NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 Q 4.3098 8.1876 121.9663 56.1450 30.3535 173.4743 16 N 5.3313 8.3360 123.8436 50.8285 40.1563 172.1386 17 Y 4.9021 9.2842 117.8732 55.9461 43.1837 176.1531 18 L 4.5761 8.7784 121.3684 55.2651 42.7223 176.4342 19 F 5.0272 8.9185 123.6839 56.7494 42.9388 173.6661 20 G 3.8110 7.5594 111.0552 45.1426 0.0000 170.3203 21 C 4.3398 8.3900 116.6524 58.8806 33.3689 172.6024 22 E 4.8767 8.0872 118.1046 55.6474 31.9625 174.2225 23 L 5.2747 8.6198 124.8802 52.5632 46.8213 175.3980 24 K 5.0479 8.3752 118.0541 56.2247 36.7213 176.2819 25 A 4.3491 8.6602 121.5078 53.9853 17.9751 177.9514 26 D 4.7606 7.9802 112.9889 54.1828 44.1393 176.0810 27 K 4.4016 7.8050 122.1289 54.4562 31.8458 174.3781 28 D 5.0738 7.8763 124.2943 52.9394 44.5391 173.5128 29 Y 4.7593 8.6827 120.3566 56.5115 41.9829 173.2617 30 H 5.1424 8.5049 124.0848 54.3648 30.8601 174.5315 31 F 4.7731 10.0579 127.6041 56.4399 40.2805 174.1940 32 K 4.8764 7.9723 124.1577 55.1031 35.6974 175.6361 33 V 4.3315 8.0066 119.2850 61.6802 34.5409 173.9223 34 D 4.8232 8.1805 121.8866 53.2722 40.3932 177.4867 *39 E 4.5018 8.2896 119.9645 57.0299 32.1631 176.1885 40 H 4.8970 7.9876 110.2045 55.4079 32.6833 173.6650 41 Q 4.5662 9.1769 122.4749 55.1196 33.3896 172.3538 42 L 4.6429 8.7024 128.9815 53.5214 44.0757 174.7239 43 S 5.1118 8.7502 122.5134 56.6437 64.3117 172.6965 44 L 4.3090 9.0050 128.3290 55.3572 42.7516 175.4715 45 R 4.5098 9.5943 123.1174 55.9079 31.1922 176.3392 46 T 5.0379 6.7770 110.7021 60.5185 73.0112 175.2443 47 V 4.8727 8.6290 122.3808 61.3776 34.4730 174.3339 48 S 5.6889 8.9395 122.1146 55.3952 66.6841 173.5947 49 L 4.3637 8.6036 121.3947 54.7860 42.5045 176.6543 50 G 4.0521 8.9893 109.0275 45.7778 0.0000 176.4081 51 A 3.8566 7.5090 125.6522 54.2389 19.6336 178.7140 52 G 3.9976 7.7902 99.8628 44.9540 0.0000 173.2324 53 A 4.1562 7.9290 123.5627 51.3632 18.9585 178.0816 54 K 4.0695 7.7052 122.0173 56.7311 33.0635 177.1562 55 D 4.6555 8.4371 120.6187 54.3167 40.2988 174.9443 56 E 4.6983 7.5690 116.2786 53.8174 32.7740 175.4467 57 L 4.4117 8.0810 120.8188 55.8249 43.6190 175.1831 58 H 5.2264 9.2516 119.9751 54.3235 33.6432 172.6357 59 I 5.0959 8.5361 121.5275 59.8806 41.4976 174.0488 60 V 4.8778 8.7007 127.5562 61.0713 33.4973 174.2307 61 E 5.1406 9.2778 125.3971 54.5668 33.1752 174.5018 62 A 5.2287 9.0341 123.1699 50.2600 22.4447 174.4717 63 E 5.3443 9.7407 123.4968 53.6000 32.1329 174.6582 64 A 4.9263 8.3251 126.5632 50.6198 22.8856 175.0568 65 M 4.4286 8.7432 119.4639 56.0347 33.0231 176.5878 66 N 4.9535 8.3681 119.4398 51.6588 40.0433 174.7815 67 Y 4.4691 8.6845 117.6762 60.4396 39.1841 176.7534 68 E 4.3427 8.4373 119.2267 55.9957 29.9856 178.1503 69 G 4.1431 7.9887 113.2152 46.1197 0.0000 175.4825 70 S 4.4582 7.9957 115.6600 57.0397 64.1805 172.5141 71 P 4.8292 0.0000 0.0000 62.9447 31.8890 175.4999 72 I 4.6511 8.5714 116.1094 59.1027 41.0852 174.0981 73 K 4.8881 8.5287 122.0592 54.7561 34.0807 175.9827 74 V 4.5197 8.4854 123.9060 61.2518 35.2274 174.4106 75 T 4.5699 8.5719 124.0295 63.5334 68.3543 174.5882 76 L 4.4085 9.6525 128.6344 57.3641 42.6668 176.9269 77 A 4.4327 7.3255 117.2131 51.7469 22.5430 175.2486 78 T 5.0538 8.6567 115.5126 61.9080 70.9983 173.8491 79 L 4.9174 8.8617 126.1367 53.0867 46.2873 176.0967 80 K 4.3743 8.9026 120.7656 56.5850 34.8444 175.8171 81 M 3.7625 8.8976 128.9663 58.6457 32.2551 177.0880 82 S 4.6085 8.0468 109.5563 58.1766 63.7343 173.7627 83 V 4.0825 7.5272 118.4995 64.1497 33.2392 176.0636 84 Q 4.3322 8.5585 126.7859 54.9096 30.0914 172.3258 85 P 4.4955 0.0000 0.0000 64.3206 32.8200 176.3426 86 T 