NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.8267 8.4093 118.1233 52.4540 40.7968 173.7447 2 F 4.8962 7.2397 110.8670 55.7096 41.0033 170.9145 3 M 4.7828 10.1088 120.6898 53.6706 36.2973 176.2624 4 L 5.2573 8.4363 119.5721 53.4749 45.0105 175.5360 5 T 4.9564 8.9546 115.1719 60.0466 71.1638 173.7020 6 Q 5.4159 8.7909 122.2602 52.0443 32.9709 173.4707 7 P 4.4860 0.0000 0.0000 62.0269 32.3197 175.6545 8 P 4.7626 0.0000 0.0000 65.6844 32.3261 175.9477 9 S 5.5041 7.9914 112.2138 56.3536 66.2988 174.0560 *11 V 4.1605 8.2524 120.0206 62.0691 32.7582 174.2858 12 S 5.5187 8.1634 115.5114 57.1180 66.1509 172.3508 13 E 4.7265 8.2557 119.3374 55.6518 32.7886 174.7745 14 S 4.7355 8.8080 120.5099 57.0685 64.5457 172.3390 15 P 4.3289 0.0000 0.0000 64.4836 31.4564 177.4043 16 G 3.8831 9.3609 111.0381 45.3638 0.0000 173.5620 17 K 4.4219 7.4177 119.6765 55.7706 34.7012 175.2400 18 T 5.1531 8.2558 117.0682 61.9563 70.7729 174.6539 19 V 4.4859 8.4260 124.6588 60.0851 34.9251 174.4754 20 T 4.8782 8.4030 118.6393 61.7966 71.4986 173.2261 21 I 4.5745 8.4980 127.0722 59.4825 39.5891 175.0337 22 S 5.3523 8.7397 121.2662 57.1048 66.2284 173.6874 23 C 5.3698 9.6477 121.1298 55.5561 47.1535 172.5642 24 T 5.0627 8.9601 124.0287 61.7554 70.5885 173.6497 25 R 4.7668 8.6110 128.2030 55.8120 30.1891 176.6184 26 S 4.5715 8.9877 122.0820 60.8443 63.8414 174.5452 27 S 4.4369 8.1462 112.4987 57.9865 65.2209 174.6786 27A G 3.8547 8.5075 109.9264 44.9972 0.0000 172.7195 28A S 4.5607 7.9022 112.7093 56.8168 63.2660 174.6395 28 I 3.4646 9.0684 127.4903 64.0687 37.7812 177.2233 29 A 4.1197 7.6066 120.1419 53.2202 18.4734 178.4682 30 S 4.2535 7.6685 112.3270 60.7277 63.1402 174.5036 31 N 5.0115 7.3386 115.6190 51.1840 42.4697 173.9800 32 Y 4.6148 8.5231 118.9789 58.4921 38.7808 175.6546 33 V 4.5998 9.1764 123.1996 61.3546 34.1789 174.4693 34 Q 5.1405 8.9431 126.3388 53.8554 32.3341 174.4249 35 W 5.3549 9.1118 121.9040 55.1824 32.6727 174.1642 36 Y 5.3203 9.5232 121.3981 56.3336 41.3404 174.2159 37 Q 4.5612 9.1780 124.4560 54.5631 31.5488 174.0795 38 Q 4.7892 8.8421 127.2075 54.3921 32.0576 174.4632 39 R 4.6038 8.5161 125.7058 54.6799 32.0126 174.6503 40 P 4.3709 0.0000 0.0000 64.3641 31.6803 177.2497 41 G 3.9382 9.0476 110.9324 45.3875 0.0000 172.8251 42 S 4.7648 7.6655 114.7857 56.2120 65.6702 173.7683 43 S 4.4504 8.1748 116.0545 56.9896 63.8408 172.1916 44 P 4.6511 0.0000 0.0000 63.1979 31.8128 175.8839 45 T 4.7487 9.1676 121.1167 61.7553 71.1029 174.0253 46 T 4.1445 8.8236 123.4179 64.2208 68.3737 174.3688 47 V 4.1553 8.7235 119.6745 62.0715 33.8066 176.5689 48 I 5.0862 7.6503 119.7780 59.6785 41.5778 174.0515 49 Y 4.9640 8.3002 123.0357 54.8344 41.9272 174.4445 50 E 3.0681 9.6690 116.9967 57.5509 27.6841 175.5466 51 D 5.1246 9.2612 125.8996 55.2787 40.6467 176.8362 52 N 4.9652 7.6377 109.9640 53.0317 38.8757 173.4015 53 Q 4.1719 8.0360 119.2993 54.8275 29.8469 174.9007 54 R 4.7480 8.1471 121.7676 54.1390 31.5870 174.8823 55 P 4.6325 0.0000 0.0000 62.0440 32.1413 175.6993 56 S 4.3154 8.4129 115.1810 60.0038 62.6064 174.7903 57 G 3.9451 8.9952 115.6565 45.2026 0.0000 173.1837 58 V 3.9442 7.3776 120.3723 60.8538 32.3261 174.0807 59 P 4.5571 0.0000 0.0000 62.7039 31.9009 176.4057 60 D 4.6705 8.5590 117.9245 54.2183 39.7708 177.4408 61 R 4.0113 7.9383 120.0283 58.1366 31.2021 175.9384 62 F 5.0600 8.1584 118.4327 55.7509 40.3853 175.7619 63 S 4.6915 9.0061 117.7239 56.6173 66.6163 173.1700 64 G 4.5459 8.8455 108.1773 44.0716 0.0000 172.0442 65 S 4.9048 8.6751 115.3316 57.2383 67.1279 172.7399 66 I 5.1698 8.1602 119.4792 59.8174 41.1037 174.6318 66A D 4.4667 9.2660 124.5716 52.7837 44.5602 175.3720 67A S 3.8136 9.1806 117.2569 62.6927 63.5712 176.4462 67 S 4.1316 8.0893 120.0824 59.4548 63.2151 175.2138 68 S 4.5088 7.6869 113.6706 57.0611 63.6818 173.1682 69 N 4.1404 8.1889 119.7106 55.0666 37.7675 172.8605 70 S 5.3836 8.1872 109.4398 56.4815 67.4416 173.1541 71 A 5.3883 9.0976 122.1924 50.4803 22.2336 175.6139 72 