NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.5842 8.3393 109.6986 45.5413 0.0000 172.8095 1 S 3.8852 5.9848 119.1693 55.2587 66.6272 172.2708 2 F 5.0522 9.3924 126.1076 57.7031 41.1912 175.8807 3 T 4.0113 7.3369 122.4891 60.5911 70.8229 171.7410 4 P 4.1383 0.0000 0.0000 62.6972 31.7608 177.5071 5 S 4.6407 7.7634 118.8748 55.2837 63.7578 173.4835 6 G 4.1639 7.5382 109.2376 46.2496 0.0000 169.1248 7 T 4.6173 7.8500 110.3909 61.2532 71.2802 173.4464 8 T 5.1145 8.4413 118.1251 61.8082 70.6645 174.3969 9 G 4.2224 9.2298 113.3902 44.6816 0.0000 172.0691 10 T 5.0430 8.5221 120.5859 61.9383 71.3197 173.6118 11 T 4.4257 8.8741 124.0847 62.1603 69.9723 173.7630 12 K 5.1494 8.5237 126.0463 54.6995 34.6409 175.9781 13 L 4.8015 9.0080 125.2914 54.1739 46.1664 174.2710 14 T 5.0490 8.8457 123.0916 62.0616 70.6666 173.5299 15 V 4.7943 9.1890 127.7810 61.8783 33.7496 174.8600 16 T 5.1529 8.7666 116.7679 60.3871 73.0192 172.1817 17 E 4.5291 8.4402 120.7861 55.0942 31.3510 176.3359 18 K 3.8022 8.8904 120.6743 60.1466 32.0052 176.8888 19 C 4.1815 7.9681 121.1056 59.1877 30.7732 171.8780 20 Q 4.3918 8.4983 128.8244 54.2028 29.8032 175.0724 21 V 4.1097 8.2027 125.7306 61.0679 31.6384 174.5734 22 R 4.2257 8.3672 126.6505 55.2216 30.2774 176.3902 23 V 4.2337 8.3008 123.1742 61.9129 33.7065 177.0467 24 G 3.8446 8.5900 114.8150 45.0564 0.0000 172.7063 25 D 4.4780 8.4677 119.3725 53.8095 41.5171 176.0068 26 L 4.0614 8.2979 124.0725 55.7348 42.5615 176.3060 27 T 4.6079 7.9352 113.9151 59.6653 72.0823 173.3032 28 V 3.8134 8.2977 121.7066 63.1718 32.2402 174.4777 29 A 5.3352 8.4530 128.9500 50.3966 22.2405 174.8141 30 K 4.7733 9.0874 119.3671 55.1028 37.4428 175.9306 31 T 4.7459 8.3817 112.2087 60.5093 70.4087 175.8963 32 R 4.0884 8.6223 121.0652 59.8170 28.9011 179.3043 33 G 3.6354 8.0544 104.4429 47.0244 0.0000 174.6081 34 Q 4.3001 8.2591 118.6627 56.5002 30.3184 176.2183 35 L 4.3406 7.5061 122.5114 54.1873 41.0346 176.3706 36 T 4.5402 7.3058 109.7785 60.1775 70.7334 174.1147 37 D 4.4528 8.4380 121.7266 56.0657 41.3816 176.6395 38 A 3.7593 9.3276 127.9707 51.8864 17.6311 177.6774 39 A 4.3009 7.9431 119.6380 51.3432 19.4057 175.6507 40 P 4.6223 0.0000 0.0000 63.2439 31.6711 176.0867 41 I 4.1565 9.1791 124.6210 61.0759 38.8684 176.4563 42 G 4.3009 7.1278 111.5801 45.4806 0.0000 170.1364 43 P 5.0841 0.0000 0.0000 61.5387 33.5938 175.6701 44 V 4.3643 8.5205 121.0925 61.0437 33.9845 174.7413 45 T 4.4972 8.5339 118.9156 61.7319 69.7801 174.0574 46 V 4.5156 8.8873 124.0967 61.3761 35.0362 174.1347 47 Q 4.6519 8.8559 125.4915 54.3455 31.4839 174.2700 48 A 4.8525 8.7227 126.2847 50.7202 20.9629 176.2746 49 L 4.5127 8.0837 118.9079 53.6437 45.8923 176.4807 50 G 3.9092 8.9886 110.9494 47.2646 0.0000 173.4216 51 C 4.8136 8.1160 116.0515 58.7896 28.9095 176.4040 52 D 4.3716 8.4020 121.4998 55.6196 39.0300 176.6341 53 A 4.7022 7.8125 120.9309 51.5168 19.6816 175.2233 54 R 4.6643 7.7158 116.7960 56.0985 35.3812 174.5806 55 Q 4.8419 8.4699 119.3854 54.2306 30.1993 175.5642 56 V 4.2118 8.3433 124.5213 63.7890 32.8831 174.5717 57 A 5.5673 9.4291 127.0097 50.9180 23.4650 174.8668 58 L 5.3506 9.2983 118.9540 52.8832 45.6691 175.5610 59 K 4.6882 8.8979 125.2596 54.3811 34.2826 175.0992 60 A 5.4563 8.3833 129.0488 50.4914 19.9565 176.9525 61 D 4.5158 8.7194 119.6748 54.6688 41.6724 177.7137 62 T 3.4917 8.9368 118.4512 67.2159 68.5077 174.8250 63 D 4.6175 8.0115 117.2138 55.0621 40.7958 176.2179 64 N 4.6156 9.0030 116.7544 51.8580 39.3399 173.9161 65 F 4.3289 6.7193 111.8312 55.9869 40.6351 173.0132 66 E 4.6164 8.5353 119.2292 57.0892 35.6018 175.9879 *70 F 4.7899 7.5984 117.4030 57.4984 40.8999 173.8765 71 F 5.0904 7.8757 112.7440 56.2412 41.2949 173.4149 72 L 4.6884 8.6281 121.1489 54.7944 43.3048 175.6669 73 I 5.2804 8.6409 121.7763 58.9155 41.1787 175.2139 74 S 4.5378 8.5080 123.5727 57.6020 63.5273 174.9902 75 D 4.3708 8.5493 120.8986 57.4092 