NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5525 8.2185 120.1948 53.7682 41.4312 175.5659 3 A 4.0117 8.6900 129.9546 54.2634 18.6614 177.0203 4 K 4.0795 8.5582 119.8804 59.6572 32.3653 177.2298 5 A 4.1772 8.4574 121.1969 54.8067 18.1959 179.7800 6 G 3.6541 8.2539 104.3409 47.6376 0.0000 175.6195 7 E 3.2919 7.6811 119.7643 59.2815 29.5832 178.9602 8 A 4.0836 7.6413 120.0304 55.1365 18.5221 179.9090 9 V 3.5475 7.6811 116.3658 66.0167 31.6882 177.8097 10 F 4.1173 8.2760 120.5932 60.9771 38.7604 176.9716 11 K 3.7335 7.5011 117.6810 59.6743 32.1244 178.7681 12 Q 3.9273 7.7637 117.5136 59.1094 28.5753 178.5924 13 C 3.7657 7.4371 116.9683 62.5800 26.7278 175.4655 14 M 4.5651 7.1023 120.7647 56.8680 31.1938 178.4375 15 T 3.9923 7.4033 116.0312 65.9465 68.7845 174.4996 16 C 4.7089 7.5439 113.1844 58.9946 30.8550 173.2698 17 H 5.1267 8.1652 116.6450 53.7718 31.5526 172.9464 18 R 5.0157 8.0869 119.4246 54.0740 33.9636 176.8857 19 A 3.9963 8.7881 122.0480 55.5098 18.4598 179.2925 20 D 4.8380 8.0118 111.8471 54.1417 41.8860 176.4588 21 K 4.7214 7.5114 116.8854 54.7784 35.7502 175.7509 22 N 4.7826 8.5191 117.1915 53.9216 40.2064 175.2849 23 M 4.4482 8.0348 123.4134 54.7155 35.6807 176.6159 24 V 3.7116 8.9038 114.3986 64.9255 31.8370 175.8053 25 G 3.8250 7.8606 107.7637 42.1357 0.0000 170.7119 26 P 4.3232 0.0000 0.0000 61.6750 31.7730 176.2393 27 A 4.2481 8.5621 123.1366 53.1021 18.8382 177.8295 28 L 4.5023 8.5545 119.7251 54.2367 43.1175 176.7511 29 A 4.2902 7.9677 123.4081 53.4498 18.5695 178.0329 30 G 3.9824 9.2125 111.7188 45.4107 0.0000 174.9998 31 V 3.6532 7.7879 120.8939 64.0176 31.6581 176.1798 32 V 3.7258 7.6016 120.2645 65.7554 30.8237 175.1621 33 G 4.1077 9.3438 116.6886 44.9654 0.0000 171.9171 34 R 4.6451 8.0152 120.3901 53.7201 32.3916 175.4584 35 K 4.2367 8.6564 126.8525 56.3482 33.0261 176.2268 36 A 3.9097 8.6208 129.4280 52.5662 19.6558 177.5459 37 G 2.4546 7.7763 108.2529 46.6234 0.0000 174.5191 38 T 4.6517 7.7214 104.7807 60.5294 70.3380 173.4174 39 A 4.1540 8.8889 126.1164 52.1931 18.8942 177.8526 40 A 4.2627 8.6070 125.9107 53.7815 18.7864 178.2212 41 G 3.9880 9.0485 110.7101 45.3110 0.0000 173.0077 42 F 4.3159 7.8430 121.4378 56.8481 40.5153 175.2720 43 T 4.1900 6.7950 124.0180 62.4299 68.2588 174.2613 44 Y 4.7765 8.4393 124.5131 56.3698 39.7738 176.4317 45 S 4.4455 8.6333 116.2210 58.0028 64.9707 173.4331 46 P 4.3063 0.0000 0.0000 65.7463 31.0989 178.6215 47 L 4.0045 8.0311 118.6091 58.3362 42.0295 178.5107 48 N 4.4575 8.3787 116.8862 56.9598 39.0472 176.4049 49 H 4.0933 8.7503 120.0977 59.3678 29.9429 177.0331 50 N 4.4373 9.0576 118.9414 56.0516 38.3946 177.6056 51 S 4.4027 8.2375 117.0015 61.6383 62.8777 176.9670 52 G 3.7045 7.7886 109.6303 47.3510 0.0000 175.6529 53 E 3.9607 7.8614 119.5725 58.5840 29.5052 178.3679 54 A 4.3511 7.8348 118.5286 52.0412 18.7704 177.5347 55 G 3.9499 8.1545 105.4706 45.0080 0.0000 174.3976 56 L 3.5318 8.0799 123.8506 55.0122 42.7803 175.7266 57 V 4.5008 7.7784 125.9911 60.4922 34.0704 174.9796 58 W 4.6266 8.6346 128.5473 57.0523 30.5199 175.4673 59 T 5.0118 9.8955 113.6642 59.1495 71.8470 174.6249 60 A 4.0848 8.7463 122.2110 55.1018 18.2842 179.0920 61 D 4.5150 8.0519 116.8758 57.0653 41.4824 177.8032 62 N 4.7903 8.6248 116.7281 54.5913 37.8833 177.3824 63 I 3.6731 7.7930 122.6214 64.1094 36.8572 177.7813 64 V 3.5849 7.9313 118.3099 65.9529 31.0194 175.8575 65 P 4.4241 0.0000 0.0000 65.9192 31.3433 177.4237 66 Y 3.8454 7.4768 118.9469 60.6402 38.5801 178.4391 67 L 3.7214 7.9982 119.2008 57.3119 41.3930 179.3056 68 A 4.3120 7.3134 121.0476 53.7718 19.1910 177.0959 69 D 4.3269 7.8195 114.2531 51.7535 43.2259 173.7957 70 P 3.8936 0.0000 0.0000 65.2320 31.3957 177.5725 71 N 4.3839 8.2059 114.1538 56.4523 38.5831 177.0699 72 A 4.0312 8.3355 121.9918 55.1026 18.4901 179.2344 73 F 4.0113 8.5415 119.1460 61.7258 39.5693 177.4721 74 L 4.2133 8.4051 118.4628 57.7469 41.4873 179.6272 75 K 4.0156 8.5091 118.8450 59.3531 31.9064 179.3514 76 K 3.9147 8.1165 119.9436 59.2136 32.2480 178.4600 77 F 3.8442 7.9757 