NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9437 8.3393 109.7341 45.6168 0.0000 173.8643 2 S 4.2603 7.7762 112.4689 59.3864 64.5869 174.1670 3 S 4.2668 7.8550 114.0389 59.3622 66.2598 174.5781 4 G 3.7822 8.1458 110.4430 45.7603 0.0000 171.0557 5 S 4.2767 7.8377 117.5747 56.3468 66.1728 174.0695 6 S 3.5164 8.5270 120.5130 59.0108 62.7370 173.4907 7 G 4.4874 8.2183 112.6218 44.3468 0.0000 171.0120 8 C 5.3133 8.9262 119.8940 57.7832 32.7478 174.6517 9 V 4.0132 7.8994 116.6888 62.0519 32.2703 177.1890 10 E 4.2588 8.1816 120.4671 58.7044 29.6155 176.7413 11 C 4.4383 8.0956 111.0070 57.4536 30.4211 173.7610 12 R 5.0861 7.7689 117.0485 56.2742 27.6752 175.5972 13 K 4.8480 7.2281 115.2351 53.6263 35.4241 174.1687 14 P 4.6018 0.0000 0.0000 63.0898 32.0854 175.4769 15 I 4.4906 7.9054 123.0048 59.6576 39.0163 176.2028 16 G 3.8617 8.0937 114.8187 44.5508 0.0000 173.8750 17 A 4.1105 8.3993 121.6858 54.9791 18.7438 178.7703 18 D 4.4048 8.0735 114.2119 56.8812 41.5669 176.7806 19 S 4.0593 7.9812 113.8707 58.2174 62.5279 173.7173 20 K 4.2388 8.7952 125.3706 56.6600 32.4729 176.1280 21 E 4.9810 8.6784 123.2552 54.5968 32.9221 175.4328 22 V 4.1369 8.3989 118.9348 61.3352 33.7295 173.6604 23 H 5.2460 8.7038 128.7507 54.5545 30.6991 173.8484 24 Y 4.5450 8.1326 125.6231 57.4666 41.9564 174.3124 25 K 3.6808 8.5043 125.0072 57.9597 29.6663 174.4436 26 N 4.1061 7.9463 107.6112 54.5099 36.5553 174.1522 27 R 4.3791 6.9771 115.8966 54.7867 35.1835 174.3896 28 F 5.6734 6.7609 115.5501 57.4165 43.5149 173.7405 29 W 5.2035 8.7761 122.8394 54.8110 32.9592 174.8200 30 H 4.8097 9.0175 120.7029 55.6256 29.0423 176.2319 31 D 4.6624 8.2380 121.7222 56.1048 39.1168 177.4380 32 T 4.4259 7.8899 111.9138 62.5093 68.7957 174.8999 33 C 4.2875 8.7358 118.7241 62.3402 28.9405 173.2735 34 F 4.2439 8.3107 124.6849 59.3323 39.5758 173.8595 35 R 4.5796 7.4328 120.9005 54.9782 32.2448 173.6742 36 C 4.2374 8.8686 120.7040 59.6991 32.5244 173.5858 37 A 4.5482 8.0143 122.6297 51.8526 19.9887 177.4951 38 K 4.2811 8.1048 115.6275 57.6022 33.3108 176.6594 39 C 4.4312 7.8932 109.5666 57.0180 30.9485 172.8965 40 L 4.1489 7.5770 118.5813 55.4304 38.7484 173.7297 41 H 4.6971 7.6495 117.3928 53.2617 31.9960 171.2786 42 P 5.1509 0.0000 0.0000 62.5615 31.0277 176.0565 43 L 4.5671 8.0530 123.5218 54.7794 41.8297 178.9541 44 A 4.0533 7.9024 125.3616 54.6658 18.3209 179.1802 45 N 4.9716 8.1921 109.5065 52.7738 40.4161 173.9082 46 E 4.7251 7.4318 118.6697 53.6809 32.2960 175.3422 47 T 4.0252 8.3548 114.6834 62.3480 69.0264 172.3603 48 F 5.0110 7.4570 115.3761 55.6041 41.5649 173.7848 49 V 4.4805 9.3942 118.6143 61.2353 35.0483 173.5153 50 A 5.3391 8.9279 129.2373 50.2853 20.9928 175.7506 51 K 4.5310 8.6479 121.3972 56.3141 36.0649 176.6043 52 D 4.7550 9.3778 121.3598 56.0920 38.3029 173.0299 53 N 4.3215 8.3993 108.9951 54.0042 36.6771 174.9990 54 K 4.6104 7.7883 114.9171 54.7783 36.3797 175.7615 55 I 4.5831 8.1398 123.9707 60.7715 38.6694 174.8645 56 L 4.9568 9.1834 125.7799 53.5441 46.8748 174.9135 57 C 4.8417 8.3790 115.7446 56.7351 31.6698 174.4132 58 N 4.8203 8.5620 118.6234 55.6473 36.5229 177.3701 59 K 3.9515 7.9523 119.4592 58.9505 32.1635 178.2984 60 C 4.7183 7.9921 117.0630 61.5808 29.1535 175.3903 61 T 3.9882 8.1882 111.8828 64.5564 68.0152 173.8987 62 T 4.1826 6.9575 113.7337 61.6139 68.1425 173.3843 63 R 4.3437 8.1896 122.9275 56.1498 28.9514 175.6715 64 E 4.7541 7.7323 111.3887 56.5634 30.6972 175.8640 65 D 5.0047 7.8011 119.7503 52.4665 40.8733 175.9901 66 S 4.2220 8.2150 118.9305 57.4680 64.1795 172.7818 67 P 4.5326 0.0000 0.0000 62.9948 32.3683 175.3237 68 K 