NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2367 8.1727 120.1329 56.8184 34.8280 173.9208 2 V 4.5472 8.0736 121.7120 60.8601 32.3852 174.7339 3 F 4.4289 9.4194 128.1877 57.2287 40.1761 174.9293 4 E 3.9849 8.9832 122.8399 56.0357 30.7127 176.6840 5 R 3.3566 9.0412 124.3498 60.5859 29.9340 179.3999 6 C 4.3046 8.2459 115.1582 59.7918 41.4151 175.6774 7 E 3.8844 8.3800 120.5489 59.2215 29.2031 178.4968 8 L 3.5384 8.0413 120.0596 57.8747 42.0725 178.5878 9 A 3.9325 7.8222 120.6619 55.5092 18.3448 179.9377 10 R 3.9216 7.9846 116.3873 59.4575 29.6593 179.4616 11 T 3.8647 7.9108 115.6722 66.7145 68.4858 176.7168 12 L 3.8759 8.1011 121.2190 57.3860 41.5824 179.5173 13 K 3.9031 8.0571 119.6881 59.6808 31.9852 179.0816 14 R 3.9897 7.8567 116.9190 58.8237 29.9765 177.9893 15 L 4.4575 7.2255 115.8982 54.1609 41.7471 177.1117 16 G 3.8852 7.8778 106.8325 46.4662 0.0000 174.9887 17 M 3.9376 7.8562 120.8322 56.4156 32.2907 175.6697 18 D 4.3807 7.9910 117.8693 55.7152 40.9553 175.6566 19 G 3.9539 9.3707 115.5191 45.4851 0.0000 171.3066 20 Y 4.2448 8.2557 121.7485 59.0060 39.1771 176.6340 21 R 3.4555 8.9641 127.2430 57.2032 27.7933 177.1049 22 G 3.8120 8.2271 104.3736 45.3335 0.0000 173.6821 23 I 4.0701 7.6398 122.0817 59.2588 37.7095 175.7855 24 S 4.6262 8.3024 121.0564 58.0025 64.8571 174.7272 25 L 4.2360 8.5793 124.4580 58.5554 41.7433 179.3826 26 A 4.1443 8.1103 120.2185 55.1740 18.3167 179.1882 27 N 4.4168 8.1121 115.1457 56.3273 38.5101 177.7017 28 W 4.3214 7.9625 120.2679 59.8603 29.0399 178.5139 29 M 4.1408 8.5848 119.0949 58.6446 31.4847 177.8954 30 C 3.3175 8.1046 118.6582 59.1852 43.7280 175.2680 31 L 3.9688 8.2206 121.7093 58.3225 41.7067 178.8742 32 A 4.1566 8.4049 120.7922 54.9434 18.3085 179.4773 33 K 2.7850 8.3250 118.4305 59.2079 32.0276 178.9581 34 W 4.3106 7.7232 117.2212 58.8650 29.1961 178.4685 35 E 4.3134 8.4320 118.8438 58.8306 28.8991 177.9178 36 S 4.5226 7.8285 109.4621 56.4038 64.7040 174.4512 37 G 3.4731 8.4349 108.8865 46.9257 0.0000 173.2978 38 Y 3.6525 7.1185 110.7208 58.7127 35.5436 168.7125 39 N 5.3117 7.9023 119.0452 51.9380 40.2762 175.5107 40 T 4.0903 8.9500 117.5890 63.8534 69.2083 176.0439 41 R 4.3963 8.0286 116.6482 55.8368 30.3535 176.3586 42 A 4.2713 7.9035 122.5764 52.7611 19.2668 176.5875 43 T 5.0170 8.4648 111.8232 59.8510 72.3720 173.0882 44 N 4.8995 8.7148 121.6079 52.2784 42.5054 172.4299 45 Y 4.6528 8.7516 127.8018 57.2395 40.8280 173.8199 46 N 4.6191 8.4753 124.6564 51.2350 38.9339 175.4531 47 A 3.6622 8.2671 127.8349 54.6341 19.0354 179.1007 48 G 3.7592 8.1062 104.4877 48.2099 0.0000 173.9390 49 D 4.7194 7.5231 115.2045 51.9991 40.0327 176.0842 50 R 4.1863 8.1215 115.9829 56.7267 28.4307 176.0406 51 S 4.8187 7.8453 113.9851 57.6592 65.7779 172.9344 52 T 5.1302 8.8269 115.5251 61.9546 72.7888 172.8809 53 D 5.6011 9.0614 124.4236 53.0142 43.6561 175.0043 54 Y 4.9284 9.1254 120.3784 57.4552 41.4604 177.3006 55 G 4.5509 9.4442 112.8557 46.1776 0.0000 173.4892 56 I 3.7832 8.2014 116.8567 62.8634 37.9992 177.4616 57 F 4.7290 8.0148 115.8658 56.4718 39.9674 175.1669 58 Q 3.6469 7.9081 119.2194 57.0897 26.4551 173.8630 59 I 4.4562 8.2329 119.0933 61.0008 39.3434 176.6358 60 N 5.4839 9.1422 125.5403 52.8067 40.1038 175.7704 61 S 4.6222 9.0035 120.0922 60.3318 63.3435 175.4796 62 R 3.7401 8.8479 122.4948 58.7903 30.4197 177.7138 63 Y 4.0782 7.6796 114.9572 57.9354 40.3571 176.9143 64 W 4.9708 8.0014 118.3592 57.5429 31.6556 173.9216 65 C 5.6260 8.0909 112.0428 53.7141 44.9095 172.3654 66 N 5.0314 8.9643 119.1375 52.1613 39.9023 174.8444 67 D 4.7783 8.9455 124.0018 52.5696 40.4198 176.5995 68 G 4.1375 8.4762 109.3536 45.3657 0.0000 174.6732 69 K 4.4505 8.0646 115.5566 56.5552 32.9480 175.6801 70 T 4.5046 7.6898 117.7449 61.1221 