NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3137 8.3049 120.3238 53.7668 34.5322 175.3321 2 E 3.5733 8.1873 116.0738 56.7461 26.8545 173.7591 3 L 4.2215 7.5246 119.1868 54.8577 43.8244 178.4468 4 T 4.3040 8.8962 115.0627 60.3533 71.2179 173.9876 5 P 4.2708 0.0000 0.0000 65.8004 31.3730 179.1702 6 R 3.9597 7.9562 114.3517 59.2696 29.1276 178.6971 7 E 3.9731 7.6109 117.6908 59.1772 29.6403 179.0904 8 K 4.1273 8.0047 118.2084 59.2179 32.0788 178.9993 9 D 4.3360 8.1941 118.6531 57.3042 41.1616 178.4781 10 K 4.1166 8.0763 118.5806 59.1081 31.9556 179.3058 11 L 4.0621 7.6236 119.6808 57.3701 41.4373 179.1764 12 L 4.0046 7.8464 120.6973 57.8694 42.0290 178.7442 13 L 3.9458 7.7887 119.8975 58.0342 42.2813 178.3589 14 F 4.1178 8.4196 120.6803 61.8597 39.1834 177.2802 15 T 3.7897 8.1725 115.0226 66.5109 68.0869 176.5762 16 A 3.9585 8.1380 122.5403 55.0788 18.2658 179.5614 17 A 3.9249 7.8963 119.3160 54.9754 18.4471 179.8583 18 L 3.7197 7.3920 117.3744 57.6554 41.5417 179.7602 19 V 3.4807 7.4778 117.9668 65.9820 31.4282 177.9251 20 A 3.9320 7.6489 120.2992 55.0531 18.2102 178.9902 21 E 3.8173 8.3330 118.0734 59.7761 29.5449 179.4547 22 R 3.9524 7.8813 117.6923 59.2063 30.1330 179.3320 23 R 3.9438 7.7570 117.7568 58.9409 30.0901 178.7179 24 L 3.9320 8.2677 120.3605 58.0826 41.8542 178.8982 25 A 4.0202 7.7709 119.8226 55.0731 18.3832 179.3078 26 R 4.1382 7.4797 115.0801 57.3407 30.2236 177.6752 27 G 3.9387 7.9488 106.9965 45.1862 0.0000 173.3907 28 L 4.4446 7.3742 118.3434 53.6306 43.0052 176.6736 29 K 4.4934 8.4000 121.2751 55.5322 32.8230 177.0654 30 L 4.4558 8.8525 126.1792 55.0327 43.2220 177.0387 31 N 4.8448 9.0203 120.0883 52.1302 40.4100 174.5012 32 Y 4.0971 8.9230 118.2874 60.8465 38.7883 176.6342 33 P 3.9178 0.0000 0.0000 65.8131 31.4037 178.1298 34 E 3.9116 8.6574 118.4089 59.2199 29.3752 179.5143 35 S 4.0493 7.9594 115.1698 61.5474 62.9119 176.8817 36 V 3.4465 7.4190 120.4895 65.8633 31.1581 177.9391 37 A 3.9310 7.9292 120.4750 54.9105 18.3454 179.3573 38 L 3.8503 7.8713 118.7842 58.4894 42.3512 179.3456 39 I 3.7731 7.6601 119.6724 64.3412 37.0150 178.6289 40 S 4.1447 8.1492 115.8306 61.7232 62.7635 176.7004 41 A 4.0924 8.2546 123.4100 54.9203 18.0269 179.4823 42 F 4.0965 8.1133 118.9737 61.6047 39.5265 177.4668 43 I 3.5859 7.8548 119.1246 64.6003 36.9935 178.2862 44 M 3.9481 7.9697 119.4840 58.5239 31.7864 178.7428 45 E 4.0284 8.0668 118.3311 58.9585 29.5585 179.5604 46 G 3.3353 7.5816 105.7813 47.6372 0.0000 175.6365 47 A 3.2543 7.6359 123.3111 54.5062 17.9419 179.7099 48 R 3.7267 7.3022 116.0330 59.5731 30.1835 178.2571 49 D 4.4918 7.7917 117.8815 55.5070 40.7738 177.3754 50 G 4.0939 7.4802 106.9803 45.1304 0.0000 173.8984 51 K 4.2520 7.6581 118.6819 55.7055 32.9517 177.8351 52 S 4.5074 8.3781 116.5361 57.8468 65.3391 175.5564 53 V 3.5166 8.0110 121.5585 66.0800 31.1887 177.9250 54 A 3.9970 7.9465 119.9670 55.3946 18.1832 179.6401 55 S 4.1123 7.9610 113.0447 61.8414 62.8474 177.0134 56 L 4.1614 7.9919 121.3790 58.0487 41.1380 179.3717 57 M 4.0632 8.1672 117.9527 57.8530 32.0893 177.9950 58 E 4.2529 7.6781 118.8088 58.9558 30.2313 178.0264 59 E 4.2524 8.7127 119.1047 59.5314 29.3200 179.6633 60 G 3.8314 8.4622 105.0217 47.1924 0.0000 174.8933 61 R 4.6972 7.6032 119.5121 55.8702 30.1718 176.1774 62 H 4.9151 7.7708 115.4483 55.5794 30.0532 174.9858 63 V 3.6284 7.8479 120.9531 64.3928 31.8470 176.1911 64 L 4.9414 7.4576 116.9999 52.9658 45.3155 175.6692 65 T 4.5759 8.4609 111.8133 59.3223 71.4564 175.3683 66 R 3.8847 8.3532 121.6042 59.2320 30.0346 177.5509 67 E 4.3298 8.1000 113.1868 57.4839 30.2336 