NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 D 4.6352 8.2227 120.3170 52.7007 40.9901 175.7261 5 I 3.7487 8.2647 119.2637 62.6500 37.6310 176.3531 6 S 2.7900 8.5826 115.9566 60.5314 62.9190 175.1021 7 D 4.3036 7.9858 121.5551 55.7371 40.2504 177.1429 8 F 4.6773 7.7266 117.3473 57.1312 39.9717 176.8522 9 Y 3.3883 7.2928 117.7546 61.0313 37.7083 177.9262 10 Q 4.1735 8.2172 119.7922 59.9486 28.9036 178.8522 11 T 3.9520 7.8844 115.9072 66.5222 68.5108 176.3074 12 F 4.3393 7.7809 122.2620 61.4076 39.4814 177.0180 13 F 4.2828 8.1693 117.7461 60.7107 38.8166 177.2334 14 D 4.3189 8.2958 117.4413 57.3051 41.0183 177.8109 15 E 3.9173 8.3873 119.7009 59.3423 29.6680 178.6300 16 A 3.8515 8.3535 121.1450 55.1324 18.2773 179.2350 17 D 4.2989 8.0962 117.3605 57.5485 40.8133 178.9529 18 E 3.9466 8.0087 118.4114 59.4388 29.2879 179.4050 19 L 3.9961 7.9297 117.8310 57.7678 41.7643 179.2834 20 L 4.1183 8.1706 117.8639 57.7122 41.7480 179.0002 21 A 4.1958 8.1308 120.7491 55.1611 18.3045 180.3192 22 D 4.4817 8.1514 114.5876 54.6516 41.0789 177.7301 *24 E 4.1916 8.1230 119.1384 55.7666 31.6005 177.3812 25 Q 3.9434 7.8016 119.0499 59.6723 28.7882 178.0532 26 H 4.2918 8.0181 116.0321 58.7641 29.0856 177.5394 27 L 4.1735 7.7629 120.5213 57.7603 41.3699 179.2922 28 L 4.0899 8.0111 118.2102 57.3981 41.6300 178.3784 29 D 4.6376 7.8379 116.3111 53.7806 41.4984 176.9171 30 L 4.0820 7.0720 119.8408 54.6737 42.1915 176.8828 31 V 4.2502 8.0258 120.9076 60.5287 33.2705 172.5855 32 P 4.2202 0.0000 0.0000 62.5643 31.5720 175.5857 *37 A 4.4645 7.8582 124.2807 52.2222 21.0082 179.3646 38 E 4.2964 8.3220 116.1218 58.6609 29.1892 179.2554 39 Q 4.0940 8.1016 116.5244 58.7198 28.8821 177.7525 40 L 4.2521 8.0683 120.4530 56.1837 41.3988 178.2149 41 N 4.3398 8.0239 117.0859 56.7072 38.5565 176.7450 42 A 4.0290 7.9694 121.0241 55.3841 18.3250 179.6107 43 I 3.5900 7.5496 117.5843 64.4227 37.2029 178.4996 44 F 4.0447 8.1294 118.5834 60.4738 38.7972 177.4123 45 R 3.9458 8.4535 118.4647 59.5753 29.7538 178.2557 46 A 4.0008 8.1947 119.9611 55.1496 18.4438 179.3196 47 A 3.9513 8.1538 119.3600 55.5844 18.4037 179.0656 48 H 4.3178 8.8554 118.3153 59.0917 29.9362 177.5428 49 S 4.1413 8.2087 116.6284 61.6463 62.6234 176.8171 50 I 4.0389 8.1362 122.6750 64.4099 36.8120 178.4333 51 K 4.1246 8.7740 121.0583 59.2725 32.0182 178.9675 52 G 3.6128 8.3363 106.2949 47.9312 0.0000 175.9182 53 G 3.0148 8.1548 108.7135 46.8531 0.0000 175.5295 54 A 4.0337 8.0917 123.2578 54.9168 18.2723 180.0323 55 G 3.3674 8.1960 104.5117 48.0619 0.0000 176.1121 56 T 3.4775 7.2719 117.1533 65.6834 68.3641 175.7742 57 F 4.5772 6.8257 116.3419 56.1121 39.0597 175.9931 58 G 3.7873 7.0686 106.2890 47.1208 0.0000 176.1572 59 F 4.7102 7.7257 119.4097 55.4447 35.5021 175.4873 60 T 3.8931 7.8799 120.4385 67.0226 68.8883 175.5576 61 I 2.9402 7.7630 120.5355 64.2969 37.0959 178.2119 62 L 4.7633 7.8902 121.9072 57.6500 41.9597 178.6853 63 Q 4.0330 8.7651 120.0687 59.3099 29.0712 177.9967 64 E 4.1318 8.6891 120.6594 59.5182 29.4871 178.8443 65 T 4.0674 8.0977 115.0051 67.1507 68.6690 176.4700 66 T 4.0965 8.0818 116.4818 66.7579 68.7331 175.9233 67 H 4.6203 8.4386 120.2474 59.1223 30.0384 178.1906 68 L 4.2997 7.9835 120.8431 54.7998 41.2256 179.1582 *70 E 4.2945 8.1997 119.8139 56.6685 31.6439 178.1577 71 N 4.3942 8.3091 114.9957 56.3549 38.9724 176.9061 72 L 4.1793 7.8572 121.0716 58.1922 42.1545 178.8344 73 L 4.0496 8.0432 118.5111 58.0085 41.4305 178.9073 74 D 4.6496 8.8223 118.2460 57.4047 41.2415 178.1050 75 E 4.0419 8.2068 118.6796 59.2762 29.4429 179.2208 76 A 4.0706 7.9585 120.4034 55.0936 18.4099 179.4564 77 R 3.9775 8.2390 116.5790 59.6218 30.3359 178.3280 78 R 4.2358 8.3316 115.1096 56.2382 30.1693 177.5170 79 G 3.9732 7.8655 106.9859 46.0877 0.0000 173.7310 80 E 4.2389 7.8674 117.6240 56.6066 29.4353 176.3074 *82 Q 4.0847 7.9297 118.7245 55.7465 29.9916 174.5414 83 L 4.3408 8.3994 124.9851 54.6027 42.7608 176.4289 84 N 5.0786 8.2801 119.1655 50.4752 41.7526 175.4063 85 T 3.8925 8.6161 111.9974 65.5001 68.4981 176.0656 86 D 4.3310 8.1161 120.9168 57.2061 40.9384 178.5980 87 I 3.4893 8.1693 120.4769 64.2969 36.9766 178.5830 88 I 3.9258 7.7896 120.6975 64.4408 36.8037 178.2773 89 N 4.3692 8.2305 117.5003 55.8479 38.3181 177.3163 90 L 3.9030 7.6507 121.7838 58.1842 42.2324 178.8833 91 F 4.5709 7.9315 117.7057 60.9155 38.8666 177.7576 92 