4.9273 8.2535 120.0161 54.6982 36.0078 175.6624 69 C 4.2987 8.3454 123.4659 58.4343 32.5889 173.6437 70 K 2.9602 7.3472 120.8302 55.9289 33.5136 177.3001 71 G 4.1165 7.5765 107.0683 47.4180 0.0000 173.9322 72 C 4.7305 7.5199 111.2689 56.4240 31.7233 173.3861 73 F 4.3469 7.7185 116.8099 58.4436 35.7473 174.6571 74 K 4.8119 7.5120 118.1156 53.9397 36.1738 176.6611 75 A 4.1846 8.7596 124.7025 52.9112 18.5816 177.5062 76 I 4.2172 8.3920 123.4001 61.3049 38.6920 176.1528 77 V 4.3867 8.1495 122.9166 60.6921 34.3161 175.9375 78 A 4.0743 8.8705 129.4851 55.5355 18.4380 179.2260 79 G 3.7981 8.1567 102.9206 48.6290 0.0000 174.0396 80 D 4.4873 7.3005 117.3442 54.3660 41.5295 176.0028 81 Q 4.3746 8.4836 120.5901 55.9059 29.7893 174.9398 82 N 5.3058 8.6887 120.0868 51.5774 43.5608 174.1602 83 V 4.0730 9.0190 120.6369 61.1818 33.8064 173.8065 84 E 4.4475 8.6327 129.4801 55.7182 30.1315 173.3565 85 Y 4.8208 9.1012 125.4492 57.2705 41.7685 175.5037 86 K 4.1271 7.7632 127.3524 54.5459 33.2504 175.5427 87 G 4.3199 8.6639 115.8780 45.6518 0.0000 171.7463 88 T 4.5637 7.4006 115.6930 61.6261 70.8916 174.1212 89 V 4.9723 7.9610 116.8351 59.6357 35.1511 174.4231 90 W 4.8627 9.8356 125.8555 55.0319 31.3935 175.5272 91 H 4.4994 9.0575 120.7047 56.4471 28.8489 175.8817 92 K 3.9694 8.4887 123.1142 60.4130 32.1308 177.7213 93 D 4.5492 8.4110 118.3723 57.5302 41.2276 177.1517 94 C 4.0844 8.4026 115.0380 62.6930 28.3025 174.3777 95 F 4.0907 8.8224 122.6630 57.4759 39.3104 175.9268 96 S 4.5506 7.4796 124.3147 56.1526 62.0171 173.7738 97 G 3.7955 7.9295 117.5779 45.5080 0.0000 170.1577 98 P 4.5072 0.0000 0.0000 63.1114 31.4115 178.0667 99 S 4.0827 7.3385 115.1531 61.8341 62.7146 174.4363 100 S 4.5215 7.4472 114.0258 57.9415 67.0742 175.4398 101 G 3.7149 8.5712 109.9249 45.8074 0.0000 173.5141 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 8.34 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 2 S 7.78 4.26 0.00 4.06 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 3 S 7.86 4.27 0.00 3.79 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 4 G 8.15 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 0.00 0.00 0.00 5 S 7.84 4.28 0.00 3.72 3.66 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 6 S 8.53 3.52 0.00 3.30 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 7 G 8.22 4.49 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 0.00 8 C 8.93 5.31 0.00 2.78 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 9 V 7.90 4.01 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 0.44 0.00 0.00 0.58 0.00 0.00 10 E 8.18 4.26 0.00 2.29 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 0.00 2.46 2.42 0.00 11 C 8.10 4.44 0.00 3.18 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 12 R 7.77 5.09 0.00 1.96 2.03 0.00 3.37 0.00 0.00 3.87 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 13 K 7.23 4.85 0.00 1.71 1.71 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.55 1.51 7.81 14 P 0.00 4.60 0.00 2.04 2.01 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 15 I 7.91 4.49 1.85 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.52 0.88 0.00 0.00 16 G 8.09 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 0.00 0.00 0.00 17 A 8.40 4.11 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 18 D 8.07 4.40 0.00 2.65 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 19 S 7.98 4.06 0.00 4.06 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 20 K 8.80 4.24 0.00 1.82 1.86 0.00 1.73 0.00 0.00 1.89 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.52 7.81 21 E 8.68 4.98 0.00 2.01 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 