NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.0858 8.1727 122.0323 56.2378 33.9582 173.7856 2 Q 4.6663 8.4035 128.9116 53.9352 30.2470 174.3016 3 F 4.9014 8.5589 126.3412 57.4268 40.8863 174.9658 4 T 4.5046 8.4111 111.3480 60.5067 71.0217 175.8157 5 K 3.4211 8.9131 122.0625 60.2172 32.0465 179.3078 6 C 4.3125 8.0637 115.9079 59.5782 34.9413 175.4809 7 E 3.8547 7.8660 121.2280 59.3404 29.3221 178.7122 8 L 3.4477 7.5956 120.2072 57.9428 41.5155 178.8923 9 S 4.0401 7.8924 115.1114 61.8245 62.5592 176.8030 10 Q 3.9784 7.8038 119.2667 59.0197 28.5339 178.6632 11 L 4.0904 7.5909 118.5694 56.7481 41.7575 178.4978 12 L 4.5024 7.5767 116.9526 54.1638 41.8329 177.7983 13 K 3.7780 7.5584 121.9133 59.8698 31.8446 178.0440 14 D 4.5174 7.9709 115.7406 56.0190 41.1288 176.5089 15 I 4.0746 7.8289 119.3493 60.7467 38.4449 174.6577 16 D 4.5075 7.5422 119.7313 56.7785 41.3645 176.5975 17 G 3.9409 9.1854 115.2507 45.2894 0.0000 172.4066 18 Y 3.9354 8.0692 122.2079 58.7509 38.8597 176.2382 19 G 3.9110 8.7138 116.1478 46.7350 0.0000 174.0210 20 G 3.8297 7.9916 105.3830 45.5597 0.0000 174.1404 21 I 4.2063 7.2934 121.0563 59.4928 38.3304 175.2788 22 A 4.5825 8.1662 127.6198 51.2454 20.2515 177.6182 23 L 3.8337 8.8490 125.5802 58.1595 42.2223 178.1677 24 P 4.3146 0.0000 0.0000 65.6362 31.2505 178.4501 25 E 3.8924 8.1000 117.0297 59.2597 29.4494 178.9903 26 L 3.8172 7.7862 120.4211 57.9279 42.1204 179.0648 27 I 3.6563 7.9073 120.1029 64.4231 37.0749 177.4317 28 C 2.4500 7.6214 119.1446 59.2944 39.0981 175.7135 29 T 3.7303 7.4636 117.0775 67.0875 68.0869 176.6159 30 M 3.9261 7.9575 120.3491 57.8512 31.9214 178.6072 31 F 3.2510 7.9788 121.0425 61.4448 39.4299 176.7102 32 H 4.1942 7.6508 112.3433 57.5334 28.5775 177.1304 33 T 4.3403 7.1145 117.7422 64.9869 69.2415 175.6444 34 S 4.4392 7.6798 111.0141 56.5345 64.7012 174.5050 35 G 3.3393 8.0855 108.5906 46.7946 0.0000 173.5861 36 Y 3.7946 7.2979 113.0827 58.5816 35.6236 168.5483 37 D 5.1580 7.7117 120.8350 52.8758 42.0194 177.1923 38 T 4.1179 8.7634 117.9124 63.8671 69.7294 175.6160 39 Q 4.7703 8.4678 119.7652 55.4530 29.7460 175.7394 40 A 4.1828 7.8177 122.7687 52.2820 19.5323 177.2221 41 I 4.8382 8.3101 122.3698 59.5065 40.9020 174.9673 42 V 4.2638 8.4114 126.9915 60.8437 34.1358 174.2839 43 E 4.3044 8.8224 128.4446 56.4586 30.0054 176.5951 44 N 4.8755 8.5026 124.0561 51.3893 40.8787 173.3972 45 N 3.9403 8.2810 113.1780 56.7280 38.5884 174.6137 46 E 4.7425 8.1632 118.7746 55.6672 31.0501 176.1790 47 S 4.8782 7.6308 111.9374 58.6320 66.3310 172.2751 48 T 4.9549 9.0775 116.3220 62.0070 73.0703 172.9092 49 E 5.2378 8.7619 123.8887 54.8781 32.6475 174.6846 50 Y 5.2024 8.8281 120.3938 57.4026 42.3182 177.4137 51 G 4.4827 9.1254 111.8734 44.0967 0.0000 173.5440 52 L 3.9494 8.7808 119.3428 58.1101 41.7164 178.2962 53 F 4.6475 8.2076 113.2205 56.8749 39.9724 175.1987 54 Q 3.5759 7.9790 119.3172 57.0379 26.5131 174.0403 55 I 4.2604 7.9945 118.9833 60.8736 39.1809 177.4122 56 S 5.1272 9.3451 122.8856 58.2512 63.3515 174.1113 57 N 5.1249 9.0650 123.1056 53.1168 37.2805 176.1791 58 K 4.1642 8.1949 121.2104 59.0184 32.8200 177.0298 59 L 4.3946 7.7011 116.3246 54.9859 45.8181 177.3494 60 W 4.5976 8.2748 118.1444 57.8466 30.0130 173.2666 61 C 5.6851 7.9887 110.9703 53.4666 46.8491 172.7741 62 K 4.5163 8.7724 121.2879 55.3100 32.8770 175.2355 63 S 5.0324 8.4338 120.9730 56.3566 65.8028 174.8445 64 S 4.2365 8.8943 119.4011 60.8215 63.1973 175.3813 65 Q 4.1073 8.0485 122.3166 58.2638 29.1728 176.0886 66 V 4.3902 7.4107 117.4923 59.5012 31.2100 173.6299 