NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 3.7029 8.2649 123.4745 52.0107 20.5258 176.0658 2 L 4.2130 7.4772 115.2350 52.5654 41.0805 173.9280 3 D 5.0081 7.3292 119.5460 51.8019 43.0333 177.0408 4 T 4.2966 7.9461 107.5577 63.1511 68.7427 174.9773 5 N 4.7140 8.1272 119.2799 55.5628 39.9375 175.2040 6 Y 4.3548 8.3654 120.4677 59.8263 38.7734 176.8449 7 C 4.2118 8.0857 117.1368 59.2597 40.7670 174.4627 8 F 4.3930 8.0241 117.6715 57.9825 39.1660 176.4288 9 S 4.4881 7.8896 114.0438 59.3469 64.9670 172.4758 10 S 4.3301 6.9878 112.5633 57.6379 64.3909 171.6484 11 T 4.3695 7.9160 116.0081 62.6096 70.6057 172.6802 12 E 4.8893 7.3868 122.4561 56.5996 31.7059 176.0025 13 K 4.3708 8.3290 119.1098 56.5955 34.5069 175.9114 14 N 4.4388 7.4080 116.2112 51.5988 40.3069 174.4305 15 C 4.7420 7.7415 119.1706 57.1966 43.0707 173.1724 16 C 5.1448 8.3253 116.9302 55.5119 46.5607 173.1452 17 V 4.4295 8.6977 127.0604 62.1094 31.3504 175.9109 18 R 4.6512 7.9327 123.7954 53.6603 33.5824 175.4226 19 Q 4.5475 9.1956 118.2314 56.9597 29.4162 176.8019 20 L 4.2460 8.1292 121.2858 52.6127 41.9723 174.8893 21 Y 3.8068 8.0691 119.2141 58.4895 40.1440 175.2259 22 I 4.3981 6.8405 126.3701 59.3201 40.3926 174.4264 23 D 4.6545 9.3491 127.9759 54.5277 41.1792 178.5824 24 F 3.5349 8.2595 125.3411 59.2287 39.4116 178.8344 25 R 4.3234 8.3336 116.5247 58.0917 29.6133 178.5655 26 K 3.9132 8.3871 119.8172 59.2398 32.3441 177.8343 27 D 4.5741 7.8180 116.3768 56.3866 41.7235 177.7857 28 L 4.0972 7.8021 116.4221 54.7468 42.1794 177.6544 29 G 4.5568 8.2550 104.8352 45.7684 0.0000 173.3326 30 W 4.7107 8.3341 119.1062 57.5972 29.2450 176.3571 31 K 4.4584 8.9345 121.9656 56.5670 32.4906 177.0836 32 W 4.6397 8.1833 114.5342 56.4303 28.6751 175.9517 33 I 3.9909 6.8985 119.7207 59.8875 39.5596 174.0134 34 H 4.6593 8.8555 125.5273 57.9452 30.4745 174.8106 35 E 4.8133 7.6783 116.1566 53.5303 33.9551 173.4653 36 P 4.8854 0.0000 0.0000 61.8632 32.6128 176.1150 37 K 4.1406 8.9219 118.5102 59.8139 32.8057 176.2829 38 G 4.1333 7.5155 107.8944 46.5008 0.0000 170.7328 39 Y 4.2691 6.0830 120.3176 57.6486 41.6796 173.3789 40 H 4.6962 7.6500 116.6002 53.8328 27.5630 175.8447 41 A 3.7783 6.1079 125.5721 52.7991 18.7652 178.6142 42 N 4.1573 7.0462 112.9781 53.1806 38.5490 172.3890 43 F 4.6546 7.8123 110.0383 57.6815 41.0420 171.8867 44 C 4.7193 8.1196 116.1965 55.5163 39.0226 173.9508 45 L 4.3532 7.2397 120.6469 54.2259 44.8178 176.4218 46 G 4.2459 8.6975 106.2123 45.2497 0.0000 171.7103 47 P 4.5737 0.0000 0.0000 61.9656 32.9357 175.4971 48 C 5.0247 8.2572 117.6947 54.6033 46.4628 172.0655 49 P 4.4468 0.0000 0.0000 62.9352 31.4040 174.1648 50 Y 4.2443 6.7362 114.0174 57.3971 37.9899 177.4174 51 I 3.6677 8.6163 117.1810 62.9985 38.4635 176.3745 52 W 4.2780 7.9913 130.7907 58.6579 28.2999 174.4230 53 S 3.3346 7.6924 110.4580 59.2614 59.1038 170.8100 54 L 4.6058 8.0208 125.2116 53.0271 42.8536 175.7988 55 D 4.5046 7.9214 123.2936 55.5401 42.2271 176.7399 56 T 4.5568 7.3126 107.9096 60.2089 71.1543 175.7331 57 Q 4.0494 8.5634 120.9687 59.2355 28.7145 178.1980 58 Y 4.2735 7.8224 118.6690 60.0465 38.4435 177.9065 59 S 3.9361 8.1665 116.3021 60.7267 62.7256 175.8423 60 K 4.3353 7.8669 121.1395 58.4452 33.0760 179.2410 61 V 3.5814 7.4676 119.1148 65.9080 31.6823 177.6761 62 L 3.9861 7.5381 119.8856 57.8470 41.8742 178.2737 63 A 4.0449 7.4452 119.5957 55.6565 18.2126 179.7078 64 L 4.1983 7.9069 117.1321 57.9855 41.5666 178.6448 65 Y 4.0619 7.8513 118.6630 60.6206 38.6511 177.5571 66 N 4.5296 8.3879 117.1866 56.1350 39.3906 176.8926 67 Q 4.1006 7.9742 117.4837 58.5769 28.8303 178.2077 68 H 4.5186 8.1456 116.6658 56.3053 29.3301 175.0772 69 N 4.6953 7.3066 119.3436 50.5693 39.6027 172.4635 70 P 4.3276 0.0000 0.0000 65.2665 31.2356 175.7295 71 G 3.8383 8.9173 110.4771 44.9800 0.0000 172.7858 72 A 4.1718 7.6014 123.2255 52.1460 18.5788 177.3311 73 S 4.6742 8.7414 117.8849 58.5883 62.6566 173.9240 74 A 4.6503 7.6013 118.4394 51.1707 18.9631 177.5361 75 A 4.2752 8.0480 122.1530 52.8293 18.7876 175.6341 76 P 4.6087 0.0000 0.0000 62.8472 33.1422 175.6530 77 C 4.5951 7.7184 118.7329 58.0892 