NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7618 8.3549 109.7293 45.5684 0.0000 173.6291 *2 Q 4.4594 8.4157 117.3130 55.7188 31.3024 174.2662 3 Y 5.3619 6.8337 114.9302 56.3370 41.1074 173.6258 4 I 4.5906 8.9066 119.8643 59.3558 41.7009 173.7142 5 K 4.4445 8.8263 131.1842 55.2180 31.6506 176.0975 6 I 3.9262 8.3792 129.7605 63.7587 37.6780 176.3719 7 H 4.8730 8.2553 117.6613 53.6585 32.9059 173.6054 8 A 3.9814 8.5516 127.7135 55.4376 18.1768 178.9149 9 L 4.2663 8.0448 113.0137 56.2130 42.2384 177.2114 10 D 4.6150 7.9345 119.3884 54.5034 41.3056 175.6179 11 N 4.9855 8.5411 118.2331 52.6384 38.5603 174.1205 12 V 4.8304 7.5694 110.7154 59.7961 35.7839 174.5964 13 A 4.6655 7.8098 123.6538 50.0214 22.6441 175.0972 14 V 4.6574 8.4222 120.5835 61.1364 33.5646 175.2196 15 A 4.6669 9.3191 130.9598 52.4514 19.0565 177.5621 16 L 4.7136 9.0800 121.4988 54.7926 42.7804 175.8732 17 A 4.7455 7.7098 119.1771 50.1287 22.8753 175.4979 18 D 4.6071 8.7032 119.3333 54.6539 41.3827 176.2156 19 L 4.8339 9.1232 123.9968 52.6890 44.6938 175.9955 20 A 4.6562 8.4333 124.5997 51.0225 20.0261 176.4502 21 E 3.8709 8.9196 121.8854 58.2382 29.9929 177.9401 22 G 3.9614 8.9088 114.1276 45.3534 0.0000 173.8290 23 T 4.0013 7.6409 117.8853 63.6668 69.5208 173.2603 24 E 4.7221 8.7252 126.0624 55.3888 30.8473 175.7040 25 V 4.4459 9.0710 124.9899 60.9918 34.5095 174.2326 26 S 5.2213 8.7610 121.5214 56.5472 64.7633 173.7001 27 V 4.5903 8.9944 127.0293 61.5811 35.3165 174.3292 28 D 4.0998 8.5216 126.2876 56.6732 40.1110 174.5208 29 N 4.8824 8.9655 123.6700 52.7932 37.6066 173.8194 30 Q 4.7165 8.3387 118.7513 55.2513 31.3089 174.6010 31 T 5.1361 8.4998 118.4686 61.9349 71.5091 173.6974 32 V 4.5920 8.7031 119.0329 59.7507 35.8749 174.6199 33 T 4.9020 8.1287 119.0314 61.4413 71.1586 173.8179 34 L 4.2297 8.5923 127.2387 55.2847 42.3093 178.0713 35 R 4.4415 8.7048 121.8944 57.0361 30.8261 175.8207 36 Q 4.5947 7.5018 115.2477 54.8352 31.5048 173.6913 37 D 4.6992 8.6381 119.8848 54.5260 41.8224 176.2152 38 V 4.4129 8.7487 122.4651 60.8674 34.4549 174.7621 39 A 4.7129 8.5412 129.5686 51.0813 19.8185 176.9102 40 R 4.2062 8.9771 117.6734 57.8778 29.7925 177.4784 41 G 4.0194 9.3456 109.0852 45.6898 0.0000 173.2850 42 H 5.0888 7.9947 117.0568 54.6169 31.1641 174.1973 43 K 5.2370 8.5681 118.3087 55.1502 35.9845 174.8180 44 F 5.5859 8.0656 115.3139 54.7090 41.8937 173.9034 45 A 4.6199 9.0467 122.6478 52.3002 18.7909 178.4303 46 L 4.5501 8.7118 121.8894 56.4254 42.5249 176.3810 47 T 4.6104 7.4917 111.3900 60.5100 70.5942 172.6180 48 D 4.7212 8.7140 124.4110 54.6986 41.7729 176.2845 49 I 4.5133 8.7175 123.2149 59.1586 39.9733 175.1643 50 A 4.4733 8.6074 129.2918 51.1632 19.7633 176.4412 51 K 3.7736 8.8777 121.7672 58.4756 32.4729 177.5176 52 G 3.8376 9.0207 114.2475 45.2653 0.0000 173.2812 53 A 4.5825 7.8637 121.7908 50.9820 20.5020 176.6255 54 N 4.8509 8.6934 116.8768 53.3544 39.6226 175.0776 55 V 4.1391 8.8866 123.8477 62.0711 33.2746 174.5466 56 I 4.8941 8.9767 129.0429 59.3786 40.0089 174.8570 57 K 4.5574 8.7699 127.0836 56.1473 35.2072 175.8150 58 Y 3.5810 9.1063 120.8756 58.5771 35.3024 170.2568 59 G 3.5407 8.8880 106.9911 45.6831 0.0000 173.7643 60 L 4.7661 7.6681 118.7677 51.4366 45.0235 174.3142 61 P 4.6285 0.0000 0.0000 62.9763 31.5645 175.9840 62 I 4.1978 8.5743 117.2520 60.1873 39.5491 175.3275 63 G 3.9847 6.6419 109.0366 46.7605 0.0000 170.8656 64 Y 5.5392 7.7384 116.3585 55.6300 41.4330 175.8467 65 A 4.5033 8.8317 125.1383 52.4128 19.0130 178.5531 66 L 4.2094 8.8079 122.1058 56.7128 42.5128 176.5180 67 A 4.7296 7.6503 118.1525 50.0275 22.6962 175.4816 68 D 4.6502 8.7216 118.9293 54.9420 41.7408 176.5756 69 I 4.6438 8.6801 123.2813 59.3088 40.0206 174.9823 70 A 4.6499 9.3396 129.9513 51.0094 19.7564 176.5741 71 A 4.0178 8.8150 124.0365 54.4072 18.8872 178.5421 72 G 4.0142 9.5575 111.1166 46.1196 0.0000 172.5750 73 E 4.8229 8.1108 121.2675 55.2010 31.3699 175.0610 74 H 4.8208 9.0971 125.9275 56.6594 30.6403 174.5486 75 V 4.3942 8.6810 126.0985 61.9029 33.2480 173.7560 