NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.2561 8.1849 122.4797 54.8722 43.2507 175.8203 3 Q 4.4085 8.2470 123.5897 53.4621 32.1552 173.2751 4 I 3.2391 8.4080 122.3941 58.9947 39.2834 174.1663 5 P 4.1633 0.0000 0.0000 62.5089 31.7249 177.1851 6 Q 3.9485 8.6978 123.1162 58.9468 28.9829 176.8557 7 N 4.7849 8.1279 112.5963 53.0060 37.8383 174.6775 8 Y 4.4076 7.9923 117.0696 58.0729 38.9029 174.3769 9 I 4.6987 8.6094 122.6471 59.3659 40.9113 174.0940 10 H 3.8949 8.9616 129.1897 56.3335 29.6950 174.3932 11 T 4.3901 8.1870 116.0405 62.9186 70.7633 174.3476 12 R 4.6110 7.0890 119.4113 55.2084 33.6953 173.8146 13 S 5.2269 8.3775 117.9290 57.0757 66.8638 173.7024 14 T 4.3475 8.3041 113.8394 59.4066 70.7644 172.6154 15 P 4.2081 0.0000 0.0000 61.8191 33.1740 175.3377 16 F 4.4229 8.1968 118.3911 57.4139 39.3702 175.4154 17 W 5.3838 9.4297 123.4391 55.0211 33.6496 173.9293 18 N 5.8247 9.1704 118.6053 51.1598 40.2894 174.9115 19 K 4.0402 9.2718 117.1730 59.4888 32.2371 177.8468 20 Q 4.3799 8.7713 119.0403 57.8692 29.6772 176.7397 21 T 4.0506 8.2296 106.1703 63.5143 69.4692 174.8474 22 A 2.7315 7.6408 124.5499 50.5391 19.1633 175.1760 23 P 4.0467 0.0000 0.0000 61.9159 32.2687 177.3503 24 A 4.1139 8.9863 126.8435 55.5109 18.2914 179.6478 25 G 3.8220 8.1244 103.6229 47.9801 0.0000 174.9943 26 I 3.6989 7.6421 120.0917 63.2197 38.0989 176.9953 27 F 5.2238 7.7613 116.3598 57.5624 39.2164 175.0787 28 E 4.8287 7.4174 120.1930 54.1859 31.8840 176.1357 29 R 4.3390 8.4260 120.9569 57.2141 30.8911 175.8461 30 H 5.0623 9.1788 118.5203 55.1058 32.4646 171.6541 31 L 4.7801 8.1330 119.2814 53.3515 44.5643 175.6132 32 D 4.7711 8.9071 126.0329 53.6033 41.7478 175.0747 33 K 4.1490 8.6935 122.2482 57.8249 34.0394 177.8695 34 G 3.9394 7.8259 106.2525 44.6055 0.0000 174.3801 35 T 3.8417 8.4019 114.8739 65.5876 68.5629 175.2703 36 R 4.7039 7.0140 115.8326 53.1782 33.1412 173.8096 37 P 4.3503 0.0000 0.0000 63.5874 32.0156 176.8007 38 G 3.8750 8.1541 107.6835 44.8251 0.0000 174.1664 39 V 4.0556 7.4298 119.1186 63.3823 32.6439 174.5954 40 Y 4.8919 9.1997 124.2676 55.9379 40.4351 173.0334 41 P 4.8314 0.0000 0.0000 61.1874 34.0631 174.9870 42 R 4.5901 8.5036 123.7847 54.4444 32.7396 173.4765 43 L 4.9621 7.9101 129.8553 53.7086 43.6287 175.1930 44 S 5.3542 8.7551 120.7906 56.7107 65.8733 174.2123 45 V 4.1480 8.5580 123.9909 61.8625 34.0282 173.9064 *47 H 4.4721 8.4818 120.9440 56.8350 31.2139 172.7718 48 G 3.9045 9.3202 111.9688 45.6701 0.0000 172.9494 49 A 4.7963 8.7237 124.1659 50.8192 22.6114 175.8341 50 V 4.6648 8.9576 120.3593 60.9047 35.3381 174.1552 51 K 5.0582 9.1539 128.2382 54.8239 35.1065 173.7836 52 Y 4.8014 9.1514 128.6981 56.0074 41.0686 174.1420 53 L 4.3626 8.1178 126.2103 52.9266 44.6447 175.6727 54 G 4.1167 8.3770 112.1403 44.7912 0.0000 171.2620 55 Y 5.1047 8.8747 119.3885 55.5306 40.9296 176.0577 56 A 4.1741 9.1875 124.1899 54.8329 18.8114 176.8879 57 D 4.6723 8.0208 113.1796 52.5260 42.3669 175.5988 58 E 2.5400 8.2509 119.1594 58.4854 29.1670 177.0667 59 H 4.6934 8.1570 113.0348 55.0255 29.5085 174.3028 60 S 4.1670 7.5637 116.0645 59.0089 63.1598 174.7924 61 A 4.1940 8.6030 126.7432 54.3175 18.6247 177.6410 62 E 4.9300 7.8149 112.8625 53.6569 33.4361 173.6801 63 P 4.0983 0.0000 0.0000 62.7477 32.0267 175.8589 64 D 4.7893 8.3450 118.8265 53.6442 41.0755 175.5169 65 Q 4.6336 7.5424 120.7887 54.6163 32.8230 173.3947 66 V 4.9789 8.3907 124.7997 61.3614 34.9019 174.3917 67 I 4.6549 8.7313 127.5445 59.5762 41.2688 173.7187 68 L 4.8204 8.6665 129.1045 53.7276 43.4571 175.3028 69 I 4.4635 9.1727 127.6861 59.8250 39.4815 174.8968 70 E 4.9490 9.2008 126.6177 53.8641 32.5553 175.6151 71 A 4.7328 7.2157 123.1258 53.8344 18.5821 