NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4151 8.1927 115.2907 58.3146 64.2419 175.0590 2 N 4.2355 8.5358 122.6456 55.4441 40.0310 174.5691 3 I 3.9499 8.5521 118.7238 63.5992 39.7742 175.7103 4 I 4.0069 7.1167 120.6123 61.7490 38.6444 176.8183 5 K 3.4238 8.7194 120.2171 58.7637 32.4849 178.3960 6 Q 4.0167 8.6474 120.0569 58.7056 29.0475 177.5828 7 L 3.9637 7.7559 119.6299 57.1560 41.9107 178.7449 8 E 4.1070 8.1035 119.2572 58.8689 29.2344 178.6512 9 Q 4.2461 8.2850 117.8606 59.1767 28.4863 178.3644 10 E 3.6733 9.0800 122.2463 58.3844 29.3724 177.7895 11 Q 4.3885 8.1478 116.2679 56.2344 30.7638 176.0975 12 M 3.6203 7.0985 117.4550 55.6334 32.2560 176.5409 13 K 4.4689 8.5377 122.5251 56.2730 34.3515 175.9798 14 Q 4.5358 8.2027 114.8924 56.0027 30.0187 175.4181 15 D 4.6286 8.2763 115.0329 54.0290 41.3381 175.8045 16 V 4.0975 7.3659 111.7895 59.3680 32.8472 174.4510 17 P 4.5424 0.0000 0.0000 61.8725 33.4043 175.2683 18 S 4.1802 8.5018 112.6485 58.9219 62.8000 174.0562 19 F 5.4325 8.1829 124.7127 55.8496 42.5335 174.0644 20 R 4.3828 7.2222 119.4210 55.8355 31.9384 172.7696 21 P 4.2699 0.0000 0.0000 63.1820 30.9415 177.0426 22 G 3.9171 7.8234 108.2479 46.8087 0.0000 173.9527 23 D 4.5850 7.8623 118.6560 55.1104 41.5767 177.6244 24 T 3.9058 9.7497 118.5582 65.8451 69.1135 176.4080 25 V 3.3162 7.6961 115.1470 60.0105 31.0394 171.3688 26 E 4.9235 8.1046 119.9776 55.2397 32.3186 173.7012 27 V 4.3512 8.9615 128.2430 61.8195 33.4034 174.9786 28 K 4.9432 8.3220 126.2314 55.0569 34.0373 175.8747 29 V 4.3528 8.6430 119.2374 59.0859 34.9805 176.2128 30 W 4.8765 8.3409 120.4684 57.8379 29.4294 174.7006 31 V 4.4518 8.8318 118.2250 62.5770 37.3847 173.7959 32 V 3.7325 8.1595 123.2070 62.8190 31.6783 172.1892 33 E 3.6350 7.5562 117.6733 57.4146 31.1920 175.8486 34 G 3.7171 9.0465 106.1438 46.2448 0.0000 174.2840 35 S 4.6198 9.3083 114.9308 58.4285 63.5997 174.0023 36 K 4.7087 6.8045 120.6586 56.7202 34.1679 175.7867 37 K 4.4092 8.0257 113.7951 56.3253 32.2048 175.3109 38 R 4.0711 7.9430 120.3290 58.0085 31.6226 175.7448 39 L 4.9851 8.3202 119.0798 53.1560 43.3076 176.2306 40 Q 4.2899 9.2740 126.6829 55.8260 30.1311 175.4528 41 A 4.9479 8.6280 127.9808 51.7206 20.9794 177.0669 42 F 4.2566 9.1793 121.6313 57.9582 41.8511 172.8557 43 E 4.7436 8.7467 127.0191 55.6130 28.6237 176.2821 44 G 4.7531 8.1443 112.1706 44.1504 0.0000 171.3655 45 V 4.3228 8.4295 120.5422 61.1065 33.7196 174.2372 46 V 3.8380 7.7505 127.1647 63.6830 31.2812 175.0054 47 I 4.2730 8.7583 122.0327 61.5965 39.8789 174.9075 48 A 4.9117 7.2726 123.4613 50.2719 22.2735 174.8221 49 I 4.6443 8.0243 116.1698 59.7089 42.4136 177.4325 50 R 4.2950 8.8620 123.1248 55.9114 28.4042 177.7831 51 N 4.2357 9.9124 107.8644 52.8480 34.8441 174.4600 52 R 4.5315 8.7018 114.6267 56.0694 34.0101 177.5735 53 G 3.8263 8.1657 106.8409 45.8225 0.0000 175.4717 54 L 3.7672 8.7823 122.8872 58.3044 41.8438 177.2659 55 H 4.5847 7.6720 116.1912 55.8839 28.7235 174.8590 56 S 4.7384 8.3149 118.0477 57.6503 67.3319 174.3974 57 A 5.2434 8.7980 125.2435 49.8627 21.8857 174.4845 58 F 4.8870 8.9823 113.2405 59.5349 41.6427 173.8874 59 T 3.4213 8.2810 125.6271 63.2173 64.8930 170.0976 60 V 5.0087 8.4193 118.4073 59.3379 35.3969 175.4149 61 R 4.8178 8.4711 124.1259 56.2865 31.2151 176.2755 62 K 4.0096 8.4090 120.9722 57.5229 34.1366 176.0932 63 I 3.2920 7.6238 115.5437 61.9047 34.1134 174.5852 64 S 4.5229 7.2824 121.7542 58.3100 63.2202 178.2668 65 N 4.5996 8.7206 124.6188 54.1862 36.0751 173.0988 66 G 4.2625 8.1748 109.5663 45.1843 0.0000 172.4799 67 E 4.4079 7.6876 119.4664 53.9861 30.7626 175.9171 68 G 3.8429 8.4598 114.9321 45.9722 0.0000 172.7686 69 V 4.6646 7.9598 112.8093 59.5172 36.6227 173.7198 70 E 5.1447 8.7049 122.7575 54.5168 32.6455 174.4039 71 R 4.1203 8.7026 126.8904 54.6227 32.6435 174.8165 72 V 4.3498 7.9136 120.5461 59.5138 31.4469 176.6178 73 F 4.3822 7.5531 124.6221 57.5105 40.1574 175.0035 74 Q 5.1504 8.2382 115.7628 61.2404 29.2683 180.2173 75 T 2.7498 6.5514 110.7415 64.5868 70.6853 173.3698 76 H 4.5086 8.1290 120.1941 56.0930 28.8395 175.0771 77 S 4.6162 7.7884 115.1083 55.8065 63.7337 172.9329 78 P 4.0797 0.0000 0.0000 65.7925 31.5948 178.8409 