NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2235 8.3144 121.7899 55.7404 33.4958 175.1710 2 E 3.8658 8.5891 127.8832 54.2907 30.3024 174.7331 3 S 4.5318 8.9050 122.9907 57.9313 66.3830 174.5998 4 A 3.9871 8.5982 124.7844 55.4350 18.1227 180.1023 5 A 3.9593 7.9885 118.6049 55.1616 18.4605 179.6151 6 A 3.9464 8.0582 119.3753 55.0832 18.4571 179.5934 7 K 4.0278 8.2439 119.7461 59.0414 32.2322 178.6131 8 F 4.0609 8.4556 120.7594 61.4093 39.3375 176.8282 9 E 4.0713 8.4197 118.1944 59.4982 29.0542 179.4216 10 R 3.8433 8.0950 117.8539 59.5640 30.2749 178.2278 11 Q 4.0560 8.1799 116.7506 57.6474 28.9242 176.3374 12 H 4.6845 8.0663 113.7520 55.0848 30.3798 173.0549 13 M 4.6531 7.7637 119.9615 53.6834 34.0499 176.5846 14 D 4.7529 8.2754 122.2567 53.3387 42.1982 174.4848 15 S 4.5489 7.9177 115.4909 58.4370 64.5777 176.9238 16 G 3.6513 8.1010 108.8522 46.3113 0.0000 171.6001 17 N 4.4654 7.5650 126.7151 52.7142 42.5303 174.2389 18 S 4.2130 8.2749 122.8942 58.6283 63.3811 175.1302 19 A 4.4577 8.3482 121.3071 52.7194 17.6113 177.2334 20 S 4.7052 8.2924 114.1151 58.9062 64.7341 173.6286 21 S 4.4390 8.6824 118.8473 58.8226 62.7806 169.3271 22 S 4.5627 8.3147 114.7192 58.8699 63.4024 175.7520 23 S 4.3082 7.5472 117.0505 60.5697 62.9415 174.2652 24 N 4.6771 8.0174 117.9322 53.7183 39.5925 175.4035 25 Y 4.0948 7.8041 119.1774 62.1935 38.7216 177.4973 26 C 4.1367 8.4641 116.7905 60.1450 38.6322 175.9364 27 N 4.5032 8.2342 117.4456 56.4938 38.1482 177.3899 28 Q 4.0153 7.9221 119.1679 59.2063 28.9255 178.5587 29 M 3.7482 7.9087 120.0526 58.4742 31.7375 178.7086 30 M 4.1576 8.3176 119.2202 58.3799 32.0777 178.4946 31 C 4.1816 7.6346 118.7910 61.9114 31.6104 175.0967 32 C 4.0277 8.1801 119.8651 62.5438 31.1960 174.2681 33 R 4.3033 8.4936 116.2329 55.5416 29.7571 176.5745 34 K 3.8613 7.6296 115.4409 58.6958 29.8802 175.6631 35 M 4.7465 8.5462 114.3929 55.3398 32.6559 177.4719 36 T 5.0662 7.7385 106.5058 60.3301 69.8582 172.8454 37 Q 4.6015 8.1267 122.2535 56.3317 29.0403 177.1178 38 G 3.8708 9.8183 111.8435 45.3638 0.0000 172.7947 39 K 3.3338 6.6325 117.0368 55.7232 35.5406 173.3195 40 C 4.7940 8.7193 122.6609 55.4301 39.8431 173.3854 41 K 3.9764 8.7436 127.7689 56.4297 31.7366 174.4933 42 P 4.5866 0.0000 0.0000 65.8590 32.0956 176.4906 43 V 5.0903 7.5860 117.6681 61.1812 34.6568 173.6319 44 N 4.7932 9.2089 124.8297 52.5391 42.7860 172.8477 45 T 4.7672 7.7312 120.6515 61.5620 71.3974 173.3103 46 F 4.8083 8.9617 124.5379 55.6594 41.8368 174.5354 47 V 4.4572 8.4889 123.1456 61.9220 32.7466 175.0222 48 H 4.9616 8.7901 123.0343 55.7415 29.7467 174.6385 49 E 4.3222 8.1124 118.6880 55.1946 30.5898 176.8974 50 S 4.3555 8.2784 114.6386 58.3008 64.9383 174.8488 51 L 3.9451 8.5006 124.2609 58.2597 41.7702 179.1054 52 A 3.9855 7.9802 120.1973 55.4003 18.1530 179.1561 53 D 4.2845 8.0044 116.1861 57.5162 41.1863 178.9999 54 V 3.7590 7.8428 118.7412 65.9564 31.5894 178.2404 55 K 3.9446 8.5557 118.5050 59.3685 31.8663 179.0708 56 A 4.0511 8.2622 121.0181 54.6775 18.2118 179.7187 57 V 3.7683 7.7953 117.1194 66.0917 31.3309 177.1858 58 C 3.8772 8.0095 115.4356 58.1624 39.9181 174.2186 59 S 4.6409 7.4700 115.0788 57.9401 63.7172 174.6671 60 Q 4.7463 7.5536 121.0662 56.0795 29.4264 175.6760 61 K 4.1436 8.6226 124.8519 57.5799 33.3562 176.4952 62 K 4.4344 8.6223 128.7232 56.0522 33.1104 175.9570 63 V 4.5130 7.8144 118.6000 60.2970 36.0015 174.6638 64 T 4.0953 8.2637 119.2898 63.3278 69.5290 175.6471 65 C 4.7233 8.3416 121.7432 56.2665 41.0470 175.3580 66 K 3.8250 8.6357 120.9703 58.8707 31.6597 178.0508 67 D 4.6480 8.1390 116.6558 52.8078 39.6071 176.8743 68 G 