176.6387 68 Q 4.5573 8.1395 118.4275 56.0122 30.0703 175.2631 69 V 5.0515 7.2541 110.4379 59.2498 35.7369 175.4574 70 M 4.3426 8.8366 122.0379 54.8909 33.2171 175.9898 71 E 4.0721 8.6041 121.7338 57.8527 30.3308 176.8582 72 G 4.1306 8.9392 113.6698 44.7898 0.0000 175.7114 73 V 3.6815 7.6506 119.0447 65.5616 31.4489 176.2492 74 P 4.3289 0.0000 0.0000 65.6249 31.5157 178.1304 75 E 4.1335 8.0329 117.0806 58.6880 29.6083 178.1844 76 M 4.3932 7.8591 116.9014 56.3642 32.3717 176.7153 77 I 4.6866 7.2922 119.7910 58.3655 37.5428 173.9361 78 P 4.6176 0.0000 0.0000 65.4351 32.5676 176.4719 79 D 4.9664 7.2588 117.5051 52.7841 42.6187 175.2994 80 I 4.7586 8.5645 119.8433 59.7137 41.1138 174.6955 81 Q 5.6003 8.8193 123.7496 53.2621 32.5087 174.8754 82 V 4.5630 8.2026 120.2781 60.8132 34.6032 172.2634 83 E 5.5696 8.9872 120.9157 54.2860 32.7946 174.7871 84 A 4.5740 8.3053 121.8953 51.1297 23.2717 175.7466 85 T 4.2060 8.3057 116.2433 63.0305 68.7237 175.3401 86 F 4.4078 9.2729 126.8168 55.4935 40.2586 175.5329 87 P 4.3697 0.0000 0.0000 65.1926 31.0720 177.0760 88 D 4.7820 8.2558 116.6421 52.8671 40.0420 176.8453 89 G 3.8767 8.0487 108.1496 45.1245 0.0000 173.0108 90 S 5.3098 8.1775 114.3964 58.2604 63.3488 174.4741 91 K 4.6861 8.8273 122.1868 54.6517 36.8607 174.5351 92 L 4.8397 8.4405 124.3295 53.6874 43.7328 175.4971 93 V 4.4151 8.7064 126.3800 61.4659 33.8183 174.1618 94 T 4.8477 8.5994 124.4029 61.8239 70.8378 173.6322 95 V 4.2475 8.7562 127.9189 61.4180 33.2554 174.3376 96 H 4.5789 8.8819 125.6976 55.9588 28.3310 175.7094 97 N 4.1360 9.0686 119.3312 53.6317 36.4313 173.5394 98 P 4.3826 0.0000 0.0000 64.7799 32.1506 176.9453 99 I 4.6147 7.0597 117.8249 59.2172 38.7102 175.5435 100 I 4.1941 8.0914 117.8513 61.0970 37.5639 174.8979 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 1 M 8.30 4.31 0.00 2.00 2.18 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 2 E 8.19 3.57 0.00 2.13 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 2.22 2.45 0.00 3 L 7.52 4.22 0.00 1.62 1.60 0.89 0.97 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 4 T 8.90 4.30 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 1.25 0.00 0.00 5 P 0.00 4.27 0.00 2.18 2.15 0.00 3.60 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 6 R 7.96 3.96 0.00 2.04 2.19 0.00 2.97 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 7 E 7.61 3.97 0.00 2.21 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 2.31 2.33 0.00 8 K 8.00 4.13 0.00 1.99 1.86 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.56 7.81 9 D 8.19 4.34 0.00 2.92 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 10 K 8.08 4.12 0.00 1.98 1.85 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.62 1.62 7.81 11 L 7.62 4.06 0.00 1.90 1.75 0.90 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.85 4.00 0.00 1.77 1.95 0.93 0.51 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 13 L 7.79 3.95 0.00 1.82 1.90 0.92 0.90 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 14 F 8.42 4.12 0.00 3.15 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 15 T 8.17 3.79 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 1.22 0.00 0.00 16 A 8.14 3.96 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 17 A 7.90 3.92 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 18 L 7.39 3.72 0.00 1.75 1.59 0.83 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.48 3.48 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 0.98 0.00 0.00 0.92 0.00 0.00 20 A 7.65 3.93 1.30 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 21 E 8.33 3.82 0.00 2.17 