120.9647 61.4906 39.1783 177.2320 78 L 3.8665 7.9877 118.3250 57.8677 41.3054 179.6802 79 T 3.7951 7.8971 115.7800 66.7433 68.1938 176.5608 80 E 3.8918 8.0125 119.3419 58.9924 29.4844 178.6696 81 K 4.1690 7.2239 115.4595 55.9767 32.1216 177.4321 82 G 3.8888 7.9601 107.3712 46.0930 0.0000 174.2299 83 K 4.6156 8.0389 117.4568 55.1321 33.2873 178.5201 84 A 4.0304 8.2210 123.9987 55.3082 18.6888 180.2713 85 D 4.4511 8.0025 113.8351 56.0244 39.5432 177.1521 86 Q 4.2406 7.9399 117.1165 56.6618 29.0986 175.8867 87 A 4.8483 7.7250 121.6249 51.9775 19.4404 177.7954 88 V 4.1677 7.9167 114.1214 63.0334 33.3477 177.3288 89 G 4.1309 7.7455 109.6233 44.6903 0.0000 172.9305 90 V 4.7060 7.9804 112.3304 59.4606 35.4942 175.2291 91 T 4.3476 9.3348 116.8019 61.7679 67.7828 175.0936 92 K 4.0903 8.6220 124.2468 58.8777 32.3621 177.1322 93 M 4.2063 8.0294 118.3258 56.0258 31.5153 176.4117 94 T 4.5222 8.0203 120.2562 58.9375 67.8914 173.6553 95 F 4.8428 7.3971 124.6770 57.9293 42.7918 172.9810 96 K 4.3470 7.1278 124.5174 54.4547 35.9894 175.8437 97 L 4.2230 8.1483 121.8158 53.1378 43.7981 177.1308 98 A 3.8874 8.5060 130.1500 54.7128 19.1413 177.7786 99 N 4.3774 7.9732 115.0613 53.4903 39.8921 175.0387 100 E 3.9411 8.8246 128.8393 59.4867 29.8877 178.4484 101 Q 3.9843 8.1036 119.1177 59.2926 29.2365 177.9800 102 Q 4.0557 9.0038 119.5131 58.9179 28.6763 179.0879 103 R 3.9653 7.8400 118.7481 59.1827 30.1275 179.1780 104 K 4.0128 8.1800 118.3019 59.6052 32.0535 179.2306 105 D 4.4756 8.3157 119.4404 57.2823 40.7495 179.2106 106 V 3.7597 8.0209 119.8303 64.8000 31.4369 178.6222 107 V 3.6424 7.9887 118.7541 65.6994 31.0995 177.9023 108 A 4.0176 8.0394 119.9023 55.1405 18.4850 178.6697 109 Y 3.9326 8.0901 118.1320 60.7236 38.7851 178.0793 110 L 3.7911 8.4481 120.1558 57.8241 41.5528 179.3795 111 A 3.9651 7.8550 119.3351 54.4505 18.3386 178.6710 112 T 4.3008 7.1919 106.2990 61.2687 70.3839 175.7094 113 L 4.1081 7.4665 123.9744 53.5067 40.4121 177.0625 114 K 4.1120 8.0571 121.2954 56.4208 32.0245 177.2811 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 2 D 8.22 4.55 0.00 2.78 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 3 A 8.69 4.01 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 4 K 8.56 4.08 0.00 1.91 2.00 0.00 1.63 0.00 0.00 1.84 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.58 7.81 5 A 8.46 4.18 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 G 8.25 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 7.68 3.29 0.00 2.10 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 2.31 2.56 0.00 8 A 7.64 4.08 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 9 V 7.68 3.55 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 1.12 0.00 0.00 0.95 0.00 0.00 10 F 8.28 4.12 0.00 2.71 2.69 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 11 K 7.50 3.73 0.00 1.73 1.80 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.73 7.81 12 Q 7.76 3.93 0.00 2.02 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 13 C 7.44 3.77 0.00 1.96 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 14 M 7.10 4.57 0.00 1.92 2.06 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 15 T 7.40 3.99 4.08 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 0.00 0.00 0.00 1.11 0.00 0.00 16 C 7.54 4.71 0.00 2.64 2.70 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 0.00 0.00 0.00 17 H 8.17 5.13 0.00 3.07 3.08 0.00 5.55 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.09 5.02 0.00 2.06 1.82 0.00 3.13 0.00 0.00 3.35 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 19 A 8.79 4.00 1.33 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 0.00 0.00 20 D 8.01 4.84 0.00 2.69 2.72 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 21 K 7.51 4.72 0.00 1.81 1.73 0.00 1.59 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.46 7.81 22 N 8.52 4.78 0.00 2.82 2.99 0.00 0.00 6.66 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 23 M 8.03 4.45 0.00 2.11 1.44 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 24 V 8.90 3.71 