62.8565 175.8138 27 S 4.3195 7.4346 115.8764 58.3017 63.3775 173.2961 28 N 4.4631 6.9263 119.5665 51.0738 40.8983 173.8543 29 K 4.1305 7.5308 119.9937 54.6960 34.5307 175.0613 30 F 4.7636 8.3285 126.8453 56.6655 40.7028 174.8580 31 H 5.7875 9.1109 119.9219 52.4426 32.6489 173.6799 32 V 3.8916 8.9092 121.5123 64.8442 31.7354 176.1300 33 G 4.0429 9.0092 115.5137 45.5191 0.0000 173.3245 34 D 4.9966 8.1513 119.9084 54.2298 42.8102 175.0536 35 S 5.0349 9.0065 112.9395 57.4613 67.1613 172.8541 36 L 5.1910 8.9210 120.3101 52.7860 44.8501 175.5590 37 L 5.0500 8.5457 124.5661 53.4500 44.8192 175.1554 38 F 4.5408 9.1931 126.8048 56.1390 40.5923 174.6233 39 N 5.4337 8.4638 122.3820 51.9612 40.4578 173.9859 40 Y 4.9894 8.2108 120.6119 56.4489 42.3852 173.1241 41 N 4.8070 8.8715 118.7863 52.6980 38.4649 174.7985 42 N 5.3018 8.7807 121.8885 54.1210 37.3027 175.7511 43 K 4.3985 8.7543 118.4050 57.2169 32.9099 177.1737 44 F 4.4283 8.6161 116.9774 58.1203 40.7951 174.5875 45 H 5.0917 8.1452 114.7725 54.1663 32.5434 170.7834 46 N 4.9991 8.1390 116.2576 52.1656 41.1977 173.2006 47 V 4.3603 8.8652 118.2384 61.0691 34.3620 173.9881 48 L 5.2802 9.0995 128.2329 52.9892 44.9399 175.2778 49 Q 4.6437 9.2137 125.5751 55.3368 30.5715 174.9552 50 V 4.8137 8.2908 118.9192 59.9277 36.4183 174.1080 51 D 4.6820 8.7064 121.3336 51.8923 41.4926 177.1961 52 Q 2.6132 8.2264 118.7534 59.0685 28.7862 177.7809 53 E 3.8632 8.0012 119.4516 59.5666 29.6434 178.7163 54 Q 3.9850 8.8510 118.3523 58.6543 28.8379 178.3271 55 F 4.1097 8.3964 122.1004 61.4624 39.2286 177.3801 56 K 3.9491 8.2729 117.1293 58.8108 31.9330 178.5017 57 S 4.4743 7.6885 110.9643 57.3110 63.6520 173.1983 58 C 3.9496 7.6012 118.1837 58.0695 38.0279 172.8978 59 N 4.6246 8.5349 119.5006 53.1727 38.3508 174.2269 60 S 4.7721 8.5205 119.6515 58.0704 63.4151 175.2261 61 S 4.3160 8.5042 116.9390 60.9478 63.6663 174.7882 62 S 4.6636 7.5218 116.4383 56.5280 63.5449 171.9979 63 P 4.4752 0.0000 0.0000 62.7724 32.3095 177.0859 64 A 4.3255 9.0765 122.3893 54.5686 19.1413 177.6452 65 A 4.6816 7.7438 114.7145 50.8481 23.0117 175.5406 66 S 5.0713 8.0080 114.2613 57.0600 67.1386 173.3322 67 Y 4.8601 9.1531 120.5254 56.2585 42.1054 176.2731 68 T 5.2961 8.7205 111.3136 61.0342 69.8028 175.0851 69 S 4.1913 8.8376 119.7938 60.0637 63.5301 175.3937 70 G 2.6328 9.5398 108.6125 44.5416 0.0000 173.1689 71 A 4.8430 7.3948 121.2712 50.5929 18.6223 176.9601 72 D 4.4493 8.3817 122.6033 54.5434 42.5357 177.2203 73 S 5.0035 8.6401 118.7565 56.8582 63.8516 172.9496 74 I 4.4895 8.6602 128.8726 58.5509 39.5901 173.5453 75 P 4.5836 0.0000 0.0000 62.8119 32.4189 176.5318 76 L 4.5359 8.4552 122.3564 52.8575 41.4109 176.9473 77 K 4.2681 8.4153 119.6801 57.4649 33.8926 178.0409 78 R 4.7935 7.7083 117.2868 53.6081 34.0791 173.1034 79 P 4.5557 0.0000 0.0000 63.0037 32.0779 176.0008 80 G 4.0560 7.7885 106.7274 43.9903 0.0000 171.9824 81 T 4.9232 7.9006 116.7155 61.9033 69.9368 174.7158 82 F 4.6281 9.1727 125.1573 55.7328 42.6077 174.1480 83 Y 4.9398 7.8899 117.8909 56.2489 41.7507 174.5191 84 F 5.7066 9.3882 121.2971 56.0584 43.7057 173.6919 85 L 5.3812 9.0730 120.5401 55.0536 44.2094 173.6000 86 C 5.1193 8.1966 121.4240 58.1978 31.8426 173.9517 87 G 3.8350 8.9112 114.1528 46.4267 0.0000 173.9634 88 I 3.6027 7.5544 122.1331 60.4593 37.5194 173.3587 89 P 4.2611 0.0000 0.0000 64.6369 30.2346 176.3780 90 G 4.0924 9.0384 111.9797 45.9425 0.0000 175.1305 91 H 4.2441 8.4706 117.2277 59.1041 29.1059 176.9486 92 C 4.3808 8.3037 118.9244 59.7398 43.5539 175.4076 93 Q 3.7318 7.4291 117.1958 58.1529 28.3067 176.9016 94 L 4.3628 7.4202 116.5610 54.4016 41.7301 177.2360 95 G 4.1266 8.0321 107.0453 45.3023 0.0000 175.1496 96 Q 4.0723 7.8424 122.7026 54.0803 27.0055 174.0695 97 K 5.5957 7.7704 119.0523 55.6590 36.0163 176.2934 98 V 5.0203 10.0777 121.6219 60.4798 35.1617 173.2331 99 E 4.6206 9.2150 124.7944 54.7298 31.1896 174.7459 100 I 4.1052 8.5826 127.9619 59.4135 39.9827 174.7721 101 K 4.6479 8.6240 127.5337 54.9826 33.1141 176.1773 102 V 4.2150 8.9183 127.2428 61.5655 32.8379 175.8993 103 D 4.5870 8.8248 130.8975 54.7963 38.8898 171.8455 104 P 4.4711 0.0000 0.0000 62.1440 32.8704 177.0714 105 G 3.7376 8.4874 107.2237 46.0182 0.0000 173.6378 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 M 8.30 4.32 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 2 A 8.46 4.23 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.42 4.57 4.12 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 