NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 I 4.0692 8.0244 120.7870 60.1945 38.7272 174.8624 13 Q 3.9273 7.8304 122.9627 54.9839 30.0068 174.0107 14 Q 4.4592 8.9012 120.6849 57.8075 30.9424 175.8230 15 Y 4.7175 7.7557 116.7725 55.8349 39.6960 174.4678 16 L 3.5856 8.0720 118.7278 54.7594 42.2462 176.7806 17 V 3.2982 8.2021 124.8325 63.1109 31.5852 175.2910 18 E 3.9372 8.7708 126.1404 57.1579 29.8414 177.5018 19 S 4.2405 8.8116 117.6562 60.4281 62.8639 174.1345 20 G 4.2299 7.8126 106.4679 42.8777 0.0000 170.9014 21 N 5.1503 8.0209 116.8123 50.1840 42.0152 174.5745 22 Y 3.3801 8.3729 119.6566 60.7151 38.7024 177.6996 23 E 4.0574 8.1359 119.1451 58.8647 29.7147 178.8534 24 L 3.8535 7.9224 120.6433 58.1744 42.2226 179.0138 25 I 3.5150 7.2779 119.7092 64.3800 36.9427 178.4231 26 S 3.9382 7.6515 113.7219 61.1608 62.1272 175.9692 27 N 4.3495 7.8952 119.4499 55.9443 38.2744 177.0569 28 E 3.8936 8.0280 120.7921 58.9864 29.8674 178.5713 29 L 3.8310 7.8436 120.4852 57.9755 42.1973 178.9000 30 K 3.9127 7.9978 119.4196 59.2928 32.0755 178.7490 31 A 4.0193 7.9435 121.2716 55.0017 18.2904 179.7957 32 R 3.8280 7.9596 116.6144 59.4512 30.1145 179.2524 33 L 3.9692 7.6916 118.3564 57.7310 41.5768 179.4053 34 L 4.0382 7.8690 119.8542 58.2184 41.8212 178.8463 35 Q 4.0510 7.9703 118.6727 58.8615 29.0993 177.2433 36 E 4.2971 8.1382 117.7824 56.2953 29.9007 177.3772 37 G 3.9906 8.0280 107.4562 46.2747 0.0000 175.5764 38 W 4.1274 8.4515 132.2817 60.2884 30.5261 178.2409 39 V 3.4380 8.0184 117.7780 65.8262 30.9975 177.5861 40 D 4.3567 7.8709 118.3748 56.9517 40.7696 178.6647 41 K 3.9006 7.9334 119.2544 59.1294 32.0173 179.6768 42 V 3.2462 7.2782 118.6034 65.6396 31.4346 178.0590 43 K 3.8621 7.8067 119.3724 59.5385 31.9914 178.5422 44 D 4.3314 8.1802 119.3441 57.0673 40.8022 178.4751 45 L 3.9704 7.8449 120.8098 58.0499 41.8811 179.3481 46 T 3.8241 7.7169 116.0368 66.5057 68.3512 176.8802 47 K 3.9183 7.8093 120.1771 59.5252 31.9588 179.5394 48 S 4.1606 8.1487 114.4773 61.3619 62.9880 176.4157 49 E 3.9571 8.2325 122.1688 59.2511 28.9651 179.0638 50 M 4.0901 8.1488 118.2774 57.8123 32.0192 177.8036 51 N 4.4957 7.5689 116.9536 56.1804 39.2779 176.7046 52 I 3.9359 7.8555 120.6963 62.9728 37.1104 175.8176 53 N 4.8417 7.4746 118.8172 51.3237 39.4990 175.7321 54 E 3.8347 9.0047 123.9331 59.5221 29.7402 177.6336 55 S 4.0984 7.2150 110.9719 58.0902 62.6696 172.2343 *57 N 4.5253 8.3885 117.4240 53.3690 39.7066 174.9929 58 F 4.2053 8.8754 127.4750 61.6577 40.2279 177.4022 59 T 3.6641 8.6696 117.7311 66.3462 68.1718 176.5736 60 Q 3.8697 8.2254 120.9555 59.4180 29.0137 178.2495 61 I 3.6569 7.4259 120.7629 64.2693 37.1432 178.2747 62 L 3.7166 7.7722 121.2664 57.9790 41.5329 178.9815 63 S 4.0578 7.7262 112.5064 61.5535 62.3535 175.9314 64 T 4.0664 7.2504 117.0934 66.0676 68.5408 176.7036 65 V 3.7753 7.3563 120.0716 65.2678 31.5982 177.8393 66 E 3.9107 8.1965 119.1533 58.7845 29.5257 176.8955 67 P 4.2483 0.0000 0.0000 65.6067 31.4654 178.5565 68 K 3.9974 8.0188 117.6603 59.2784 31.9991 178.4948 69 A 4.1182 7.8741 120.3457 55.2174 18.7410 179.3096 70 L 4.1924 8.2613 117.5552 58.0189 41.5082 179.3850 71 E 4.1012 7.8502 117.7838 59.4698 29.5937 178.5091 72 M 4.3415 8.0033 118.2183 56.7466 32.1688 177.2323 73 V 3.4849 6.9371 118.1315 62.8148 32.1591 175.9479 74 S 4.3612 8.5710 121.3913 58.4667 63.6562 175.0460 75 D 4.3379 8.6104 120.9406 57.5319 40.5563 178.5266 76 S 4.0417 8.0711 113.1799 61.7751 62.1709 175.9620 77 T 3.7977 7.9359 117.9316 66.9469 68.2466 176.6730 78 R 3.8170 8.0147 120.1625 59.2331 30.1457 178.2196 79 E 4.0813 8.3566 118.4807 59.1727 29.6782 179.1500 80 T 3.9166 7.9724 116.0478 66.4243 68.4906 176.9554 81 V 3.6756 7.5388 120.0162 65.4127 31.5555 178.1335 82 L 3.9733 7.6880 118.9921 57.5055 41.3306 179.3001 83 K 3.9472 7.9180 119.2059 59.5629 31.9253 178.7430 84 Q 3.9674 7.6511 118.4167 58.9342 29.1999 178.0092 85 I 4.0471 7.9560 121.0362 64.3219 37.3028 178.0534 86 R 3.9149 8.0348 119.4958 59.7939 29.7312 178.3083 87 E 4.1825 8.4304 116.1823 