40.3351 177.5176 76 N 4.4578 7.9747 114.0687 52.3863 37.7932 175.2370 77 N 4.5957 8.2611 116.4534 54.6421 38.2747 174.1831 78 R 4.2614 7.5249 116.6574 57.7086 31.2139 176.0896 79 D 4.8700 8.2740 118.3227 53.1263 42.4795 175.7987 80 K 4.8861 8.4988 121.7035 54.7018 34.9952 176.1358 81 L 4.6646 8.5652 124.8445 52.5372 43.2307 173.8224 82 Y 4.8521 8.4250 121.0577 58.5814 39.0160 175.6511 83 V 5.1954 8.7086 115.7614 60.0035 36.5568 174.3488 84 N 5.1047 9.4643 119.0098 51.6819 41.4644 173.9466 85 I 4.5894 8.0711 123.7972 59.5229 38.9318 175.2670 86 R 4.6440 8.5061 127.6765 53.9483 33.4938 172.6537 87 P 4.9491 0.0000 0.0000 63.1781 31.6058 176.7728 88 T 4.1529 8.9160 111.6820 63.5588 68.5939 174.9868 89 D 4.3719 7.7673 121.2060 56.1276 40.0896 176.1677 90 N 5.1352 7.6492 118.1036 50.4792 39.8731 174.5943 91 S 4.1425 8.3423 112.3215 58.0916 64.3069 174.6724 92 A 4.3081 8.4353 123.6879 51.7930 19.0811 176.5879 93 W 4.7595 8.6678 121.5044 54.9970 33.3906 174.8907 94 T 4.3753 8.0137 117.4072 61.9305 72.0598 173.0338 95 T 5.0907 8.2274 120.8407 62.0182 70.7860 174.0837 96 D 4.2515 9.3665 126.1281 53.1775 43.1704 174.1816 97 N 4.1529 9.8108 127.8748 54.4923 37.1843 174.5707 98 G 2.2327 7.2905 105.0996 44.5773 0.0000 171.1797 99 V 4.6607 7.4347 120.2625 60.8826 34.3493 174.2194 100 F 5.4149 9.4995 131.1131 56.7535 40.6902 173.2447 101 Y 5.2656 7.9014 124.1201 54.5434 40.9871 174.9283 102 K 2.9125 7.9781 122.7173 55.6371 32.7356 177.6332 103 N 4.4470 8.5125 124.7911 55.1370 38.8625 174.6256 104 D 4.9074 7.0075 117.4255 51.9675 44.0301 175.7381 105 V 4.0339 8.1174 116.4614 60.9811 32.6315 174.7597 106 G 4.1679 7.7170 106.8030 43.6922 0.0000 175.1274 107 S 4.6111 8.1188 119.5615 57.3932 60.9890 173.2329 108 W 4.4565 8.5269 133.5834 57.1004 32.3924 174.5751 109 G 4.0022 7.4588 112.4441 44.5032 0.0000 172.1056 110 G 3.3731 7.2176 110.3298 45.9600 0.0000 171.1975 111 I 5.0031 7.9260 119.6823 59.5040 40.3735 174.9264 112 I 4.4804 8.8761 128.3807 59.5685 39.0884 175.1735 113 G 3.8812 8.8808 115.4341 45.3151 0.0000 172.0879 114 I 4.6899 7.6997 123.8439 59.4532 39.4551 174.4722 115 Y 5.2790 8.5541 124.0772 55.6592 42.4680 175.1687 116 V 3.8770 8.9447 122.5894 63.2717 32.7630 174.7068 117 D 4.9037 9.2109 129.5730 53.8396 40.5485 175.9939 118 G 4.0896 9.6821 111.8854 45.0043 0.0000 171.3206 119 Q 4.0279 8.4210 121.7460 56.9039 29.7030 177.4330 120 Q 4.6409 8.8364 125.8310 55.1926 29.9152 176.1748 121 T 4.8304 7.9641 105.5975 62.8189 69.1577 174.4657 122 N 4.6954 7.8027 118.5021 53.2607 39.2333 175.0951 123 T 3.8355 7.5819 116.3340 63.2151 68.8334 172.3318 124 P 4.3968 0.0000 0.0000 61.7299 32.0108 174.6751 125 P 4.4271 0.0000 0.0000 62.1325 32.0776 176.5725 126 G 3.9166 7.7828 108.5760 45.7313 0.0000 170.1175 127 N 5.3588 7.8385 116.7559 51.9600 40.3746 174.0035 128 Y 5.1070 9.6865 122.7846 56.5994 40.9780 175.1805 129 T 5.1724 8.7999 118.4830 61.8269 73.5472 172.9028 130 L 5.1311 8.6828 125.7531 52.7621 45.4124 174.9579 131 T 4.9917 8.5386 123.3075 61.9333 71.0051 173.6291 132 L 5.2318 8.9343 126.0465 53.2232 45.3009 175.4963 133 T 5.0511 9.1157 120.6447 61.7051 71.3412 174.3110 134 G 4.1889 9.0398 113.3022 46.0950 0.0000 174.0287 135 G 4.1899 8.1708 108.2657 45.8485 0.0000 171.3933 136 Y 5.4940 6.7169 117.3136 55.2709 42.2521 174.1358 137 W 5.1166 9.3547 131.0985 55.9951 32.1686 175.8734 138 A 4.2954 8.4409 128.8450 51.9916 18.8573 175.4603 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 8.34 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 5.98 3.89 0.00 3.62 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.39 5.05 0.00 3.28 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 T 7.34 4.01 2.69 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 0.75 0.00 0.00 4 P 0.00 4.14 0.00 1.87 2.06 0.00 3.47 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.21 0.00 5 S 7.76 4.64 0.00 3.76 3.75 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 