NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.5228 8.1933 115.4129 58.4335 65.3592 175.8639 2 N 4.0310 8.1996 118.0633 55.5147 38.4358 174.9519 3 I 4.7986 8.1583 118.0079 60.6790 39.1932 175.8408 4 I 4.6862 8.0868 116.1514 61.5839 40.1611 175.6313 5 K 4.4564 8.1073 118.5106 57.6769 34.5797 178.6964 6 Q 4.2536 7.9953 116.2038 57.7164 28.3560 177.9621 7 L 4.4408 8.2494 122.4821 57.2746 42.3939 178.1223 8 E 4.1522 7.9604 117.4090 59.3975 29.6108 178.7018 9 Q 4.0151 8.1069 118.7627 58.6685 28.8183 178.2420 10 E 4.1046 8.2356 117.3830 58.2331 29.7068 177.9991 11 Q 4.9815 7.7038 115.9288 55.1459 28.2385 175.1242 12 M 4.4080 7.4878 115.0117 56.9075 35.0723 175.0079 13 K 3.9917 7.9199 128.0647 57.2307 32.2254 177.3511 14 Q 4.5251 8.8384 128.3401 55.3021 30.3099 172.5892 15 D 5.0396 7.8571 121.9218 52.5150 45.5087 175.9442 16 V 4.5925 7.8744 115.0687 61.1638 31.1023 172.2065 17 P 4.0907 0.0000 0.0000 64.7826 32.3672 177.8044 18 S 4.6125 8.2496 109.0423 58.5006 66.1420 175.4503 19 F 3.5566 8.4104 114.8883 58.3904 36.8706 174.9601 20 R 4.2773 7.8121 115.5950 55.1798 33.2113 171.6669 21 P 4.9844 0.0000 0.0000 61.1495 33.2553 175.9070 22 G 3.9500 8.3353 110.5245 45.8797 0.0000 172.6662 23 D 3.9391 8.9225 121.1743 58.0413 42.5129 175.6754 24 T 3.6788 7.8957 123.8087 65.4718 66.7168 172.3608 25 V 4.0333 8.1598 127.6209 61.6303 30.3033 176.9974 26 E 4.3040 8.6853 125.3465 56.3410 28.8370 177.6797 27 V 3.2900 8.5042 118.8863 61.7839 31.3318 175.9129 28 K 3.7926 8.1722 123.3630 56.1827 32.0622 177.4421 29 V 3.8334 7.9898 126.2062 61.4390 30.8962 174.1135 30 W 4.7337 8.6111 125.8540 56.5912 29.4100 175.4863 31 V 4.3970 8.4767 124.0402 60.8080 33.1309 176.1034 32 V 3.5919 8.1436 128.5063 65.5497 31.8620 178.9363 33 E 3.6736 9.0962 118.5894 56.4110 29.9307 173.2628 34 G 3.4397 11.1457 105.4002 45.6207 0.0000 175.4633 35 S 3.7472 7.8879 115.5397 56.7270 62.7086 168.7807 36 K 4.6929 7.9592 119.9235 54.8153 35.9644 177.9142 37 K 3.6333 8.1625 119.5659 57.9303 30.8321 176.0736 38 R 4.2408 8.4909 132.8514 55.9387 29.6692 174.2707 39 L 3.4285 8.5962 120.0480 54.9319 40.4579 173.0970 40 Q 3.8519 8.4503 123.9359 53.2335 28.7399 174.0276 41 A 3.5564 8.3867 129.1697 51.9398 19.1513 177.1113 42 F 5.2411 7.5689 112.7453 55.5141 40.9047 173.9688 43 E 5.0586 8.8616 121.4696 54.9238 33.2816 176.4120 44 G 4.2825 8.2370 113.4778 45.2212 0.0000 172.2161 45 V 4.4885 7.9412 119.0109 61.0786 35.0376 175.9032 46 V 3.8606 8.4776 127.4137 63.7879 32.2833 174.4725 47 I 4.6808 7.9008 123.3406 60.5957 41.5982 173.8537 48 A 4.6345 8.4633 120.6633 53.9082 25.4827 173.2197 49 I 4.3569 8.7590 120.4285 61.6949 37.2983 173.4503 50 R 4.8028 7.9457 121.2158 55.4084 34.8855 172.7675 51 N 4.7204 7.4873 121.4767 51.2117 38.0508 175.0291 52 R 4.9406 8.4178 115.3877 56.7379 33.3096 174.7582 53 G 4.1334 8.0527 110.8495 44.8551 0.0000 171.8058 54 L 3.4362 7.4239 127.2069 56.8292 46.4747 174.0074 55 H 3.6481 8.8517 116.5769 56.3472 26.4045 176.9228 56 S 4.2163 7.4248 113.3154 59.3092 61.9409 172.3013 57 A 4.7293 7.8833 123.1200 50.3647 19.2602 176.2820 58 F 4.5763 8.6135 126.8510 56.8138 38.1528 178.1629 59 T 4.2295 7.2833 117.1690 63.5736 67.0924 175.8015 60 V 3.9488 7.6745 123.2018 62.4670 36.0776 174.5428 61 R 3.7807 8.7098 115.2886 57.1812 26.0661 176.9073 62 K 4.8355 8.1647 117.7490 56.7842 33.7241 177.8440 63 I 4.5427 8.6025 126.2687 59.6867 39.3258 174.9203 64 S 4.8675 8.5668 123.2574 56.4331 63.7075 173.8566 65 N 4.6071 8.7646 123.1980 53.4588 39.3524 176.0669 66 G 4.0333 8.5780 107.7518 44.9754 0.0000 173.4137 67 E 3.7580 8.4028 118.3133 57.6769 29.0451 175.6125 68 G 4.1273 8.4865 113.6316 45.4679 0.0000 174.3960 69 V 4.1596 7.4559 116.1762 60.2026 32.8899 176.6021 70 E 4.6034 9.1686 111.8799 56.0007 34.1702 176.7940 71 R 3.4735 8.1154 124.1005 57.0998 29.9300 175.2461 72 V 2.8747 7.3688 108.6625 61.2326 33.0477 174.1051 73 F 4.3802 7.3398 120.5447 57.9338 42.1265 174.4872 74 Q 4.6774 8.0577 121.3884 55.4654 29.3393 173.9266 75 T 4.1934 8.3509 111.1524 61.2804 69.3623 173.4260 76 H 4.3490 9.1663 122.2120 58.7517 28.0330 175.1287 77 S 4.5560 8.8711 123.1768 59.4050 69.7431 174.6732 78 P 4.6256 0.0000 0.0000 61.8191 33.5099 178.8715 79 V 3.0509 7.8722 113.4711 63.0172 30.1282 175.5118 80 