58.1118 29.4547 177.8900 88 F 5.1477 7.8331 120.7625 57.5015 39.4888 176.0353 89 L 4.2356 7.6108 118.6497 56.2743 42.8702 178.0940 90 E 3.9173 8.1397 118.6355 58.9655 29.1406 178.8183 91 E 3.8534 8.0321 117.0625 59.8964 29.3158 179.5651 92 I 3.5466 6.8735 119.4650 64.2589 37.2395 177.7812 93 V 3.5396 7.7020 114.4778 64.8777 31.5095 176.7798 94 D 4.3626 8.1278 121.3020 54.5376 38.9923 179.3569 95 T 4.1695 7.4872 116.6083 59.0903 68.3969 170.0660 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 12 I 8.02 4.07 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 1.30 1.35 0.90 0.00 0.00 13 Q 7.83 3.93 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 14 Q 8.90 4.46 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.15 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 15 Y 7.76 4.72 0.00 2.89 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 16 L 8.07 3.59 0.00 1.70 1.56 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.20 3.30 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 0.80 0.00 0.00 0.77 0.00 0.00 18 E 8.77 3.94 0.00 2.00 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 2.35 2.37 0.00 19 S 8.81 4.24 0.00 3.82 3.89 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 7.81 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 0.00 0.00 0.00 0.00 21 N 8.02 5.15 0.00 3.00 2.96 0.00 0.00 5.60 7.57 0.00 0.00 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 Y 8.37 3.38 0.00 3.17 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 23 E 8.14 4.06 0.00 2.11 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 0.00 2.43 2.48 0.00 24 L 7.92 3.85 0.00 1.95 1.57 0.85 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.28 3.51 1.34 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.48 0.66 0.00 0.00 26 S 7.65 3.94 0.00 3.68 3.89 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 27 N 7.90 4.35 0.00 2.92 2.80 0.00 0.00 6.55 7.66 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 28 E 8.03 3.89 0.00 2.04 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 0.00 2.38 2.28 0.00 29 L 7.84 3.83 0.00 1.66 1.50 0.72 -0.07 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 30 K 8.00 3.91 0.00 1.97 1.95 0.00 1.62 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.51 7.81 31 A 7.94 4.02 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 32 R 7.96 3.83 0.00 1.96 1.92 0.00 3.06 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 33 L 7.69 3.97 0.00 1.88 1.85 -0.03 -0.46 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 34 L 7.87 4.04 0.00 1.82 1.87 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 35 Q 7.97 4.05 0.00 2.11 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 36 E 8.14 4.30 0.00 2.28 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 2.37 2.55 0.00 37 G 8.03 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 38 W 8.45 4.13 0.00 3.41 3.32 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 39 V 8.02 3.44 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 1.03 0.00 0.00 1.19 0.00 0.00 40 D 7.87 4.36 0.00 2.91 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 41 K 7.93 3.90 0.00 1.73 1.72 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.58 7.81 42 V 7.28 3.25 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 0.68 0.00 0.00 -0.63 0.00 0.00 43 K 7.81 3.86 0.00 1.90 1.72 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.44 7.81 44 D 8.18 4.33 0.00 2.80 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 45 L 7.84 3.97 0.00 1.77 1.74 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 46 T 7.72 3.82 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 1.18 0.00 0.00 47 K 7.81 3.92 0.00 1.91 1.84 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.43 7.81 48 S 8.15 4.16 0.00 4.04 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 49 E 8.23 3.96 0.00 2.14 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 0.00 2.46 2.41 0.00 50 M 8.15 4.09 0.00 1.97 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.53 0.00 51 N 7.57 