69.5389 172.1310 71 P 4.2422 0.0000 0.0000 63.7804 31.9161 176.8907 72 G 3.7908 8.8510 108.4233 45.6282 0.0000 173.3998 73 A 4.2831 7.3467 120.7241 51.8853 19.2929 177.2226 74 V 4.3820 8.1478 112.4102 59.2911 35.7760 176.0393 75 N 5.0198 8.0590 116.6588 52.4700 37.6854 174.7014 76 A 4.0810 8.8054 124.4543 54.8528 19.1832 178.5931 77 C 4.4060 8.5408 111.9240 57.6594 41.0388 173.0585 78 H 4.0841 8.0703 115.3760 56.4941 27.4424 173.8501 79 L 4.8669 8.1954 117.8867 53.2146 46.3097 176.8307 80 S 4.5475 8.3658 115.1749 58.2753 63.1644 176.0350 81 C 3.9858 8.7694 124.9029 59.8146 39.4940 176.3060 82 S 3.9307 7.9195 114.8048 61.4091 61.6156 176.0256 83 A 4.1544 7.9657 122.3903 54.2173 18.3743 177.8618 84 L 4.5357 7.7752 116.8537 54.8540 41.7357 177.4750 85 L 4.9735 7.7871 116.8631 54.5088 42.5641 176.7991 86 Q 4.3304 7.9500 117.5195 55.4688 29.4915 176.0538 87 D 4.4184 8.6197 120.6662 57.2678 41.1181 176.8985 88 N 4.5417 8.0662 118.0899 53.3910 39.3360 174.6052 89 I 4.2946 8.4158 118.6560 60.9083 37.9788 177.0628 90 A 3.9325 8.5253 124.9936 56.0374 18.1649 180.1966 91 D 4.2585 8.0975 116.4849 57.3619 40.9157 178.7093 92 A 4.0736 7.9822 120.8898 55.1873 18.3713 179.7132 93 V 3.3728 8.2673 116.9588 65.9497 31.5916 178.0127 94 A 3.8089 8.1017 120.7486 55.3476 18.1093 178.8654 95 C 4.1774 8.4150 116.7843 59.6049 37.9203 175.4800 96 A 3.9386 8.3126 122.8590 55.2083 17.6121 179.7569 97 K 3.8003 7.7485 116.1742 59.3900 32.4037 179.2060 98 R 4.0529 7.8525 119.0063 59.2979 30.0067 178.4577 99 V 2.3240 7.4608 118.1344 65.7887 31.1260 177.7341 100 V 3.9611 7.2843 107.4561 61.9995 31.7034 177.7908 101 R 4.2059 7.7029 117.7789 57.0185 30.5768 176.4316 102 D 4.7492 7.4619 119.3460 52.6736 42.0384 175.4347 103 P 4.2430 0.0000 0.0000 66.1157 31.6812 178.3686 104 Q 4.0356 8.2031 116.2943 56.7438 29.9905 177.6016 105 G 3.5813 7.8405 107.3211 46.4997 0.0000 176.2639 106 I 3.8190 7.7123 121.7803 62.7589 37.9540 177.6924 107 R 4.2254 7.3287 117.7436 58.5825 30.0310 177.5036 108 A 3.9296 7.6981 120.9070 54.2960 18.5560 177.6767 109 W 4.7411 8.2254 116.4393 55.4845 29.9270 177.5598 110 V 3.7495 8.7720 123.5349 66.0409 30.8819 177.6792 111 A 4.0191 8.2823 120.1782 54.6935 18.1283 179.2659 112 W 3.9438 8.3074 126.6883 60.6804 30.6178 178.3910 113 R 3.9992 8.1257 117.6056 58.7703 29.6410 178.3748 114 N 4.3511 8.1282 115.0654 55.6514 38.7044 176.8164 115 R 4.0638 7.6503 115.4914 55.7652 31.6036 175.8115 116 C 4.5029 7.1041 113.8281 57.9979 39.3663 174.2490 117 Q 3.1561 6.7330 120.7762 57.2397 28.7700 176.1473 118 N 4.2230 8.6580 119.8971 54.0390 36.1857 173.8345 119 R 4.4889 7.2581 116.2688 54.0943 32.8082 175.4345 120 D 4.5781 8.4599 119.1657 54.0875 41.0057 176.0330 121 V 4.6347 8.2308 119.0541 61.2155 32.3801 178.1760 122 R 4.0922 8.2845 122.1246 59.1092 30.1890 179.0400 123 Q 3.9897 8.0959 115.7852 59.1540 28.7004 178.1180 124 Y 4.1467 7.6234 115.3646 60.2914 38.1995 177.3947 125 V 4.3118 7.6780 110.4570 60.6310 32.6164 175.2221 126 Q 4.1275 7.5897 122.8317 57.5621 29.0033 176.6588 127 G 3.9843 9.0186 113.5838 45.7892 0.0000 174.2529 128 C 4.4408 7.9200 115.3826 56.7783 40.6135 174.1584 129 G 3.8832 8.2149 107.3296 46.4275 0.0000 174.1434 130 V 4.0156 7.8069 118.0701 61.1107 32.1659 175.7158 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 4.24 0.00 1.64 2.09 0.00 1.07 0.00 0.00 1.15 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.15 7.81 2 V 8.07 4.55 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.42 4.43 0.00 2.77 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 4 E 8.98 3.98 0.00 2.03 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 2.39 2.26 0.00 5 R 9.04 3.36 0.00 1.97 1.89 0.00 3.46 0.00 0.00 3.44 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.81 0.00 6 