NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2456 8.3149 120.1279 55.8586 34.3420 175.3983 4 I 4.1500 7.6115 120.0439 59.9658 38.2535 173.7373 5 I 4.2752 9.4230 129.9867 60.3984 39.2663 175.6930 6 H 4.9176 8.6615 124.2259 55.8878 30.4810 173.2793 7 L 4.7131 8.1365 117.9359 55.1800 46.0701 174.9850 8 T 4.8115 8.3493 110.8122 62.0130 70.1710 173.6521 9 D 4.4955 8.8922 125.7651 56.5720 40.6177 177.4951 10 D 4.7085 7.4545 119.5431 55.5897 40.8391 177.9165 11 S 4.2371 8.1218 116.8890 61.3181 63.1010 176.3766 12 F 3.9449 8.3325 124.8671 61.4568 38.6171 176.2984 13 D 4.5059 8.3976 117.5855 57.1868 42.0171 177.1376 14 T 4.4885 7.1008 108.6271 59.5378 68.0593 172.8007 15 D 4.4210 7.1421 123.8321 55.1266 47.3800 177.4793 16 V 3.8777 7.6196 116.6612 64.2167 32.7750 176.5469 17 L 4.2007 7.2962 119.2707 57.5930 42.1827 179.5010 18 K 3.7990 8.3096 117.3161 57.2514 31.8325 178.4667 19 A 3.5474 7.7116 124.2751 51.8483 18.1531 178.0433 20 D 4.4621 8.3958 121.6140 54.1245 40.8730 171.5187 21 G 3.7140 8.6168 106.3634 43.8521 0.0000 171.6373 22 A 5.1737 8.4744 119.3951 50.3162 21.5777 176.3100 23 I 4.9055 9.0655 122.1122 59.3613 41.4517 174.2486 24 L 4.9831 8.6262 129.2401 53.6111 43.6848 174.8650 25 V 4.5822 9.0177 128.1907 61.2656 33.7020 173.8216 26 D 5.0505 8.9552 128.1045 52.6982 43.2510 174.9170 27 F 5.4630 9.1339 126.6492 56.3085 40.5113 174.9763 28 W 5.4001 8.9353 120.3974 54.7186 32.4266 173.8576 29 A 3.9108 8.0522 119.2891 50.0695 21.1101 177.2546 30 E 4.0638 8.2868 123.0937 58.4432 29.8231 177.3855 31 W 4.8547 7.0146 114.0100 56.2399 28.7660 175.3042 32 C 4.9639 7.6466 119.1261 57.8857 33.5838 173.8799 33 G 3.6000 8.7532 115.3301 47.5626 0.0000 173.4939 34 P 4.2757 0.0000 0.0000 65.2941 31.1620 178.4076 35 C 4.1318 7.9755 113.7153 62.8923 27.9881 175.8068 36 K 4.0779 8.1461 120.9982 59.0696 31.5193 178.5387 37 M 3.8469 7.7906 116.5928 57.5089 31.8236 177.4538 38 I 3.9990 7.6056 117.2346 61.5506 38.0936 177.2011 39 A 3.8268 7.2084 120.8036 55.2502 18.4750 177.5270 40 P 5.1151 0.0000 0.0000 65.4940 31.5228 178.8772 41 I 3.7221 7.6984 117.9925 64.3986 36.9026 178.3261 42 L 4.0444 7.8099 119.6618 57.2939 41.4117 179.1828 43 D 4.2882 7.8385 119.2196 57.3824 40.7815 178.5389 44 E 4.0687 8.0709 118.3289 59.6751 29.5821 179.4323 45 I 3.8645 7.7688 119.4964 64.3020 36.9290 178.2831 46 A 4.1134 8.1856 120.6248 54.0924 18.1583 178.5082 47 D 4.5231 7.2607 114.4983 56.8311 42.2216 177.8078 48 E 4.1264 8.5035 119.3768 59.8284 29.6009 178.9639 49 Y 4.4091 8.2642 114.5211 57.4417 38.3974 175.3875 50 Q 4.1884 7.3261 121.2723 57.4915 29.5661 176.7497 51 G 4.0390 9.1290 112.7818 45.3330 0.0000 173.7401 52 K 4.5653 7.4377 116.0716 55.2533 34.2163 176.0298 53 L 4.7638 7.0452 116.6360 55.5625 42.2750 173.5114 54 T 4.6505 8.0203 117.9044 61.8354 71.6460 173.5009 55 V 4.5578 8.2879 125.0794 62.1395 33.8479 174.5182 56 A 5.0348 8.5856 127.6842 50.4838 22.3091 175.0021 57 K 4.9081 8.6936 122.6724 54.7986 34.4698 176.1827 58 L 4.7548 9.4062 125.8960 53.1696 45.3156 175.0774 59 N 4.1343 8.9331 126.7118 52.8675 39.0095 175.3686 60 I 3.7647 7.9662 121.3789 63.4456 37.4620 177.3480 61 D 4.5391 8.5657 123.2525 57.0859 41.0656 177.9019 62 Q 4.1785 8.1404 116.4103 57.9056 29.0365 175.8874 63 N 5.4562 8.1676 114.8790 49.5303 38.8488 172.9024 64 P 4.4130 0.0000 0.0000 64.5747 32.3836 179.1454 65 G 3.6545 8.2333 107.9821 48.8639 0.0000 175.1871 66 T 3.7574 8.4970 116.9826 66.2688 69.0416 176.5288 67 A 3.5518 8.0750 123.8547 54.8662 18.2035 177.6932 68 P 4.2079 0.0000 0.0000 65.6482 31.0147 178.8192 69 K 3.7131 7.5367 116.2904 59.1501 31.9541 178.0586 70 Y 4.4642 7.5075 114.2192 57.1884 39.4685 175.0309 71 G 3.6190 7.5737 106.4989 45.7878 0.0000 174.4154 72 I 3.8253 7.3575 117.8638 61.6932 38.0060 177.0024 73 R 4.5432 8.2219 121.2996 55.1760 31.8512 175.0180 74 