L 4.1152 8.3354 118.7490 57.6373 41.3846 179.1964 93 E 4.0231 8.4812 119.7134 59.5145 29.3687 178.9161 94 T 3.9551 8.3258 115.3367 66.4966 68.5762 176.1237 95 K 4.1167 8.0099 120.5876 59.5690 32.4856 178.2716 96 D 4.5830 7.9945 118.6750 57.2924 40.7072 180.0218 97 I 4.7387 7.7457 120.9212 60.9825 37.0407 178.0503 *99 Q 4.2105 8.0941 122.4574 56.2584 30.7637 176.8903 100 E 3.9197 8.3188 117.3883 59.2929 29.4559 179.3869 101 Q 3.6646 8.3054 118.3926 58.7746 28.8488 178.3423 102 L 4.0941 7.9053 120.7140 58.5714 41.9397 178.5936 103 D 4.1331 8.2992 118.6685 57.0406 40.5979 178.5246 104 A 3.8413 7.6747 121.2164 55.5739 18.5036 179.2846 105 Y 4.0853 7.2228 114.8870 61.2116 37.5905 179.1842 106 K 3.3360 7.3888 118.2202 58.0548 32.0286 178.0405 107 N 4.7512 7.2309 114.8586 52.0536 38.8215 174.8437 108 S 3.8888 7.6319 114.4232 59.6587 60.9683 171.5524 109 E 4.5817 8.0870 119.0593 54.6243 31.4663 174.9777 110 E 4.3351 8.2395 121.0938 53.9281 30.7250 174.0492 111 P 4.1735 0.0000 0.0000 62.1981 32.3665 175.5980 112 D 4.4741 8.3407 117.6095 53.6766 41.8564 176.4427 113 A 4.1688 8.6753 129.3216 55.1208 18.5933 178.9414 114 A 4.0022 8.0642 118.8420 55.6203 18.4920 179.9368 115 S 4.2429 9.0016 114.0759 61.5143 62.8702 176.6287 116 F 4.3610 8.2628 123.0876 61.6366 39.2402 177.0790 117 E 3.6114 8.6481 118.5143 59.2571 29.2291 178.7566 118 Y 4.0248 8.1048 119.5570 60.8132 38.8777 178.1337 119 I 3.2043 7.9271 119.6136 63.9639 37.9825 177.6257 120 C 4.0190 7.8895 117.6448 62.7979 27.8918 175.8490 121 N 4.1893 7.9728 117.8093 56.1037 38.0756 177.3466 122 A 3.8148 7.6526 122.0870 55.0947 18.4525 179.7177 123 L 3.8729 8.0915 117.8855 57.8802 41.5822 179.9805 124 R 3.8691 8.1350 118.1991 59.2900 29.9214 178.8492 125 Q 3.9474 8.0527 117.7140 59.1062 28.7899 178.9094 126 L 3.8932 7.6486 118.9324 58.1181 41.8962 179.7903 127 A 4.0754 7.9629 120.0881 54.5989 17.9827 179.5395 128 L 3.9501 7.9868 121.4491 59.0756 42.2928 179.3725 129 E 4.1230 8.2622 117.0543 61.5147 29.7060 179.8253 130 A 4.2354 8.1175 123.1250 55.8881 18.3964 178.2392 131 K 4.1520 8.2050 122.3494 54.4886 31.7749 179.2248 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 4 D 8.22 4.64 0.00 2.86 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 5 I 8.26 3.75 1.92 0.00 0.00 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 2.04 1.62 0.94 0.00 0.00 6 S 8.58 2.79 0.00 3.69 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 7 D 7.99 4.30 0.00 2.28 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 0.00 0.00 0.00 0.00 8 F 7.73 4.68 0.00 3.30 3.20 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 9 Y 7.29 3.39 0.00 2.81 2.24 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 10 Q 8.22 4.17 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.91 0.00 0.00 0.00 0.00 0.00 2.50 2.63 0.00 11 T 7.88 3.95 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 1.31 0.00 0.00 12 F 7.78 4.34 0.00 3.03 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 13 F 8.17 4.28 0.00 3.31 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 14 D 8.30 4.32 0.00 2.88 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 15 E 8.39 3.92 0.00 2.23 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 2.35 2.39 0.00 16 A 8.35 3.85 0.89 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 17 D 8.10 4.30 0.00 2.86 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 18 E 8.01 3.95 0.00 2.23 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 0.00 2.43 2.51 0.00 19 L 7.93 4.00 0.00 1.74 1.76 1.09 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.17 4.12 0.00 1.75 1.73 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.13 4.20 1.38 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 0.00 0.00 22 D 8.15 4.48 0.00 2.86 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 *24 E 8.12 4.19 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 2.28 2.32 0.00 25 Q 7.80 3.94 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.60 0.00 26 H 8.02 4.29 0.00 3.28 3.31 0.00 5.71 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 7.76 4.17 0.00 1.92 1.76 0.95 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.01 4.09 0.00 1.80 1.74 0.92 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 29 D 7.84 4.64 0.00 2.70 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 30 L 7.07 4.08 0.00 1.86 1.64 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.03 