C 8.25 4.30 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 7 E 8.38 3.88 0.00 2.06 2.21 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 2.75 2.48 0.00 8 L 8.04 3.54 0.00 1.35 1.40 -0.09 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.82 3.93 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 10 R 7.98 3.92 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.91 3.86 4.24 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 1.20 0.00 0.00 12 L 8.10 3.88 0.00 1.73 1.58 0.90 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.06 3.90 0.00 1.95 1.91 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 7.86 3.99 0.00 1.97 1.97 0.00 3.20 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 15 L 7.23 4.46 0.00 1.64 1.56 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.88 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 17 M 7.86 3.94 0.00 1.38 2.01 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.24 0.00 18 D 7.99 4.38 0.00 2.68 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 19 G 9.37 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 20 Y 8.26 4.24 0.00 3.38 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 21 R 8.96 3.46 0.00 1.74 1.76 0.00 3.14 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.54 0.00 22 G 8.23 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 0.00 0.00 0.00 23 I 7.64 4.07 1.77 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.72 -0.24 0.00 0.00 24 S 8.30 4.63 0.00 4.11 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 25 L 8.58 4.24 0.00 2.01 1.81 1.00 1.69 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 26 A 8.11 4.14 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.11 4.42 0.00 2.74 2.75 0.00 0.00 7.08 8.68 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 28 W 7.96 4.32 0.00 3.44 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 29 M 8.58 4.14 0.00 2.16 2.36 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.93 0.00 30 C 8.10 3.32 0.00 2.48 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 31 L 8.22 3.97 0.00 1.87 1.91 0.48 -0.29 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 32 A 8.40 4.16 1.47 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 0.00 0.00 0.00 33 K 8.33 2.78 0.00 1.65 1.54 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.24 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.58 1.42 7.81 34 W 7.72 4.31 0.00 3.32 3.23 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 35 E 8.43 4.31 0.00 2.03 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 0.00 2.58 2.53 0.00 36 S 7.83 4.52 0.00 4.06 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 37 G 8.43 3.47 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 0.00 0.00 0.00 0.00 38 Y 7.12 3.65 0.00 3.28 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 39 N 7.90 5.31 0.00 2.84 2.84 0.00 0.00 7.03 6.59 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 40 T 8.95 4.09 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 1.44 0.00 0.00 41 R 8.03 4.40 0.00 1.99 2.10 0.00 3.08 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.58 0.00 42 A 7.90 4.27 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 43 T 8.46 5.02 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 1.25 0.00 0.00 44 N 8.71 4.90 0.00 2.84 2.74 0.00 0.00 6.93 7.08 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 45 Y 8.75 4.65 0.00 3.08 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 46 N 8.48 4.62 0.00 2.62 2.59 0.00 0.00 7.02 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 47 A 8.27 3.66 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 48 G 8.11 3.76 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 0.00 0.00 0.00 49 D 7.52 4.72 0.00 2.71 