NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3978 8.1927 115.2918 58.2938 64.7764 175.2954 3 R 3.7059 8.1975 120.1023 59.4401 29.6700 176.9141 4 Q 4.0314 8.8213 118.6661 59.0902 29.1079 178.1004 5 T 3.8951 7.8941 116.4105 66.8042 68.5387 176.3342 6 E 3.9417 8.4296 120.5086 59.2288 29.4096 179.4411 7 I 3.5736 7.7377 120.0414 64.4528 37.1406 178.6728 8 V 3.6314 7.8019 119.0111 65.9933 31.2422 178.2762 9 R 3.9203 8.2950 118.1274 59.0424 29.7951 179.0047 10 R 3.6688 7.7537 118.8512 59.2088 29.8264 178.2222 11 M 4.1232 7.8116 118.0952 58.6737 32.3543 178.2066 12 V 3.8980 8.0489 118.5385 66.3748 31.6347 177.8826 13 S 4.1469 8.4470 112.7185 61.3178 62.1035 175.9220 14 A 4.0146 8.0452 123.5728 55.2835 17.8949 179.6635 15 F 4.2085 7.7909 115.4544 60.6799 39.0213 177.3087 16 N 4.6370 8.1241 115.1863 55.2495 38.5135 176.4920 17 T 4.5108 8.1477 109.1129 60.5692 70.2959 175.6089 18 G 3.7956 8.3692 109.4258 45.4265 0.0000 173.3137 19 R 4.1016 7.5347 119.6040 56.2261 29.6450 175.9491 20 T 4.6977 8.3404 113.6495 60.9915 69.9125 175.2847 21 D 4.4030 8.3048 122.5311 55.7170 39.8093 176.6044 22 D 4.9659 7.9379 118.0820 52.9854 40.0098 178.1890 23 V 2.9995 7.5158 115.9683 64.4780 31.5346 177.9434 24 D 4.3866 7.8464 117.6645 55.2067 39.4234 177.0488 25 E 4.2121 8.1239 119.5276 58.3591 29.8766 176.7253 26 Y 4.7570 7.3829 113.2038 55.8953 39.6084 174.1600 27 I 4.3458 7.0742 122.1487 59.4005 39.0497 175.1377 28 H 4.2766 8.9363 125.9011 55.2147 30.3570 174.2069 29 P 4.1630 0.0000 0.0000 65.3827 31.2024 176.8623 30 D 4.8160 8.0623 114.5425 53.6778 41.5093 175.4619 31 Y 4.8694 7.8468 121.8838 57.8414 39.9447 175.2304 32 L 4.5115 7.7215 126.5713 53.5553 46.2453 173.4095 33 N 5.6523 8.5690 124.6923 50.2867 40.4207 173.3591 34 P 4.2896 0.0000 0.0000 64.9529 31.6761 177.4248 35 A 4.0758 8.1162 121.9463 54.5839 18.6322 178.5548 36 T 4.0441 7.7857 105.8389 63.3656 69.7846 177.0128 37 L 4.0799 7.9019 122.8678 57.7455 41.7014 178.2593 38 E 4.2110 7.9502 113.5132 57.5580 29.8206 176.7268 39 H 4.3939 7.9120 116.4713 55.9971 29.3479 176.0893 40 G 3.8995 7.7632 107.0745 44.9394 0.0000 173.7688 41 I 4.0916 7.4757 120.6782 61.2172 38.6467 174.2971 42 H 4.6583 9.3322 124.0082 55.9928 27.6895 176.9497 43 T 4.8234 8.8241 112.2944 61.3025 72.6541 175.1837 44 G 3.9269 8.8910 110.9038 44.5676 0.0000 172.1230 45 P 4.0521 0.0000 0.0000 65.6850 31.0217 178.6005 46 K 3.9072 8.0463 117.5586 59.3141 32.0687 178.5727 47 A 4.1736 8.0021 120.7014 55.1486 18.4020 179.2111 48 F 3.9268 8.1435 118.9952 61.2167 39.3723 177.0467 49 A 3.7555 8.2547 120.7758 55.3910 18.0726 179.6690 50 Q 3.9640 8.2592 116.5419 58.8549 28.6573 178.7613 51 L 4.0229 8.0224 121.6475 58.0715 42.1630 178.9834 52 V 3.6078 7.4531 118.3954 66.0231 31.2410 178.0621 53 G 3.6925 8.0346 105.2086 47.6974 0.0000 175.3746 54 W 4.0218 8.5037 131.1496 60.0098 30.6335 178.1595 55 V 3.3406 8.5013 118.6086 66.2304 31.0536 178.3207 56 R 4.0917 8.1790 117.4643 59.0355 29.6553 178.8829 57 A 3.9503 7.9881 120.2232 54.8058 18.5865 179.1735 58 T 3.7534 7.1861 113.9064 64.7813 68.7673 176.4059 59 F 5.6583 8.3068 116.5973 56.1434 40.0052 176.3492 60 S 4.7569 8.1051 111.9046 58.3496 63.0901 169.7473 61 E 4.1200 8.4586 119.1331 58.4020 29.3371 177.5985 62 E 4.3616 7.6599 116.1166 55.9531 29.8333 176.2208 63 A 4.4135 7.8211 121.8690 52.4215 19.3679 177.4931 64 R 4.7238 9.1941 121.1185 54.4791 33.6913 173.5524 65 L 5.1353 9.8597 129.3776 53.7058 43.3558 175.1635 66 E 4.7178 9.3271 126.9840 54.8316 32.1113 174.8889 67 E 4.5003 8.6571 124.2103 55.8912 30.1166 175.7454 68 V 4.1211 8.9614 128.5021 64.6400 32.1415 175.9722 69 R 4.6947 7.5833 113.9744 55.4198 32.3094 172.9682 70 I 5.1746 8.4908 120.8047 59.7859 40.2665 174.6676 71 E 5.0640 9.5443 126.4412 54.5916 32.8716 174.8044 72 E 5.2693 8.6046 118.4871 55.1550 33.5894 175.3318 73 R 4.4142 9.3562 121.5704 56.1125 33.2479 174.5897 74 G 3.7402 8.5077 116.9179 46.7217 0.0000 172.0545 75 P 4.4767 0.0000 0.0000 62.5580 31.8412 175.1152 76 W 5.2983 8.2062 120.3142 55.6661 31.2137 175.3771 77 V 4.9494 9.2047 123.5559 60.9671 34.6083 173.9006 78 K 5.0753 