NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 5.0798 8.3481 122.2711 50.9012 21.6020 176.4813 3 Q 4.7219 7.5569 112.1291 55.6337 29.9869 170.1077 4 K 4.1803 8.3855 118.0534 56.1777 37.2844 174.5935 5 T 5.1162 8.3035 120.6485 61.8512 70.6375 173.6928 6 F 5.1077 9.5687 125.5741 55.9111 42.8285 175.2716 7 T 4.9684 8.5566 113.1377 60.1336 69.4942 173.6309 8 V 4.1179 8.7227 128.7207 62.8884 31.9387 176.3766 9 T 4.3513 9.0284 119.9223 61.4377 68.8364 174.1264 10 A 4.1652 8.0449 125.1054 52.7905 19.1459 177.8746 11 D 4.5193 8.7951 123.8876 57.7510 40.9664 178.5023 12 S 4.4393 8.0806 111.0945 57.8512 64.1596 176.3583 13 G 3.7743 8.4702 109.9503 46.6397 0.0000 177.3678 14 I 4.1258 7.9616 118.1756 59.7829 35.9426 173.7924 15 H 4.7480 7.6551 120.7445 54.0095 34.1441 173.4730 16 A 3.5560 8.5846 121.8158 53.0108 17.2872 178.4576 17 R 3.8819 8.8203 111.1993 60.2809 30.2466 176.9010 18 P 5.2924 0.0000 0.0000 65.0125 31.3083 177.8890 19 A 3.9276 8.2030 118.9943 55.9887 18.1911 179.8489 20 T 3.9047 8.2560 113.6862 66.4761 68.4146 176.6230 21 T 4.1408 7.9756 118.1425 65.8785 68.7431 176.6123 22 L 4.0099 7.8150 121.8008 58.1762 41.8837 178.7197 23 V 4.1159 7.5846 117.5719 64.0473 31.7942 177.1342 24 Q 4.1734 7.3948 119.0976 58.9811 29.0299 177.3317 25 A 4.0688 8.5435 121.8447 54.6926 18.1973 178.5607 26 A 4.5606 7.6695 117.0126 53.3141 19.0012 178.5329 27 S 4.5655 7.8107 112.5689 58.8250 63.7893 175.6468 28 K 4.0343 7.4612 118.7956 56.1625 32.3022 176.4735 29 F 4.9885 7.3167 117.8878 55.2957 41.3161 175.2678 30 D 4.4905 9.1438 125.4482 57.2747 40.9031 177.0256 31 S 4.2933 7.9246 112.5090 58.8682 64.0706 174.4381 32 D 4.7242 8.8329 120.4837 53.6726 41.7593 175.6945 33 I 4.9360 8.2977 124.8255 59.8090 39.6005 174.7574 34 N 5.4550 9.5255 122.8899 51.3803 43.0811 173.1527 35 L 5.9294 8.8007 123.7917 52.3732 45.1755 174.5735 36 E 5.2291 8.7719 127.0350 54.8170 32.6352 174.3192 37 F 4.8475 9.4910 127.3644 57.7413 43.4654 173.5769 38 N 3.4842 9.1659 123.7881 54.4326 37.0054 174.8544 39 G 3.9501 8.4665 103.5317 44.4957 0.0000 174.0163 40 K 4.7016 7.8769 118.8278 55.1061 35.0712 175.0777 41 T 5.2639 8.2334 116.0872 62.1651 71.8050 173.8157 42 V 4.5651 8.8526 116.9468 59.3145 36.6822 174.1825 43 N 4.6646 8.8184 122.7044 53.7748 38.9949 174.6139 44 L 4.0005 8.8111 128.2704 56.4604 42.9217 176.9534 45 K 4.5325 8.8325 119.8870 55.5362 31.1055 175.3561 *47 I 4.1303 7.4667 121.5980 60.9523 40.0786 177.0412 48 M 4.2638 8.0786 117.9514 57.4990 32.4293 177.8228 49 G 3.7734 7.8658 105.5831 47.3185 0.0000 175.8553 50 V 3.6240 7.5813 120.5344 66.0409 31.5264 177.7783 51 M 3.9987 7.6624 116.9529 57.9468 31.8502 177.9519 52 S 4.5401 7.3454 110.6159 58.5631 63.6044 174.8283 53 L 4.1526 7.9451 123.4290 56.2481 42.3960 175.9420 54 G 3.5501 7.7691 104.9106 45.8042 0.0000 172.1164 55 I 3.3950 6.9046 120.8373 60.6551 38.5236 176.4702 56 Q 4.4585 8.2482 124.2674 53.7093 30.5562 174.9497 57 K 4.1060 8.2304 120.2374 58.0381 32.5386 176.9138 58 G 3.9926 9.6431 113.7642 45.3378 0.0000 173.8764 59 A 4.5510 7.8202 121.6092 52.1471 20.0487 176.4499 60 T 5.2252 8.6423 109.5735 60.0034 70.6022 173.5393 61 I 4.9534 8.8966 119.9403 59.2095 41.4552 174.8078 62 T 5.0726 8.6321 120.5210 62.1184 71.0642 173.1689 63 I 4.8267 8.7517 129.0123 60.3752 38.9181 175.3834 64 S 5.2103 10.0372 122.3551 56.4373 66.1852 172.6473 65 A 5.1956 8.9577 126.3283 50.1310 21.7809 175.5652 66 E 4.4336 9.5119 119.7543 56.7826 32.1520 175.3088 67 G 4.0809 9.9033 115.2522 45.3356 0.0000 170.9708 68 S 4.0791 8.6308 114.0031 61.3940 62.6537 175.1224 69 D 4.8765 8.1582 118.3942 53.3725 39.8694 178.7153 70 E 3.6165 8.0054 121.1154 59.1233 29.1579 178.9372 71 A 3.9869 8.0005 120.4499 55.5123 18.3388 178.9303 72 D 4.1839 7.9015 116.7734 57.5475 40.7202 179.3488 73 A 2.5800 6.9646 120.1432 54.4166 17.9860 179.0583 74 L 4.1125 8.3398 119.1317 58.4320 41.7786 179.1378 75 A 3.7131 8.6967 120.7626 54.4288 18.2827 179.2375 76 A 4.0610 7.4807 119.6276 54.5655 18.8401 178.7856 77 L 4.3279 8.5831 115.6616 55.0652 41.9019 177.5903 78 E 4.6273 7.5849 120.5200 58.2408 