NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -9 T 4.5036 8.0333 112.9321 60.2883 70.9065 175.1780 -8 E 4.0865 8.2669 121.2771 57.6262 30.0390 175.3463 -7 N 5.1333 8.2882 114.3677 51.9405 38.7738 175.5487 -6 L 4.2007 8.0024 121.1655 56.6540 43.4016 175.9773 -5 Y 4.9551 7.5217 114.7614 55.9790 39.9351 174.9600 -4 F 4.6279 9.2825 127.2934 56.9986 40.0981 175.0345 -3 Q 3.9652 8.0322 129.8121 55.8148 29.8110 174.4335 -2 S 4.7035 8.3637 119.1349 56.0951 64.6184 174.1216 -1 N 4.5865 9.0025 125.4698 54.9135 38.4193 174.9514 0 A 4.7130 6.8361 117.5634 52.0589 21.1857 178.9679 -7 K 4.7133 8.1782 116.0677 55.0405 32.9738 176.9487 -6 T 4.2107 7.9924 112.9655 63.3540 70.8016 173.0773 -5 L 4.7451 7.5617 116.2614 53.1790 44.5351 176.6600 -4 K 4.3279 9.2725 127.3934 55.4986 33.5981 175.8345 -3 E 3.9752 8.1322 130.2121 56.7148 30.3110 175.0335 -2 L 4.5735 8.2137 125.2349 52.8951 43.2184 177.1216 -1 R 4.1865 8.8325 127.2698 57.8135 30.4193 176.0514 0 T 4.7430 6.7461 107.3634 61.3589 71.8857 175.8679 10 D 4.3456 8.0620 119.5491 56.6391 40.8502 177.2762 11 Y 4.5276 7.7434 113.9412 56.6223 38.5641 175.4919 12 G 3.9313 7.8786 106.9278 46.6471 0.0000 173.9691 13 L 4.7299 7.8974 118.2035 53.1029 43.6384 177.5429 14 T 4.2588 8.7996 113.1078 61.2962 70.9137 175.9647 15 Q 4.0050 8.5092 120.3061 58.9737 28.7363 179.0020 16 K 3.9892 7.8988 121.4298 58.9049 32.2907 178.5259 17 E 3.8928 8.4368 119.0902 59.3630 29.4672 178.9925 18 L 3.6610 7.7702 120.2153 58.0413 42.0817 178.7148 19 G 3.7741 8.1614 105.5816 48.3325 0.0000 174.8640 20 D 4.4156 8.2068 121.5626 56.8635 40.7432 179.1090 21 L 3.9481 7.9377 119.5795 57.7297 42.1582 178.1136 22 F 4.9188 8.2938 114.5911 56.1161 39.8145 175.6503 23 K 3.9113 7.8906 116.6490 57.5706 29.8622 175.1851 24 V 4.6192 7.8508 109.3165 59.0879 36.0655 176.3509 25 S 4.3704 8.4180 115.9063 58.3077 63.3025 175.5222 26 S 4.1302 8.6980 117.5783 61.8720 62.3647 177.1110 27 R 4.0236 7.9357 121.0689 59.6122 29.7079 178.4388 28 T 3.9217 8.0080 115.1434 66.5908 68.4736 176.4557 29 I 3.9983 7.3146 120.9997 64.3565 37.4883 177.6096 30 Q 4.2297 8.3299 120.7273 59.5641 28.7178 179.7297 31 N 4.1652 8.1834 113.7938 54.2702 38.3036 176.6434 *33 E 4.3640 8.1041 121.9661 56.5715 31.6665 177.7587 34 K 4.0828 8.1618 118.1395 58.6989 32.3243 176.2643 35 D 4.9877 8.4695 119.6318 52.8498 43.0655 175.3292 36 S 4.5980 8.8725 122.5044 58.4976 63.4794 176.1770 37 T 3.8384 7.9570 118.4434 66.3459 68.2606 174.5434 38 N 4.9457 7.8578 115.1197 52.5927 39.3403 174.2152 39 I 3.7387 7.5640 118.5823 61.4715 38.6504 176.1971 40 K 4.2906 8.4720 125.9596 55.8765 33.9463 177.9974 41 D 4.3994 8.7756 122.5614 57.2224 40.9146 178.6723 42 S 4.0929 8.0177 113.9644 61.3450 63.1486 175.9638 43 L 3.9831 7.7267 123.4539 57.5576 41.8508 178.0348 44 L 4.0624 8.0331 120.4471 58.8056 41.7393 179.2196 45 S 4.1406 8.2567 113.5097 61.5899 62.8956 176.6517 46 K 3.8811 7.8999 121.2658 58.9467 31.5417 179.4718 47 Y 4.5668 7.3150 114.7270 58.6781 37.5005 178.0637 *49 S 4.2077 8.0711 116.3201 58.2196 64.1826 174.7310 50 A 4.0146 8.0750 122.2554 54.1079 18.2627 177.9396 51 F 4.7869 8.0371 111.8003 56.5336 39.8310 175.0385 52 N 3.8721 7.8556 117.6868 55.0180 36.6966 173.7408 53 V 4.5526 7.4139 108.6602 59.3282 35.6223 176.3719 54 K 4.3655 8.7855 121.8746 55.6812 33.1302 177.5448 55 Y 4.0583 8.8807 122.1160 61.3196 38.4768 178.0562 56 D 4.5620 8.2002 115.1611 55.5499 40.9212 176.2885 57 D 4.6919 8.3571 118.9403 54.3238 41.5402 176.0298 58 I 4.9985 6.9487 121.0005 59.2898 39.0621 175.0640 59 F 4.0927 8.5923 129.8541 57.5799 39.8817 174.3171 60 L 4.4227 7.6130 125.7783 52.0523 44.2018 176.2557 61 G 3.6355 7.7002 111.7034 44.1938 0.0000 171.5790 62 N 5.2392 8.1845 118.1729 52.1155 39.8604 175.4162 63 E 4.3299 8.6635 120.6629 58.8825 29.5239 178.0782 64 Y 4.2054 8.1914 119.4964 60.6196 38.9881 177.0459 65 E 4.0279 8.8868 119.6218 59.6197 29.5915 178.7134 66 N 4.3801 8.5716 116.4670 56.6701 38.6329 176.8000 67 F 3.9190 8.2517 121.3550 61.4770 39.4973 177.2420 68 V 3.2474 7.7135 117.7128 65.8244 31.3179 177.7773 69 F 3.8315 8.2021 120.8097 61.4483 39.1886 177.3245 70 T 3.4729 7.9195 109.8239 64.4374 68.5781 176.1792 71 N 3.9829 7.7913 120.2792 56.1323 38.7886 176.5983 72 D 4.1890 8.1133 120.7911 57.2176 40.8779 178.7441 73 K 3.6362 7.3344 118.5961 59.2475 31.9582 179.0427 74 K 3.7541 7.6422 119.5304 59.6663 32.0336 178.9719 75 K 3.9693 8.0146 118.4892 59.3151 31.8624 179.6378 76 S 4.0373 8.0361 115.5569 61.6735 62.8374 176.3383 77 I 3.6719 7.7129 122.4797 64.7634 36.9077 178.4921 