NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 S 4.4137 8.3349 115.4117 58.4363 64.6660 174.2849 7 I 3.9318 7.7843 122.6918 59.2070 35.3553 174.0979 8 A 4.1138 8.3912 125.4754 51.6727 20.2977 177.8012 9 I 3.8769 8.2363 123.9749 61.5983 38.0246 175.1286 10 D 4.7166 8.7472 123.6163 55.5136 42.2467 176.4481 11 S 4.7510 7.5726 109.9753 57.2659 65.7363 172.6071 12 Y 4.7880 8.2916 122.0028 56.1987 41.5520 173.7186 13 Q 4.2788 7.9775 127.5522 54.2308 31.3163 174.6929 14 E 3.9173 8.4107 124.8729 58.8562 30.1784 177.1394 15 D 4.3456 7.8107 116.9025 53.5781 41.3257 174.5226 16 P 4.1325 0.0000 0.0000 63.5431 31.2677 174.4682 17 S 4.4498 8.2586 116.5014 58.3475 65.0359 174.0036 18 V 4.2097 7.3846 121.8155 58.8228 33.3856 175.8218 19 V 4.1207 7.8246 120.3275 60.7460 32.6777 175.1544 20 V 3.6653 8.2593 127.7936 62.4745 31.9586 175.0390 21 S 4.3380 8.3496 121.3806 56.1666 64.2731 172.7487 22 N 4.5948 8.1537 125.7650 51.8853 38.5077 173.2685 23 F 4.5112 7.7569 124.9077 57.2549 39.5806 176.9603 24 F 4.8146 7.3187 117.3802 56.0316 40.6990 174.2576 25 K 3.9851 8.8117 121.2511 57.7998 32.2922 177.5968 26 G 3.6444 8.7258 113.6334 46.0457 0.0000 173.4713 27 V 3.1953 7.0759 116.5556 62.3966 32.5479 175.7525 28 R 4.2728 8.1310 124.7098 54.2362 30.1872 174.6565 29 V 4.0799 7.7761 121.6428 60.0594 32.1692 173.7834 30 P 4.6325 0.0000 0.0000 61.7059 31.9597 176.7290 31 K 4.1915 8.5077 117.3612 59.8559 32.9423 178.7995 32 D 4.3291 8.0442 117.7568 56.5585 41.3024 175.6096 33 T 3.9235 7.2556 113.9958 61.8015 66.7788 173.1649 34 E 4.5641 8.5630 129.4226 55.1961 30.5277 176.0915 35 F 4.7502 8.8950 122.6613 56.1452 40.7054 175.2638 36 Q 4.4186 8.5182 121.9073 54.0323 31.5780 174.9010 37 L 4.4677 8.0495 124.2121 53.8815 43.6868 175.8436 38 Y 4.5562 8.0025 120.2070 55.8978 39.6976 174.6619 39 K 4.1151 8.4478 126.1993 55.6537 33.0454 176.5067 40 K 4.1848 8.5000 127.5692 56.0761 32.8757 176.1611 41 R 4.2725 8.4516 125.4301 55.3672 30.8737 176.1705 42 K 4.2404 8.2307 123.5807 55.2473 34.5322 175.0764 43 Q 4.1666 8.6720 128.4134 55.3632 28.1359 175.0421 44 D 4.4328 8.4437 125.1962 54.5477 41.4518 176.7045 45 Q 4.4066 7.9440 119.2631 55.4775 29.9134 174.9309 46 F 5.0673 8.4552 117.4198 56.1235 43.4420 174.4421 47 V 4.7735 8.4205 118.5059 61.4128 34.7706 173.9494 48 L 4.8929 9.2600 128.3341 53.5827 45.7777 174.7579 49 H 4.9544 8.9184 124.3937 54.6220 32.4331 172.1886 50 G 4.2007 9.4512 115.0159 45.0129 0.0000 171.2929 51 E 5.3965 8.6228 124.5189 55.2604 33.1518 173.9491 52 N 4.8107 7.9995 120.4224 52.6931 39.8731 174.2712 53 E 4.3682 8.7553 118.0041 57.2613 29.6569 176.8164 54 R 4.4319 8.2243 117.7983 57.2077 32.2545 175.0359 55 L 4.9038 8.9266 116.0843 52.8343 46.5905 174.9299 56 E 4.8035 9.4332 123.0865 54.7442 32.4792 174.5146 57 Y 5.3478 9.1971 123.7468 55.4031 40.5867 173.6684 58 D 5.5162 8.4279 124.0146 52.6788 44.0489 175.7272 59 G 4.4582 8.6148 107.3576 46.4321 0.0000 171.8188 60 E 5.1666 8.5342 121.5048 54.3671 33.5979 174.0828 61 T 4.5782 8.3722 107.8646 59.4854 71.5792 174.0533 62 D 4.5461 8.5153 123.4424 53.0974 40.8139 176.1619 63 E 3.9041 8.7422 127.9235 59.5246 29.2252 178.3447 64 L 4.0821 7.4441 117.7924 58.4492 42.1693 179.1294 65 T 4.0626 8.2823 115.8651 66.7551 68.1579 176.4141 66 T 4.3406 7.3236 112.3222 64.0045 67.9880 175.2804 67 K 4.5706 7.8280 120.0711 56.5277 34.8049 177.4256 68 T 4.2906 7.6838 114.0390 64.7863 69.2087 174.4426 69 N 4.9192 7.9825 116.9480 51.2165 41.4561 174.4106 70 Q 4.4950 8.4431 120.8935 55.3594 30.7313 174.2348 71 Y 4.7298 8.4405 116.9246 56.6901 40.5132 174.5369 72 M 5.1158 8.6076 122.5632 53.5786 35.9311 174.7513 73 V 4.3577 8.7170 123.4225 61.6254 33.6373 174.8585 74 G 4.8380 8.5720 112.9878 44.4967 0.0000 171.4445 75 L 4.9444 8.6946 122.1361 52.8614 44.2837 174.6562 76 Y 5.5157 8.5416 124.3450 54.7872 41.5206 174.1551 77 D 4.3556 8.3359 126.6273 52.9200 41.5948 176.7381 78 K 3.4373 8.1719 127.1166 59.5451 32.2402 179.1365 79 Q 4.0940 7.6931 116.9215 57.6929 28.5606 177.7535 80 S 4.5521 7.9388 113.3037 59.2882 65.0441 175.6888 81 G 4.0128 8.8747 108.9448 45.6244 0.0000 172.8143 82 K 4.8385 7.8034 116.0685 54.1916 37.1161 176.3082 83 I 4.8244 8.2832 121.5706 59.6991 40.4853 175.2313 84 N 4.7367 9.1684 129.1631 52.3022 37.7603 174.0059 85 L 4.7090 7.9690 122.1640 54.5765 43.4438 176.0121 86 Y 4.6051 9.2277 120.3181 56.2224 41.9914 174.5585 87 R 4.4962 8.8962 125.7920 56.3445 30.7713 175.4853 88 A 4.8433 8.5667 127.5639 49.5081 21.9812 173.8225 89 P 4.4483 