G 4.0557 7.4863 105.5385 45.5479 0.0000 172.2291 75 I 4.7824 7.9681 111.9110 58.1785 40.7598 172.9793 76 P 4.7784 0.0000 0.0000 63.2550 32.9490 174.9607 77 T 4.8747 8.6836 117.6798 61.8917 71.6682 172.9766 78 L 4.9288 9.1346 127.2340 53.3474 43.4926 175.3811 79 L 4.9828 9.1454 125.1229 52.8340 44.6273 175.4998 80 L 4.8789 9.6942 127.3673 53.8285 43.7380 175.1434 81 F 5.0460 9.9909 128.2820 56.0749 40.7104 175.3000 82 K 4.5400 8.8176 124.8404 55.9985 33.2463 176.2055 83 N 4.4500 9.7642 128.1731 52.5925 37.4895 175.2429 84 G 4.4352 7.2594 102.9305 44.8280 0.0000 172.1537 85 E 4.5899 7.9408 121.1714 53.7957 32.2932 175.6421 86 V 3.6058 7.6993 122.6148 61.5221 29.9435 175.2076 87 A 4.2163 8.6436 126.8677 54.2064 18.9066 177.4068 88 A 4.6765 7.5246 113.6008 51.5450 22.4616 175.4216 89 T 5.1589 8.6295 109.1554 59.9273 72.4097 173.1679 90 K 4.4463 9.2570 124.5658 54.6793 35.7263 174.6918 91 V 4.5918 9.8007 127.0935 60.5862 33.0266 174.7433 92 G 4.2762 7.6557 113.4450 43.3502 0.0000 173.9742 93 A 4.3999 7.7247 124.8705 49.9474 17.3197 177.1101 94 L 4.2536 7.5910 121.3615 54.3218 43.0464 178.0529 95 S 4.6214 8.6971 116.2427 57.0616 65.7713 175.1273 96 K 3.9251 8.7138 123.9711 60.2461 31.3362 179.0393 97 G 3.6362 8.0361 105.0620 47.6673 0.0000 175.6672 98 Q 4.1264 7.8321 120.5386 58.5097 28.8104 178.1856 99 L 3.9840 8.5394 121.8035 58.2365 42.0005 178.8457 100 K 3.9052 7.9173 118.4597 59.5600 31.8239 178.7488 101 E 3.9442 7.8206 117.2685 59.9320 29.9575 179.3841 102 F 4.3635 8.1224 120.3203 61.2943 39.2853 177.1367 103 L 3.8882 7.5131 116.7151 56.7042 41.4475 177.9069 104 D 4.8919 8.0504 117.4990 53.9498 40.9560 176.4252 105 A 4.6830 7.2653 118.4244 51.7937 20.6876 177.4942 106 N 5.0012 7.5571 112.5271 51.6331 40.0586 174.5533 107 L 4.0905 7.3947 121.1446 55.1880 42.7474 176.1082 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 3 K 8.31 4.25 0.00 1.74 1.93 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.20 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.45 7.81 4 I 7.61 4.15 1.82 0.00 0.00 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 1.28 0.56 0.86 0.00 0.00 5 I 9.42 4.28 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.84 0.88 0.00 0.00 6 H 8.66 4.92 0.00 3.04 3.30 0.00 5.73 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 7 L 8.14 4.71 0.00 1.61 1.73 0.98 0.68 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 8 T 8.35 4.81 4.30 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 1.32 0.00 0.00 9 D 8.89 4.50 0.00 2.76 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 10 D 7.45 4.71 0.00 2.73 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 11 S 8.12 4.24 0.00 4.24 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 12 F 8.33 3.94 0.00 3.37 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 13 D 8.40 4.51 0.00 2.94 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 14 T 7.10 4.49 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 1.24 0.00 0.00 15 D 7.14 4.42 0.00 2.84 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.62 3.88 1.01 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 -0.11 0.00 0.00 0.20 0.00 0.00 17 L 7.30 4.20 0.00 2.02 1.75 1.22 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.31 3.80 0.00 1.79 1.66 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.42 7.81 19 A 7.71 3.55 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 20 D 8.40 4.46 0.00 2.71 2.46 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 21 G 8.62 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 22 A 8.47 5.17 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 23 I 9.07 4.91 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.23 0.78 0.00 0.00 24 L 8.63 4.98 0.00 1.78 1.51 1.14 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 25 V 9.02 4.58 1.62 