NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 V 4.0739 8.0549 120.3098 60.5835 32.4714 175.3040 8 P 4.2854 0.0000 0.0000 62.3904 31.9668 173.7587 9 E 4.0228 8.4188 119.1284 57.8131 30.7693 178.3810 10 D 4.3350 7.8661 119.3622 56.6869 39.7330 178.1606 11 M 3.9783 7.9418 119.0591 57.6714 32.2707 177.8447 12 Q 3.9682 7.5296 119.9475 59.2771 29.3616 177.7567 13 N 4.4332 8.0342 117.5137 55.9810 38.4282 176.9187 14 E 3.8706 7.8340 120.3680 59.1509 29.8019 178.3006 15 A 4.0848 7.7572 120.6309 55.6084 18.3725 179.4309 16 L 4.0494 7.8903 116.5852 58.1816 41.6514 179.9548 17 S 4.0999 7.9587 114.6370 61.5221 62.7407 176.1597 18 L 3.9197 8.0597 122.8505 58.3270 41.6689 178.6127 19 L 3.9934 8.4132 120.2594 58.4323 41.7299 178.7059 20 E 4.2535 8.2299 119.0419 58.1363 29.6942 177.9680 21 K 4.1757 7.8734 118.9798 58.4454 32.6128 178.3181 22 V 3.5305 8.6136 120.0950 66.4136 31.0847 178.2580 23 R 4.0205 7.5719 114.4379 59.0764 29.3396 177.8559 24 E 4.0921 8.6798 119.6101 58.5213 29.7687 177.3562 25 S 4.5914 8.0513 110.5157 59.7665 65.1776 174.7217 26 G 4.5134 7.9717 115.2705 43.5296 0.0000 172.1318 27 K 4.6793 8.4579 120.9978 54.6178 35.7487 176.5018 28 V 4.8285 8.4130 125.2311 61.0023 35.0185 174.3086 29 K 4.7656 9.3586 125.8465 54.3316 34.7296 175.0638 30 K 4.6624 8.7262 124.0475 55.9266 34.9278 176.3537 31 G 4.0449 9.2190 112.4578 45.5783 0.0000 174.3545 32 T 3.8988 8.9728 120.3771 66.9327 68.5033 176.0833 33 N 4.2861 8.1809 117.4019 56.7937 38.4541 177.2285 34 E 4.0643 8.0468 117.8398 59.3895 29.7934 179.1973 35 T 4.0327 8.4420 116.4366 66.8429 68.5108 176.6932 36 T 3.9115 8.3120 117.9137 66.7563 68.1539 176.8475 37 K 4.5799 8.2055 120.2254 58.0568 31.9385 179.2651 38 A 3.8881 7.8244 121.8616 55.2071 18.5895 180.0826 39 V 3.6271 7.6719 110.4775 64.4956 31.8111 178.5174 40 E 4.0383 8.5498 118.1193 58.6812 29.4829 178.4318 41 R 4.5494 7.3967 116.2298 55.1105 30.2386 176.0044 42 G 4.0729 7.8609 104.6694 46.7727 0.0000 174.5811 43 L 4.4203 7.8771 116.0548 53.9104 42.2154 176.0795 44 A 4.2466 7.7074 121.6323 51.1021 18.1296 178.2088 45 K 4.1431 8.9751 121.2871 59.6744 32.2656 177.5483 46 L 4.9836 7.8193 120.7968 53.2245 46.1984 174.3670 47 V 5.0110 8.8455 124.6126 61.3988 34.5753 173.6251 48 Y 5.0983 10.0987 125.6905 56.4437 40.6212 174.7907 49 I 4.9808 8.8397 123.4120 59.4978 41.2446 174.5834 50 A 4.7788 8.6151 128.3336 51.7183 18.8390 177.2675 51 E 4.2809 9.5985 120.7033 57.8212 30.8995 176.9464 52 D 4.9086 7.5320 120.6362 52.0905 37.5801 176.3535 53 V 4.3721 7.3583 119.2342 61.4844 34.1112 174.8358 54 D 4.3483 9.1801 124.8660 56.2498 39.0215 177.1716 55 P 3.5844 0.0000 0.0000 63.6564 28.9656 170.8892 56 P 4.2816 0.0000 0.0000 62.9093 29.7132 174.9492 57 E 4.1804 8.1371 122.4151 58.5626 30.1085 178.1392 58 I 4.0777 7.6459 119.0781 62.3064 38.5787 175.9976 59 V 4.4743 7.5062 115.9028 60.0280 32.6570 176.8153 60 A 4.0777 8.6531 123.8203 55.8333 18.4769 179.1557 61 H 4.2935 8.3555 113.0585 58.3780 28.6463 177.5273 62 L 3.6844 7.3315 121.8370 57.4279 41.1890 177.3647 63 P 3.3464 0.0000 0.0000 65.7458 31.3999 177.7237 64 L 3.8562 7.8073 118.1768 58.0281 41.9326 178.2612 65 L 4.1271 7.7440 120.7600 57.8842 41.8550 179.3592 66 C 4.0443 7.8961 116.4827 62.7747 27.9910 175.9125 67 E 4.0081 7.4924 117.4633 58.7473 28.7926 177.9768 68 E 4.3670 8.1202 117.1818 56.9445 30.0804 177.2177 69 K 4.4294 7.3861 117.6077 55.1863 32.7492 175.5312 70 N 4.2907 8.2153 115.3230 54.4359 35.8270 173.9876 71 V 4.5273 7.8131 117.1218 59.0830 33.7963 173.7690 72 P 4.6461 0.0000 0.0000 62.6492 32.4619 174.7361 73 Y 5.2158 8.4299 121.3197 55.1064 40.9446 174.4356 74 I 4.3101 8.8456 122.2574 59.3157 41.3227 173.4649 75 Y 5.0893 8.4831 126.2561 56.9848 39.3130 175.0135 76 V 4.1868 9.4300 124.3218 60.9198 34.3702 174.9886 77 K 4.0982 9.6213 124.2692 57.7246 31.8814 175.9283 78 S 5.3225 8.0510 113.2252 55.7578 64.9617 175.7626 79 K 4.2028 9.2779 126.5675 59.8130 32.2667 179.4579 80 N 4.3752 8.2615 118.2972 56.2500 38.4381 177.0183 81 D 4.3269 8.0173 119.8642 57.3540 40.6743 178.4450 82 L 4.1508 7.8877 120.4940 57.5088 41.9132 179.2459 83 G 3.5904 7.9218 105.9688 