NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 S 4.4171 8.3349 115.4123 58.4730 64.6640 174.2674 7 I 3.9502 7.7837 122.7637 59.2749 35.3747 174.0198 8 A 4.1382 8.3904 125.4780 51.5441 20.3228 177.7939 9 I 3.8504 8.2724 124.0831 61.6642 37.9884 175.0744 10 D 4.7085 8.7659 123.7779 55.5072 42.2542 176.2633 11 S 4.7483 7.5370 109.7241 57.2698 65.7934 172.4705 12 Y 4.7853 8.2723 121.3576 56.0257 41.5226 173.7874 13 Q 4.2719 7.9911 127.4599 54.2442 31.2421 174.6861 14 E 3.9370 8.4024 124.8562 58.8161 30.2099 177.1178 15 D 4.3964 7.7261 116.9975 53.4400 41.3855 174.6291 16 P 4.2528 0.0000 0.0000 63.3485 31.4569 174.7700 17 S 4.4351 8.2864 116.7084 58.5923 64.9499 174.0491 18 V 4.1896 7.3965 121.5860 58.9165 33.2588 175.8770 19 V 4.1064 7.8001 120.2374 60.7706 32.7364 175.0695 20 V 3.6479 8.2680 127.7725 62.4811 31.9076 175.0164 21 S 4.3443 8.3495 121.5806 56.1867 64.0688 172.7557 22 N 4.5748 8.1205 125.8672 51.9020 38.2952 173.2980 23 F 4.5348 7.6290 124.4216 57.3212 39.8142 176.8635 24 F 4.8608 7.1648 116.9638 55.9249 40.7181 174.1452 25 K 4.0242 8.7686 121.3569 57.6738 32.3821 177.6644 26 G 3.6787 8.7403 113.3513 46.0945 0.0000 173.5499 27 V 3.2436 7.1014 116.5888 62.3123 32.5324 175.7534 28 R 4.2823 8.1443 124.7118 54.2296 30.0609 174.5846 29 V 4.0969 7.7700 121.4690 60.0369 32.2901 173.8018 30 P 4.6270 0.0000 0.0000 61.7624 31.6771 176.7299 31 K 4.1926 8.5066 117.4646 59.8165 32.9570 178.8127 32 D 4.3605 8.0658 117.8213 56.6374 41.2845 175.6462 33 T 3.9309 7.2559 114.0400 61.7326 66.8081 173.2361 34 E 4.5324 8.5805 129.5208 55.2860 30.4011 176.1219 35 F 4.7600 8.8948 122.7296 56.1220 40.7169 175.2714 36 Q 4.4328 8.5366 121.9494 54.0256 31.5126 174.9209 37 L 4.4976 8.0472 124.2207 53.9375 43.6819 175.9370 38 Y 4.5519 7.9818 120.4550 56.0396 39.5808 174.3644 39 K 4.1376 8.4086 125.9519 55.4989 33.0814 176.6741 40 K 4.1264 8.4811 127.5833 56.1086 32.8262 176.3424 41 R 4.0701 8.4720 125.3806 55.7974 30.2218 176.4268 42 K 4.1996 8.3011 124.5919 54.5628 33.3491 175.2009 43 Q 4.0518 8.5998 128.0825 55.9242 28.5733 175.6763 44 D 4.4701 8.3981 125.3121 54.2903 41.5370 176.3932 45 Q 4.3656 7.9327 119.4116 55.5639 29.8029 175.0654 46 F 5.0816 8.9000 117.9641 56.0386 43.3405 174.4976 47 V 4.7821 8.4333 118.5654 61.4114 34.7997 173.9696 48 L 4.8881 9.2493 128.3733 53.5773 45.7544 174.6993 49 H 5.0383 8.9381 124.5081 54.6038 32.4169 172.2001 50 G 4.2108 9.4410 114.9317 45.0049 0.0000 171.3600 51 E 5.4147 8.6236 124.4570 55.1607 33.2159 173.8585 52 N 4.8315 8.0969 120.3606 52.7783 39.9957 174.0930 53 E 4.5250 8.6765 118.1755 56.9006 29.6511 176.9085 54 R 4.4446 8.2944 117.9517 57.3313 32.4187 174.9809 55 L 4.9083 8.8668 116.3909 52.8017 46.4734 174.8512 56 E 4.7811 9.3763 123.3461 54.7591 32.4330 174.4916 57 Y 5.2854 9.2325 124.0089 55.3830 40.4401 173.6062 58 D 5.5037 8.4373 123.9448 52.6580 43.9641 175.7017 59 G 4.4818 8.6835 107.5564 46.1584 0.0000 171.5145 60 E 5.2882 8.6482 121.5330 54.3259 33.8412 173.7702 61 T 4.6720 8.3433 109.3284 59.6011 71.6584 174.5711 62 D 4.5109 8.7270 123.4395 53.4128 41.1170 176.1363 63 E 3.8972 8.7792 127.9120 59.6042 29.3932 178.0592 64 L 4.1136 7.9605 119.3479 58.4862 42.1885 178.9513 65 T 4.0604 8.2292 115.8078 66.7676 68.1987 176.3582 66 T 4.2904 7.7384 113.5372 64.3010 68.2560 175.1762 67 K 4.5467 7.8540 119.5538 56.6997 34.8629 177.4254 68 T 4.2913 7.7177 113.7672 64.9064 69.1488 174.5624 69 N 4.9329 7.9570 116.8922 51.2033 41.6082 174.3130 70 Q 4.5354 8.4289 120.6680 55.2866 30.7435 174.2643 71 Y 4.8143 8.3973 116.7267 56.7278 40.9743 174.6340 72 M 5.2070 8.5167 121.7956 53.9344 36.3172 174.5675 73 V 4.3088 8.9165 123.6349 61.8998 33.6313 174.8913 74 G 4.8589 8.5328 112.1409 44.3919 0.0000 171.3802 75 L 4.9670 8.6575 121.4364 52.8375 44.6979 174.7175 76 Y 5.5742 8.4688 124.0183 54.7647 42.1393 173.6102 77 D 4.3105 8.3500 126.5421 52.8892 41.7098 176.7410 78 K 3.4905 8.0868 128.3606 59.0287 32.2452 179.1163 79 Q 4.0979 7.7382 117.0814 57.6392 28.5870 177.7151 80 S 4.5408 7.9344 113.4531 59.2735 65.0811 175.5692 81 G 4.0007 8.8357 108.8483 45.6756 0.0000 172.8597 82 K 4.8272 7.7832 116.1618 54.1928 36.9876 176.4501 83 I 4.7612 8.3074 121.8877 59.6909 40.5118 175.1993 84 N 4.7413 9.1774 129.1823 52.2726 37.8425 174.0581 85 L 4.7437 7.9889 122.2936 54.5894 43.3637 175.9906 86 Y 4.6381 9.2222 120.2989 56.2282 