NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 N 4.7470 8.4201 118.2170 52.8453 39.2259 173.4283 0 A 4.4847 7.7498 122.2246 50.0677 20.6269 171.7616 2 E 4.6875 8.3552 110.6271 56.3211 34.3900 174.6775 3 V 4.3273 8.4213 122.0935 62.4115 30.7958 175.6908 4 T 4.0386 8.8467 125.6315 66.0931 68.8576 174.3104 5 D 4.8822 7.8793 118.6387 52.5946 45.6107 174.0423 6 V 4.7932 8.2413 121.0841 61.3803 34.3761 174.4082 7 R 4.7702 9.2309 127.1199 54.3691 33.1109 174.9313 8 L 5.4273 8.3922 122.2568 53.3854 45.1574 175.4027 9 R 4.4685 9.1657 116.3910 55.0271 33.3471 174.4010 10 R 3.6979 8.5016 115.2800 56.9960 26.8448 176.9686 11 V 4.0005 7.6247 116.8399 63.9695 32.2340 175.2339 12 N 4.1561 9.6780 125.2949 54.7786 36.4018 175.7633 13 T 4.2621 7.2537 110.0524 63.0312 67.9039 173.9794 14 D 4.7081 7.5181 118.8128 52.9212 44.1662 175.2422 15 G 3.7541 8.7035 113.8075 47.6916 0.0000 174.1000 16 R 4.4823 9.0816 120.5385 56.2355 30.8324 178.2558 *18 R 4.2642 8.2427 119.7291 56.2000 33.0505 175.4281 19 A 4.9024 7.0123 116.3225 51.8883 23.3294 175.3428 20 I 4.7971 8.7542 121.6510 59.8564 39.1753 174.8976 21 A 5.2246 9.0274 128.0961 50.2189 21.9598 175.6500 22 S 4.9402 9.1215 116.2421 56.6073 66.6745 173.5323 23 I 4.9596 8.3425 116.9648 59.3964 41.1166 174.3490 24 T 5.0420 8.4368 118.8524 61.8334 72.0072 172.9575 25 L 4.9422 9.5302 127.1771 53.7273 44.1885 176.6244 26 D 4.5263 9.2734 123.0168 56.0410 38.9684 174.8932 27 H 4.1677 8.0449 112.1015 56.7884 28.4066 175.9375 28 E 4.6689 8.3362 115.9655 55.6727 31.8759 175.6825 29 F 4.8395 8.0654 120.7835 56.2373 42.5593 173.4118 30 V 4.6460 7.7091 125.5525 60.9722 33.7921 174.5982 31 V 4.1727 8.2954 126.7417 61.7077 34.2856 174.6564 32 H 5.0432 8.2431 125.5530 56.8471 30.9771 175.2411 33 D 4.3036 8.7057 121.6249 55.6072 38.7024 174.0227 34 I 4.2325 7.4690 122.0295 61.4525 38.4671 175.3928 35 R 4.8886 8.8642 124.3906 54.3347 33.5668 174.6684 36 V 4.1717 8.2344 123.7825 61.7834 32.8464 174.5443 37 I 4.4836 7.5486 128.9468 59.3904 40.2472 174.8579 38 D 4.8183 8.6467 127.2587 53.1759 40.4188 177.0850 39 G 4.0932 8.5281 116.9797 45.1275 0.0000 171.2335 40 N 4.7529 8.6782 117.4357 53.5504 37.7430 174.6536 41 N 4.9011 7.7742 116.1428 53.1303 40.0011 175.0585 42 G 3.9797 8.3617 105.4451 44.5731 0.0000 173.2337 43 L 4.4816 8.1475 118.4597 54.6114 42.3726 176.4410 44 F 5.1572 8.8150 116.8863 55.4606 42.1931 173.0195 45 V 4.5327 8.2028 117.9648 61.5713 32.7029 175.0473 46 A 5.0067 8.8219 132.1380 49.8701 22.5113 173.3485 *48 P 4.5499 0.0000 0.0000 63.0998 33.0056 175.8535 49 S 5.3248 8.5202 114.5873 56.9165 66.7647 172.3297 50 K 4.8418 8.8823 120.5361 54.9567 36.3670 174.5534 51 R 3.9503 8.3855 123.9859 55.2855 30.8284 176.2419 52 T 4.0735 8.5761 123.8064 63.1408 69.3573 174.5013 53 P 4.1084 0.0000 0.0000 65.6421 31.6901 177.3524 54 D 4.3711 7.9078 116.3923 55.8474 39.4969 175.8005 55 G 3.3077 7.1053 109.9253 44.7820 0.0000 173.4496 56 E 4.4737 8.0687 119.5842 55.0126 31.4630 174.7577 57 F 5.2226 8.4632 117.9926 56.4556 40.9852 175.6789 58 R 4.8177 8.6055 119.4019 54.2602 34.6723 174.4129 59 D 4.8963 8.7536 122.4768 54.6504 40.7910 177.0367 60 I 3.9564 8.6567 124.6679 63.8559 37.5261 176.5131 61 T 4.7090 7.4284 113.4258 60.6200 70.2450 172.1454 62 H 4.6901 8.1419 120.8314 53.9471 30.6711 171.9609 63 P 4.4350 0.0000 0.0000 62.8150 31.7517 176.4960 64 I 3.9048 8.2456 120.0894 63.4406 38.5288 175.2597 65 N 4.9459 7.5688 116.7626 50.7427 41.2127 175.1077 66 S 4.1896 