4.50 0.00 2.82 2.97 0.00 0.00 7.21 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 52 I 7.86 3.94 1.85 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 1.51 0.95 0.90 0.00 0.00 53 N 7.47 4.84 0.00 2.68 2.72 0.00 0.00 7.09 7.51 0.00 0.00 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 E 9.00 3.83 0.00 1.95 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 2.32 2.34 0.00 55 S 7.22 4.10 0.00 3.85 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 *57 N 8.39 4.53 0.00 2.81 2.87 0.00 0.00 6.56 7.71 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 58 F 8.88 4.21 0.00 3.16 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 59 T 8.67 3.66 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 1.22 0.00 0.00 60 Q 8.23 3.87 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 61 I 7.43 3.66 1.82 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 1.60 0.80 0.85 0.00 0.00 62 L 7.77 3.72 0.00 0.94 1.31 0.81 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 63 S 7.73 4.06 0.00 3.96 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 64 T 7.25 4.07 4.19 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 1.27 0.00 0.00 65 V 7.36 3.78 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 0.90 0.00 0.00 0.91 0.00 0.00 66 E 8.20 3.91 0.00 2.12 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 2.33 2.39 0.00 67 P 0.00 4.25 0.00 2.20 2.09 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 2.19 2.14 0.00 68 K 8.02 4.00 0.00 1.82 1.79 0.00 1.72 0.00 0.00 1.80 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.51 7.81 69 A 7.87 4.12 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.26 4.19 0.00 1.93 1.77 0.97 0.71 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 71 E 7.85 4.10 0.00 1.95 2.27 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 2.35 2.43 0.00 72 M 8.00 4.34 0.00 2.27 2.57 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.60 0.00 73 V 6.94 3.48 2.01 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 0.56 0.00 0.00 0.80 0.00 0.00 74 S 8.57 4.36 0.00 4.04 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 75 D 8.61 4.34 0.00 2.70 2.93 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 76 S 8.07 4.04 0.00 3.87 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 77 T 7.94 3.80 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 1.05 0.00 0.00 78 R 8.01 3.82 0.00 1.96 1.88 0.00 3.05 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 79 E 8.36 4.08 0.00 2.21 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 2.30 2.40 0.00 80 T 7.97 3.92 4.19 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 1.18 0.00 0.00 81 V 7.54 3.68 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 0.91 0.00 0.00 0.86 0.00 0.00 82 L 7.69 3.97 0.00 1.86 1.69 0.92 1.09 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 83 K 7.92 3.95 0.00 1.84 2.05 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 84 Q 7.65 3.97 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 85 I 7.96 4.05 1.90 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 1.35 0.56 1.03 0.00 0.00 86 R 8.03 3.91 0.00 1.96 2.01 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 87 E 8.43 4.18 0.00 2.03 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 2.45 2.48 0.00 88 F 7.83 5.15 0.00 3.00 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 89 L 7.61 4.24 0.00 1.82 1.59 0.96 0.85 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 90 E 8.14 3.92 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 91 E 8.03 3.85 0.00 2.13 2.22 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 2.25 2.40 0.00 92 I 6.87 3.55 1.82 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.07 0.81 0.00 0.00 93 V 7.70 3.54 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 0.59 0.00 0.00 0.93 0.00 0.00 94 D 8.13 4.36 0.00 2.54 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 95 T 7.49 4.17 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 * Residues marked with a * may have inaccurate shift predictions.