42.1357 174.5428 87 R 4.3874 8.9178 125.6921 56.4540 30.7527 175.4921 88 A 4.8254 8.5245 127.4453 49.4963 22.0454 173.9278 89 P 4.3785 0.0000 0.0000 62.0243 32.6036 176.0114 90 V 3.7994 7.9517 119.7057 61.4579 31.5689 175.2342 91 V 4.3937 8.0400 128.5378 61.4414 32.5443 175.5583 92 T 4.2496 8.1910 119.5022 61.5041 68.5761 174.3666 93 S 5.0821 8.5454 122.6426 56.8972 66.4734 173.0173 94 K 4.7208 9.2607 120.1342 54.8847 36.6033 175.0349 95 I 4.5685 8.1924 120.8842 59.9373 39.6685 175.6876 96 V 4.5724 8.7085 118.6467 60.5434 37.0625 174.1736 97 S 4.7109 8.1587 115.0996 57.8469 64.8517 175.0351 98 K 4.1366 8.6331 123.7349 56.4528 32.0019 176.8388 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 4.42 0.00 3.99 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 3.95 1.87 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 0.21 0.91 0.00 0.00 8 A 8.39 4.14 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 8.27 3.85 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.57 0.93 0.00 0.00 10 D 8.77 4.71 0.00 2.63 2.67 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 0.00 0.00 0.00 0.00 11 S 7.54 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 8.27 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 7.99 4.27 0.00 1.84 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.11 2.33 0.00 14 E 8.40 3.94 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 2.37 2.46 0.00 15 D 7.73 4.40 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 4.25 0.00 2.00 1.98 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 2.01 2.07 0.00 17 S 8.29 4.44 0.00 3.87 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 18 V 7.40 4.19 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 0.70 0.00 0.00 0.88 0.00 0.00 19 V 7.80 4.11 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 8.27 3.65 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 0.75 0.00 0.00 0.89 0.00 0.00 21 S 8.35 4.34 0.00 3.56 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 22 N 8.12 4.57 0.00 2.57 2.60 0.00 0.00 7.10 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 7.63 4.53 0.00 2.71 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 F 7.16 4.86 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 8.77 4.02 0.00 1.88 1.89 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.49 7.81 26 G 8.74 3.68 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 0.00 0.00 0.00 27 V 7.10 3.24 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.71 0.00 0.00 28 R 8.14 4.28 0.00 1.81 1.84 0.00 3.23 0.00 0.00 3.17 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 7.77 4.10 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 0.96 0.00 0.00 0.64 0.00 0.00 30 P 0.00 4.63 0.00 2.09 2.00 0.00 3.73 0.00 0.00 3.86 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 8.07 4.36 0.00 2.65 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 3.93 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 1.39 0.00 0.00 34 E 8.58 4.53 0.00 2.00 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 0.00 2.31 2.37 0.00 35 F 8.89 4.76 0.00 2.93 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 8.54 4.43 0.00 2.05 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 37 L 8.05 4.50 0.00 1.52 1.43 0.93 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 7.98 4.55 0.00 2.96 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 8.41 4.14 0.00 1.73 1.73 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.44 7.81 40 K 8.48 4.13 0.00 1.78 1.71 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.48 7.81 41 R 8.47 4.07 0.00 1.86 1.89 0.00 3.25 0.00 0.00 3.18 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 42 K 8.30 4.20 0.00 1.66 1.68 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.36 7.81 43 Q 8.60 4.05 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 44 D 8.40 4.47 0.00 2.41 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 0.00 0.00 0.00 45 Q 7.93 4.37 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 46 F 8.90 5.08 0.00 2.83 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 47 V 8.43 4.78 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 9.25 4.89 0.00 1.75 1.46 0.92 0.65 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 49 H 8.94 5.04 0.00 3.14 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 9.44 