8.5847 115.2009 61.4266 63.1778 176.4727 67 S 4.1343 8.1286 117.7654 61.5467 62.8531 176.3950 68 T 4.0462 8.4700 113.2603 63.8488 68.5933 176.7291 69 R 4.0245 8.0399 122.1344 59.3562 30.0784 178.7106 70 G 3.6025 8.2167 105.6202 47.5386 0.0000 175.8154 71 K 3.9792 7.8920 120.5222 59.4492 32.2213 179.5275 72 I 3.7335 7.8318 119.9491 64.2143 37.0488 178.2665 73 Q 3.9351 8.4086 120.7245 59.2954 28.9849 177.7958 74 D 4.3261 8.5899 119.9541 57.4649 40.7799 178.4328 75 A 3.9906 7.8725 121.0661 55.6183 18.2271 179.9780 76 V 3.5765 7.6826 115.7878 66.1598 31.7026 178.3348 77 L 4.0226 8.4901 119.0900 57.5697 41.4203 179.2148 78 N 4.3563 8.2799 116.7318 56.3488 38.4221 177.0640 79 E 3.9621 7.9726 120.7782 59.2550 29.6017 178.2673 80 Y 4.0295 8.2349 120.0438 60.8272 38.8673 177.4145 81 H 3.9425 8.5787 117.4895 58.7280 28.6908 177.6103 82 R 3.7920 7.9510 120.2968 59.5996 29.9501 178.5659 83 L 4.1037 8.0961 118.8945 57.3059 41.7400 179.5598 84 G 3.2298 7.8106 105.9241 47.5504 0.0000 175.5111 85 D 4.5623 7.7370 122.0611 56.8823 40.7273 179.4380 86 T 3.9103 7.5137 116.7239 66.5765 68.5449 176.7525 87 E 4.6675 8.8704 121.0262 58.9942 29.3950 179.0313 88 A 4.0497 8.6114 122.0347 54.9023 18.4049 179.6006 89 L 4.0181 7.7476 117.8169 57.7459 41.8238 179.2886 90 E 3.9962 8.3541 118.7212 59.3263 29.1636 179.2327 91 F 4.1418 8.2967 119.5992 61.4510 39.3798 176.4483 92 E 3.9929 8.7795 118.6786 59.7075 28.7844 179.6672 93 E 3.9053 8.3104 117.7547 59.4292 29.5595 178.9922 94 A 4.0927 8.1630 119.7325 55.0583 18.3779 178.3187 95 G 3.5897 7.5310 102.0296 45.8594 0.0000 175.7136 96 A 3.8638 7.5934 125.4385 54.2593 18.9299 177.7904 97 S 4.2697 7.5471 114.3389 58.9018 62.7881 174.1798 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 8.42 4.75 0.00 2.85 2.90 0.00 0.00 5.77 6.38 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 A 7.75 4.48 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 2 E 8.36 4.69 0.00 1.96 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 2.32 2.16 0.00 3 V 8.42 4.33 2.08 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 0.83 0.00 0.00 0.94 0.00 0.00 4 T 8.85 4.04 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 1.10 0.00 0.00 5 D 7.88 4.88 0.00 2.72 2.41 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 6 V 8.24 4.79 2.08 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 0.87 0.00 0.00 0.92 0.00 0.00 7 R 9.23 4.77 0.00 1.73 1.77 0.00 3.12 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 8 L 8.39 5.43 0.00 1.49 1.57 0.93 0.95 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 9 R 9.17 4.47 0.00 1.83 1.99 0.00 2.91 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 10 R 8.50 3.70 0.00 1.96 1.95 0.00 3.10 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 11 V 7.62 4.00 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 1.08 0.00 0.00 0.99 0.00 0.00 12 N 9.68 4.16 0.00 2.91 2.81 0.00 0.00 6.18 5.12 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 13 T 7.25 4.26 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 1.21 0.00 0.00 14 D 7.52 4.71 0.00 2.58 2.40 0.00 0.00 0.00 0.00 0.00 0.00 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 8.70 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 16 R 9.08 4.48 0.00 1.84 1.86 0.00 3.20 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 *18 R 8.24 4.26 0.00 1.31 1.52 0.00 3.35 0.00 0.00 3.52 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.35 0.00 19 A 7.01 4.90 1.07 