78 I 3.7212 7.5269 119.7272 64.2827 36.9986 178.3249 79 L 3.9431 8.2130 121.1957 57.9860 41.7222 178.6855 80 A 3.9795 8.2836 119.8281 55.1479 18.6366 178.9294 81 F 4.1914 8.1518 118.9513 61.6727 39.5265 177.5246 82 K 3.8776 8.2335 117.8884 59.2573 31.6498 178.4355 83 E 4.1039 8.0671 117.3186 57.6464 29.6282 177.7432 84 K 4.2104 7.6282 116.6666 57.7980 32.7701 176.3544 85 Q 4.0705 7.5475 122.5490 55.8633 28.7806 175.3371 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 -9 T 8.03 4.50 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 -8 E 8.27 4.09 0.00 2.08 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 0.00 2.32 2.41 0.00 -7 N 8.29 5.13 0.00 2.99 3.06 0.00 0.00 6.24 6.67 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 -6 L 8.00 4.20 0.00 1.56 1.47 0.85 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 -5 Y 7.52 4.96 0.00 3.07 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 -4 F 9.28 4.63 0.00 3.01 3.06 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 -3 Q 8.03 3.97 0.00 1.98 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.63 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 -2 S 8.36 4.70 0.00 3.93 3.72 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 -1 N 9.00 4.59 0.00 2.85 2.94 0.00 0.00 6.01 7.26 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 A 6.84 4.71 1.03 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 0.00 0.00 -7 K 8.18 4.71 0.00 2.00 2.06 0.00 0.61 0.00 0.00 1.70 0.00 0.00 2.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.43 7.81 -6 T 7.99 4.21 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 -5 L 7.56 4.75 0.00 1.66 1.64 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 -4 K 9.27 4.33 0.00 1.71 1.77 0.00 0.61 0.00 0.00 1.63 0.00 0.00 2.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.41 7.81 -3 E 8.13 3.98 0.00 1.92 1.65 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 0.00 2.28 2.24 0.00 -2 L 8.21 4.57 0.00 1.66 1.47 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 -1 R 8.83 4.19 0.00 1.88 1.95 0.00 2.21 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 0 T 6.75 4.74 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 10 D 8.06 4.35 0.00 2.78 2.29 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 0.00 11 Y 7.74 4.53 0.00 3.18 3.14 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 0.00 12 G 7.88 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 13 L 7.90 4.73 0.00 1.69 1.61 1.10 0.92 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 14 T 8.80 4.26 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 1.24 0.00 0.00 15 Q 8.51 4.00 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.94 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 16 K 7.90 3.99 0.00 1.82 1.80 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.39 7.81 17 E 8.44 3.89 0.00 2.00 1.93 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 2.31 2.30 0.00 18 L 7.77 3.66 0.00 1.77 1.55 0.39 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.16 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 20 D 8.21 4.42 0.00 2.84 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 21 L 7.94 3.95 0.00 1.45 1.41 0.88 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.29 4.92 0.00 2.89 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 23 K 7.89 3.91 0.00 1.96 1.89 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.43 7.81 24 V 7.85 4.62 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 0.79 0.00 0.00 1.06 0.00 0.00 25 S 8.42 4.37 0.00 4.02 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 26 S 8.70 4.13 0.00 3.90 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 27 R 7.94 4.02 0.00 1.94 1.94 0.00 3.26 0.00 0.00 3.36 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.80 0.00 28 T 8.01 3.92 4.46 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 0.00 0.00 0.00 1.29 0.00 0.00 29 I 7.31 4.00 2.08 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.93 1.03 0.00 0.00 30 Q 8.33 4.23 0.00 2.18 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.05 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 31 N 8.18 4.17 0.00 2.81 2.85 0.00 0.00 7.10 7.49 0.00 0.00 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 E 8.10 4.36 0.00 2.32 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 0.00 2.37 2.46 0.00 34 K 8.16 4.08 0.00 2.04 1.89 0.00 1.64 0.00 0.00 1.61 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.67 1.42 7.81 35 D 8.47 4.99 0.00 2.56 2.54 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 36 S 8.87 4.60 0.00 3.78 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 37 T 7.96 3.84 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 38 N 7.86 4.95 0.00 2.66 2.78 0.00 0.00 6.81 7.45 0.00 0.00 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 I 7.56 3.74 1.87 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.81 0.93 0.00 0.00 40 K 8.47 4.29 0.00 1.87 1.72 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.51 7.81 41 D 8.78 4.40 0.00 2.78 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 42 S 8.02 4.09 0.00 4.04 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 43 L 7.73 3.98 0.00 1.84 1.90 1.