32.9080 173.7827 78 C 4.7818 8.6728 125.0882 56.7808 44.7866 172.6926 79 V 4.5030 8.0136 116.8091 59.5432 36.5400 171.8832 80 P 4.6071 0.0000 0.0000 62.6649 30.4852 176.2166 81 Q 4.1410 9.0767 127.1732 58.1488 28.9142 175.3997 82 A 4.6460 7.9206 121.3879 51.0220 21.2326 175.6311 83 L 5.3123 8.1880 119.7057 53.5772 45.7377 175.1519 84 E 4.8758 8.6989 117.1655 54.9437 34.5220 174.6395 85 P 5.5769 0.0000 0.0000 63.3006 33.9453 175.0256 86 L 4.2689 8.1332 119.9185 54.1640 44.6679 173.1464 87 P 5.3888 0.0000 0.0000 62.5028 31.4414 175.0443 88 I 4.8467 7.8245 121.0661 60.5581 41.5731 174.1157 89 V 4.3009 8.1085 120.8548 63.3596 34.8681 172.7863 90 Y 5.3045 7.3271 128.4214 55.3905 41.5606 173.7460 91 Y 4.8265 8.7280 115.2264 56.7417 41.5423 175.6857 92 V 4.0771 8.6124 125.2155 61.7584 30.1740 174.7059 93 G 4.1071 8.5484 116.6038 45.2832 0.0000 171.8486 94 R 4.6923 7.7247 118.2500 54.4894 34.1247 175.1031 95 K 4.4256 7.9602 121.3037 54.1547 33.2779 173.8732 96 P 3.1375 0.0000 0.0000 61.9644 32.3669 175.9816 97 K 4.0993 7.7256 120.1370 55.0198 35.9960 175.1808 98 V 4.3215 8.0168 125.5331 61.1408 32.8946 174.6943 99 E 4.6753 8.3538 128.3254 55.7539 33.3759 174.1595 100 Q 4.8616 8.7596 112.8325 54.1664 30.8757 174.0617 101 L 4.1041 8.9517 123.1574 55.3304 43.3980 175.7650 102 S 4.7984 8.6738 116.4851 57.2691 64.0792 173.2999 103 N 4.3566 8.7671 122.8723 54.9599 35.7521 174.1791 104 M 4.5617 8.2604 115.8479 55.8159 32.9032 175.1061 105 I 5.0248 7.6110 117.2977 60.2377 42.2674 173.8125 106 V 4.6865 7.9860 122.2134 61.5465 32.9587 175.3398 107 R 4.7364 8.5232 125.9259 56.0485 33.0121 175.1279 108 S 4.7664 7.5124 110.0623 58.1840 65.1896 176.6421 109 C 5.4718 8.9413 120.4005 54.5767 37.0228 174.4775 110 K 4.2791 8.8964 124.4274 56.0766 35.2005 178.2570 111 C 4.6760 8.7691 114.6758 55.7517 41.1754 173.0297 112 S 4.3350 8.4551 117.5871 58.2349 62.1194 173.8853 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 A 8.26 3.70 1.16 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 0.00 0.00 2 L 7.48 4.21 0.00 1.53 1.50 0.20 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 3 D 7.33 5.01 0.00 2.84 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 4 T 7.95 4.30 4.36 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 1.29 0.00 0.00 5 N 8.13 4.71 0.00 2.78 3.07 0.00 0.00 7.03 7.58 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 6 Y 8.37 4.35 0.00 3.17 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 7 C 8.09 4.21 0.00 3.12 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 8 F 8.02 4.39 0.00 3.10 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 9 S 7.89 4.49 0.00 3.95 3.74 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 10 S 6.99 4.33 0.00 3.67 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 11 T 7.92 4.37 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 1.15 0.00 0.00 12 E 7.39 4.89 0.00 1.90 1.81 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 2.29 2.14 0.00 13 K 8.33 4.37 0.00 1.73 1.76 0.00 1.52 0.00 0.00 1.58 0.00 0.00 2.68 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.03 1.16 7.81 14 N 7.41 4.44 0.00 1.44 1.95 0.00 0.00 6.34 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 15 C 7.74 4.74 0.00 3.26 3.43 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 16 C 8.33 5.14 0.00 3.19 2.81 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 17 V 8.70 4.43 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 1.08 0.00 0.00 1.00 0.00 0.00 18 R 7.93 4.65 0.00 1.79 2.13 0.00 3.19 0.00 0.00 3.