NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.1480 8.0549 114.0564 61.3851 33.0082 174.4445 3 Q 4.4743 8.2167 120.3654 53.7170 32.7425 173.0434 4 Q 4.4609 8.3791 120.1630 54.7525 33.0061 173.4629 5 K 4.2656 8.5982 126.8101 55.8867 32.9666 176.1699 6 V 4.5255 8.0169 118.3462 59.3569 35.3954 174.3786 7 E 4.2270 8.5192 122.9144 55.0626 30.3900 176.1355 8 V 3.8757 8.2990 126.2038 62.6450 31.0896 175.5349 9 R 4.4462 8.3233 125.7227 55.9693 30.8747 177.0741 10 L 4.2532 7.5194 117.8986 54.1458 42.3590 176.7435 11 K 4.3743 8.4040 120.6150 56.8119 32.8954 176.4485 12 T 4.7055 8.3015 112.9841 60.4099 72.6498 172.4830 13 G 4.2487 8.1534 107.7372 45.3893 0.0000 172.8411 14 L 4.2274 8.5489 119.7448 54.9699 42.2422 178.3246 15 Q 4.3037 8.4977 120.8187 55.0572 30.8287 177.3363 16 A 3.9830 8.5027 123.3670 55.5263 18.4029 179.9883 17 R 3.8695 8.0093 116.6918 59.2228 30.2752 176.8555 18 P 4.6205 0.0000 0.0000 65.2268 31.2900 178.2114 19 A 4.1516 8.2475 120.6311 55.0127 18.3397 179.4149 20 A 3.9786 8.4464 119.7297 55.3721 18.5723 179.9248 21 L 3.9507 8.1444 117.5733 57.4985 41.6014 179.4248 22 F 3.3627 8.1644 120.7847 61.2364 39.3054 177.3843 23 V 3.7631 8.0331 117.8708 65.9902 31.0440 177.6381 24 Q 3.9130 7.9112 118.5014 59.1888 29.0361 178.0350 25 E 4.0431 8.0302 118.9410 59.3668 29.5772 179.0844 26 A 4.3301 8.5246 121.2551 55.3989 18.2572 179.3694 27 N 4.3908 8.3233 113.9931 56.1190 38.6050 177.4248 28 R 3.8266 7.5382 118.4567 57.2368 30.3830 176.6296 29 F 4.9679 7.1792 117.2787 56.0857 40.4997 176.2146 30 T 4.1644 9.2070 114.2944 64.0297 68.9606 175.6941 31 S 4.5157 8.3154 118.6302 58.6128 64.2573 173.5140 32 D 4.5426 8.9071 122.7064 54.1450 42.1968 175.7517 33 V 4.7700 7.6220 120.9838 61.2389 35.0702 174.0823 34 F 5.4116 9.3613 125.0110 55.8267 43.8761 173.3804 35 L 5.2677 8.8423 120.1508 53.1370 44.7067 175.3944 36 E 5.1636 9.2220 123.0879 54.6109 33.7366 174.1639 37 K 4.6238 9.1906 126.4431 55.9638 36.2881 175.4268 38 D 4.4743 9.8723 127.5104 55.5623 38.3801 174.7261 39 G 3.9308 8.4975 104.6512 45.3820 0.0000 173.7705 40 K 4.5518 7.8535 119.7431 54.1852 34.0825 174.9357 41 K 5.0962 8.4858 123.7210 54.7164 34.7588 175.4134 42 V 4.6686 8.8375 120.0214 59.3182 36.0823 174.2431 43 N 4.7837 8.6979 121.8196 53.1840 39.5270 175.5412 44 A 3.8416 8.7610 129.4095 53.4916 18.7086 177.6335 45 K 4.3502 8.3487 115.0684 55.6711 32.3789 176.0092 46 S 4.6137 7.5888 114.6169 56.3335 64.1185 175.2725 47 I 3.9054 8.4339 125.4977 62.4501 36.4269 177.0718 *49 G 4.0245 8.1544 110.4957 45.8134 0.0000 177.0806 50 L 3.9351 7.8136 120.8960 54.3694 40.8685 179.1389 *52 S 4.3922 8.0599 113.1147 57.5339 64.7884 173.2772 53 L 4.1388 7.4802 123.7512 54.2329 42.5085 175.7133 54 A 4.5760 8.4577 127.8159 51.9159 18.5917 176.8821 55 V 4.6235 8.5459 114.4895 60.6288 36.3568 175.0198 56 S 4.8693 8.6679 117.5232 56.6043 67.2160 174.0893 57 T 4.0460 8.4485 119.1205 65.2659 68.5776 174.8353 58 G 4.0451 8.9241 114.5713 45.6016 0.0000 174.0739 59 T 4.0313 7.5666 116.2248 63.3749 69.0162 173.3563 60 E 4.4581 8.5012 125.4875 55.2100 30.7686 175.3809 61 V 4.6693 8.0475 117.5193 60.1225 36.5664 174.4079 62 T 4.5780 8.8471 118.4404 61.9867 70.4087 173.6964 63 L 5.0167 8.5781 128.6892 53.8395 43.7207 175.5139 64 I 4.8559 8.9715 125.9736 59.5220 41.0314 174.2864 65 A 5.1783 8.6115 126.6123 50.3295 22.4371 175.2018 66 Q 4.5243 9.8237 122.3924 54.0590 32.8189 175.1914 67 G 4.5639 8.9164 114.3053 44.5698 0.0000 172.1728 68 E 3.9798 8.5323 120.1544 58.5433 29.7408 177.2286 69 D 5.0587 7.8937 117.4677 52.7569 40.2379 177.9615 70 E 3.8822 8.0755 121.3867 60.6232 29.2614 178.4242 71 Q 3.8970 7.9333 118.3003 58.8067 28.8872 178.1435 72 E 4.1492 8.3528 120.9204 58.4743 29.7104 178.5014 73 A 2.5800 7.5793 120.8571 54.3456 18.2703 179.2753 74 L 3.8084 7.9116 119.1532 58.3385 42.1777 179.0351 75 E 3.9040 8.1574 118.4499 59.2315 29.4026 179.3459 76 K 4.0672 8.0908 119.6381 59.6783 32.2928 178.9689 77 L 3.9926 8.0444 118.9961 57.4013 41.6376 179.3218 78 A 3.9421 8.3054 121.0532 54.9756 18.2489 179.5405 79 A 4.2094 7.7927 120.2977 54.7817 