4.0154 7.8785 109.4191 45.8658 0.0000 174.6059 69 Q 4.1732 8.2737 118.7370 56.4697 29.5277 176.3179 70 T 4.5659 8.1252 107.8118 61.5261 69.0404 173.5302 71 N 5.0989 7.7778 113.3322 53.9366 39.0143 175.1610 72 C 5.3965 8.0510 115.7214 56.8622 41.4846 172.5487 73 Y 5.2254 9.3505 118.7206 56.3047 42.3122 173.8918 74 Q 5.1935 8.9693 123.6245 53.8934 30.3916 175.5021 75 S 4.6402 9.1477 122.2503 58.3081 63.5358 175.7799 76 K 4.1995 9.9090 123.4822 59.2019 32.5770 176.7382 77 S 5.0162 7.2895 109.5912 55.9503 66.2542 174.2589 78 T 4.0221 8.2910 110.4553 62.3238 69.5450 173.3128 79 M 4.9980 9.1311 121.4277 53.5227 37.0215 174.8611 80 R 4.5109 9.7908 122.2486 56.1840 31.4177 175.8514 81 I 5.0703 8.8470 116.9754 59.4000 41.9997 174.1634 82 T 5.0188 9.0639 119.2298 61.8548 71.9139 172.5801 83 D 4.9630 9.3231 126.8654 53.2317 43.1685 174.2510 84 C 5.5119 9.2192 123.4129 55.3241 43.8586 173.1618 85 R 5.1809 8.5783 122.3126 53.9125 33.1150 174.8108 86 E 4.0270 9.3692 126.1554 57.1804 30.3675 176.3694 87 T 4.4458 8.8919 115.8528 59.9666 71.1124 175.7160 88 G 3.8459 8.9498 112.2250 49.2070 0.0000 174.9946 89 S 4.1709 8.2127 114.7478 61.0996 62.9644 175.2986 90 S 4.0621 7.3415 113.2351 58.8031 62.4085 173.8251 91 K 4.3011 8.6366 128.2616 55.0979 33.7457 174.3187 92 Y 4.3923 8.7706 127.8056 57.8711 39.0323 174.3048 93 P 3.2032 0.0000 0.0000 63.2178 32.4826 176.2659 94 N 4.9217 7.8481 113.8979 52.7092 38.5980 173.1744 95 C 4.3899 8.1106 115.8064 56.7395 36.8744 173.3320 96 A 4.9985 8.8985 126.6250 50.2788 21.2422 174.4209 97 Y 5.1420 9.4868 120.3308 56.0180 41.4046 175.0732 98 K 4.5527 8.9965 123.7655 55.4071 34.0578 175.2953 99 T 4.8658 8.5983 124.4885 63.2534 69.9738 174.5645 100 T 4.5352 8.7531 122.2557 62.2552 72.5415 172.7496 101 Q 4.9995 8.7294 126.1060 54.6706 30.2283 175.7683 102 V 4.5287 8.5184 115.6410 59.9856 37.0049 174.2512 103 E 5.5073 8.7160 121.8900 54.2527 30.6794 175.1070 104 K 4.7674 8.2432 123.0845 54.4199 37.2351 175.1750 105 H 4.9297 9.1515 118.3752 55.6128 30.2121 175.0271 106 I 4.9657 8.8848 114.6466 59.1796 41.0296 174.1797 107 I 4.9328 8.6398 125.4519 59.7462 39.7639 175.1572 108 V 4.7611 8.8922 119.2705 59.4868 36.4167 174.2412 109 A 5.1624 9.0488 124.5921 50.9850 20.9349 175.6752 110 C 5.4881 8.7391 118.2995 55.6030 44.3792 173.3655 111 G 3.8829 9.3018 107.6337 46.9191 0.0000 173.5656 112 G 4.1028 8.9006 108.0763 44.7171 0.0000 172.5579 113 K 4.6578 8.1155 116.9241 53.5909 34.6887 175.0849 114 P 4.2775 0.0000 0.0000 62.4119 31.8001 176.1624 115 S 4.6829 8.3606 114.8529 58.2624 62.5340 173.3099 116 V 4.5741 8.4169 120.2141 58.2974 35.7288 173.5421 117 P 4.7945 0.0000 0.0000 63.3117 31.3786 176.9617 118 V 4.5247 8.7956 115.3854 60.7986 34.1884 175.0840 119 H 4.5557 7.8198 118.2791 55.2431 33.2798 172.0555 120 F 4.4098 8.8391 128.9465 57.7959 39.3295 174.2200 121 D 4.6015 8.3718 126.7326 55.7797 42.2341 175.7096 122 A 4.6486 6.3536 117.9868 51.7552 22.2708 174.9269 123 S 5.2850 8.9522 113.4669 56.5766 65.9981 174.7190 124 V 4.1423 9.0352 121.2668 62.0371 31.5224 175.1775 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 K 8.31 4.22 0.00 1.74 1.81 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.39 7.81 2 E 8.59 3.87 0.00 2.13 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 2.40 2.37 0.00 3 S 8.90 4.53 0.00 4.10 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 4 A 8.60 3.99 1.36 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 0.00 0.00 0.00 0.00 0.00 5 A 7.99 3.96 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 6 A 8.06 3.95 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 7 K 8.24 