76 H 4.4656 9.0720 129.6902 55.7049 32.1479 173.5788 77 A 4.1453 8.8166 119.3269 55.3525 18.4810 178.9217 78 H 4.4186 8.3515 110.7798 58.0713 28.9410 175.7678 79 N 5.1770 8.0316 115.4284 52.3263 39.2693 173.8629 80 T 5.0898 7.8410 107.6317 60.5098 72.4634 172.8651 81 R 4.5755 8.8297 124.2963 54.9102 31.8999 175.4182 82 T 4.5990 8.6437 123.8549 63.4405 69.1870 174.3291 83 N 4.8861 8.4920 121.3268 52.4501 38.1077 174.7849 84 L 4.1496 7.8191 124.1427 55.3922 41.7464 176.6712 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 0 G 8.35 3.76 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 0.00 0.00 0.00 *2 Q 8.42 4.46 0.00 2.01 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.61 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 3 Y 6.83 5.36 0.00 3.16 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 4 I 8.91 4.59 1.89 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 1.13 1.71 0.94 0.00 0.00 5 K 8.83 4.44 0.00 1.82 1.76 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.50 1.40 7.81 6 I 8.38 3.93 1.98 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.62 1.06 0.00 0.00 7 H 8.26 4.87 0.00 3.13 3.39 0.00 5.61 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 A 8.55 3.98 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 9 L 8.04 4.27 0.00 1.68 1.73 0.94 1.06 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 10 D 7.93 4.62 0.00 2.70 2.66 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 0.00 11 N 8.54 4.99 0.00 2.77 2.95 0.00 0.00 6.80 8.42 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 12 V 7.57 4.83 1.86 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 0.61 0.00 0.00 0.77 0.00 0.00 13 A 7.81 4.67 0.69 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 0.00 0.00 14 V 8.42 4.66 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 1.10 0.00 0.00 0.86 0.00 0.00 15 A 9.32 4.67 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.08 4.71 0.00 1.52 1.72 0.91 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 17 A 7.71 4.75 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 18 D 8.70 4.61 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 19 L 9.12 4.83 0.00 1.43 1.46 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.43 4.66 1.21 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 0.00 0.00 0.00 21 E 8.92 3.87 0.00 1.89 1.87 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 2.31 2.17 0.00 22 G 8.91 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 0.00 0.00 0.00 23 T 7.64 4.00 4.15 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 0.00 0.00 0.00 1.19 0.00 0.00 24 E 8.73 4.72 0.00 1.85 1.88 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 2.25 2.28 0.00 25 V 9.07 4.45 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 0.20 0.00 0.00 0.54 0.00 0.00 26 S 8.76 5.22 0.00 3.91 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 27 V 8.99 4.59 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 0.65 0.00 0.00 1.03 0.00 0.00 28 D 8.52 4.10 0.00 2.81 1.88 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 29 N 8.97 4.88 0.00 2.73 2.68 0.00 0.00 6.31 7.46 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 30 Q 8.34 4.72 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 31 T 8.50 5.14 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 1.26 0.00 0.00 32 V 8.70 4.59 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 0.80 0.00 0.00 0.96 0.00 0.00 33 T 8.13 4.90 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 1.20 0.00 0.00 34 L 8.59 4.23 0.00 1.54 1.58 0.62 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.70 4.44 0.00 1.70 1.96 0.00 3.32 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 36 Q 7.50 4.59 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.93 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 37 D 8.64 4.70 0.00 2.56 2.62 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 38 V 8.75 4.41 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 1.01 0.00 0.00 0.97 0.00 0.00 39 A 8.54 4.71 1.10 