30.4192 177.2066 79 D 4.3069 7.4966 117.5403 57.7888 41.3392 177.9725 80 T 4.2336 7.8179 115.6470 67.3189 68.5475 175.6261 81 M 3.6886 8.0849 118.9904 59.3602 32.1856 178.3800 82 S 4.2223 8.3908 114.2158 61.0305 63.2880 176.4040 83 K 4.2943 9.0658 122.6346 58.9092 32.4265 177.9221 84 E 4.5684 8.7715 118.4260 54.3641 30.9998 175.4386 85 G 4.1017 7.8493 105.0421 46.5881 0.0000 172.5165 86 L 4.5274 8.7650 121.4665 55.6864 44.6350 176.8447 87 G 4.7141 7.6706 104.1655 43.5626 0.0000 171.7752 88 E 4.3143 8.8926 118.7746 56.2346 29.8566 175.4790 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 2 A 8.35 5.08 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 Q 7.56 4.72 0.00 2.41 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.82 0.00 0.00 0.00 0.00 0.00 2.07 2.38 0.00 4 K 8.39 4.18 0.00 1.58 1.13 0.00 1.26 0.00 0.00 0.90 0.00 0.00 2.79 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.56 1.00 7.81 5 T 8.30 5.12 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 1.28 0.00 0.00 6 F 9.57 5.11 0.00 2.80 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 7 T 8.56 4.97 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 8 V 8.72 4.12 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 0.91 0.00 0.00 0.92 0.00 0.00 9 T 9.03 4.35 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 1.29 0.00 0.00 10 A 8.04 4.17 1.36 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 0.00 0.00 0.00 11 D 8.80 4.52 0.00 2.66 2.76 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 12 S 8.08 4.44 0.00 3.85 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 13 G 8.47 3.77 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 0.00 0.00 0.00 14 I 7.96 4.13 1.65 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.48 0.77 0.00 0.00 15 H 7.66 4.75 0.00 3.22 3.11 0.00 5.76 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 16 A 8.58 3.56 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 17 R 8.82 3.88 0.00 1.80 1.98 0.00 3.25 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 18 P 0.00 5.29 0.00 2.28 2.02 0.00 4.26 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 19 A 8.20 3.93 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 20 T 8.26 3.90 4.23 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 1.20 0.00 0.00 21 T 7.98 4.14 4.43 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 1.20 0.00 0.00 22 L 7.82 4.01 0.00 1.69 1.61 0.78 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.58 4.12 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 1.23 0.00 0.00 0.96 0.00 0.00 24 Q 7.39 4.17 0.00 2.36 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 25 A 8.54 4.07 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 26 A 7.67 4.56 1.40 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 0.00 0.00 27 S 7.81 4.57 0.00 3.98 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 28 K 7.46 4.03 0.00 1.34 1.31 0.00 1.52 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.53 1.44 7.81 29 F 7.32 4.99 0.00 3.05 3.22 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 30 D 9.14 4.49 0.00 2.85 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 31 S 7.92 4.29 0.00 3.85 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 32 D 8.83 4.72 0.00 2.93 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 33 I 8.30 4.94 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.21 0.98 0.00 0.00 34 N 9.53 5.45 0.00 2.64 2.67 0.00 0.00 6.23 7.35 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 35 L 8.80 5.93 0.00 1.75 1.49 0.95 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.77 5.23 0.00 2.11 1.81 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 2.31 2.29 0.00 37 F 9.49 4.85 0.00 3.07 2.85 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 38 N 9.17 3.48 0.00 1.44 2.43 0.00 0.00 7.28 7.98 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 39 G 8.47 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 40 K 7.88 4.70 0.00 1.97 1.92 0.00 1.31 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.52 7.81 41 T 8.23 5.26 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 