4.03 0.00 2.02 2.08 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.32 7.81 8 F 8.46 4.06 0.00 3.19 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 9 E 8.42 4.07 0.00 2.31 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 0.00 2.49 2.65 0.00 10 R 8.09 3.84 0.00 1.77 2.15 0.00 3.23 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 11 Q 8.18 4.06 0.00 1.59 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.49 0.00 0.00 0.00 0.00 0.00 2.27 2.48 0.00 12 H 8.07 4.68 0.00 1.90 2.76 0.00 5.61 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.76 4.65 0.00 2.02 2.14 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 2.68 2.65 0.00 14 D 8.28 4.75 0.00 2.53 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 7.92 4.55 0.00 4.04 4.10 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 0.00 0.00 0.00 16 G 8.10 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 17 N 7.57 4.47 0.00 2.83 2.89 0.00 0.00 7.11 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 18 S 8.27 4.21 0.00 3.92 3.82 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 19 A 8.35 4.46 1.26 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 0.00 0.00 0.00 20 S 8.29 4.71 0.00 3.76 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 21 S 8.68 4.44 0.00 4.22 4.06 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 0.00 0.00 0.00 22 S 8.31 4.56 0.00 4.01 4.12 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 0.00 0.00 0.00 0.00 23 S 7.55 4.31 0.00 3.96 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 24 N 8.02 4.68 0.00 2.82 2.92 0.00 0.00 6.79 7.56 0.00 0.00 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 Y 7.80 4.09 0.00 3.09 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 26 C 8.46 4.14 0.00 3.18 3.16 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 0.00 0.00 0.00 0.00 27 N 8.23 4.50 0.00 2.93 2.93 0.00 0.00 7.14 7.74 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 28 Q 7.92 4.02 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 29 M 7.91 3.75 0.00 0.88 1.14 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.74 0.00 30 M 8.32 4.16 0.00 1.64 1.95 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 2.46 0.00 31 C 7.63 4.18 0.00 3.07 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.18 4.03 0.00 2.84 3.02 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 0.00 0.00 0.00 33 R 8.49 4.30 0.00 1.98 2.02 0.00 3.57 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.90 0.00 34 K 7.63 3.86 0.00 1.94 1.87 0.00 1.88 0.00 0.00 1.89 0.00 0.00 3.13 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.54 7.81 35 M 8.55 4.75 0.00 1.99 2.08 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 2.49 2.40 0.00 36 T 7.74 5.07 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 1.50 0.00 0.00 37 Q 8.13 4.60 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.74 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 38 G 9.82 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 0.00 0.00 0.00 39 K 6.63 3.33 0.00 1.47 1.39 0.00 1.55 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.15 1.17 7.81 40 C 8.72 4.79 0.00 3.13 3.13 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 41 K 8.74 3.98 0.00 1.78 1.78 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.23 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.41 7.81 42 P 0.00 4.59 0.00 2.19 2.34 0.00 3.75 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 2.01 0.00 43 V 7.59 5.09 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 0.98 0.00 0.00 44 N 9.21 4.79 0.00 2.58 2.20 0.00 0.00 6.77 8.01 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 