9.4733 128.6780 54.6095 34.8136 174.1919 79 A 5.1418 9.2117 129.8597 50.4775 21.5690 174.6287 80 Y 4.7407 9.2508 121.8782 56.9285 39.4014 175.0289 81 L 5.4010 9.1181 124.1583 52.7488 46.7440 175.7153 82 V 4.6850 8.7266 119.0787 61.2433 34.7398 173.7545 83 L 4.8968 8.7912 130.5038 54.1717 43.8422 174.4959 84 Y 4.5755 9.1072 124.2580 56.3022 40.7429 175.2750 85 G 3.8133 7.6033 110.6946 45.3895 0.0000 170.8362 86 R 5.2033 8.8858 119.1391 55.0544 33.8386 174.7278 87 H 5.1637 9.9433 127.3257 56.1566 29.0150 175.2008 88 V 4.3425 8.8967 116.0672 60.5052 33.0893 175.6319 89 G 4.1610 7.7162 106.7092 43.5136 0.0000 173.0161 90 R 4.2642 8.6281 121.1660 56.4455 30.7580 175.8408 91 L 4.6803 8.8361 125.6489 54.5228 44.7331 176.8517 92 V 3.3999 9.8611 121.6145 62.5781 29.2795 174.5949 93 G 4.1219 8.3969 106.5110 44.5198 0.0000 172.5630 94 M 4.7807 8.3137 121.1389 52.8520 32.8820 174.3564 95 P 4.6856 0.0000 0.0000 61.5766 32.2027 174.5447 96 P 3.7963 0.0000 0.0000 63.0011 31.3340 177.0944 97 T 4.0129 8.4002 113.1472 62.2746 69.4092 175.3464 98 D 4.5782 8.2132 120.0606 54.9234 40.5244 172.9534 99 R 4.4993 7.3707 117.1572 55.3077 31.4117 176.4677 100 R 4.8512 8.6668 122.3643 56.5513 31.2235 175.5064 101 F 5.1675 8.6246 115.6796 56.2229 41.7971 172.7995 102 S 4.6052 9.2888 113.8346 56.8766 65.5373 173.3427 103 G 4.2160 8.7396 111.7987 44.7514 0.0000 172.5041 104 E 4.7051 8.7666 122.8279 56.8381 30.9915 175.9333 105 Q 4.7291 9.2367 120.1929 54.4623 34.0895 173.8897 106 V 4.7975 8.5852 121.4591 61.4837 34.6011 173.9460 107 H 5.2842 9.2259 124.6304 53.8354 32.1588 172.7003 108 L 5.3340 8.7990 124.0345 53.6559 44.9140 175.0404 109 M 5.4266 9.4744 125.3631 53.6359 36.5054 174.1060 110 R 4.2889 8.8045 123.2261 54.6047 32.0814 174.7622 111 I 4.6071 8.2608 128.1458 60.0010 38.7202 175.5749 112 V 4.0584 8.5981 126.5995 61.9085 33.7449 174.9375 113 D 4.2049 9.9456 128.6729 55.3655 39.3958 174.0451 114 G 4.0158 8.6925 104.3981 45.2461 0.0000 173.2523 115 K 4.7742 7.8903 118.1686 54.1816 36.2382 175.3750 116 I 4.2806 8.6992 123.1364 61.7509 37.5918 176.0883 117 R 4.3332 9.1986 127.5405 57.2811 32.5105 175.2348 118 D 5.2211 7.8230 118.2326 52.6265 43.9934 175.0239 119 H 5.2505 8.7102 122.2189 54.7529 33.3677 171.8100 120 R 4.7172 9.1081 126.4390 54.2515 33.0752 173.8403 121 D 4.7705 7.9814 123.3073 51.2832 42.9305 175.5137 122 W 4.8482 8.9140 120.6709 54.0554 30.8084 173.2923 123 P 4.3240 0.0000 0.0000 61.8299 32.0586 177.2170 124 D 4.5579 7.9279 121.5993 53.0362 38.2209 176.7210 125 F 4.1635 7.8197 122.9133 60.3218 39.4611 176.8748 126 Q 4.0993 8.2576 117.2924 58.9673 28.6103 178.9502 127 G 3.5652 8.5753 106.8154 47.8372 0.0000 175.8964 128 T 3.7391 7.9533 118.0255 66.4693 68.3885 176.5692 129 L 3.9141 8.0764 120.9983 57.8121 41.5686 179.6993 130 R 4.2031 7.9994 119.3001 58.9834 29.8791 179.2397 131 Q 4.0839 8.0135 115.8064 58.2643 28.7279 177.7079 132 L 4.4821 7.6563 118.1762 54.2131 41.7959 176.9148 133 G 3.7403 8.0856 107.0568 46.4774 0.0000 174.0031 134 D 4.2243 8.3099 116.3145 54.3453 38.4570 171.5676 135 P 4.5509 0.0000 0.0000 62.4155 32.7536 176.3087 136 W 4.8665 8.3950 118.1648 53.8526 32.2554 174.0917 137 P 4.6367 0.0000 0.0000 62.7535 31.8497 176.0539 138 D 4.7989 8.4861 119.9799 52.1781 41.2737 176.7111 139 D 4.3627 8.6457 118.0027 57.6231 40.8773 177.9953 140 E 3.9180 8.2137 119.1031 57.1649 30.1880 178.1086 141 G 3.7870 7.9824 107.4694 45.1411 0.0000 173.1697 142 W 4.8496 8.1567 114.2277 56.1326 29.7375 175.7542 143 R 4.2625 7.5972 124.1054 56.5547 29.8518 174.5217 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 S 8.19 4.40 0.00 3.88 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 3 R 8.20 3.71 0.00 1.99 1.93 0.00 3.22 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 4 Q 8.82 4.03 0.00 2.35 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 5 T 7.89 3.90 4.41 0.00 0.00 0.00 0.00 0.00 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 6 E 8.43 3.94 0.00 2.10 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 2.51 2.48 0.00 7 I 7.74 3.57 2.00 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 1.40 0.84 0.93 0.00 0.00 8 V 7.80 3.63 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 1.14 0.00 0.00 0.98 0.00 0.00 9 R 8.29 3.92 0.00 2.00 1.94 0.00 3.48 0.00 0.00 3.09 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.81 0.00 10 R 7.75 3.67 0.00 1.72 1.51 0.00 2.81 0.00 0.00 2.