0.96 0.00 0.00 4 V 8.37 4.60 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 0.79 0.00 0.00 0.92 0.00 0.00 5 H 9.32 4.89 0.00 3.54 3.67 0.00 5.86 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 K 8.82 4.51 0.00 1.78 1.72 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.46 7.81 7 V 7.62 2.00 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 0.00 0.00 0.22 0.00 0.00 -0.66 0.00 0.00 8 G 5.76 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.93 4.17 0.00 2.96 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 10 S 8.87 4.22 0.00 3.98 4.03 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 11 T 7.85 3.85 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 12 G 7.62 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 13 W 8.61 4.85 0.00 3.24 3.32 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 14 T 8.22 4.29 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 1.15 0.00 0.00 15 T 7.97 4.45 4.14 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 16 L 8.04 4.04 0.00 1.54 1.70 0.89 0.75 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 17 V 7.23 4.60 2.10 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 0.80 0.00 0.00 0.97 0.00 0.00 18 P 0.00 4.40 0.00 2.03 1.99 0.00 3.66 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 19 Y 8.16 4.35 0.00 2.84 2.39 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 20 D 7.74 4.70 0.00 2.59 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 0.00 0.00 0.00 0.00 21 Y 8.47 4.58 0.00 3.61 3.42 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 22 A 8.38 4.27 1.56 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 0.00 0.00 0.00 0.00 0.00 0.00 23 K 8.44 4.14 0.00 1.85 1.86 0.00 1.69 0.00 0.00 1.45 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.56 7.81 24 W 8.30 4.24 0.00 3.73 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.74 3.94 1.71 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 0.00 0.00 26 S 8.37 4.13 0.00 4.06 4.17 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 0.00 0.00 0.00 0.00 27 S 7.43 4.32 0.00 3.96 4.03 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 28 N 6.93 4.46 0.00 1.80 1.42 0.00 0.00 6.63 7.32 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 29 K 7.53 4.13 0.00 1.50 1.43 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.97 1.28 7.81 30 F 8.33 4.76 0.00 3.21 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 H 9.11 5.79 0.00 3.10 3.14 0.00 5.66 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 8.91 3.89 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 0.78 0.00 0.00 1.00 0.00 0.00 33 G 9.01 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 34 D 8.15 5.00 0.00 2.84 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 35 S 9.01 5.03 0.00 3.93 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 36 L 8.92 5.19 0.00 1.39 1.19 0.47 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.55 5.05 0.00 1.68 1.42 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 38 F 9.19 4.54 0.00 2.86 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 39 N 8.46 5.43 0.00 2.68 2.73 0.00 0.00 6.65 7.48 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 40 Y 8.21 4.99 0.00 3.30 3.46 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 0.00 41 N 8.87 4.81 0.00 2.80 2.92 0.00 0.00 6.63 6.71 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 42 N 8.78 5.30 0.00 3.18 2.98 0.00 0.00 6.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.75 4.40 0.00 2.11 1.91 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.57 1.61 7.81 44 F 8.62 4.43 0.00 3.00 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.15 5.09 0.00 2.96 3.08 0.00 5.70 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 N 8.14 5.00 0.00 2.97 2.95 0.00 0.00 5.33 7.68 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 47 V 8.87 4.36 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 -0.00 0.00 0.00 48 L 9.10 5.28 0.00 1.75 1.57 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 9.21 4.64 0.00 2.