5.1005 7.8673 114.4972 61.5517 72.0884 173.8105 87 V 4.4105 8.5469 124.2335 61.2007 35.0287 173.8255 88 S 5.1129 8.6889 122.5101 56.9157 62.9044 173.7596 89 L 4.1003 9.6513 128.9114 54.7933 42.3417 177.2351 90 G 3.6136 8.5422 106.0446 46.7832 0.0000 172.9723 91 G 3.7922 8.2733 102.4727 46.1877 0.0000 174.4204 92 F 4.7542 8.6754 121.5908 57.3149 40.8369 175.0783 93 E 4.9804 9.0541 126.5503 55.7763 30.5914 176.2388 94 I 4.6910 8.9236 124.2755 59.7559 41.8665 174.4146 95 T 4.7014 8.4133 121.8490 61.7427 69.1725 173.3734 96 P 4.5674 0.0000 0.0000 62.1937 32.1200 173.9832 97 P 5.0238 0.0000 0.0000 62.5517 32.3308 175.7129 98 V 4.7746 9.2034 121.6073 59.9387 35.2799 174.3811 99 V 5.0788 8.8117 122.1426 61.2623 34.4067 173.9801 100 L 5.3269 9.2170 128.5724 53.2288 44.0275 175.8213 101 R 5.4330 8.9279 118.6122 55.5981 33.5125 173.9741 102 L 4.7554 8.3964 122.0981 53.4046 41.7611 176.2727 103 K 3.8311 8.9543 129.3414 59.2207 33.0193 175.7712 104 C 4.6550 7.9654 112.9765 58.2910 33.1793 174.1188 105 G 3.9279 8.9653 106.4165 46.0474 0.0000 173.9545 106 S 4.0224 9.6815 118.3622 61.1737 63.1317 175.4543 107 G 3.8725 8.3719 105.2731 42.6315 0.0000 170.5541 108 P 5.2270 0.0000 0.0000 62.6588 32.7855 175.8401 109 V 4.5407 8.0107 119.9963 61.8414 34.8399 173.4128 110 H 5.2306 9.4577 126.0308 54.9573 30.5283 174.3846 111 I 5.0494 8.0956 123.0783 59.4807 40.4342 174.8101 112 S 5.0149 9.8282 120.2380 56.0269 66.7324 174.2110 113 G 4.0006 7.2203 105.8995 46.3261 0.0000 171.1601 114 Q 4.7801 8.7438 119.0257 55.0603 32.8942 174.4795 115 H 5.0063 9.8286 122.6136 55.1941 30.0974 173.6577 116 L 4.8302 9.3520 125.9021 54.1739 43.1862 176.1456 117 V 4.5592 8.4973 121.8327 61.9271 34.7310 175.2166 118 A 4.1540 8.2914 128.8975 52.8471 19.1238 176.9096 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 15 Q 8.19 4.31 0.00 2.14 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.16 0.00 16 N 8.34 5.33 0.00 2.76 2.69 0.00 0.00 6.05 6.66 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 17 Y 9.28 4.90 0.00 3.05 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 18 L 8.78 4.58 0.00 1.62 1.68 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 19 F 8.92 5.03 0.00 3.12 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 20 G 7.56 3.81 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 0.00 0.00 0.00 21 C 8.39 4.34 0.00 2.56 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.09 4.88 0.00 1.90 1.75 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 2.08 2.26 0.00 23 L 8.62 5.27 0.00 1.60 1.49 0.94 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.38 5.05 0.00 1.68 1.69 0.00 1.95 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.29 7.81 25 A 8.66 4.35 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 26 D 7.98 4.76 0.00 2.57 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 27 K 7.80 4.40 0.00 1.73 1.68 0.00 1.81 0.00 0.00 1.83 0.00 0.00 3.15 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.42 1.36 7.81 28 D 7.88 5.07 0.00 2.87 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.68 4.76 0.00 3.18 2.87 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 30 H 8.50 5.14 0.00 2.91 3.16 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 10.06 4.77 0.00 3.07 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 32 K 7.97 4.88 0.00 1.64 1.63 0.00 1.49 0.00 0.00 1.53 0.00 0.00 2.81 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.11 1.24 7.81 33 V 8.01 4.33 1.80 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 0.51 0.00 0.00 0.53 0.00 0.00 34 D 8.18 4.82 0.00 2.76 2.65 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 *39 