47.8262 0.0000 175.8778 84 R 4.0519 8.3621 119.1754 57.8782 29.2643 178.7101 85 A 3.9629 7.8924 122.4096 55.0412 18.2653 179.0817 86 V 3.8127 7.2988 113.2273 62.9430 31.6806 176.0258 87 G 3.8046 7.5123 105.1353 47.5093 0.0000 173.4760 88 I 4.4583 7.3109 118.1784 58.7082 40.2960 174.8599 89 E 4.2524 8.5826 121.2893 57.5873 30.4660 176.8795 90 V 4.1598 7.4127 117.9323 60.1521 32.8744 173.5220 91 P 4.3340 0.0000 0.0000 63.2551 31.6221 174.7693 92 C 4.8304 8.4221 121.0336 57.8852 32.9936 173.5092 93 A 4.4168 8.6818 126.7540 53.5973 19.9002 176.5039 94 S 5.0145 7.7618 106.9236 57.7905 65.4058 174.2765 95 A 5.2645 9.3017 126.1055 50.4143 23.2682 174.9750 96 A 5.0091 9.0424 121.1192 50.3364 22.9222 175.1119 97 I 4.4215 9.1062 124.5378 60.3669 38.7807 176.1153 98 I 4.7660 8.4741 122.6612 60.8130 39.3713 175.2937 99 N 4.7620 7.9030 121.2320 51.8958 41.1491 174.5588 100 E 3.9822 9.1458 127.4285 57.6578 31.1878 178.3246 101 G 3.9898 7.8845 107.1480 47.0794 0.0000 174.3241 102 E 4.4492 8.8347 124.1676 56.3982 29.4323 176.7975 103 L 4.9401 7.4218 116.0488 53.3600 43.2221 179.1599 104 R 3.5284 7.1069 113.4569 58.5087 29.0666 178.0043 105 K 3.8110 8.0533 119.1531 59.5393 32.5864 178.8189 106 E 4.0407 8.2837 119.3419 57.8405 29.2316 178.5005 107 L 4.3014 7.8798 120.4027 57.0818 42.2879 178.3012 108 G 3.7958 8.5959 106.2723 48.0134 0.0000 175.6811 109 S 4.2077 7.8026 115.3900 61.2929 62.8127 176.3999 110 L 3.9693 8.1001 124.1006 57.6043 41.8659 179.0367 111 V 3.5381 7.6053 118.0393 65.9677 31.5179 177.4971 112 E 3.9737 7.8947 117.8686 59.0653 29.2638 178.8040 113 K 4.1392 7.7182 117.3362 59.1946 32.2181 179.0779 114 I 3.8878 7.4044 119.8484 64.1709 36.1842 178.5412 115 K 4.1004 7.9625 118.7391 58.7105 31.5143 178.5358 116 G 3.9120 8.2006 104.6630 44.4243 0.0000 173.7451 117 L 4.6099 7.8888 121.0257 54.6241 42.7271 176.5810 118 Q 4.5456 7.6342 113.9231 56.0383 31.1636 175.4445 119 K 4.1292 7.3737 122.1297 56.8214 32.0299 176.0715 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 7 V 8.05 4.07 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 1.03 0.00 0.00 0.99 0.00 0.00 8 P 0.00 4.29 0.00 2.22 2.20 0.00 3.56 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 9 E 8.42 4.02 0.00 2.05 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 2.34 2.42 0.00 10 D 7.87 4.33 0.00 2.87 2.92 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 11 M 7.94 3.98 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.55 0.00 12 Q 7.53 3.97 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.57 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 13 N 8.03 4.43 0.00 2.74 2.87 0.00 0.00 6.68 8.16 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 14 E 7.83 3.87 0.00 2.15 2.22 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 2.32 2.34 0.00 15 A 7.76 4.08 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 16 L 7.89 4.05 0.00 1.90 1.77 0.96 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.96 4.10 0.00 4.09 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 18 L 8.06 3.92 0.00 1.81 2.01 0.95 0.47 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 19 L 8.41 3.99 0.00 1.49 1.74 0.58 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.23 4.25 0.00 1.95 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 2.31 2.15 0.00 21 K 7.87 4.18 0.00 1.85 1.90 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.43 7.81 22 V 8.61 3.53 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 1.06 0.00 0.00 1.02 0.00 0.00 23 R 7.57 4.02 0.00 1.94 2.01 0.00 3.08 0.00 0.00 3.28 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 24 E 8.68 4.09 0.00 2.01 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 2.58 2.39 0.00 25 S 8.05 4.59 0.00 3.95 3.95 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 0.00 0.00 0.00 0.00 26 G 7.97 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.46 4.68 0.00 1.79 1.60 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.39 7.81 28 V 8.41 4.83 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 0.85 0.00 0.00 0.89 0.00 0.00 29 K 9.36 4.77 0.00 1.77 1.67 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.49 