V 3.8924 8.3414 126.2782 62.8305 30.5004 175.6060 81 D 4.9978 7.6583 121.2858 52.7950 40.6861 176.6656 82 S 4.7489 7.7590 132.1000 57.4838 62.6286 177.6656 83 I 3.6285 8.4670 121.2585 62.0966 36.7658 175.6975 84 S 4.7239 8.3671 117.3300 57.5869 64.4689 176.2766 85 V 3.6542 7.7990 120.1996 66.0715 31.7071 176.2380 86 K 3.9711 7.4522 119.5896 56.8680 32.4313 176.1460 87 R 4.5476 8.3234 121.8528 54.8425 32.9797 174.7300 88 R 4.4429 8.7819 122.3692 56.1287 32.4669 175.6212 89 G 4.5040 8.0665 104.5157 42.9171 0.0000 172.3822 90 A 4.5152 8.6034 128.3716 52.2487 18.2417 179.5063 91 V 4.3045 8.7256 122.3669 62.5948 31.0754 175.6275 92 R 3.9646 9.3909 112.8483 56.2982 27.7991 175.7643 93 K 4.0629 7.7924 115.7138 56.2493 30.3010 175.9377 94 A 4.3371 8.2625 126.3254 52.8664 19.9553 177.9623 95 K 4.2964 7.8431 112.9626 55.0933 33.4810 176.8391 96 L 3.0052 7.5669 116.4768 56.2848 40.7737 172.7000 97 Y 4.0661 5.3700 114.2029 59.3349 39.4707 175.4196 98 Y 3.1956 8.4554 117.8082 58.9555 34.2046 170.5609 99 L 4.6515 7.3644 121.6962 53.4899 41.4934 174.1716 100 R 4.4025 7.9266 119.1925 54.4830 29.5340 175.4839 101 E 4.3748 8.4474 121.7338 56.2256 32.5230 177.3056 102 R 3.6031 7.5285 116.2299 57.7839 27.6139 175.6070 103 T 4.6918 7.5937 114.0312 61.9566 71.5779 175.2279 104 G 4.3512 8.0700 111.9124 44.5165 0.0000 173.8622 105 K 4.2085 7.7909 128.1902 56.8387 38.4198 176.6646 106 A 3.9975 9.4739 114.7323 52.4942 17.8955 178.8877 107 A 4.4141 7.6020 122.8020 51.9316 17.8914 177.8089 108 R 4.5674 8.0485 119.5635 55.4031 32.4654 177.2383 109 I 4.2306 7.7472 120.7757 58.7549 36.7666 173.5924 110 K 4.0349 8.2815 125.6174 56.0118 31.7096 178.9924 111 E 4.3737 8.1725 126.6228 54.4439 29.2040 178.2476 112 R 3.6657 8.8331 120.7789 57.7963 28.5037 176.1543 113 L 4.1173 7.9819 119.5797 55.1719 40.8760 176.4521 114 N 4.6199 8.4324 122.1120 53.1899 39.0923 174.8332 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 S 8.19 4.52 0.00 4.02 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 2 N 8.20 4.03 0.00 2.82 2.94 0.00 0.00 6.66 6.57 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 3 I 8.16 4.80 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 0.60 0.98 0.00 0.00 4 I 8.09 4.69 1.94 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 1.30 0.48 0.91 0.00 0.00 5 K 8.11 4.46 0.00 1.82 1.75 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.52 7.81 6 Q 8.00 4.25 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.87 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 7 L 8.25 4.44 0.00 1.55 1.70 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 8 E 7.96 4.15 0.00 2.26 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 2.45 2.35 0.00 9 Q 8.11 4.02 0.00 2.41 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.94 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 10 E 8.24 4.10 0.00 2.12 2.24 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 2.45 2.28 0.00 11 Q 7.70 4.98 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 12 M 7.49 4.41 0.00 2.05 2.05 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 2.50 2.45 0.00 13 K 7.92 3.99 0.00 1.95 1.76 0.00 1.79 0.00 0.00 1.92 0.00 0.00 2.13 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.37 1.45 7.81 14 Q 8.84 4.53 0.00 2.06 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.33 6.28 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 15 D 7.86 5.04 0.00 2.53 2.50 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 16 V 7.87 4.59 2.13 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 0.94 0.00 0.00 0.99 0.00 0.00 17 P 0.00 4.09 0.00 2.14 1.88 0.00 3.55 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 1.90 1.98 0.00 18 S 8.25 4.61 0.00 3.84 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 19 F 8.41 3.56 0.00 3.04 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 20 R 7.81 4.28 0.00 1.80 1.83 0.00 3.36 0.00 0.00 3.35 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 21 P 0.00 4.98 0.00 2.34 2.08 0.00 3.83 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 2.11 1.97 0.00 22 G 8.34 3.95 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 0.00 0.00 0.00 23 D 8.92 3.94 0.00 2.77 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 24 T 7.90 3.68 4.23 