NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8177 8.3544 109.7375 45.4421 0.0000 172.9102 2 S 4.3010 8.5338 120.8567 55.7387 62.6953 171.4660 3 S 4.0815 9.2162 123.4541 61.2605 63.9082 175.9693 4 G 3.6852 7.9052 109.9441 45.8817 0.0000 172.1588 5 S 4.2532 8.4813 119.7595 57.7602 63.4068 173.8137 6 S 4.1090 8.3535 116.8748 59.0363 63.0940 173.8739 7 G 3.9938 8.9138 111.4876 46.5642 0.0000 174.6353 8 A 4.2258 7.7676 123.8221 51.8136 16.8313 176.1413 9 E 4.4889 8.3505 121.1624 57.2168 30.1811 176.6502 10 S 3.6433 8.3093 110.6029 58.6832 60.9707 171.4129 11 L 3.9168 7.8361 119.6952 55.3396 42.6046 176.1897 12 S 4.4537 8.5303 119.4184 59.1243 63.6210 174.2509 13 G 3.8945 8.1756 103.1984 47.2738 0.0000 175.5662 14 L 4.8337 7.5241 115.5484 53.0643 42.3696 179.0623 15 S 4.6542 7.6387 113.3222 55.5905 62.7139 173.6610 16 L 4.0884 7.7387 126.7455 54.9918 42.4782 176.9691 17 K 4.8339 8.3616 120.7018 54.8457 36.2529 175.4373 18 L 3.6551 8.5798 124.8289 55.0651 41.4914 176.7668 19 V 3.7684 8.6940 127.4956 65.2369 31.4546 176.0886 20 K 4.5514 7.7099 120.4740 54.4913 35.8563 174.0840 21 K 4.6402 8.7524 128.6294 55.1891 33.0858 174.9414 22 E 4.9510 8.5947 126.8917 53.6854 33.2894 175.7263 23 P 4.8693 0.0000 0.0000 65.0328 31.7369 177.3473 24 R 4.8648 7.4735 116.2959 54.1086 31.6232 174.8114 25 Q 4.7739 8.0729 116.9341 55.6653 32.9130 172.9552 26 L 4.7328 8.6179 124.3263 53.9385 46.3186 174.0595 27 E 5.1228 8.6107 124.5267 54.5473 32.3511 174.6184 28 L 5.7133 8.3328 123.7630 52.9538 46.6628 175.0990 29 T 4.4917 8.3595 114.8324 60.2036 71.1365 172.3333 30 W 5.2222 7.8621 125.0941 54.7380 30.1318 174.5751 31 A 4.7739 9.4910 126.7404 49.5102 21.7312 175.4671 32 G 5.2035 7.6935 121.7927 47.1085 0.0000 172.3406 33 S 4.8143 7.8694 114.9628 56.2967 65.9551 173.6708 34 R 4.6308 8.0752 117.5265 53.6158 31.1414 174.7574 35 P 4.4476 0.0000 0.0000 63.2321 32.4751 175.1681 36 R 3.7870 8.3301 115.0594 57.5458 28.0311 175.3859 37 N 4.6473 8.1056 113.8862 51.4435 39.9504 172.5605 38 P 4.4923 0.0000 0.0000 61.8069 32.3798 175.5004 39 G 3.7032 8.1722 107.7251 46.0759 0.0000 172.5916 40 G 3.5202 8.5712 103.1457 45.8268 0.0000 173.8876 41 N 4.0249 7.7164 114.4668 52.7548 38.4123 175.3733 42 L 4.0662 8.1406 123.4300 55.0434 42.5491 175.7279 43 S 4.4701 7.6044 113.7944 57.7687 68.0381 172.7652 44 Y 5.2821 8.5982 116.9275 56.9416 42.6885 174.0941 45 E 4.7802 9.3366 125.5917 54.7842 31.5937 174.1130 46 L 5.0503 8.4545 129.5369 53.7777 44.7052 174.6129 47 H 5.1762 9.0209 125.1395 54.7179 32.9865 171.7581 48 V 4.4641 8.4645 126.5409 61.0028 33.7689 174.4358 49 L 4.7387 8.5723 126.5675 52.8647 45.7395 174.9934 50 N 5.1741 8.9137 120.4818 51.5220 42.7338 174.7885 51 Q 4.0653 8.8341 118.8277 58.9716 28.6199 179.5001 52 D 4.9289 7.8191 114.4848 53.5520 42.5571 175.6891 53 E 4.6065 8.1048 118.1264 55.1474 32.8018 174.0358 54 E 4.9400 8.9292 125.1214 53.7811 31.9987 174.7735 55 W 5.5032 8.5984 122.7277 55.1978 31.9484 173.4918 56 H 5.6352 8.9621 116.4648 54.2924 31.6013 173.0842 57 Q 4.5363 9.2976 118.2319 55.5162 31.6064 173.1656 58 M 4.3963 8.8930 125.4507 55.4367 33.0760 175.5516 59 V 4.5855 9.0142 119.4147 59.4549 35.0882 176.0923 60 L 4.4701 8.6162 123.2799 54.3778 41.8536 176.0902 61 E 4.9171 7.9044 116.3862 53.8597 32.7193 173.9582 62 P 3.3934 0.0000 0.0000 63.4273 31.9621 175.4104 63 R 4.6475 6.8983 116.8839 54.6034 32.5006 175.5811 64 V 4.4721 7.9438 118.1288 60.6173 35.2258 172.3637 65 L 4.7739 8.6770 126.4766 53.4332 43.9000 174.9929 66 L 4.8248 8.5430 127.3464 53.4966 43.7649 176.1093 67 T 4.6572 7.9166 112.4160 59.3355 72.5386 172.8965 68 K 3.7357 8.3464 117.1398 57.6642 29.2730 175.7451 69 L 4.5667 7.5008 116.9200 53.3444 43.9409 175.7776 70 Q 4.6421 8.8839 119.9222 53.7882 30.0488 174.6106 71 P 4.4882 0.0000 0.0000 63.3471 32.5246 175.5397 72 D 4.4128 8.7669 118.2425 55.7266 39.5030 173.5449 73 T 4.6372 8.3117 115.3323 62.1602 73.5426 175.1491 74 T 