178.4350 72 G 4.0189 9.4913 110.6521 45.0174 0.0000 172.5571 73 Q 4.8542 8.0957 117.9493 53.9580 33.2749 174.0013 74 F 5.5433 7.9912 114.0734 55.6332 41.7843 173.4890 75 A 4.6813 9.0242 120.0001 50.3632 22.7283 175.2584 76 V 4.4072 8.4310 121.5710 61.9869 32.7239 175.2064 77 F 4.7258 8.6567 127.2389 55.6451 40.0460 174.2225 78 P 4.3813 0.0000 0.0000 62.0224 31.6731 174.3309 79 P 4.3210 0.0000 0.0000 63.7469 31.7588 176.3582 80 E 3.6638 8.7998 119.4281 56.5355 27.0583 173.7594 81 K 4.6010 7.3730 119.2209 53.9583 33.8526 176.0049 82 W 4.5899 8.8853 126.3726 57.6675 30.5920 174.7274 83 H 5.5723 9.1339 117.7078 56.8356 31.9453 171.8242 84 N 5.1375 8.0261 113.7955 52.0256 40.1983 173.3873 85 I 5.0947 8.4701 113.4535 59.3213 41.5420 173.9018 86 E 4.9197 8.9337 122.5449 54.9659 32.7152 175.1219 87 A 4.2431 8.4896 131.6798 51.6114 20.7433 175.3556 *89 T 4.2060 8.0599 105.0415 61.9815 69.8437 173.3461 90 D 4.6060 8.5085 119.9351 56.7028 41.1513 177.8297 91 D 4.6863 8.0658 116.8463 56.0467 41.3284 176.6641 92 T 4.9459 8.0266 117.1308 63.5043 68.9232 173.5383 93 Y 5.5339 8.3746 122.7435 56.1479 41.2724 173.6435 94 F 5.4106 9.0708 116.2554 56.4901 42.3826 172.2056 95 N 4.9204 9.0387 114.2403 51.8408 40.7990 173.4536 96 I 4.8096 8.6227 120.8334 59.5902 40.7277 174.2953 97 D 5.2204 8.3741 125.2519 52.4221 44.1598 174.9629 98 F 5.3855 8.9248 121.1027 55.7134 42.2091 174.4246 99 F 5.3870 9.4505 121.1798 55.7604 42.5831 174.3827 100 V 5.0030 9.0054 121.7066 60.5167 35.1399 174.6057 101 A 2.9253 8.2644 126.6883 50.6568 19.0035 175.7333 102 P 4.0382 0.0000 0.0000 62.9304 31.5165 176.2461 103 E 4.0441 8.8941 119.8637 56.6849 29.0953 176.9395 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 L 8.18 4.26 0.00 1.58 1.61 0.96 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 3 Q 8.25 4.41 0.00 1.97 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.68 0.00 0.00 0.00 0.00 0.00 2.17 2.36 0.00 4 I 8.41 3.24 1.31 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.03 0.30 0.00 0.00 5 P 0.00 4.16 0.00 2.20 1.97 0.00 2.23 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.86 0.00 6 Q 8.70 3.95 0.00 1.97 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.13 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 7 N 8.13 4.78 0.00 2.92 2.96 0.00 0.00 6.08 7.55 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 8 Y 7.99 4.41 0.00 3.07 3.16 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 9 I 8.61 4.70 1.91 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 1.13 1.78 0.99 0.00 0.00 10 H 8.96 3.89 0.00 2.74 3.04 0.00 5.74 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.19 4.39 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 1.22 0.00 0.00 12 R 7.09 4.61 0.00 1.76 1.66 0.00 3.02 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 13 S 8.38 5.23 0.00 3.62 3.52 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.30 4.35 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 1.21 0.00 0.00 15 P 0.00 4.21 0.00 1.96 1.99 0.00 3.24 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 1.63 2.04 0.00 16 F 8.20 4.42 0.00 2.90 3.01 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 0.00 0.00 0.00 0.00 17 W 9.43 5.38 0.00 2.55 2.65 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 0.00 0.00 0.00 18 N 9.17 5.82 0.00 3.03 3.17 0.00 0.00 7.25 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 19 K 9.27 4.04 0.00 1.81 1.87 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.73 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.17 1.51 7.81 20 Q 8.77 4.38 0.00 2.01 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.03 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 21 T 8.23 4.05 