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 0.32 0.00 0.00 0.47 0.00 0.00 26 D 8.96 5.05 0.00 2.69 2.41 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 0.00 27 F 9.13 5.46 0.00 3.10 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 28 W 8.94 5.40 0.00 3.42 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 29 A 8.05 3.91 -0.08 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 0.00 0.00 30 E 8.29 4.06 0.00 1.79 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 2.38 2.48 0.00 31 W 7.01 4.85 0.00 3.57 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 32 C 7.65 4.96 0.00 2.64 2.70 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 33 G 8.75 3.60 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 0.00 0.00 0.00 34 P 0.00 4.28 0.00 2.17 2.14 0.00 3.64 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 2.14 2.22 0.00 35 C 7.98 4.13 0.00 3.15 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 36 K 8.15 4.08 0.00 2.04 1.81 0.00 1.69 0.00 0.00 1.81 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.42 7.81 37 M 7.79 3.85 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.67 0.00 38 I 7.61 4.00 1.94 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.42 0.88 0.00 0.00 39 A 7.21 3.83 1.11 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 0.00 0.00 40 P 0.00 5.12 0.00 2.13 2.07 0.00 4.03 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 2.07 1.98 0.00 41 I 7.70 3.72 1.83 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 1.61 0.94 0.92 0.00 0.00 42 L 7.81 4.04 0.00 1.79 1.62 0.81 0.98 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 43 D 7.84 4.29 0.00 2.88 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 44 E 8.07 4.07 0.00 2.14 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 2.40 2.56 0.00 45 I 7.77 3.86 1.83 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 1.67 0.87 0.77 0.00 0.00 46 A 8.19 4.11 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 47 D 7.26 4.52 0.00 2.88 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 48 E 8.50 4.13 0.00 2.21 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 2.34 2.54 0.00 49 Y 8.26 4.41 0.00 3.16 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 50 Q 7.33 4.19 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.52 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 51 G 9.13 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 7.44 4.57 0.00 1.96 1.86 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.31 7.81 53 L 7.05 4.76 0.00 1.70 1.63 0.89 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.02 4.65 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 1.17 0.00 0.00 55 V 8.29 4.56 2.03 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 1.01 0.00 0.00 0.89 0.00 0.00 56 A 8.59 5.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.69 4.91 0.00 1.65 1.66 0.00 1.62 0.00 0.00 1.34 0.00 0.00 2.19 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.22 7.81 58 L 9.41 4.75 0.00 1.79 1.70 1.08 0.94 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 59 N 8.93 4.13 0.00 2.48 2.60 0.00 0.00 6.90 7.78 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 60 I 7.97 3.76 1.80 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 1.19 0.63 0.85 0.00 0.00 61 D 8.57 4.54 0.00 2.73 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 62 Q 8.14 4.18 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.20 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 63 N 8.17 5.46 0.00 2.74 3.01 0.00 0.00 6.76 7.98 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 64 P 0.00 4.41 0.00 2.15 2.16 0.00 3.89 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 65 G 8.23 3.65 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 0.00 0.00 0.00 66 T 8.50 3.76 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 0.45 