4.7059 8.4289 122.7500 63.3936 69.1775 173.6044 75 Y 4.6557 8.8441 125.1587 56.1713 40.5633 175.2075 76 I 4.5850 8.5044 125.9916 60.0374 38.4659 175.3253 77 V 4.9906 8.3465 125.4489 61.2253 35.5897 174.4608 78 R 5.2962 8.7983 122.4906 55.2878 32.4413 174.0426 79 V 4.8892 8.1810 123.5225 59.5263 34.5916 174.6854 80 R 4.6683 8.3585 118.5471 54.5863 32.9160 174.4110 81 T 4.6333 8.5527 119.5749 63.7382 69.6658 173.5249 82 L 4.5616 8.1728 126.5057 54.3458 42.8314 176.5570 83 T 4.7038 8.1111 111.3019 59.1371 71.9934 173.1452 84 P 4.2004 0.0000 0.0000 64.9767 31.5889 176.1345 85 L 4.4255 7.5473 118.3620 53.0584 42.2387 172.6744 86 G 3.6332 8.5217 113.5531 44.4183 0.0000 168.6510 87 P 4.6143 0.0000 0.0000 61.8066 32.2961 176.9722 88 G 3.9432 8.1456 110.3078 45.8587 0.0000 171.1696 89 P 4.6100 0.0000 0.0000 62.2837 32.7929 175.6186 90 F 4.5143 8.6441 119.3897 56.3815 39.4593 176.0057 91 S 4.3346 8.2384 119.5955 57.2590 64.2131 172.3051 92 P 4.6828 0.0000 0.0000 62.2427 32.0286 175.0002 93 D 4.1302 8.7344 122.6012 53.9561 38.7443 176.4148 94 H 4.1553 8.3346 121.9637 53.9515 29.5282 174.7301 95 E 4.0209 8.3201 125.5802 56.3685 29.9027 175.7580 96 F 5.3683 8.4092 126.3066 55.6252 42.8190 174.4471 97 R 5.1575 8.7355 121.9439 54.6555 32.4105 175.3517 98 T 4.4225 8.4703 116.1774 61.0374 70.4484 174.2465 99 S 4.4395 8.6579 117.6050 57.5533 63.4905 172.0137 100 P 4.5967 0.0000 0.0000 61.7515 31.8196 174.2904 101 P 4.4137 0.0000 0.0000 61.8141 32.1399 175.1528 102 S 3.9395 8.4440 112.5844 58.6754 61.7418 173.3472 103 G 4.1919 8.1845 115.3256 43.1370 0.0000 169.0416 104 P 4.5905 0.0000 0.0000 62.3450 32.2305 175.7660 105 S 4.5592 8.1356 112.3234 56.4762 65.4027 174.1220 106 S 4.1863 8.7618 120.1865 58.3186 63.3587 174.4335 107 G 3.7322 8.5564 110.6775 45.9492 0.0000 173.4148 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 G 8.35 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 2 S 8.53 4.30 0.00 3.92 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 3 S 9.22 4.08 0.00 3.86 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 4 G 7.91 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 5 S 8.48 4.25 0.00 3.98 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 6 S 8.35 4.11 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 7 G 8.91 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 0.00 0.00 0.00 8 A 7.77 4.23 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 9 E 8.35 4.49 0.00 1.96 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 2.22 0.00 10 S 8.31 3.64 0.00 3.90 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 11 L 7.84 3.92 0.00 1.63 1.61 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.53 4.45 0.00 3.92 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 13 G 8.18 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 14 L 7.52 4.83 0.00 1.54 1.42 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 15 S 7.64 4.65 0.00 4.08 3.96 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 16 L 7.74 4.09 0.00 1.48 1.92 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 17 K 8.36 4.83 0.00 1.73 1.95 0.00 1.27 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.47 7.81 18 L 8.58 3.66 0.00 1.43 1.64 0.71 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 19 V 8.69 3.77 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 0.76 0.00 0.00 0.87 0.00 0.00 20 K 7.71 4.55 0.00 1.78 1.53 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.74 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.40 7.81 21 K 8.75 4.64 0.00 1.81 1.72 0.00 1.86 0.00 0.00 1.79 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.53 7.81 22 E 8.59 4.95 0.00 1.94 1.77 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 2.20 2.35 0.00 23 P 0.00 4.87 0.00 2.24 2.33 0.00 3.81 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 2.08 1.96 0.00 24 R 7.47 4.86 0.00 1.65 1.89 0.00 3.30 0.00 0.00 2.25 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.45 0.00 25 Q 8.07 4.77 0.00 2.06 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.76 6.78 0.00 0.00 0.00 0.00 0.00 2.27 2.53 0.00 26 L 8.62 4.73 0.00 1.58 1.48 1.04 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.61 5.12 0.00 2.03 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 2.14 2.42 0.00 28 L 8.33 5.71 0.00 1.77 1.65 1.