NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4162 8.2493 123.5854 52.9123 19.8006 176.6720 3 T 4.3480 7.6613 110.7299 61.0848 71.3436 173.4456 4 L 4.4048 7.6551 124.7516 53.5419 41.3257 176.4257 5 R 4.8916 8.0778 117.8999 53.4877 32.9337 175.9823 6 S 4.8106 8.6629 113.8803 58.8673 63.8848 173.0121 7 F 4.8802 8.2262 116.3857 55.9168 41.8474 173.0024 8 V 4.1450 8.2789 119.5944 62.0094 31.1942 175.2829 9 L 4.0715 8.4079 131.6563 57.2819 42.8960 176.9931 10 V 4.1771 7.4383 119.5407 61.0453 34.0523 174.2233 11 D 5.0503 8.7755 128.6875 53.2804 41.1654 176.2265 12 N 4.8077 9.2090 130.1261 52.7215 38.3045 175.8391 13 G 4.0897 8.8097 111.1511 44.8731 0.0000 174.4267 14 G 4.2108 7.2746 108.5405 45.5186 0.0000 174.1327 15 T 3.8188 8.1159 116.9226 65.5212 66.7821 176.9078 16 G 4.0405 8.9862 114.2106 45.9146 0.0000 173.9199 17 N 4.4696 8.0714 117.8653 53.4160 39.4272 175.2494 18 V 3.9590 8.4317 123.8246 61.8220 32.7892 174.5575 19 T 4.6971 8.2166 124.7222 61.9480 70.6483 174.4332 20 V 4.4812 8.0516 124.2767 61.1721 34.6502 174.8280 21 V 5.0190 9.0729 120.3833 58.8183 35.3263 173.1430 22 P 4.1916 0.0000 0.0000 62.6916 31.1920 176.2800 23 V 4.3632 8.7152 124.1477 63.9524 34.0424 175.2736 24 S 4.5580 7.5686 112.4087 56.8953 66.4308 174.0381 25 N 5.4907 8.2219 115.9614 52.3187 39.2082 173.5108 26 A 4.5462 7.6607 123.4705 51.9115 21.1564 177.2191 27 N 3.8902 9.5824 118.1235 54.4857 36.1402 175.2190 28 G 3.7975 8.5248 102.7254 45.8847 0.0000 173.9963 29 V 4.5358 7.5684 119.9172 60.6153 33.7797 174.5664 30 A 4.4731 8.8382 131.0052 51.4589 20.0876 175.4899 31 E 5.2170 8.6686 122.3365 54.1738 32.9740 174.5342 32 W 5.4604 10.0303 126.4618 55.2237 32.7709 174.6166 33 L 5.7772 9.4774 122.5929 52.0342 46.0515 176.3608 34 S 4.7108 8.5669 115.8255 56.9650 65.3055 174.4656 35 N 4.6995 8.1543 117.3134 52.2025 36.7268 173.3212 36 N 5.1322 7.3914 115.7310 50.7963 43.6427 174.9151 37 S 4.2232 8.4178 115.1197 58.8130 63.2820 176.0927 38 R 3.6864 8.8016 124.0444 59.3513 29.9614 178.2043 39 S 4.2506 8.0514 111.3775 60.7832 63.5217 174.6005 40 Q 4.4239 8.5780 119.0130 55.0884 28.2927 173.7147 41 A 4.9063 7.3351 118.4203 50.5812 22.8658 177.2297 42 Y 4.2532 8.9343 117.8254 58.2558 39.3829 175.3135 43 R 5.1940 8.8388 121.9658 54.9210 34.4008 173.9304 44 V 5.2129 9.1149 124.4385 61.6255 35.2754 174.0209 45 T 6.0565 9.5519 116.4894 59.5656 72.6762 172.4185 46 A 5.8904 8.8858 122.3571 52.1472 23.0594 175.1406 47 S 4.9841 8.6070 112.4419 57.3183 66.6645 172.5476 48 Y 4.8014 8.5942 122.6640 56.1010 40.8675 174.3942 49 R 4.5931 8.0535 124.2718 54.0690 35.2227 174.6259 50 A 4.4640 8.2232 121.8194 52.0983 19.5945 177.1777 51 S 4.1906 8.6821 113.7934 58.2398 66.1115 175.7636 52 G 4.0622 8.6148 117.0522 45.2517 0.0000 172.4144 53 A 4.4129 8.4552 120.4993 53.0667 19.4493 178.5486 54 D 4.5901 7.4743 114.8738 52.9189 40.5591 174.9548 55 K 5.1408 8.1340 117.0123 55.6253 36.9041 175.4519 56 R 4.8357 8.9933 120.2048 54.3651 34.3786 175.0184 57 K 5.0384 8.6616 122.4582 55.3613 35.4283 174.7868 58 Y 4.8220 9.3454 126.2655 57.8475 40.0594 175.3062 59 T 5.0050 8.9891 118.9096 62.2661 72.1084 172.6507 60 I 5.1985 8.8680 127.8778 59.3373 40.3547 175.2510 61 K 5.1482 9.2798 125.0631 54.5756 36.1433 175.0208 62 L 5.2849 8.9410 125.8934 53.3439 45.8051 175.0209 63 E 4.6379 9.1624 123.4101 54.6963 33.5989 174.5639 64 V 4.2082 8.5194 125.9449 60.3392 33.5076 173.1098 65 P 4.6190 0.0000 0.0000 61.8236 33.2728 175.8740 66 K 3.7143 7.6809 123.1661 54.4041 32.6101 174.8381 67 I 4.0113 7.7397 128.2966 61.2551 37.7679 175.8390 68 V 4.4560 8.3776 118.9057 60.5086 37.1065 173.7385 69 T 4.8948 8.2090 117.6301 61.9072 70.3386 174.3949 70 Q 4.3299 8.7961 128.4508 56.0586 30.8293 