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 0.82 0.00 0.00 0.91 0.00 0.00 25 G 7.86 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 26 P 0.00 4.32 0.00 2.04 1.38 0.00 3.28 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.71 0.00 27 A 8.56 4.25 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 28 L 8.55 4.50 0.00 1.78 1.67 0.77 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 29 A 7.97 4.29 1.33 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 0.00 0.00 30 G 9.21 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 0.00 0.00 0.00 31 V 7.79 3.65 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 0.63 0.00 0.00 0.83 0.00 0.00 32 V 7.60 3.73 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 0.81 0.00 0.00 0.94 0.00 0.00 33 G 9.34 4.11 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 0.00 34 R 8.02 4.65 0.00 2.18 1.99 0.00 3.17 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 35 K 8.66 4.24 0.00 1.73 1.64 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.32 7.81 36 A 8.62 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.78 2.45 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 0.00 0.00 0.00 0.00 38 T 7.72 4.65 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 1.21 0.00 0.00 39 A 8.89 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.61 4.26 1.31 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 0.00 0.00 0.00 41 G 9.05 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 42 F 7.84 4.32 0.00 2.93 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 6.79 4.19 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 1.10 0.00 0.00 44 Y 8.44 4.78 0.00 3.09 3.08 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 0.00 0.00 0.00 0.00 45 S 8.63 4.45 0.00 4.16 4.14 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 46 P 0.00 4.31 0.00 2.24 2.20 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.19 0.00 47 L 8.03 4.00 0.00 1.86 1.81 1.02 0.66 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 48 N 8.38 4.46 0.00 3.09 3.07 0.00 0.00 6.90 7.95 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 49 H 8.75 4.09 0.00 3.33 3.43 0.00 5.83 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 N 9.06 4.44 0.00 2.84 3.03 0.00 0.00 6.99 7.69 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 51 S 8.24 4.40 0.00 3.99 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 52 G 7.79 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 53 E 7.86 3.96 0.00 2.06 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 2.21 2.32 0.00 54 A 7.83 4.35 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.15 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 0.00 0.00 0.00 56 L 8.08 3.53 0.00 0.27 0.91 0.14 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.78 4.50 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 0.85 0.00 0.00 0.89 0.00 0.00 58 W 8.63 4.63 0.00 3.50 2.96 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 59 T 9.90 5.01 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 60 A 8.75 4.08 1.33 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 0.00 0.00 61 D 8.05 4.51 0.00 2.73 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 62 N 8.62 4.79 0.00 3.33 3.27 0.00 0.00 7.03 7.17 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 63 I 7.79 3.67 1.85 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 1.15 1.18 0.76 0.00 0.00 64 V 7.93 3.58 2.12 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 0.91 0.00 0.00 0.96 0.00 0.00 65 P 0.00 4.42 0.00 2.63 2.45 0.00 3.90 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 2.42 2.22 0.00 66 Y 7.48 3.85 0.00 2.07 2.72 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 67 L 8.00 3.72 0.00 1.70 1.65 0.95 0.61 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 68 A 7.31 4.31 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 69 D 7.82 4.33 0.00 2.65 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 70 P 0.00 3.89 0.00 2.13 1.82 0.00 3.51 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.51 0.00 71 N 8.21 4.38 0.00 2.78 