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 20 I 8.75 4.80 1.84 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 1.10 0.61 0.94 0.00 0.00 21 A 9.03 5.22 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 22 S 9.12 4.94 0.00 3.68 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.34 4.96 1.86 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 1.20 0.93 0.89 0.00 0.00 24 T 8.44 5.04 4.22 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 1.25 0.00 0.00 25 L 9.53 4.94 0.00 1.68 1.62 1.09 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 26 D 9.27 4.53 0.00 2.80 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 27 H 8.04 4.17 0.00 3.33 3.44 0.00 5.79 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.34 4.67 0.00 2.01 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 2.28 2.53 0.00 29 F 8.07 4.84 0.00 3.02 2.88 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 30 V 7.71 4.65 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 0.57 0.00 0.00 0.83 0.00 0.00 31 V 8.30 4.17 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 0.92 0.00 0.00 0.94 0.00 0.00 32 H 8.24 5.04 0.00 3.19 3.20 0.00 5.75 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.71 4.30 0.00 2.74 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 34 I 7.47 4.23 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.76 0.92 0.00 0.00 35 R 8.86 4.89 0.00 1.56 1.60 0.00 3.00 0.00 0.00 3.02 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.46 0.00 36 V 8.23 4.17 1.61 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 0.25 0.00 0.00 0.71 0.00 0.00 37 I 7.55 4.48 0.69 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 0.87 0.09 0.96 0.00 0.00 38 D 8.65 4.82 0.00 2.65 2.59 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 39 G 8.53 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 40 N 8.68 4.75 0.00 2.84 2.94 0.00 0.00 5.66 8.04 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 41 N 7.77 4.90 0.00 2.65 2.80 0.00 0.00 7.14 7.65 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 42 G 8.36 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 43 L 8.15 4.48 0.00 1.69 1.53 1.18 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.82 5.16 0.00 2.99 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 45 V 8.20 4.53 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 0.71 0.00 0.00 0.89 0.00 0.00 46 A 8.82 5.01 1.19 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 0.00 0.00 *48 P 0.00 4.55 0.00 2.18 2.34 0.00 3.67 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.13 0.00 49 S 8.52 5.32 0.00 4.09 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 50 K 8.88 4.84 0.00 1.89 1.67 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.44 7.81 51 R 8.39 3.95 0.00 1.63 1.65 0.00 3.17 0.00 0.00 3.06 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.82 0.00 52 T 8.58 4.07 4.32 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 1.19 0.00 0.00 53 P 0.00 4.11 0.00 2.02 2.05 0.00 3.63 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 2.00 2.11 0.00 54 D 7.91 4.37 0.00 2.75 2.77 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 55 G 7.11 3.31 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 56 E 8.07 4.47 0.00 2.13 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 2.41 2.25 0.00 57 F 8.46 5.22 0.00 2.94 3.03 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 58 R 8.61 4.82 0.00 1.71 1.78 0.00 3.30 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 