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 0.00 2.28 2.33 0.00 22 R 7.88 3.95 0.00 2.04 1.94 0.00 3.25 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 23 R 7.76 3.94 0.00 1.94 1.95 0.00 3.13 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 24 L 8.27 3.93 0.00 1.79 1.80 0.90 1.17 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 25 A 7.77 4.02 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 26 R 7.48 4.14 0.00 1.92 1.99 0.00 3.14 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 27 G 7.95 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 28 L 7.37 4.44 0.00 1.68 1.59 0.91 0.81 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 29 K 8.40 4.49 0.00 1.64 1.74 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.46 7.81 30 L 8.85 4.46 0.00 1.58 1.56 0.88 0.45 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 31 N 9.02 4.84 0.00 2.88 3.00 0.00 0.00 6.71 8.38 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 32 Y 8.92 4.10 0.00 3.08 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 33 P 0.00 3.92 0.00 2.26 2.29 0.00 3.96 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.12 0.00 34 E 8.66 3.91 0.00 2.04 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 2.30 2.42 0.00 35 S 7.96 4.05 0.00 3.94 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 36 V 7.42 3.45 1.75 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 0.89 0.00 0.00 0.43 0.00 0.00 37 A 7.93 3.93 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 L 7.87 3.85 0.00 1.88 1.63 0.88 0.75 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 39 I 7.66 3.77 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 1.44 1.04 0.93 0.00 0.00 40 S 8.15 4.14 0.00 4.06 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 41 A 8.25 4.09 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 42 F 8.11 4.10 0.00 3.25 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 43 I 7.85 3.59 2.07 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 1.68 1.12 0.97 0.00 0.00 44 M 7.97 3.95 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.57 0.00 45 E 8.07 4.03 0.00 1.96 1.89 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 2.56 2.49 0.00 46 G 7.58 3.34 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 0.00 47 A 7.64 3.25 0.13 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 0.00 0.00 0.00 48 R 7.30 3.73 0.00 1.70 2.03 0.00 3.23 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 49 D 7.79 4.49 0.00 2.81 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 50 G 7.48 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 0.00 0.00 0.00 0.00 51 K 7.66 4.25 0.00 1.90 1.81 0.00 1.64 0.00 0.00 1.87 0.00 0.00 3.22 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.33 7.81 52 S 8.38 4.51 0.00 4.03 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 53 V 8.01 3.52 1.89 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 1.01 0.00 0.00 0.26 0.00 0.00 54 A 7.95 4.00 1.32 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 0.00 0.00 55 S 7.96 4.11 0.00 4.07 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 0.00 56 L 7.99 4.16 0.00 1.99 1.83 1.11 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 57 M 8.17 4.06 0.00 2.02 2.31 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.69 0.00 58 E 7.68 4.25 0.00 2.25 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 2.32 2.47 0.00 59 E 8.71 4.25 0.00 2.26 2.36 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 2.47 2.59 0.00 60 G 8.46 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 61 R 7.60 4.70 0.00 1.64 1.84 0.00 3.08 0.00 0.00 3.06 