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 1.28 0.00 0.00 22 A 7.64 2.73 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 23 P 0.00 4.05 0.00 1.87 1.74 0.00 2.57 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.35 0.00 24 A 8.99 4.11 1.35 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 0.00 0.00 0.00 25 G 8.12 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 0.00 0.00 0.00 26 I 7.64 3.70 1.70 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.44 0.01 0.00 0.00 27 F 7.76 5.22 0.00 3.19 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 28 E 7.42 4.83 0.00 2.01 1.90 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 2.33 2.36 0.00 29 R 8.43 4.34 0.00 1.57 1.72 0.00 2.60 0.00 0.00 2.93 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.48 0.00 30 H 9.18 5.06 0.00 3.19 3.49 0.00 5.40 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.13 4.78 0.00 0.37 1.04 -0.24 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.91 4.77 0.00 2.92 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 33 K 8.69 4.15 0.00 1.66 1.77 0.00 1.76 0.00 0.00 1.52 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.27 7.81 34 G 7.83 3.94 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 0.00 0.00 0.00 35 T 8.40 3.84 4.20 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 1.18 0.00 0.00 36 R 7.01 4.70 0.00 1.81 1.77 0.00 3.13 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.49 0.00 37 P 0.00 4.35 0.00 2.16 2.03 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 38 G 8.15 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 39 V 7.43 4.06 2.16 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 1.02 0.00 0.00 1.06 0.00 0.00 40 Y 9.20 4.89 0.00 3.17 2.75 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 41 P 0.00 4.83 0.00 1.82 1.81 0.00 3.85 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 42 R 8.50 4.59 0.00 1.66 1.65 0.00 2.21 0.00 0.00 2.43 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.35 0.00 43 L 7.91 4.96 0.00 1.32 1.32 0.86 0.69 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 44 S 8.76 5.35 0.00 4.07 4.01 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 0.00 0.00 0.00 0.00 45 V 8.56 4.15 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 1.11 0.00 0.00 1.06 0.00 0.00 *47 H 8.48 4.47 0.00 2.68 2.64 0.00 5.97 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 48 G 9.32 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 0.00 0.00 0.00 49 A 8.72 4.80 1.23 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 50 V 8.96 4.66 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 0.89 0.00 0.00 0.82 0.00 0.00 51 K 9.15 5.06 0.00 1.85 1.64 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.53 7.81 52 Y 9.15 4.80 0.00 2.81 2.65 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 0.00 0.00 0.00 53 L 8.12 4.36 0.00 1.59 1.12 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.38 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 0.00 0.00 0.00 0.00 55 Y 8.87 5.10 0.00 2.81 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 56 A 9.19 4.17 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 57 D 8.02 4.67 0.00 2.87 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 58 E 8.25 2.54 0.00 1.16 1.17 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 1.47 1.47 0.00 59 H 8.16 4.69 0.00 3.02 3.13 0.00 5.73 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 7.56 4.17 0.00 4.00 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 61 A 8.60 4.19 1.29 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 0.00 0.00 62 E 7.81 4.93 0.00 1.94 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 2.23 2.29 0.00 63 P 0.00 4.10 0.00 