175.2286 71 V 4.9429 8.0268 115.6945 59.9541 35.6715 174.9653 72 V 4.2511 8.7173 125.1103 62.1884 34.2006 174.9659 73 N 4.1573 9.8396 125.4564 54.5658 35.9363 175.0184 74 G 3.8151 8.3650 101.8425 45.8333 0.0000 173.4447 75 V 4.3936 7.8817 121.0271 60.8043 33.3503 174.2387 76 E 5.1433 8.7563 126.4085 55.1356 31.5069 175.4953 77 L 4.9436 8.8779 122.2150 52.1260 46.3481 173.9070 78 P 4.7170 0.0000 0.0000 62.8824 32.1806 175.4562 79 V 4.5083 8.7263 123.7268 61.0897 35.8907 173.3731 80 S 4.9448 8.2674 116.5289 56.1729 63.5049 174.4152 81 A 4.1830 8.7381 130.4832 54.3145 18.9280 176.8296 82 W 4.3449 6.4936 107.9941 56.5148 31.7714 173.8406 83 K 5.2692 9.1918 118.1712 54.7672 35.8159 175.6320 84 A 4.9545 9.1106 124.3679 50.6431 21.4493 175.4902 85 Y 5.1769 8.8481 118.2310 56.1045 41.3428 175.0491 86 A 4.8842 8.9274 124.1862 50.2085 22.6922 174.8476 87 S 5.0827 8.7773 115.4977 56.5856 65.5615 173.1262 88 I 4.7525 9.0922 127.2986 59.5954 40.9481 173.9627 89 D 5.3752 8.9075 125.7021 52.4466 43.5942 174.8188 90 L 4.8537 9.1228 126.0327 53.4672 44.8655 174.9930 91 T 5.1881 8.6908 122.1483 61.8970 71.3599 173.4336 92 I 4.7478 8.9358 126.7877 58.6984 41.3165 173.5565 93 P 4.9974 0.0000 0.0000 62.5963 32.2342 177.3679 94 I 3.8891 8.3123 115.4676 62.4302 37.8775 177.1297 95 F 4.3087 7.4507 118.7668 58.9842 39.2307 175.4306 96 A 3.9577 7.7474 124.0171 52.4555 18.4647 177.8085 97 A 4.5999 8.7838 125.6010 50.8357 22.1544 177.4648 98 T 3.8031 8.4280 116.1438 67.5746 68.3476 176.1090 99 D 4.3864 8.1455 119.5061 57.7245 40.9199 178.5459 100 D 4.3871 8.1595 118.4954 57.6033 40.8377 178.8926 101 V 3.6070 7.8130 118.2692 66.4207 31.4649 177.8947 102 T 3.8269 8.0722 115.4690 66.7715 68.2862 176.2811 103 V 3.5326 7.8281 119.7014 66.2370 31.6259 177.6873 104 I 3.6584 7.7881 119.3257 64.6559 36.8958 177.8679 105 S 4.0133 8.5663 113.8823 61.7545 62.1692 176.6447 106 K 3.9979 8.4064 121.1411 59.2450 31.6470 179.5482 107 S 4.0654 8.4401 116.0170 61.6347 62.8231 176.5071 108 L 4.0259 7.7971 120.9963 57.8668 41.1856 179.3768 109 A 4.1197 7.5696 119.3255 55.2494 18.6539 179.4528 110 G 3.7510 8.5522 104.3323 47.8934 0.0000 175.0654 111 L 3.7518 8.1326 122.2335 57.8431 42.0982 178.5173 112 F 4.5080 7.7968 113.3993 56.1178 39.9992 176.1181 113 K 3.9464 7.5751 121.4842 56.3524 32.5660 176.0488 114 V 3.9276 8.1981 125.4186 64.0775 31.9473 175.4248 115 G 4.1064 9.0543 115.1615 45.8376 0.0000 174.1699 116 N 4.6905 7.9818 116.7179 51.4060 40.8422 174.0506 117 P 4.2084 0.0000 0.0000 66.6755 31.0233 178.3365 118 I 3.9323 7.8599 119.3987 63.7574 36.9379 178.1181 119 A 4.0387 7.9388 120.8037 55.0847 18.1315 178.8158 120 E 3.8413 7.9623 116.2778 59.5102 29.9584 178.4884 121 A 4.0414 8.4203 120.7956 55.3046 18.4855 179.4076 122 I 3.7245 7.9011 118.3442 64.6649 37.0396 178.4401 123 S 4.6561 8.1073 110.8314 58.9100 62.6111 174.4974 124 S 4.5812 7.3691 113.8198 58.1425 63.7247 173.6254 125 Q 3.4014 8.2472 116.3695 57.5809 26.0561 173.6281 126 S 4.6858 7.9691 113.0010 57.0765 65.2711 173.1509 127 G 3.8826 8.1421 109.9831 43.9872 0.0000 172.3264 128 F 4.3933 8.2723 119.7718 55.9639 39.1650 174.2593 129 Y 4.9212 8.0350 122.9909 54.8622 41.1544 175.4709 130 A 4.2924 8.7824 121.3909 53.4238 19.2138 176.3637 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 A 8.25 4.42 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 3 T 7.66 4.35 4.32 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 1.22 0.00 0.00 4 L 7.66 4.40 0.00 1.54 1.58 0.20 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 5 R 8.08 4.89 0.00 2.02 1.92 0.00 3.16 0.00 0.00 3.43 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.77 0.00 6 S 8.66 4.81 0.00 4.06 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 