S 5.2363 9.2787 115.4726 56.6706 67.4939 172.8064 73 L 4.3226 7.6122 125.3667 53.4032 43.8356 174.9514 74 T 4.7807 8.6766 123.4339 61.7454 71.3204 173.3950 75 I 4.4895 8.4069 127.7130 59.4858 39.5110 175.3226 76 S 4.5428 8.6481 122.6943 56.4471 65.5660 173.9571 77 G 3.8285 8.3257 106.2277 45.8454 0.0000 174.4367 78 L 4.0382 7.7359 117.9003 55.1354 42.7714 177.5226 79 K 4.9522 8.9334 121.8656 54.3290 35.4149 177.6018 80 T 3.9643 8.4035 111.2865 64.4242 68.8920 176.1961 81 E 4.1161 8.1304 118.9733 58.5482 29.7932 177.5607 82 D 4.6435 8.0442 119.0263 56.2406 41.1462 175.9438 83 E 4.3942 8.1300 120.6218 56.4614 30.0846 176.0247 84 A 4.3214 8.2405 127.4557 51.9133 22.4730 174.1350 85 D 5.0912 8.0459 119.0424 53.9410 42.7294 175.7135 86 Y 5.2687 8.7523 119.9712 56.4397 41.0441 174.2373 87 Y 5.4542 9.3231 121.7130 56.3818 41.4852 172.9809 88 C 4.3949 8.9713 118.1008 54.7885 42.5398 172.1126 89 Q 4.7093 7.8509 118.8023 55.5408 32.5711 173.1783 90 S 4.1848 8.5431 120.1995 57.5822 66.0694 171.6598 91 Y 5.3288 8.6383 114.7320 56.4365 41.9638 175.9978 92 D 5.3218 8.8640 128.4466 53.6046 40.0208 176.7709 93 S 4.5733 8.1547 107.0849 58.6946 64.8022 175.5651 94 S 3.7819 8.9464 112.7145 60.1071 62.1616 173.9399 95 N 3.8033 6.9391 114.3362 50.8269 38.1853 172.8613 95A H 4.8936 8.1612 118.9142 55.0837 33.2923 173.4678 96 V 4.1024 8.5767 115.3276 61.0485 32.6520 175.6472 97 V 4.2250 8.3613 124.7611 61.0569 33.8835 174.1151 98 F 4.9793 8.7256 126.3384 55.5619 40.8523 175.9368 99 G 4.3086 9.1293 110.8853 45.8777 0.0000 174.0590 100 G 3.8322 8.8178 108.3972 46.6654 0.0000 175.1168 101 G 3.7084 8.6031 106.6639 45.7567 0.0000 172.8577 102 T 4.9157 8.4027 117.9207 60.3043 71.8072 173.0603 103 K 4.5558 9.1136 129.1482 55.5714 33.4493 175.0226 104 L 4.9187 8.8971 130.9501 54.2181 43.8829 175.0214 105 T 4.7465 8.6860 123.3519 61.8810 71.0135 173.5984 106 V 4.4697 8.7068 127.0436 61.2308 32.5644 175.6747 107 L 4.2830 8.6068 127.6978 55.0605 41.1076 177.1342 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 N 8.41 4.83 0.00 2.65 2.94 0.00 0.00 6.73 6.56 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 2 F 7.24 4.90 0.00 3.04 3.04 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 3 M 10.11 4.78 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 4 L 8.44 5.26 0.00 1.61 1.58 0.97 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.95 4.96 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 1.26 0.00 0.00 6 Q 8.79 5.42 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.99 0.00 0.00 0.00 0.00 0.00 2.61 2.26 0.00 7 P 0.00 4.49 0.00 2.25 2.21 0.00 3.91 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.99 0.00 8 P 0.00 4.76 0.00 2.16 2.38 0.00 3.70 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 2.09 1.99 0.00 9 S 7.99 5.50 0.00 3.88 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 *11 V 8.25 4.16 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 0.77 0.00 0.00 0.89 0.00 0.00 12 S 8.16 5.52 0.00 3.89 3.82 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 13 E 8.26 4.73 0.00 2.02 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 2.31 2.29 0.00 14 S 8.81 4.74 0.00 3.78 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 15 P 0.00 4.33 0.00 2.02 1.99 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 16 G 9.36 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 0.00 0.00 0.00 17 K 7.42 4.42 0.00 1.70 1.72 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.65 7.81 18 T 8.26 5.15 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 1.10 0.00 0.00 19 V 8.43 4.49 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 0.67 0.00 0.00 0.84 0.00 0.00 20 T 8.40 4.88 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 1.11 0.00 0.00 21 I 8.50 4.57 1.55 0.00 0.00 0.62 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 0.51 1.11 0.00 0.00 22 S 8.74 5.35 0.00 3.98 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 23 C 9.65 5.37 0.00 2.99 3.26 