67 P 4.3305 0.0000 0.0000 64.7651 31.5233 178.0770 68 Q 4.2579 7.9236 114.8934 56.0300 29.0091 175.8521 69 S 4.1418 7.7195 114.2613 58.8051 62.7542 174.6800 70 R 3.8511 8.4565 125.4919 57.2088 30.7789 175.9190 71 N 4.1484 8.0164 116.3693 54.3687 37.6394 175.1057 72 I 3.6717 7.7667 119.7955 64.8252 37.7337 177.4386 73 C 4.5024 8.5892 115.1165 56.8787 40.8744 172.6738 74 D 4.3109 7.9759 119.0365 54.0853 39.5191 172.6089 75 I 4.3359 7.8408 118.2248 59.7578 42.1899 173.5684 76 S 4.5763 8.1894 120.8163 58.0548 63.9025 176.0502 77 C 3.8959 8.5759 120.4712 59.4629 35.5171 176.1268 78 D 4.0704 7.7404 120.5556 56.0449 38.6915 178.2162 79 K 4.1130 7.3782 118.1061 58.0863 31.7879 177.3699 80 F 5.5462 7.6464 117.0837 56.7853 39.0510 176.6294 81 L 4.9806 7.9205 119.5266 54.4296 42.5283 176.0918 82 D 4.8353 7.7927 118.7629 52.0650 41.5302 175.6256 83 D 4.4194 8.5295 117.2654 55.9065 41.1416 176.0617 84 D 4.7085 7.7016 118.2563 53.1361 40.9152 175.9857 85 I 4.7170 8.2452 121.8234 60.8645 38.0547 177.3841 86 T 3.8740 8.1928 119.8685 67.2391 68.3430 176.2297 87 D 4.5040 8.1773 120.3601 56.3029 39.0443 178.1275 88 D 4.1922 8.2779 120.1467 57.3748 40.8867 178.4833 89 I 3.2868 8.0232 120.4490 64.3466 36.9292 178.1155 90 M 3.8645 7.8267 118.6144 58.7855 31.9932 177.5484 91 C 4.2060 8.1597 118.3893 59.4792 42.9204 175.1892 92 A 3.5397 7.6187 122.5867 55.0882 17.7060 179.7999 93 K 3.6450 7.8566 116.9906 59.2620 32.0021 179.5543 94 K 3.9856 7.6531 119.8936 59.3705 32.0482 179.0604 95 I 2.9335 7.4554 120.3108 64.0465 36.3471 178.3380 96 L 4.1328 8.1640 120.1716 57.9084 41.2056 179.4464 97 D 4.4014 8.1958 118.0190 57.2615 40.8780 178.4983 98 I 4.0602 7.7046 118.7491 63.6220 37.6266 177.0657 99 K 4.1232 7.8598 118.3893 58.2647 33.0593 176.1036 100 G 3.9334 8.3651 103.8413 44.9230 0.0000 173.9203 101 I 4.0773 8.4477 117.4493 64.0979 37.9093 176.8855 102 D 4.7017 8.1502 117.2732 55.4760 40.6649 176.3979 103 Y 3.8699 7.8620 120.9782 59.3421 39.0932 175.6144 104 W 4.4914 8.2571 120.5859 54.6817 28.8448 176.3346 105 L 3.9906 8.5068 126.4078 58.1094 41.3860 178.5234 106 A 4.0349 8.1363 120.2226 55.0359 18.2407 178.7500 107 H 3.9776 8.2238 116.7778 59.7044 29.7892 177.7470 108 K 3.9954 8.0229 118.2923 59.0590 32.0406 178.9580 109 A 4.1908 7.5497 119.7707 54.5776 18.5334 178.2174 110 L 4.7372 7.7993 111.7904 54.4273 43.8635 176.4932 111 C 4.8998 8.1941 115.9603 56.8983 40.4268 174.4262 112 T 4.3162 7.9562 107.9980 61.3227 69.0277 172.9940 113 E 4.6355 7.5264 118.7786 55.2976 33.1462 174.2934 114 K 3.8464 8.4832 115.3759 57.6621 29.6247 176.1956 115 L 4.6562 7.6135 117.6121 56.4172 43.0267 179.6782 116 E 4.0330 8.2854 118.7955 59.1755 29.5557 178.9998 117 Q 3.7530 7.8392 115.5533 58.3085 28.4292 177.1540 118 W 4.5901 7.4492 116.2248 56.9380 29.6151 176.6016 119 L 4.3238 7.6493 119.1718 54.3851 41.7855 175.4320 120 C 4.9323 8.4419 120.7754 54.9252 46.2236 173.1663 121 E 4.1562 8.8434 128.0267 57.4069 29.8432 175.8634 122 K 4.3311 7.1887 114.8869 55.5535 34.9098 174.3156 123 L 4.3144 8.4678 125.1266 55.2147 42.2797 176.0295 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 8.17 4.09 0.00 1.71 1.47 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.73 7.81 2 Q 8.40 4.67 0.00 2.13 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.91 0.00 0.00 0.00 0.00 0.00 2.33 2.55 0.00 3 F 8.56 4.90 0.00 2.92 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 4 T 8.41 4.50 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 1.27 0.00 0.00 5 K 8.91 3.42 0.00 1.97 1.88 0.00 1.83 