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.36 4.49 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 1.15 0.00 0.00 30 W 7.86 5.22 0.00 3.21 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 31 A 9.49 4.77 1.15 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 0.00 0.00 32 G 7.69 5.20 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 0.00 0.00 0.00 0.00 33 S 7.87 4.81 0.00 3.89 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 34 R 8.08 4.63 0.00 1.91 1.91 0.00 3.05 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 35 P 0.00 4.45 0.00 2.20 2.15 0.00 3.91 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 36 R 8.33 3.79 0.00 1.96 2.04 0.00 3.23 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 37 N 8.11 4.65 0.00 2.72 2.70 0.00 0.00 7.26 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 38 P 0.00 4.49 0.00 2.21 2.07 0.00 3.83 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 1.98 1.96 0.00 39 G 8.17 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 0.00 0.00 0.00 40 G 8.57 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 0.00 0.00 0.00 41 N 7.72 4.02 0.00 2.68 2.84 0.00 0.00 7.24 7.86 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 42 L 8.14 4.07 0.00 1.49 1.34 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 43 S 7.60 4.47 0.00 3.57 3.63 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 44 Y 8.60 5.28 0.00 3.29 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 45 E 9.34 4.78 0.00 2.10 1.79 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 2.44 2.45 0.00 46 L 8.45 5.05 0.00 1.87 1.84 1.01 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 47 H 9.02 5.18 0.00 3.25 3.04 0.00 5.62 0.00 0.00 0.00 0.00 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.46 4.46 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 0.00 0.00 -0.01 0.00 0.00 0.96 0.00 0.00 49 L 8.57 4.74 0.00 1.38 1.30 0.43 0.10 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 50 N 8.91 5.17 0.00 2.93 2.93 0.00 0.00 7.31 7.07 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 51 Q 8.83 4.07 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.25 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 52 D 7.82 4.93 0.00 2.60 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 53 E 8.10 4.61 0.00 2.24 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 2.33 2.54 0.00 54 E 8.93 4.94 0.00 1.81 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 0.00 2.16 2.18 0.00 55 W 8.60 5.50 0.00 3.39 3.31 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 56 H 8.96 5.64 0.00 3.23 3.24 0.00 5.57 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 57 Q 9.30 4.54 0.00 2.18 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.15 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 58 M 8.89 4.40 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.76 0.00 59 V 9.01 4.59 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 0.83 0.00 0.00 1.40 0.00 0.00 60 L 8.62 4.47 0.00 1.68 1.70 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 61 E 7.90 4.92 0.00 2.03 2.01 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 2.28 2.34 0.00 62 P 0.00 3.39 0.00 1.49 1.73 0.00 3.52 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.78 0.00 63 R 6.90 4.65 0.00 1.54 1.61 0.00 3.01 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.41 0.00 64 V 7.94 4.47 2.40 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 1.03 0.00 0.00 1.10 0.00 0.00 65 L 8.68 4.77 0.00 1.63 1.59 0.90 1.01 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 