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 1.23 0.00 0.00 25 V 8.16 4.03 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 1.14 0.00 0.00 1.11 0.00 0.00 26 E 8.69 4.30 0.00 1.95 1.91 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 2.29 2.28 0.00 27 V 8.50 3.29 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 0.69 0.00 0.00 0.99 0.00 0.00 28 K 8.17 3.79 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.57 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.90 0.61 7.81 29 V 7.99 3.83 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 0.82 0.00 0.00 0.86 0.00 0.00 30 W 8.61 4.73 0.00 3.19 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 V 8.48 4.40 1.94 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 0.97 0.00 0.00 0.72 0.00 0.00 32 V 8.14 3.59 2.31 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 0.85 0.00 0.00 0.84 0.00 0.00 33 E 9.10 3.67 0.00 2.41 1.67 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 2.33 2.47 0.00 34 G 11.15 3.44 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 35 S 7.89 3.75 0.00 4.11 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 36 K 7.96 4.69 0.00 1.72 1.67 0.00 2.00 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.42 7.81 37 K 8.16 3.63 0.00 1.95 1.38 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.36 7.81 38 R 8.49 4.24 0.00 1.77 1.72 0.00 3.56 0.00 0.00 3.23 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 39 L 8.60 3.43 0.00 1.78 1.66 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.45 3.85 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.15 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 41 A 8.39 3.56 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 42 F 7.57 5.24 0.00 3.27 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 43 E 8.86 5.06 0.00 2.01 1.91 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 2.32 2.30 0.00 44 G 8.24 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 45 V 7.94 4.49 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 0.91 0.00 0.00 0.87 0.00 0.00 46 V 8.48 3.86 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 0.85 0.00 0.00 0.98 0.00 0.00 47 I 7.90 4.68 1.93 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 1.34 1.20 0.92 0.00 0.00 48 A 8.46 4.63 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 49 I 8.76 4.36 1.89 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 1.44 0.05 0.96 0.00 0.00 50 R 7.95 4.80 0.00 1.79 1.57 0.00 3.14 0.00 0.00 3.36 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 51 N 7.49 4.72 0.00 2.74 2.30 0.00 0.00 5.88 7.66 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 52 R 8.42 4.94 0.00 1.80 1.81 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 1.44 1.46 0.00 53 G 8.05 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 0.00 0.00 0.00 0.00 54 L 7.42 3.44 0.00 1.44 1.29 0.64 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 55 H 8.85 3.65 0.00 3.15 3.21 0.00 5.81 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 7.42 4.22 0.00 4.08 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 0.00 57 A 7.88 4.73 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 58 F 8.61 4.58 0.00 2.98 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 59 T 7.28 4.23 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 0.98 0.00 0.00 60 V 7.67 3.95 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 0.64 0.00 0.00 1.06 0.00 0.00 61 R 8.71 3.78 0.00 2.01 2.08 0.00 3.23 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 62 K 8.16 4.84 0.00 1.65 1.76 0.00 1.62 0.00 0.00 1.99 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.34 7.81 63 I 8.60 4.54 1.95 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 1.40 1.13 0.91 0.00 0.00 64 S 8.57 4.87 0.00 3.85 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 65 N 8.76 4.61 0.00 2.70 2.79 0.00 0.00 6.69 7.60 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 66 G 8.58 4.03 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 0.00 67 E 8.40 3.76 0.00 2.08 2.00 0.00 0.00 0.00 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 2.33 0.00 68 G 8.49 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 0.00 0.00 0.00 0.00 69 V 7.46 4.16 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 