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 50 R 8.12 4.19 0.00 2.05 2.22 0.00 3.15 0.00 0.00 3.21 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.54 0.00 51 S 7.85 4.82 0.00 4.00 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 52 T 8.83 5.13 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 0.68 0.00 0.00 53 D 9.06 5.60 0.00 2.67 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 54 Y 9.13 4.93 0.00 3.04 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 55 G 9.44 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.20 3.78 1.67 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.14 -0.02 0.00 0.00 57 F 8.01 4.73 0.00 3.22 2.85 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 58 Q 7.91 3.65 0.00 2.56 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 7.23 0.00 0.00 0.00 0.00 0.00 2.53 2.72 0.00 59 I 8.23 4.46 2.14 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 1.41 1.10 1.11 0.00 0.00 60 N 9.14 5.48 0.00 3.07 2.99 0.00 0.00 7.02 7.73 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 61 S 9.00 4.62 0.00 4.04 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 0.00 62 R 8.85 3.74 0.00 1.62 1.48 0.00 2.72 0.00 0.00 2.85 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 63 Y 7.68 4.08 0.00 1.81 1.47 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 0.00 64 W 8.00 4.97 0.00 3.53 3.24 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 65 C 8.09 5.63 0.00 3.04 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 66 N 8.96 5.03 0.00 2.85 2.70 0.00 0.00 7.10 8.80 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 67 D 8.95 4.78 0.00 2.83 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.48 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 0.00 0.00 0.00 69 K 8.06 4.45 0.00 1.91 1.90 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.63 1.52 7.81 70 T 7.69 4.50 4.24 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 1.18 0.00 0.00 71 P 0.00 4.24 0.00 2.16 2.05 0.00 3.85 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 72 G 8.85 3.79 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 0.00 73 A 7.35 4.28 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 74 V 8.15 4.38 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 0.59 0.00 0.00 0.90 0.00 0.00 75 N 8.06 5.02 0.00 2.77 2.63 0.00 0.00 6.97 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 76 A 8.81 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 77 C 8.54 4.41 0.00 3.33 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 78 H 8.07 4.08 0.00 3.33 3.39 0.00 5.50 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.20 4.87 0.00 1.70 1.53 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.37 4.55 0.00 3.83 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 81 C 8.77 3.99 0.00 2.18 1.25 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 82 S 7.92 3.93 0.00 3.89 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 83 A 7.97 4.15 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 84 L 7.78 4.54 0.00 1.95 1.82 1.04 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.79 4.97 0.00 1.78 1.70 1.14 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.95 4.33 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.60 7.30 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 87 D 8.62 4.42 0.00 2.62 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 88 N 8.07 4.54 0.00 2.69 2.75 0.00 0.00 6.93 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 89 I 8.42 4.29 1.77 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.01 0.98 0.00 0.00 90 A 8.53 3.93 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 91 D 8.10 4.26 0.00 2.71 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 92 A 7.98 4.07 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 