E 8.29 4.50 0.00 2.03 2.13 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 2.33 2.39 0.00 40 H 7.99 4.90 0.00 3.04 3.22 0.00 5.74 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 41 Q 9.18 4.57 0.00 2.14 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 42 L 8.70 4.64 0.00 0.88 1.16 -0.31 -1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.75 5.11 0.00 3.92 3.70 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 44 L 9.01 4.31 0.00 1.59 1.57 0.70 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 45 R 9.59 4.51 0.00 1.73 1.75 0.00 3.28 0.00 0.00 3.32 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 46 T 6.78 5.04 4.25 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 1.22 0.00 0.00 47 V 8.63 4.87 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 1.00 0.00 0.00 0.96 0.00 0.00 48 S 8.94 5.69 0.00 3.87 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.60 4.36 0.00 1.51 1.54 0.84 0.62 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 50 G 8.99 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 0.00 0.00 0.00 0.00 51 A 7.51 3.86 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 52 G 7.79 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 0.00 0.00 0.00 53 A 7.93 4.16 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 54 K 7.71 4.07 0.00 2.31 1.79 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.49 1.40 7.81 55 D 8.44 4.66 0.00 2.62 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 56 E 7.57 4.70 0.00 2.07 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 2.32 2.11 0.00 57 L 8.08 4.41 0.00 1.80 1.56 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 58 H 9.25 5.23 0.00 3.18 3.11 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.54 5.10 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.67 0.97 0.00 0.00 60 V 8.70 4.88 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 1.00 0.00 0.00 0.95 0.00 0.00 61 E 9.28 5.14 0.00 2.19 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 2.18 2.23 0.00 62 A 9.03 5.23 1.12 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 0.00 0.00 63 E 9.74 5.34 0.00 1.99 1.79 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 2.20 2.23 0.00 64 A 8.33 4.93 1.23 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 0.00 0.00 65 M 8.74 4.43 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.64 0.00 66 N 8.37 4.95 0.00 3.06 3.03 0.00 0.00 6.64 7.24 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 67 Y 8.68 4.47 0.00 2.82 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 E 8.44 4.34 0.00 2.11 1.85 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 2.23 2.18 0.00 69 G 7.99 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 0.00 0.00 0.00 0.00 70 S 8.00 4.46 0.00 3.92 4.01 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 0.00 0.00 0.00 71 P 0.00 4.83 0.00 2.10 2.11 0.00 3.72 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 1.99 1.97 0.00 72 I 8.57 4.65 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.76 0.99 0.00 0.00 73 K 8.53 4.89 0.00 1.65 1.76 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.41 7.81 74 V 8.49 4.52 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 1.16 0.00 0.00 0.99 0.00 0.00 75 T 8.57 4.57 4.28 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 1.26 0.00 0.00 76 L 9.65 4.41 0.00 1.57 1.77 0.88 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.33 4.43 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 78 T 8.66 5.05 4.26 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 1.26 0.00 0.00 79 L 8.86 4.92 0.00 1.52 1.62 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.90 