NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3635 8.1633 120.3294 54.5660 32.5955 173.8850 2 E 3.8474 8.1340 120.6830 57.4339 29.0649 175.4647 3 T 3.4057 9.3116 123.2337 62.2629 67.6011 172.5811 4 I 2.9867 6.5770 114.9675 62.4424 34.7819 173.9005 5 A 4.5360 9.0896 130.3179 50.3072 19.9430 174.7612 6 K 4.7680 8.4074 120.5670 55.9455 34.7151 175.9434 7 H 4.5274 8.8328 120.2713 56.5592 31.2835 171.3649 8 R 4.0763 8.6751 125.6183 56.9522 31.6810 175.3126 9 H 4.4661 9.8145 122.3827 56.3523 26.2434 176.3388 10 A 4.0577 9.5505 130.4734 51.3967 18.2860 178.3805 11 R 3.7501 7.6035 115.6275 55.5347 27.8236 175.1176 12 S 4.5961 8.2117 111.8046 57.2144 64.4058 177.4955 13 S 3.6014 8.3191 114.5230 58.0747 63.2072 170.5300 14 A 4.5870 8.3814 118.9092 53.6306 19.6295 178.9174 15 Q 3.9570 8.0467 115.1669 59.2447 28.0978 179.2329 16 K 3.8319 7.5562 120.1550 59.4030 32.3868 179.0945 17 V 3.7432 7.6917 118.0729 65.6094 31.5718 177.5080 18 R 3.8895 8.2722 119.0381 59.7155 29.6128 178.3917 19 L 4.5490 7.5415 116.0536 56.9515 41.7403 178.7623 20 V 3.8260 7.8413 116.6230 62.8280 31.8905 176.6711 21 A 4.4059 7.6205 122.5848 53.2848 19.6615 177.1296 22 D 4.2229 7.6363 114.5625 58.8283 41.2933 177.9786 23 L 4.4386 7.7203 118.2327 55.8981 41.8198 177.2439 24 I 4.8502 7.8775 117.4132 60.8090 39.3354 176.6932 25 R 4.6067 7.7627 121.9022 55.3856 28.1731 179.1870 26 G 4.3518 8.7622 103.2318 44.9868 0.0000 174.5767 27 K 3.6237 8.9684 119.3053 57.6064 33.3600 176.3606 28 K 3.7285 9.4934 124.0233 57.6979 30.0614 176.3311 29 V 3.7403 9.1794 132.4321 65.1737 31.6795 173.0466 30 S 4.2013 7.7503 114.7869 61.4426 62.0339 176.7202 31 Q 4.0395 7.9104 120.0926 58.8249 28.6167 177.8116 32 A 4.1329 8.1764 121.3890 55.6700 18.2943 179.4770 33 L 3.8314 7.9763 116.8737 57.9444 41.4532 179.7935 34 D 4.3750 7.6736 117.6156 57.3917 40.7536 178.4036 35 I 3.7698 8.7976 119.1867 64.6712 37.5331 178.1375 36 L 4.1194 8.6122 119.6529 58.1589 41.3833 179.5006 37 T 3.8386 7.6743 110.8322 64.1049 67.2535 173.7807 38 Y 4.4544 7.4863 115.7655 58.0735 39.1942 175.7947 39 T 4.2929 7.5486 115.0396 60.2290 66.3424 173.3164 40 N 4.4591 8.6179 126.5943 51.4215 39.2330 174.8034 41 K 4.9486 8.7174 132.4708 56.2855 33.6843 175.3462 42 K 3.6861 8.6386 126.0159 58.7421 32.5033 176.8480 43 A 4.0299 8.3241 121.0901 55.6761 18.1309 179.5868 44 A 4.2716 8.2725 114.6978 52.8882 18.0074 177.1802 45 V 3.8573 8.3754 113.8603 63.7627 32.2644 176.3259 46 L 3.4777 8.5566 121.2718 55.5111 40.0554 176.3536 47 V 3.6466 7.7071 118.8521 65.6641 31.5919 178.1736 48 K 3.9976 7.4539 119.1948 58.9562 31.9389 179.1041 49 K 4.3079 7.7434 119.9390 59.0815 31.4755 179.5379 50 V 3.6412 8.0331 113.0257 64.2854 31.4046 178.4528 51 L 4.4837 8.0444 120.1906 58.0894 41.7742 178.8168 52 E 3.9783 7.8799 118.6073 59.4225 29.3599 179.6395 53 S 4.1127 8.1358 114.8524 61.5360 62.8915 176.5236 54 A 4.2306 9.2206 121.8474 54.4186 18.1155 178.4598 55 I 4.0912 7.6942 116.3403 62.5277 38.8270 177.5501 56 A 4.0791 8.0121 121.8767 55.0845 18.2227 179.1574 57 N 4.2246 8.7556 115.0514 56.5144 38.5731 177.2682 58 A 4.1536 7.7030 119.3876 54.0703 18.5634 177.6823 59 E 4.3084 7.5935 115.6935 57.9356 30.4839 176.8975 60 H 4.1310 8.7525 118.7308 58.5693 30.5198 177.1010 61 N 4.9601 7.6731 116.2973 51.7946 37.4816 173.2591 62 D 4.5522 7.3548 116.5451 55.0418 47.0402 178.3235 63 G 4.0237 8.5191 116.4910 44.2015 0.0000 175.6058 64 A 4.0022 9.0809 128.2168 51.5006 18.9231 177.7982 65 D 4.7564 8.5239 121.0927 54.1480 41.6147 177.4281 66 I 4.1862 8.3785 123.3635 63.6479 38.9966 177.1919 67 D 4.2827 8.0483 118.3353 56.4014 41.0480 175.6583 68 D 4.7277 7.1529 118.6591 53.8512 43.1478 171.2097 69 L 3.6734 8.5878 126.8999 55.1675 41.8908 174.5060 70 K 4.4573 7.9597 118.6241 54.8070 34.7492 174.9370 71 V 3.8240 7.7375 119.4802 62.9717 28.9896 171.7876 72 T 3.9437 8.0893 117.4856 64.3847 67.3749 173.3761 73 K 4.8774 7.8256 117.5072 55.2567 37.0574 174.6991 74 I 4.3398 7.9210 114.9939 59.6448 40.8253 173.6737 75 F 4.8317 