NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7838 8.3549 109.7374 45.1635 0.0000 174.2276 *2 L 4.3860 7.5340 119.3933 54.7853 43.6242 175.7208 3 Y 4.8093 9.1782 122.5508 56.9676 39.4870 174.7130 4 H 5.2084 9.2080 126.9154 54.9730 30.8540 173.2867 5 L 4.8755 8.7161 126.8586 52.9767 43.9428 176.2095 6 V 5.0357 7.8962 122.3827 59.6584 35.5372 173.7779 *8 L 4.4966 8.1697 120.6555 54.8626 43.4402 176.4011 9 E 4.8834 9.0326 123.1068 53.8039 30.0190 173.0140 10 P 4.9051 0.0000 0.0000 63.1406 32.4946 176.2525 11 E 4.5747 9.4362 121.3294 55.4129 33.4339 173.1167 12 G 3.9049 9.3085 112.4793 43.0308 0.0000 173.8188 13 E 3.9437 8.4926 116.2293 57.0215 30.1802 176.5567 14 G 3.8937 9.0400 111.2583 45.0156 0.0000 174.6623 15 A 3.8769 7.7816 118.2120 53.5606 18.1241 179.5011 *17 D 4.4884 8.0907 118.0966 55.2215 42.9619 177.2216 18 R 4.0275 7.9552 119.0006 59.4147 30.1403 179.4523 19 I 3.9026 7.6532 117.3662 61.5044 36.5955 177.1557 *21 E 4.3085 8.4576 120.6761 56.6307 31.2469 179.1785 22 A 3.8017 7.7906 119.2803 52.8002 18.4757 179.0710 *24 A 4.2732 8.1605 123.5965 53.8865 20.2802 180.0449 25 I 3.6112 7.7564 116.4911 64.7239 37.0742 178.7412 26 L 3.7258 7.6638 119.5615 57.4346 41.0370 179.0429 27 D 4.2640 7.5622 116.9481 57.2516 41.3784 178.2441 28 G 3.6606 8.0768 104.8876 47.0014 0.0000 174.7785 29 L 4.1426 7.3719 121.6240 57.0997 42.2461 178.0989 30 A 3.9881 7.5968 121.0128 54.9050 18.0824 177.9324 31 P 4.2924 0.0000 0.0000 65.5734 31.3493 177.5587 32 E 4.4756 7.9973 116.7988 56.2270 30.0486 176.0607 33 L 4.5887 7.4501 120.0042 52.2190 41.9383 175.2803 34 P 4.2918 0.0000 0.0000 65.2183 31.6383 178.1089 35 G 3.7853 8.1354 105.3726 45.8816 0.0000 172.3427 36 L 4.7335 7.6849 122.9093 54.2254 41.6339 176.0000 37 T 4.3622 8.7339 118.1796 62.9206 70.2933 174.9601 38 E 4.6529 7.6886 122.6347 54.6718 33.2882 173.2949 39 F 5.3372 8.7868 128.4759 56.5107 42.0738 174.1938 40 R 4.5778 8.0333 123.8538 54.7175 34.5421 173.7818 41 H 5.0849 7.9138 116.2968 54.1917 32.1131 172.4503 42 G 3.8276 7.7711 106.6927 45.0051 0.0000 170.3183 43 P 4.7417 0.0000 0.0000 62.3115 32.3284 176.2483 44 N 4.4124 8.5459 121.7230 53.0940 38.3070 175.2045 45 R 3.6394 8.3112 125.9207 57.1163 31.2624 176.5837 46 D 4.1989 7.6464 115.5031 55.1331 39.5774 174.1794 47 F 4.3676 7.5780 118.3087 59.9250 39.6479 176.5502 48 E 4.3760 8.2173 117.3696 55.4639 30.4280 175.3244 49 Q 4.0360 7.7230 116.5728 56.7968 26.3944 173.9793 50 K 4.7184 8.5995 111.6507 55.8186 33.7509 178.1664 51 S 4.6766 7.8316 112.3218 57.0394 62.6188 176.6125 52 E 4.0430 8.4188 122.1388 59.8601 29.4988 178.6153 53 R 3.8229 7.7687 118.1241 58.1781 30.2500 175.6719 54 Y 5.1775 7.7730 114.9748 54.3677 38.0026 173.3262 55 P 4.5933 0.0000 0.0000 64.6101 32.9998 175.4555 56 Y 4.9802 7.8446 121.0584 56.6972 42.7796 173.6173 57 G 4.2425 8.0406 110.4734 46.4433 0.0000 171.4251 58 F 5.3825 8.4573 114.0636 55.7334 42.0787 173.1627 59 L 5.0759 8.8423 120.7547 53.6893 45.4019 174.4127 60 C 5.0573 9.0890 124.2970 58.2748 30.6947 172.9575 61 T 4.4376 8.4084 121.7039 62.5289 69.2820 173.8650 62 F 6.1316 9.1280 125.9808 55.1778 41.2729 176.3067 63 T 4.3620 8.8447 112.4493 64.3468 70.3891 173.6654 64 D 4.7729 7.8771 119.7947 50.9102 42.1140 175.8785 65 K 3.8159 8.6700 119.4558 59.7091 31.8981 178.3194 66 A 3.9734 7.9952 120.2114 54.7219 18.3048 179.3880 67 A 3.9485 7.8912 119.3896 55.2436 18.5327 179.5765 68 L 2.4400 7.4611 118.7803 57.8002 42.0954 179.0291 69 D 4.2639 8.1466 118.7320 57.1852 40.5583 178.4464 70 A 4.0062 7.6978 120.1919 55.2811 18.7647 178.7317 71 Y 4.1640 8.0006 117.6496 60.7478 38.6815 177.8368 72 A 3.7816 7.7698 121.2687 55.5423 18.4062 179.1559 73 V 3.8289 7.4574 105.6028 62.6503 32.1214 177.0177 74 H 4.1446 7.8622 121.1722 55.3932 30.8280 173.7143 75 P 4.1852 0.0000 0.0000 66.2459 31.2327 178.7813 76 T 3.8726 8.0198 113.9228 66.7631 68.3861 176.0621 77 H 3.9640 8.0820 119.6251 59.3652 29.9795 177.0629 78 Q 3.8640 8.2537 120.1698 58.8685 28.2317 179.1196 79 R 3.7745 7.8356 118.6096 59.3675 30.2662 178.1562 80 A 4.1707 7.6434 119.2039 55.0246 18.6857 179.2872 81 G 3.9367 8.5967 104.7740 47.8383 0.0000 177.1303 82 G 3.7269 7.8547 106.7999 44.5087 0.0000 175.5656 *84 L 4.3007 7.8842 121.3506 54.5107 43.9360 179.4122 85 V 3.6019 7.8878 117.3477 66.1908 31.1282 177.7632 86 A 4.1764 8.1178 118.4685 54.0024 18.4654 178.5138 87 S 4.6253 8.1773 112.3596 57.6336 64.1891 173.3713 88 C 5.2565 7.1005 119.1931 57.1665 30.8845 173.0396 89 R 4.1597 9.1240 122.8474 57.7205 29.7325 176.6081 90 N 4.0348 9.6258 123.0444 54.4470 37.4484 175.5553 91 G 4.3028 7.6570 110.0886 46.0986 