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 0.00 0.00 0.00 0.00 51 E 8.62 5.41 0.00 1.98 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 2.22 2.34 0.00 52 N 8.10 4.83 0.00 2.97 2.82 0.00 0.00 6.94 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 8.68 4.52 0.00 1.99 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 2.29 2.30 0.00 54 R 8.29 4.44 0.00 1.72 1.88 0.00 3.18 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 1.50 1.62 0.00 55 L 8.87 4.91 0.00 1.43 0.95 0.96 0.71 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 56 E 9.38 4.78 0.00 1.88 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 9.23 5.29 0.00 2.85 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 8.44 5.50 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 8.68 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 0.00 0.00 0.00 0.00 60 E 8.65 5.29 0.00 2.04 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 2.28 2.30 0.00 61 T 8.34 4.67 4.34 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 1.42 0.00 0.00 62 D 8.73 4.51 0.00 2.83 2.67 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 0.00 0.00 0.00 0.00 63 E 8.78 3.90 0.00 2.01 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 2.55 0.00 64 L 7.96 4.11 0.00 1.81 1.83 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 65 T 8.23 4.06 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 1.45 0.00 0.00 66 T 7.74 4.29 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 1.45 0.00 0.00 67 K 7.85 4.55 0.00 1.86 1.81 0.00 1.92 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 1.34 1.44 7.81 68 T 7.72 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 7.96 4.93 0.00 2.56 2.41 0.00 0.00 7.13 7.67 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 70 Q 8.43 4.54 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.70 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 71 Y 8.40 4.81 0.00 3.01 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 72 M 8.52 5.21 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 2.53 2.57 0.00 73 V 8.92 4.31 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 8.53 4.86 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 75 L 8.66 4.97 0.00 1.68 1.63 0.98 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.47 5.57 0.00 2.99 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 77 D 8.35 4.31 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 8.09 3.49 0.00 1.66 1.83 0.00 1.86 0.00 0.00 2.43 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.61 1.29 7.81 79 Q 7.74 4.10 0.00 2.07 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 7.93 4.54 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 8.84 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 0.00 0.00 0.00 82 K 7.78 4.83 0.00 1.66 1.70 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 8.31 4.76 1.96 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 1.37 0.81 0.93 0.00 0.00 84 N 9.18 4.74 0.00 2.86 2.89 0.00 0.00 6.64 6.67 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 85 L 7.99 4.74 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 1.58 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 9.22 4.64 0.00 2.76 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 87 R 8.92 4.39 0.00 1.86 1.90 0.00 3.24 0.00 0.00 3.45 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.69 0.00 88 A 8.52 4.83 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 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.38 0.00 1.96 1.81 0.00 3.47 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.44 0.00 90 V 7.95 3.80 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 0.54 0.00 0.00 0.19 0.00 0.00 91 V 8.04 4.39 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 0.95 0.00 0.00 0.91 0.00 0.00 92 T 8.19 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 8.55 5.08 0.00 3.82 3.93 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 94 K 9.26 4.72 0.00 1.60 1.66 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 1.35 1.39 7.81 95 I 8.19 4.57 1.78 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.65 0.47 0.00 0.00 96 V 8.71 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 0.75 0.00 0.00 0.86 0.00 0.00 97 S 8.16 4.71 0.00 3.88 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 98 K 8.63 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 1.40 1.37 7.81