6 G 7.54 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.85 4.62 4.28 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 0.00 0.00 0.00 1.25 0.00 0.00 8 T 8.44 5.11 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 1.31 0.00 0.00 9 G 9.23 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 0.00 0.00 0.00 0.00 10 T 8.52 5.04 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 11 T 8.87 4.43 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 1.15 0.00 0.00 12 K 8.52 5.15 0.00 1.62 1.72 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.40 7.81 13 L 9.01 4.80 0.00 1.71 1.49 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 14 T 8.85 5.05 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 15 V 9.19 4.79 2.17 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 1.08 0.00 0.00 0.71 0.00 0.00 16 T 8.77 5.15 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 1.23 0.00 0.00 17 E 8.44 4.53 0.00 1.88 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 2.28 2.25 0.00 18 K 8.89 3.80 0.00 1.71 1.86 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.39 7.81 19 C 7.97 4.18 0.00 2.97 2.87 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 20 Q 8.50 4.39 0.00 2.03 1.97 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 2.25 2.32 0.00 21 V 8.20 4.11 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 22 R 8.37 4.23 0.00 1.84 1.87 0.00 3.23 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 23 V 8.30 4.23 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 0.80 0.00 0.00 0.98 0.00 0.00 24 G 8.59 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 25 D 8.47 4.48 0.00 2.68 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 26 L 8.30 4.06 0.00 1.58 1.57 0.92 0.87 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 27 T 7.94 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 1.29 0.00 0.00 28 V 8.30 3.81 2.26 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 0.92 0.00 0.00 0.92 0.00 0.00 29 A 8.45 5.34 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.09 4.77 0.00 1.63 1.63 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.37 7.81 31 T 8.38 4.75 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 1.28 0.00 0.00 32 R 8.62 4.09 0.00 2.25 2.36 0.00 2.84 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.66 0.00 33 G 8.05 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 34 Q 8.26 4.30 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.56 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 35 L 7.51 4.34 0.00 1.88 1.60 0.86 0.61 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 36 T 7.31 4.54 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 1.25 0.00 0.00 37 D 8.44 4.45 0.00 2.64 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 38 A 9.33 3.76 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 39 A 7.94 4.30 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 40 P 0.00 4.62 0.00 2.06 2.19 0.00 3.80 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 41 I 9.18 4.16 1.86 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 1.12 0.57 0.85 0.00 0.00 42 G 7.13 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 0.00 0.00 0.00 0.00 43 P 0.00 5.08 0.00 2.03 1.98 0.00 3.64 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.90 0.00 44 V 8.52 4.36 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 1.04 0.00 0.00 0.84 0.00 0.00 45 T 8.53 4.50 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 1.18 0.00 0.00 46 V 8.89 4.52 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 1.13 0.00 0.00 47 Q 8.86 4.65 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.61 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 48 A 8.72 4.85 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.08 4.51 0.00 1.49 1.54 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.99 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 