79 V 3.0337 7.4635 110.9397 63.8481 31.7194 178.7048 80 V 3.3361 7.7891 119.4203 62.7040 32.8912 178.9162 81 D 3.8902 7.4609 117.4778 55.0719 41.3336 176.4271 82 S 4.6025 8.5966 111.0324 57.6163 65.9269 173.1081 83 I 4.3333 7.6781 118.8582 60.6020 39.6530 174.2331 84 S 4.6632 9.4397 129.2326 58.2689 63.6344 173.2206 85 V 4.5746 8.5364 112.5864 60.7766 35.9942 179.2126 86 K 3.6026 8.3875 116.1391 57.1623 31.5627 176.4327 87 R 4.7767 8.9175 126.8020 55.3200 32.6957 174.0770 88 R 4.6164 8.5729 121.3767 54.6138 32.0778 174.9702 89 G 4.4252 8.6253 105.2882 44.3745 0.0000 172.4545 90 A 4.3317 9.2464 126.1098 52.0139 19.1989 177.2451 91 V 4.0710 7.9571 119.6264 64.3161 34.1981 175.4770 92 R 3.6889 8.2707 114.9667 55.4491 27.2312 175.0370 93 K 4.1804 7.1652 115.2248 56.1816 35.3673 173.9322 94 A 4.2490 8.7770 127.3641 53.4843 19.3959 178.0550 95 K 4.4353 7.7029 114.1364 54.7044 34.7568 176.8154 96 L 4.8398 8.6073 127.2950 54.5040 41.9575 178.4025 97 Y 4.3839 7.6059 118.1995 61.0646 38.3519 178.3708 98 Y 4.2140 8.1410 116.6544 59.0459 38.1014 176.3689 99 L 3.9799 7.1660 121.4494 55.1571 43.4460 177.4312 100 R 3.9643 8.4197 118.4825 58.1268 28.6687 178.8111 101 E 4.2967 9.1130 124.1895 57.5136 28.2085 176.5258 102 R 4.2823 7.6928 122.8637 58.5702 33.2502 176.7200 103 T 3.4601 7.6949 113.8561 61.9126 67.6522 171.2912 104 G 4.1589 8.3621 110.8515 46.8169 0.0000 172.8156 105 K 4.1002 8.8676 123.0100 57.5283 30.5477 178.4691 106 A 4.0477 7.8643 119.3070 54.5332 18.5308 178.1211 107 A 4.2667 7.8809 117.2802 52.9851 19.2544 177.9672 108 R 3.8893 7.5332 115.7117 56.8113 30.4538 175.7876 109 I 4.5373 8.1028 116.2858 58.5267 39.2568 175.6544 110 K 4.0783 8.7985 126.5755 56.5217 33.2316 176.9233 111 E 4.0468 8.7983 122.3849 56.9216 30.2047 176.7884 112 R 4.1170 8.7839 118.7099 56.8771 30.5874 175.1338 113 L 3.4960 7.6564 128.8350 55.1191 39.7451 174.1751 114 N 4.6001 8.3552 119.6714 52.8941 38.9192 174.8530 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 4.42 0.00 3.88 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 2 N 8.54 4.24 0.00 2.78 2.83 0.00 0.00 6.87 7.06 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 3 I 8.55 3.95 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 1.41 1.21 0.94 0.00 0.00 4 I 7.12 4.01 1.92 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 1.19 0.82 0.92 0.00 0.00 5 K 8.72 3.42 0.00 2.06 1.91 0.00 1.72 0.00 0.00 1.93 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.35 7.81 6 Q 8.65 4.02 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.54 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 7 L 7.76 3.96 0.00 1.62 1.72 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.10 4.11 0.00 2.06 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 2.37 2.47 0.00 9 Q 8.28 4.25 0.00 2.28 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.53 2.35 0.00 10 E 9.08 3.67 0.00 2.21 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 2.29 2.34 0.00 11 Q 8.15 4.39 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.51 0.00 0.00 0.00 0.00 0.00 2.27 2.49 0.00 12 M 7.10 3.62 0.00 1.82 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.12 0.00 13 K 8.54 4.47 0.00 1.84 1.82 0.00 1.50 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 1.44 1.42 7.81 14 Q 8.20 4.54 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.18 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 15 D 8.28 4.63 0.00 2.57 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 7.37 4.10 1.84 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 0.70 0.00 0.00 0.84 0.00 0.00 17 P 0.00 4.54 0.00 2.12 2.04 0.00 3.54 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 1.81 1.87 0.00 18 S 8.50 4.18 0.00 3.86 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 19 F 8.18 5.43 0.00 2.81 2.78 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 20 R 7.22 4.38 0.00 1.91 1.90 0.00 3.23 0.00 0.00 3.38 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.44 0.00 21 P 0.00 4.27 0.00 2.16 2.12 0.00 3.71 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 22 G 7.82 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 0.00 0.00 0.00 23 D 7.86 4.59 0.00 2.60 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 