2.93 0.00 0.00 6.93 7.60 0.00 0.00 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 A 8.34 4.03 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.54 4.01 0.00 3.39 3.57 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 74 L 8.41 4.21 0.00 2.00 1.90 1.27 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.51 4.02 0.00 1.91 1.89 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.77 1.63 7.81 76 K 8.12 3.91 0.00 1.82 1.83 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.40 7.81 77 F 7.98 3.84 0.00 2.75 3.05 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 0.00 0.00 0.00 78 L 7.99 3.87 0.00 1.79 1.89 1.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 79 T 7.90 3.80 4.39 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 1.17 0.00 0.00 80 E 8.01 3.89 0.00 1.82 1.84 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 2.27 2.38 0.00 81 K 7.22 4.17 0.00 1.60 1.61 0.00 1.52 0.00 0.00 1.37 0.00 0.00 2.66 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.61 0.87 7.81 82 G 7.96 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.04 4.62 0.00 1.81 1.72 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.43 7.81 84 A 8.22 4.03 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 85 D 8.00 4.45 0.00 2.80 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 86 Q 7.94 4.24 0.00 2.25 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.47 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 87 A 7.72 4.85 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 88 V 7.92 4.17 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 0.76 0.00 0.00 1.00 0.00 0.00 89 G 7.75 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 90 V 7.98 4.71 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 0.79 0.00 0.00 0.98 0.00 0.00 91 T 9.33 4.35 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 1.38 0.00 0.00 92 K 8.62 4.09 0.00 1.95 1.96 0.00 1.95 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.53 7.81 93 M 8.03 4.21 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.58 0.00 94 T 8.02 4.52 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 1.25 0.00 0.00 95 F 7.40 4.84 0.00 2.90 2.89 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 0.00 0.00 0.00 96 K 7.13 4.35 0.00 1.42 1.55 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.67 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.17 1.22 7.81 97 L 8.15 4.22 0.00 1.56 1.39 1.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.51 3.89 1.22 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 0.00 0.00 0.00 99 N 7.97 4.38 0.00 2.76 2.83 0.00 0.00 6.84 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 8.82 3.94 0.00 2.08 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 2.39 2.38 0.00 101 Q 8.10 3.98 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.67 0.00 0.00 0.00 0.00 0.00 2.43 2.67 0.00 102 Q 9.00 4.06 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.61 0.00 103 R 7.84 3.97 0.00 2.07 1.98 0.00 3.39 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 104 K 8.18 4.01 0.00 1.97 1.88 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.48 1.71 7.81 105 D 8.32 4.48 0.00 2.72 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 0.00 106 V 8.02 3.76 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 1.06 0.00 0.00 1.09 0.00 0.00 107 V 7.99 3.64 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 1.08 0.00 0.00 0.99 0.00 0.00 108 A 8.04 4.02 1.43 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 0.00 0.00 0.00 109 Y 8.09 3.93 0.00 3.26 3.07 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 0.00 110 L 8.45 3.79 0.00 1.79 1.65 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.85 3.97 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 0.00 112 T 7.19 4.30 4.03 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 0.00 0.00 1.06 0.00 0.00 113 L 7.47 4.11 0.00 1.78 1.53 0.79 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 114 K 8.06 4.11 0.00 1.69 1.68 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.32 7.81