6.9892 116.3404 56.6108 40.9855 173.5278 76 V 5.0018 8.6139 112.1395 59.9529 34.9202 174.8399 77 D 5.1314 8.7652 124.2231 52.3473 43.9405 175.6839 78 E 4.4915 8.7927 120.9857 56.5040 30.4159 176.0809 79 G 4.0520 8.5081 109.8606 43.3221 0.0000 170.0794 80 P 4.4197 0.0000 0.0000 62.9130 30.2588 176.4527 81 S 4.5012 8.0410 117.0599 57.7128 64.6017 173.7745 82 M 4.4147 8.5028 120.9819 55.1494 33.8487 175.1812 83 K 4.8729 8.5681 122.8808 55.4871 34.4238 174.9788 84 R 4.6244 8.4931 126.9208 54.6445 33.2441 174.0187 85 I 4.9972 8.0869 119.0263 59.3348 41.2375 173.8632 86 M 4.3190 8.9331 128.2390 53.2425 34.5148 173.6671 87 P 4.0110 0.0000 0.0000 62.0891 32.1672 177.1306 88 R 4.3916 7.8455 116.0515 56.0606 30.5003 176.0860 89 A 4.0666 8.1879 123.6452 52.6477 18.5323 179.1067 90 K 3.8629 8.5186 119.1820 55.8500 31.0911 176.6000 91 G 3.6839 8.6218 106.3401 48.4377 0.0000 174.0865 92 R 4.1375 6.7569 119.0286 56.6447 31.1490 175.8696 93 A 5.6001 8.0724 119.9849 51.8159 22.1900 175.4354 94 D 5.0323 8.8836 120.5846 52.4268 45.1327 175.2946 95 R 4.7183 8.5328 120.0709 55.6029 31.5794 175.5874 96 I 4.4836 8.6283 123.7150 59.1797 40.7107 173.8834 97 L 4.9194 8.3421 128.8206 53.1654 42.4586 176.5637 98 K 4.0110 9.1625 126.6306 57.6067 32.7697 174.8271 99 R 3.9593 8.4602 123.2218 55.9419 30.0561 174.7220 100 T 4.5021 7.7672 113.3179 62.0947 71.0052 171.4140 101 S 4.8977 8.1246 117.3469 57.9648 66.7290 173.0089 102 H 4.5314 9.2146 118.6286 55.4830 29.9084 175.2110 103 I 3.6533 8.9337 125.9413 60.6290 36.3831 173.0730 104 T 3.4801 9.1686 131.6425 63.4163 68.0394 171.2154 105 V 4.4556 9.1343 126.4006 59.8422 35.4063 174.7617 106 V 4.6227 8.1443 115.7399 59.1774 35.2927 176.6283 107 V 4.3951 7.6796 119.8575 60.4812 32.2708 177.7705 108 S 4.1244 8.3873 111.4605 59.6454 62.6576 173.4397 109 D 4.6370 7.9508 121.5966 53.5419 42.1449 176.1404 110 R 4.1199 8.1327 120.3358 57.1831 30.2221 173.5921 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 M 8.16 4.36 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 2 E 8.13 3.85 0.00 2.08 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 2.42 2.31 0.00 3 T 9.31 3.41 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 1.22 0.00 0.00 4 I 6.58 2.99 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.65 0.92 0.00 0.00 5 A 9.09 4.54 1.26 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 0.00 0.00 6 K 8.41 4.77 0.00 1.73 1.73 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.40 7.81 7 H 8.83 4.53 0.00 3.07 3.33 0.00 6.05 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.68 4.08 0.00 1.88 1.95 0.00 3.20 0.00 0.00 3.13 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.51 0.00 9 H 9.81 4.47 0.00 3.40 3.23 0.00 5.86 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 10 A 9.55 4.06 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 R 7.60 3.75 0.00 1.99 1.99 0.00 3.36 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 12 S 8.21 4.60 0.00 3.81 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 13 S 8.32 3.60 0.00 4.14 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 14 A 8.38 4.59 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 15 Q 8.05 3.96 0.00 2.29 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.87 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 16 K 7.56 3.83 0.00 1.90 1.91 0.00 1.70 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.44 7.81 17 V 7.69 3.74 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 1.11 0.00 0.00 1.01 0.00 0.00 18 R 8.27 3.89 0.00 2.00 1.96 0.00 3.33 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 19 L 7.54 4.55 0.00 1.55 1.73 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.84 3.83 2.08 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 0.70 0.00 0.00 0.93 0.00 0.00 21 A 7.62 4.41 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 22 D 7.64 4.22 0.00 2.72 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 23 L 7.72 4.44 0.00 1.61 1.66 0.93 0.93 