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 24 T 8.96 5.06 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 1.24 0.00 0.00 25 R 8.61 4.77 0.00 1.71 1.72 0.00 2.47 0.00 0.00 2.87 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.16 0.00 26 S 8.99 4.57 0.00 3.99 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 27 S 8.15 4.44 0.00 3.98 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 27A G 8.51 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 28A S 7.90 4.56 0.00 3.81 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 28 I 9.07 3.46 2.02 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 1.39 1.03 0.94 0.00 0.00 29 A 7.61 4.12 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 30 S 7.67 4.25 0.00 3.88 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 31 N 7.34 5.01 0.00 2.69 2.85 0.00 0.00 7.04 7.34 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 32 Y 8.52 4.61 0.00 3.14 3.07 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 33 V 9.18 4.60 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 0.74 0.00 0.00 0.93 0.00 0.00 34 Q 8.94 5.14 0.00 2.04 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.53 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 35 W 9.11 5.35 0.00 3.19 3.14 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 36 Y 9.52 5.32 0.00 3.16 3.01 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 37 Q 9.18 4.56 0.00 2.14 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.10 1.80 0.00 38 Q 8.84 4.79 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 39 R 8.52 4.60 0.00 1.81 1.82 0.00 3.20 0.00 0.00 3.35 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 40 P 0.00 4.37 0.00 2.04 2.01 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 41 G 9.05 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 0.00 0.00 0.00 42 S 7.67 4.76 0.00 3.99 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 43 S 8.17 4.45 0.00 3.94 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 44 P 0.00 4.65 0.00 1.80 1.99 0.00 3.55 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.91 0.00 45 T 9.17 4.75 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 1.22 0.00 0.00 46 T 8.82 4.14 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 1.24 0.00 0.00 47 V 8.72 4.16 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 0.25 0.00 0.00 1.16 0.00 0.00 48 I 7.65 5.09 2.19 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 1.47 1.01 1.04 0.00 0.00 49 Y 8.30 4.96 0.00 3.01 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 50 E 9.67 3.07 0.00 1.62 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 1.47 1.97 0.00 51 D 9.26 5.12 0.00 2.97 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 52 N 7.64 4.97 0.00 2.74 2.94 0.00 0.00 5.97 7.39 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 53 Q 8.04 4.17 0.00 0.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.91 0.00 0.00 0.00 0.00 0.00 1.93 2.05 0.00 54 R 8.15 4.75 0.00 1.80 1.88 0.00 3.52 0.00 0.00 3.55 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.64 0.00 55 P 0.00 4.63 0.00 2.22 2.02 0.00 3.72 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.28 0.00 56 S 8.41 4.32 0.00 3.85 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 57 G 9.00 3.95 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 0.00 0.00 0.00 58 V 7.38 3.94 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 0.65 0.00 0.00 0.87 0.00 0.00 59 P 0.00 4.56 0.00 2.38 2.25 0.00 3.78 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.12 0.00 60 D 8.56 4.67 0.00 2.80 2.84 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 61 R 7.94 4.01 0.00 1.67 1.89 0.00 3.50 0.00 0.00 3.26 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.51 0.00 62 F 8.16 5.06 0.00 3.01 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 63 S 9.01 4.69 0.00 3.79 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 64 G 8.85 4.55 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 0.00 0.00 0.00 65 S 8.68 4.90 0.00 