4.25 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 0.86 0.00 0.00 0.95 0.00 0.00 32 P 0.00 4.22 0.00 2.09 2.07 0.00 3.78 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 *37 A 7.86 4.46 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 38 E 8.32 4.30 0.00 2.03 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 2.41 2.24 0.00 39 Q 8.10 4.09 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.03 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 40 L 8.07 4.25 0.00 2.00 1.87 1.04 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.02 4.34 0.00 2.90 2.92 0.00 0.00 6.69 7.64 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 42 A 7.97 4.03 1.07 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 0.00 0.00 0.00 0.00 0.00 43 I 7.55 3.59 1.79 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.46 0.54 0.00 0.00 44 F 8.13 4.04 0.00 3.25 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 45 R 8.45 3.95 0.00 2.11 2.17 0.00 3.13 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 46 A 8.19 4.00 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 47 A 8.15 3.95 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 48 H 8.86 4.32 0.00 3.36 3.60 0.00 5.84 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 49 S 8.21 4.14 0.00 4.13 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 50 I 8.14 4.04 2.11 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 1.48 0.77 1.11 0.00 0.00 51 K 8.77 4.12 0.00 1.96 1.84 0.00 1.73 0.00 0.00 1.92 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.68 7.81 52 G 8.34 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 0.00 0.00 0.00 53 G 8.15 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 0.00 0.00 0.00 54 A 8.09 4.03 1.56 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 55 G 8.20 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 56 T 7.27 3.48 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 57 F 6.83 4.58 0.00 1.51 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 0.00 0.00 0.00 58 G 7.07 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 59 F 7.73 4.71 0.00 2.88 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 60 T 7.88 3.89 4.26 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 1.24 0.00 0.00 61 I 7.76 2.94 1.73 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.32 0.46 0.00 0.00 62 L 7.89 4.76 0.00 2.15 2.16 1.15 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.77 4.03 0.00 2.16 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.59 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 64 E 8.69 4.13 0.00 2.30 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 2.80 2.66 0.00 65 T 8.10 4.07 4.54 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 1.35 0.00 0.00 66 T 8.08 4.10 4.48 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 0.00 0.00 0.00 1.33 0.00 0.00 67 H 8.44 4.62 0.00 3.32 3.64 0.00 5.78 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 68 L 7.98 4.30 0.00 1.76 1.64 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 *70 E 8.20 4.29 0.00 2.34 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 0.00 2.43 2.58 0.00 71 N 8.31 4.39 0.00 2.84 2.90 0.00 0.00 7.03 7.47 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 L 7.86 4.18 0.00 1.84 1.91 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.04 4.05 0.00 1.60 0.85 0.13 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.82 4.65 0.00 3.10 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 75 E 8.21 4.04 0.00 2.35 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 2.59 2.51 0.00 76 A 7.96 4.07 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 77 R 8.24 3.98 0.00 2.13 2.26 0.00 3.02 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 78 R 8.33 4.24 0.00 1.88 1.97 0.00 3.35 0.00 0.00 3.24 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 79 G 7.87 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.87 4.24 0.00 2.26 1.99 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 2.35 2.26 0.00 *82 Q 7.93 4.08 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.84 6.96 0.00 0.00 0.00 0.00 0.00 2.25 2.46 0.00 83 L 8.40 4.34 0.00 1.72 1.62 0.99 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.28 5.08 0.00 2.92 2.84 0.00 0.00 5.97 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 85 T 8.62 3.89 