0.0000 0.0000 61.7622 32.8253 175.7529 90 V 3.8408 7.9339 119.6017 61.3874 31.8004 175.0990 91 V 4.4345 8.0529 128.2469 61.3298 32.8135 175.4700 92 T 4.2476 8.2146 119.2273 61.5134 68.3392 174.2884 93 S 5.1018 8.5239 122.9086 56.9299 66.4228 173.1045 94 K 4.6847 9.2151 120.3747 54.8061 36.3808 174.9529 95 I 4.6022 8.1687 121.0015 59.9321 39.6135 175.6528 96 V 4.5662 8.6388 118.6844 60.6248 37.0663 174.0040 97 S 4.8188 8.1189 114.6887 57.8202 65.0069 175.1386 98 K 4.1361 8.6593 123.7129 56.4767 31.9911 176.7938 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 6 S 8.33 4.41 0.00 3.98 3.96 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 7 I 7.78 3.93 1.86 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 1.34 0.20 0.90 0.00 0.00 8 A 8.39 4.11 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 9 I 8.24 3.88 1.86 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.55 0.94 0.00 0.00 10 D 8.75 4.72 0.00 2.63 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 7.57 4.75 0.00 3.98 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 12 Y 8.29 4.79 0.00 2.83 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 13 Q 7.98 4.28 0.00 1.84 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.78 0.00 0.00 0.00 0.00 0.00 2.11 2.33 0.00 14 E 8.41 3.92 0.00 1.87 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 2.36 2.43 0.00 15 D 7.81 4.35 0.00 2.60 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 16 P 0.00 4.13 0.00 2.00 2.01 0.00 3.59 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 17 S 8.26 4.45 0.00 3.87 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 18 V 7.38 4.21 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 0.71 0.00 0.00 0.89 0.00 0.00 19 V 7.82 4.12 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 0.79 0.00 0.00 0.89 0.00 0.00 20 V 8.26 3.67 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 0.76 0.00 0.00 0.89 0.00 0.00 21 S 8.35 4.34 0.00 3.54 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 22 N 8.15 4.59 0.00 2.57 2.61 0.00 0.00 7.08 7.02 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 23 F 7.76 4.51 0.00 2.72 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 24 F 7.32 4.81 0.00 3.10 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 25 K 8.81 3.99 0.00 1.89 1.89 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.50 7.81 26 G 8.73 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 27 V 7.08 3.20 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 -0.10 0.00 0.00 0.68 0.00 0.00 28 R 8.13 4.27 0.00 1.80 1.83 0.00 3.24 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 29 V 7.78 4.08 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 0.97 0.00 0.00 0.61 0.00 0.00 30 P 0.00 4.63 0.00 2.09 2.01 0.00 3.73 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 2.02 2.06 0.00 31 K 8.51 4.19 0.00 1.92 2.07 0.00 1.53 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.37 7.81 32 D 8.04 4.33 0.00 2.64 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 33 T 7.26 3.92 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 1.37 0.00 0.00 34 E 8.56 4.56 0.00 2.00 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 2.30 2.37 0.00 35 F 8.89 4.75 0.00 2.94 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 36 Q 8.52 4.42 0.00 2.04 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 37 L 8.05 4.47 0.00 1.52 1.42 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 8.00 4.56 0.00 2.95 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 39 K 8.45 4.12 0.00 1.72 1.73 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.44 7.81 40 K 8.50 4.18 0.00 1.78 1.71 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.47 7.81 41 R 8.45 4.27 0.00 1.86 1.87 0.00 3.29 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 42 K 8.23 4.24 0.00 1.67 1.65 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.37 7.81 43 Q 8.67 4.17 0.00 2.12 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.75 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 44 D 8.44 4.43 0.00 2.40 2.37 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 45 Q 7.94 4.41 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 46 F 8.46 5.07 0.00 2.87 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 47 V 8.42 4.77 2.13 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 0.81 0.00 0.00 0.97 0.00 0.00 48 L 9.26 4.89 0.00 1.75 1.45 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 49 H 8.92 4.95 0.00 3.15 3.19 0.00 5.96 