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.59 0.00 19 Q 9.20 4.55 0.00 2.26 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 7.58 0.00 0.00 0.00 0.00 0.00 2.79 2.54 0.00 20 L 8.13 4.25 0.00 1.01 1.51 0.36 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 8.07 3.81 0.00 3.00 2.71 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 0.00 0.00 0.00 0.00 22 I 6.84 4.40 1.18 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.05 0.58 0.00 0.00 23 D 9.35 4.65 0.00 3.00 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 24 F 8.26 3.53 0.00 3.46 3.06 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 25 R 8.33 4.32 0.00 2.15 2.29 0.00 2.83 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.93 0.00 26 K 8.39 3.91 0.00 2.09 1.91 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.50 7.81 27 D 7.82 4.57 0.00 2.57 2.57 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 28 L 7.80 4.10 0.00 1.41 1.08 -0.16 0.70 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 29 G 8.25 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 W 8.33 4.71 0.00 3.67 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 31 K 8.93 4.46 0.00 1.83 1.94 0.00 1.78 0.00 0.00 1.98 0.00 0.00 3.22 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.54 7.81 32 W 8.18 4.64 0.00 3.44 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 33 I 6.90 3.99 0.99 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.24 -0.36 -0.33 0.00 0.00 34 H 8.86 4.66 0.00 3.19 3.64 0.00 5.89 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 35 E 7.68 4.81 0.00 1.84 1.71 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 0.00 2.05 2.00 0.00 36 P 0.00 4.89 0.00 2.22 2.15 0.00 3.91 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.11 0.00 37 K 8.92 4.14 0.00 1.93 2.07 0.00 1.77 0.00 0.00 1.88 0.00 0.00 2.91 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.58 1.46 7.81 38 G 7.52 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 39 Y 6.08 4.27 0.00 3.04 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 40 H 7.65 4.70 0.00 3.17 3.22 0.00 5.63 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 6.11 3.78 0.79 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 0.00 0.00 42 N 7.05 4.16 0.00 3.02 2.94 0.00 0.00 6.91 7.36 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 43 F 7.81 4.65 0.00 3.26 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 44 C 8.12 4.72 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 45 L 7.24 4.35 0.00 1.61 1.51 1.24 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.70 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 0.00 0.00 0.00 0.00 47 P 0.00 4.57 0.00 2.20 2.22 0.00 3.61 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 1.99 1.90 0.00 48 C 8.26 5.02 0.00 3.00 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 49 P 0.00 4.45 0.00 1.42 1.52 0.00 3.83 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.49 0.00 50 Y 6.74 4.24 0.00 3.24 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 51 I 8.62 3.67 1.99 0.00 0.00 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 1.25 0.76 1.11 0.00 0.00 52 W 7.99 4.28 0.00 3.19 3.06 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 53 S 7.69 3.33 0.00 3.79 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 54 L 8.02 4.61 0.00 1.64 1.61 1.03 1.20 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 55 D 7.92 4.50 0.00 2.71 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 56 T 7.31 4.56 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 1.28 0.00 0.00 57 Q 8.56 4.05 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.97 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 58 Y 7.82 4.27 0.00 3.15 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 59 S 8.17 3.94 0.00 4.09 3.92 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 60 K 7.87 4.34 0.00 2.03 2.10 0.00 1.32 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.48 7.81 61 V 7.47 3.58 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 1.05 0.00 0.00 1.00 0.00 0.00 62 L 7.54 3.99 0.00 1.48 0.95 0.97 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 63 A 7.45 4.04 1.65 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 64 L 7.91 4.20 0.00 1.84 1.79 0.76 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 65 Y 7.85 4.06 0.00 3.10 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 66 N 8.39 4.53 0.00 3.01 2.83 0.00 0.00 7.13 6.46 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 67 Q 7.97 4.10 0.00 2.44 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.57 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 68 H 8.15 4.52 0.00 3.12 3.28 0.00 5.83 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 