0.0000 178.3088 92 A 4.1560 8.5737 126.6945 54.5444 18.3980 179.4339 93 D 4.4785 7.8083 114.8209 56.7518 41.0723 177.2140 94 G 4.2460 8.1243 107.5938 44.5452 0.0000 172.6046 95 I 4.8553 7.5985 119.6609 58.9697 40.4680 174.6128 96 L 4.5908 8.4331 128.4366 53.2091 44.2335 174.8081 97 V 4.5652 8.3628 125.9780 61.1836 33.6784 174.4006 98 V 4.2366 8.4925 128.5854 61.5686 33.5663 174.4143 99 D 5.2537 8.5578 127.0157 52.3754 41.4093 173.7868 100 L 4.2078 8.9994 122.5798 54.1065 43.3763 175.4207 101 E 4.5913 8.8067 125.3856 55.0982 30.1003 176.2385 102 V 3.8626 8.0554 119.6064 61.3522 31.9497 176.0768 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 8.35 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.53 4.39 0.00 1.86 1.83 0.93 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 3 Y 9.18 4.81 0.00 2.81 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 4 H 9.21 5.21 0.00 3.54 3.58 0.00 5.75 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.72 4.88 0.00 1.51 1.37 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 6 V 7.90 5.04 0.67 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 1.23 0.00 0.00 0.52 0.00 0.00 *8 L 8.17 4.50 0.00 1.87 1.76 1.27 0.96 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 9 E 9.03 4.88 0.00 2.05 1.88 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 2.37 2.33 0.00 10 P 0.00 4.91 0.00 1.95 1.99 0.00 3.68 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 11 E 9.44 4.57 0.00 1.68 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 2.15 2.13 0.00 12 G 9.31 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 13 E 8.49 3.94 0.00 2.00 1.77 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 2.23 1.88 0.00 14 G 9.04 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 0.00 0.00 0.00 15 A 7.78 3.88 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *17 D 8.09 4.49 0.00 2.86 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 18 R 7.96 4.03 0.00 1.89 2.07 0.00 3.13 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 19 I 7.65 3.90 1.74 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 1.34 0.74 0.83 0.00 0.00 *21 E 8.46 4.31 0.00 2.25 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 2.29 0.00 22 A 7.79 3.80 1.31 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 0.00 0.00 *24 A 8.16 4.27 1.31 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 0.00 0.00 25 I 7.76 3.61 1.93 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.05 0.83 0.00 0.00 26 L 7.66 3.73 0.00 0.88 0.70 0.64 0.72 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 27 D 7.56 4.26 0.00 2.82 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 28 G 8.08 3.66 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 0.00 0.00 0.00 29 L 7.37 4.14 0.00 1.68 1.69 0.57 0.88 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 30 A 7.60 3.99 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 31 P 0.00 4.29 0.00 2.23 2.20 0.00 3.70 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 32 E 8.00 4.48 0.00 2.07 2.04 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 2.31 2.48 0.00 33 L 7.45 4.59 0.00 1.79 1.72 1.15 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.29 0.00 2.07 2.15 0.00 3.71 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 35 G 8.14 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.68 4.73 0.00 1.76 1.57 0.87 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.73 4.36 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 1.22 0.00 0.00 38 E 7.69 4.65 0.00 1.92 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 39 F 8.79 5.34 0.00 2.92 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 40 R 8.03 4.58 0.00 1.47 1.50 0.00 3.19 0.00 0.00 3.08 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.55 0.00 41 H 7.91 5.08 0.00 3.17 3.00 0.00 5.79 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 G 7.77 3.83 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 0.00 0.00 0.00 43 P 0.00 4.74 0.00 2.09 2.20 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.02 0.00 44 N 8.55 4.41 0.00 2.63 2.85 0.00 0.00 7.21 7.22 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 45 R 8.31 3.64 0.00 0.88 0.90 0.00 3.47 0.00 0.00 3.02 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.44 0.00 46 D 7.65 4.20 0.00 2.89 2.47 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 47 F 7.58 4.37 0.00 3.12 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 48 E 8.22 4.38 0.00 1.99 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 0.00 2.30 2.40 0.00 49 Q 7.72 4.04 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.25 