59 D 8.75 4.90 0.00 2.57 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 60 I 8.66 3.96 2.04 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 1.23 0.52 0.96 0.00 0.00 61 T 7.43 4.71 4.30 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 1.26 0.00 0.00 62 H 8.14 4.69 0.00 3.24 3.24 0.00 5.78 0.00 0.00 0.00 0.00 6.72 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 4.43 0.00 2.42 2.12 0.00 3.85 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 64 I 8.25 3.90 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.70 0.91 0.00 0.00 65 N 7.57 4.95 0.00 2.99 2.89 0.00 0.00 6.05 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 66 S 8.58 4.19 0.00 4.08 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 67 S 8.13 4.13 0.00 4.08 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 68 T 8.47 4.05 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 1.27 0.00 0.00 69 R 8.04 4.02 0.00 1.96 2.14 0.00 3.13 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 70 G 8.22 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.89 3.98 0.00 2.07 1.89 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.50 7.81 72 I 7.83 3.73 2.02 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 1.42 1.16 0.92 0.00 0.00 73 Q 8.41 3.94 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 74 D 8.59 4.33 0.00 2.95 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 75 A 7.87 3.99 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 76 V 7.68 3.58 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 1.07 0.00 0.00 0.99 0.00 0.00 77 L 8.49 4.02 0.00 1.94 1.67 0.85 0.80 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 78 N 8.28 4.36 0.00 3.04 2.88 0.00 0.00 6.56 6.97 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 79 E 7.97 3.96 0.00 2.20 2.08 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 2.46 2.37 0.00 80 Y 8.23 4.03 0.00 3.00 3.02 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 81 H 8.58 3.94 0.00 3.14 3.26 0.00 5.70 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 R 7.95 3.79 0.00 1.94 2.07 0.00 3.07 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 83 L 8.10 4.10 0.00 1.69 1.67 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 84 G 7.81 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 0.00 0.00 0.00 85 D 7.74 4.56 0.00 2.80 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 86 T 7.51 3.91 4.35 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 1.20 0.00 0.00 87 E 8.87 4.67 0.00 2.19 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 0.00 2.27 2.49 0.00 88 A 8.61 4.05 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 89 L 7.75 4.02 0.00 1.85 1.73 0.98 0.88 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 90 E 8.35 4.00 0.00 2.26 2.05 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 2.35 2.54 0.00 91 F 8.30 4.14 0.00 3.09 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 92 E 8.78 3.99 0.00 2.11 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 2.40 2.59 0.00 93 E 8.31 3.91 0.00 2.21 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 2.30 2.31 0.00 94 A 8.16 4.09 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 95 G 7.53 3.59 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 0.00 96 A 7.59 3.86 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 97 S 7.55 4.27 0.00 3.92 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 * Residues marked with a * may have inaccurate shift predictions.