24 T 9.75 3.91 4.26 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 1.32 0.00 0.00 25 V 7.70 3.32 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 1.04 0.00 0.00 1.09 0.00 0.00 26 E 8.10 4.92 0.00 2.05 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 2.35 2.37 0.00 27 V 8.96 4.35 2.02 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 0.17 0.00 0.00 0.97 0.00 0.00 28 K 8.32 4.94 0.00 1.67 1.76 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.39 7.81 29 V 8.64 4.35 2.23 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 0.66 0.00 0.00 1.06 0.00 0.00 30 W 8.34 4.88 0.00 3.31 3.03 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 31 V 8.83 4.45 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 0.64 0.00 0.00 1.02 0.00 0.00 32 V 8.16 3.73 2.10 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 0.71 0.00 0.00 0.94 0.00 0.00 33 E 7.56 3.64 0.00 2.08 1.12 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 2.20 2.35 0.00 34 G 9.05 3.72 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 0.00 0.00 0.00 35 S 9.31 4.62 0.00 3.85 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 6.80 4.71 0.00 1.75 1.73 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.48 7.81 37 K 8.03 4.41 0.00 1.27 1.57 0.00 1.47 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.05 1.05 7.81 38 R 7.94 4.07 0.00 1.82 1.98 0.00 3.07 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 39 L 8.32 4.99 0.00 1.55 1.69 1.23 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 9.27 4.29 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 2.52 2.41 0.00 41 A 8.63 4.95 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 42 F 9.18 4.26 0.00 3.26 3.17 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 43 E 8.75 4.74 0.00 1.85 1.90 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 2.33 2.27 0.00 44 G 8.14 4.75 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 0.00 0.00 0.00 45 V 8.43 4.32 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 0.89 0.00 0.00 0.94 0.00 0.00 46 V 7.75 3.84 1.89 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 0.46 0.00 0.00 0.36 0.00 0.00 47 I 8.76 4.27 2.06 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.87 0.93 0.00 0.00 48 A 7.27 4.91 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 8.02 4.64 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 1.57 0.71 0.93 0.00 0.00 50 R 8.86 4.29 0.00 2.10 1.71 0.00 3.33 0.00 0.00 3.51 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.81 0.00 51 N 9.91 4.24 0.00 2.95 2.97 0.00 0.00 6.62 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 8.70 4.53 0.00 2.04 1.92 0.00 3.45 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 53 G 8.17 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.78 3.77 0.00 1.43 1.44 0.82 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 55 H 7.67 4.58 0.00 3.23 3.26 0.00 5.79 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 56 S 8.31 4.74 0.00 3.81 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 57 A 8.80 5.24 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 58 F 8.98 4.89 0.00 3.30 3.23 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 59 T 8.28 3.42 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 1.26 0.00 0.00 60 V 8.42 5.01 2.29 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 1.04 0.00 0.00 1.21 0.00 0.00 61 R 8.47 4.82 0.00 1.74 1.85 0.00 3.38 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 62 K 8.41 4.01 0.00 1.74 1.72 0.00 0.84 0.00 0.00 0.88 0.00 0.00 2.46 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.24 1.31 7.81 63 I 7.62 3.29 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 1.41 0.52 0.90 0.00 0.00 64 S 7.28 4.52 0.00 3.82 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 65 N 8.72 4.60 0.00 2.68 2.80 0.00 0.00 6.92 7.65 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 66 G 8.17 4.26 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 0.00 67 E 7.69 4.41 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 2.23 2.29 0.00 68 G 8.46 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 0.00 0.00 0.00 69 V 7.96 4.66 2.18 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 