7.81 30 K 8.73 4.66 0.00 1.70 1.74 0.00 1.52 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.39 7.81 31 G 9.22 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 0.00 0.00 0.00 32 T 8.97 3.90 4.27 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 1.34 0.00 0.00 33 N 8.18 4.29 0.00 2.81 2.88 0.00 0.00 7.13 7.66 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 34 E 8.05 4.06 0.00 1.94 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 2.31 2.40 0.00 35 T 8.44 4.03 4.43 0.00 0.00 0.00 0.00 0.00 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 36 T 8.31 3.91 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 1.29 0.00 0.00 37 K 8.21 4.58 0.00 1.82 1.86 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.46 7.81 38 A 7.82 3.89 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.67 3.63 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 1.02 0.00 0.00 40 E 8.55 4.04 0.00 2.03 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 2.33 2.54 0.00 41 R 7.40 4.55 0.00 1.77 1.91 0.00 3.31 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 42 G 7.86 4.07 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 0.00 43 L 7.88 4.42 0.00 1.72 1.66 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.71 4.25 1.25 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 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.98 4.14 0.00 1.84 1.90 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.60 1.55 7.81 46 L 7.82 4.98 0.00 1.71 1.52 0.81 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.85 5.01 2.22 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 0.97 0.00 0.00 0.96 0.00 0.00 48 Y 10.10 5.10 0.00 2.99 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 49 I 8.84 4.98 1.48 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.94 1.03 0.00 0.00 50 A 8.62 4.78 1.37 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 51 E 9.60 4.28 0.00 2.04 1.97 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 2.29 2.56 0.00 52 D 7.53 4.91 0.00 2.78 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 53 V 7.36 4.37 2.14 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 0.91 0.00 0.00 1.02 0.00 0.00 54 D 9.18 4.35 0.00 2.81 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 55 P 0.00 3.58 0.00 2.15 2.45 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.10 0.00 56 P 0.00 4.28 0.00 2.37 2.12 0.00 3.73 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 1.98 2.06 0.00 57 E 8.14 4.18 0.00 2.06 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 0.00 2.29 2.38 0.00 58 I 7.65 4.08 1.89 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 1.49 0.75 0.98 0.00 0.00 59 V 7.51 4.47 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 0.86 0.00 0.00 0.96 0.00 0.00 60 A 8.65 4.08 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 61 H 8.36 4.29 0.00 3.36 3.55 0.00 5.48 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 7.33 3.68 0.00 1.64 1.58 0.87 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 3.35 0.00 2.08 2.10 0.00 3.63 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 2.21 2.23 0.00 64 L 7.81 3.86 0.00 1.65 1.69 0.91 0.46 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 65 L 7.74 4.13 0.00 1.88 1.60 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 66 C 7.90 4.04 0.00 2.75 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 67 E 7.49 4.01 0.00 2.14 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 0.00 2.49 2.32 0.00 68 E 8.12 4.37 0.00 2.24 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 2.38 2.32 0.00 69 K 7.39 4.43 0.00 1.82 1.85 0.00 1.85 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.58 7.81 70 N 8.22 4.29 0.00 2.88 2.93 0.00 0.00 6.80 7.68 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 71 V 7.81 4.53 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 0.74 0.00 0.00 1.03 0.00 0.00 72 P 0.00 4.65 0.00 2.06 1.96 0.00 3.77 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 2.10 2.08 0.00 73 Y 8.43 5.22 0.00 2.71 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 74 I 8.85 4.31 1.53 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 