NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *0 A 4.0844 8.2601 123.5821 51.9671 20.2322 176.9206 *2 A 4.0396 7.9829 121.1152 51.5273 19.7143 176.0727 3 A 4.2674 8.2142 122.3001 50.8486 19.4645 175.8533 4 P 4.2952 0.0000 0.0000 63.0893 31.9329 177.8400 5 I 3.6986 8.5654 123.2520 64.1654 37.2778 177.6687 6 L 4.6884 7.4939 119.2589 53.4746 42.3187 176.1222 7 K 3.9659 7.6108 119.4008 58.4126 32.4098 176.3671 8 D 4.6095 8.8654 123.3845 54.4963 38.7181 173.8808 9 V 3.9323 7.6850 121.0991 62.4723 33.0545 174.9332 10 V 4.7653 9.0105 127.9261 61.3672 33.6216 173.8519 11 A 5.2574 9.1830 130.8317 50.5387 21.7791 174.6256 12 Y 4.9796 8.8870 121.9516 55.6757 41.7444 174.4109 13 V 4.5984 7.7479 125.9547 61.1607 33.8648 174.8974 14 E 4.4731 9.2601 128.7077 54.2652 31.5432 172.5678 15 V 4.7032 8.7931 124.6007 60.5269 34.4143 173.9948 16 W 5.4112 9.0993 127.5259 54.3642 33.0899 175.6223 17 S 4.5152 9.0313 116.9546 58.4971 63.2769 175.6138 18 S 4.3296 9.1663 117.1157 61.0794 62.6898 175.3388 19 N 4.4716 8.1446 114.7048 53.0527 37.6076 175.8531 20 G 3.8604 8.3237 108.0855 45.7856 0.0000 174.4795 21 T 4.2549 8.1355 109.9864 62.6026 69.6454 174.8763 22 E 4.3221 8.3273 122.3291 54.0721 31.5778 174.1659 23 N 3.5598 7.9386 122.0399 51.9031 39.8072 173.5160 24 Y 4.7582 8.0259 123.3447 57.9543 38.4967 178.2426 25 S 4.2706 8.2612 119.8697 61.1215 63.1884 176.6904 26 K 4.0826 7.9444 120.9956 59.3694 31.5665 178.5562 27 T 3.7668 7.5776 112.1309 64.8573 67.2208 176.3118 28 F 4.1486 8.0538 119.3127 60.1033 39.1607 177.5066 29 T 3.8840 7.5925 114.4190 67.2279 68.1991 176.3305 30 T 3.8670 7.5759 117.3328 66.9180 68.2270 176.6833 31 Q 3.9538 7.5317 118.2795 58.8129 29.1265 178.4723 32 L 4.0991 7.9130 120.0051 57.8338 41.4750 179.7035 33 V 4.0317 7.3791 118.0216 65.2414 31.6150 178.7198 34 D 4.6428 7.6270 119.4378 53.7665 40.7258 177.4615 *36 G 3.7978 8.0503 106.6469 44.7752 0.0000 173.6340 37 A 4.5545 7.7298 121.8316 51.7434 20.0709 176.8200 38 K 4.5983 8.8601 118.8794 54.8498 34.8593 175.8522 39 V 4.8668 8.2719 122.5224 61.2508 33.8233 174.4714 40 S 4.7993 9.1541 123.3203 56.8619 63.0605 174.5645 41 K 4.2791 8.9941 125.9448 58.6462 32.2482 176.9183 42 T 4.8455 7.4893 107.0234 59.5918 71.6085 174.3120 43 F 4.2315 8.0208 125.4486 56.8346 37.8464 174.4267 44 N 4.9407 7.9042 123.7841 50.4619 39.9631 176.3470 45 K 4.1730 8.4358 116.1312 59.0643 32.2449 178.4014 46 Q 4.1707 8.0789 117.1351 57.5381 29.0060 176.7663 47 V 3.9295 7.6607 118.7658 63.2514 32.0983 175.3876 48 T 4.5697 9.2035 116.9243 62.4094 71.2746 173.9848 49 H 5.1520 8.0686 118.3914 53.8003 33.5374 172.3681 50 V 4.7308 8.8982 122.4925 61.1693 34.2493 174.2009 51 I 4.7732 8.5198 129.4393 60.1952 38.3927 174.5326 52 F 5.2716 8.9954 129.8896 56.1654 42.0232 174.3075 53 K 4.3446 8.5126 127.1057 55.1874 35.7394 175.7205 54 D 4.4666 8.6660 128.5372 55.2421 38.9532 173.6064 55 G 3.6866 6.1480 109.6175 45.0126 0.0000 173.5683 56 Y 4.3811 9.3996 118.1555 57.2850 39.9968 176.2647 57 Q 4.2093 9.0056 124.7254 59.5174 29.1781 179.0231 58 S 4.2741 8.3397 114.8787 61.6844 62.9937 176.6014 59 T 4.2211 8.2552 118.8931 66.2080 68.4216 176.1558 60 W 3.8574 8.3928 130.0991 60.7240 30.7098 177.7195 61 D 4.4460 8.7617 119.1345 57.2674 40.2328 178.7774 62 K 3.8197 8.2774 119.9877 59.2099 32.1358 178.7368 63 A 4.2100 8.3642 121.1999 55.4011 18.1748 179.5711 64 Q 3.7528 7.8806 116.5055 58.9590 28.5320 179.1015 65 K 3.9155 7.9133 119.5017 59.2696 32.3816 178.3154 66 R 4.2889 8.0171 115.4256 55.5383 30.3226 176.8695 67 G 3.8320 7.4215 106.7715 46.2658 0.0000 173.9873 68 V 3.8372 7.5072 119.3074 61.9642 32.5610 175.9343 69 K 3.9698 8.4594 127.3327 56.3419 33.0606 175.8116 70 L 4.9275 8.2118 125.2262 53.2474 43.0296 176.2061 71 V 4.8063 8.3804 117.2097 59.1975 36.0740 175.7823 72 S 4.8105 8.7777 117.9033 57.7662 64.4306 175.7472 73 V 3.4303 8.3876 112.9706 64.2064 31.0707 178.6284 74 L 4.0601 7.7210 117.6301 57.5165 41.4022 179.2669 75 W 3.0306 8.0561 128.1499 59.8733 30.6701 178.1766 76 V 3.1520 7.6306 118.0716 65.8841 30.9929 177.5548 77 E 3.8446 8.0539 118.4921 59.1753 29.4212 178.5494 78 K 3.8347 7.7626 119.5454 59.5664 32.3117 178.4486 79 C 4.3122 7.4096 118.3269 62.0584 27.7787 176.2321 80 R 3.7371 7.5645 119.9426 59.6961 29.5380 178.7748 81 T 3.8701 7.9689 108.3731 64.4666 68.9546 175.8484 82 A 4.2204 8.3503 122.1547 51.6403 19.1147 177.1066 83 G 3.8650 7.6196 105.1131 45.5973 0.0000 173.2114 84 A 4.5194 7.5523 118.8486 50.7681 22.5188 176.4150 85 H 4.3759 8.4981 120.3035 55.0463 28.4758 174.7794 86 I 3.9838 7.7820 125.7984 60.3461 38.0059 