3.89 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 66 I 8.16 5.17 1.91 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.01 0.94 0.00 0.00 66A D 9.27 4.47 0.00 2.74 2.45 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 0.00 67A S 9.18 3.81 0.00 4.04 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 67 S 8.09 4.13 0.00 4.00 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 68 S 7.69 4.51 0.00 3.84 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 69 N 8.19 4.14 0.00 2.92 2.82 0.00 0.00 6.65 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 70 S 8.19 5.38 0.00 4.05 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 71 A 9.10 5.39 1.45 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 0.00 0.00 0.00 72 S 9.28 5.24 0.00 3.71 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.61 4.32 0.00 0.27 0.13 0.78 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.68 4.78 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 1.11 0.00 0.00 75 I 8.41 4.49 1.50 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.51 0.23 0.00 0.00 76 S 8.65 4.54 0.00 3.80 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 G 8.33 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 78 L 7.74 4.04 0.00 1.73 1.59 0.90 0.65 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 79 K 8.93 4.95 0.00 1.79 1.67 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.48 7.81 80 T 8.40 3.96 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 1.22 0.00 0.00 81 E 8.13 4.12 0.00 2.15 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 0.00 2.34 2.42 0.00 82 D 8.04 4.64 0.00 2.88 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 83 E 8.13 4.39 0.00 1.99 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 0.00 2.36 2.37 0.00 84 A 8.24 4.32 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 85 D 8.05 5.09 0.00 2.66 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 0.00 0.00 0.00 0.00 86 Y 8.75 5.27 0.00 3.02 3.10 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 87 Y 9.32 5.45 0.00 3.34 3.19 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 0.00 88 C 8.97 4.39 0.00 1.85 1.18 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.85 4.71 0.00 1.67 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.49 0.00 0.00 0.00 0.00 0.00 1.52 1.16 0.00 90 S 8.54 4.18 0.00 3.85 3.80 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 91 Y 8.64 5.33 0.00 3.02 2.83 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 92 D 8.86 5.32 0.00 2.91 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 93 S 8.15 4.57 0.00 4.00 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 94 S 8.95 3.78 0.00 3.85 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 95 N 6.94 3.80 0.00 2.74 2.87 0.00 0.00 6.97 7.89 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 95A H 8.16 4.89 0.00 3.38 3.09 0.00 5.68 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 96 V 8.58 4.10 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 0.73 0.00 0.00 0.79 0.00 0.00 97 V 8.36 4.22 1.74 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 0.74 0.00 0.00 0.18 0.00 0.00 98 F 8.73 4.98 0.00 2.86 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 G 9.13 4.31 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 0.00 100 G 8.82 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 0.00 101 G 8.60 3.71 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 0.00 102 T 8.40 4.92 4.37 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 1.29 0.00 0.00 103 K 9.11 4.56 0.00 2.02 1.83 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.45 7.81 104 L 8.90 4.92 0.00 1.93 1.96 0.95 0.44 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 0.00 105 T 8.69 4.75 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 0.00 106 V 8.71 4.47 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 0.75 0.00 0.00 1.00 0.00 0.00 107 L 8.61 4.28 0.00 1.56 1.56 0.91 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.