7 F 8.23 4.88 0.00 3.05 3.11 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 8 V 8.28 4.15 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 0.76 0.00 0.00 0.89 0.00 0.00 9 L 8.41 4.07 0.00 1.22 1.43 0.91 1.01 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 10 V 7.44 4.18 1.88 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 0.88 0.00 0.00 0.72 0.00 0.00 11 D 8.78 5.05 0.00 2.63 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 12 N 9.21 4.81 0.00 2.72 2.75 0.00 0.00 6.71 7.89 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 13 G 8.81 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 14 G 7.27 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 15 T 8.12 3.82 4.23 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 1.20 0.00 0.00 16 G 8.99 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 17 N 8.07 4.47 0.00 2.55 2.71 0.00 0.00 6.68 8.37 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 18 V 8.43 3.96 1.60 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 0.21 0.00 0.00 0.57 0.00 0.00 19 T 8.22 4.70 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 1.18 0.00 0.00 20 V 8.05 4.48 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 0.94 0.00 0.00 0.64 0.00 0.00 21 V 9.07 5.02 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 0.71 0.00 0.00 0.97 0.00 0.00 22 P 0.00 4.19 0.00 1.80 1.56 0.00 3.66 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 2.06 2.25 0.00 23 V 8.72 4.36 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 0.78 0.00 0.00 0.93 0.00 0.00 24 S 7.57 4.56 0.00 3.84 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 25 N 8.22 5.49 0.00 2.49 2.64 0.00 0.00 7.23 7.96 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 26 A 7.66 4.55 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 27 N 9.58 3.89 0.00 2.88 2.90 0.00 0.00 7.04 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 28 G 8.52 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 29 V 7.57 4.54 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 1.00 0.00 0.00 0.96 0.00 0.00 30 A 8.84 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.67 5.22 0.00 2.05 1.72 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 2.25 2.34 0.00 32 W 10.03 5.46 0.00 3.47 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 33 L 9.48 5.78 0.00 1.56 1.55 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.57 4.71 0.00 3.88 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 35 N 8.15 4.70 0.00 2.72 2.82 0.00 0.00 6.59 8.00 0.00 0.00 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 N 7.39 5.13 0.00 2.71 2.68 0.00 0.00 7.25 7.57 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 37 S 8.42 4.22 0.00 3.86 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 38 R 8.80 3.69 0.00 1.80 2.03 0.00 3.39 0.00 0.00 3.43 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 39 S 8.05 4.25 0.00 3.95 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 40 Q 8.58 4.42 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.20 2.41 0.00 41 A 7.34 4.91 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 42 Y 8.93 4.25 0.00 2.91 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 43 R 8.84 5.19 0.00 1.90 1.73 0.00 3.09 0.00 0.00 3.33 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 44 V 9.11 5.21 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 0.85 0.00 0.00 0.95 0.00 0.00 45 T 9.55 6.06 4.44 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 1.34 0.00 0.00 46 A 8.89 5.89 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 47 S 8.61 4.98 0.00 3.90 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 0.00 48 Y 8.59 4.80 0.00 2.58 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 