175.8106 87 D 4.5461 8.9596 123.6034 54.7080 41.5792 177.0974 88 E 3.9275 9.1427 126.7771 59.3700 29.2077 179.2449 89 S 4.2400 8.2570 113.2885 60.6340 63.1442 175.6173 90 L 4.2439 7.8670 120.9799 55.3035 43.1277 176.3777 91 F 5.0166 8.2135 117.6391 55.2358 38.8159 173.0559 92 P 4.7315 0.0000 0.0000 63.0070 32.1697 178.1432 93 A 4.6421 8.7347 124.1930 51.7555 19.6307 176.2971 94 A 4.8542 8.7725 121.0735 50.4442 21.9928 176.1607 95 N 4.2953 8.0301 117.7582 53.6139 39.1060 174.1667 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 A 8.26 4.08 1.24 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 *2 A 7.98 4.04 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 3 A 8.21 4.27 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 4 P 0.00 4.30 0.00 2.19 2.00 0.00 3.62 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 2.12 2.13 0.00 5 I 8.57 3.70 1.78 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.42 0.81 0.00 0.00 6 L 7.49 4.69 0.00 1.62 1.61 0.64 0.31 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 7 K 7.61 3.97 0.00 1.86 1.77 0.00 1.90 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.45 7.81 8 D 8.87 4.61 0.00 2.94 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 9 V 7.69 3.93 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 0.92 0.00 0.00 0.94 0.00 0.00 10 V 9.01 4.77 2.28 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 0.89 0.00 0.00 0.97 0.00 0.00 11 A 9.18 5.26 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 12 Y 8.89 4.98 0.00 2.89 2.48 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 0.00 13 V 7.75 4.60 1.95 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 0.85 0.00 0.00 0.93 0.00 0.00 14 E 9.26 4.47 0.00 1.99 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 2.48 2.59 0.00 15 V 8.79 4.70 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 1.05 0.00 0.00 0.75 0.00 0.00 16 W 9.10 5.41 0.00 3.13 2.98 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 17 S 9.03 4.52 0.00 4.02 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 18 S 9.17 4.33 0.00 3.91 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 19 N 8.14 4.47 0.00 2.81 2.94 0.00 0.00 6.16 7.00 0.00 0.00 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 G 8.32 3.86 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 0.00 0.00 0.00 21 T 8.14 4.25 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 1.26 0.00 0.00 22 E 8.33 4.32 0.00 1.37 1.16 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 2.21 2.40 0.00 23 N 7.94 3.56 0.00 1.44 2.02 0.00 0.00 7.04 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 24 Y 8.03 4.76 0.00 3.15 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 25 S 8.26 4.27 0.00 3.72 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 26 K 7.94 4.08 0.00 1.78 1.74 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.46 7.81 27 T 7.58 3.77 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 0.82 0.00 0.00 28 F 8.05 4.15 0.00 3.14 3.09 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 29 T 7.59 3.88 4.45 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 1.22 0.00 0.00 30 T 7.58 3.87 4.32 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 1.16 0.00 0.00 31 Q 7.53 3.95 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.96 0.00 0.00 0.00 0.00 0.00 2.26 2.51 0.00 32 L 7.91 4.10 0.00 1.92 1.75 1.08 0.90 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 33 V 7.38 4.03 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 1.12 0.00 0.00 0.96 0.00 0.00 34 D 7.63 4.64 0.00 2.60 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 *36 G 8.05 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.73 4.55 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 38 K 8.86 4.60 0.00 1.74 1.75 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.38 7.81 39 V 8.27 4.87 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 0.81 0.00 0.00 1.00 0.00 0.00 40 S 9.15 4.80 0.00 3.95 3.87 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 41 K 8.99 4.28 0.00 1.86 1.95 0.00 1.81 0.00 0.00 1.81 0.00 0.00 3.10 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.42 7.81 42 T 7.49 4.85 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 1.28 0.00 0.00 43 F 8.02 4.23 0.00 1.73 2.48 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 0.00 44 N 7.90 4.94 0.00 2.99 2.98 0.00 0.00 6.14 6.47 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 45 K 8.44 4.17 0.00 1.77 1.91 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.43 7.81 46 Q 8.08 4.17 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 