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 62 H 7.77 4.92 0.00 3.17 3.18 0.00 5.64 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.85 3.63 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 0.54 0.00 0.00 0.16 0.00 0.00 64 L 7.46 4.94 0.00 1.56 1.45 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 65 T 8.46 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 1.20 0.00 0.00 66 R 8.35 3.88 0.00 1.92 1.97 0.00 3.17 0.00 0.00 3.39 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 67 E 8.10 4.33 0.00 2.11 2.05 0.00 0.00 0.00 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 2.26 0.00 68 Q 8.14 4.56 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 69 V 7.25 5.05 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 0.67 0.00 0.00 1.00 0.00 0.00 70 M 8.84 4.34 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.50 0.00 71 E 8.60 4.07 0.00 1.92 1.86 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 2.29 2.32 0.00 72 G 8.94 4.13 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 0.00 0.00 0.00 0.00 73 V 7.65 3.68 2.25 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 1.02 0.00 0.00 1.02 0.00 0.00 74 P 0.00 4.33 0.00 2.22 2.10 0.00 3.60 0.00 0.00 3.92 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 75 E 8.03 4.13 0.00 2.21 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 2.33 2.33 0.00 76 M 7.86 4.39 0.00 1.81 2.30 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.38 0.00 77 I 7.29 4.69 1.93 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.36 0.99 0.00 0.00 78 P 0.00 4.62 0.00 2.14 2.34 0.00 3.88 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 2.11 2.00 0.00 79 D 7.26 4.97 0.00 2.79 2.64 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 80 I 8.56 4.76 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.77 0.92 0.00 0.00 81 Q 8.82 5.60 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.68 0.00 0.00 0.00 0.00 0.00 2.24 2.16 0.00 82 V 8.20 4.56 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 0.76 0.00 0.00 0.96 0.00 0.00 83 E 8.99 5.57 0.00 1.88 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 2.25 2.15 0.00 84 A 8.31 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.31 4.21 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 1.22 0.00 0.00 86 F 9.27 4.41 0.00 3.19 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 87 P 0.00 4.37 0.00 2.09 2.15 0.00 3.86 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 88 D 8.26 4.78 0.00 2.77 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 89 G 8.05 3.88 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 0.00 0.00 0.00 90 S 8.18 5.31 0.00 3.81 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 91 K 8.83 4.69 0.00 1.04 1.31 0.00 1.50 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 0.81 7.81 92 L 8.44 4.84 0.00 1.85 1.56 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.71 4.42 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.18 0.00 0.00 94 T 8.60 4.85 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 1.04 0.00 0.00 95 V 8.76 4.25 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 1.10 0.00 0.00 0.98 0.00 0.00 96 H 8.88 4.58 0.00 3.10 3.22 0.00 5.90 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 9.07 4.14 0.00 2.78 2.78 0.00 0.00 6.54 7.92 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 98 P 0.00 4.38 0.00 2.19 2.30 0.00 3.83 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 99 I 7.06 4.61 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 1.32 0.63 0.93 0.00 0.00 100 I 8.09 4.19 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.64 0.91 0.00 0.00