0.00 0.00 0.00 51 C 8.12 4.81 0.00 3.00 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 52 D 8.40 4.37 0.00 2.75 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 53 A 7.81 4.70 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 54 R 7.72 4.66 0.00 1.53 1.57 0.00 2.99 0.00 0.00 2.98 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.82 0.00 55 Q 8.47 4.84 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.03 0.00 0.00 0.00 0.00 0.00 2.45 2.34 0.00 56 V 8.34 4.21 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 1.45 0.00 0.00 1.20 0.00 0.00 57 A 9.43 5.57 1.69 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 58 L 9.30 5.35 0.00 1.68 1.55 1.11 1.06 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 59 K 8.90 4.69 0.00 0.79 0.94 0.00 1.20 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.19 1.06 7.81 60 A 8.38 5.46 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 61 D 8.72 4.52 0.00 2.73 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 62 T 8.94 3.49 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 1.07 0.00 0.00 63 D 8.01 4.62 0.00 2.68 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 64 N 9.00 4.62 0.00 2.89 2.73 0.00 0.00 6.68 8.02 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 65 F 6.72 4.33 0.00 2.66 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 66 E 8.54 4.62 0.00 2.25 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 2.15 2.23 0.00 *70 F 7.60 4.79 0.00 3.07 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 71 F 7.88 5.09 0.00 2.78 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 72 L 8.63 4.69 0.00 1.78 1.85 0.93 0.62 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 73 I 8.64 5.28 2.20 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.36 1.00 0.00 0.00 74 S 8.51 4.54 0.00 3.54 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 75 D 8.55 4.37 0.00 2.57 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 76 N 7.97 4.46 0.00 2.86 2.99 0.00 0.00 5.94 6.96 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 77 N 8.26 4.60 0.00 2.81 2.91 0.00 0.00 6.96 7.31 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 78 R 7.52 4.26 0.00 1.63 1.95 0.00 3.28 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 79 D 8.27 4.87 0.00 2.71 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 80 K 8.50 4.89 0.00 0.96 0.74 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.17 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.51 0.99 7.81 81 L 8.57 4.66 0.00 1.32 1.41 0.85 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 82 Y 8.42 4.85 0.00 3.09 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 83 V 8.71 5.20 2.23 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 0.82 0.00 0.00 0.95 0.00 0.00 84 N 9.46 5.10 0.00 2.66 2.73 0.00 0.00 7.31 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 I 8.07 4.59 0.67 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.09 -0.09 0.00 0.00 86 R 8.51 4.64 0.00 1.87 1.82 0.00 3.08 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 87 P 0.00 4.95 0.00 2.23 1.63 0.00 3.79 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.65 0.00 88 T 8.92 4.15 4.31 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 1.28 0.00 0.00 89 D 7.77 4.37 0.00 2.98 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 90 N 7.65 5.14 0.00 2.71 2.80 0.00 0.00 6.83 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 91 S 8.34 4.14 0.00 4.03 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 0.00 92 A 8.44 4.31 1.26 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 0.00 0.00 0.00 93 W 8.67 4.76 0.00 2.43 1.74 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 94 T 8.01 4.38 2.69 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 0.88 0.00 0.00 95 T 8.23 5.09 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 1.21 0.00 0.00 96 D 9.37 4.25 0.00 2.53 2.34 