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.57 1.78 7.81 6 C 8.06 4.31 0.00 2.99 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 7 E 7.87 3.85 0.00 2.02 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 0.00 2.43 2.39 0.00 8 L 7.60 3.45 0.00 1.31 1.17 0.30 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 9 S 7.89 4.04 0.00 4.03 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 10 Q 7.80 3.98 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 11 L 7.59 4.09 0.00 1.52 1.56 0.46 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.58 4.50 0.00 1.60 1.60 0.83 0.79 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 13 K 7.56 3.78 0.00 1.99 1.80 0.00 1.50 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.54 7.81 14 D 7.97 4.52 0.00 2.69 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 15 I 7.83 4.07 1.84 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.18 0.93 0.00 0.00 16 D 7.54 4.51 0.00 2.63 2.60 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 0.00 0.00 0.00 0.00 17 G 9.19 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 18 Y 8.07 3.94 0.00 3.09 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 19 G 8.71 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 20 G 7.99 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 21 I 7.29 4.21 2.10 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 1.18 0.42 0.89 0.00 0.00 22 A 8.17 4.58 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 23 L 8.85 3.83 0.00 1.76 1.69 0.88 0.82 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 24 P 0.00 4.31 0.00 2.28 2.23 0.00 3.63 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 25 E 8.10 3.89 0.00 2.22 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 2.62 2.39 0.00 26 L 7.79 3.82 0.00 1.77 1.70 0.85 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 27 I 7.91 3.66 2.04 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.86 1.13 0.00 0.00 28 C 7.62 2.45 0.00 1.23 2.65 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 29 T 7.46 3.73 4.16 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 1.07 0.00 0.00 30 M 7.96 3.93 0.00 1.96 2.09 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.54 0.00 31 F 7.98 3.25 0.00 2.97 2.86 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 32 H 7.65 4.19 0.00 3.13 3.27 0.00 5.70 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 33 T 7.11 4.34 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 1.41 0.00 0.00 34 S 7.68 4.44 0.00 3.93 4.05 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 35 G 8.09 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 36 Y 7.30 3.79 0.00 3.43 3.19 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 0.00 37 D 7.71 5.16 0.00 2.61 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 38 T 8.76 4.12 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 1.34 0.00 0.00 39 Q 8.47 4.77 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.84 0.00 0.00 0.00 0.00 0.00 2.50 2.30 0.00 40 A 7.82 4.18 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 41 I 8.31 4.84 1.88 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.02 0.83 0.00 0.00 42 V 8.41 4.26 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 1.01 0.00 0.00 0.96 0.00 0.00 43 E 8.82 4.30 0.00 1.86 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 0.00 2.28 2.30 0.00 44 N 8.50 4.88 0.00 2.80 2.76 0.00 0.00 7.06 8.82 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 45 N 8.28 3.94 0.00 2.70 2.72 0.00 0.00 6.60 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 46 E 8.16 4.74 0.00 2.04 