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 24 I 7.88 4.85 1.90 0.00 0.00 0.87 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 1.32 0.91 0.00 0.00 25 R 7.76 4.61 0.00 1.89 1.07 0.00 3.13 0.00 0.00 3.24 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.97 0.00 26 G 8.76 4.35 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 0.00 27 K 8.97 3.62 0.00 1.88 1.84 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.15 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.43 7.81 28 K 9.49 3.73 0.00 1.92 1.48 0.00 2.16 0.00 0.00 1.63 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.48 7.81 29 V 9.18 3.74 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 0.95 0.00 0.00 0.93 0.00 0.00 30 S 7.75 4.20 0.00 3.91 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 31 Q 7.91 4.04 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 32 A 8.18 4.13 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 33 L 7.98 3.83 0.00 1.92 1.74 0.90 1.06 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 34 D 7.67 4.37 0.00 2.98 2.84 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 35 I 8.80 3.77 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.71 0.93 0.00 0.00 36 L 8.61 4.12 0.00 1.63 1.69 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.67 3.84 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 0.92 0.00 0.00 38 Y 7.49 4.45 0.00 3.05 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 39 T 7.55 4.29 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 1.33 0.00 0.00 40 N 8.62 4.46 0.00 2.75 2.76 0.00 0.00 7.09 7.61 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 41 K 8.72 4.95 0.00 2.05 2.03 0.00 1.54 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.26 1.15 7.81 42 K 8.64 3.69 0.00 1.72 1.91 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.41 7.81 43 A 8.32 4.03 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.27 4.27 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 45 V 8.38 3.86 2.04 0.00 0.00 0.00 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 0.98 0.00 0.00 46 L 8.56 3.48 0.00 1.64 1.53 0.56 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.71 3.65 2.06 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 0.98 0.00 0.00 0.99 0.00 0.00 48 K 7.45 4.00 0.00 1.83 1.75 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.44 7.81 49 K 7.74 4.31 0.00 1.77 1.79 0.00 1.95 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.67 1.34 7.81 50 V 8.03 3.64 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 0.87 0.00 0.00 0.95 0.00 0.00 51 L 8.04 4.48 0.00 1.95 1.64 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 52 E 7.88 3.98 0.00 2.27 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 0.00 2.31 2.64 0.00 53 S 8.14 4.11 0.00 4.02 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 54 A 9.22 4.23 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 55 I 7.69 4.09 2.09 0.00 0.00 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 1.45 1.27 0.91 0.00 0.00 56 A 8.01 4.08 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.76 4.22 0.00 2.73 2.88 0.00 0.00 6.93 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 58 A 7.70 4.15 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 59 E 7.59 4.31 0.00 2.12 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 2.23 2.29 0.00 60 H 8.75 4.13 0.00 3.14 3.42 0.00 5.77 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 N 7.67 4.96 0.00 2.87 2.94 0.00 0.00 6.97 7.93 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 62 D 7.35 4.55 0.00 2.56 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 63 G 8.52 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 64 A 9.08 4.00 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 65 D 8.52 4.76 0.00 2.62 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 0.00 0.00 0.00 0.00 66 I 8.38 4.19 1.87 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 1.42 1.31 0.91 0.00 0.00 67 D 8.05 4.28 0.00 2.71 2.72 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 