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 1.26 0.00 11 M 7.81 4.12 0.00 2.39 2.05 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 2.52 2.99 0.00 12 V 8.05 3.90 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 1.02 0.00 0.00 1.06 0.00 0.00 13 S 8.45 4.15 0.00 3.98 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 14 A 8.05 4.01 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 15 F 7.79 4.21 0.00 3.27 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 16 N 8.12 4.64 0.00 2.91 2.91 0.00 0.00 6.88 7.84 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 17 T 8.15 4.51 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 1.27 0.00 0.00 18 G 8.37 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 19 R 7.53 4.10 0.00 1.84 1.90 0.00 3.22 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 20 T 8.34 4.70 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 1.11 0.00 0.00 21 D 8.30 4.40 0.00 2.81 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 22 D 7.94 4.97 0.00 2.89 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 23 V 7.52 3.00 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 0.94 0.00 0.00 0.95 0.00 0.00 24 D 7.85 4.39 0.00 2.72 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 25 E 8.12 4.21 0.00 2.23 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 2.35 2.26 0.00 26 Y 7.38 4.76 0.00 3.04 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 27 I 7.07 4.35 1.52 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.06 0.45 0.00 0.00 28 H 8.94 4.28 0.00 3.13 3.23 0.00 5.61 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.16 0.00 2.03 2.09 0.00 3.11 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.04 0.00 30 D 8.06 4.82 0.00 2.72 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 0.00 31 Y 7.85 4.87 0.00 3.27 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 32 L 7.72 4.51 0.00 1.65 1.28 0.86 0.43 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 33 N 8.57 5.65 0.00 2.66 2.63 0.00 0.00 7.44 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 34 P 0.00 4.29 0.00 2.16 2.11 0.00 3.82 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.89 0.00 35 A 8.12 4.08 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 36 T 7.79 4.04 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 1.29 0.00 0.00 37 L 7.90 4.08 0.00 1.69 1.76 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 38 E 7.95 4.21 0.00 1.97 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 2.04 1.95 0.00 39 H 7.91 4.39 0.00 3.11 3.25 0.00 5.81 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 40 G 7.76 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 0.00 0.00 0.00 41 I 7.48 4.09 1.98 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.55 0.98 0.00 0.00 42 H 9.33 4.66 0.00 3.11 2.92 0.00 5.66 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.82 4.82 4.37 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 1.17 0.00 0.00 44 G 8.89 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 45 P 0.00 4.05 0.00 2.09 1.97 0.00 3.58 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 2.04 2.23 0.00 46 K 8.05 3.91 0.00 1.82 1.81 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.52 7.81 47 A 8.00 4.17 1.57 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 0.00 0.00 48 F 8.14 3.93 0.00 2.02 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 49 A 8.25 3.76 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 50 Q 8.26 3.96 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 51 L 8.02 4.02 0.00 1.81 1.77 1.08 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.45 3.61 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 0.80 0.00 0.00 -0.32 0.00 0.00 53 G 8.03 3.69 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 0.00 0.00 0.00 0.00 