0.00 0.00 67 A 8.07 3.55 1.03 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 0.00 0.00 68 P 0.00 4.21 0.00 2.07 2.05 0.00 3.52 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 2.14 2.11 0.00 69 K 7.54 3.71 0.00 1.18 1.32 0.00 1.41 0.00 0.00 1.49 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.28 1.48 7.81 70 Y 7.51 4.46 0.00 2.99 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 71 G 7.57 3.62 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 0.00 0.00 0.00 72 I 7.36 3.83 1.79 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.51 0.93 0.00 0.00 73 R 8.22 4.54 0.00 1.76 1.92 0.00 3.44 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.54 0.00 74 G 7.49 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.97 4.78 1.86 0.00 0.00 0.43 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 0.57 0.92 0.00 0.00 76 P 0.00 4.78 0.00 2.27 2.26 0.00 3.63 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.99 0.00 77 T 8.68 4.87 4.50 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 1.45 0.00 0.00 78 L 9.13 4.93 0.00 1.47 1.49 0.73 0.34 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 79 L 9.15 4.98 0.00 1.72 1.91 1.12 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 80 L 9.69 4.88 0.00 2.06 1.66 0.51 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.99 5.05 0.00 2.95 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 82 K 8.82 4.54 0.00 1.67 1.72 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.77 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.37 7.81 83 N 9.76 4.45 0.00 2.89 3.00 0.00 0.00 6.89 8.07 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 84 G 7.26 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 0.00 0.00 0.00 0.00 85 E 7.94 4.59 0.00 1.95 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 2.10 2.16 0.00 86 V 7.70 3.61 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 0.74 0.00 0.00 0.47 0.00 0.00 87 A 8.64 4.22 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 88 A 7.52 4.68 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 89 T 8.63 5.16 4.39 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 1.29 0.00 0.00 90 K 9.26 4.45 0.00 0.80 1.08 0.00 1.39 0.00 0.00 1.47 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.88 1.18 7.81 91 V 9.80 4.59 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 0.85 0.00 0.00 0.96 0.00 0.00 92 G 7.66 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 7.72 4.40 1.28 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 0.00 0.00 0.00 0.00 0.00 0.00 94 L 7.59 4.25 0.00 1.58 1.58 0.71 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.70 4.62 0.00 4.05 3.97 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 96 K 8.71 3.93 0.00 1.88 1.90 0.00 1.62 0.00 0.00 1.95 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.64 7.81 97 G 8.04 3.64 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 0.00 0.00 0.00 98 Q 7.83 4.13 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 99 L 8.54 3.98 0.00 1.74 1.82 0.83 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 100 K 7.92 3.91 0.00 2.02 2.07 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.70 1.75 7.81 101 E 7.82 3.94 0.00 2.18 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 2.39 2.40 0.00 102 F 8.12 4.36 0.00 3.03 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 0.00 103 L 7.51 3.89 0.00 1.38 1.33 0.08 1.12 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 0.00 104 D 8.05 4.89 0.00 2.67 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 0.00 105 A 7.27 4.68 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 0.00 106 N 7.56 5.00 0.00 2.25 2.52 0.00 0.00 6.82 7.85 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 0.00 107 L 7.39 4.09 0.00 1.57 1.49 1.06 0.95 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