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 1.22 0.00 0.00 86 D 8.12 4.33 0.00 2.88 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 87 I 8.17 3.49 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.94 0.39 0.00 0.00 88 I 7.79 3.93 2.03 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 1.66 0.87 0.99 0.00 0.00 89 N 8.23 4.37 0.00 2.88 2.87 0.00 0.00 6.59 6.17 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 90 L 7.65 3.90 0.00 1.64 1.49 0.84 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 91 F 7.93 4.57 0.00 3.34 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 L 8.34 4.12 0.00 1.90 1.76 0.95 1.14 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 93 E 8.48 4.02 0.00 2.19 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 0.00 2.44 2.43 0.00 94 T 8.33 3.96 4.54 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 1.29 0.00 0.00 95 K 8.01 4.12 0.00 1.79 2.04 0.00 1.84 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.47 1.64 7.81 96 D 7.99 4.58 0.00 2.99 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 97 I 7.75 4.74 2.07 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 1.47 1.82 1.02 0.00 0.00 *99 Q 8.09 4.21 0.00 2.25 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.33 6.90 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 100 E 8.32 3.92 0.00 2.18 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 2.53 0.00 101 Q 8.31 3.66 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.76 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 102 L 7.91 4.09 0.00 1.79 1.77 1.13 1.18 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 0.00 103 D 8.30 4.13 0.00 2.72 2.57 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 0.00 0.00 0.00 0.00 104 A 7.67 3.84 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 0.00 105 Y 7.22 4.09 0.00 2.92 2.52 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 0.00 106 K 7.39 3.34 0.00 1.52 1.49 0.00 1.29 0.00 0.00 1.37 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.43 0.21 7.81 107 N 7.23 4.75 0.00 2.68 2.84 0.00 0.00 7.01 7.42 0.00 0.00 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 S 7.63 3.89 0.00 4.11 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 0.00 109 E 8.09 4.58 0.00 1.99 1.79 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 2.23 2.36 0.00 110 E 8.24 4.34 0.00 1.88 1.79 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 2.23 2.31 0.00 111 P 0.00 4.17 0.00 1.98 1.53 0.00 3.62 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.51 0.00 112 D 8.34 4.47 0.00 2.79 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 A 8.68 4.17 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 0.00 114 A 8.06 4.00 1.38 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 0.00 0.00 115 S 9.00 4.24 0.00 3.92 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 0.00 116 F 8.26 4.36 0.00 3.19 3.33 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 0.00 117 E 8.65 3.61 0.00 2.04 1.94 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 2.22 2.60 0.00 118 Y 8.10 4.02 0.00 3.02 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 0.00 119 I 7.93 3.20 1.99 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.15 1.04 0.00 0.00 120 C 7.89 4.02 0.00 2.65 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 0.00 121 N 7.97 4.19 0.00 2.84 2.77 0.00 0.00 6.94 6.63 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 0.00 122 A 7.65 3.81 0.97 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 0.00 0.00 0.00 0.00 0.00 123 L 8.09 3.87 0.00 1.78 1.71 0.98 0.85 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 0.00 124 R 8.14 3.87 0.00 1.99 1.93 0.00 3.08 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 125 Q 8.05 3.95 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 126 L 7.65 3.89 0.00 1.74 1.65 0.72 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.96 4.08 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 0.00 128 L 7.99 3.95 0.00 1.87 1.89 0.91 1.12 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 0.00 129 E 8.26 4.12 0.00 2.10 1.85 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 2.26 2.20 0.00 130 A 8.12 4.24 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 0.00 131 K 8.21 4.15 0.00 1.83 1.60 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.26 7.81 * Residues marked with a * may have inaccurate shift predictions.