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 50 G 9.45 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 0.00 0.00 0.00 0.00 51 E 8.62 5.40 0.00 1.97 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 2.23 2.34 0.00 52 N 8.00 4.81 0.00 2.95 2.82 0.00 0.00 6.98 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 53 E 8.76 4.37 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 2.32 2.30 0.00 54 R 8.22 4.43 0.00 1.73 1.99 0.00 3.19 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 55 L 8.93 4.90 0.00 1.44 0.94 0.95 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 56 E 9.43 4.80 0.00 1.86 1.66 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 2.12 2.23 0.00 57 Y 9.20 5.35 0.00 2.84 2.80 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 58 D 8.43 5.52 0.00 2.60 2.58 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 59 G 8.61 4.46 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 0.00 60 E 8.53 5.17 0.00 2.04 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 2.28 2.30 0.00 61 T 8.37 4.58 4.33 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 1.39 0.00 0.00 62 D 8.52 4.55 0.00 2.83 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 63 E 8.74 3.90 0.00 2.08 1.98 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 2.40 2.55 0.00 64 L 7.44 4.08 0.00 1.79 1.83 0.93 0.86 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 65 T 8.28 4.06 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 1.46 0.00 0.00 66 T 7.32 4.34 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 1.43 0.00 0.00 67 K 7.83 4.57 0.00 1.85 1.80 0.00 1.91 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.45 7.81 68 T 7.68 4.29 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 1.21 0.00 0.00 69 N 7.98 4.92 0.00 2.59 2.43 0.00 0.00 7.15 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 70 Q 8.44 4.50 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.70 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 71 Y 8.44 4.73 0.00 3.04 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 72 M 8.61 5.12 0.00 1.87 1.93 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 73 V 8.72 4.36 2.13 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 0.95 0.00 0.00 0.95 0.00 0.00 74 G 8.57 4.84 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 75 L 8.69 4.94 0.00 1.69 1.63 0.99 0.69 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 76 Y 8.54 5.52 0.00 2.87 2.82 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 77 D 8.34 4.36 0.00 2.59 2.35 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 78 K 8.17 3.44 0.00 1.66 1.83 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.43 7.81 79 Q 7.69 4.09 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 80 S 7.94 4.55 0.00 3.96 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 81 G 8.87 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 0.00 0.00 0.00 82 K 7.80 4.84 0.00 1.65 1.69 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.34 7.81 83 I 8.28 4.82 1.97 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 1.37 0.81 0.93 0.00 0.00 84 N 9.17 4.74 0.00 2.86 2.88 0.00 0.00 6.64 6.54 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 85 L 7.97 4.71 0.00 1.46 1.57 0.91 0.86 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 86 Y 9.23 4.61 0.00 2.76 2.79 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 87 R 8.90 4.50 0.00 1.86 1.90 0.00 3.24 0.00 0.00 3.47 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 88 A 8.57 4.84 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 89 P 0.00 4.45 0.00 1.94 1.81 0.00 3.47 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.44 0.00 90 V 7.93 3.84 1.45 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 0.54 0.00 0.00 0.23 0.00 0.00 91 V 8.05 4.43 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 0.92 0.00 0.00 0.91 0.00 0.00 92 T 8.21 4.25 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 1.18 0.00 0.00 93 S 8.52 5.10 0.00 3.82 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 94 K 9.22 4.68 0.00 1.62 1.67 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 95 I 8.17 4.60 1.78 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.65 0.50 0.00 0.00 96 V 8.64 4.57 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 0.74 0.00 0.00 0.92 0.00 0.00 97 S 8.12 4.82 0.00 3.88 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 98 K 8.66 4.14 0.00 1.76 1.75 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.37 7.81