49 R 8.05 4.59 0.00 1.60 1.62 0.00 3.14 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 50 A 8.22 4.46 1.08 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 0.00 0.00 51 S 8.68 4.19 0.00 3.83 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 8.61 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 0.00 0.00 0.00 53 A 8.46 4.41 1.27 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 0.00 0.00 0.00 54 D 7.47 4.59 0.00 2.63 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 55 K 8.13 5.14 0.00 1.88 1.66 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.38 7.81 56 R 8.99 4.84 0.00 1.68 1.28 0.00 3.01 0.00 0.00 2.92 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.68 0.00 57 K 8.66 5.04 0.00 1.72 1.54 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.56 7.81 58 Y 9.35 4.82 0.00 3.06 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 59 T 8.99 5.01 4.32 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 1.31 0.00 0.00 60 I 8.87 5.20 1.89 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 1.30 0.94 0.94 0.00 0.00 61 K 9.28 5.15 0.00 1.73 1.74 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 62 L 8.94 5.28 0.00 1.73 1.47 1.03 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 63 E 9.16 4.64 0.00 2.01 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.23 0.00 64 V 8.52 4.21 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 0.83 0.00 0.00 1.01 0.00 0.00 65 P 0.00 4.62 0.00 1.76 1.70 0.00 2.32 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.28 0.00 66 K 7.68 3.71 0.00 0.79 0.74 0.00 1.10 0.00 0.00 1.12 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 0.81 7.81 67 I 7.74 4.01 1.76 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 1.17 0.43 0.84 0.00 0.00 68 V 8.38 4.46 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 0.57 0.00 0.00 0.92 0.00 0.00 69 T 8.21 4.89 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 70 Q 8.80 4.33 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 71 V 8.03 4.94 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 0.71 0.00 0.00 0.93 0.00 0.00 72 V 8.72 4.25 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 1.09 0.00 0.00 0.93 0.00 0.00 73 N 9.84 4.16 0.00 2.88 2.85 0.00 0.00 7.15 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 74 G 8.37 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 0.00 0.00 0.00 75 V 7.88 4.39 2.18 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 1.00 0.00 0.00 0.99 0.00 0.00 76 E 8.76 5.14 0.00 1.99 1.95 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 2.20 2.32 0.00 77 L 8.88 4.94 0.00 1.53 1.52 0.92 0.83 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 78 P 0.00 4.72 0.00 2.04 2.05 0.00 3.69 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 1.97 1.94 0.00 79 V 8.73 4.51 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 0.91 0.00 0.00 0.95 0.00 0.00 80 S 8.27 4.94 0.00 3.93 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.74 4.18 1.05 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 0.00 0.00 82 W 6.49 4.34 0.00 3.46 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 83 K 9.19 5.27 0.00 1.38 1.18 0.00 1.73 0.00 0.00 1.44 0.00 0.00 2.68 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.16 1.42 7.81 84 A 9.11 4.95 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 85 Y 8.85 5.18 0.00 2.81 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.93 4.88 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 87 S 8.78 5.08 0.00 3.90 3.75 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 88 I 9.09 4.75 1.88 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.46 0.94 0.00 0.00 89 D 8.91 5.38 0.00 2.54 