1.71 0.86 0.00 3.74 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.75 0.00 64 D 8.35 4.79 0.00 2.84 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 65 Q 7.54 4.63 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 66 V 8.39 4.98 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 0.87 0.00 0.00 0.86 0.00 0.00 67 I 8.73 4.65 1.90 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 1.09 0.54 0.89 0.00 0.00 68 L 8.67 4.82 0.00 1.64 1.57 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 69 I 9.17 4.46 2.00 0.00 0.00 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 1.28 0.84 0.95 0.00 0.00 70 E 9.20 4.95 0.00 1.89 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 2.24 2.23 0.00 71 A 7.22 4.73 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 72 G 9.49 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 73 Q 8.10 4.85 0.00 2.03 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.59 0.00 0.00 0.00 0.00 0.00 2.20 2.35 0.00 74 F 7.99 5.54 0.00 2.98 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 75 A 9.02 4.68 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 76 V 8.43 4.41 2.19 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 0.78 0.00 0.00 0.91 0.00 0.00 77 F 8.66 4.73 0.00 2.91 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 78 P 0.00 4.38 0.00 2.26 2.05 0.00 3.56 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 2.13 2.12 0.00 79 P 0.00 4.32 0.00 1.82 1.93 0.00 3.70 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 1.00 1.54 0.00 80 E 8.80 3.66 0.00 2.07 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 2.18 2.30 0.00 81 K 7.37 4.60 0.00 1.82 2.00 0.00 1.91 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.65 7.81 82 W 8.89 4.59 0.00 3.40 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 83 H 9.13 5.57 0.00 2.52 3.10 0.00 5.58 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.03 5.14 0.00 2.96 3.00 0.00 0.00 5.50 7.77 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 85 I 8.47 5.09 1.95 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.11 1.12 0.00 0.00 86 E 8.93 4.92 0.00 2.10 1.82 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 2.20 2.27 0.00 87 A 8.49 4.24 1.46 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 0.00 0.00 0.00 *89 T 8.06 4.21 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 1.23 0.00 0.00 90 D 8.51 4.61 0.00 2.73 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 91 D 8.07 4.69 0.00 2.78 2.91 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 92 T 8.03 4.95 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 1.54 0.00 0.00 93 Y 8.37 5.53 0.00 3.06 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 94 F 9.07 5.41 0.00 3.39 3.36 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 95 N 9.04 4.92 0.00 2.40 2.46 0.00 0.00 7.21 7.38 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 96 I 8.62 4.81 1.76 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.08 0.07 0.00 0.00 97 D 8.37 5.22 0.00 2.59 2.45 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 0.00 0.00 0.00 0.00 98 F 8.92 5.39 0.00 2.86 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 99 F 9.45 5.39 0.00 3.12 3.15 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 0.00 100 V 9.01 5.00 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 0.92 0.00 0.00 1.00 0.00 0.00 101 A 8.26 2.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 4.04 0.00 2.15 2.21 0.00 3.50 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 1.92 1.94 0.00 103 E 8.89 4.04 0.00 2.06 2.00 0.00 0.00 0.00 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 2.28 0.00 * Residues marked with a * may have inaccurate shift predictions.