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 50 K 8.60 4.72 0.00 1.70 1.77 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.42 7.81 51 S 7.83 4.68 0.00 4.14 4.08 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 0.00 0.00 0.00 52 E 8.42 4.04 0.00 1.94 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 2.37 2.23 0.00 53 R 7.77 3.82 0.00 1.47 1.25 0.00 2.91 0.00 0.00 2.65 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.32 0.00 54 Y 7.77 5.18 0.00 2.98 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 55 P 0.00 4.59 0.00 2.21 2.34 0.00 4.08 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.01 0.00 56 Y 7.84 4.98 0.00 3.11 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 57 G 8.04 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 0.00 0.00 0.00 0.00 58 F 8.46 5.38 0.00 2.94 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 59 L 8.84 5.08 0.00 1.58 1.30 0.74 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 60 C 9.09 5.06 0.00 2.52 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 0.00 0.00 0.00 61 T 8.41 4.44 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 1.18 0.00 0.00 62 F 9.13 6.13 0.00 2.92 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 63 T 8.84 4.36 4.29 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 1.26 0.00 0.00 64 D 7.88 4.77 0.00 2.89 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 65 K 8.67 3.82 0.00 1.87 1.84 0.00 1.55 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.68 7.81 66 A 8.00 3.97 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 67 A 7.89 3.95 1.52 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 0.00 0.00 68 L 7.46 2.44 0.00 1.12 1.56 0.41 1.21 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 69 D 8.15 4.26 0.00 2.84 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 70 A 7.70 4.01 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 71 Y 8.00 4.16 0.00 3.21 3.02 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 72 A 7.77 3.78 1.36 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 0.00 0.00 73 V 7.46 3.83 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 0.65 0.00 0.00 1.01 0.00 0.00 74 H 7.86 4.14 0.00 3.44 3.19 0.00 5.61 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.19 0.00 2.14 2.05 0.00 3.19 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 2.00 2.11 0.00 76 T 8.02 3.87 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 1.16 0.00 0.00 77 H 8.08 3.96 0.00 2.71 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.25 3.86 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 79 R 7.84 3.77 0.00 1.88 2.11 0.00 3.24 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 80 A 7.64 4.17 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 81 G 8.60 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 82 G 7.85 3.73 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 0.00 0.00 0.00 *84 L 7.88 4.30 0.00 2.00 1.88 1.22 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.89 3.60 2.10 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 1.03 0.00 0.00 0.99 0.00 0.00 86 A 8.12 4.18 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 8.18 4.63 0.00 4.02 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 88 C 7.10 5.26 0.00 3.13 3.02 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 89 R 9.12 4.16 0.00 1.80 1.82 0.00 3.23 0.00 0.00 3.31 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 90 N 9.63 4.03 0.00 2.98 2.87 0.00 0.00 7.01 7.87 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 91 G 7.66 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 92 A 8.57 4.16 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 93 D 7.81 4.48 0.00 2.87 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.12 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 95 I 7.60 4.86 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.78 0.93 0.00 0.00 96 L 8.43 4.59 0.00 1.56 1.03 0.90 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.36 4.57 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 0.91 0.00 0.00 98 V 8.49 4.24 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 0.98 0.00 0.00 0.85 0.00 0.00 99 D 8.56 5.25 0.00 2.59 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 0.00 100 L 9.00 4.21 0.00 1.63 1.54 0.91 0.60 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 0.00 101 E 8.81 4.59 0.00 1.97 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 0.00 2.25 2.34 0.00 102 V 8.06 3.86 1.71 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 0.37 0.00 0.00 0.23 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.