47 V 7.66 3.93 2.42 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 0.68 0.00 0.00 1.10 0.00 0.00 48 T 9.20 4.57 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 1.26 0.00 0.00 49 H 8.07 5.15 0.00 3.05 3.05 0.00 5.75 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 V 8.90 4.73 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 1.20 0.00 0.00 0.39 0.00 0.00 51 I 8.52 4.77 1.85 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.58 0.76 0.00 0.00 52 F 9.00 5.27 0.00 3.13 3.04 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 53 K 8.51 4.34 0.00 1.78 1.55 0.00 1.86 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.44 7.81 54 D 8.67 4.47 0.00 3.03 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 55 G 6.15 3.69 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 0.00 56 Y 9.40 4.38 0.00 3.28 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 57 Q 9.01 4.21 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.90 0.00 0.00 0.00 0.00 0.00 2.48 2.77 0.00 58 S 8.34 4.27 0.00 4.13 4.18 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 59 T 8.26 4.22 5.09 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 1.77 0.00 0.00 60 W 8.39 3.86 0.00 3.17 3.21 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 0.00 61 D 8.76 4.45 0.00 2.78 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 62 K 8.28 3.82 0.00 1.74 1.78 0.00 1.17 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.44 1.03 7.81 63 A 8.36 4.21 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 64 Q 7.88 3.75 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.01 2.37 0.00 65 K 7.91 3.92 0.00 1.77 1.92 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.44 7.81 66 R 8.02 4.29 0.00 1.91 1.95 0.00 3.12 0.00 0.00 2.95 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 67 G 7.42 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 68 V 7.51 3.84 2.28 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 0.69 0.00 0.00 1.11 0.00 0.00 69 K 8.46 3.97 0.00 1.29 1.38 0.00 1.38 0.00 0.00 1.45 0.00 0.00 2.72 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.28 1.21 7.81 70 L 8.21 4.93 0.00 1.10 1.26 -0.51 0.51 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 71 V 8.38 4.81 1.91 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 0.21 0.00 0.00 0.64 0.00 0.00 72 S 8.78 4.81 0.00 4.04 4.32 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 73 V 8.39 3.43 1.57 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 0.32 0.00 0.00 0.90 0.00 0.00 74 L 7.72 4.06 0.00 2.12 2.04 1.11 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 75 W 8.06 3.03 0.00 3.26 3.26 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 76 V 7.63 3.15 2.33 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 0.98 0.00 0.00 1.09 0.00 0.00 77 E 8.05 3.84 0.00 2.08 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 2.33 2.35 0.00 78 K 7.76 3.83 0.00 1.69 1.18 0.00 1.59 0.00 0.00 1.75 0.00 0.00 3.21 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.68 1.51 7.81 79 C 7.41 4.31 0.00 2.55 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 80 R 7.56 3.74 0.00 1.88 1.96 0.00 3.02 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 81 T 7.97 3.87 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 1.22 0.00 0.00 82 A 8.35 4.22 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 83 G 7.62 3.87 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 0.00 0.00 0.00 84 A 7.55 4.52 1.28 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 0.00 0.00 0.00 85 H 8.50 4.38 0.00 3.35 3.28 0.00 5.76 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 I 7.78 3.98 1.89 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 1.34 0.80 1.31 0.00 0.00 87 D 8.96 4.55 0.00 2.79 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 88 E 9.14 3.93 0.00 1.98 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.63 0.00 89 S 8.26 4.24 0.00 4.04 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 90 L 7.87 4.24 0.00 1.89 1.52 1.02 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 91 F 8.21 5.02 0.00 3.11 3.12 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 92 P 0.00 4.73 0.00 2.14 2.09 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 93 A 8.73 4.64 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 0.00 0.00 0.00 0.00 0.00 94 A 8.77 4.85 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 95 N 8.03 4.30 0.00 1.44 1.42 0.00 0.00 6.88 7.56 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 * Residues marked with a * may have inaccurate shift predictions.