66 L 8.54 4.82 0.00 1.77 1.61 1.06 0.67 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 67 T 7.92 4.66 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 1.21 0.00 0.00 68 K 8.35 3.74 0.00 1.78 1.81 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.38 7.81 69 L 7.50 4.57 0.00 1.64 1.32 0.82 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 70 Q 8.88 4.64 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.90 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 71 P 0.00 4.49 0.00 2.21 2.09 0.00 3.59 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.94 0.00 72 D 8.77 4.41 0.00 2.81 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 73 T 8.31 4.64 4.33 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 0.74 0.00 0.00 74 T 8.43 4.71 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 1.21 0.00 0.00 75 Y 8.84 4.66 0.00 3.02 2.89 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 76 I 8.50 4.58 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.23 0.83 0.00 0.00 77 V 8.35 4.99 2.34 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 1.07 0.00 0.00 1.12 0.00 0.00 78 R 8.80 5.30 0.00 2.01 1.97 0.00 2.94 0.00 0.00 3.09 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.46 0.00 79 V 8.18 4.89 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 0.00 0.00 -0.62 0.00 0.00 0.31 0.00 0.00 80 R 8.36 4.67 0.00 1.75 1.61 0.00 2.52 0.00 0.00 2.90 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.20 0.00 81 T 8.55 4.63 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 1.28 0.00 0.00 82 L 8.17 4.56 0.00 1.47 1.52 0.86 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.11 4.70 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 1.21 0.00 0.00 84 P 0.00 4.20 0.00 2.18 2.20 0.00 3.68 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 1.97 1.97 0.00 85 L 7.55 4.43 0.00 1.59 1.62 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 86 G 8.52 3.63 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 0.00 0.00 0.00 87 P 0.00 4.61 0.00 1.98 2.00 0.00 3.37 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 1.94 1.78 0.00 88 G 8.15 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 89 P 0.00 4.61 0.00 2.09 2.08 0.00 3.72 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 1.96 1.98 0.00 90 F 8.64 4.51 0.00 2.97 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 91 S 8.24 4.33 0.00 3.97 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 92 P 0.00 4.68 0.00 2.03 2.07 0.00 3.86 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 93 D 8.73 4.13 0.00 2.68 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 94 H 8.33 4.16 0.00 3.24 2.20 0.00 5.81 0.00 0.00 0.00 0.00 6.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.32 4.02 0.00 1.83 1.74 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 2.23 2.27 0.00 96 F 8.41 5.37 0.00 3.40 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 97 R 8.74 5.16 0.00 1.84 1.85 0.00 3.27 0.00 0.00 3.30 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 98 T 8.47 4.42 4.57 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 1.61 0.00 0.00 99 S 8.66 4.44 0.00 4.05 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 0.00 100 P 0.00 4.60 0.00 2.23 2.06 0.00 3.84 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 2.00 1.97 0.00 101 P 0.00 4.41 0.00 2.21 2.14 0.00 3.83 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 2.00 1.97 0.00 102 S 8.44 3.94 0.00 3.85 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 0.00 103 G 8.18 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 0.00 0.00 0.00 0.00 104 P 0.00 4.59 0.00 2.19 2.11 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 105 S 8.14 4.56 0.00 3.94 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 0.00 106 S 8.76 4.19 0.00 4.00 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 0.00 107 G 8.56 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 0.00 0.00 0.00