1.02 1.38 0.26 0.00 0.00 75 Y 8.48 5.09 0.00 2.92 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 76 V 9.43 4.19 2.20 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 0.94 0.00 0.00 1.08 0.00 0.00 77 K 9.62 4.10 0.00 1.76 1.76 0.00 1.92 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.69 1.37 7.81 78 S 8.05 5.32 0.00 3.85 3.84 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 79 K 9.28 4.20 0.00 2.15 2.09 0.00 1.38 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.70 1.49 7.81 80 N 8.26 4.38 0.00 2.78 2.91 0.00 0.00 6.85 7.39 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 81 D 8.02 4.33 0.00 2.91 2.74 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 0.00 0.00 0.00 0.00 82 L 7.89 4.15 0.00 1.75 1.98 0.86 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 83 G 7.92 3.59 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 0.00 84 R 8.36 4.05 0.00 2.03 2.20 0.00 2.78 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.64 0.00 85 A 7.89 3.96 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 86 V 7.30 3.81 2.16 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 0.80 0.00 0.00 0.93 0.00 0.00 87 G 7.51 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 88 I 7.31 4.46 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.95 1.07 0.00 0.00 89 E 8.58 4.25 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 2.22 2.28 0.00 90 V 7.41 4.16 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 0.85 0.00 0.00 0.93 0.00 0.00 91 P 0.00 4.33 0.00 2.23 2.29 0.00 3.78 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 92 C 8.42 4.83 0.00 2.99 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 93 A 8.68 4.42 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 94 S 7.76 5.01 0.00 3.88 3.67 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 95 A 9.30 5.26 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 96 A 9.04 5.01 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.11 4.42 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.53 1.17 0.00 0.00 98 I 8.47 4.77 1.90 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 1.23 1.91 0.96 0.00 0.00 99 N 7.90 4.76 0.00 2.73 2.78 0.00 0.00 7.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 E 9.15 3.98 0.00 2.19 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 2.41 2.40 0.00 101 G 7.88 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 0.00 0.00 0.00 102 E 8.83 4.45 0.00 1.97 1.97 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 2.31 2.27 0.00 103 L 7.42 4.94 0.00 1.85 1.64 1.02 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.11 3.53 0.00 2.20 2.23 0.00 2.85 0.00 0.00 3.22 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 105 K 8.05 3.81 0.00 2.00 2.13 0.00 1.52 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.50 1.56 7.81 106 E 8.28 4.04 0.00 2.18 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 0.00 2.41 2.38 0.00 107 L 7.88 4.30 0.00 1.74 1.98 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.60 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 0.00 109 S 7.80 4.21 0.00 4.09 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 0.00 110 L 8.10 3.97 0.00 1.76 1.89 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.61 3.54 2.23 0.00 0.00 0.00 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 0.99 0.00 0.00 112 E 7.89 3.97 0.00 2.10 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 2.29 2.33 0.00 113 K 7.72 4.14 0.00 1.91 1.83 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.60 1.61 7.81 114 I 7.40 3.89 1.76 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.85 0.70 0.00 0.00 115 K 7.96 4.10 0.00 1.92 1.84 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.70 7.81 116 G 8.20 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 0.00 0.00 0.00 117 L 7.89 4.61 0.00 1.70 1.81 0.90 0.56 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 0.00 118 Q 7.63 4.55 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.66 0.00 0.00 0.00 0.00 0.00 2.21 2.43 0.00 119 K 7.37 4.13 0.00 1.91 1.77 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.61 7.81