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 97 N 9.81 4.15 0.00 2.87 2.83 0.00 0.00 7.33 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 98 G 7.29 2.23 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 99 V 7.43 4.66 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 1.21 0.00 0.00 0.98 0.00 0.00 100 F 9.50 5.41 0.00 2.91 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 0.00 101 Y 7.90 5.27 0.00 3.00 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 0.00 102 K 7.98 2.91 0.00 0.79 1.14 0.00 0.82 0.00 0.00 1.18 0.00 0.00 2.20 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.51 0.21 7.81 103 N 8.51 4.45 0.00 2.42 2.76 0.00 0.00 6.72 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 D 7.01 4.91 0.00 2.60 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 0.00 0.00 0.00 105 V 8.12 4.03 2.17 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 0.72 0.00 0.00 0.96 0.00 0.00 106 G 7.72 4.17 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 0.00 107 S 8.12 4.61 0.00 3.81 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 0.00 108 W 8.53 4.46 0.00 3.42 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 0.00 109 G 7.46 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 0.00 0.00 0.00 110 G 7.22 3.37 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 0.00 111 I 7.93 5.00 1.90 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 1.28 0.96 0.89 0.00 0.00 112 I 8.88 4.48 1.77 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.03 0.58 0.00 0.00 113 G 8.88 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 0.00 0.00 0.00 114 I 7.70 4.69 1.72 0.00 0.00 0.61 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 1.09 0.79 0.00 0.00 115 Y 8.55 5.28 0.00 2.81 2.92 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 0.00 116 V 8.94 3.88 2.31 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 0.97 0.00 0.00 0.97 0.00 0.00 117 D 9.21 4.90 0.00 2.68 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 0.00 118 G 9.68 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 119 Q 8.42 4.03 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.44 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 120 Q 8.84 4.64 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.68 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 121 T 7.96 4.83 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 1.27 0.00 0.00 122 N 7.80 4.70 0.00 2.73 2.89 0.00 0.00 7.00 7.54 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 0.00 123 T 7.58 3.84 4.12 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 124 P 0.00 4.40 0.00 2.15 2.04 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.15 0.00 125 P 0.00 4.43 0.00 2.07 2.10 0.00 3.86 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.12 0.00 126 G 7.78 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 0.00 0.00 0.00 127 N 7.84 5.36 0.00 2.86 2.73 0.00 0.00 6.71 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Y 9.69 5.11 0.00 2.92 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 0.00 129 T 8.80 5.17 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 0.00 130 L 8.68 5.13 0.00 1.73 1.45 0.91 0.60 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 0.00 131 T 8.54 4.99 4.40 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 1.23 0.00 0.00 132 L 8.93 5.23 0.00 1.50 1.48 0.74 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 133 T 9.12 5.05 4.38 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 1.37 0.00 0.00 134 G 9.04 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 0.00 0.00 0.00 0.00 135 G 8.17 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 0.00 0.00 0.00 0.00 136 Y 6.72 5.49 0.00 3.07 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 0.00 137 W 9.35 5.12 0.00 3.27 2.83 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 0.00 0.00 0.00 138 A 8.44 4.30 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.