0.80 0.00 0.00 0.93 0.00 0.00 70 E 9.17 4.60 0.00 1.93 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 0.00 2.20 2.30 0.00 71 R 8.12 3.47 0.00 1.95 1.95 0.00 3.32 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 72 V 7.37 2.87 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 0.64 0.00 0.00 0.88 0.00 0.00 73 F 7.34 4.38 0.00 3.14 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 74 Q 8.06 4.68 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.96 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 75 T 8.35 4.19 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 1.14 0.00 0.00 76 H 9.17 4.35 0.00 3.23 3.24 0.00 5.67 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.87 4.56 0.00 3.78 3.77 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 78 P 0.00 4.63 0.00 2.05 2.00 0.00 3.87 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 2.06 2.11 0.00 79 V 7.87 3.05 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 0.89 0.00 0.00 0.92 0.00 0.00 80 V 8.34 3.89 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 0.91 0.00 0.00 0.94 0.00 0.00 81 D 7.66 5.00 0.00 2.73 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 82 S 7.76 4.75 0.00 3.86 3.20 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 83 I 8.47 3.63 1.75 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.08 1.02 0.00 0.00 84 S 8.37 4.72 0.00 3.91 4.01 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 0.00 0.00 0.00 85 V 7.80 3.65 2.12 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 0.97 0.00 0.00 0.95 0.00 0.00 86 K 7.45 3.97 0.00 1.77 1.72 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.49 7.81 87 R 8.32 4.55 0.00 1.77 1.80 0.00 3.27 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.76 0.00 88 R 8.78 4.44 0.00 1.71 1.87 0.00 3.22 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 89 G 8.07 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 0.00 0.00 0.00 0.00 90 A 8.60 4.52 1.13 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 0.00 0.00 0.00 91 V 8.73 4.30 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 1.00 0.00 0.00 1.03 0.00 0.00 92 R 9.39 3.96 0.00 2.00 2.16 0.00 3.33 0.00 0.00 3.42 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.66 0.00 93 K 7.79 4.06 0.00 1.71 1.61 0.00 1.11 0.00 0.00 1.35 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.30 7.81 94 A 8.26 4.34 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 95 K 7.84 4.30 0.00 1.69 1.77 0.00 1.94 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.42 7.81 96 L 7.57 3.01 0.00 1.56 0.59 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 5.37 4.07 0.00 3.49 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 98 Y 8.46 3.20 0.00 3.31 3.14 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 0.00 99 L 7.36 4.65 0.00 1.70 1.55 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 100 R 7.93 4.40 0.00 1.86 1.91 0.00 3.38 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 101 E 8.45 4.37 0.00 1.88 1.94 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 2.19 2.34 0.00 102 R 7.53 3.60 0.00 1.87 2.05 0.00 3.16 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 103 T 7.59 4.69 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 1.21 0.00 0.00 104 G 8.07 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 0.00 105 K 7.79 4.21 0.00 1.88 1.29 0.00 1.51 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.37 7.81 106 A 9.47 4.00 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 0.00 107 A 7.60 4.41 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 0.00 108 R 8.05 4.57 0.00 1.77 1.85 0.00 3.19 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 109 I 7.75 4.23 1.85 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 1.29 0.85 0.89 0.00 0.00 110 K 8.28 4.03 0.00 1.70 1.78 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.43 7.81 111 E 8.17 4.37 0.00 2.06 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 2.35 0.00 112 R 8.83 3.67 0.00 1.92 2.01 0.00 3.37 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 113 L 7.98 4.12 0.00 1.58 1.62 0.92 1.10 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 0.00 114 N 8.43 4.62 0.00 2.71 2.66 0.00 0.00 7.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00