18.2233 179.1801 80 Y 3.8205 7.9084 118.0264 60.9384 38.6856 178.5148 81 V 3.2949 7.5450 117.7263 65.5291 31.6212 176.9511 82 Q 4.2818 7.5842 114.4729 54.4373 29.0799 175.2011 83 E 3.6468 7.5082 118.3894 57.1860 27.7504 174.5968 84 E 4.4352 8.0855 117.1394 55.2881 30.9052 176.4562 85 V 4.4678 7.8428 120.9584 59.3060 34.3529 175.4361 86 L 4.1497 8.2768 121.4578 54.5397 42.2265 177.3704 87 Q 4.1707 8.6667 120.3450 56.4573 28.5888 176.4861 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 V 8.05 4.15 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 0.90 0.00 0.00 0.93 0.00 0.00 3 Q 8.22 4.47 0.00 2.05 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.61 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 4 Q 8.38 4.46 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 5 K 8.60 4.27 0.00 1.76 1.70 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.45 7.81 6 V 8.02 4.53 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 0.82 0.00 0.00 0.93 0.00 0.00 7 E 8.52 4.23 0.00 1.92 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 0.00 2.25 2.28 0.00 8 V 8.30 3.88 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 0.88 0.00 0.00 0.93 0.00 0.00 9 R 8.32 4.45 0.00 1.83 1.94 0.00 3.26 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 10 L 7.52 4.25 0.00 1.64 1.60 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.40 4.37 0.00 1.64 1.74 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.44 7.81 12 T 8.30 4.71 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 13 G 8.15 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 0.00 0.00 0.00 0.00 14 L 8.55 4.23 0.00 1.70 1.71 1.10 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 8.50 4.30 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 16 A 8.50 3.98 1.34 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 0.00 0.00 0.00 17 R 8.01 3.87 0.00 1.92 1.98 0.00 3.21 0.00 0.00 3.42 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 18 P 0.00 4.62 0.00 2.44 2.37 0.00 3.96 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 1.94 0.00 19 A 8.25 4.15 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 20 A 8.45 3.98 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 21 L 8.14 3.95 0.00 1.85 1.65 1.04 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.16 3.36 0.00 3.46 3.05 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 23 V 8.03 3.76 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 1.06 0.00 0.00 0.98 0.00 0.00 24 Q 7.91 3.91 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 25 E 8.03 4.04 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 2.21 2.25 0.00 26 A 8.52 4.33 1.50 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 0.00 0.00 27 N 8.32 4.39 0.00 2.74 2.87 0.00 0.00 7.09 8.51 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 28 R 7.54 3.83 0.00 1.19 1.48 0.00 2.95 0.00 0.00 3.02 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.67 0.00 29 F 7.18 4.97 0.00 3.09 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 30 T 9.21 4.16 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 1.23 0.00 0.00 31 S 8.32 4.52 0.00 3.82 3.92 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 0.00 0.00 0.00 32 D 8.91 4.54 0.00 2.66 2.36 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 33 V 7.62 4.77 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 1.14 0.00 0.00 0.93 0.00 0.00 34 F 9.36 5.41 0.00 2.95 2.90 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 35 L 8.84 5.27 0.00 1.59 1.58 1.03 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 36 E 9.22 5.16 0.00 2.00 1.73 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 2.18 2.37 0.00 37 K 9.19 4.62 0.00 1.91 1.60 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.35 1.47 7.81 38 D 9.87 4.47 0.00 2.83 2.71 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 39 G 8.50 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 0.00 0.00 0.00 40 K 7.85 4.55 0.00 1.89 1.70 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.48 7.81 41 K 8.49 5.10 0.00 1.71 1.51 0.00 0.98 0.00 0.00 1.64 0.00 0.00 