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.54 0.00 0.00 0.00 0.00 0.00 2.18 1.94 0.00 50 V 8.29 4.81 2.28 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 0.86 0.00 0.00 1.08 0.00 0.00 51 D 8.71 4.68 0.00 2.81 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 52 Q 8.23 2.61 0.00 1.82 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 53 E 8.00 3.86 0.00 2.02 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 2.34 2.38 0.00 54 Q 8.85 3.99 0.00 2.22 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 55 F 8.40 4.11 0.00 2.94 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 56 K 8.27 3.95 0.00 1.87 1.86 0.00 1.75 0.00 0.00 1.79 0.00 0.00 3.17 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.75 7.81 57 S 7.69 4.47 0.00 4.02 3.93 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 58 C 7.60 3.95 0.00 3.11 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 59 N 8.53 4.62 0.00 2.62 2.73 0.00 0.00 6.87 7.41 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 60 S 8.52 4.77 0.00 4.00 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 61 S 8.50 4.32 0.00 3.99 4.02 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 0.00 0.00 0.00 62 S 7.52 4.66 0.00 3.80 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.48 0.00 2.34 2.07 0.00 3.75 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 64 A 9.08 4.33 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 65 A 7.74 4.68 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 66 S 8.01 5.07 0.00 3.57 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 67 Y 9.15 4.86 0.00 2.86 3.09 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 68 T 8.72 5.30 4.36 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 1.27 0.00 0.00 69 S 8.84 4.19 0.00 4.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 9.54 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.39 4.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.38 4.45 0.00 2.55 2.43 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 73 S 8.64 5.00 0.00 3.85 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 74 I 8.66 4.49 1.54 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.03 0.80 0.00 0.00 75 P 0.00 4.58 0.00 2.10 2.06 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 76 L 8.46 4.54 0.00 1.61 1.31 0.78 0.26 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 77 K 8.42 4.27 0.00 1.91 1.97 0.00 1.57 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.55 7.81 78 R 7.71 4.79 0.00 1.93 1.90 0.00 3.27 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 79 P 0.00 4.56 0.00 2.09 2.04 0.00 3.73 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 80 G 7.79 4.06 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 0.00 0.00 0.00 81 T 7.90 4.92 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 82 F 9.17 4.63 0.00 2.82 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 83 Y 7.89 4.94 0.00 2.91 2.48 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 0.00 84 F 9.39 5.71 0.00 3.06 2.69 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 85 L 9.07 5.38 0.00 1.87 1.97 1.01 0.76 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 86 C 8.20 5.12 0.00 2.91 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 87 G 8.91 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 I 7.55 3.60 1.22 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.10 0.73 0.00 0.00 89 P 0.00 4.26 0.00 2.01 2.04 0.00 3.62 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 90 G 9.04 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 0.00 0.00 0.00 91 H 8.47 4.24 0.00 3.26 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 C 8.30 4.38 0.00 3.14 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 93 Q 7.43 3.73 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 94 L 7.42 4.36 0.00 1.78 1.67 0.93 0.99 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 95 G 8.03 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 Q 7.84 4.07 0.00 1.82 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 97 K 7.77 5.60 0.00 2.15 1.79 0.00 0.61 0.00 0.00 1.42 0.00 0.00 2.73 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.45 7.81 98 V 10.08 5.02 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 0.97 0.00 0.00 1.43 0.00 0.00 99 E 9.22 4.62 0.00 1.79 1.95 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 2.04 1.73 0.00 100 I 8.58 4.11 1.73 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.85 -0.31 0.00 0.00 101 K 8.62 4.65 0.00 1.70 1.80 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.39 7.81 102 V 8.92 4.21 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 1.05 0.00 0.00 0.60 0.00 0.00 103 D 8.82 4.59 0.00 2.89 2.69 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 0.00 104 P 0.00 4.47 0.00 2.20 2.07 0.00 3.80 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 105 G 8.49 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00