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 0.00 0.00 40 R 8.98 4.21 0.00 1.91 1.89 0.00 3.11 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 41 G 9.35 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 0.00 0.00 0.00 42 H 7.99 5.09 0.00 3.34 3.34 0.00 5.58 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.57 5.24 0.00 1.71 1.77 0.00 1.27 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.30 7.81 44 F 8.07 5.59 0.00 3.22 3.13 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 45 A 9.05 4.62 1.41 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 0.00 0.00 46 L 8.71 4.55 0.00 1.48 1.81 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 47 T 7.49 4.61 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 1.20 0.00 0.00 48 D 8.71 4.72 0.00 2.60 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 49 I 8.72 4.51 1.87 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 1.15 0.93 0.92 0.00 0.00 50 A 8.61 4.47 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 51 K 8.88 3.77 0.00 1.80 1.76 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.45 1.46 7.81 52 G 9.02 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 53 A 7.86 4.58 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 54 N 8.69 4.85 0.00 2.62 2.69 0.00 0.00 6.85 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 55 V 8.89 4.14 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 0.94 0.00 0.00 0.89 0.00 0.00 56 I 8.98 4.89 1.81 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 1.06 0.96 0.96 0.00 0.00 57 K 8.77 4.56 0.00 1.36 1.07 0.00 1.38 0.00 0.00 0.92 0.00 0.00 2.50 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.30 0.81 7.81 58 Y 9.11 3.58 0.00 3.16 2.99 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 0.00 0.00 0.00 59 G 8.89 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.67 4.77 0.00 1.86 1.53 0.96 0.77 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 61 P 0.00 4.63 0.00 2.01 2.05 0.00 3.71 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 1.93 1.91 0.00 62 I 8.57 4.20 1.88 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.61 1.05 0.00 0.00 63 G 6.64 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 64 Y 7.74 5.54 0.00 2.92 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 65 A 8.83 4.50 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 66 L 8.81 4.21 0.00 1.53 1.74 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.65 4.73 1.17 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 0.00 0.00 68 D 8.72 4.65 0.00 2.58 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 69 I 8.68 4.64 1.87 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 1.15 1.05 0.92 0.00 0.00 70 A 9.34 4.65 1.24 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 0.00 0.00 0.00 71 A 8.82 4.02 1.24 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 0.00 0.00 0.00 72 G 9.56 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 0.00 0.00 0.00 73 E 8.11 4.82 0.00 2.23 1.90 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 2.35 2.39 0.00 74 H 9.10 4.82 0.00 3.25 3.29 0.00 5.77 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.68 4.39 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 0.73 0.00 0.00 1.00 0.00 0.00 76 H 9.07 4.47 0.00 2.92 3.08 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.82 4.15 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 78 H 8.35 4.42 0.00 3.29 3.43 0.00 5.48 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.03 5.18 0.00 2.75 2.84 0.00 0.00 6.29 6.73 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 80 T 7.84 5.09 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 1.19 0.00 0.00 81 R 8.83 4.58 0.00 1.93 1.93 0.00 3.16 0.00 0.00 3.21 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 82 T 8.64 4.60 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 1.25 0.00 0.00 83 N 8.49 4.89 0.00 2.80 2.84 0.00 0.00 7.00 7.90 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 84 L 7.82 4.15 0.00 1.66 1.62 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.