2.22 2.38 0.00 22 V 8.40 4.14 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.66 0.00 0.00 23 H 8.70 5.25 0.00 3.47 3.26 0.00 5.63 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 8.13 4.54 0.00 2.85 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 25 K 8.50 3.68 0.00 1.96 1.77 0.00 1.85 0.00 0.00 1.55 0.00 0.00 2.17 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.53 1.41 7.81 26 N 7.95 4.11 0.00 2.77 2.86 0.00 0.00 6.96 7.64 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 27 R 6.98 4.38 0.00 1.29 0.66 0.00 3.58 0.00 0.00 3.04 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.84 0.00 28 F 6.76 5.67 0.00 2.98 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 29 W 8.78 5.20 0.00 3.40 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 30 H 9.02 4.81 0.00 3.22 3.28 0.00 5.66 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.24 4.66 0.00 3.02 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 32 T 7.89 4.43 4.27 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 1.26 0.00 0.00 33 C 8.74 4.29 0.00 3.46 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 34 F 8.31 4.24 0.00 3.19 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 35 R 7.43 4.58 0.00 1.79 1.73 0.00 3.05 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.46 0.00 36 C 8.87 4.24 0.00 2.87 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 37 A 8.01 4.55 1.30 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 0.00 0.00 38 K 8.10 4.28 0.00 1.67 1.77 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.37 7.81 39 C 7.89 4.43 0.00 3.09 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 40 L 7.58 4.15 0.00 1.77 1.73 0.93 1.08 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 41 H 7.65 4.70 0.00 3.16 3.06 0.00 5.87 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 5.15 0.00 2.25 2.16 0.00 3.41 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.84 0.00 43 L 8.05 4.57 0.00 1.36 2.05 1.00 0.44 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 44 A 7.90 4.05 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 45 N 8.19 4.97 0.00 2.73 2.87 0.00 0.00 6.63 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 46 E 7.43 4.73 0.00 1.72 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 2.18 2.18 0.00 47 T 8.35 4.03 4.09 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 1.14 0.00 0.00 48 F 7.46 5.01 0.00 2.80 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 49 V 9.39 4.48 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 0.91 0.00 0.00 0.86 0.00 0.00 50 A 8.93 5.34 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.65 4.53 0.00 1.83 1.66 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.44 7.81 52 D 9.38 4.75 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 53 N 8.40 4.32 0.00 2.88 2.93 0.00 0.00 6.97 7.64 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 54 K 7.79 4.61 0.00 1.97 1.61 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.65 7.81 55 I 8.14 4.58 1.57 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.51 0.49 0.00 0.00 56 L 9.18 4.96 0.00 1.46 1.44 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 57 C 8.38 4.84 0.00 2.92 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 58 N 8.56 4.82 0.00 2.97 3.07 0.00 0.00 6.69 6.88 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 59 K 7.95 3.95 0.00 1.68 1.87 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.48 7.81 60 C 7.99 4.72 0.00 3.03 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 61 T 8.19 3.99 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 62 T 6.96 