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.12 4.85 0.00 1.79 1.74 0.90 0.83 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 91 T 8.69 5.19 4.29 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 1.29 0.00 0.00 92 I 8.94 4.75 2.03 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.95 1.00 0.00 0.00 93 P 0.00 5.00 0.00 2.22 2.17 0.00 3.66 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.17 0.00 94 I 8.31 3.89 1.62 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.36 0.73 0.00 0.00 95 F 7.45 4.31 0.00 3.17 3.18 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 0.00 96 A 7.75 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 97 A 8.78 4.60 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 98 T 8.43 3.80 4.25 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 1.22 0.00 0.00 99 D 8.15 4.39 0.00 2.69 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 0.00 100 D 8.16 4.39 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 0.00 101 V 7.81 3.61 2.26 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 1.04 0.00 0.00 1.02 0.00 0.00 102 T 8.07 3.83 4.47 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 0.00 0.00 0.00 1.20 0.00 0.00 103 V 7.83 3.53 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 1.09 0.00 0.00 1.03 0.00 0.00 104 I 7.79 3.66 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.13 0.92 0.00 0.00 105 S 8.57 4.01 0.00 3.83 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 0.00 106 K 8.41 4.00 0.00 1.93 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.65 7.81 107 S 8.44 4.07 0.00 3.94 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 7.80 4.03 0.00 1.88 1.81 0.90 0.88 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 0.00 109 A 7.57 4.12 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 0.00 110 G 8.55 3.75 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 0.00 0.00 0.00 111 L 8.13 3.75 0.00 1.59 1.70 0.68 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 112 F 7.80 4.51 0.00 3.11 3.10 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 0.00 113 K 7.58 3.95 0.00 1.96 1.84 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.41 7.81 114 V 8.20 3.93 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 0.85 0.00 0.00 0.96 0.00 0.00 115 G 9.05 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 0.00 116 N 7.98 4.69 0.00 2.97 2.70 0.00 0.00 6.54 7.34 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 0.00 117 P 0.00 4.21 0.00 2.28 2.34 0.00 3.68 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.06 0.00 118 I 7.86 3.93 1.88 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.40 0.85 0.00 0.00 119 A 7.94 4.04 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 0.00 120 E 7.96 3.84 0.00 1.99 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 2.32 2.35 0.00 121 A 8.42 4.04 1.12 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 0.00 0.00 122 I 7.90 3.72 2.12 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.12 0.98 0.00 0.00 123 S 8.11 4.66 0.00 4.02 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 0.00 124 S 7.37 4.58 0.00 3.98 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 0.00 125 Q 8.25 3.40 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.14 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 126 S 7.97 4.69 0.00 3.82 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 0.00 127 G 8.14 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 0.00 128 F 8.27 4.39 0.00 3.11 3.03 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 0.00 129 Y 8.03 4.92 0.00 3.00 2.95 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 0.00 130 A 8.78 4.29 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