45 T 7.73 4.77 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 0.74 0.00 0.00 46 F 8.96 4.81 0.00 3.02 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 8.49 4.46 2.15 0.00 0.00 0.00 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 1.06 0.00 0.00 48 H 8.79 4.96 0.00 3.15 3.27 0.00 5.71 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.11 4.32 0.00 1.99 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 2.34 2.26 0.00 50 S 8.28 4.36 0.00 4.05 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 51 L 8.50 3.95 0.00 1.79 1.72 0.94 1.14 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 52 A 7.98 3.99 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 53 D 8.00 4.28 0.00 2.83 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.84 3.76 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 1.08 0.00 0.00 1.06 0.00 0.00 55 K 8.56 3.94 0.00 2.01 1.82 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.59 7.81 56 A 8.26 4.05 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 57 V 7.80 3.77 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 1.09 0.00 0.00 1.00 0.00 0.00 58 C 8.01 3.88 0.00 2.90 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 59 S 7.47 4.64 0.00 3.88 3.77 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 60 Q 7.55 4.75 0.00 2.26 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.85 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 61 K 8.62 4.14 0.00 1.86 1.84 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 1.44 7.81 62 K 8.62 4.43 0.00 1.78 1.56 0.00 1.58 0.00 0.00 1.31 0.00 0.00 2.65 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.03 1.30 7.81 63 V 7.81 4.51 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 0.61 0.00 0.00 0.86 0.00 0.00 64 T 8.26 4.10 4.19 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 0.00 0.00 1.24 0.00 0.00 65 C 8.34 4.72 0.00 3.14 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 66 K 8.64 3.83 0.00 1.77 1.88 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.53 7.81 67 D 8.14 4.65 0.00 2.76 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 68 G 7.88 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.27 4.17 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 70 T 8.13 4.57 4.18 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 1.21 0.00 0.00 71 N 7.78 5.10 0.00 2.93 3.02 0.00 0.00 6.02 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 72 C 8.05 5.40 0.00 2.91 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 73 Y 9.35 5.23 0.00 2.85 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 74 Q 8.97 5.19 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.82 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 75 S 9.15 4.64 0.00 3.99 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 76 K 9.91 4.20 0.00 1.87 2.02 0.00 1.56 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.63 1.41 7.81 77 S 7.29 5.02 0.00 3.81 3.85 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 78 T 8.29 4.02 4.19 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 0.00 0.00 1.06 0.00 0.00 79 M 9.13 5.00 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.51 0.00 80 R 9.79 4.51 0.00 1.77 1.89 0.00 3.06 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.81 0.00 81 I 8.85 5.07 1.91 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 1.46 0.75 1.01 0.00 0.00 82 T 9.06 5.02 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 1.31 0.00 0.00 83 D 9.32 4.96 0.00 2.76 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 84 C 9.22 5.51 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 85 R 