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 2.17 2.20 0.00 47 S 7.63 4.88 0.00 4.13 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 48 T 9.08 4.95 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 0.61 0.00 0.00 49 E 8.76 5.24 0.00 1.93 1.87 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 2.31 2.24 0.00 50 Y 8.83 5.20 0.00 3.23 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 51 G 9.13 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 0.00 0.00 0.00 0.00 52 L 8.78 3.95 0.00 1.62 1.62 0.98 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.21 4.65 0.00 3.09 3.36 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 54 Q 7.98 3.58 0.00 2.38 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 55 I 7.99 4.26 1.86 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.58 1.04 0.00 0.00 56 S 9.35 5.13 0.00 4.22 4.17 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 0.00 0.00 0.00 57 N 9.06 5.12 0.00 2.94 3.36 0.00 0.00 6.88 7.01 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 58 K 8.19 4.16 0.00 1.81 1.94 0.00 1.66 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.40 7.81 59 L 7.70 4.39 0.00 1.43 0.98 0.58 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 60 W 8.27 4.60 0.00 3.66 3.22 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 61 C 7.99 5.69 0.00 3.05 3.39 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 62 K 8.77 4.52 0.00 1.87 1.66 0.00 1.45 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.39 7.81 63 S 8.43 5.03 0.00 3.91 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 64 S 8.89 4.24 0.00 4.02 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 65 Q 8.05 4.11 0.00 2.13 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.14 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 66 V 7.41 4.39 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 1.04 0.00 0.00 0.99 0.00 0.00 67 P 0.00 4.33 0.00 2.21 2.18 0.00 3.82 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 1.99 1.96 0.00 68 Q 7.92 4.26 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.94 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 69 S 7.72 4.14 0.00 4.02 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.46 3.85 0.00 1.65 1.85 0.00 3.26 0.00 0.00 3.02 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00 71 N 8.02 4.15 0.00 2.94 2.75 0.00 0.00 7.02 7.71 0.00 0.00 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 I 7.77 3.67 1.72 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.48 1.03 0.00 0.00 73 C 8.59 4.50 0.00 3.42 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 74 D 7.98 4.31 0.00 2.75 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 75 I 7.84 4.34 1.84 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 1.01 1.04 0.82 0.00 0.00 76 S 8.19 4.58 0.00 3.99 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 77 C 8.58 3.90 0.00 2.22 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 0.00 0.00 0.00 78 D 7.74 4.07 0.00 2.79 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 79 K 7.38 4.11 0.00 1.38 1.99 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.39 1.47 7.81 80 F 7.65 5.55 0.00 3.27 3.12 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 81 L 7.92 4.98 0.00 1.80 1.74 1.05 1.27 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 82 D 7.79 4.84 0.00 2.79 2.73 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 83 D 8.53 4.42 0.00 2.70 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.70 4.71 0.00 2.72 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 85 