1.24 0.00 0.00 42 V 8.85 4.57 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 1.02 0.00 0.00 43 N 8.82 4.66 0.00 2.74 2.76 0.00 0.00 6.97 7.78 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 44 L 8.81 4.00 0.00 1.96 1.66 0.92 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.83 4.53 0.00 1.78 1.75 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.54 7.81 *47 I 7.47 4.13 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.34 0.90 0.00 0.00 48 M 8.08 4.26 0.00 2.05 2.07 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 2.58 2.60 0.00 49 G 7.87 3.77 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 0.00 0.00 0.00 50 V 7.58 3.62 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 0.97 0.00 0.00 0.90 0.00 0.00 51 M 7.66 4.00 0.00 2.03 2.41 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 52 S 7.35 4.54 0.00 4.08 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 53 L 7.95 4.15 0.00 1.50 1.70 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 54 G 7.77 3.55 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 55 I 6.90 3.39 1.49 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 -0.36 0.70 0.00 0.00 56 Q 8.25 4.46 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 7.03 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 57 K 8.23 4.11 0.00 1.85 1.73 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.37 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.48 7.81 58 G 9.64 3.99 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 0.00 0.00 0.00 59 A 7.82 4.55 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.64 5.23 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 61 I 8.90 4.95 1.98 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.31 1.01 0.00 0.00 62 T 8.63 5.07 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 1.27 0.00 0.00 63 I 8.75 4.83 2.32 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.84 1.00 0.00 0.00 64 S 10.04 5.21 0.00 3.70 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 65 A 8.96 5.20 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.51 4.43 0.00 2.03 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 2.31 2.29 0.00 67 G 9.90 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 0.00 0.00 0.00 68 S 8.63 4.08 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 69 D 8.16 4.88 0.00 3.09 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.01 3.62 0.00 1.96 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 0.00 2.35 2.56 0.00 71 A 8.00 3.99 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 72 D 7.90 4.18 0.00 2.60 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 73 A 6.96 2.58 0.75 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 74 L 8.34 4.11 0.00 1.86 1.63 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.70 3.71 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 76 A 7.48 4.06 1.42 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 0.00 0.00 77 L 8.58 4.33 0.00 1.54 1.68 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 78 E 7.58 4.63 0.00 2.25 1.97 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 0.00 2.27 2.48 0.00 79 D 7.50 4.31 0.00 2.69 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 80 T 7.82 4.23 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 1.19 0.00 0.00 81 M 8.08 3.69 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.29 0.00 82 S 8.39 4.22 0.00 4.14 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 0.00 83 K 9.07 4.29 0.00 1.79 2.11 0.00 1.58 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.58 1.48 7.81 84 E 8.77 4.57 0.00 2.15 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 2.23 2.42 0.00 85 G 7.85 4.10 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 0.00 86 L 8.76 4.53 0.00 1.57 1.57 0.83 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 87 G 7.67 4.71 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 88 E 8.89 4.31 0.00 1.96 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 2.20 2.29 0.00 * Residues marked with a * may have inaccurate shift predictions.