8.58 5.18 0.00 1.80 1.85 0.00 3.32 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 86 E 9.37 4.03 0.00 1.83 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 2.21 2.08 0.00 87 T 8.89 4.45 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 1.24 0.00 0.00 88 G 8.95 3.85 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 0.00 89 S 8.21 4.17 0.00 3.84 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 90 S 7.34 4.06 0.00 3.75 3.82 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 91 K 8.64 4.30 0.00 1.69 1.59 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.52 7.81 92 Y 8.77 4.39 0.00 3.09 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 93 P 0.00 3.20 0.00 1.69 0.78 0.00 3.53 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 94 N 7.85 4.92 0.00 2.86 2.70 0.00 0.00 7.09 8.08 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 95 C 8.11 4.39 0.00 3.11 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.90 5.00 1.10 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 0.00 0.00 0.00 0.00 0.00 97 Y 9.49 5.14 0.00 2.85 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 98 K 9.00 4.55 0.00 1.87 1.74 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.45 7.81 99 T 8.60 4.87 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 1.35 0.00 0.00 100 T 8.75 4.54 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 1.23 0.00 0.00 101 Q 8.73 5.00 0.00 1.90 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.80 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 102 V 8.52 4.53 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 0.95 0.00 0.00 103 E 8.72 5.51 0.00 1.82 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 2.21 2.14 0.00 104 K 8.24 4.77 0.00 1.71 1.88 0.00 1.70 0.00 0.00 1.86 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.46 7.81 105 H 9.15 4.93 0.00 3.27 3.21 0.00 5.55 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.88 4.97 1.68 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 1.25 1.23 1.12 0.00 0.00 107 I 8.64 4.93 1.79 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.62 0.86 0.00 0.00 108 V 8.89 4.76 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 0.55 0.00 0.00 0.94 0.00 0.00 109 A 9.05 5.16 1.28 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 0.00 0.00 0.00 110 C 8.74 5.49 0.00 2.93 2.94 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 0.00 111 G 9.30 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 0.00 112 G 8.90 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.12 4.66 0.00 1.69 1.69 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.34 7.81 114 P 0.00 4.28 0.00 2.15 2.04 0.00 3.76 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 115 S 8.36 4.68 0.00 3.88 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 0.00 116 V 8.42 4.57 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 0.70 0.00 0.00 0.99 0.00 0.00 117 P 0.00 4.79 0.00 1.96 2.02 0.00 3.62 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 118 V 8.80 4.52 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 0.69 0.00 0.00 1.03 0.00 0.00 119 H 7.82 4.56 0.00 3.23 3.12 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.84 4.41 0.00 3.05 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 0.00 121 D 8.37 4.60 0.00 2.58 2.59 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 0.00 122 A 6.35 4.65 1.21 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 0.00 123 S 8.95 5.28 0.00 3.97 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 0.00 124 V 9.04 4.14 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 0.87 0.00 0.00 0.94 0.00 0.00