4.18 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 1.31 0.00 0.00 63 R 8.19 4.34 0.00 1.80 1.85 0.00 3.38 0.00 0.00 3.26 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.54 0.00 64 E 7.73 4.75 0.00 2.17 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 2.39 2.46 0.00 65 D 7.80 5.00 0.00 2.63 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 66 S 8.21 4.22 0.00 3.84 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 67 P 0.00 4.53 0.00 2.07 2.14 0.00 3.62 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.98 0.00 68 K 8.25 4.93 0.00 1.60 1.74 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.33 1.52 7.81 69 C 8.35 4.30 0.00 2.71 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 70 K 7.35 2.96 0.00 0.79 0.74 0.00 1.57 0.00 0.00 1.14 0.00 0.00 3.17 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.73 0.86 7.81 71 G 7.58 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 72 C 7.52 4.73 0.00 3.12 3.08 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 0.00 0.00 0.00 0.00 73 F 7.72 4.35 0.00 3.25 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 74 K 7.51 4.81 0.00 1.78 1.72 0.00 1.75 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.66 7.81 75 A 8.76 4.18 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 0.00 0.00 76 I 8.39 4.22 1.95 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.72 0.96 0.00 0.00 77 V 8.15 4.39 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 1.13 0.00 0.00 0.94 0.00 0.00 78 A 8.87 4.07 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 79 G 8.16 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 80 D 7.30 4.49 0.00 2.98 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 81 Q 8.48 4.37 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.45 2.34 0.00 82 N 8.69 5.31 0.00 2.53 2.66 0.00 0.00 6.84 8.05 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 83 V 9.02 4.07 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 -0.87 0.00 0.00 0.87 0.00 0.00 84 E 8.63 4.45 0.00 2.01 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 2.27 2.31 0.00 85 Y 9.10 4.82 0.00 3.10 3.08 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 0.00 0.00 0.00 0.00 86 K 7.76 4.13 0.00 1.54 1.58 0.00 1.57 0.00 0.00 1.41 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.96 0.21 7.81 87 G 8.66 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 0.00 0.00 0.00 88 T 7.40 4.56 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 0.75 0.00 0.00 89 V 7.96 4.97 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 0.92 0.00 0.00 0.87 0.00 0.00 90 W 9.84 4.86 0.00 3.55 3.29 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 91 H 9.06 4.50 0.00 3.20 3.30 0.00 5.68 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 92 K 8.49 3.97 0.00 1.76 1.93 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.57 7.81 93 D 8.41 4.55 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 94 C 8.40 4.08 0.00 3.45 3.37 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 95 F 8.82 4.09 0.00 3.26 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 96 S 7.48 4.55 0.00 3.84 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 97 G 7.93 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 98 P 0.00 4.51 0.00 2.20 2.24 0.00 3.74 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 2.06 1.91 0.00 99 S 7.34 4.08 0.00 3.96 4.10 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 0.00 0.00 0.00 0.00 100 S 7.45 4.52 0.00 3.79 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 0.00 101 G 8.57 3.71 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 0.00 0.00 0.00