I 8.25 4.72 2.04 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.29 1.15 0.00 0.00 86 T 8.19 3.87 4.31 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 1.22 0.00 0.00 87 D 8.18 4.50 0.00 3.07 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 88 D 8.28 4.19 0.00 3.22 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 89 I 8.02 3.29 1.99 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 1.51 0.90 0.75 0.00 0.00 90 M 7.83 3.86 0.00 2.27 2.04 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 2.58 2.55 0.00 91 C 8.16 4.21 0.00 3.19 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 92 A 7.62 3.54 0.40 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 93 K 7.86 3.65 0.00 1.72 1.56 0.00 1.35 0.00 0.00 0.93 0.00 0.00 2.40 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.30 1.04 7.81 94 K 7.65 3.99 0.00 1.77 1.93 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.61 1.56 7.81 95 I 7.46 2.93 1.45 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.32 0.00 0.00 96 L 8.16 4.13 0.00 2.00 1.92 0.95 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 97 D 8.20 4.40 0.00 2.90 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.70 4.06 2.19 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 1.50 0.67 1.06 0.00 0.00 99 K 7.86 4.12 0.00 1.94 1.98 0.00 1.72 0.00 0.00 1.85 0.00 0.00 3.31 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.56 7.81 100 G 8.37 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 0.00 0.00 0.00 101 I 8.45 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 1.02 1.23 0.91 0.00 0.00 102 D 8.15 4.70 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 0.00 103 Y 7.86 3.87 0.00 2.50 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 0.00 0.00 0.00 104 W 8.26 4.49 0.00 3.66 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 0.00 105 L 8.51 3.99 0.00 1.71 1.66 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 106 A 8.14 4.03 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 0.00 107 H 8.22 3.98 0.00 3.31 3.41 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.02 4.00 0.00 1.80 1.87 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.65 1.49 7.81 109 A 7.55 4.19 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 0.00 110 L 7.80 4.74 0.00 1.51 1.65 0.66 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.19 4.90 0.00 2.94 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 0.00 112 T 7.96 4.32 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 1.16 0.00 0.00 113 E 7.53 4.64 0.00 2.07 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 2.36 0.00 114 K 8.48 3.85 0.00 2.01 1.93 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.38 1.48 7.81 115 L 7.61 4.66 0.00 1.76 1.86 1.12 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.29 4.03 0.00 1.99 1.96 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 2.40 2.30 0.00 117 Q 7.84 3.75 0.00 1.51 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.96 0.00 0.00 0.00 0.00 0.00 2.07 1.16 0.00 118 W 7.45 4.59 0.00 3.48 3.30 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 0.00 119 L 7.65 4.32 0.00 1.76 1.60 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 120 C 8.44 4.93 0.00 2.87 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 0.00 121 E 8.84 4.16 0.00 1.95 1.92 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 2.24 2.27 0.00 122 K 7.19 4.33 0.00 1.68 1.59 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.25 1.34 7.81 123 L 8.47 4.31 0.00 1.56 1.45 0.92 0.87 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