54 W 8.50 4.02 0.00 3.37 3.40 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 55 V 8.50 3.34 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 1.29 0.00 0.00 1.42 0.00 0.00 56 R 8.18 4.09 0.00 1.93 1.97 0.00 3.39 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 57 A 7.99 3.95 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 58 T 7.19 3.75 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 0.09 0.00 0.00 59 F 8.31 5.66 0.00 3.18 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 60 S 8.11 4.76 0.00 4.18 4.34 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 61 E 8.46 4.12 0.00 1.99 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 2.32 2.33 0.00 62 E 7.66 4.36 0.00 1.98 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 2.29 2.28 0.00 63 A 7.82 4.41 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 64 R 9.19 4.72 0.00 1.84 1.72 0.00 3.10 0.00 0.00 3.04 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.60 0.00 65 L 9.86 5.14 0.00 1.67 1.62 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 66 E 9.33 4.72 0.00 2.09 1.90 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 2.26 2.31 0.00 67 E 8.66 4.50 0.00 2.02 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 2.30 2.36 0.00 68 V 8.96 4.12 2.33 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 0.84 0.00 0.00 1.00 0.00 0.00 69 R 7.58 4.69 0.00 1.90 1.97 0.00 2.92 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.67 0.00 70 I 8.49 5.17 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.75 0.98 0.00 0.00 71 E 9.54 5.06 0.00 1.99 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 2.45 2.54 0.00 72 E 8.60 5.27 0.00 2.09 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 2.21 2.33 0.00 73 R 9.36 4.41 0.00 1.89 1.92 0.00 3.28 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 74 G 8.51 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 0.00 0.00 0.00 75 P 0.00 4.48 0.00 1.81 2.11 0.00 3.89 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.78 0.00 76 W 8.21 5.30 0.00 3.53 3.17 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 77 V 9.20 4.95 2.16 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 1.17 0.00 0.00 0.98 0.00 0.00 78 K 9.47 5.08 0.00 1.92 1.76 0.00 1.87 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.19 1.43 7.81 79 A 9.21 5.14 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 80 Y 9.25 4.74 0.00 3.05 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 81 L 9.12 5.40 0.00 1.54 1.65 0.80 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.73 4.68 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 0.58 0.00 0.00 0.95 0.00 0.00 83 L 8.79 4.90 0.00 1.68 1.37 0.91 0.46 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 84 Y 9.11 4.58 0.00 2.68 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 85 G 7.60 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 86 R 8.89 5.20 0.00 1.88 1.79 0.00 3.13 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 87 H 9.94 5.16 0.00 3.36 3.31 0.00 5.61 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.90 4.34 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 1.01 0.00 0.00 89 G 7.72 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 0.00 0.00 0.00 0.00 90 R 8.63 4.26 0.00 1.82 1.92 0.00 3.24 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 91 L 8.84 4.68 0.00 1.70 1.51 1.17 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 92 V 9.86 3.40 1.80 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 0.56 0.00 0.00 0.93 0.00 0.00 93 G 8.40 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 0.00 0.00 0.00 94 M 8.31 4.78 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.63 0.00 95 P 0.00 4.69 0.00 2.08 2.02 0.00 3.78 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 2.08 2.31 0.00 96 P 0.00 3.80 0.00 1.96 1.95 0.00 3.66 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 97 T 8.40 4.01 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 1.37 0.00 0.00 98 D 8.21 4.58 0.00 2.81 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 99 R 7.37 4.50 0.00 2.03 1.92 0.00 3.30 0.00 0.00 3.