0.96 0.00 0.00 1.06 0.00 0.00 70 E 8.70 5.14 0.00 1.90 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 2.28 0.00 71 R 8.70 4.12 0.00 1.24 0.76 0.00 2.32 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.76 0.00 72 V 7.91 4.35 2.02 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 0.72 0.00 0.00 0.82 0.00 0.00 73 F 7.55 4.38 0.00 2.35 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 5.15 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.60 6.15 0.00 0.00 0.00 0.00 0.00 2.30 2.21 0.00 75 T 6.55 2.75 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 76 H 8.13 4.51 0.00 3.32 3.24 0.00 5.69 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 7.79 4.62 0.00 3.83 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 4.08 0.00 1.95 1.87 0.00 3.55 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 79 V 7.46 3.03 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 0.92 0.00 0.00 0.84 0.00 0.00 80 V 7.79 3.34 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.45 0.00 0.00 81 D 7.46 3.89 0.00 2.38 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 0.00 0.00 0.00 0.00 82 S 8.60 4.60 0.00 3.91 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 83 I 7.68 4.33 1.83 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.06 0.84 0.00 0.00 84 S 9.44 4.66 0.00 3.91 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.54 4.57 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 0.79 0.00 0.00 0.99 0.00 0.00 86 K 8.39 3.60 0.00 1.86 1.45 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.62 1.49 7.81 87 R 8.92 4.78 0.00 1.89 1.77 0.00 3.12 0.00 0.00 3.39 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 88 R 8.57 4.62 0.00 1.91 1.87 0.00 3.08 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 89 G 8.63 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 A 9.25 4.33 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 91 V 7.96 4.07 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 0.94 0.00 0.00 0.98 0.00 0.00 92 R 8.27 3.69 0.00 1.97 1.95 0.00 3.31 0.00 0.00 3.11 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.58 0.00 93 K 7.17 4.18 0.00 1.68 1.66 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.33 1.39 7.81 94 A 8.78 4.25 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 95 K 7.70 4.44 0.00 1.32 0.74 0.00 1.47 0.00 0.00 1.58 0.00 0.00 3.11 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.83 0.80 7.81 96 L 8.61 4.84 0.00 1.71 1.29 0.99 0.93 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 97 Y 7.61 4.38 0.00 3.07 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 98 Y 8.14 4.21 0.00 3.11 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 99 L 7.17 3.98 0.00 1.25 1.46 0.85 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 100 R 8.42 3.96 0.00 2.01 1.70 0.00 3.28 0.00 0.00 3.45 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 101 E 9.11 4.30 0.00 2.07 2.02 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 2.30 2.42 0.00 102 R 7.69 4.28 0.00 1.81 2.01 0.00 3.67 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.49 0.00 103 T 7.69 3.46 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 8.36 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.87 4.10 0.00 1.97 1.95 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.37 7.81 106 A 7.86 4.05 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 0.00 107 A 7.88 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 0.00 108 R 7.53 3.89 0.00 2.03 1.93 0.00 3.12 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 109 I 8.10 4.54 1.88 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 1.33 0.65 0.94 0.00 0.00 110 K 8.80 4.08 0.00 1.79 1.80 0.00 1.59 0.00 0.00 1.89 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.52 7.81 111 E 8.80 4.05 0.00 2.08 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 0.00 2.37 2.39 0.00 112 R 8.78 4.12 0.00 1.84 1.92 0.00 3.44 0.00 0.00 3.15 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 113 L 7.66 3.50 0.00 1.87 1.73 0.92 0.90 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 0.00 114 N 8.36 4.60 0.00 2.72 2.67 0.00 0.00 7.03 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