N 7.31 4.70 0.00 2.45 2.62 0.00 0.00 6.64 8.51 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 70 P 0.00 4.33 0.00 2.15 2.06 0.00 3.71 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 71 G 8.92 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 0.00 0.00 0.00 72 A 7.60 4.17 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 73 S 8.74 4.67 0.00 3.87 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 74 A 7.60 4.65 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 75 A 8.05 4.28 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 76 P 0.00 4.61 0.00 2.20 2.04 0.00 3.76 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.02 0.00 77 C 7.72 4.60 0.00 3.02 2.88 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 78 C 8.67 4.78 0.00 3.06 2.99 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 79 V 8.01 4.50 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 0.83 0.00 0.00 0.95 0.00 0.00 80 P 0.00 4.61 0.00 2.11 2.15 0.00 3.80 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 81 Q 9.08 4.14 0.00 2.09 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 82 A 7.92 4.65 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 83 L 8.19 5.31 0.00 1.80 1.66 1.04 0.96 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 84 E 8.70 4.88 0.00 1.95 1.83 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 2.26 2.29 0.00 85 P 0.00 5.58 0.00 2.11 2.14 0.00 3.45 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.83 0.00 86 L 8.13 4.27 0.00 1.60 1.51 0.81 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 5.39 0.00 2.14 2.10 0.00 3.41 0.00 0.00 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.84 0.00 88 I 7.82 4.85 1.74 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.13 0.95 0.00 0.00 89 V 8.11 4.30 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 0.70 0.00 0.00 0.87 0.00 0.00 90 Y 7.33 5.30 0.00 3.14 2.93 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 91 Y 8.73 4.83 0.00 2.94 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 92 V 8.61 4.08 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 1.12 0.00 0.00 1.04 0.00 0.00 93 G 8.55 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 94 R 7.72 4.69 0.00 1.79 1.95 0.00 3.22 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 95 K 7.96 4.43 0.00 1.70 1.61 0.00 1.55 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.48 7.81 96 P 0.00 3.14 0.00 1.82 1.46 0.00 3.68 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 1.84 1.95 0.00 97 K 7.73 4.10 0.00 0.95 1.18 0.00 1.60 0.00 0.00 1.50 0.00 0.00 2.58 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.11 1.38 7.81 98 V 8.02 4.32 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 0.93 0.00 0.00 0.80 0.00 0.00 99 E 8.35 4.68 0.00 2.45 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 2.36 2.52 0.00 100 Q 8.76 4.86 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.53 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 101 L 8.95 4.10 0.00 1.70 1.79 1.42 0.91 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 0.00 102 S 8.67 4.80 0.00 3.91 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 0.00 103 N 8.77 4.36 0.00 2.96 2.94 0.00 0.00 6.96 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 0.00 104 M 8.26 4.56 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.00 0.00 105 I 7.61 5.02 1.98 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.78 1.09 0.00 0.00 106 V 7.99 4.69 2.27 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 0.73 0.00 0.00 1.05 0.00 0.00 107 R 8.52 4.74 0.00 1.91 1.86 0.00 3.38 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 108 S 7.51 4.77 0.00 3.84 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 0.00 109 C 8.94 5.47 0.00 2.84 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 0.00 110 K 8.90 4.28 0.00 1.90 0.96 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.75 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.41 1.31 7.81 111 C 8.77 4.68 0.00 2.97 2.97 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 0.00 112 S 8.46 4.34 0.00 3.89 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