0.00 0.00 0.00 68 D 7.15 4.73 0.00 2.55 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 69 L 8.59 3.67 0.00 1.79 1.68 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 70 K 7.96 4.46 0.00 1.89 1.84 0.00 1.94 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.39 7.81 71 V 7.74 3.82 2.22 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 0.88 0.00 0.00 0.91 0.00 0.00 72 T 8.09 3.94 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 1.26 0.00 0.00 73 K 7.83 4.88 0.00 1.80 1.74 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.61 7.81 74 I 7.92 4.34 1.71 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 1.37 0.59 0.80 0.00 0.00 75 F 6.99 4.83 0.00 2.93 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 76 V 8.61 5.00 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 0.87 0.00 0.00 0.99 0.00 0.00 77 D 8.77 5.13 0.00 2.71 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 78 E 8.79 4.49 0.00 1.84 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 0.00 2.31 2.32 0.00 79 G 8.51 4.05 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 0.00 0.00 0.00 80 P 0.00 4.42 0.00 2.01 2.07 0.00 3.65 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 2.06 2.11 0.00 81 S 8.04 4.50 0.00 3.92 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 82 M 8.50 4.41 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.53 0.00 83 K 8.57 4.87 0.00 1.75 1.79 0.00 1.61 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.33 7.81 84 R 8.49 4.62 0.00 1.93 1.84 0.00 3.03 0.00 0.00 3.09 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 85 I 8.09 5.00 1.87 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 1.45 1.33 0.91 0.00 0.00 86 M 8.93 4.32 0.00 2.08 1.86 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 2.49 2.48 0.00 87 P 0.00 4.01 0.00 2.21 1.96 0.00 3.69 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 2.12 2.09 0.00 88 R 7.85 4.39 0.00 1.93 2.02 0.00 3.29 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 89 A 8.19 4.07 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 90 K 8.52 3.86 0.00 1.96 1.85 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.36 7.81 91 G 8.62 3.68 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 0.00 0.00 0.00 92 R 6.76 4.14 0.00 2.12 1.93 0.00 3.19 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 93 A 8.07 5.60 1.17 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 0.00 0.00 94 D 8.88 5.03 0.00 2.58 2.52 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 95 R 8.53 4.72 0.00 1.69 1.85 0.00 3.32 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 96 I 8.63 4.48 1.87 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 1.22 1.47 0.97 0.00 0.00 97 L 8.34 4.92 0.00 1.55 1.57 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 98 K 9.16 4.01 0.00 1.82 1.93 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.46 7.81 99 R 8.46 3.96 0.00 2.00 1.93 0.00 3.45 0.00 0.00 3.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 100 T 7.77 4.50 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 1.17 0.00 0.00 101 S 8.12 4.90 0.00 4.01 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 0.00 102 H 9.21 4.53 0.00 3.14 3.29 0.00 5.62 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.93 3.65 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.77 0.89 0.00 0.00 104 T 9.17 3.48 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 1.16 0.00 0.00 105 V 9.13 4.46 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 0.82 0.00 0.00 0.84 0.00 0.00 106 V 8.14 4.62 2.08 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 0.89 0.00 0.00 0.98 0.00 0.00 107 V 7.68 4.40 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 0.79 0.00 0.00 0.98 0.00 0.00 108 S 8.39 4.12 0.00 3.98 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 0.00 109 D 7.95 4.64 0.00 2.64 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 0.00 110 R 8.13 4.12 0.00 1.74 1.72 0.00 3.37 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.50 0.00