4.37 0.00 1.85 1.64 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.39 7.81 81 M 8.90 3.76 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.64 0.00 82 S 8.05 4.61 0.00 4.05 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 83 V 7.53 4.08 2.19 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 0.83 0.00 0.00 0.94 0.00 0.00 84 Q 8.56 4.33 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.21 6.58 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 85 P 0.00 4.50 0.00 2.11 2.06 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.32 0.00 86 T 7.87 5.10 4.24 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 1.21 0.00 0.00 87 V 8.55 4.41 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 0.96 0.00 0.00 0.94 0.00 0.00 88 S 8.69 5.11 0.00 3.91 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 89 L 9.65 4.10 0.00 1.89 1.90 1.03 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 90 G 8.54 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.27 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 0.00 0.00 0.00 92 F 8.68 4.75 0.00 3.08 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 93 E 9.05 4.98 0.00 1.98 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 2.31 2.40 0.00 94 I 8.92 4.69 1.68 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.44 0.81 0.00 0.00 95 T 8.41 4.70 4.27 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 1.25 0.00 0.00 96 P 0.00 4.57 0.00 2.07 2.19 0.00 3.76 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.47 0.00 97 P 0.00 5.02 0.00 2.09 2.03 0.00 3.72 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 1.99 1.96 0.00 98 V 9.20 4.77 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 0.76 0.00 0.00 0.90 0.00 0.00 99 V 8.81 5.08 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 0.90 0.00 0.00 1.03 0.00 0.00 100 L 9.22 5.33 0.00 1.73 1.61 1.07 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 101 R 8.93 5.43 0.00 1.80 2.33 0.00 3.39 0.00 0.00 3.20 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.43 0.00 102 L 8.40 4.76 0.00 1.81 1.63 0.95 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 103 K 8.95 3.83 0.00 1.81 1.93 0.00 1.92 0.00 0.00 1.76 0.00 0.00 3.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.41 7.81 104 C 7.97 4.66 0.00 2.97 2.96 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 0.00 105 G 8.97 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 0.00 0.00 0.00 106 S 9.68 4.02 0.00 3.99 4.29 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 0.00 107 G 8.37 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 0.00 108 P 0.00 5.23 0.00 1.97 2.22 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 2.02 1.78 0.00 109 V 8.01 4.54 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 0.98 0.00 0.00 0.91 0.00 0.00 110 H 9.46 5.23 0.00 3.13 3.10 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.10 5.05 1.76 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.78 0.98 0.00 0.00 112 S 9.83 5.01 0.00 3.81 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 0.00 113 G 7.22 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 0.00 0.00 0.00 114 Q 8.74 4.78 0.00 2.03 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 115 H 9.83 5.01 0.00 3.46 3.65 0.00 5.58 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 9.35 4.83 0.00 1.85 1.60 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.50 4.56 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 0.70 0.00 0.00 0.87 0.00 0.00 118 A 8.29 4.15 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 * Residues marked with a * may have inaccurate shift predictions.