2.54 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.03 1.35 7.81 42 V 8.84 4.67 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 0.72 0.00 0.00 0.97 0.00 0.00 43 N 8.70 4.78 0.00 2.83 2.66 0.00 0.00 6.89 8.66 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 44 A 8.76 3.84 1.06 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 0.00 0.00 0.00 0.00 0.00 45 K 8.35 4.35 0.00 1.76 1.94 0.00 1.57 0.00 0.00 1.72 0.00 0.00 3.17 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.26 7.81 46 S 7.59 4.61 0.00 3.79 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 47 I 8.43 3.91 1.86 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 1.35 0.63 0.92 0.00 0.00 *49 G 8.15 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 50 L 7.81 3.94 0.00 1.83 1.60 0.31 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 *52 S 8.06 4.39 0.00 4.00 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 7.48 4.14 0.00 1.57 1.61 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.46 4.58 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 55 V 8.55 4.62 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 0.71 0.00 0.00 0.96 0.00 0.00 56 S 8.67 4.87 0.00 3.75 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.45 4.05 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 58 G 8.92 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 0.00 0.00 0.00 59 T 7.57 4.03 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 1.22 0.00 0.00 60 E 8.50 4.46 0.00 1.90 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 0.00 2.24 2.39 0.00 61 V 8.05 4.67 2.25 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 0.82 0.00 0.00 1.00 0.00 0.00 62 T 8.85 4.58 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 63 L 8.58 5.02 0.00 1.72 1.60 1.11 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.97 4.86 2.08 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 1.21 0.76 1.05 0.00 0.00 65 A 8.61 5.18 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 9.82 4.52 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 67 G 8.92 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 E 8.53 3.98 0.00 1.96 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 2.31 2.27 0.00 69 D 7.89 5.06 0.00 3.10 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 70 E 8.08 3.88 0.00 2.33 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 2.38 2.35 0.00 71 Q 7.93 3.90 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.94 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 72 E 8.35 4.15 0.00 2.13 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 2.63 2.56 0.00 73 A 7.58 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.91 3.81 0.00 1.83 1.76 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.16 3.90 0.00 2.16 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 2.31 2.36 0.00 76 K 8.09 4.07 0.00 2.06 1.81 0.00 1.59 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.71 1.75 7.81 77 L 8.04 3.99 0.00 1.80 1.73 1.06 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.31 3.94 1.34 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 0.00 0.00 0.00 79 A 7.79 4.21 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 80 Y 7.91 3.82 0.00 3.14 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 81 V 7.54 3.29 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 0.92 0.00 0.00 0.90 0.00 0.00 82 Q 7.58 4.28 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.51 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 83 E 7.51 3.65 0.00 2.01 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 0.00 2.03 2.06 0.00 84 E 8.09 4.44 0.00 2.11 1.83 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 2.26 2.36 0.00 85 V 7.84 4.47 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 0.76 0.00 0.00 0.93 0.00 0.00 86 L 8.28 4.15 0.00 1.66 1.65 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 87 Q 8.67 4.17 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.65 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 * Residues marked with a * may have inaccurate shift predictions.