93 V 8.27 3.37 2.17 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 0.75 0.00 0.00 0.89 0.00 0.00 94 A 8.10 3.81 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 95 C 8.42 4.18 0.00 3.10 3.26 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 96 A 8.31 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.75 3.80 0.00 1.55 1.30 0.00 1.26 0.00 0.00 0.70 0.00 0.00 2.34 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 0.95 7.81 98 R 7.85 4.05 0.00 1.96 2.10 0.00 3.28 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.96 0.00 99 V 7.46 2.32 1.75 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 -0.31 0.00 0.00 -0.63 0.00 0.00 100 V 7.28 3.96 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 1.01 0.00 0.00 1.45 0.00 0.00 101 R 7.70 4.21 0.00 2.07 2.04 0.00 3.24 0.00 0.00 3.39 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.11 0.00 102 D 7.46 4.75 0.00 3.13 2.63 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 0.00 0.00 0.00 103 P 0.00 4.24 0.00 2.01 2.12 0.00 3.68 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 2.02 2.12 0.00 104 Q 8.20 4.04 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.93 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.84 3.58 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 0.00 0.00 0.00 106 I 7.71 3.82 1.03 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.85 -0.79 0.00 0.00 107 R 7.33 4.23 0.00 2.05 2.05 0.00 3.23 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.56 0.00 108 A 7.70 3.93 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 0.00 109 W 8.23 4.74 0.00 3.53 3.24 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 0.00 110 V 8.77 3.75 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 1.13 0.00 0.00 1.01 0.00 0.00 111 A 8.28 4.02 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.31 3.94 0.00 3.44 3.52 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.13 4.00 0.00 2.03 1.99 0.00 3.40 0.00 0.00 2.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.90 0.00 114 N 8.13 4.35 0.00 2.66 2.69 0.00 0.00 6.91 7.26 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 0.00 115 R 7.65 4.06 0.00 1.14 0.66 0.00 2.21 0.00 0.00 2.48 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.97 0.00 116 C 7.10 4.50 0.00 1.73 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 0.00 117 Q 6.73 3.16 0.00 0.93 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.24 6.22 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 118 N 8.66 4.22 0.00 2.79 2.83 0.00 0.00 6.84 7.59 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 0.00 119 R 7.26 4.49 0.00 1.79 1.80 0.00 3.13 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 120 D 8.46 4.58 0.00 2.64 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 0.00 121 V 8.23 4.63 2.39 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 1.00 0.00 0.00 1.05 0.00 0.00 122 R 8.28 4.09 0.00 2.01 2.02 0.00 3.15 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 123 Q 8.10 3.99 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.61 0.00 0.00 0.00 0.00 0.00 1.93 1.56 0.00 124 Y 7.62 4.15 0.00 3.26 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 0.00 125 V 7.68 4.31 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 0.88 0.00 0.00 1.04 0.00 0.00 126 Q 7.59 4.13 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.54 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 127 G 9.02 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 0.00 128 C 7.92 4.44 0.00 3.00 3.14 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 0.00 129 G 8.21 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 0.00 130 V 7.81 4.02 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 0.72 0.00 0.00 0.96 0.00 0.00