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.03 4.06 0.00 1.98 1.82 1.11 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.26 4.14 0.00 3.90 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 46 K 7.90 3.88 0.00 0.99 0.74 0.00 1.43 0.00 0.00 1.31 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.15 1.39 7.81 47 Y 7.31 4.57 0.00 3.35 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 *49 S 8.07 4.21 0.00 3.79 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 A 8.08 4.01 0.95 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 51 F 8.04 4.79 0.00 3.23 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 52 N 7.86 3.87 0.00 1.44 2.02 0.00 0.00 6.87 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 53 V 7.41 4.55 2.14 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 1.00 0.00 0.00 1.08 0.00 0.00 54 K 8.79 4.37 0.00 2.02 1.77 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.38 7.81 55 Y 8.88 4.06 0.00 3.04 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 56 D 8.20 4.56 0.00 2.76 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 57 D 8.36 4.69 0.00 2.79 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 58 I 6.95 5.00 1.60 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 1.10 0.67 0.79 0.00 0.00 59 F 8.59 4.09 0.00 2.26 2.67 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 60 L 7.61 4.42 0.00 1.11 1.23 0.70 0.67 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 61 G 7.70 3.64 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 0.00 0.00 0.00 62 N 8.18 5.24 0.00 3.09 3.04 0.00 0.00 7.07 6.93 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 63 E 8.66 4.33 0.00 2.19 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 0.00 2.49 2.32 0.00 64 Y 8.19 4.21 0.00 3.17 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 65 E 8.89 4.03 0.00 2.24 2.38 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 2.50 2.63 0.00 66 N 8.57 4.38 0.00 3.15 3.06 0.00 0.00 6.69 7.73 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 67 F 8.25 3.92 0.00 3.21 3.14 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 0.00 68 V 7.71 3.25 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 0.82 0.00 0.00 0.62 0.00 0.00 69 F 8.20 3.83 0.00 2.34 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 70 T 7.92 3.47 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 1.18 0.00 0.00 71 N 7.79 3.98 0.00 1.69 2.12 0.00 0.00 7.13 8.47 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 72 D 8.11 4.19 0.00 2.59 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.33 3.64 0.00 1.52 1.59 0.00 1.43 0.00 0.00 1.05 0.00 0.00 2.13 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.11 0.80 7.81 74 K 7.64 3.75 0.00 1.81 1.83 0.00 1.55 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.40 7.81 75 K 8.01 3.97 0.00 1.90 1.80 0.00 1.77 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.41 7.81 76 S 8.04 4.04 0.00 4.02 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 77 I 7.71 3.67 1.81 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 1.46 0.98 0.85 0.00 0.00 78 I 7.53 3.72 2.02 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 1.38 1.01 0.93 0.00 0.00 79 L 8.21 3.94 0.00 1.85 1.65 0.96 1.32 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 80 A 8.28 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.15 4.19 0.00 3.25 3.24 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 82 K 8.23 3.88 0.00 1.85 1.84 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.76 7.81 83 E 8.07 4.10 0.00 2.21 1.93 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 2.30 2.32 0.00 84 K 7.63 4.21 0.00 1.61 1.71 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.62 7.81 85 Q 7.55 4.07 0.00 1.92 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.55 0.00 0.00 0.00 0.00 0.00 2.20 2.11 0.00 * Residues marked with a * may have inaccurate shift predictions.