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 100 R 8.67 4.85 0.00 1.74 1.88 0.00 3.55 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 101 F 8.62 5.17 0.00 3.14 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 0.00 102 S 9.29 4.61 0.00 3.04 3.46 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 0.00 103 G 8.74 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 0.00 0.00 0.00 0.00 104 E 8.77 4.71 0.00 1.93 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 2.41 2.32 0.00 105 Q 9.24 4.73 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.19 2.26 0.00 106 V 8.59 4.80 2.28 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 0.80 0.00 0.00 0.81 0.00 0.00 107 H 9.23 5.28 0.00 3.09 3.20 0.00 5.63 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.80 5.33 0.00 1.81 1.29 1.07 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 109 M 9.47 5.43 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.42 0.00 110 R 8.80 4.29 0.00 0.67 1.29 0.00 2.47 0.00 0.00 2.79 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.50 0.00 111 I 8.26 4.61 1.78 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 1.19 0.94 0.94 0.00 0.00 112 V 8.60 4.06 1.86 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 0.88 0.00 0.00 0.73 0.00 0.00 113 D 9.95 4.20 0.00 2.78 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 0.00 114 G 8.69 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 0.00 115 K 7.89 4.77 0.00 1.82 1.62 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.37 7.81 116 I 8.70 4.28 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.65 1.02 0.00 0.00 117 R 9.20 4.33 0.00 1.64 1.70 0.00 2.91 0.00 0.00 2.86 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.43 0.00 118 D 7.82 5.22 0.00 2.61 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 0.00 119 H 8.71 5.25 0.00 3.21 2.91 0.00 5.54 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 9.11 4.72 0.00 1.60 1.08 0.00 2.86 0.00 0.00 3.37 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 1.24 0.00 121 D 7.98 4.77 0.00 2.15 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 0.00 0.00 0.00 122 W 8.91 4.85 0.00 3.38 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 0.00 123 P 0.00 4.32 0.00 0.69 1.57 0.00 2.99 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.88 0.00 124 D 7.93 4.56 0.00 2.87 2.49 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 0.00 125 F 7.82 4.16 0.00 3.12 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 0.00 126 Q 8.26 4.10 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 127 G 8.58 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 0.00 0.00 0.00 128 T 7.95 3.74 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 129 L 8.08 3.91 0.00 1.77 1.64 0.85 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.00 4.20 0.00 2.00 1.98 0.00 3.13 0.00 0.00 3.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 131 Q 8.01 4.08 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.06 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 132 L 7.66 4.48 0.00 1.72 1.71 0.67 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.09 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 0.00 0.00 0.00 134 D 8.31 4.22 0.00 2.84 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 0.00 135 P 0.00 4.55 0.00 2.24 2.13 0.00 3.63 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 136 W 8.40 4.87 0.00 3.27 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 0.00 137 P 0.00 4.64 0.00 2.25 2.27 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 2.16 2.39 0.00 138 D 8.49 4.80 0.00 2.97 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 0.00 139 D 8.65 4.36 0.00 2.68 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 0.00 140 E 8.21 3.92 0.00 1.92 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 0.00 2.35 2.27 0.00 141 G 7.98 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 0.00 142 W 8.16 4.85 0.00 3.33 3.27 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 0.00 143 R 7.60 4.26 0.00 1.92 1.68 0.00 3.31 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00